USER MOD reduce.3.24.130724 H: found=0, std=0, add=1028, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1031 hydrogens (14 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 NoAdj-H: B 287 ALY H2 : B 287 ALY N : B 286 ILE C :(H bumps) USER MOD Set 1.1: A 69 GLN : amide:sc= 0.275 K(o=0.61,f=-1) USER MOD Set 1.2: A 107 TYR OH : rot 116:sc= 0.33 USER MOD Set 2.1: A 83 TYR OH : rot 110:sc= -0.276 USER MOD Set 2.2: A 100 GLN : amide:sc= -0.689 K(o=-0.97,f=0.58) USER MOD Set 3.1: A 51 MET CE :methyl 165:sc= -0.0803 (180deg=-0.711) USER MOD Set 3.2: A 59 LYS NZ :NH3+ -154:sc= 0.257 (180deg=0.0316) USER MOD Set 4.1: A 22 HIS : no HD1:sc= -1.35 K(o=-1.1,f=-7.9!) USER MOD Set 4.2: A 25 TYR OH : rot -23:sc= 0.293 USER MOD Single : A 1 GLY N :NH3+ -106:sc= 0.0871 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 167:sc= -0.0507 (180deg=-0.278) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -0.917 X(o=-0.92,f=-0.92) USER MOD Single : A 8 LYS NZ :NH3+ 170:sc=-0.00815 (180deg=-0.138) USER MOD Single : A 9 HIS : no HD1:sc= -0.136 X(o=-0.14,f=0) USER MOD Single : A 10 CYS SG : rot 49:sc= -3.93! USER MOD Single : A 11 ASN : amide:sc= 0.0347 X(o=0.035,f=-0.025) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 56:sc= 1.12 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 158:sc= -0.0548 (180deg=-0.369) USER MOD Single : A 30 TYR OH : rot -134:sc= 0.251 USER MOD Single : A 31 LYS NZ :NH3+ -168:sc= -0.0208 (180deg=-0.207) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HE2:sc= -1.09 K(o=-1.1,f=-0.5) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0878) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 54 SER OG : rot 87:sc= 1.2 USER MOD Single : A 55 THR OG1 : rot 125:sc= 1.3 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl 164:sc= -1.65 (180deg=-1.88) USER MOD Single : A 62 ASN : amide:sc= -1.69! K(o=-1.7!,f=-0.02) USER MOD Single : A 65 TYR OH : rot 180:sc= -0.839 USER MOD Single : A 78 MET CE :methyl -132:sc= -0.568 (180deg=-4.57!) USER MOD Single : A 80 SER OG : rot 71:sc= 1.23 USER MOD Single : A 81 ASN : amide:sc= -3.4! C(o=-3.4!,f=-2.2!) USER MOD Single : A 82 CYS SG : rot 49:sc= -1.36! USER MOD Single : A 84 LYS NZ :NH3+ -158:sc= 0.0166 (180deg=0) USER MOD Single : A 85 TYR OH : rot 0:sc= -0.922 USER MOD Single : A 86 ASN : amide:sc= -1.03 K(o=-1,f=-2.9!) USER MOD Single : A 90 HIS : no HD1:sc= -0.948 K(o=-0.95,f=-2.9!) USER MOD Single : A 95 MET CE :methyl -109:sc= -0.847 (180deg=-3.03!) USER MOD Single : A 98 LYS NZ :NH3+ 168:sc= -0.0606 (180deg=-0.37) USER MOD Single : A 109 LYS NZ :NH3+ 167:sc= -0.015 (180deg=-0.218) USER MOD Single : A 110 MET CE :methyl 163:sc= -2.11 (180deg=-3.32!) USER MOD Single : B 281 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : B 282 ASN : amide:sc= -0.229 K(o=-0.23,f=-6.1!) USER MOD Single : B 288 GLN : amide:sc= -0.377 K(o=-0.38,f=-1.2) USER MOD Single : B 291 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 292 SER OG : rot -140:sc= -0.307 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 24.355 10.358 -2.774 1.00 0.00 N ATOM 2 CA GLY A 1 24.597 9.101 -3.517 1.00 0.00 C ATOM 3 C GLY A 1 23.329 8.575 -4.148 1.00 0.00 C ATOM 4 O GLY A 1 22.234 9.024 -3.812 1.00 0.00 O ATOM 0 H1 GLY A 1 24.742 11.159 -3.312 1.00 0.00 H new ATOM 0 H2 GLY A 1 23.332 10.492 -2.641 1.00 0.00 H new ATOM 0 H3 GLY A 1 24.821 10.308 -1.845 1.00 0.00 H new ATOM 0 HA2 GLY A 1 25.345 9.273 -4.291 1.00 0.00 H new ATOM 0 HA3 GLY A 1 25.006 8.351 -2.840 1.00 0.00 H new ATOM 10 N LYS A 2 23.464 7.629 -5.063 1.00 0.00 N ATOM 11 CA LYS A 2 22.310 7.058 -5.739 1.00 0.00 C ATOM 12 C LYS A 2 21.709 5.931 -4.908 1.00 0.00 C ATOM 13 O LYS A 2 22.074 4.767 -5.077 1.00 0.00 O ATOM 14 CB LYS A 2 22.700 6.543 -7.127 1.00 0.00 C ATOM 15 CG LYS A 2 23.296 7.610 -8.031 1.00 0.00 C ATOM 16 CD LYS A 2 22.323 8.750 -8.281 1.00 0.00 C ATOM 17 CE LYS A 2 22.941 9.824 -9.162 1.00 0.00 C ATOM 18 NZ LYS A 2 23.359 9.293 -10.487 1.00 0.00 N ATOM 0 H LYS A 2 24.361 7.240 -5.355 1.00 0.00 H new ATOM 0 HA LYS A 2 21.561 7.841 -5.858 1.00 0.00 H new ATOM 0 HB2 LYS A 2 23.419 5.732 -7.015 1.00 0.00 H new ATOM 0 HB3 LYS A 2 21.818 6.122 -7.610 1.00 0.00 H new ATOM 0 HG2 LYS A 2 24.206 8.003 -7.578 1.00 0.00 H new ATOM 0 HG3 LYS A 2 23.582 7.161 -8.982 1.00 0.00 H new ATOM 0 HD2 LYS A 2 21.421 8.363 -8.755 1.00 0.00 H new ATOM 0 HD3 LYS A 2 22.021 9.187 -7.330 1.00 0.00 H new ATOM 0 HE2 LYS A 2 22.222 10.631 -9.306 1.00 0.00 H new ATOM 0 HE3 LYS A 2 23.805 10.254 -8.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 23.567 10.085 -11.128 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 24.210 8.707 -10.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 22.592 8.716 -10.887 1.00 0.00 H new ATOM 32 N LEU A 3 20.796 6.298 -4.005 1.00 0.00 N ATOM 33 CA LEU A 3 20.118 5.343 -3.126 1.00 0.00 C ATOM 34 C LEU A 3 21.090 4.692 -2.151 1.00 0.00 C ATOM 35 O LEU A 3 21.903 3.847 -2.530 1.00 0.00 O ATOM 36 CB LEU A 3 19.387 4.258 -3.930 1.00 0.00 C ATOM 37 CG LEU A 3 18.112 4.706 -4.645 1.00 0.00 C ATOM 38 CD1 LEU A 3 17.632 3.621 -5.594 1.00 0.00 C ATOM 39 CD2 LEU A 3 17.019 5.033 -3.636 1.00 0.00 C ATOM 0 H LEU A 3 20.506 7.266 -3.863 1.00 0.00 H new ATOM 0 HA LEU A 3 19.382 5.910 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 3 20.076 3.857 -4.673 1.00 0.00 H new ATOM 0 HB3 LEU A 3 19.134 3.440 -3.255 1.00 0.00 H new ATOM 0 HG LEU A 3 18.338 5.605 -5.218 1.00 0.00 H new ATOM 0 HD11 LEU A 3 16.724 3.953 -6.097 1.00 0.00 H new ATOM 0 HD12 LEU A 3 18.404 3.419 -6.336 1.00 0.00 H new ATOM 0 HD13 LEU A 3 17.423 2.711 -5.031 1.00 0.00 H new ATOM 0 HD21 LEU A 3 16.120 5.350 -4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 3 16.797 4.148 -3.040 1.00 0.00 H new ATOM 0 HD23 LEU A 3 17.357 5.836 -2.981 1.00 0.00 H new ATOM 51 N SER A 4 21.005 5.095 -0.894 1.00 0.00 N ATOM 52 CA SER A 4 21.792 4.480 0.160 1.00 0.00 C ATOM 53 C SER A 4 21.377 3.017 0.338 1.00 0.00 C ATOM 54 O SER A 4 20.340 2.604 -0.188 1.00 0.00 O ATOM 55 CB SER A 4 21.604 5.264 1.460 1.00 0.00 C ATOM 56 OG SER A 4 21.841 6.648 1.248 1.00 0.00 O ATOM 0 H SER A 4 20.395 5.849 -0.578 1.00 0.00 H new ATOM 0 HA SER A 4 22.848 4.502 -0.111 1.00 0.00 H new ATOM 0 HB2 SER A 4 20.592 5.116 1.837 1.00 0.00 H new ATOM 0 HB3 SER A 4 22.286 4.885 2.221 1.00 0.00 H new ATOM 0 HG SER A 4 21.715 7.134 2.089 1.00 0.00 H new ATOM 62 N GLU A 5 22.170 2.240 1.069 1.00 0.00 N ATOM 63 CA GLU A 5 21.937 0.800 1.191 1.00 0.00 C ATOM 64 C GLU A 5 20.510 0.496 1.648 1.00 0.00 C ATOM 65 O GLU A 5 19.835 -0.365 1.078 1.00 0.00 O ATOM 66 CB GLU A 5 22.942 0.173 2.155 1.00 0.00 C ATOM 67 CG GLU A 5 24.383 0.302 1.691 1.00 0.00 C ATOM 68 CD GLU A 5 24.605 -0.272 0.306 1.00 0.00 C ATOM 69 OE1 GLU A 5 24.640 -1.512 0.166 1.00 0.00 O ATOM 70 OE2 GLU A 5 24.743 0.517 -0.653 1.00 0.00 O ATOM 0 H GLU A 5 22.980 2.581 1.587 1.00 0.00 H new ATOM 0 HA GLU A 5 22.073 0.363 0.202 1.00 0.00 H new ATOM 0 HB2 GLU A 5 22.839 0.644 3.133 1.00 0.00 H new ATOM 0 HB3 GLU A 5 22.702 -0.883 2.283 1.00 0.00 H new ATOM 0 HG2 GLU A 5 24.669 1.354 1.694 1.00 0.00 H new ATOM 0 HG3 GLU A 5 25.036 -0.207 2.400 1.00 0.00 H new ATOM 77 N GLN A 6 20.053 1.225 2.658 1.00 0.00 N ATOM 78 CA GLN A 6 18.702 1.058 3.190 1.00 0.00 C ATOM 79 C GLN A 6 17.660 1.344 2.107 1.00 0.00 C ATOM 80 O GLN A 6 16.665 0.627 1.980 1.00 0.00 O ATOM 81 CB GLN A 6 18.480 1.993 4.391 1.00 0.00 C ATOM 82 CG GLN A 6 19.178 1.570 5.688 1.00 0.00 C ATOM 83 CD GLN A 6 20.622 1.137 5.506 1.00 0.00 C ATOM 84 OE1 GLN A 6 21.541 1.955 5.550 1.00 0.00 O ATOM 85 NE2 GLN A 6 20.830 -0.154 5.309 1.00 0.00 N ATOM 0 H GLN A 6 20.601 1.944 3.130 1.00 0.00 H new ATOM 0 HA GLN A 6 18.590 0.025 3.521 1.00 0.00 H new ATOM 0 HB2 GLN A 6 18.824 2.992 4.122 1.00 0.00 H new ATOM 0 HB3 GLN A 6 17.409 2.065 4.581 1.00 0.00 H new ATOM 0 HG2 GLN A 6 19.146 2.401 6.392 1.00 0.00 H new ATOM 0 HG3 GLN A 6 18.618 0.750 6.137 1.00 0.00 H new ATOM 0 HE21 GLN A 6 20.040 -0.799 5.279 1.00 0.00 H new ATOM 0 HE22 GLN A 6 21.780 -0.505 5.187 1.00 0.00 H new ATOM 94 N LEU A 7 17.913 2.376 1.305 1.00 0.00 N ATOM 95 CA LEU A 7 16.967 2.802 0.276 1.00 0.00 C ATOM 96 C LEU A 7 16.973 1.849 -0.914 1.00 0.00 C ATOM 97 O LEU A 7 15.949 1.649 -1.568 1.00 0.00 O ATOM 98 CB LEU A 7 17.276 4.232 -0.181 1.00 0.00 C ATOM 99 CG LEU A 7 17.005 5.313 0.863 1.00 0.00 C ATOM 100 CD1 LEU A 7 17.517 6.659 0.379 1.00 0.00 C ATOM 101 CD2 LEU A 7 15.520 5.392 1.176 1.00 0.00 C ATOM 0 H LEU A 7 18.766 2.933 1.348 1.00 0.00 H new ATOM 0 HA LEU A 7 15.969 2.783 0.714 1.00 0.00 H new ATOM 0 HB2 LEU A 7 18.324 4.286 -0.475 1.00 0.00 H new ATOM 0 HB3 LEU A 7 16.684 4.450 -1.070 1.00 0.00 H new ATOM 0 HG LEU A 7 17.536 5.049 1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 7 17.316 7.418 1.135 1.00 0.00 H new ATOM 0 HD12 LEU A 7 18.591 6.598 0.203 1.00 0.00 H new ATOM 0 HD13 LEU A 7 17.012 6.928 -0.549 1.00 0.00 H new ATOM 0 HD21 LEU A 7 15.346 6.168 1.922 1.00 0.00 H new ATOM 0 HD22 LEU A 7 14.969 5.633 0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 7 15.178 4.432 1.564 1.00 0.00 H new ATOM 113 N LYS A 8 18.124 1.257 -1.188 1.00 0.00 N ATOM 114 CA LYS A 8 18.237 0.263 -2.245 1.00 0.00 C ATOM 115 C LYS A 8 17.437 -0.977 -1.882 1.00 0.00 C ATOM 116 O LYS A 8 16.788 -1.582 -2.735 1.00 0.00 O ATOM 117 CB LYS A 8 19.704 -0.099 -2.474 1.00 0.00 C ATOM 118 CG LYS A 8 19.925 -1.169 -3.537 1.00 0.00 C ATOM 119 CD LYS A 8 19.392 -0.745 -4.898 1.00 0.00 C ATOM 120 CE LYS A 8 20.046 0.539 -5.390 1.00 0.00 C ATOM 121 NZ LYS A 8 21.524 0.413 -5.483 1.00 0.00 N ATOM 0 H LYS A 8 18.995 1.447 -0.693 1.00 0.00 H new ATOM 0 HA LYS A 8 17.834 0.681 -3.167 1.00 0.00 H new ATOM 0 HB2 LYS A 8 20.248 0.801 -2.762 1.00 0.00 H new ATOM 0 HB3 LYS A 8 20.133 -0.444 -1.533 1.00 0.00 H new ATOM 0 HG2 LYS A 8 20.990 -1.385 -3.617 1.00 0.00 H new ATOM 0 HG3 LYS A 8 19.435 -2.092 -3.228 1.00 0.00 H new ATOM 0 HD2 LYS A 8 19.568 -1.542 -5.621 1.00 0.00 H new ATOM 0 HD3 LYS A 8 18.313 -0.602 -4.837 1.00 0.00 H new ATOM 0 HE2 LYS A 8 19.642 0.799 -6.369 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.794 1.356 -4.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 21.913 1.241 -5.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 21.929 0.360 -4.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 21.766 -0.450 -6.010 1.00 0.00 H new ATOM 135 N HIS A 9 17.467 -1.337 -0.607 1.00 0.00 N ATOM 136 CA HIS A 9 16.706 -2.478 -0.134 1.00 0.00 C ATOM 137 C HIS A 9 15.216 -2.188 -0.264 1.00 0.00 C ATOM 138 O HIS A 9 14.418 -3.089 -0.517 1.00 0.00 O ATOM 139 CB HIS A 9 17.055 -2.802 1.317 1.00 0.00 C ATOM 140 CG HIS A 9 17.037 -4.270 1.612 1.00 0.00 C ATOM 141 ND1 HIS A 9 18.170 -4.985 1.936 1.00 0.00 N ATOM 142 CD2 HIS A 9 16.016 -5.158 1.636 1.00 0.00 C ATOM 143 CE1 HIS A 9 17.848 -6.247 2.144 1.00 0.00 C ATOM 144 NE2 HIS A 9 16.546 -6.380 1.970 1.00 0.00 N ATOM 0 H HIS A 9 18.007 -0.857 0.113 1.00 0.00 H new ATOM 0 HA HIS A 9 16.961 -3.344 -0.744 1.00 0.00 H new ATOM 0 HB2 HIS A 9 18.044 -2.404 1.544 1.00 0.00 H new ATOM 0 HB3 HIS A 9 16.349 -2.296 1.976 1.00 0.00 H new ATOM 0 HD2 HIS A 9 14.977 -4.945 1.431 1.00 0.00 H new ATOM 0 HE1 HIS A 9 18.533 -7.038 2.411 1.00 0.00 H new ATOM 0 HE2 HIS A 9 16.020 -7.248 2.068 1.00 0.00 H new ATOM 153 N CYS A 10 14.852 -0.917 -0.102 1.00 0.00 N ATOM 154 CA CYS A 10 13.473 -0.489 -0.284 1.00 0.00 C ATOM 155 C CYS A 10 13.036 -0.714 -1.720 1.00 0.00 C ATOM 156 O CYS A 10 11.933 -1.197 -1.982 1.00 0.00 O ATOM 157 CB CYS A 10 13.331 0.988 0.055 1.00 0.00 C ATOM 158 SG CYS A 10 13.807 1.399 1.739 1.00 0.00 S ATOM 0 H CYS A 10 15.495 -0.168 0.155 1.00 0.00 H new ATOM 0 HA CYS A 10 12.842 -1.077 0.382 1.00 0.00 H new ATOM 0 HB2 CYS A 10 13.941 1.569 -0.636 1.00 0.00 H new ATOM 0 HB3 CYS A 10 12.295 1.289 -0.103 1.00 0.00 H new ATOM 0 HG CYS A 10 14.970 0.880 2.000 1.00 0.00 H new ATOM 164 N ASN A 11 13.922 -0.358 -2.639 1.00 0.00 N ATOM 165 CA ASN A 11 13.676 -0.520 -4.061 1.00 0.00 C ATOM 166 C ASN A 11 13.366 -1.977 -4.385 1.00 0.00 C ATOM 167 O ASN A 11 12.484 -2.273 -5.191 1.00 0.00 O ATOM 168 CB ASN A 11 14.901 -0.050 -4.849 1.00 0.00 C ATOM 169 CG ASN A 11 14.690 -0.097 -6.349 1.00 0.00 C ATOM 170 OD1 ASN A 11 14.945 -1.116 -6.997 1.00 0.00 O ATOM 171 ND2 ASN A 11 14.231 1.009 -6.911 1.00 0.00 N ATOM 0 H ASN A 11 14.830 0.051 -2.418 1.00 0.00 H new ATOM 0 HA ASN A 11 12.814 0.084 -4.344 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.148 0.970 -4.554 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.756 -0.673 -4.588 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.075 1.042 -7.918 1.00 0.00 H new ATOM 0 HD22 ASN A 11 14.033 1.829 -6.337 1.00 0.00 H new ATOM 178 N GLY A 12 14.084 -2.879 -3.725 1.00 0.00 N ATOM 179 CA GLY A 12 13.894 -4.300 -3.952 1.00 0.00 C ATOM 180 C GLY A 12 12.596 -4.823 -3.362 1.00 0.00 C ATOM 181 O GLY A 12 11.896 -5.616 -3.995 1.00 0.00 O ATOM 0 H GLY A 12 14.798 -2.650 -3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 12 13.905 -4.497 -5.024 1.00 0.00 H new ATOM 0 HA3 GLY A 12 14.731 -4.847 -3.519 1.00 0.00 H new ATOM 185 N ILE A 13 12.276 -4.384 -2.148 1.00 0.00 N ATOM 186 CA ILE A 13 11.051 -4.812 -1.474 1.00 0.00 C ATOM 187 C ILE A 13 9.821 -4.328 -2.240 1.00 0.00 C ATOM 188 O ILE A 13 8.906 -5.102 -2.521 1.00 0.00 O ATOM 189 CB ILE A 13 10.984 -4.280 -0.025 1.00 0.00 C ATOM 190 CG1 ILE A 13 12.181 -4.785 0.793 1.00 0.00 C ATOM 191 CG2 ILE A 13 9.678 -4.701 0.638 1.00 0.00 C ATOM 192 CD1 ILE A 13 12.274 -4.187 2.178 1.00 0.00 C ATOM 0 H ILE A 13 12.847 -3.732 -1.610 1.00 0.00 H new ATOM 0 HA ILE A 13 11.063 -5.902 -1.446 1.00 0.00 H new ATOM 0 HB ILE A 13 11.023 -3.191 -0.059 1.00 0.00 H new ATOM 0 HG12 ILE A 13 12.117 -5.870 0.880 1.00 0.00 H new ATOM 0 HG13 ILE A 13 13.099 -4.562 0.250 1.00 0.00 H new ATOM 0 HG21 ILE A 13 9.648 -4.318 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 13 8.837 -4.298 0.074 1.00 0.00 H new ATOM 0 HG23 ILE A 13 9.614 -5.789 0.657 1.00 0.00 H new ATOM 0 HD11 ILE A 13 13.145 -4.594 2.692 1.00 0.00 H new ATOM 0 HD12 ILE A 13 12.371 -3.104 2.101 1.00 0.00 H new ATOM 0 HD13 ILE A 13 11.373 -4.432 2.741 1.00 0.00 H new ATOM 204 N LEU A 14 9.817 -3.041 -2.580 1.00 0.00 N ATOM 205 CA LEU A 14 8.726 -2.441 -3.332 1.00 0.00 C ATOM 206 C LEU A 14 8.520 -3.175 -4.650 1.00 0.00 C ATOM 207 O LEU A 14 7.394 -3.460 -5.051 1.00 0.00 O ATOM 208 CB LEU A 14 9.041 -0.972 -3.606 1.00 0.00 C ATOM 209 CG LEU A 14 7.847 -0.039 -3.561 1.00 0.00 C ATOM 210 CD1 LEU A 14 8.327 1.391 -3.528 1.00 0.00 C ATOM 211 CD2 LEU A 14 6.942 -0.251 -4.757 1.00 0.00 C ATOM 0 H LEU A 14 10.566 -2.391 -2.342 1.00 0.00 H new ATOM 0 HA LEU A 14 7.811 -2.516 -2.744 1.00 0.00 H new ATOM 0 HB2 LEU A 14 9.776 -0.632 -2.876 1.00 0.00 H new ATOM 0 HB3 LEU A 14 9.507 -0.893 -4.588 1.00 0.00 H new ATOM 0 HG LEU A 14 7.273 -0.256 -2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 14 7.469 2.062 -3.496 1.00 0.00 H new ATOM 0 HD12 LEU A 14 8.944 1.547 -2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 14 8.916 1.598 -4.422 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.094 0.432 -4.698 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.499 -0.059 -5.674 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.580 -1.279 -4.762 1.00 0.00 H new ATOM 223 N LYS A 15 9.630 -3.483 -5.305 1.00 0.00 N ATOM 224 CA LYS A 15 9.631 -4.179 -6.567 1.00 0.00 C ATOM 225 C LYS A 15 8.930 -5.527 -6.445 1.00 0.00 C ATOM 226 O LYS A 15 8.211 -5.952 -7.348 1.00 0.00 O ATOM 227 CB LYS A 15 11.083 -4.349 -7.010 1.00 0.00 C ATOM 228 CG LYS A 15 11.336 -5.595 -7.813 1.00 0.00 C ATOM 229 CD LYS A 15 10.938 -5.428 -9.266 1.00 0.00 C ATOM 230 CE LYS A 15 11.060 -6.739 -10.011 1.00 0.00 C ATOM 231 NZ LYS A 15 10.948 -6.554 -11.480 1.00 0.00 N ATOM 0 H LYS A 15 10.563 -3.250 -4.964 1.00 0.00 H new ATOM 0 HA LYS A 15 9.082 -3.604 -7.313 1.00 0.00 H new ATOM 0 HB2 LYS A 15 11.375 -3.482 -7.602 1.00 0.00 H new ATOM 0 HB3 LYS A 15 11.722 -4.362 -6.127 1.00 0.00 H new ATOM 0 HG2 LYS A 15 12.393 -5.855 -7.755 1.00 0.00 H new ATOM 0 HG3 LYS A 15 10.779 -6.425 -7.378 1.00 0.00 H new ATOM 0 HD2 LYS A 15 9.912 -5.064 -9.327 1.00 0.00 H new ATOM 0 HD3 LYS A 15 11.572 -4.677 -9.737 1.00 0.00 H new ATOM 0 HE2 LYS A 15 12.018 -7.202 -9.776 1.00 0.00 H new ATOM 0 HE3 LYS A 15 10.283 -7.423 -9.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 11.037 -7.476 -11.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 10.024 -6.135 -11.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 11.705 -5.921 -11.809 1.00 0.00 H new ATOM 245 N GLU A 16 9.130 -6.175 -5.314 1.00 0.00 N ATOM 246 CA GLU A 16 8.566 -7.501 -5.079 1.00 0.00 C ATOM 247 C GLU A 16 7.050 -7.436 -4.938 1.00 0.00 C ATOM 248 O GLU A 16 6.326 -8.200 -5.579 1.00 0.00 O ATOM 249 CB GLU A 16 9.156 -8.151 -3.828 1.00 0.00 C ATOM 250 CG GLU A 16 8.619 -9.554 -3.603 1.00 0.00 C ATOM 251 CD GLU A 16 8.117 -9.795 -2.205 1.00 0.00 C ATOM 252 OE1 GLU A 16 8.031 -10.978 -1.808 1.00 0.00 O ATOM 253 OE2 GLU A 16 7.773 -8.829 -1.514 1.00 0.00 O ATOM 0 H GLU A 16 9.680 -5.808 -4.537 1.00 0.00 H new ATOM 0 HA GLU A 16 8.823 -8.109 -5.946 1.00 0.00 H new ATOM 0 HB2 GLU A 16 10.242 -8.189 -3.918 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.930 -7.533 -2.959 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.808 -9.740 -4.307 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.406 -10.274 -3.826 1.00 0.00 H new ATOM 260 N LEU A 17 6.578 -6.527 -4.094 1.00 0.00 N ATOM 261 CA LEU A 17 5.141 -6.326 -3.898 1.00 0.00 C ATOM 262 C LEU A 17 4.483 -5.915 -5.220 1.00 0.00 C ATOM 263 O LEU A 17 3.286 -6.110 -5.421 1.00 0.00 O ATOM 264 CB LEU A 17 4.898 -5.256 -2.823 1.00 0.00 C ATOM 265 CG LEU A 17 5.534 -5.527 -1.455 1.00 0.00 C ATOM 266 CD1 LEU A 17 5.666 -4.226 -0.686 1.00 0.00 C ATOM 267 CD2 LEU A 17 4.703 -6.518 -0.647 1.00 0.00 C ATOM 0 H LEU A 17 7.168 -5.914 -3.531 1.00 0.00 H new ATOM 0 HA LEU A 17 4.695 -7.262 -3.562 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.274 -4.303 -3.195 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.822 -5.143 -2.686 1.00 0.00 H new ATOM 0 HG LEU A 17 6.520 -5.962 -1.618 1.00 0.00 H new ATOM 0 HD11 LEU A 17 6.118 -4.422 0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.295 -3.534 -1.246 1.00 0.00 H new ATOM 0 HD13 LEU A 17 4.679 -3.785 -0.545 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.179 -6.690 0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 17 3.703 -6.113 -0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.632 -7.461 -1.190 1.00 0.00 H new ATOM 279 N LEU A 18 5.290 -5.364 -6.124 1.00 0.00 N ATOM 280 CA LEU A 18 4.816 -4.944 -7.442 1.00 0.00 C ATOM 281 C LEU A 18 4.944 -6.057 -8.477 1.00 0.00 C ATOM 282 O LEU A 18 4.364 -5.981 -9.561 1.00 0.00 O ATOM 283 CB LEU A 18 5.606 -3.733 -7.922 1.00 0.00 C ATOM 284 CG LEU A 18 5.340 -2.440 -7.165 1.00 0.00 C ATOM 285 CD1 LEU A 18 6.237 -1.341 -7.699 1.00 0.00 C ATOM 286 CD2 LEU A 18 3.880 -2.036 -7.271 1.00 0.00 C ATOM 0 H LEU A 18 6.284 -5.197 -5.966 1.00 0.00 H new ATOM 0 HA LEU A 18 3.761 -4.691 -7.337 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.669 -3.963 -7.853 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.383 -3.570 -8.976 1.00 0.00 H new ATOM 0 HG LEU A 18 5.563 -2.602 -6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.044 -0.417 -7.155 1.00 0.00 H new ATOM 0 HD12 LEU A 18 7.281 -1.627 -7.568 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.033 -1.187 -8.759 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.718 -1.109 -6.721 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.619 -1.887 -8.319 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.253 -2.822 -6.849 1.00 0.00 H new ATOM 298 N SER A 19 5.719 -7.074 -8.153 1.00 0.00 N ATOM 299 CA SER A 19 5.916 -8.201 -9.053 1.00 0.00 C ATOM 300 C SER A 19 4.630 -9.018 -9.181 1.00 0.00 C ATOM 301 O SER A 19 3.863 -9.151 -8.221 1.00 0.00 O ATOM 302 CB SER A 19 7.055 -9.084 -8.540 1.00 0.00 C ATOM 303 OG SER A 19 8.267 -8.353 -8.437 1.00 0.00 O ATOM 0 H SER A 19 6.225 -7.146 -7.271 1.00 0.00 H new ATOM 0 HA SER A 19 6.179 -7.819 -10.039 1.00 0.00 H new ATOM 0 HB2 SER A 19 6.790 -9.493 -7.565 1.00 0.00 H new ATOM 0 HB3 SER A 19 7.194 -9.930 -9.213 1.00 0.00 H new ATOM 0 HG SER A 19 8.129 -7.569 -7.865 1.00 0.00 H new ATOM 309 N LYS A 20 4.419 -9.574 -10.379 1.00 0.00 N ATOM 310 CA LYS A 20 3.213 -10.341 -10.703 1.00 0.00 C ATOM 311 C LYS A 20 3.016 -11.506 -9.733 1.00 0.00 C ATOM 312 O LYS A 20 1.914 -12.042 -9.607 1.00 0.00 O ATOM 313 CB LYS A 20 3.286 -10.857 -12.141 1.00 0.00 C ATOM 314 CG LYS A 20 1.946 -11.352 -12.660 1.00 0.00 C ATOM 315 CD LYS A 20 0.993 -10.201 -12.960 1.00 0.00 C ATOM 316 CE LYS A 20 -0.349 -10.704 -13.475 1.00 0.00 C ATOM 317 NZ LYS A 20 -1.298 -9.590 -13.749 1.00 0.00 N ATOM 0 H LYS A 20 5.081 -9.504 -11.152 1.00 0.00 H new ATOM 0 HA LYS A 20 2.356 -9.675 -10.605 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.649 -10.060 -12.790 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.013 -11.668 -12.194 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.102 -11.940 -13.565 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.494 -12.015 -11.923 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.839 -9.611 -12.057 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.443 -9.539 -13.700 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.194 -11.280 -14.387 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.787 -11.381 -12.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.198 -9.978 -14.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.468 -9.055 -12.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -0.892 -8.957 -14.468 1.00 0.00 H new ATOM 331 N LYS A 21 4.094 -11.884 -9.058 1.00 0.00 N ATOM 332 CA LYS A 21 4.052 -12.882 -7.997 1.00 0.00 C ATOM 333 C LYS A 21 3.009 -12.527 -6.935 1.00 0.00 C ATOM 334 O LYS A 21 2.302 -13.400 -6.428 1.00 0.00 O ATOM 335 CB LYS A 21 5.436 -12.992 -7.349 1.00 0.00 C ATOM 336 CG LYS A 21 5.462 -13.834 -6.086 1.00 0.00 C ATOM 337 CD LYS A 21 6.853 -13.927 -5.505 1.00 0.00 C ATOM 338 CE LYS A 21 6.934 -15.077 -4.526 1.00 0.00 C ATOM 339 NZ LYS A 21 6.879 -16.396 -5.211 1.00 0.00 N ATOM 0 H LYS A 21 5.025 -11.506 -9.232 1.00 0.00 H new ATOM 0 HA LYS A 21 3.769 -13.838 -8.437 1.00 0.00 H new ATOM 0 HB2 LYS A 21 6.131 -13.419 -8.072 1.00 0.00 H new ATOM 0 HB3 LYS A 21 5.796 -11.991 -7.113 1.00 0.00 H new ATOM 0 HG2 LYS A 21 4.787 -13.402 -5.347 1.00 0.00 H new ATOM 0 HG3 LYS A 21 5.093 -14.835 -6.308 1.00 0.00 H new ATOM 0 HD2 LYS A 21 7.580 -14.068 -6.304 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.109 -12.994 -5.003 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.860 -15.003 -3.955 1.00 0.00 H new ATOM 0 HE3 LYS A 21 6.113 -15.004 -3.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 7.298 -17.124 -4.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.889 -16.642 -5.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 7.412 -16.346 -6.103 1.00 0.00 H new ATOM 353 N HIS A 22 2.908 -11.245 -6.606 1.00 0.00 N ATOM 354 CA HIS A 22 1.995 -10.807 -5.558 1.00 0.00 C ATOM 355 C HIS A 22 0.800 -10.083 -6.154 1.00 0.00 C ATOM 356 O HIS A 22 -0.210 -9.910 -5.482 1.00 0.00 O ATOM 357 CB HIS A 22 2.710 -9.892 -4.546 1.00 0.00 C ATOM 358 CG HIS A 22 3.793 -10.579 -3.765 1.00 0.00 C ATOM 359 ND1 HIS A 22 3.540 -11.430 -2.706 1.00 0.00 N ATOM 360 CD2 HIS A 22 5.140 -10.527 -3.883 1.00 0.00 C ATOM 361 CE1 HIS A 22 4.679 -11.866 -2.207 1.00 0.00 C ATOM 362 NE2 HIS A 22 5.671 -11.333 -2.898 1.00 0.00 N ATOM 0 H HIS A 22 3.442 -10.496 -7.046 1.00 0.00 H new ATOM 0 HA HIS A 22 1.644 -11.696 -5.033 1.00 0.00 H new ATOM 0 HB2 HIS A 22 3.141 -9.045 -5.079 1.00 0.00 H new ATOM 0 HB3 HIS A 22 1.973 -9.490 -3.851 1.00 0.00 H new ATOM 0 HD2 HIS A 22 5.697 -9.959 -4.614 1.00 0.00 H new ATOM 0 HE1 HIS A 22 4.784 -12.545 -1.374 1.00 0.00 H new ATOM 0 HE2 HIS A 22 6.665 -11.491 -2.731 1.00 0.00 H new ATOM 371 N ALA A 23 0.916 -9.699 -7.424 1.00 0.00 N ATOM 372 CA ALA A 23 -0.103 -8.904 -8.120 1.00 0.00 C ATOM 373 C ALA A 23 -1.516 -9.439 -7.920 1.00 0.00 C ATOM 374 O ALA A 23 -2.467 -8.666 -7.820 1.00 0.00 O ATOM 375 CB ALA A 23 0.221 -8.847 -9.598 1.00 0.00 C ATOM 0 H ALA A 23 1.722 -9.930 -8.005 1.00 0.00 H new ATOM 0 HA ALA A 23 -0.081 -7.904 -7.686 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -0.536 -8.257 -10.114 1.00 0.00 H new ATOM 0 HB2 ALA A 23 1.199 -8.386 -9.739 1.00 0.00 H new ATOM 0 HB3 ALA A 23 0.234 -9.857 -10.007 1.00 0.00 H new ATOM 381 N ALA A 24 -1.638 -10.760 -7.840 1.00 0.00 N ATOM 382 CA ALA A 24 -2.928 -11.422 -7.660 1.00 0.00 C ATOM 383 C ALA A 24 -3.665 -10.915 -6.415 1.00 0.00 C ATOM 384 O ALA A 24 -4.888 -11.032 -6.314 1.00 0.00 O ATOM 385 CB ALA A 24 -2.708 -12.922 -7.568 1.00 0.00 C ATOM 0 H ALA A 24 -0.848 -11.402 -7.898 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.556 -11.188 -8.520 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.667 -13.423 -7.434 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.238 -13.278 -8.485 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.061 -13.143 -6.719 1.00 0.00 H new ATOM 391 N TYR A 25 -2.917 -10.360 -5.471 1.00 0.00 N ATOM 392 CA TYR A 25 -3.490 -9.807 -4.251 1.00 0.00 C ATOM 393 C TYR A 25 -2.758 -8.526 -3.842 1.00 0.00 C ATOM 394 O TYR A 25 -2.855 -8.078 -2.701 1.00 0.00 O ATOM 395 CB TYR A 25 -3.453 -10.855 -3.126 1.00 0.00 C ATOM 396 CG TYR A 25 -2.162 -11.639 -3.046 1.00 0.00 C ATOM 397 CD1 TYR A 25 -1.017 -11.082 -2.504 1.00 0.00 C ATOM 398 CD2 TYR A 25 -2.098 -12.948 -3.508 1.00 0.00 C ATOM 399 CE1 TYR A 25 0.157 -11.803 -2.431 1.00 0.00 C ATOM 400 CE2 TYR A 25 -0.927 -13.674 -3.438 1.00 0.00 C ATOM 401 CZ TYR A 25 0.198 -13.097 -2.901 1.00 0.00 C ATOM 402 OH TYR A 25 1.370 -13.814 -2.832 1.00 0.00 O ATOM 0 H TYR A 25 -1.902 -10.280 -5.528 1.00 0.00 H new ATOM 0 HA TYR A 25 -4.532 -9.546 -4.439 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -3.619 -10.353 -2.173 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -4.279 -11.552 -3.268 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -1.043 -10.068 -2.133 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -2.981 -13.405 -3.929 1.00 0.00 H new ATOM 0 HE1 TYR A 25 1.042 -11.354 -2.006 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -0.895 -14.690 -3.803 1.00 0.00 H new ATOM 0 HH TYR A 25 2.129 -13.196 -2.789 1.00 0.00 H new ATOM 412 N ALA A 26 -2.031 -7.939 -4.793 1.00 0.00 N ATOM 413 CA ALA A 26 -1.288 -6.704 -4.549 1.00 0.00 C ATOM 414 C ALA A 26 -1.826 -5.556 -5.402 1.00 0.00 C ATOM 415 O ALA A 26 -1.525 -4.383 -5.147 1.00 0.00 O ATOM 416 CB ALA A 26 0.199 -6.902 -4.836 1.00 0.00 C ATOM 0 H ALA A 26 -1.941 -8.301 -5.742 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.418 -6.447 -3.498 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.733 -5.971 -4.648 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.594 -7.684 -4.187 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.333 -7.193 -5.878 1.00 0.00 H new ATOM 422 N TRP A 27 -2.638 -5.887 -6.407 1.00 0.00 N ATOM 423 CA TRP A 27 -3.145 -4.878 -7.334 1.00 0.00 C ATOM 424 C TRP A 27 -3.902 -3.721 -6.637 1.00 0.00 C ATOM 425 O TRP A 27 -3.821 -2.590 -7.119 1.00 0.00 O ATOM 426 CB TRP A 27 -4.014 -5.507 -8.441 1.00 0.00 C ATOM 427 CG TRP A 27 -5.241 -6.229 -7.958 1.00 0.00 C ATOM 428 CD1 TRP A 27 -5.339 -7.555 -7.652 1.00 0.00 C ATOM 429 CD2 TRP A 27 -6.548 -5.670 -7.741 1.00 0.00 C ATOM 430 NE1 TRP A 27 -6.617 -7.855 -7.251 1.00 0.00 N ATOM 431 CE2 TRP A 27 -7.378 -6.716 -7.297 1.00 0.00 C ATOM 432 CE3 TRP A 27 -7.097 -4.387 -7.872 1.00 0.00 C ATOM 433 CZ2 TRP A 27 -8.721 -6.523 -6.990 1.00 0.00 C ATOM 434 CZ3 TRP A 27 -8.430 -4.200 -7.565 1.00 0.00 C ATOM 435 CH2 TRP A 27 -9.229 -5.261 -7.129 1.00 0.00 C ATOM 0 H TRP A 27 -2.956 -6.837 -6.598 1.00 0.00 H new ATOM 0 HA TRP A 27 -2.260 -4.437 -7.794 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.322 -4.721 -9.130 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -3.401 -6.206 -9.009 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -4.528 -8.266 -7.716 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -6.947 -8.777 -6.965 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -6.488 -3.560 -8.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -9.341 -7.341 -6.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -8.864 -3.216 -7.664 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -10.268 -5.080 -6.897 1.00 0.00 H new ATOM 446 N PRO A 28 -4.651 -3.950 -5.511 1.00 0.00 N ATOM 447 CA PRO A 28 -5.319 -2.855 -4.788 1.00 0.00 C ATOM 448 C PRO A 28 -4.364 -1.731 -4.392 1.00 0.00 C ATOM 449 O PRO A 28 -4.790 -0.600 -4.161 1.00 0.00 O ATOM 450 CB PRO A 28 -5.874 -3.498 -3.506 1.00 0.00 C ATOM 451 CG PRO A 28 -5.421 -4.921 -3.504 1.00 0.00 C ATOM 452 CD PRO A 28 -4.958 -5.258 -4.898 1.00 0.00 C ATOM 0 HA PRO A 28 -6.080 -2.404 -5.425 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.509 -2.975 -2.622 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -6.962 -3.439 -3.484 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -4.612 -5.063 -2.788 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -6.234 -5.581 -3.202 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -4.080 -5.904 -4.880 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -5.731 -5.787 -5.456 1.00 0.00 H new ATOM 460 N PHE A 29 -3.079 -2.044 -4.315 1.00 0.00 N ATOM 461 CA PHE A 29 -2.102 -1.095 -3.787 1.00 0.00 C ATOM 462 C PHE A 29 -1.152 -0.593 -4.868 1.00 0.00 C ATOM 463 O PHE A 29 -0.345 0.304 -4.616 1.00 0.00 O ATOM 464 CB PHE A 29 -1.286 -1.730 -2.664 1.00 0.00 C ATOM 465 CG PHE A 29 -2.048 -2.740 -1.856 1.00 0.00 C ATOM 466 CD1 PHE A 29 -1.726 -4.083 -1.937 1.00 0.00 C ATOM 467 CD2 PHE A 29 -3.087 -2.351 -1.026 1.00 0.00 C ATOM 468 CE1 PHE A 29 -2.424 -5.020 -1.208 1.00 0.00 C ATOM 469 CE2 PHE A 29 -3.788 -3.287 -0.292 1.00 0.00 C ATOM 470 CZ PHE A 29 -3.455 -4.623 -0.385 1.00 0.00 C ATOM 0 H PHE A 29 -2.688 -2.939 -4.608 1.00 0.00 H new ATOM 0 HA PHE A 29 -2.666 -0.246 -3.401 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -0.407 -2.211 -3.094 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.927 -0.944 -2.000 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.918 -4.400 -2.579 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -3.351 -1.306 -0.953 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -2.163 -6.065 -1.281 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -4.595 -2.974 0.354 1.00 0.00 H new ATOM 0 HZ PHE A 29 -4.003 -5.357 0.187 1.00 0.00 H new ATOM 480 N TYR A 30 -1.221 -1.193 -6.052 1.00 0.00 N ATOM 481 CA TYR A 30 -0.412 -0.737 -7.180 1.00 0.00 C ATOM 482 C TYR A 30 -0.654 0.745 -7.451 1.00 0.00 C ATOM 483 O TYR A 30 0.284 1.537 -7.467 1.00 0.00 O ATOM 484 CB TYR A 30 -0.715 -1.561 -8.439 1.00 0.00 C ATOM 485 CG TYR A 30 -0.004 -2.894 -8.486 1.00 0.00 C ATOM 486 CD1 TYR A 30 0.390 -3.522 -7.320 1.00 0.00 C ATOM 487 CD2 TYR A 30 0.278 -3.521 -9.694 1.00 0.00 C ATOM 488 CE1 TYR A 30 1.041 -4.733 -7.345 1.00 0.00 C ATOM 489 CE2 TYR A 30 0.930 -4.738 -9.728 1.00 0.00 C ATOM 490 CZ TYR A 30 1.308 -5.338 -8.547 1.00 0.00 C ATOM 491 OH TYR A 30 1.956 -6.548 -8.568 1.00 0.00 O ATOM 0 H TYR A 30 -1.824 -1.990 -6.256 1.00 0.00 H new ATOM 0 HA TYR A 30 0.637 -0.878 -6.920 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -1.790 -1.732 -8.499 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -0.435 -0.980 -9.318 1.00 0.00 H new ATOM 0 HD1 TYR A 30 0.183 -3.052 -6.370 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.017 -3.050 -10.620 1.00 0.00 H new ATOM 0 HE1 TYR A 30 1.341 -5.206 -6.422 1.00 0.00 H new ATOM 0 HE2 TYR A 30 1.142 -5.216 -10.673 1.00 0.00 H new ATOM 0 HH TYR A 30 2.668 -6.526 -9.242 1.00 0.00 H new ATOM 501 N LYS A 31 -1.912 1.111 -7.648 1.00 0.00 N ATOM 502 CA LYS A 31 -2.285 2.494 -7.908 1.00 0.00 C ATOM 503 C LYS A 31 -3.479 2.887 -7.047 1.00 0.00 C ATOM 504 O LYS A 31 -4.206 2.017 -6.566 1.00 0.00 O ATOM 505 CB LYS A 31 -2.627 2.666 -9.389 1.00 0.00 C ATOM 506 CG LYS A 31 -1.414 2.608 -10.301 1.00 0.00 C ATOM 507 CD LYS A 31 -1.808 2.629 -11.769 1.00 0.00 C ATOM 508 CE LYS A 31 -2.709 1.454 -12.131 1.00 0.00 C ATOM 509 NZ LYS A 31 -2.106 0.149 -11.747 1.00 0.00 N ATOM 0 H LYS A 31 -2.699 0.462 -7.632 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.445 3.142 -7.657 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.331 1.888 -9.684 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.131 3.622 -9.529 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.759 3.453 -10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -0.844 1.703 -10.091 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.322 3.564 -11.994 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -0.910 2.602 -12.387 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.672 1.569 -11.633 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.902 1.462 -13.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.645 -0.625 -12.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.119 0.113 -12.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.132 0.045 -10.712 1.00 0.00 H new ATOM 523 N PRO A 32 -3.695 4.198 -6.833 1.00 0.00 N ATOM 524 CA PRO A 32 -4.832 4.692 -6.054 1.00 0.00 C ATOM 525 C PRO A 32 -6.154 4.241 -6.658 1.00 0.00 C ATOM 526 O PRO A 32 -6.292 4.147 -7.882 1.00 0.00 O ATOM 527 CB PRO A 32 -4.699 6.220 -6.127 1.00 0.00 C ATOM 528 CG PRO A 32 -3.784 6.477 -7.274 1.00 0.00 C ATOM 529 CD PRO A 32 -2.856 5.301 -7.328 1.00 0.00 C ATOM 0 HA PRO A 32 -4.826 4.314 -5.032 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -5.669 6.693 -6.283 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -4.292 6.625 -5.200 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -4.342 6.577 -8.205 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -3.231 7.405 -7.132 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.499 5.114 -8.341 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -1.976 5.452 -6.703 1.00 0.00 H new ATOM 537 N VAL A 33 -7.116 3.959 -5.792 1.00 0.00 N ATOM 538 CA VAL A 33 -8.404 3.427 -6.212 1.00 0.00 C ATOM 539 C VAL A 33 -9.140 4.436 -7.088 1.00 0.00 C ATOM 540 O VAL A 33 -8.971 5.649 -6.932 1.00 0.00 O ATOM 541 CB VAL A 33 -9.276 3.040 -4.986 1.00 0.00 C ATOM 542 CG1 VAL A 33 -8.404 2.550 -3.846 1.00 0.00 C ATOM 543 CG2 VAL A 33 -10.173 4.180 -4.524 1.00 0.00 C ATOM 0 H VAL A 33 -7.027 4.091 -4.785 1.00 0.00 H new ATOM 0 HA VAL A 33 -8.220 2.525 -6.796 1.00 0.00 H new ATOM 0 HB VAL A 33 -9.932 2.230 -5.305 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -9.032 2.284 -2.996 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -7.840 1.675 -4.169 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -7.712 3.339 -3.552 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -10.760 3.856 -3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -9.559 5.035 -4.241 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -10.843 4.467 -5.334 1.00 0.00 H new ATOM 553 N ASP A 34 -9.947 3.936 -8.011 1.00 0.00 N ATOM 554 CA ASP A 34 -10.707 4.802 -8.907 1.00 0.00 C ATOM 555 C ASP A 34 -12.004 5.184 -8.222 1.00 0.00 C ATOM 556 O ASP A 34 -13.086 4.792 -8.649 1.00 0.00 O ATOM 557 CB ASP A 34 -10.993 4.107 -10.246 1.00 0.00 C ATOM 558 CG ASP A 34 -9.729 3.640 -10.946 1.00 0.00 C ATOM 559 OD1 ASP A 34 -9.111 4.448 -11.671 1.00 0.00 O ATOM 560 OD2 ASP A 34 -9.342 2.462 -10.772 1.00 0.00 O ATOM 0 H ASP A 34 -10.094 2.938 -8.161 1.00 0.00 H new ATOM 0 HA ASP A 34 -10.121 5.695 -9.125 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -11.646 3.251 -10.074 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -11.533 4.793 -10.899 1.00 0.00 H new ATOM 565 N ALA A 35 -11.869 5.950 -7.147 1.00 0.00 N ATOM 566 CA ALA A 35 -12.960 6.205 -6.216 1.00 0.00 C ATOM 567 C ALA A 35 -14.223 6.713 -6.901 1.00 0.00 C ATOM 568 O ALA A 35 -15.317 6.236 -6.609 1.00 0.00 O ATOM 569 CB ALA A 35 -12.508 7.173 -5.138 1.00 0.00 C ATOM 0 H ALA A 35 -10.996 6.414 -6.896 1.00 0.00 H new ATOM 0 HA ALA A 35 -13.222 5.249 -5.762 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -13.330 7.358 -4.447 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -11.666 6.745 -4.594 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -12.203 8.113 -5.598 1.00 0.00 H new ATOM 575 N SER A 36 -14.073 7.658 -7.817 1.00 0.00 N ATOM 576 CA SER A 36 -15.220 8.232 -8.509 1.00 0.00 C ATOM 577 C SER A 36 -15.983 7.152 -9.279 1.00 0.00 C ATOM 578 O SER A 36 -17.213 7.075 -9.207 1.00 0.00 O ATOM 579 CB SER A 36 -14.760 9.343 -9.452 1.00 0.00 C ATOM 580 OG SER A 36 -13.931 10.271 -8.769 1.00 0.00 O ATOM 0 H SER A 36 -13.172 8.044 -8.099 1.00 0.00 H new ATOM 0 HA SER A 36 -15.896 8.659 -7.769 1.00 0.00 H new ATOM 0 HB2 SER A 36 -14.216 8.911 -10.292 1.00 0.00 H new ATOM 0 HB3 SER A 36 -15.627 9.858 -9.865 1.00 0.00 H new ATOM 0 HG SER A 36 -13.646 10.973 -9.390 1.00 0.00 H new ATOM 586 N ALA A 37 -15.245 6.298 -9.985 1.00 0.00 N ATOM 587 CA ALA A 37 -15.841 5.208 -10.748 1.00 0.00 C ATOM 588 C ALA A 37 -16.358 4.117 -9.816 1.00 0.00 C ATOM 589 O ALA A 37 -17.331 3.434 -10.122 1.00 0.00 O ATOM 590 CB ALA A 37 -14.824 4.631 -11.724 1.00 0.00 C ATOM 0 H ALA A 37 -14.228 6.342 -10.043 1.00 0.00 H new ATOM 0 HA ALA A 37 -16.685 5.604 -11.313 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.281 3.818 -12.288 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -14.497 5.411 -12.412 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -13.965 4.251 -11.172 1.00 0.00 H new ATOM 596 N LEU A 38 -15.708 3.979 -8.669 1.00 0.00 N ATOM 597 CA LEU A 38 -16.070 2.969 -7.683 1.00 0.00 C ATOM 598 C LEU A 38 -17.330 3.371 -6.917 1.00 0.00 C ATOM 599 O LEU A 38 -17.869 2.586 -6.136 1.00 0.00 O ATOM 600 CB LEU A 38 -14.901 2.758 -6.715 1.00 0.00 C ATOM 601 CG LEU A 38 -13.707 1.989 -7.287 1.00 0.00 C ATOM 602 CD1 LEU A 38 -12.454 2.243 -6.461 1.00 0.00 C ATOM 603 CD2 LEU A 38 -14.008 0.501 -7.335 1.00 0.00 C ATOM 0 H LEU A 38 -14.917 4.562 -8.396 1.00 0.00 H new ATOM 0 HA LEU A 38 -16.283 2.035 -8.203 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -14.554 3.733 -6.373 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -15.269 2.225 -5.838 1.00 0.00 H new ATOM 0 HG LEU A 38 -13.529 2.345 -8.302 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -11.619 1.686 -6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -12.222 3.308 -6.470 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -12.622 1.917 -5.435 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -13.149 -0.031 -7.744 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -14.213 0.139 -6.328 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -14.878 0.326 -7.968 1.00 0.00 H new ATOM 615 N GLY A 39 -17.795 4.596 -7.147 1.00 0.00 N ATOM 616 CA GLY A 39 -18.971 5.095 -6.454 1.00 0.00 C ATOM 617 C GLY A 39 -18.611 5.708 -5.116 1.00 0.00 C ATOM 618 O GLY A 39 -19.476 6.135 -4.349 1.00 0.00 O ATOM 0 H GLY A 39 -17.376 5.255 -7.804 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -19.471 5.840 -7.074 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -19.678 4.280 -6.303 1.00 0.00 H new ATOM 622 N LEU A 40 -17.318 5.762 -4.855 1.00 0.00 N ATOM 623 CA LEU A 40 -16.795 6.203 -3.581 1.00 0.00 C ATOM 624 C LEU A 40 -16.482 7.693 -3.607 1.00 0.00 C ATOM 625 O LEU A 40 -15.320 8.096 -3.610 1.00 0.00 O ATOM 626 CB LEU A 40 -15.530 5.416 -3.260 1.00 0.00 C ATOM 627 CG LEU A 40 -15.574 3.938 -3.649 1.00 0.00 C ATOM 628 CD1 LEU A 40 -14.298 3.243 -3.242 1.00 0.00 C ATOM 629 CD2 LEU A 40 -16.789 3.244 -3.052 1.00 0.00 C ATOM 0 H LEU A 40 -16.598 5.499 -5.528 1.00 0.00 H new ATOM 0 HA LEU A 40 -17.548 6.027 -2.813 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -14.689 5.886 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -15.336 5.489 -2.190 1.00 0.00 H new ATOM 0 HG LEU A 40 -15.664 3.879 -4.734 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -14.349 2.192 -3.527 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -13.452 3.714 -3.742 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -14.170 3.320 -2.162 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -16.791 2.195 -3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -16.751 3.315 -1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -17.697 3.725 -3.415 1.00 0.00 H new ATOM 641 N HIS A 41 -17.523 8.506 -3.616 1.00 0.00 N ATOM 642 CA HIS A 41 -17.361 9.959 -3.631 1.00 0.00 C ATOM 643 C HIS A 41 -17.039 10.513 -2.240 1.00 0.00 C ATOM 644 O HIS A 41 -17.019 11.724 -2.038 1.00 0.00 O ATOM 645 CB HIS A 41 -18.603 10.662 -4.219 1.00 0.00 C ATOM 646 CG HIS A 41 -19.917 10.024 -3.876 1.00 0.00 C ATOM 647 ND1 HIS A 41 -20.743 9.473 -4.829 1.00 0.00 N ATOM 648 CD2 HIS A 41 -20.565 9.880 -2.694 1.00 0.00 C ATOM 649 CE1 HIS A 41 -21.840 9.023 -4.253 1.00 0.00 C ATOM 650 NE2 HIS A 41 -21.760 9.257 -2.957 1.00 0.00 N ATOM 0 H HIS A 41 -18.493 8.190 -3.613 1.00 0.00 H new ATOM 0 HA HIS A 41 -16.511 10.172 -4.279 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -18.616 11.695 -3.870 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -18.504 10.693 -5.304 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -20.538 9.421 -5.827 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -20.208 10.197 -1.725 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -22.666 8.543 -4.757 1.00 0.00 H new ATOM 659 N ASP A 42 -16.800 9.624 -1.285 1.00 0.00 N ATOM 660 CA ASP A 42 -16.414 10.031 0.066 1.00 0.00 C ATOM 661 C ASP A 42 -15.025 9.501 0.407 1.00 0.00 C ATOM 662 O ASP A 42 -14.663 9.368 1.574 1.00 0.00 O ATOM 663 CB ASP A 42 -17.431 9.536 1.098 1.00 0.00 C ATOM 664 CG ASP A 42 -18.730 10.316 1.064 1.00 0.00 C ATOM 665 OD1 ASP A 42 -19.631 9.955 0.277 1.00 0.00 O ATOM 666 OD2 ASP A 42 -18.858 11.302 1.823 1.00 0.00 O ATOM 0 H ASP A 42 -16.866 8.615 -1.418 1.00 0.00 H new ATOM 0 HA ASP A 42 -16.394 11.120 0.096 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -17.641 8.482 0.918 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -16.995 9.608 2.094 1.00 0.00 H new ATOM 671 N TYR A 43 -14.241 9.222 -0.624 1.00 0.00 N ATOM 672 CA TYR A 43 -12.938 8.591 -0.455 1.00 0.00 C ATOM 673 C TYR A 43 -11.906 9.573 0.086 1.00 0.00 C ATOM 674 O TYR A 43 -11.084 9.217 0.930 1.00 0.00 O ATOM 675 CB TYR A 43 -12.482 8.000 -1.797 1.00 0.00 C ATOM 676 CG TYR A 43 -11.078 7.435 -1.819 1.00 0.00 C ATOM 677 CD1 TYR A 43 -10.838 6.127 -1.438 1.00 0.00 C ATOM 678 CD2 TYR A 43 -10.002 8.199 -2.256 1.00 0.00 C ATOM 679 CE1 TYR A 43 -9.569 5.588 -1.488 1.00 0.00 C ATOM 680 CE2 TYR A 43 -8.726 7.670 -2.304 1.00 0.00 C ATOM 681 CZ TYR A 43 -8.516 6.364 -1.921 1.00 0.00 C ATOM 682 OH TYR A 43 -7.250 5.829 -1.979 1.00 0.00 O ATOM 0 H TYR A 43 -14.486 9.424 -1.593 1.00 0.00 H new ATOM 0 HA TYR A 43 -13.031 7.790 0.279 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -13.177 7.210 -2.081 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -12.554 8.776 -2.559 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -11.660 5.516 -1.095 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -10.166 9.222 -2.563 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -9.402 4.564 -1.189 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -7.899 8.277 -2.640 1.00 0.00 H new ATOM 0 HH TYR A 43 -6.623 6.507 -2.306 1.00 0.00 H new ATOM 692 N HIS A 44 -11.965 10.813 -0.377 1.00 0.00 N ATOM 693 CA HIS A 44 -10.977 11.811 0.017 1.00 0.00 C ATOM 694 C HIS A 44 -11.257 12.338 1.421 1.00 0.00 C ATOM 695 O HIS A 44 -10.414 12.998 2.027 1.00 0.00 O ATOM 696 CB HIS A 44 -10.929 12.966 -0.988 1.00 0.00 C ATOM 697 CG HIS A 44 -10.304 12.596 -2.298 1.00 0.00 C ATOM 698 ND1 HIS A 44 -8.944 12.631 -2.517 1.00 0.00 N ATOM 699 CD2 HIS A 44 -10.858 12.181 -3.462 1.00 0.00 C ATOM 700 CE1 HIS A 44 -8.688 12.256 -3.756 1.00 0.00 C ATOM 701 NE2 HIS A 44 -9.832 11.976 -4.350 1.00 0.00 N ATOM 0 H HIS A 44 -12.680 11.152 -1.021 1.00 0.00 H new ATOM 0 HA HIS A 44 -10.002 11.323 0.024 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -11.943 13.323 -1.167 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -10.372 13.794 -0.550 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -11.911 12.038 -3.655 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -7.709 12.190 -4.207 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -9.937 11.658 -5.314 1.00 0.00 H new ATOM 710 N ASP A 45 -12.445 12.045 1.932 1.00 0.00 N ATOM 711 CA ASP A 45 -12.805 12.424 3.293 1.00 0.00 C ATOM 712 C ASP A 45 -12.197 11.457 4.297 1.00 0.00 C ATOM 713 O ASP A 45 -11.626 11.869 5.308 1.00 0.00 O ATOM 714 CB ASP A 45 -14.326 12.464 3.472 1.00 0.00 C ATOM 715 CG ASP A 45 -14.944 13.744 2.952 1.00 0.00 C ATOM 716 OD1 ASP A 45 -15.186 14.663 3.765 1.00 0.00 O ATOM 717 OD2 ASP A 45 -15.189 13.846 1.734 1.00 0.00 O ATOM 0 H ASP A 45 -13.176 11.546 1.425 1.00 0.00 H new ATOM 0 HA ASP A 45 -12.408 13.423 3.473 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.771 11.614 2.954 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -14.566 12.353 4.530 1.00 0.00 H new ATOM 722 N ILE A 46 -12.318 10.169 4.016 1.00 0.00 N ATOM 723 CA ILE A 46 -11.812 9.148 4.920 1.00 0.00 C ATOM 724 C ILE A 46 -10.296 9.008 4.794 1.00 0.00 C ATOM 725 O ILE A 46 -9.585 8.940 5.797 1.00 0.00 O ATOM 726 CB ILE A 46 -12.499 7.775 4.684 1.00 0.00 C ATOM 727 CG1 ILE A 46 -13.922 7.761 5.234 1.00 0.00 C ATOM 728 CG2 ILE A 46 -11.717 6.642 5.335 1.00 0.00 C ATOM 729 CD1 ILE A 46 -14.904 8.670 4.521 1.00 0.00 C ATOM 0 H ILE A 46 -12.761 9.806 3.172 1.00 0.00 H new ATOM 0 HA ILE A 46 -12.051 9.472 5.933 1.00 0.00 H new ATOM 0 HB ILE A 46 -12.526 7.625 3.605 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -14.300 6.740 5.190 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -13.889 8.044 6.286 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -12.226 5.696 5.150 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.713 6.603 4.912 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -11.652 6.815 6.409 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -15.885 8.585 4.989 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -14.559 9.702 4.587 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -14.976 8.378 3.473 1.00 0.00 H new ATOM 741 N ILE A 47 -9.803 8.989 3.566 1.00 0.00 N ATOM 742 CA ILE A 47 -8.378 8.806 3.330 1.00 0.00 C ATOM 743 C ILE A 47 -7.639 10.143 3.372 1.00 0.00 C ATOM 744 O ILE A 47 -7.761 10.960 2.457 1.00 0.00 O ATOM 745 CB ILE A 47 -8.110 8.124 1.975 1.00 0.00 C ATOM 746 CG1 ILE A 47 -8.942 6.847 1.834 1.00 0.00 C ATOM 747 CG2 ILE A 47 -6.630 7.808 1.842 1.00 0.00 C ATOM 748 CD1 ILE A 47 -8.484 5.725 2.727 1.00 0.00 C ATOM 0 H ILE A 47 -10.364 9.097 2.721 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.007 8.162 4.127 1.00 0.00 H new ATOM 0 HB ILE A 47 -8.402 8.807 1.178 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -9.984 7.076 2.058 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -8.905 6.513 0.797 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -6.446 7.326 0.882 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.054 8.732 1.901 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.327 7.140 2.648 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.120 4.854 2.572 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.452 5.468 2.488 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.547 6.040 3.769 1.00 0.00 H new ATOM 760 N LYS A 48 -6.879 10.362 4.439 1.00 0.00 N ATOM 761 CA LYS A 48 -6.100 11.588 4.591 1.00 0.00 C ATOM 762 C LYS A 48 -4.699 11.434 4.004 1.00 0.00 C ATOM 763 O LYS A 48 -4.057 12.417 3.631 1.00 0.00 O ATOM 764 CB LYS A 48 -6.013 11.975 6.064 1.00 0.00 C ATOM 765 CG LYS A 48 -7.330 12.484 6.624 1.00 0.00 C ATOM 766 CD LYS A 48 -7.702 13.833 6.028 1.00 0.00 C ATOM 767 CE LYS A 48 -9.176 14.132 6.195 1.00 0.00 C ATOM 768 NZ LYS A 48 -9.625 14.037 7.608 1.00 0.00 N ATOM 0 H LYS A 48 -6.785 9.706 5.214 1.00 0.00 H new ATOM 0 HA LYS A 48 -6.609 12.380 4.041 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -5.689 11.110 6.642 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -5.251 12.744 6.187 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.119 11.762 6.415 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.257 12.571 7.708 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -7.115 14.617 6.507 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -7.446 13.846 4.969 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -9.384 15.134 5.819 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -9.755 13.437 5.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -10.603 14.381 7.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -9.581 13.046 7.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -9.006 14.617 8.209 1.00 0.00 H new ATOM 782 N HIS A 49 -4.225 10.199 3.942 1.00 0.00 N ATOM 783 CA HIS A 49 -2.946 9.889 3.307 1.00 0.00 C ATOM 784 C HIS A 49 -3.126 8.851 2.201 1.00 0.00 C ATOM 785 O HIS A 49 -2.762 7.686 2.377 1.00 0.00 O ATOM 786 CB HIS A 49 -1.933 9.376 4.334 1.00 0.00 C ATOM 787 CG HIS A 49 -1.316 10.456 5.165 1.00 0.00 C ATOM 788 ND1 HIS A 49 -0.134 11.081 4.831 1.00 0.00 N ATOM 789 CD2 HIS A 49 -1.721 11.021 6.324 1.00 0.00 C ATOM 790 CE1 HIS A 49 0.161 11.980 5.749 1.00 0.00 C ATOM 791 NE2 HIS A 49 -0.786 11.965 6.665 1.00 0.00 N ATOM 0 H HIS A 49 -4.709 9.387 4.326 1.00 0.00 H new ATOM 0 HA HIS A 49 -2.565 10.811 2.869 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -2.427 8.661 4.992 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -1.143 8.836 3.813 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -2.615 10.775 6.879 1.00 0.00 H new ATOM 0 HE1 HIS A 49 1.031 12.620 5.750 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -0.819 12.559 7.493 1.00 0.00 H new ATOM 800 N PRO A 50 -3.725 9.243 1.056 1.00 0.00 N ATOM 801 CA PRO A 50 -3.848 8.355 -0.102 1.00 0.00 C ATOM 802 C PRO A 50 -2.488 8.042 -0.710 1.00 0.00 C ATOM 803 O PRO A 50 -1.919 8.849 -1.446 1.00 0.00 O ATOM 804 CB PRO A 50 -4.713 9.146 -1.089 1.00 0.00 C ATOM 805 CG PRO A 50 -4.552 10.569 -0.687 1.00 0.00 C ATOM 806 CD PRO A 50 -4.348 10.557 0.806 1.00 0.00 C ATOM 0 HA PRO A 50 -4.282 7.391 0.164 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -4.386 8.987 -2.116 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -5.757 8.836 -1.035 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.701 11.024 -1.194 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -5.432 11.153 -0.956 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.704 11.375 1.130 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.292 10.663 1.341 1.00 0.00 H new ATOM 814 N MET A 51 -1.965 6.876 -0.382 1.00 0.00 N ATOM 815 CA MET A 51 -0.661 6.469 -0.865 1.00 0.00 C ATOM 816 C MET A 51 -0.728 5.074 -1.464 1.00 0.00 C ATOM 817 O MET A 51 -1.496 4.227 -1.007 1.00 0.00 O ATOM 818 CB MET A 51 0.370 6.522 0.272 1.00 0.00 C ATOM 819 CG MET A 51 1.746 5.983 -0.109 1.00 0.00 C ATOM 820 SD MET A 51 2.418 6.791 -1.577 1.00 0.00 S ATOM 821 CE MET A 51 2.320 8.505 -1.087 1.00 0.00 C ATOM 0 H MET A 51 -2.426 6.193 0.219 1.00 0.00 H new ATOM 0 HA MET A 51 -0.347 7.162 -1.646 1.00 0.00 H new ATOM 0 HB2 MET A 51 0.475 7.555 0.605 1.00 0.00 H new ATOM 0 HB3 MET A 51 -0.010 5.951 1.119 1.00 0.00 H new ATOM 0 HG2 MET A 51 2.432 6.123 0.726 1.00 0.00 H new ATOM 0 HG3 MET A 51 1.676 4.910 -0.288 1.00 0.00 H new ATOM 0 HE1 MET A 51 2.931 9.110 -1.757 1.00 0.00 H new ATOM 0 HE2 MET A 51 1.284 8.840 -1.139 1.00 0.00 H new ATOM 0 HE3 MET A 51 2.685 8.613 -0.066 1.00 0.00 H new ATOM 831 N ASP A 52 0.079 4.859 -2.487 1.00 0.00 N ATOM 832 CA ASP A 52 0.132 3.591 -3.196 1.00 0.00 C ATOM 833 C ASP A 52 1.581 3.244 -3.501 1.00 0.00 C ATOM 834 O ASP A 52 2.448 4.112 -3.420 1.00 0.00 O ATOM 835 CB ASP A 52 -0.670 3.668 -4.496 1.00 0.00 C ATOM 836 CG ASP A 52 -0.136 4.732 -5.428 1.00 0.00 C ATOM 837 OD1 ASP A 52 0.707 4.414 -6.287 1.00 0.00 O ATOM 838 OD2 ASP A 52 -0.546 5.903 -5.295 1.00 0.00 O ATOM 0 H ASP A 52 0.720 5.563 -2.852 1.00 0.00 H new ATOM 0 HA ASP A 52 -0.306 2.815 -2.567 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -0.643 2.700 -4.997 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -1.714 3.878 -4.266 1.00 0.00 H new ATOM 843 N LEU A 53 1.846 2.003 -3.868 1.00 0.00 N ATOM 844 CA LEU A 53 3.219 1.555 -4.089 1.00 0.00 C ATOM 845 C LEU A 53 3.887 2.294 -5.245 1.00 0.00 C ATOM 846 O LEU A 53 5.092 2.557 -5.207 1.00 0.00 O ATOM 847 CB LEU A 53 3.254 0.048 -4.315 1.00 0.00 C ATOM 848 CG LEU A 53 3.091 -0.782 -3.047 1.00 0.00 C ATOM 849 CD1 LEU A 53 2.800 -2.218 -3.403 1.00 0.00 C ATOM 850 CD2 LEU A 53 4.333 -0.700 -2.181 1.00 0.00 C ATOM 0 H LEU A 53 1.136 1.287 -4.020 1.00 0.00 H new ATOM 0 HA LEU A 53 3.789 1.791 -3.191 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.463 -0.221 -5.015 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.200 -0.215 -4.788 1.00 0.00 H new ATOM 0 HG LEU A 53 2.253 -0.378 -2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 53 2.685 -2.803 -2.490 1.00 0.00 H new ATOM 0 HD12 LEU A 53 1.880 -2.269 -3.985 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.624 -2.621 -3.991 1.00 0.00 H new ATOM 0 HD21 LEU A 53 4.191 -1.301 -1.283 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.190 -1.078 -2.738 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.512 0.338 -1.899 1.00 0.00 H new ATOM 862 N SER A 54 3.109 2.649 -6.257 1.00 0.00 N ATOM 863 CA SER A 54 3.640 3.385 -7.394 1.00 0.00 C ATOM 864 C SER A 54 4.122 4.774 -6.969 1.00 0.00 C ATOM 865 O SER A 54 5.171 5.233 -7.418 1.00 0.00 O ATOM 866 CB SER A 54 2.593 3.496 -8.499 1.00 0.00 C ATOM 867 OG SER A 54 2.255 2.214 -9.000 1.00 0.00 O ATOM 0 H SER A 54 2.112 2.440 -6.314 1.00 0.00 H new ATOM 0 HA SER A 54 4.496 2.834 -7.784 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.700 3.988 -8.113 1.00 0.00 H new ATOM 0 HB3 SER A 54 2.975 4.119 -9.308 1.00 0.00 H new ATOM 0 HG SER A 54 1.538 1.829 -8.455 1.00 0.00 H new ATOM 873 N THR A 55 3.367 5.430 -6.091 1.00 0.00 N ATOM 874 CA THR A 55 3.755 6.740 -5.581 1.00 0.00 C ATOM 875 C THR A 55 4.902 6.620 -4.578 1.00 0.00 C ATOM 876 O THR A 55 5.767 7.494 -4.514 1.00 0.00 O ATOM 877 CB THR A 55 2.577 7.481 -4.928 1.00 0.00 C ATOM 878 OG1 THR A 55 1.440 7.453 -5.803 1.00 0.00 O ATOM 879 CG2 THR A 55 2.957 8.921 -4.658 1.00 0.00 C ATOM 0 H THR A 55 2.486 5.076 -5.719 1.00 0.00 H new ATOM 0 HA THR A 55 4.087 7.322 -6.441 1.00 0.00 H new ATOM 0 HB THR A 55 2.330 6.987 -3.988 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.670 7.078 -5.327 1.00 0.00 H new ATOM 0 HG21 THR A 55 2.117 9.438 -4.195 1.00 0.00 H new ATOM 0 HG22 THR A 55 3.816 8.951 -3.987 1.00 0.00 H new ATOM 0 HG23 THR A 55 3.213 9.412 -5.597 1.00 0.00 H new ATOM 887 N VAL A 56 4.915 5.536 -3.807 1.00 0.00 N ATOM 888 CA VAL A 56 6.024 5.265 -2.897 1.00 0.00 C ATOM 889 C VAL A 56 7.313 5.151 -3.693 1.00 0.00 C ATOM 890 O VAL A 56 8.339 5.736 -3.344 1.00 0.00 O ATOM 891 CB VAL A 56 5.801 3.966 -2.094 1.00 0.00 C ATOM 892 CG1 VAL A 56 7.022 3.638 -1.248 1.00 0.00 C ATOM 893 CG2 VAL A 56 4.571 4.087 -1.209 1.00 0.00 C ATOM 0 H VAL A 56 4.175 4.835 -3.794 1.00 0.00 H new ATOM 0 HA VAL A 56 6.087 6.091 -2.189 1.00 0.00 H new ATOM 0 HB VAL A 56 5.642 3.155 -2.805 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.842 2.719 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 56 7.889 3.506 -1.896 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.211 4.454 -0.550 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.431 3.161 -0.651 1.00 0.00 H new ATOM 0 HG22 VAL A 56 4.705 4.914 -0.511 1.00 0.00 H new ATOM 0 HG23 VAL A 56 3.694 4.273 -1.829 1.00 0.00 H new ATOM 903 N LYS A 57 7.236 4.412 -4.785 1.00 0.00 N ATOM 904 CA LYS A 57 8.370 4.248 -5.670 1.00 0.00 C ATOM 905 C LYS A 57 8.690 5.559 -6.358 1.00 0.00 C ATOM 906 O LYS A 57 9.847 5.920 -6.500 1.00 0.00 O ATOM 907 CB LYS A 57 8.090 3.181 -6.718 1.00 0.00 C ATOM 908 CG LYS A 57 9.251 2.227 -6.906 1.00 0.00 C ATOM 909 CD LYS A 57 9.050 1.299 -8.084 1.00 0.00 C ATOM 910 CE LYS A 57 10.086 0.192 -8.056 1.00 0.00 C ATOM 911 NZ LYS A 57 10.021 -0.677 -9.259 1.00 0.00 N ATOM 0 H LYS A 57 6.395 3.915 -5.079 1.00 0.00 H new ATOM 0 HA LYS A 57 9.224 3.935 -5.069 1.00 0.00 H new ATOM 0 HB2 LYS A 57 7.204 2.616 -6.428 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.863 3.663 -7.669 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.168 2.799 -7.050 1.00 0.00 H new ATOM 0 HG3 LYS A 57 9.383 1.636 -6.000 1.00 0.00 H new ATOM 0 HD2 LYS A 57 8.048 0.871 -8.053 1.00 0.00 H new ATOM 0 HD3 LYS A 57 9.129 1.859 -9.016 1.00 0.00 H new ATOM 0 HE2 LYS A 57 11.081 0.631 -7.982 1.00 0.00 H new ATOM 0 HE3 LYS A 57 9.939 -0.416 -7.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 10.748 -1.417 -9.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 9.081 -1.119 -9.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 10.188 -0.104 -10.111 1.00 0.00 H new ATOM 925 N ARG A 58 7.649 6.255 -6.786 1.00 0.00 N ATOM 926 CA ARG A 58 7.786 7.565 -7.417 1.00 0.00 C ATOM 927 C ARG A 58 8.619 8.503 -6.547 1.00 0.00 C ATOM 928 O ARG A 58 9.619 9.071 -6.991 1.00 0.00 O ATOM 929 CB ARG A 58 6.405 8.172 -7.627 1.00 0.00 C ATOM 930 CG ARG A 58 6.424 9.482 -8.390 1.00 0.00 C ATOM 931 CD ARG A 58 5.113 10.231 -8.239 1.00 0.00 C ATOM 932 NE ARG A 58 3.956 9.420 -8.619 1.00 0.00 N ATOM 933 CZ ARG A 58 2.698 9.750 -8.337 1.00 0.00 C ATOM 934 NH1 ARG A 58 2.435 10.874 -7.679 1.00 0.00 N ATOM 935 NH2 ARG A 58 1.704 8.956 -8.713 1.00 0.00 N ATOM 0 H ARG A 58 6.685 5.931 -6.708 1.00 0.00 H new ATOM 0 HA ARG A 58 8.290 7.436 -8.375 1.00 0.00 H new ATOM 0 HB2 ARG A 58 5.782 7.458 -8.165 1.00 0.00 H new ATOM 0 HB3 ARG A 58 5.938 8.334 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 58 7.243 10.103 -8.028 1.00 0.00 H new ATOM 0 HG3 ARG A 58 6.614 9.287 -9.446 1.00 0.00 H new ATOM 0 HD2 ARG A 58 5.001 10.555 -7.204 1.00 0.00 H new ATOM 0 HD3 ARG A 58 5.140 11.131 -8.854 1.00 0.00 H new ATOM 0 HE ARG A 58 4.123 8.553 -9.129 1.00 0.00 H new ATOM 0 HH11 ARG A 58 3.198 11.486 -7.389 1.00 0.00 H new ATOM 0 HH12 ARG A 58 1.470 11.125 -7.464 1.00 0.00 H new ATOM 0 HH21 ARG A 58 1.904 8.093 -9.218 1.00 0.00 H new ATOM 0 HH22 ARG A 58 0.740 9.209 -8.497 1.00 0.00 H new ATOM 949 N LYS A 59 8.189 8.648 -5.304 1.00 0.00 N ATOM 950 CA LYS A 59 8.869 9.491 -4.332 1.00 0.00 C ATOM 951 C LYS A 59 10.282 8.965 -4.056 1.00 0.00 C ATOM 952 O LYS A 59 11.228 9.741 -3.904 1.00 0.00 O ATOM 953 CB LYS A 59 8.046 9.534 -3.044 1.00 0.00 C ATOM 954 CG LYS A 59 6.746 10.331 -3.161 1.00 0.00 C ATOM 955 CD LYS A 59 5.797 10.131 -1.963 1.00 0.00 C ATOM 956 CE LYS A 59 6.375 10.611 -0.613 1.00 0.00 C ATOM 957 NZ LYS A 59 5.297 10.982 0.341 1.00 0.00 N ATOM 0 H LYS A 59 7.357 8.184 -4.939 1.00 0.00 H new ATOM 0 HA LYS A 59 8.963 10.500 -4.732 1.00 0.00 H new ATOM 0 HB2 LYS A 59 7.808 8.514 -2.743 1.00 0.00 H new ATOM 0 HB3 LYS A 59 8.655 9.967 -2.250 1.00 0.00 H new ATOM 0 HG2 LYS A 59 6.985 11.391 -3.253 1.00 0.00 H new ATOM 0 HG3 LYS A 59 6.231 10.040 -4.076 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.866 10.664 -2.158 1.00 0.00 H new ATOM 0 HD3 LYS A 59 5.548 9.073 -1.884 1.00 0.00 H new ATOM 0 HE2 LYS A 59 6.991 9.823 -0.179 1.00 0.00 H new ATOM 0 HE3 LYS A 59 7.026 11.469 -0.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.660 11.680 1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.497 11.392 -0.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.979 10.134 0.852 1.00 0.00 H new ATOM 971 N MET A 60 10.414 7.640 -3.987 1.00 0.00 N ATOM 972 CA MET A 60 11.725 6.997 -3.856 1.00 0.00 C ATOM 973 C MET A 60 12.620 7.322 -5.053 1.00 0.00 C ATOM 974 O MET A 60 13.816 7.560 -4.895 1.00 0.00 O ATOM 975 CB MET A 60 11.587 5.476 -3.745 1.00 0.00 C ATOM 976 CG MET A 60 12.918 4.772 -3.518 1.00 0.00 C ATOM 977 SD MET A 60 12.962 3.108 -4.210 1.00 0.00 S ATOM 978 CE MET A 60 11.464 2.433 -3.517 1.00 0.00 C ATOM 0 H MET A 60 9.629 6.989 -4.020 1.00 0.00 H new ATOM 0 HA MET A 60 12.180 7.387 -2.945 1.00 0.00 H new ATOM 0 HB2 MET A 60 10.911 5.237 -2.924 1.00 0.00 H new ATOM 0 HB3 MET A 60 11.130 5.091 -4.656 1.00 0.00 H new ATOM 0 HG2 MET A 60 13.717 5.366 -3.962 1.00 0.00 H new ATOM 0 HG3 MET A 60 13.117 4.720 -2.448 1.00 0.00 H new ATOM 0 HE1 MET A 60 11.189 1.527 -4.057 1.00 0.00 H new ATOM 0 HE2 MET A 60 11.625 2.194 -2.466 1.00 0.00 H new ATOM 0 HE3 MET A 60 10.661 3.165 -3.604 1.00 0.00 H new ATOM 988 N GLU A 61 12.035 7.321 -6.247 1.00 0.00 N ATOM 989 CA GLU A 61 12.766 7.626 -7.473 1.00 0.00 C ATOM 990 C GLU A 61 13.261 9.062 -7.458 1.00 0.00 C ATOM 991 O GLU A 61 14.319 9.374 -7.997 1.00 0.00 O ATOM 992 CB GLU A 61 11.880 7.393 -8.700 1.00 0.00 C ATOM 993 CG GLU A 61 11.583 5.927 -8.968 1.00 0.00 C ATOM 994 CD GLU A 61 10.686 5.719 -10.171 1.00 0.00 C ATOM 995 OE1 GLU A 61 9.544 6.226 -10.166 1.00 0.00 O ATOM 996 OE2 GLU A 61 11.112 5.029 -11.121 1.00 0.00 O ATOM 0 H GLU A 61 11.048 7.110 -6.392 1.00 0.00 H new ATOM 0 HA GLU A 61 13.626 6.959 -7.528 1.00 0.00 H new ATOM 0 HB2 GLU A 61 10.939 7.927 -8.565 1.00 0.00 H new ATOM 0 HB3 GLU A 61 12.367 7.822 -9.576 1.00 0.00 H new ATOM 0 HG2 GLU A 61 12.521 5.394 -9.124 1.00 0.00 H new ATOM 0 HG3 GLU A 61 11.110 5.490 -8.088 1.00 0.00 H new ATOM 1003 N ASN A 62 12.493 9.930 -6.820 1.00 0.00 N ATOM 1004 CA ASN A 62 12.884 11.327 -6.656 1.00 0.00 C ATOM 1005 C ASN A 62 13.847 11.453 -5.487 1.00 0.00 C ATOM 1006 O ASN A 62 14.343 12.534 -5.179 1.00 0.00 O ATOM 1007 CB ASN A 62 11.663 12.225 -6.429 1.00 0.00 C ATOM 1008 CG ASN A 62 10.859 12.481 -7.694 1.00 0.00 C ATOM 1009 OD1 ASN A 62 10.241 13.536 -7.842 1.00 0.00 O ATOM 1010 ND2 ASN A 62 10.851 11.526 -8.611 1.00 0.00 N ATOM 0 H ASN A 62 11.592 9.694 -6.405 1.00 0.00 H new ATOM 0 HA ASN A 62 13.375 11.655 -7.572 1.00 0.00 H new ATOM 0 HB2 ASN A 62 11.016 11.764 -5.683 1.00 0.00 H new ATOM 0 HB3 ASN A 62 11.994 13.179 -6.018 1.00 0.00 H new ATOM 0 HD21 ASN A 62 10.321 11.652 -9.474 1.00 0.00 H new ATOM 0 HD22 ASN A 62 11.375 10.665 -8.455 1.00 0.00 H new ATOM 1017 N ARG A 63 14.097 10.311 -4.850 1.00 0.00 N ATOM 1018 CA ARG A 63 15.043 10.190 -3.748 1.00 0.00 C ATOM 1019 C ARG A 63 14.671 11.106 -2.591 1.00 0.00 C ATOM 1020 O ARG A 63 15.535 11.610 -1.872 1.00 0.00 O ATOM 1021 CB ARG A 63 16.458 10.472 -4.251 1.00 0.00 C ATOM 1022 CG ARG A 63 16.821 9.662 -5.486 1.00 0.00 C ATOM 1023 CD ARG A 63 16.984 8.180 -5.177 1.00 0.00 C ATOM 1024 NE ARG A 63 16.856 7.348 -6.379 1.00 0.00 N ATOM 1025 CZ ARG A 63 17.799 7.223 -7.316 1.00 0.00 C ATOM 1026 NH1 ARG A 63 18.931 7.911 -7.233 1.00 0.00 N ATOM 1027 NH2 ARG A 63 17.598 6.416 -8.348 1.00 0.00 N ATOM 0 H ARG A 63 13.640 9.431 -5.090 1.00 0.00 H new ATOM 0 HA ARG A 63 15.005 9.170 -3.366 1.00 0.00 H new ATOM 0 HB2 ARG A 63 16.552 11.534 -4.479 1.00 0.00 H new ATOM 0 HB3 ARG A 63 17.171 10.252 -3.456 1.00 0.00 H new ATOM 0 HG2 ARG A 63 16.047 9.790 -6.242 1.00 0.00 H new ATOM 0 HG3 ARG A 63 17.748 10.047 -5.911 1.00 0.00 H new ATOM 0 HD2 ARG A 63 17.960 8.010 -4.721 1.00 0.00 H new ATOM 0 HD3 ARG A 63 16.234 7.878 -4.446 1.00 0.00 H new ATOM 0 HE ARG A 63 15.987 6.830 -6.508 1.00 0.00 H new ATOM 0 HH11 ARG A 63 19.087 8.543 -6.448 1.00 0.00 H new ATOM 0 HH12 ARG A 63 19.645 7.808 -7.954 1.00 0.00 H new ATOM 0 HH21 ARG A 63 16.725 5.893 -8.424 1.00 0.00 H new ATOM 0 HH22 ARG A 63 18.316 6.318 -9.066 1.00 0.00 H new ATOM 1041 N ASP A 64 13.370 11.297 -2.409 1.00 0.00 N ATOM 1042 CA ASP A 64 12.851 12.109 -1.309 1.00 0.00 C ATOM 1043 C ASP A 64 12.929 11.353 0.009 1.00 0.00 C ATOM 1044 O ASP A 64 12.782 11.936 1.083 1.00 0.00 O ATOM 1045 CB ASP A 64 11.406 12.522 -1.581 1.00 0.00 C ATOM 1046 CG ASP A 64 11.298 13.894 -2.210 1.00 0.00 C ATOM 1047 OD1 ASP A 64 11.284 13.987 -3.455 1.00 0.00 O ATOM 1048 OD2 ASP A 64 11.211 14.889 -1.458 1.00 0.00 O ATOM 0 H ASP A 64 12.649 10.899 -3.011 1.00 0.00 H new ATOM 0 HA ASP A 64 13.469 13.004 -1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 64 10.941 11.788 -2.239 1.00 0.00 H new ATOM 0 HB3 ASP A 64 10.847 12.511 -0.645 1.00 0.00 H new ATOM 1053 N TYR A 65 13.142 10.051 -0.081 1.00 0.00 N ATOM 1054 CA TYR A 65 13.317 9.220 1.101 1.00 0.00 C ATOM 1055 C TYR A 65 14.767 9.286 1.542 1.00 0.00 C ATOM 1056 O TYR A 65 15.672 9.293 0.707 1.00 0.00 O ATOM 1057 CB TYR A 65 12.951 7.758 0.816 1.00 0.00 C ATOM 1058 CG TYR A 65 11.492 7.505 0.493 1.00 0.00 C ATOM 1059 CD1 TYR A 65 10.924 6.262 0.732 1.00 0.00 C ATOM 1060 CD2 TYR A 65 10.689 8.489 -0.062 1.00 0.00 C ATOM 1061 CE1 TYR A 65 9.598 6.011 0.428 1.00 0.00 C ATOM 1062 CE2 TYR A 65 9.368 8.245 -0.362 1.00 0.00 C ATOM 1063 CZ TYR A 65 8.827 7.010 -0.117 1.00 0.00 C ATOM 1064 OH TYR A 65 7.508 6.775 -0.423 1.00 0.00 O ATOM 0 H TYR A 65 13.198 9.544 -0.964 1.00 0.00 H new ATOM 0 HA TYR A 65 12.657 9.595 1.883 1.00 0.00 H new ATOM 0 HB2 TYR A 65 13.557 7.405 -0.019 1.00 0.00 H new ATOM 0 HB3 TYR A 65 13.223 7.157 1.684 1.00 0.00 H new ATOM 0 HD1 TYR A 65 11.527 5.477 1.163 1.00 0.00 H new ATOM 0 HD2 TYR A 65 11.107 9.464 -0.263 1.00 0.00 H new ATOM 0 HE1 TYR A 65 9.172 5.037 0.618 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.758 9.027 -0.790 1.00 0.00 H new ATOM 0 HH TYR A 65 7.110 7.588 -0.799 1.00 0.00 H new ATOM 1074 N ARG A 66 14.990 9.354 2.839 1.00 0.00 N ATOM 1075 CA ARG A 66 16.342 9.383 3.368 1.00 0.00 C ATOM 1076 C ARG A 66 16.758 7.998 3.837 1.00 0.00 C ATOM 1077 O ARG A 66 17.932 7.632 3.761 1.00 0.00 O ATOM 1078 CB ARG A 66 16.431 10.384 4.526 1.00 0.00 C ATOM 1079 CG ARG A 66 17.830 10.564 5.091 1.00 0.00 C ATOM 1080 CD ARG A 66 18.693 11.424 4.182 1.00 0.00 C ATOM 1081 NE ARG A 66 20.099 11.394 4.571 1.00 0.00 N ATOM 1082 CZ ARG A 66 21.053 12.084 3.948 1.00 0.00 C ATOM 1083 NH1 ARG A 66 20.745 12.867 2.920 1.00 0.00 N ATOM 1084 NH2 ARG A 66 22.313 11.992 4.352 1.00 0.00 N ATOM 0 H ARG A 66 14.256 9.390 3.546 1.00 0.00 H new ATOM 0 HA ARG A 66 17.021 9.698 2.576 1.00 0.00 H new ATOM 0 HB2 ARG A 66 16.063 11.351 4.184 1.00 0.00 H new ATOM 0 HB3 ARG A 66 15.768 10.056 5.326 1.00 0.00 H new ATOM 0 HG2 ARG A 66 17.769 11.024 6.077 1.00 0.00 H new ATOM 0 HG3 ARG A 66 18.298 9.589 5.223 1.00 0.00 H new ATOM 0 HD2 ARG A 66 18.594 11.076 3.154 1.00 0.00 H new ATOM 0 HD3 ARG A 66 18.332 12.452 4.207 1.00 0.00 H new ATOM 0 HE ARG A 66 20.366 10.812 5.365 1.00 0.00 H new ATOM 0 HH11 ARG A 66 19.777 12.940 2.607 1.00 0.00 H new ATOM 0 HH12 ARG A 66 21.476 13.395 2.444 1.00 0.00 H new ATOM 0 HH21 ARG A 66 22.553 11.392 5.141 1.00 0.00 H new ATOM 0 HH22 ARG A 66 23.042 12.521 3.873 1.00 0.00 H new ATOM 1098 N ASP A 67 15.795 7.222 4.308 1.00 0.00 N ATOM 1099 CA ASP A 67 16.078 5.913 4.845 1.00 0.00 C ATOM 1100 C ASP A 67 14.933 4.958 4.582 1.00 0.00 C ATOM 1101 O ASP A 67 13.869 5.356 4.102 1.00 0.00 O ATOM 1102 CB ASP A 67 16.345 6.022 6.344 1.00 0.00 C ATOM 1103 CG ASP A 67 15.252 6.755 7.094 1.00 0.00 C ATOM 1104 OD1 ASP A 67 14.107 6.279 7.112 1.00 0.00 O ATOM 1105 OD2 ASP A 67 15.549 7.815 7.687 1.00 0.00 O ATOM 0 H ASP A 67 14.809 7.483 4.327 1.00 0.00 H new ATOM 0 HA ASP A 67 16.964 5.517 4.348 1.00 0.00 H new ATOM 0 HB2 ASP A 67 16.454 5.021 6.761 1.00 0.00 H new ATOM 0 HB3 ASP A 67 17.293 6.537 6.501 1.00 0.00 H new ATOM 1110 N ALA A 68 15.163 3.696 4.906 1.00 0.00 N ATOM 1111 CA ALA A 68 14.181 2.656 4.673 1.00 0.00 C ATOM 1112 C ALA A 68 13.047 2.760 5.666 1.00 0.00 C ATOM 1113 O ALA A 68 11.982 2.180 5.468 1.00 0.00 O ATOM 1114 CB ALA A 68 14.823 1.289 4.763 1.00 0.00 C ATOM 0 H ALA A 68 16.029 3.368 5.334 1.00 0.00 H new ATOM 0 HA ALA A 68 13.779 2.790 3.669 1.00 0.00 H new ATOM 0 HB1 ALA A 68 14.070 0.521 4.585 1.00 0.00 H new ATOM 0 HB2 ALA A 68 15.610 1.206 4.013 1.00 0.00 H new ATOM 0 HB3 ALA A 68 15.252 1.153 5.756 1.00 0.00 H new ATOM 1120 N GLN A 69 13.275 3.505 6.735 1.00 0.00 N ATOM 1121 CA GLN A 69 12.239 3.709 7.726 1.00 0.00 C ATOM 1122 C GLN A 69 11.171 4.634 7.153 1.00 0.00 C ATOM 1123 O GLN A 69 9.978 4.434 7.375 1.00 0.00 O ATOM 1124 CB GLN A 69 12.812 4.293 9.014 1.00 0.00 C ATOM 1125 CG GLN A 69 11.781 4.417 10.113 1.00 0.00 C ATOM 1126 CD GLN A 69 11.442 3.090 10.757 1.00 0.00 C ATOM 1127 OE1 GLN A 69 12.277 2.191 10.838 1.00 0.00 O ATOM 1128 NE2 GLN A 69 10.210 2.959 11.217 1.00 0.00 N ATOM 0 H GLN A 69 14.159 3.973 6.935 1.00 0.00 H new ATOM 0 HA GLN A 69 11.795 2.744 7.972 1.00 0.00 H new ATOM 0 HB2 GLN A 69 13.631 3.662 9.360 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.233 5.276 8.805 1.00 0.00 H new ATOM 0 HG2 GLN A 69 12.152 5.101 10.876 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.873 4.859 9.703 1.00 0.00 H new ATOM 0 HE21 GLN A 69 9.548 3.730 11.129 1.00 0.00 H new ATOM 0 HE22 GLN A 69 9.921 2.087 11.660 1.00 0.00 H new ATOM 1137 N GLU A 70 11.612 5.640 6.398 1.00 0.00 N ATOM 1138 CA GLU A 70 10.700 6.533 5.703 1.00 0.00 C ATOM 1139 C GLU A 70 9.934 5.775 4.638 1.00 0.00 C ATOM 1140 O GLU A 70 8.760 6.044 4.389 1.00 0.00 O ATOM 1141 CB GLU A 70 11.436 7.712 5.074 1.00 0.00 C ATOM 1142 CG GLU A 70 11.902 8.740 6.084 1.00 0.00 C ATOM 1143 CD GLU A 70 12.273 10.052 5.435 1.00 0.00 C ATOM 1144 OE1 GLU A 70 13.411 10.173 4.942 1.00 0.00 O ATOM 1145 OE2 GLU A 70 11.427 10.971 5.413 1.00 0.00 O ATOM 0 H GLU A 70 12.599 5.853 6.255 1.00 0.00 H new ATOM 0 HA GLU A 70 10.001 6.928 6.440 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.299 7.339 4.522 1.00 0.00 H new ATOM 0 HB3 GLU A 70 10.780 8.196 4.351 1.00 0.00 H new ATOM 0 HG2 GLU A 70 11.113 8.910 6.817 1.00 0.00 H new ATOM 0 HG3 GLU A 70 12.763 8.349 6.627 1.00 0.00 H new ATOM 1152 N PHE A 71 10.605 4.820 4.014 1.00 0.00 N ATOM 1153 CA PHE A 71 9.945 3.938 3.072 1.00 0.00 C ATOM 1154 C PHE A 71 8.897 3.119 3.795 1.00 0.00 C ATOM 1155 O PHE A 71 7.733 3.113 3.399 1.00 0.00 O ATOM 1156 CB PHE A 71 10.947 3.020 2.362 1.00 0.00 C ATOM 1157 CG PHE A 71 10.322 1.763 1.811 1.00 0.00 C ATOM 1158 CD1 PHE A 71 9.693 1.761 0.575 1.00 0.00 C ATOM 1159 CD2 PHE A 71 10.363 0.585 2.538 1.00 0.00 C ATOM 1160 CE1 PHE A 71 9.117 0.602 0.078 1.00 0.00 C ATOM 1161 CE2 PHE A 71 9.791 -0.570 2.051 1.00 0.00 C ATOM 1162 CZ PHE A 71 9.167 -0.564 0.818 1.00 0.00 C ATOM 0 H PHE A 71 11.600 4.638 4.143 1.00 0.00 H new ATOM 0 HA PHE A 71 9.466 4.549 2.307 1.00 0.00 H new ATOM 0 HB2 PHE A 71 11.418 3.570 1.547 1.00 0.00 H new ATOM 0 HB3 PHE A 71 11.737 2.747 3.061 1.00 0.00 H new ATOM 0 HD1 PHE A 71 9.651 2.671 -0.006 1.00 0.00 H new ATOM 0 HD2 PHE A 71 10.851 0.571 3.501 1.00 0.00 H new ATOM 0 HE1 PHE A 71 8.630 0.610 -0.886 1.00 0.00 H new ATOM 0 HE2 PHE A 71 9.830 -1.479 2.632 1.00 0.00 H new ATOM 0 HZ PHE A 71 8.719 -1.469 0.434 1.00 0.00 H new ATOM 1172 N ALA A 72 9.319 2.440 4.862 1.00 0.00 N ATOM 1173 CA ALA A 72 8.423 1.633 5.665 1.00 0.00 C ATOM 1174 C ALA A 72 7.231 2.457 6.112 1.00 0.00 C ATOM 1175 O ALA A 72 6.101 1.987 6.078 1.00 0.00 O ATOM 1176 CB ALA A 72 9.161 1.052 6.864 1.00 0.00 C ATOM 0 H ALA A 72 10.286 2.439 5.186 1.00 0.00 H new ATOM 0 HA ALA A 72 8.058 0.805 5.057 1.00 0.00 H new ATOM 0 HB1 ALA A 72 8.474 0.448 7.457 1.00 0.00 H new ATOM 0 HB2 ALA A 72 9.985 0.428 6.517 1.00 0.00 H new ATOM 0 HB3 ALA A 72 9.553 1.863 7.478 1.00 0.00 H new ATOM 1182 N ALA A 73 7.501 3.695 6.493 1.00 0.00 N ATOM 1183 CA ALA A 73 6.472 4.633 6.906 1.00 0.00 C ATOM 1184 C ALA A 73 5.433 4.841 5.806 1.00 0.00 C ATOM 1185 O ALA A 73 4.231 4.753 6.052 1.00 0.00 O ATOM 1186 CB ALA A 73 7.123 5.955 7.279 1.00 0.00 C ATOM 0 H ALA A 73 8.446 4.079 6.524 1.00 0.00 H new ATOM 0 HA ALA A 73 5.952 4.223 7.771 1.00 0.00 H new ATOM 0 HB1 ALA A 73 6.355 6.664 7.590 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.824 5.797 8.098 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.657 6.354 6.416 1.00 0.00 H new ATOM 1192 N ASP A 74 5.902 5.095 4.591 1.00 0.00 N ATOM 1193 CA ASP A 74 5.023 5.386 3.472 1.00 0.00 C ATOM 1194 C ASP A 74 4.271 4.142 2.997 1.00 0.00 C ATOM 1195 O ASP A 74 3.067 4.201 2.740 1.00 0.00 O ATOM 1196 CB ASP A 74 5.834 5.990 2.329 1.00 0.00 C ATOM 1197 CG ASP A 74 5.825 7.509 2.340 1.00 0.00 C ATOM 1198 OD1 ASP A 74 6.501 8.107 3.205 1.00 0.00 O ATOM 1199 OD2 ASP A 74 5.145 8.117 1.484 1.00 0.00 O ATOM 0 H ASP A 74 6.895 5.105 4.357 1.00 0.00 H new ATOM 0 HA ASP A 74 4.274 6.104 3.808 1.00 0.00 H new ATOM 0 HB2 ASP A 74 6.863 5.637 2.393 1.00 0.00 H new ATOM 0 HB3 ASP A 74 5.434 5.636 1.379 1.00 0.00 H new ATOM 1204 N VAL A 75 4.968 3.012 2.897 1.00 0.00 N ATOM 1205 CA VAL A 75 4.337 1.779 2.430 1.00 0.00 C ATOM 1206 C VAL A 75 3.307 1.276 3.442 1.00 0.00 C ATOM 1207 O VAL A 75 2.211 0.849 3.067 1.00 0.00 O ATOM 1208 CB VAL A 75 5.373 0.667 2.114 1.00 0.00 C ATOM 1209 CG1 VAL A 75 6.379 0.504 3.233 1.00 0.00 C ATOM 1210 CG2 VAL A 75 4.695 -0.665 1.840 1.00 0.00 C ATOM 0 H VAL A 75 5.957 2.924 3.130 1.00 0.00 H new ATOM 0 HA VAL A 75 3.827 2.021 1.498 1.00 0.00 H new ATOM 0 HB VAL A 75 5.902 0.983 1.215 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.087 -0.283 2.974 1.00 0.00 H new ATOM 0 HG12 VAL A 75 6.916 1.441 3.379 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.860 0.237 4.153 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.451 -1.420 1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.121 -0.968 2.716 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.027 -0.564 0.985 1.00 0.00 H new ATOM 1220 N ARG A 76 3.637 1.357 4.726 1.00 0.00 N ATOM 1221 CA ARG A 76 2.713 0.912 5.755 1.00 0.00 C ATOM 1222 C ARG A 76 1.534 1.876 5.856 1.00 0.00 C ATOM 1223 O ARG A 76 0.430 1.474 6.210 1.00 0.00 O ATOM 1224 CB ARG A 76 3.412 0.760 7.111 1.00 0.00 C ATOM 1225 CG ARG A 76 3.789 2.080 7.772 1.00 0.00 C ATOM 1226 CD ARG A 76 4.411 1.878 9.145 1.00 0.00 C ATOM 1227 NE ARG A 76 5.388 0.785 9.170 1.00 0.00 N ATOM 1228 CZ ARG A 76 6.447 0.749 9.982 1.00 0.00 C ATOM 1229 NH1 ARG A 76 6.716 1.777 10.777 1.00 0.00 N ATOM 1230 NH2 ARG A 76 7.241 -0.315 9.990 1.00 0.00 N ATOM 0 H ARG A 76 4.524 1.721 5.073 1.00 0.00 H new ATOM 0 HA ARG A 76 2.338 -0.071 5.471 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.759 0.204 7.783 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.314 0.163 6.977 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.490 2.617 7.133 1.00 0.00 H new ATOM 0 HG3 ARG A 76 2.900 2.704 7.866 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.898 2.802 9.458 1.00 0.00 H new ATOM 0 HD3 ARG A 76 3.623 1.672 9.869 1.00 0.00 H new ATOM 0 HE ARG A 76 5.250 0.005 8.528 1.00 0.00 H new ATOM 0 HH11 ARG A 76 6.112 2.599 10.769 1.00 0.00 H new ATOM 0 HH12 ARG A 76 7.526 1.745 11.396 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.042 -1.105 9.376 1.00 0.00 H new ATOM 0 HH22 ARG A 76 8.050 -0.343 10.610 1.00 0.00 H new ATOM 1244 N LEU A 77 1.769 3.146 5.520 1.00 0.00 N ATOM 1245 CA LEU A 77 0.705 4.141 5.485 1.00 0.00 C ATOM 1246 C LEU A 77 -0.319 3.774 4.420 1.00 0.00 C ATOM 1247 O LEU A 77 -1.512 4.043 4.568 1.00 0.00 O ATOM 1248 CB LEU A 77 1.281 5.528 5.198 1.00 0.00 C ATOM 1249 CG LEU A 77 0.962 6.599 6.241 1.00 0.00 C ATOM 1250 CD1 LEU A 77 1.504 7.938 5.789 1.00 0.00 C ATOM 1251 CD2 LEU A 77 -0.537 6.675 6.492 1.00 0.00 C ATOM 0 H LEU A 77 2.690 3.506 5.269 1.00 0.00 H new ATOM 0 HA LEU A 77 0.215 4.160 6.459 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.364 5.442 5.110 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.908 5.865 4.231 1.00 0.00 H new ATOM 0 HG LEU A 77 1.444 6.330 7.181 1.00 0.00 H new ATOM 0 HD11 LEU A 77 1.273 8.696 6.538 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.585 7.870 5.664 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.046 8.214 4.839 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.743 7.443 7.237 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.049 6.925 5.563 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -0.894 5.712 6.856 1.00 0.00 H new ATOM 1263 N MET A 78 0.159 3.155 3.349 1.00 0.00 N ATOM 1264 CA MET A 78 -0.716 2.661 2.299 1.00 0.00 C ATOM 1265 C MET A 78 -1.636 1.567 2.844 1.00 0.00 C ATOM 1266 O MET A 78 -2.855 1.647 2.700 1.00 0.00 O ATOM 1267 CB MET A 78 0.108 2.168 1.104 1.00 0.00 C ATOM 1268 CG MET A 78 -0.700 1.404 0.068 1.00 0.00 C ATOM 1269 SD MET A 78 -0.715 -0.367 0.393 1.00 0.00 S ATOM 1270 CE MET A 78 0.975 -0.804 -0.019 1.00 0.00 C ATOM 0 H MET A 78 1.151 2.984 3.186 1.00 0.00 H new ATOM 0 HA MET A 78 -1.347 3.478 1.948 1.00 0.00 H new ATOM 0 HB2 MET A 78 0.579 3.025 0.622 1.00 0.00 H new ATOM 0 HB3 MET A 78 0.910 1.527 1.469 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.723 1.779 0.058 1.00 0.00 H new ATOM 0 HG3 MET A 78 -0.284 1.587 -0.923 1.00 0.00 H new ATOM 0 HE1 MET A 78 0.976 -1.680 -0.668 1.00 0.00 H new ATOM 0 HE2 MET A 78 1.451 0.030 -0.534 1.00 0.00 H new ATOM 0 HE3 MET A 78 1.526 -1.028 0.894 1.00 0.00 H new ATOM 1280 N PHE A 79 -1.059 0.562 3.494 1.00 0.00 N ATOM 1281 CA PHE A 79 -1.866 -0.482 4.127 1.00 0.00 C ATOM 1282 C PHE A 79 -2.778 0.117 5.205 1.00 0.00 C ATOM 1283 O PHE A 79 -3.909 -0.337 5.405 1.00 0.00 O ATOM 1284 CB PHE A 79 -0.983 -1.576 4.742 1.00 0.00 C ATOM 1285 CG PHE A 79 -0.112 -2.300 3.750 1.00 0.00 C ATOM 1286 CD1 PHE A 79 -0.669 -3.009 2.698 1.00 0.00 C ATOM 1287 CD2 PHE A 79 1.265 -2.277 3.880 1.00 0.00 C ATOM 1288 CE1 PHE A 79 0.134 -3.678 1.790 1.00 0.00 C ATOM 1289 CE2 PHE A 79 2.073 -2.942 2.980 1.00 0.00 C ATOM 1290 CZ PHE A 79 1.514 -3.643 1.932 1.00 0.00 C ATOM 0 H PHE A 79 -0.051 0.446 3.597 1.00 0.00 H new ATOM 0 HA PHE A 79 -2.482 -0.935 3.350 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -0.348 -1.127 5.506 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.622 -2.302 5.245 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.743 -3.040 2.585 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.714 -1.731 4.697 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.312 -4.226 0.973 1.00 0.00 H new ATOM 0 HE2 PHE A 79 3.146 -2.913 3.097 1.00 0.00 H new ATOM 0 HZ PHE A 79 2.146 -4.161 1.226 1.00 0.00 H new ATOM 1300 N SER A 80 -2.289 1.153 5.883 1.00 0.00 N ATOM 1301 CA SER A 80 -3.043 1.799 6.949 1.00 0.00 C ATOM 1302 C SER A 80 -4.299 2.486 6.416 1.00 0.00 C ATOM 1303 O SER A 80 -5.375 2.340 6.998 1.00 0.00 O ATOM 1304 CB SER A 80 -2.165 2.807 7.695 1.00 0.00 C ATOM 1305 OG SER A 80 -1.034 2.171 8.268 1.00 0.00 O ATOM 0 H SER A 80 -1.371 1.562 5.711 1.00 0.00 H new ATOM 0 HA SER A 80 -3.358 1.021 7.644 1.00 0.00 H new ATOM 0 HB2 SER A 80 -1.838 3.588 7.008 1.00 0.00 H new ATOM 0 HB3 SER A 80 -2.748 3.293 8.477 1.00 0.00 H new ATOM 0 HG SER A 80 -0.414 1.903 7.558 1.00 0.00 H new ATOM 1311 N ASN A 81 -4.183 3.225 5.308 1.00 0.00 N ATOM 1312 CA ASN A 81 -5.350 3.922 4.771 1.00 0.00 C ATOM 1313 C ASN A 81 -6.388 2.916 4.270 1.00 0.00 C ATOM 1314 O ASN A 81 -7.590 3.177 4.328 1.00 0.00 O ATOM 1315 CB ASN A 81 -4.995 4.956 3.676 1.00 0.00 C ATOM 1316 CG ASN A 81 -4.511 4.357 2.370 1.00 0.00 C ATOM 1317 OD1 ASN A 81 -5.304 3.917 1.544 1.00 0.00 O ATOM 1318 ND2 ASN A 81 -3.209 4.396 2.147 1.00 0.00 N ATOM 0 H ASN A 81 -3.319 3.353 4.781 1.00 0.00 H new ATOM 0 HA ASN A 81 -5.780 4.495 5.592 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -5.874 5.568 3.475 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -4.224 5.623 4.062 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -2.832 4.053 1.263 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -2.581 4.769 2.858 1.00 0.00 H new ATOM 1325 N CYS A 82 -5.924 1.750 3.824 1.00 0.00 N ATOM 1326 CA CYS A 82 -6.825 0.672 3.421 1.00 0.00 C ATOM 1327 C CYS A 82 -7.712 0.239 4.588 1.00 0.00 C ATOM 1328 O CYS A 82 -8.923 0.059 4.421 1.00 0.00 O ATOM 1329 CB CYS A 82 -6.034 -0.538 2.911 1.00 0.00 C ATOM 1330 SG CYS A 82 -4.899 -0.172 1.553 1.00 0.00 S ATOM 0 H CYS A 82 -4.933 1.528 3.733 1.00 0.00 H new ATOM 0 HA CYS A 82 -7.454 1.054 2.616 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -5.465 -0.960 3.740 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -6.737 -1.304 2.584 1.00 0.00 H new ATOM 0 HG CYS A 82 -4.179 0.867 1.857 1.00 0.00 H new ATOM 1336 N TYR A 83 -7.110 0.080 5.771 1.00 0.00 N ATOM 1337 CA TYR A 83 -7.862 -0.339 6.953 1.00 0.00 C ATOM 1338 C TYR A 83 -8.774 0.771 7.456 1.00 0.00 C ATOM 1339 O TYR A 83 -9.763 0.503 8.132 1.00 0.00 O ATOM 1340 CB TYR A 83 -6.940 -0.767 8.098 1.00 0.00 C ATOM 1341 CG TYR A 83 -6.125 -2.017 7.825 1.00 0.00 C ATOM 1342 CD1 TYR A 83 -6.679 -3.089 7.137 1.00 0.00 C ATOM 1343 CD2 TYR A 83 -4.806 -2.138 8.275 1.00 0.00 C ATOM 1344 CE1 TYR A 83 -5.954 -4.239 6.901 1.00 0.00 C ATOM 1345 CE2 TYR A 83 -4.079 -3.286 8.039 1.00 0.00 C ATOM 1346 CZ TYR A 83 -4.655 -4.331 7.355 1.00 0.00 C ATOM 1347 OH TYR A 83 -3.928 -5.474 7.125 1.00 0.00 O ATOM 0 H TYR A 83 -6.115 0.234 5.933 1.00 0.00 H new ATOM 0 HA TYR A 83 -8.462 -1.193 6.640 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -6.258 0.053 8.322 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -7.544 -0.932 8.990 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.696 -3.021 6.780 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.351 -1.321 8.815 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -6.401 -5.062 6.364 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -3.061 -3.364 8.390 1.00 0.00 H new ATOM 0 HH TYR A 83 -3.223 -5.287 6.471 1.00 0.00 H new ATOM 1357 N LYS A 84 -8.437 2.015 7.142 1.00 0.00 N ATOM 1358 CA LYS A 84 -9.289 3.141 7.507 1.00 0.00 C ATOM 1359 C LYS A 84 -10.615 3.050 6.786 1.00 0.00 C ATOM 1360 O LYS A 84 -11.684 3.224 7.378 1.00 0.00 O ATOM 1361 CB LYS A 84 -8.647 4.473 7.128 1.00 0.00 C ATOM 1362 CG LYS A 84 -7.453 4.870 7.975 1.00 0.00 C ATOM 1363 CD LYS A 84 -7.770 6.106 8.801 1.00 0.00 C ATOM 1364 CE LYS A 84 -8.108 7.301 7.917 1.00 0.00 C ATOM 1365 NZ LYS A 84 -8.617 8.453 8.707 1.00 0.00 N ATOM 0 H LYS A 84 -7.587 2.270 6.639 1.00 0.00 H new ATOM 0 HA LYS A 84 -9.431 3.096 8.587 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -8.334 4.425 6.085 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -9.401 5.257 7.199 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -7.178 4.046 8.634 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -6.594 5.065 7.333 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -8.608 5.895 9.465 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -6.916 6.350 9.433 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -7.219 7.605 7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -8.857 7.007 7.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -9.170 9.080 8.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -9.222 8.105 9.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -7.815 8.981 9.107 1.00 0.00 H new ATOM 1379 N TYR A 85 -10.524 2.775 5.498 1.00 0.00 N ATOM 1380 CA TYR A 85 -11.672 2.826 4.628 1.00 0.00 C ATOM 1381 C TYR A 85 -12.518 1.569 4.736 1.00 0.00 C ATOM 1382 O TYR A 85 -13.689 1.619 5.113 1.00 0.00 O ATOM 1383 CB TYR A 85 -11.226 3.011 3.181 1.00 0.00 C ATOM 1384 CG TYR A 85 -12.392 3.278 2.259 1.00 0.00 C ATOM 1385 CD1 TYR A 85 -13.032 4.498 2.334 1.00 0.00 C ATOM 1386 CD2 TYR A 85 -12.869 2.336 1.347 1.00 0.00 C ATOM 1387 CE1 TYR A 85 -14.112 4.793 1.534 1.00 0.00 C ATOM 1388 CE2 TYR A 85 -13.951 2.623 0.538 1.00 0.00 C ATOM 1389 CZ TYR A 85 -14.569 3.854 0.637 1.00 0.00 C ATOM 1390 OH TYR A 85 -15.646 4.150 -0.164 1.00 0.00 O ATOM 0 H TYR A 85 -9.655 2.512 5.033 1.00 0.00 H new ATOM 0 HA TYR A 85 -12.280 3.674 4.941 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -10.520 3.840 3.122 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -10.697 2.118 2.848 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -12.677 5.238 3.036 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.387 1.372 1.273 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -14.598 5.755 1.609 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.312 1.889 -0.168 1.00 0.00 H new ATOM 0 HH TYR A 85 -15.959 5.058 0.031 1.00 0.00 H new ATOM 1400 N ASN A 86 -11.908 0.443 4.414 1.00 0.00 N ATOM 1401 CA ASN A 86 -12.636 -0.805 4.278 1.00 0.00 C ATOM 1402 C ASN A 86 -12.779 -1.494 5.621 1.00 0.00 C ATOM 1403 O ASN A 86 -11.796 -1.673 6.343 1.00 0.00 O ATOM 1404 CB ASN A 86 -11.921 -1.737 3.297 1.00 0.00 C ATOM 1405 CG ASN A 86 -11.719 -1.109 1.936 1.00 0.00 C ATOM 1406 OD1 ASN A 86 -12.561 -1.244 1.047 1.00 0.00 O ATOM 1407 ND2 ASN A 86 -10.595 -0.431 1.762 1.00 0.00 N ATOM 0 H ASN A 86 -10.906 0.367 4.241 1.00 0.00 H new ATOM 0 HA ASN A 86 -13.629 -0.574 3.893 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -10.952 -2.018 3.710 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -12.499 -2.654 3.187 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -10.397 0.006 0.862 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -9.927 -0.346 2.528 1.00 0.00 H new ATOM 1414 N PRO A 87 -14.011 -1.869 5.985 1.00 0.00 N ATOM 1415 CA PRO A 87 -14.269 -2.637 7.201 1.00 0.00 C ATOM 1416 C PRO A 87 -13.650 -4.029 7.109 1.00 0.00 C ATOM 1417 O PRO A 87 -13.389 -4.530 6.012 1.00 0.00 O ATOM 1418 CB PRO A 87 -15.799 -2.723 7.260 1.00 0.00 C ATOM 1419 CG PRO A 87 -16.261 -2.484 5.866 1.00 0.00 C ATOM 1420 CD PRO A 87 -15.248 -1.571 5.240 1.00 0.00 C ATOM 0 HA PRO A 87 -13.837 -2.177 8.089 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -16.124 -3.699 7.620 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -16.209 -1.979 7.943 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -16.334 -3.421 5.314 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -17.252 -2.030 5.857 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -15.133 -1.769 4.174 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -15.535 -0.524 5.340 1.00 0.00 H new ATOM 1428 N PRO A 88 -13.405 -4.659 8.279 1.00 0.00 N ATOM 1429 CA PRO A 88 -12.695 -5.947 8.395 1.00 0.00 C ATOM 1430 C PRO A 88 -13.278 -7.053 7.523 1.00 0.00 C ATOM 1431 O PRO A 88 -12.611 -8.048 7.241 1.00 0.00 O ATOM 1432 CB PRO A 88 -12.852 -6.324 9.874 1.00 0.00 C ATOM 1433 CG PRO A 88 -13.892 -5.405 10.416 1.00 0.00 C ATOM 1434 CD PRO A 88 -13.797 -4.153 9.601 1.00 0.00 C ATOM 0 HA PRO A 88 -11.663 -5.842 8.060 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -13.155 -7.365 9.983 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -11.910 -6.208 10.410 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -14.885 -5.848 10.337 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -13.719 -5.198 11.472 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -14.747 -3.620 9.565 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -13.058 -3.461 10.006 1.00 0.00 H new ATOM 1442 N ASP A 89 -14.522 -6.882 7.112 1.00 0.00 N ATOM 1443 CA ASP A 89 -15.175 -7.856 6.242 1.00 0.00 C ATOM 1444 C ASP A 89 -15.165 -7.348 4.803 1.00 0.00 C ATOM 1445 O ASP A 89 -16.202 -6.989 4.244 1.00 0.00 O ATOM 1446 CB ASP A 89 -16.619 -8.140 6.703 1.00 0.00 C ATOM 1447 CG ASP A 89 -17.245 -9.313 5.972 1.00 0.00 C ATOM 1448 OD1 ASP A 89 -18.115 -9.092 5.104 1.00 0.00 O ATOM 1449 OD2 ASP A 89 -16.877 -10.469 6.271 1.00 0.00 O ATOM 0 H ASP A 89 -15.102 -6.082 7.363 1.00 0.00 H new ATOM 0 HA ASP A 89 -14.621 -8.793 6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -16.621 -8.341 7.774 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -17.229 -7.251 6.544 1.00 0.00 H new ATOM 1454 N HIS A 90 -13.978 -7.291 4.209 1.00 0.00 N ATOM 1455 CA HIS A 90 -13.842 -6.837 2.833 1.00 0.00 C ATOM 1456 C HIS A 90 -12.580 -7.426 2.200 1.00 0.00 C ATOM 1457 O HIS A 90 -11.641 -7.790 2.903 1.00 0.00 O ATOM 1458 CB HIS A 90 -13.785 -5.304 2.763 1.00 0.00 C ATOM 1459 CG HIS A 90 -14.468 -4.727 1.546 1.00 0.00 C ATOM 1460 ND1 HIS A 90 -13.825 -4.584 0.336 1.00 0.00 N ATOM 1461 CD2 HIS A 90 -15.739 -4.269 1.340 1.00 0.00 C ATOM 1462 CE1 HIS A 90 -14.656 -4.073 -0.549 1.00 0.00 C ATOM 1463 NE2 HIS A 90 -15.821 -3.874 0.030 1.00 0.00 N ATOM 0 H HIS A 90 -13.100 -7.553 4.658 1.00 0.00 H new ATOM 0 HA HIS A 90 -14.716 -7.180 2.280 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -14.248 -4.891 3.659 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -12.742 -4.987 2.768 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -16.531 -4.226 2.073 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -14.420 -3.853 -1.580 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -16.650 -3.489 -0.422 1.00 0.00 H new ATOM 1472 N ASP A 91 -12.556 -7.508 0.879 1.00 0.00 N ATOM 1473 CA ASP A 91 -11.410 -8.070 0.159 1.00 0.00 C ATOM 1474 C ASP A 91 -10.126 -7.277 0.391 1.00 0.00 C ATOM 1475 O ASP A 91 -9.065 -7.855 0.617 1.00 0.00 O ATOM 1476 CB ASP A 91 -11.697 -8.128 -1.344 1.00 0.00 C ATOM 1477 CG ASP A 91 -12.656 -9.239 -1.718 1.00 0.00 C ATOM 1478 OD1 ASP A 91 -12.239 -10.172 -2.440 1.00 0.00 O ATOM 1479 OD2 ASP A 91 -13.824 -9.194 -1.280 1.00 0.00 O ATOM 0 H ASP A 91 -13.317 -7.193 0.277 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.261 -9.076 0.552 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.112 -7.173 -1.667 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.760 -8.267 -1.883 1.00 0.00 H new ATOM 1484 N VAL A 92 -10.227 -5.953 0.360 1.00 0.00 N ATOM 1485 CA VAL A 92 -9.037 -5.103 0.360 1.00 0.00 C ATOM 1486 C VAL A 92 -8.305 -5.152 1.698 1.00 0.00 C ATOM 1487 O VAL A 92 -7.114 -4.875 1.757 1.00 0.00 O ATOM 1488 CB VAL A 92 -9.352 -3.634 -0.010 1.00 0.00 C ATOM 1489 CG1 VAL A 92 -8.361 -3.120 -1.039 1.00 0.00 C ATOM 1490 CG2 VAL A 92 -10.766 -3.491 -0.537 1.00 0.00 C ATOM 0 H VAL A 92 -11.112 -5.446 0.335 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.385 -5.510 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 92 -9.264 -3.038 0.898 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -8.598 -2.085 -1.287 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -7.352 -3.173 -0.631 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -8.421 -3.732 -1.939 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -10.957 -2.448 -0.788 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -10.886 -4.107 -1.428 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -11.473 -3.816 0.226 1.00 0.00 H new ATOM 1500 N VAL A 93 -9.002 -5.528 2.766 1.00 0.00 N ATOM 1501 CA VAL A 93 -8.351 -5.652 4.064 1.00 0.00 C ATOM 1502 C VAL A 93 -7.650 -7.003 4.172 1.00 0.00 C ATOM 1503 O VAL A 93 -6.565 -7.107 4.734 1.00 0.00 O ATOM 1504 CB VAL A 93 -9.331 -5.468 5.251 1.00 0.00 C ATOM 1505 CG1 VAL A 93 -10.041 -4.132 5.148 1.00 0.00 C ATOM 1506 CG2 VAL A 93 -10.347 -6.594 5.324 1.00 0.00 C ATOM 0 H VAL A 93 -9.998 -5.748 2.760 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.619 -4.847 4.128 1.00 0.00 H new ATOM 0 HB VAL A 93 -8.742 -5.492 6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -10.725 -4.018 5.989 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -9.306 -3.327 5.167 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -10.602 -4.089 4.215 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -11.015 -6.427 6.169 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.928 -6.620 4.402 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -9.829 -7.544 5.453 1.00 0.00 H new ATOM 1516 N ALA A 94 -8.265 -8.031 3.597 1.00 0.00 N ATOM 1517 CA ALA A 94 -7.682 -9.364 3.589 1.00 0.00 C ATOM 1518 C ALA A 94 -6.439 -9.395 2.707 1.00 0.00 C ATOM 1519 O ALA A 94 -5.437 -10.028 3.049 1.00 0.00 O ATOM 1520 CB ALA A 94 -8.706 -10.385 3.120 1.00 0.00 C ATOM 0 H ALA A 94 -9.169 -7.964 3.130 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.384 -9.622 4.605 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -8.256 -11.378 3.119 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -9.563 -10.376 3.793 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -9.034 -10.134 2.111 1.00 0.00 H new ATOM 1526 N MET A 95 -6.508 -8.698 1.577 1.00 0.00 N ATOM 1527 CA MET A 95 -5.357 -8.563 0.693 1.00 0.00 C ATOM 1528 C MET A 95 -4.276 -7.717 1.362 1.00 0.00 C ATOM 1529 O MET A 95 -3.085 -8.002 1.226 1.00 0.00 O ATOM 1530 CB MET A 95 -5.761 -7.951 -0.659 1.00 0.00 C ATOM 1531 CG MET A 95 -6.658 -8.854 -1.507 1.00 0.00 C ATOM 1532 SD MET A 95 -6.899 -8.232 -3.187 1.00 0.00 S ATOM 1533 CE MET A 95 -8.363 -7.217 -2.998 1.00 0.00 C ATOM 0 H MET A 95 -7.348 -8.219 1.253 1.00 0.00 H new ATOM 0 HA MET A 95 -4.958 -9.559 0.501 1.00 0.00 H new ATOM 0 HB2 MET A 95 -6.278 -7.008 -0.480 1.00 0.00 H new ATOM 0 HB3 MET A 95 -4.859 -7.718 -1.225 1.00 0.00 H new ATOM 0 HG2 MET A 95 -6.220 -9.851 -1.554 1.00 0.00 H new ATOM 0 HG3 MET A 95 -7.628 -8.954 -1.020 1.00 0.00 H new ATOM 0 HE1 MET A 95 -9.207 -7.701 -3.489 1.00 0.00 H new ATOM 0 HE2 MET A 95 -8.583 -7.090 -1.938 1.00 0.00 H new ATOM 0 HE3 MET A 95 -8.190 -6.241 -3.452 1.00 0.00 H new ATOM 1543 N ALA A 96 -4.698 -6.698 2.113 1.00 0.00 N ATOM 1544 CA ALA A 96 -3.763 -5.836 2.832 1.00 0.00 C ATOM 1545 C ALA A 96 -3.040 -6.617 3.922 1.00 0.00 C ATOM 1546 O ALA A 96 -1.840 -6.453 4.113 1.00 0.00 O ATOM 1547 CB ALA A 96 -4.480 -4.641 3.434 1.00 0.00 C ATOM 0 H ALA A 96 -5.680 -6.451 2.238 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.026 -5.472 2.116 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.762 -4.015 3.964 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.951 -4.061 2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -5.243 -4.988 4.131 1.00 0.00 H new ATOM 1553 N ARG A 97 -3.776 -7.469 4.630 1.00 0.00 N ATOM 1554 CA ARG A 97 -3.195 -8.288 5.691 1.00 0.00 C ATOM 1555 C ARG A 97 -2.123 -9.221 5.143 1.00 0.00 C ATOM 1556 O ARG A 97 -1.042 -9.346 5.720 1.00 0.00 O ATOM 1557 CB ARG A 97 -4.267 -9.115 6.399 1.00 0.00 C ATOM 1558 CG ARG A 97 -5.246 -8.283 7.208 1.00 0.00 C ATOM 1559 CD ARG A 97 -6.180 -9.158 8.020 1.00 0.00 C ATOM 1560 NE ARG A 97 -5.464 -9.917 9.042 1.00 0.00 N ATOM 1561 CZ ARG A 97 -5.912 -11.044 9.587 1.00 0.00 C ATOM 1562 NH1 ARG A 97 -7.077 -11.555 9.209 1.00 0.00 N ATOM 1563 NH2 ARG A 97 -5.193 -11.656 10.516 1.00 0.00 N ATOM 0 H ARG A 97 -4.776 -7.611 4.489 1.00 0.00 H new ATOM 0 HA ARG A 97 -2.740 -7.605 6.408 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -4.820 -9.689 5.656 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -3.782 -9.833 7.060 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -4.696 -7.619 7.875 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.829 -7.651 6.538 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -6.939 -8.536 8.495 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -6.702 -9.847 7.355 1.00 0.00 H new ATOM 0 HE ARG A 97 -4.562 -9.560 9.358 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -7.634 -11.083 8.497 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -7.415 -12.420 9.631 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -4.299 -11.262 10.811 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -5.533 -12.521 10.937 1.00 0.00 H new ATOM 1577 N LYS A 98 -2.430 -9.870 4.029 1.00 0.00 N ATOM 1578 CA LYS A 98 -1.512 -10.829 3.429 1.00 0.00 C ATOM 1579 C LYS A 98 -0.272 -10.123 2.883 1.00 0.00 C ATOM 1580 O LYS A 98 0.855 -10.516 3.176 1.00 0.00 O ATOM 1581 CB LYS A 98 -2.214 -11.617 2.321 1.00 0.00 C ATOM 1582 CG LYS A 98 -1.371 -12.750 1.767 1.00 0.00 C ATOM 1583 CD LYS A 98 -2.068 -13.473 0.631 1.00 0.00 C ATOM 1584 CE LYS A 98 -1.165 -14.531 0.030 1.00 0.00 C ATOM 1585 NZ LYS A 98 -0.647 -15.473 1.059 1.00 0.00 N ATOM 0 H LYS A 98 -3.307 -9.750 3.522 1.00 0.00 H new ATOM 0 HA LYS A 98 -1.192 -11.528 4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -3.148 -12.024 2.709 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -2.475 -10.937 1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -0.418 -12.354 1.415 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -1.147 -13.459 2.564 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -2.984 -13.936 0.997 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -2.358 -12.757 -0.138 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.715 -15.089 -0.728 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -0.328 -14.049 -0.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.206 -16.290 0.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 0.060 -14.989 1.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -1.432 -15.799 1.658 1.00 0.00 H new ATOM 1599 N LEU A 99 -0.485 -9.080 2.092 1.00 0.00 N ATOM 1600 CA LEU A 99 0.613 -8.259 1.594 1.00 0.00 C ATOM 1601 C LEU A 99 1.398 -7.609 2.734 1.00 0.00 C ATOM 1602 O LEU A 99 2.588 -7.326 2.592 1.00 0.00 O ATOM 1603 CB LEU A 99 0.101 -7.172 0.651 1.00 0.00 C ATOM 1604 CG LEU A 99 0.217 -7.438 -0.857 1.00 0.00 C ATOM 1605 CD1 LEU A 99 0.777 -6.211 -1.529 1.00 0.00 C ATOM 1606 CD2 LEU A 99 1.111 -8.622 -1.179 1.00 0.00 C ATOM 0 H LEU A 99 -1.409 -8.781 1.780 1.00 0.00 H new ATOM 0 HA LEU A 99 1.281 -8.926 1.048 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -0.949 -6.992 0.882 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.639 -6.251 0.874 1.00 0.00 H new ATOM 0 HG LEU A 99 -0.783 -7.672 -1.223 1.00 0.00 H new ATOM 0 HD11 LEU A 99 0.863 -6.390 -2.601 1.00 0.00 H new ATOM 0 HD12 LEU A 99 0.112 -5.365 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 99 1.762 -5.989 -1.118 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.155 -8.762 -2.259 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.114 -8.435 -0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.707 -9.521 -0.713 1.00 0.00 H new ATOM 1618 N GLN A 100 0.741 -7.358 3.858 1.00 0.00 N ATOM 1619 CA GLN A 100 1.435 -6.822 5.019 1.00 0.00 C ATOM 1620 C GLN A 100 2.398 -7.863 5.564 1.00 0.00 C ATOM 1621 O GLN A 100 3.481 -7.528 6.027 1.00 0.00 O ATOM 1622 CB GLN A 100 0.443 -6.389 6.116 1.00 0.00 C ATOM 1623 CG GLN A 100 1.100 -5.876 7.398 1.00 0.00 C ATOM 1624 CD GLN A 100 0.100 -5.602 8.504 1.00 0.00 C ATOM 1625 OE1 GLN A 100 0.413 -5.746 9.685 1.00 0.00 O ATOM 1626 NE2 GLN A 100 -1.104 -5.200 8.137 1.00 0.00 N ATOM 0 H GLN A 100 -0.258 -7.515 3.990 1.00 0.00 H new ATOM 0 HA GLN A 100 1.992 -5.938 4.707 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -0.203 -5.608 5.716 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -0.197 -7.236 6.364 1.00 0.00 H new ATOM 0 HG2 GLN A 100 1.827 -6.609 7.746 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.650 -4.961 7.178 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -1.326 -5.092 7.147 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -1.811 -4.997 8.843 1.00 0.00 H new ATOM 1635 N ASP A 101 1.999 -9.126 5.481 1.00 0.00 N ATOM 1636 CA ASP A 101 2.824 -10.229 5.960 1.00 0.00 C ATOM 1637 C ASP A 101 4.137 -10.289 5.185 1.00 0.00 C ATOM 1638 O ASP A 101 5.214 -10.241 5.776 1.00 0.00 O ATOM 1639 CB ASP A 101 2.070 -11.555 5.827 1.00 0.00 C ATOM 1640 CG ASP A 101 2.789 -12.715 6.488 1.00 0.00 C ATOM 1641 OD1 ASP A 101 2.424 -13.068 7.633 1.00 0.00 O ATOM 1642 OD2 ASP A 101 3.702 -13.297 5.863 1.00 0.00 O ATOM 0 H ASP A 101 1.104 -9.413 5.084 1.00 0.00 H new ATOM 0 HA ASP A 101 3.049 -10.059 7.013 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.079 -11.449 6.269 1.00 0.00 H new ATOM 0 HB3 ASP A 101 1.925 -11.780 4.770 1.00 0.00 H new ATOM 1647 N VAL A 102 4.041 -10.366 3.858 1.00 0.00 N ATOM 1648 CA VAL A 102 5.232 -10.426 3.009 1.00 0.00 C ATOM 1649 C VAL A 102 6.136 -9.213 3.235 1.00 0.00 C ATOM 1650 O VAL A 102 7.320 -9.369 3.542 1.00 0.00 O ATOM 1651 CB VAL A 102 4.880 -10.555 1.501 1.00 0.00 C ATOM 1652 CG1 VAL A 102 3.782 -9.599 1.094 1.00 0.00 C ATOM 1653 CG2 VAL A 102 6.104 -10.326 0.634 1.00 0.00 C ATOM 0 H VAL A 102 3.157 -10.388 3.349 1.00 0.00 H new ATOM 0 HA VAL A 102 5.771 -11.327 3.300 1.00 0.00 H new ATOM 0 HB VAL A 102 4.520 -11.572 1.349 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.567 -9.722 0.033 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.883 -9.810 1.673 1.00 0.00 H new ATOM 0 HG13 VAL A 102 4.103 -8.575 1.283 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.829 -10.422 -0.416 1.00 0.00 H new ATOM 0 HG22 VAL A 102 6.497 -9.326 0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 102 6.867 -11.065 0.879 1.00 0.00 H new ATOM 1663 N PHE A 103 5.570 -8.018 3.107 1.00 0.00 N ATOM 1664 CA PHE A 103 6.321 -6.781 3.312 1.00 0.00 C ATOM 1665 C PHE A 103 6.962 -6.731 4.706 1.00 0.00 C ATOM 1666 O PHE A 103 8.091 -6.259 4.859 1.00 0.00 O ATOM 1667 CB PHE A 103 5.420 -5.558 3.073 1.00 0.00 C ATOM 1668 CG PHE A 103 5.857 -4.323 3.824 1.00 0.00 C ATOM 1669 CD1 PHE A 103 7.078 -3.729 3.543 1.00 0.00 C ATOM 1670 CD2 PHE A 103 5.060 -3.768 4.823 1.00 0.00 C ATOM 1671 CE1 PHE A 103 7.500 -2.615 4.238 1.00 0.00 C ATOM 1672 CE2 PHE A 103 5.479 -2.650 5.515 1.00 0.00 C ATOM 1673 CZ PHE A 103 6.700 -2.075 5.226 1.00 0.00 C ATOM 0 H PHE A 103 4.590 -7.878 2.861 1.00 0.00 H new ATOM 0 HA PHE A 103 7.132 -6.759 2.584 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.401 -5.335 2.006 1.00 0.00 H new ATOM 0 HB3 PHE A 103 4.400 -5.807 3.365 1.00 0.00 H new ATOM 0 HD1 PHE A 103 7.707 -4.144 2.770 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.106 -4.217 5.058 1.00 0.00 H new ATOM 0 HE1 PHE A 103 8.455 -2.165 4.010 1.00 0.00 H new ATOM 0 HE2 PHE A 103 4.851 -2.224 6.284 1.00 0.00 H new ATOM 0 HZ PHE A 103 7.030 -1.203 5.772 1.00 0.00 H new ATOM 1683 N GLU A 104 6.264 -7.255 5.707 1.00 0.00 N ATOM 1684 CA GLU A 104 6.734 -7.224 7.069 1.00 0.00 C ATOM 1685 C GLU A 104 8.024 -8.026 7.196 1.00 0.00 C ATOM 1686 O GLU A 104 9.011 -7.549 7.754 1.00 0.00 O ATOM 1687 CB GLU A 104 5.640 -7.791 7.975 1.00 0.00 C ATOM 1688 CG GLU A 104 6.114 -8.146 9.357 1.00 0.00 C ATOM 1689 CD GLU A 104 6.416 -6.931 10.213 1.00 0.00 C ATOM 1690 OE1 GLU A 104 7.540 -6.836 10.748 1.00 0.00 O ATOM 1691 OE2 GLU A 104 5.530 -6.056 10.346 1.00 0.00 O ATOM 0 H GLU A 104 5.359 -7.710 5.588 1.00 0.00 H new ATOM 0 HA GLU A 104 6.952 -6.199 7.370 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.834 -7.061 8.055 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.219 -8.681 7.506 1.00 0.00 H new ATOM 0 HG2 GLU A 104 5.354 -8.751 9.851 1.00 0.00 H new ATOM 0 HG3 GLU A 104 7.011 -8.761 9.280 1.00 0.00 H new ATOM 1698 N PHE A 105 8.025 -9.229 6.637 1.00 0.00 N ATOM 1699 CA PHE A 105 9.192 -10.093 6.709 1.00 0.00 C ATOM 1700 C PHE A 105 10.283 -9.637 5.744 1.00 0.00 C ATOM 1701 O PHE A 105 11.459 -9.930 5.953 1.00 0.00 O ATOM 1702 CB PHE A 105 8.807 -11.549 6.452 1.00 0.00 C ATOM 1703 CG PHE A 105 7.989 -12.141 7.563 1.00 0.00 C ATOM 1704 CD1 PHE A 105 6.611 -12.212 7.465 1.00 0.00 C ATOM 1705 CD2 PHE A 105 8.599 -12.616 8.712 1.00 0.00 C ATOM 1706 CE1 PHE A 105 5.856 -12.744 8.491 1.00 0.00 C ATOM 1707 CE2 PHE A 105 7.850 -13.151 9.739 1.00 0.00 C ATOM 1708 CZ PHE A 105 6.476 -13.215 9.629 1.00 0.00 C ATOM 0 H PHE A 105 7.233 -9.626 6.131 1.00 0.00 H new ATOM 0 HA PHE A 105 9.596 -10.022 7.719 1.00 0.00 H new ATOM 0 HB2 PHE A 105 8.245 -11.612 5.520 1.00 0.00 H new ATOM 0 HB3 PHE A 105 9.712 -12.141 6.319 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.120 -11.847 6.575 1.00 0.00 H new ATOM 0 HD2 PHE A 105 9.674 -12.567 8.805 1.00 0.00 H new ATOM 0 HE1 PHE A 105 4.781 -12.791 8.402 1.00 0.00 H new ATOM 0 HE2 PHE A 105 8.339 -13.520 10.629 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.888 -13.633 10.432 1.00 0.00 H new ATOM 1718 N ARG A 106 9.904 -8.906 4.700 1.00 0.00 N ATOM 1719 CA ARG A 106 10.884 -8.321 3.797 1.00 0.00 C ATOM 1720 C ARG A 106 11.695 -7.267 4.538 1.00 0.00 C ATOM 1721 O ARG A 106 12.924 -7.248 4.471 1.00 0.00 O ATOM 1722 CB ARG A 106 10.205 -7.692 2.577 1.00 0.00 C ATOM 1723 CG ARG A 106 9.597 -8.693 1.609 1.00 0.00 C ATOM 1724 CD ARG A 106 10.653 -9.616 1.025 1.00 0.00 C ATOM 1725 NE ARG A 106 10.084 -10.584 0.093 1.00 0.00 N ATOM 1726 CZ ARG A 106 10.716 -11.674 -0.339 1.00 0.00 C ATOM 1727 NH1 ARG A 106 11.933 -11.967 0.105 1.00 0.00 N ATOM 1728 NH2 ARG A 106 10.126 -12.469 -1.219 1.00 0.00 N ATOM 0 H ARG A 106 8.933 -8.707 4.461 1.00 0.00 H new ATOM 0 HA ARG A 106 11.544 -9.114 3.446 1.00 0.00 H new ATOM 0 HB2 ARG A 106 9.422 -7.016 2.921 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.936 -7.086 2.042 1.00 0.00 H new ATOM 0 HG2 ARG A 106 8.840 -9.285 2.124 1.00 0.00 H new ATOM 0 HG3 ARG A 106 9.092 -8.161 0.803 1.00 0.00 H new ATOM 0 HD2 ARG A 106 11.409 -9.022 0.512 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.158 -10.145 1.833 1.00 0.00 H new ATOM 0 HE ARG A 106 9.139 -10.415 -0.251 1.00 0.00 H new ATOM 0 HH11 ARG A 106 12.390 -11.356 0.781 1.00 0.00 H new ATOM 0 HH12 ARG A 106 12.411 -12.804 -0.230 1.00 0.00 H new ATOM 0 HH21 ARG A 106 9.192 -12.245 -1.563 1.00 0.00 H new ATOM 0 HH22 ARG A 106 10.606 -13.305 -1.553 1.00 0.00 H new ATOM 1742 N TYR A 107 10.995 -6.404 5.262 1.00 0.00 N ATOM 1743 CA TYR A 107 11.651 -5.378 6.064 1.00 0.00 C ATOM 1744 C TYR A 107 12.340 -6.013 7.273 1.00 0.00 C ATOM 1745 O TYR A 107 13.364 -5.522 7.745 1.00 0.00 O ATOM 1746 CB TYR A 107 10.645 -4.308 6.515 1.00 0.00 C ATOM 1747 CG TYR A 107 11.297 -3.085 7.126 1.00 0.00 C ATOM 1748 CD1 TYR A 107 11.610 -1.976 6.349 1.00 0.00 C ATOM 1749 CD2 TYR A 107 11.615 -3.047 8.477 1.00 0.00 C ATOM 1750 CE1 TYR A 107 12.222 -0.870 6.903 1.00 0.00 C ATOM 1751 CE2 TYR A 107 12.222 -1.941 9.036 1.00 0.00 C ATOM 1752 CZ TYR A 107 12.525 -0.856 8.244 1.00 0.00 C ATOM 1753 OH TYR A 107 13.141 0.243 8.794 1.00 0.00 O ATOM 0 H TYR A 107 9.976 -6.393 5.311 1.00 0.00 H new ATOM 0 HA TYR A 107 12.406 -4.890 5.448 1.00 0.00 H new ATOM 0 HB2 TYR A 107 10.045 -4.000 5.658 1.00 0.00 H new ATOM 0 HB3 TYR A 107 9.961 -4.747 7.242 1.00 0.00 H new ATOM 0 HD1 TYR A 107 11.371 -1.980 5.296 1.00 0.00 H new ATOM 0 HD2 TYR A 107 11.383 -3.898 9.101 1.00 0.00 H new ATOM 0 HE1 TYR A 107 12.462 -0.018 6.285 1.00 0.00 H new ATOM 0 HE2 TYR A 107 12.458 -1.926 10.090 1.00 0.00 H new ATOM 0 HH TYR A 107 12.545 0.657 9.452 1.00 0.00 H new ATOM 1763 N ALA A 108 11.782 -7.120 7.757 1.00 0.00 N ATOM 1764 CA ALA A 108 12.356 -7.833 8.892 1.00 0.00 C ATOM 1765 C ALA A 108 13.693 -8.466 8.525 1.00 0.00 C ATOM 1766 O ALA A 108 14.591 -8.565 9.360 1.00 0.00 O ATOM 1767 CB ALA A 108 11.394 -8.896 9.403 1.00 0.00 C ATOM 0 H ALA A 108 10.933 -7.542 7.380 1.00 0.00 H new ATOM 0 HA ALA A 108 12.529 -7.107 9.686 1.00 0.00 H new ATOM 0 HB1 ALA A 108 11.842 -9.416 10.250 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.464 -8.423 9.718 1.00 0.00 H new ATOM 0 HB3 ALA A 108 11.186 -9.611 8.607 1.00 0.00 H new ATOM 1773 N LYS A 109 13.825 -8.898 7.276 1.00 0.00 N ATOM 1774 CA LYS A 109 15.084 -9.463 6.809 1.00 0.00 C ATOM 1775 C LYS A 109 16.053 -8.349 6.456 1.00 0.00 C ATOM 1776 O LYS A 109 17.269 -8.527 6.509 1.00 0.00 O ATOM 1777 CB LYS A 109 14.877 -10.375 5.597 1.00 0.00 C ATOM 1778 CG LYS A 109 15.267 -11.827 5.857 1.00 0.00 C ATOM 1779 CD LYS A 109 14.327 -12.513 6.839 1.00 0.00 C ATOM 1780 CE LYS A 109 12.928 -12.678 6.260 1.00 0.00 C ATOM 1781 NZ LYS A 109 12.914 -13.592 5.087 1.00 0.00 N ATOM 0 H LYS A 109 13.084 -8.868 6.576 1.00 0.00 H new ATOM 0 HA LYS A 109 15.498 -10.067 7.617 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.830 -10.336 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 109 15.463 -9.994 4.760 1.00 0.00 H new ATOM 0 HG2 LYS A 109 15.267 -12.375 4.915 1.00 0.00 H new ATOM 0 HG3 LYS A 109 16.284 -11.863 6.246 1.00 0.00 H new ATOM 0 HD2 LYS A 109 14.729 -13.491 7.104 1.00 0.00 H new ATOM 0 HD3 LYS A 109 14.274 -11.930 7.759 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.261 -13.066 7.030 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.541 -11.703 5.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 11.933 -13.851 4.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.344 -13.114 4.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.456 -14.451 5.310 1.00 0.00 H new ATOM 1795 N MET A 110 15.501 -7.202 6.088 1.00 0.00 N ATOM 1796 CA MET A 110 16.300 -6.021 5.794 1.00 0.00 C ATOM 1797 C MET A 110 17.025 -5.545 7.049 1.00 0.00 C ATOM 1798 O MET A 110 16.388 -5.245 8.060 1.00 0.00 O ATOM 1799 CB MET A 110 15.409 -4.904 5.222 1.00 0.00 C ATOM 1800 CG MET A 110 16.082 -3.539 5.134 1.00 0.00 C ATOM 1801 SD MET A 110 15.884 -2.570 6.641 1.00 0.00 S ATOM 1802 CE MET A 110 16.673 -1.043 6.158 1.00 0.00 C ATOM 0 H MET A 110 14.496 -7.064 5.985 1.00 0.00 H new ATOM 0 HA MET A 110 17.048 -6.281 5.045 1.00 0.00 H new ATOM 0 HB2 MET A 110 15.077 -5.196 4.226 1.00 0.00 H new ATOM 0 HB3 MET A 110 14.517 -4.815 5.842 1.00 0.00 H new ATOM 0 HG2 MET A 110 17.144 -3.674 4.930 1.00 0.00 H new ATOM 0 HG3 MET A 110 15.664 -2.986 4.293 1.00 0.00 H new ATOM 0 HE1 MET A 110 16.379 -0.249 6.844 1.00 0.00 H new ATOM 0 HE2 MET A 110 17.755 -1.167 6.189 1.00 0.00 H new ATOM 0 HE3 MET A 110 16.367 -0.780 5.146 1.00 0.00 H new ATOM 1812 N PRO A 111 18.366 -5.503 7.019 1.00 0.00 N ATOM 1813 CA PRO A 111 19.150 -5.005 8.135 1.00 0.00 C ATOM 1814 C PRO A 111 19.298 -3.491 8.092 1.00 0.00 C ATOM 1815 O PRO A 111 19.380 -2.888 7.017 1.00 0.00 O ATOM 1816 CB PRO A 111 20.499 -5.686 7.949 1.00 0.00 C ATOM 1817 CG PRO A 111 20.623 -5.920 6.478 1.00 0.00 C ATOM 1818 CD PRO A 111 19.224 -5.944 5.904 1.00 0.00 C ATOM 0 HA PRO A 111 18.686 -5.219 9.098 1.00 0.00 H new ATOM 0 HB2 PRO A 111 21.311 -5.058 8.317 1.00 0.00 H new ATOM 0 HB3 PRO A 111 20.546 -6.624 8.502 1.00 0.00 H new ATOM 0 HG2 PRO A 111 21.215 -5.132 6.013 1.00 0.00 H new ATOM 0 HG3 PRO A 111 21.135 -6.862 6.281 1.00 0.00 H new ATOM 0 HD2 PRO A 111 19.135 -5.278 5.046 1.00 0.00 H new ATOM 0 HD3 PRO A 111 18.951 -6.943 5.563 1.00 0.00 H new ATOM 1826 N ASP A 112 19.330 -2.888 9.262 1.00 0.00 N ATOM 1827 CA ASP A 112 19.424 -1.444 9.378 1.00 0.00 C ATOM 1828 C ASP A 112 20.565 -1.076 10.308 1.00 0.00 C ATOM 1829 O ASP A 112 21.610 -0.607 9.814 1.00 0.00 O ATOM 1830 CB ASP A 112 18.109 -0.861 9.897 1.00 0.00 C ATOM 1831 CG ASP A 112 18.136 0.652 9.970 1.00 0.00 C ATOM 1832 OD1 ASP A 112 18.335 1.199 11.075 1.00 0.00 O ATOM 1833 OD2 ASP A 112 17.959 1.303 8.921 1.00 0.00 O ATOM 1834 OXT ASP A 112 20.434 -1.307 11.529 1.00 0.00 O ATOM 0 H ASP A 112 19.292 -3.379 10.155 1.00 0.00 H new ATOM 0 HA ASP A 112 19.619 -1.024 8.391 1.00 0.00 H new ATOM 0 HB2 ASP A 112 17.293 -1.176 9.246 1.00 0.00 H new ATOM 0 HB3 ASP A 112 17.901 -1.266 10.887 1.00 0.00 H new TER 1839 ASP A 112 ATOM 1840 N HIS B 281 -14.194 1.868 9.150 1.00 0.00 N ATOM 1841 CA HIS B 281 -15.212 2.440 10.060 1.00 0.00 C ATOM 1842 C HIS B 281 -16.439 1.545 10.120 1.00 0.00 C ATOM 1843 O HIS B 281 -16.444 0.455 9.546 1.00 0.00 O ATOM 1844 CB HIS B 281 -15.621 3.845 9.606 1.00 0.00 C ATOM 1845 CG HIS B 281 -14.750 4.936 10.142 1.00 0.00 C ATOM 1846 ND1 HIS B 281 -15.192 5.859 11.060 1.00 0.00 N ATOM 1847 CD2 HIS B 281 -13.462 5.258 9.880 1.00 0.00 C ATOM 1848 CE1 HIS B 281 -14.218 6.700 11.339 1.00 0.00 C ATOM 1849 NE2 HIS B 281 -13.153 6.359 10.638 1.00 0.00 N ATOM 0 HA HIS B 281 -14.771 2.506 11.055 1.00 0.00 H new ATOM 0 HB2 HIS B 281 -15.604 3.883 8.517 1.00 0.00 H new ATOM 0 HB3 HIS B 281 -16.650 4.030 9.915 1.00 0.00 H new ATOM 0 HD2 HIS B 281 -12.800 4.743 9.200 1.00 0.00 H new ATOM 0 HE1 HIS B 281 -14.280 7.530 12.027 1.00 0.00 H new ATOM 0 HE2 HIS B 281 -12.251 6.835 10.657 1.00 0.00 H new ATOM 1860 N ASN B 282 -17.473 2.010 10.812 1.00 0.00 N ATOM 1861 CA ASN B 282 -18.711 1.249 10.971 1.00 0.00 C ATOM 1862 C ASN B 282 -19.292 0.835 9.617 1.00 0.00 C ATOM 1863 O ASN B 282 -19.725 -0.306 9.444 1.00 0.00 O ATOM 1864 CB ASN B 282 -19.743 2.056 11.776 1.00 0.00 C ATOM 1865 CG ASN B 282 -20.136 3.374 11.124 1.00 0.00 C ATOM 1866 OD1 ASN B 282 -19.343 4.002 10.416 1.00 0.00 O ATOM 1867 ND2 ASN B 282 -21.362 3.809 11.365 1.00 0.00 N ATOM 0 H ASN B 282 -17.480 2.918 11.276 1.00 0.00 H new ATOM 0 HA ASN B 282 -18.472 0.340 11.522 1.00 0.00 H new ATOM 0 HB2 ASN B 282 -20.638 1.449 11.914 1.00 0.00 H new ATOM 0 HB3 ASN B 282 -19.339 2.258 12.768 1.00 0.00 H new ATOM 0 HD21 ASN B 282 -21.679 4.690 10.961 1.00 0.00 H new ATOM 0 HD22 ASN B 282 -21.990 3.263 11.955 1.00 0.00 H new ATOM 1874 N LEU B 283 -19.290 1.757 8.660 1.00 0.00 N ATOM 1875 CA LEU B 283 -19.762 1.464 7.314 1.00 0.00 C ATOM 1876 C LEU B 283 -19.316 2.548 6.340 1.00 0.00 C ATOM 1877 O LEU B 283 -18.388 2.340 5.557 1.00 0.00 O ATOM 1878 CB LEU B 283 -21.291 1.343 7.292 1.00 0.00 C ATOM 1879 CG LEU B 283 -21.899 0.964 5.937 1.00 0.00 C ATOM 1880 CD1 LEU B 283 -21.417 -0.409 5.496 1.00 0.00 C ATOM 1881 CD2 LEU B 283 -23.418 0.998 6.007 1.00 0.00 C ATOM 0 H LEU B 283 -18.966 2.715 8.793 1.00 0.00 H new ATOM 0 HA LEU B 283 -19.328 0.513 7.005 1.00 0.00 H new ATOM 0 HB2 LEU B 283 -21.590 0.596 8.028 1.00 0.00 H new ATOM 0 HB3 LEU B 283 -21.719 2.294 7.610 1.00 0.00 H new ATOM 0 HG LEU B 283 -21.570 1.695 5.198 1.00 0.00 H new ATOM 0 HD11 LEU B 283 -21.861 -0.658 4.532 1.00 0.00 H new ATOM 0 HD12 LEU B 283 -20.331 -0.401 5.404 1.00 0.00 H new ATOM 0 HD13 LEU B 283 -21.713 -1.153 6.235 1.00 0.00 H new ATOM 0 HD21 LEU B 283 -23.833 0.726 5.036 1.00 0.00 H new ATOM 0 HD22 LEU B 283 -23.763 0.290 6.760 1.00 0.00 H new ATOM 0 HD23 LEU B 283 -23.748 2.002 6.274 1.00 0.00 H new ATOM 1893 N LEU B 284 -19.962 3.710 6.425 1.00 0.00 N ATOM 1894 CA LEU B 284 -19.757 4.798 5.471 1.00 0.00 C ATOM 1895 C LEU B 284 -20.039 4.314 4.049 1.00 0.00 C ATOM 1896 O LEU B 284 -21.196 4.171 3.648 1.00 0.00 O ATOM 1897 CB LEU B 284 -18.336 5.374 5.576 1.00 0.00 C ATOM 1898 CG LEU B 284 -17.966 5.960 6.940 1.00 0.00 C ATOM 1899 CD1 LEU B 284 -16.501 6.348 6.975 1.00 0.00 C ATOM 1900 CD2 LEU B 284 -18.840 7.162 7.265 1.00 0.00 C ATOM 0 H LEU B 284 -20.641 3.923 7.156 1.00 0.00 H new ATOM 0 HA LEU B 284 -20.456 5.598 5.715 1.00 0.00 H new ATOM 0 HB2 LEU B 284 -17.624 4.586 5.332 1.00 0.00 H new ATOM 0 HB3 LEU B 284 -18.221 6.152 4.822 1.00 0.00 H new ATOM 0 HG LEU B 284 -18.139 5.194 7.696 1.00 0.00 H new ATOM 0 HD11 LEU B 284 -16.258 6.763 7.953 1.00 0.00 H new ATOM 0 HD12 LEU B 284 -15.887 5.467 6.792 1.00 0.00 H new ATOM 0 HD13 LEU B 284 -16.304 7.094 6.205 1.00 0.00 H new ATOM 0 HD21 LEU B 284 -18.560 7.563 8.239 1.00 0.00 H new ATOM 0 HD22 LEU B 284 -18.701 7.929 6.503 1.00 0.00 H new ATOM 0 HD23 LEU B 284 -19.886 6.856 7.286 1.00 0.00 H new ATOM 1912 N ARG B 285 -18.985 4.031 3.303 1.00 0.00 N ATOM 1913 CA ARG B 285 -19.117 3.474 1.970 1.00 0.00 C ATOM 1914 C ARG B 285 -18.049 2.409 1.780 1.00 0.00 C ATOM 1915 O ARG B 285 -16.921 2.571 2.242 1.00 0.00 O ATOM 1916 CB ARG B 285 -18.992 4.566 0.896 1.00 0.00 C ATOM 1917 CG ARG B 285 -19.972 5.720 1.079 1.00 0.00 C ATOM 1918 CD ARG B 285 -20.040 6.617 -0.143 1.00 0.00 C ATOM 1919 NE ARG B 285 -20.596 5.924 -1.305 1.00 0.00 N ATOM 1920 CZ ARG B 285 -21.845 6.088 -1.745 1.00 0.00 C ATOM 1921 NH1 ARG B 285 -22.678 6.905 -1.107 1.00 0.00 N ATOM 1922 NH2 ARG B 285 -22.262 5.426 -2.817 1.00 0.00 N ATOM 0 H ARG B 285 -18.021 4.180 3.602 1.00 0.00 H new ATOM 0 HA ARG B 285 -20.106 3.029 1.863 1.00 0.00 H new ATOM 0 HB2 ARG B 285 -17.975 4.959 0.907 1.00 0.00 H new ATOM 0 HB3 ARG B 285 -19.151 4.118 -0.085 1.00 0.00 H new ATOM 0 HG2 ARG B 285 -20.964 5.321 1.290 1.00 0.00 H new ATOM 0 HG3 ARG B 285 -19.676 6.312 1.945 1.00 0.00 H new ATOM 0 HD2 ARG B 285 -20.650 7.491 0.083 1.00 0.00 H new ATOM 0 HD3 ARG B 285 -19.040 6.980 -0.382 1.00 0.00 H new ATOM 0 HE ARG B 285 -19.992 5.276 -1.810 1.00 0.00 H new ATOM 0 HH11 ARG B 285 -22.363 7.409 -0.278 1.00 0.00 H new ATOM 0 HH12 ARG B 285 -23.632 7.028 -1.447 1.00 0.00 H new ATOM 0 HH21 ARG B 285 -21.628 4.792 -3.304 1.00 0.00 H new ATOM 0 HH22 ARG B 285 -23.217 5.551 -3.154 1.00 0.00 H new ATOM 1936 N ILE B 286 -18.410 1.308 1.143 1.00 0.00 N ATOM 1937 CA ILE B 286 -17.464 0.227 0.928 1.00 0.00 C ATOM 1938 C ILE B 286 -16.948 0.252 -0.505 1.00 0.00 C ATOM 1939 O ILE B 286 -17.707 0.487 -1.447 1.00 0.00 O ATOM 1940 CB ILE B 286 -18.084 -1.158 1.238 1.00 0.00 C ATOM 1941 CG1 ILE B 286 -19.226 -1.477 0.268 1.00 0.00 C ATOM 1942 CG2 ILE B 286 -18.572 -1.204 2.680 1.00 0.00 C ATOM 1943 CD1 ILE B 286 -19.879 -2.818 0.511 1.00 0.00 C ATOM 0 H ILE B 286 -19.344 1.140 0.768 1.00 0.00 H new ATOM 0 HA ILE B 286 -16.634 0.382 1.618 1.00 0.00 H new ATOM 0 HB ILE B 286 -17.313 -1.917 1.107 1.00 0.00 H new ATOM 0 HG12 ILE B 286 -19.983 -0.696 0.344 1.00 0.00 H new ATOM 0 HG13 ILE B 286 -18.842 -1.450 -0.752 1.00 0.00 H new ATOM 0 HG21 ILE B 286 -19.006 -2.182 2.886 1.00 0.00 H new ATOM 0 HG22 ILE B 286 -17.733 -1.030 3.354 1.00 0.00 H new ATOM 0 HG23 ILE B 286 -19.327 -0.433 2.833 1.00 0.00 H new ATOM 0 HD11 ILE B 286 -20.677 -2.971 -0.215 1.00 0.00 H new ATOM 0 HD12 ILE B 286 -19.136 -3.609 0.406 1.00 0.00 H new ATOM 0 HD13 ILE B 286 -20.295 -2.843 1.518 1.00 0.00 H new HETATM 1955 OH ALY B 287 -9.319 1.831 0.510 1.00 0.00 O HETATM 1956 CH ALY B 287 -8.709 1.354 -0.445 1.00 0.00 C HETATM 1957 CH3 ALY B 287 -7.178 1.372 -0.444 1.00 0.00 C HETATM 1958 NZ ALY B 287 -9.338 0.822 -1.482 1.00 0.00 N HETATM 1959 CE ALY B 287 -10.788 0.755 -1.605 1.00 0.00 C HETATM 1960 CD ALY B 287 -11.217 -0.122 -2.772 1.00 0.00 C HETATM 1961 CG ALY B 287 -12.707 -0.010 -3.044 1.00 0.00 C HETATM 1962 CB ALY B 287 -13.529 -0.281 -1.798 1.00 0.00 C HETATM 1963 CA ALY B 287 -15.013 0.005 -1.966 1.00 0.00 C HETATM 1964 N ALY B 287 -15.648 0.038 -0.655 1.00 0.00 N HETATM 1965 C ALY B 287 -15.654 -1.066 -2.839 1.00 0.00 C HETATM 1966 O ALY B 287 -15.920 -2.174 -2.370 1.00 0.00 O HETATM 0 HH33 ALY B 287 -6.826 2.402 -0.388 1.00 0.00 H new HETATM 0 HH32 ALY B 287 -6.808 0.815 0.417 1.00 0.00 H new HETATM 0 HH31 ALY B 287 -6.808 0.912 -1.360 1.00 0.00 H new HETATM 0 HZ ALY B 287 -8.774 0.436 -2.239 1.00 0.00 H new HETATM 0 HG3 ALY B 287 -12.988 -0.716 -3.825 1.00 0.00 H new HETATM 0 HG2 ALY B 287 -12.934 0.988 -3.419 1.00 0.00 H new HETATM 0 HE3 ALY B 287 -11.188 1.760 -1.739 1.00 0.00 H new HETATM 0 HE2 ALY B 287 -11.213 0.364 -0.681 1.00 0.00 H new HETATM 0 HD3 ALY B 287 -10.964 -1.160 -2.559 1.00 0.00 H new HETATM 0 HD2 ALY B 287 -10.662 0.165 -3.665 1.00 0.00 H new HETATM 0 HCA ALY B 287 -15.146 0.971 -2.452 1.00 0.00 H new HETATM 0 HB3 ALY B 287 -13.142 0.326 -0.980 1.00 0.00 H new HETATM 0 HB2 ALY B 287 -13.400 -1.324 -1.509 1.00 0.00 H new HETATM 0 H ALY B 287 -15.092 -0.119 0.185 1.00 0.00 H new ATOM 1981 N GLN B 288 -15.899 -0.747 -4.102 1.00 0.00 N ATOM 1982 CA GLN B 288 -16.546 -1.688 -5.006 1.00 0.00 C ATOM 1983 C GLN B 288 -15.538 -2.709 -5.535 1.00 0.00 C ATOM 1984 O GLN B 288 -15.270 -2.787 -6.733 1.00 0.00 O ATOM 1985 CB GLN B 288 -17.225 -0.943 -6.159 1.00 0.00 C ATOM 1986 CG GLN B 288 -18.183 -1.810 -6.963 1.00 0.00 C ATOM 1987 CD GLN B 288 -19.244 -2.461 -6.094 1.00 0.00 C ATOM 1988 OE1 GLN B 288 -19.635 -1.923 -5.059 1.00 0.00 O ATOM 1989 NE2 GLN B 288 -19.719 -3.621 -6.511 1.00 0.00 N ATOM 0 H GLN B 288 -15.661 0.151 -4.523 1.00 0.00 H new ATOM 0 HA GLN B 288 -17.313 -2.228 -4.451 1.00 0.00 H new ATOM 0 HB2 GLN B 288 -17.771 -0.089 -5.758 1.00 0.00 H new ATOM 0 HB3 GLN B 288 -16.459 -0.547 -6.826 1.00 0.00 H new ATOM 0 HG2 GLN B 288 -18.667 -1.200 -7.726 1.00 0.00 H new ATOM 0 HG3 GLN B 288 -17.619 -2.584 -7.483 1.00 0.00 H new ATOM 0 HE21 GLN B 288 -19.369 -4.035 -7.375 1.00 0.00 H new ATOM 0 HE22 GLN B 288 -20.436 -4.103 -5.969 1.00 0.00 H new ATOM 1998 N PHE B 289 -14.974 -3.481 -4.615 1.00 0.00 N ATOM 1999 CA PHE B 289 -14.030 -4.540 -4.953 1.00 0.00 C ATOM 2000 C PHE B 289 -14.665 -5.903 -4.711 1.00 0.00 C ATOM 2001 O PHE B 289 -13.973 -6.887 -4.445 1.00 0.00 O ATOM 2002 CB PHE B 289 -12.744 -4.411 -4.124 1.00 0.00 C ATOM 2003 CG PHE B 289 -11.747 -3.416 -4.657 1.00 0.00 C ATOM 2004 CD1 PHE B 289 -12.106 -2.488 -5.622 1.00 0.00 C ATOM 2005 CD2 PHE B 289 -10.441 -3.417 -4.191 1.00 0.00 C ATOM 2006 CE1 PHE B 289 -11.183 -1.583 -6.112 1.00 0.00 C ATOM 2007 CE2 PHE B 289 -9.516 -2.512 -4.674 1.00 0.00 C ATOM 2008 CZ PHE B 289 -9.887 -1.594 -5.637 1.00 0.00 C ATOM 0 H PHE B 289 -15.157 -3.392 -3.616 1.00 0.00 H new ATOM 0 HA PHE B 289 -13.773 -4.444 -6.008 1.00 0.00 H new ATOM 0 HB2 PHE B 289 -13.011 -4.127 -3.106 1.00 0.00 H new ATOM 0 HB3 PHE B 289 -12.266 -5.389 -4.067 1.00 0.00 H new ATOM 0 HD1 PHE B 289 -13.119 -2.472 -5.996 1.00 0.00 H new ATOM 0 HD2 PHE B 289 -10.143 -4.135 -3.441 1.00 0.00 H new ATOM 0 HE1 PHE B 289 -11.476 -0.868 -6.866 1.00 0.00 H new ATOM 0 HE2 PHE B 289 -8.503 -2.522 -4.299 1.00 0.00 H new ATOM 0 HZ PHE B 289 -9.165 -0.887 -6.017 1.00 0.00 H new ATOM 2018 N LEU B 290 -15.989 -5.947 -4.784 1.00 0.00 N ATOM 2019 CA LEU B 290 -16.721 -7.190 -4.602 1.00 0.00 C ATOM 2020 C LEU B 290 -16.590 -8.048 -5.852 1.00 0.00 C ATOM 2021 O LEU B 290 -17.221 -7.763 -6.871 1.00 0.00 O ATOM 2022 CB LEU B 290 -18.204 -6.924 -4.296 1.00 0.00 C ATOM 2023 CG LEU B 290 -18.503 -6.270 -2.940 1.00 0.00 C ATOM 2024 CD1 LEU B 290 -18.156 -4.788 -2.951 1.00 0.00 C ATOM 2025 CD2 LEU B 290 -19.963 -6.472 -2.566 1.00 0.00 C ATOM 0 H LEU B 290 -16.577 -5.134 -4.968 1.00 0.00 H new ATOM 0 HA LEU B 290 -16.294 -7.719 -3.750 1.00 0.00 H new ATOM 0 HB2 LEU B 290 -18.608 -6.286 -5.082 1.00 0.00 H new ATOM 0 HB3 LEU B 290 -18.741 -7.871 -4.347 1.00 0.00 H new ATOM 0 HG LEU B 290 -17.877 -6.753 -2.189 1.00 0.00 H new ATOM 0 HD11 LEU B 290 -18.380 -4.355 -1.976 1.00 0.00 H new ATOM 0 HD12 LEU B 290 -17.095 -4.664 -3.168 1.00 0.00 H new ATOM 0 HD13 LEU B 290 -18.745 -4.282 -3.716 1.00 0.00 H new ATOM 0 HD21 LEU B 290 -20.160 -6.003 -1.602 1.00 0.00 H new ATOM 0 HD22 LEU B 290 -20.599 -6.020 -3.327 1.00 0.00 H new ATOM 0 HD23 LEU B 290 -20.178 -7.539 -2.501 1.00 0.00 H new ATOM 2037 N GLN B 291 -15.761 -9.085 -5.761 1.00 0.00 N ATOM 2038 CA GLN B 291 -15.448 -9.947 -6.898 1.00 0.00 C ATOM 2039 C GLN B 291 -14.848 -9.127 -8.039 1.00 0.00 C ATOM 2040 O GLN B 291 -15.534 -8.762 -8.996 1.00 0.00 O ATOM 2041 CB GLN B 291 -16.694 -10.709 -7.366 1.00 0.00 C ATOM 2042 CG GLN B 291 -16.422 -11.700 -8.488 1.00 0.00 C ATOM 2043 CD GLN B 291 -17.628 -12.556 -8.814 1.00 0.00 C ATOM 2044 OE1 GLN B 291 -17.812 -13.629 -8.242 1.00 0.00 O ATOM 2045 NE2 GLN B 291 -18.457 -12.091 -9.734 1.00 0.00 N ATOM 0 H GLN B 291 -15.288 -9.351 -4.898 1.00 0.00 H new ATOM 0 HA GLN B 291 -14.709 -10.682 -6.579 1.00 0.00 H new ATOM 0 HB2 GLN B 291 -17.122 -11.243 -6.518 1.00 0.00 H new ATOM 0 HB3 GLN B 291 -17.443 -9.991 -7.701 1.00 0.00 H new ATOM 0 HG2 GLN B 291 -16.115 -11.156 -9.381 1.00 0.00 H new ATOM 0 HG3 GLN B 291 -15.590 -12.344 -8.205 1.00 0.00 H new ATOM 0 HE21 GLN B 291 -18.268 -11.196 -10.185 1.00 0.00 H new ATOM 0 HE22 GLN B 291 -19.285 -12.628 -9.992 1.00 0.00 H new ATOM 2054 N SER B 292 -13.566 -8.824 -7.921 1.00 0.00 N ATOM 2055 CA SER B 292 -12.871 -8.043 -8.928 1.00 0.00 C ATOM 2056 C SER B 292 -11.745 -8.859 -9.557 1.00 0.00 C ATOM 2057 O SER B 292 -10.690 -9.026 -8.910 1.00 0.00 O ATOM 2058 CB SER B 292 -12.326 -6.754 -8.313 1.00 0.00 C ATOM 2059 OG SER B 292 -13.384 -5.940 -7.827 1.00 0.00 O ATOM 2060 OXT SER B 292 -11.924 -9.338 -10.698 1.00 0.00 O ATOM 0 H SER B 292 -12.984 -9.109 -7.133 1.00 0.00 H new ATOM 0 HA SER B 292 -13.578 -7.779 -9.714 1.00 0.00 H new ATOM 0 HB2 SER B 292 -11.643 -6.995 -7.498 1.00 0.00 H new ATOM 0 HB3 SER B 292 -11.752 -6.205 -9.059 1.00 0.00 H new ATOM 0 HG SER B 292 -13.193 -5.000 -8.030 1.00 0.00 H new TER 2066 SER B 292