USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1204 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 25 ASN : amide:sc= -0.142 K(o=1,f=-6.4!) USER MOD Set 1.2: B 29 LYS NZ :NH3+ 166:sc= 1.14 (180deg=0.791) USER MOD Set 2.1: B 7 THR OG1 : rot 134:sc= 1.84 USER MOD Set 2.2: B 9 THR OG1 : rot 180:sc= 1.13 USER MOD Set 3.1: B 6 LYS NZ :NH3+ 176:sc= 0.417 (180deg=-0.25) USER MOD Set 3.2: B 12 THR OG1 : rot 180:sc= 0.533 USER MOD Set 4.1: A 46 GLN : amide:sc= -3! C(o=-3.2!,f=-2.3!) USER MOD Set 4.2: A 53 SER OG : rot 180:sc= -0.192 USER MOD Set 5.1: A 13 TYR OH : rot 97:sc= 1.3 USER MOD Set 5.2: A 59 GLN : amide:sc= 0.207 K(o=2.8,f=1.8) USER MOD Set 5.3: B 68 HIS : no HE2:sc= 1.28 K(o=2.8,f=-6.9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= 1.33 (180deg=0.945) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 165:sc= -0.0289 (180deg=-0.297) USER MOD Single : A 7 LYS NZ :NH3+ -145:sc= 1.18 (180deg=0.806) USER MOD Single : A 12 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.019) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -147:sc= 1.1 USER MOD Single : A 20 GLN : amide:sc= -0.146 K(o=-0.15,f=-0.8) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.194 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 90:sc= 1.23 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0511) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0207) USER MOD Single : A 44 MET CE :methyl 136:sc= -0.26 (180deg=-1.13) USER MOD Single : A 45 CYS SG : rot -1:sc= -3.5! USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -172:sc=-0.00318 (180deg=-0.0708) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 170:sc= 1.91 (180deg=1.73) USER MOD Single : A 69 HIS : no HD1:sc=-0.00526 X(o=-0.0053,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 157:sc= 1.27 (180deg=0.917) USER MOD Single : B 2 GLN : amide:sc= -1.6 K(o=-1.6,f=0) USER MOD Single : B 11 LYS NZ :NH3+ -167:sc= -0.0131 (180deg=-0.239) USER MOD Single : B 14 THR OG1 : rot -79:sc= 0.196 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot -34:sc= 0.269 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.0126 USER MOD Single : B 27 LYS NZ :NH3+ 174:sc= 2.43 (180deg=2.35) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 31 GLN : amide:sc= -1.17 X(o=-1.2,f=-1.2) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -1.56! K(o=-1.6!,f=0) USER MOD Single : B 41 GLN : amide:sc= -3.4! C(o=-3.4!,f=-5.5!) USER MOD Single : B 48 LYS NZ :NH3+ -159:sc= 1.22 (180deg=1.14) USER MOD Single : B 49 GLN : amide:sc= -0.756 K(o=-0.76,f=0.016) USER MOD Single : B 55 THR OG1 : rot -62:sc= 1.24 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot -148:sc= -0.781! USER MOD Single : B 60 ASN : amide:sc= -0.295 K(o=-0.3,f=-0.81) USER MOD Single : B 62 GLN : amide:sc= -1.02 K(o=-1,f=0) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 65 SER OG : rot 99:sc= 1.28 USER MOD Single : B 66 THR OG1 : rot -41:sc= 0.137 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -25.316 2.138 13.166 1.00 0.00 N ATOM 2 CA MET A 1 -25.445 3.533 13.645 1.00 0.00 C ATOM 3 C MET A 1 -25.446 4.497 12.465 1.00 0.00 C ATOM 4 O MET A 1 -25.488 4.069 11.312 1.00 0.00 O ATOM 5 CB MET A 1 -24.307 3.882 14.610 1.00 0.00 C ATOM 6 CG MET A 1 -24.418 3.215 15.975 1.00 0.00 C ATOM 7 SD MET A 1 -24.290 1.418 15.902 1.00 0.00 S ATOM 8 CE MET A 1 -24.453 1.003 17.639 1.00 0.00 C ATOM 0 H1 MET A 1 -25.096 1.514 13.969 1.00 0.00 H new ATOM 0 H2 MET A 1 -26.210 1.837 12.728 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.551 2.081 12.464 1.00 0.00 H new ATOM 0 HA MET A 1 -26.391 3.626 14.179 1.00 0.00 H new ATOM 0 HB2 MET A 1 -23.359 3.596 14.154 1.00 0.00 H new ATOM 0 HB3 MET A 1 -24.281 4.963 14.747 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.634 3.602 16.626 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.371 3.486 16.428 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.394 -0.078 17.762 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.649 1.476 18.203 1.00 0.00 H new ATOM 0 HE3 MET A 1 -25.415 1.358 18.009 1.00 0.00 H new ATOM 20 N ALA A 2 -25.392 5.795 12.756 1.00 0.00 N ATOM 21 CA ALA A 2 -25.456 6.824 11.721 1.00 0.00 C ATOM 22 C ALA A 2 -24.323 6.680 10.708 1.00 0.00 C ATOM 23 O ALA A 2 -24.485 7.008 9.533 1.00 0.00 O ATOM 24 CB ALA A 2 -25.426 8.206 12.354 1.00 0.00 C ATOM 0 H ALA A 2 -25.304 6.160 13.704 1.00 0.00 H new ATOM 0 HA ALA A 2 -26.395 6.695 11.183 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -25.474 8.965 11.573 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -26.279 8.319 13.023 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -24.503 8.327 12.921 1.00 0.00 H new ATOM 30 N SER A 3 -23.186 6.172 11.162 1.00 0.00 N ATOM 31 CA SER A 3 -22.027 5.980 10.300 1.00 0.00 C ATOM 32 C SER A 3 -22.147 4.691 9.479 1.00 0.00 C ATOM 33 O SER A 3 -21.155 4.013 9.213 1.00 0.00 O ATOM 34 CB SER A 3 -20.753 5.959 11.148 1.00 0.00 C ATOM 35 OG SER A 3 -20.626 7.166 11.886 1.00 0.00 O ATOM 0 H SER A 3 -23.041 5.883 12.129 1.00 0.00 H new ATOM 0 HA SER A 3 -21.979 6.812 9.598 1.00 0.00 H new ATOM 0 HB2 SER A 3 -20.778 5.110 11.831 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.883 5.826 10.505 1.00 0.00 H new ATOM 0 HG SER A 3 -19.808 7.136 12.424 1.00 0.00 H new ATOM 41 N LYS A 4 -23.366 4.364 9.068 1.00 0.00 N ATOM 42 CA LYS A 4 -23.592 3.234 8.185 1.00 0.00 C ATOM 43 C LYS A 4 -23.261 3.632 6.751 1.00 0.00 C ATOM 44 O LYS A 4 -24.149 3.943 5.955 1.00 0.00 O ATOM 45 CB LYS A 4 -25.044 2.751 8.283 1.00 0.00 C ATOM 46 CG LYS A 4 -25.329 1.488 7.482 1.00 0.00 C ATOM 47 CD LYS A 4 -24.635 0.274 8.077 1.00 0.00 C ATOM 48 CE LYS A 4 -25.173 -0.049 9.463 1.00 0.00 C ATOM 49 NZ LYS A 4 -24.529 -1.250 10.051 1.00 0.00 N ATOM 0 H LYS A 4 -24.212 4.868 9.334 1.00 0.00 H new ATOM 0 HA LYS A 4 -22.942 2.414 8.489 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -25.286 2.568 9.330 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -25.705 3.546 7.937 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -26.404 1.313 7.450 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -24.998 1.628 6.453 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -24.776 -0.585 7.421 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -23.562 0.458 8.135 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -25.013 0.805 10.121 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -26.250 -0.209 9.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -24.927 -1.431 10.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -24.703 -2.072 9.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -23.505 -1.090 10.133 1.00 0.00 H new ATOM 63 N SER A 5 -21.978 3.664 6.443 1.00 0.00 N ATOM 64 CA SER A 5 -21.523 4.070 5.130 1.00 0.00 C ATOM 65 C SER A 5 -20.990 2.880 4.344 1.00 0.00 C ATOM 66 O SER A 5 -19.968 2.297 4.694 1.00 0.00 O ATOM 67 CB SER A 5 -20.443 5.144 5.258 1.00 0.00 C ATOM 68 OG SER A 5 -20.945 6.297 5.917 1.00 0.00 O ATOM 0 H SER A 5 -21.230 3.412 7.089 1.00 0.00 H new ATOM 0 HA SER A 5 -22.373 4.482 4.587 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.593 4.745 5.812 1.00 0.00 H new ATOM 0 HB3 SER A 5 -20.078 5.417 4.268 1.00 0.00 H new ATOM 0 HG SER A 5 -20.235 6.968 5.988 1.00 0.00 H new ATOM 74 N LYS A 6 -21.712 2.505 3.302 1.00 0.00 N ATOM 75 CA LYS A 6 -21.253 1.469 2.396 1.00 0.00 C ATOM 76 C LYS A 6 -20.705 2.087 1.120 1.00 0.00 C ATOM 77 O LYS A 6 -21.408 2.195 0.113 1.00 0.00 O ATOM 78 CB LYS A 6 -22.382 0.485 2.070 1.00 0.00 C ATOM 79 CG LYS A 6 -22.746 -0.435 3.226 1.00 0.00 C ATOM 80 CD LYS A 6 -21.595 -1.364 3.584 1.00 0.00 C ATOM 81 CE LYS A 6 -21.985 -2.352 4.673 1.00 0.00 C ATOM 82 NZ LYS A 6 -23.108 -3.232 4.253 1.00 0.00 N ATOM 0 H LYS A 6 -22.620 2.904 3.063 1.00 0.00 H new ATOM 0 HA LYS A 6 -20.454 0.916 2.890 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -23.267 1.047 1.773 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -22.087 -0.122 1.214 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -23.017 0.163 4.096 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -23.622 -1.026 2.960 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -21.278 -1.909 2.695 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -20.741 -0.774 3.917 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -21.122 -2.965 4.932 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -22.270 -1.806 5.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -23.176 -4.042 4.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -23.998 -2.694 4.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -22.937 -3.576 3.287 1.00 0.00 H new ATOM 96 N LYS A 7 -19.458 2.534 1.178 1.00 0.00 N ATOM 97 CA LYS A 7 -18.803 3.100 0.010 1.00 0.00 C ATOM 98 C LYS A 7 -18.272 1.985 -0.872 1.00 0.00 C ATOM 99 O LYS A 7 -17.980 0.896 -0.392 1.00 0.00 O ATOM 100 CB LYS A 7 -17.666 4.035 0.423 1.00 0.00 C ATOM 101 CG LYS A 7 -18.139 5.289 1.134 1.00 0.00 C ATOM 102 CD LYS A 7 -16.980 6.213 1.460 1.00 0.00 C ATOM 103 CE LYS A 7 -17.459 7.528 2.054 1.00 0.00 C ATOM 104 NZ LYS A 7 -18.348 8.273 1.120 1.00 0.00 N ATOM 0 H LYS A 7 -18.882 2.515 2.020 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.534 3.683 -0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -16.981 3.494 1.076 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -17.102 4.321 -0.465 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -18.860 5.814 0.507 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -18.657 5.014 2.053 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -16.308 5.720 2.162 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.406 6.410 0.555 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -17.993 7.332 2.984 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -16.598 8.147 2.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -18.186 9.295 1.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -18.138 7.990 0.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -19.341 8.055 1.338 1.00 0.00 H new ATOM 118 N ARG A 8 -18.152 2.248 -2.158 1.00 0.00 N ATOM 119 CA ARG A 8 -17.711 1.229 -3.093 1.00 0.00 C ATOM 120 C ARG A 8 -16.285 1.496 -3.550 1.00 0.00 C ATOM 121 O ARG A 8 -15.929 2.632 -3.867 1.00 0.00 O ATOM 122 CB ARG A 8 -18.654 1.166 -4.291 1.00 0.00 C ATOM 123 CG ARG A 8 -20.062 0.739 -3.918 1.00 0.00 C ATOM 124 CD ARG A 8 -20.996 0.782 -5.111 1.00 0.00 C ATOM 125 NE ARG A 8 -22.311 0.241 -4.785 1.00 0.00 N ATOM 126 CZ ARG A 8 -23.450 0.673 -5.320 1.00 0.00 C ATOM 127 NH1 ARG A 8 -23.446 1.691 -6.175 1.00 0.00 N ATOM 128 NH2 ARG A 8 -24.596 0.093 -4.987 1.00 0.00 N ATOM 0 H ARG A 8 -18.353 3.155 -2.580 1.00 0.00 H new ATOM 0 HA ARG A 8 -17.729 0.265 -2.584 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -18.692 2.145 -4.768 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.252 0.469 -5.026 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.040 -0.271 -3.510 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -20.444 1.392 -3.133 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -21.101 1.811 -5.455 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -20.562 0.214 -5.934 1.00 0.00 H new ATOM 0 HE ARG A 8 -22.360 -0.516 -4.104 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.567 2.145 -6.424 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -24.322 2.018 -6.582 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -24.602 -0.681 -4.323 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -25.471 0.421 -5.395 1.00 0.00 H new ATOM 142 N GLY A 9 -15.473 0.452 -3.566 1.00 0.00 N ATOM 143 CA GLY A 9 -14.100 0.590 -3.991 1.00 0.00 C ATOM 144 C GLY A 9 -13.670 -0.515 -4.935 1.00 0.00 C ATOM 145 O GLY A 9 -14.002 -1.690 -4.731 1.00 0.00 O ATOM 0 H GLY A 9 -15.743 -0.492 -3.291 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.971 1.554 -4.483 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.450 0.589 -3.116 1.00 0.00 H new ATOM 149 N ILE A 10 -12.948 -0.132 -5.976 1.00 0.00 N ATOM 150 CA ILE A 10 -12.389 -1.081 -6.921 1.00 0.00 C ATOM 151 C ILE A 10 -10.868 -1.099 -6.792 1.00 0.00 C ATOM 152 O ILE A 10 -10.191 -0.127 -7.130 1.00 0.00 O ATOM 153 CB ILE A 10 -12.799 -0.752 -8.378 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.296 -1.018 -8.575 1.00 0.00 C ATOM 155 CG2 ILE A 10 -11.977 -1.565 -9.369 1.00 0.00 C ATOM 156 CD1 ILE A 10 -14.810 -0.673 -9.960 1.00 0.00 C ATOM 0 H ILE A 10 -12.734 0.843 -6.188 1.00 0.00 H new ATOM 0 HA ILE A 10 -12.789 -2.067 -6.684 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.602 0.304 -8.563 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -14.496 -2.071 -8.377 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.856 -0.443 -7.838 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.283 -1.317 -10.385 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -10.920 -1.333 -9.241 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.139 -2.628 -9.191 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -15.877 -0.890 -10.017 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.644 0.386 -10.156 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -14.279 -1.267 -10.704 1.00 0.00 H new ATOM 168 N VAL A 11 -10.339 -2.193 -6.269 1.00 0.00 N ATOM 169 CA VAL A 11 -8.903 -2.322 -6.063 1.00 0.00 C ATOM 170 C VAL A 11 -8.164 -2.438 -7.400 1.00 0.00 C ATOM 171 O VAL A 11 -8.501 -3.267 -8.248 1.00 0.00 O ATOM 172 CB VAL A 11 -8.578 -3.524 -5.147 1.00 0.00 C ATOM 173 CG1 VAL A 11 -9.279 -4.783 -5.626 1.00 0.00 C ATOM 174 CG2 VAL A 11 -7.077 -3.746 -5.051 1.00 0.00 C ATOM 0 H VAL A 11 -10.882 -3.006 -5.979 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.556 -1.417 -5.564 1.00 0.00 H new ATOM 0 HB VAL A 11 -8.950 -3.291 -4.149 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -9.032 -5.612 -4.963 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -10.357 -4.623 -5.621 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -8.952 -5.019 -6.639 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -6.876 -4.597 -4.401 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -6.674 -3.945 -6.044 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -6.603 -2.855 -4.639 1.00 0.00 H new ATOM 184 N GLN A 12 -7.172 -1.577 -7.585 1.00 0.00 N ATOM 185 CA GLN A 12 -6.432 -1.505 -8.840 1.00 0.00 C ATOM 186 C GLN A 12 -5.294 -2.521 -8.862 1.00 0.00 C ATOM 187 O GLN A 12 -5.179 -3.326 -9.789 1.00 0.00 O ATOM 188 CB GLN A 12 -5.872 -0.095 -9.038 1.00 0.00 C ATOM 189 CG GLN A 12 -6.926 1.000 -8.998 1.00 0.00 C ATOM 190 CD GLN A 12 -7.916 0.911 -10.142 1.00 0.00 C ATOM 191 OE1 GLN A 12 -7.695 1.479 -11.212 1.00 0.00 O ATOM 192 NE2 GLN A 12 -9.023 0.217 -9.922 1.00 0.00 N ATOM 0 H GLN A 12 -6.859 -0.914 -6.876 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.119 -1.739 -9.654 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -5.129 0.102 -8.265 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.354 -0.052 -9.996 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.466 0.943 -8.053 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.433 1.972 -9.026 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.168 -0.239 -9.021 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.730 0.139 -10.653 1.00 0.00 H new ATOM 201 N TYR A 13 -4.451 -2.477 -7.839 1.00 0.00 N ATOM 202 CA TYR A 13 -3.311 -3.383 -7.742 1.00 0.00 C ATOM 203 C TYR A 13 -3.731 -4.704 -7.109 1.00 0.00 C ATOM 204 O TYR A 13 -4.918 -4.974 -6.934 1.00 0.00 O ATOM 205 CB TYR A 13 -2.205 -2.775 -6.874 1.00 0.00 C ATOM 206 CG TYR A 13 -1.580 -1.499 -7.393 1.00 0.00 C ATOM 207 CD1 TYR A 13 -2.178 -0.264 -7.174 1.00 0.00 C ATOM 208 CD2 TYR A 13 -0.365 -1.529 -8.062 1.00 0.00 C ATOM 209 CE1 TYR A 13 -1.578 0.904 -7.604 1.00 0.00 C ATOM 210 CE2 TYR A 13 0.235 -0.366 -8.504 1.00 0.00 C ATOM 211 CZ TYR A 13 -0.374 0.846 -8.270 1.00 0.00 C ATOM 212 OH TYR A 13 0.235 2.010 -8.683 1.00 0.00 O ATOM 0 H TYR A 13 -4.534 -1.822 -7.062 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.941 -3.550 -8.754 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.615 -2.578 -5.883 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.417 -3.518 -6.751 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.126 -0.216 -6.660 1.00 0.00 H new ATOM 0 HD2 TYR A 13 0.120 -2.477 -8.240 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.051 1.857 -7.419 1.00 0.00 H new ATOM 0 HE2 TYR A 13 1.177 -0.407 -9.030 1.00 0.00 H new ATOM 0 HH TYR A 13 0.910 2.278 -8.024 1.00 0.00 H new ATOM 222 N ASP A 14 -2.744 -5.520 -6.775 1.00 0.00 N ATOM 223 CA ASP A 14 -2.965 -6.693 -5.943 1.00 0.00 C ATOM 224 C ASP A 14 -2.421 -6.409 -4.552 1.00 0.00 C ATOM 225 O ASP A 14 -1.417 -5.710 -4.413 1.00 0.00 O ATOM 226 CB ASP A 14 -2.265 -7.934 -6.517 1.00 0.00 C ATOM 227 CG ASP A 14 -2.809 -8.365 -7.863 1.00 0.00 C ATOM 228 OD1 ASP A 14 -3.950 -8.868 -7.918 1.00 0.00 O ATOM 229 OD2 ASP A 14 -2.089 -8.218 -8.876 1.00 0.00 O ATOM 0 H ASP A 14 -1.776 -5.391 -7.069 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.035 -6.898 -5.909 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -1.199 -7.728 -6.614 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -2.368 -8.758 -5.811 1.00 0.00 H new ATOM 234 N PHE A 15 -3.086 -6.916 -3.527 1.00 0.00 N ATOM 235 CA PHE A 15 -2.600 -6.769 -2.164 1.00 0.00 C ATOM 236 C PHE A 15 -2.838 -8.050 -1.379 1.00 0.00 C ATOM 237 O PHE A 15 -3.965 -8.534 -1.286 1.00 0.00 O ATOM 238 CB PHE A 15 -3.270 -5.584 -1.464 1.00 0.00 C ATOM 239 CG PHE A 15 -2.798 -5.383 -0.051 1.00 0.00 C ATOM 240 CD1 PHE A 15 -1.499 -4.974 0.208 1.00 0.00 C ATOM 241 CD2 PHE A 15 -3.651 -5.606 1.017 1.00 0.00 C ATOM 242 CE1 PHE A 15 -1.060 -4.791 1.506 1.00 0.00 C ATOM 243 CE2 PHE A 15 -3.217 -5.424 2.316 1.00 0.00 C ATOM 244 CZ PHE A 15 -1.921 -5.016 2.561 1.00 0.00 C ATOM 0 H PHE A 15 -3.962 -7.432 -3.612 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.528 -6.574 -2.206 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -3.077 -4.677 -2.036 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.349 -5.736 -1.461 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.822 -4.796 -0.614 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -4.666 -5.926 0.833 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.045 -4.473 1.694 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.892 -5.601 3.140 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.582 -4.873 3.576 1.00 0.00 H new ATOM 254 N MET A 16 -1.773 -8.592 -0.812 1.00 0.00 N ATOM 255 CA MET A 16 -1.860 -9.837 -0.069 1.00 0.00 C ATOM 256 C MET A 16 -1.742 -9.563 1.422 1.00 0.00 C ATOM 257 O MET A 16 -0.819 -8.879 1.862 1.00 0.00 O ATOM 258 CB MET A 16 -0.757 -10.804 -0.514 1.00 0.00 C ATOM 259 CG MET A 16 -0.775 -11.110 -2.004 1.00 0.00 C ATOM 260 SD MET A 16 -2.301 -11.909 -2.536 1.00 0.00 S ATOM 261 CE MET A 16 -2.013 -12.041 -4.299 1.00 0.00 C ATOM 0 H MET A 16 -0.837 -8.188 -0.852 1.00 0.00 H new ATOM 0 HA MET A 16 -2.828 -10.296 -0.271 1.00 0.00 H new ATOM 0 HB2 MET A 16 0.212 -10.381 -0.251 1.00 0.00 H new ATOM 0 HB3 MET A 16 -0.859 -11.737 0.041 1.00 0.00 H new ATOM 0 HG2 MET A 16 -0.642 -10.183 -2.562 1.00 0.00 H new ATOM 0 HG3 MET A 16 0.070 -11.753 -2.248 1.00 0.00 H new ATOM 0 HE1 MET A 16 -2.871 -12.517 -4.773 1.00 0.00 H new ATOM 0 HE2 MET A 16 -1.871 -11.046 -4.720 1.00 0.00 H new ATOM 0 HE3 MET A 16 -1.121 -12.641 -4.478 1.00 0.00 H new ATOM 271 N ALA A 17 -2.681 -10.089 2.193 1.00 0.00 N ATOM 272 CA ALA A 17 -2.672 -9.897 3.632 1.00 0.00 C ATOM 273 C ALA A 17 -1.608 -10.765 4.287 1.00 0.00 C ATOM 274 O ALA A 17 -1.631 -11.993 4.170 1.00 0.00 O ATOM 275 CB ALA A 17 -4.039 -10.203 4.219 1.00 0.00 C ATOM 0 H ALA A 17 -3.458 -10.651 1.845 1.00 0.00 H new ATOM 0 HA ALA A 17 -2.433 -8.853 3.833 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.013 -10.054 5.298 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.781 -9.538 3.778 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.305 -11.238 4.002 1.00 0.00 H new ATOM 281 N GLU A 18 -0.666 -10.124 4.956 1.00 0.00 N ATOM 282 CA GLU A 18 0.358 -10.844 5.690 1.00 0.00 C ATOM 283 C GLU A 18 -0.101 -11.080 7.126 1.00 0.00 C ATOM 284 O GLU A 18 0.222 -12.101 7.734 1.00 0.00 O ATOM 285 CB GLU A 18 1.683 -10.084 5.655 1.00 0.00 C ATOM 286 CG GLU A 18 2.280 -9.946 4.257 1.00 0.00 C ATOM 287 CD GLU A 18 2.571 -11.283 3.590 1.00 0.00 C ATOM 288 OE1 GLU A 18 2.775 -12.288 4.307 1.00 0.00 O ATOM 289 OE2 GLU A 18 2.595 -11.339 2.342 1.00 0.00 O ATOM 0 H GLU A 18 -0.589 -9.108 5.006 1.00 0.00 H new ATOM 0 HA GLU A 18 0.519 -11.812 5.214 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.531 -9.089 6.074 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.401 -10.595 6.297 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.592 -9.378 3.631 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.204 -9.371 4.319 1.00 0.00 H new ATOM 296 N SER A 19 -0.864 -10.135 7.658 1.00 0.00 N ATOM 297 CA SER A 19 -1.477 -10.288 8.966 1.00 0.00 C ATOM 298 C SER A 19 -2.989 -10.398 8.810 1.00 0.00 C ATOM 299 O SER A 19 -3.530 -10.165 7.726 1.00 0.00 O ATOM 300 CB SER A 19 -1.120 -9.103 9.872 1.00 0.00 C ATOM 301 OG SER A 19 -1.666 -9.253 11.178 1.00 0.00 O ATOM 0 H SER A 19 -1.073 -9.249 7.198 1.00 0.00 H new ATOM 0 HA SER A 19 -1.096 -11.197 9.431 1.00 0.00 H new ATOM 0 HB2 SER A 19 -0.036 -9.011 9.940 1.00 0.00 H new ATOM 0 HB3 SER A 19 -1.491 -8.180 9.427 1.00 0.00 H new ATOM 0 HG SER A 19 -1.898 -8.372 11.539 1.00 0.00 H new ATOM 307 N GLN A 20 -3.666 -10.758 9.892 1.00 0.00 N ATOM 308 CA GLN A 20 -5.117 -10.893 9.888 1.00 0.00 C ATOM 309 C GLN A 20 -5.780 -9.515 9.911 1.00 0.00 C ATOM 310 O GLN A 20 -6.981 -9.380 9.671 1.00 0.00 O ATOM 311 CB GLN A 20 -5.565 -11.723 11.097 1.00 0.00 C ATOM 312 CG GLN A 20 -7.008 -12.191 11.029 1.00 0.00 C ATOM 313 CD GLN A 20 -7.270 -13.100 9.844 1.00 0.00 C ATOM 314 OE1 GLN A 20 -6.375 -13.804 9.376 1.00 0.00 O ATOM 315 NE2 GLN A 20 -8.496 -13.092 9.354 1.00 0.00 N ATOM 0 H GLN A 20 -3.230 -10.963 10.791 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.423 -11.405 8.976 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.916 -12.594 11.186 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -5.429 -11.130 12.001 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -7.259 -12.718 11.949 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -7.665 -11.323 10.969 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -9.208 -12.493 9.772 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -8.731 -13.685 8.558 1.00 0.00 H new ATOM 324 N ASP A 21 -4.983 -8.493 10.204 1.00 0.00 N ATOM 325 CA ASP A 21 -5.472 -7.118 10.238 1.00 0.00 C ATOM 326 C ASP A 21 -5.739 -6.625 8.825 1.00 0.00 C ATOM 327 O ASP A 21 -6.700 -5.898 8.577 1.00 0.00 O ATOM 328 CB ASP A 21 -4.455 -6.193 10.910 1.00 0.00 C ATOM 329 CG ASP A 21 -3.987 -6.708 12.253 1.00 0.00 C ATOM 330 OD1 ASP A 21 -4.786 -6.701 13.211 1.00 0.00 O ATOM 331 OD2 ASP A 21 -2.810 -7.115 12.354 1.00 0.00 O ATOM 0 H ASP A 21 -3.991 -8.591 10.422 1.00 0.00 H new ATOM 0 HA ASP A 21 -6.397 -7.103 10.815 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -3.594 -6.071 10.253 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -4.899 -5.206 11.040 1.00 0.00 H new ATOM 336 N GLU A 22 -4.877 -7.031 7.906 1.00 0.00 N ATOM 337 CA GLU A 22 -5.013 -6.666 6.508 1.00 0.00 C ATOM 338 C GLU A 22 -6.069 -7.532 5.832 1.00 0.00 C ATOM 339 O GLU A 22 -6.695 -8.381 6.471 1.00 0.00 O ATOM 340 CB GLU A 22 -3.684 -6.808 5.780 1.00 0.00 C ATOM 341 CG GLU A 22 -2.628 -5.834 6.260 1.00 0.00 C ATOM 342 CD GLU A 22 -1.876 -6.332 7.475 1.00 0.00 C ATOM 343 OE1 GLU A 22 -1.136 -7.331 7.353 1.00 0.00 O ATOM 344 OE2 GLU A 22 -2.012 -5.724 8.557 1.00 0.00 O ATOM 0 H GLU A 22 -4.069 -7.619 8.108 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.326 -5.623 6.461 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.315 -7.825 5.909 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -3.846 -6.660 4.712 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -1.920 -5.646 5.453 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.101 -4.881 6.497 1.00 0.00 H new ATOM 351 N LEU A 23 -6.263 -7.320 4.542 1.00 0.00 N ATOM 352 CA LEU A 23 -7.208 -8.116 3.780 1.00 0.00 C ATOM 353 C LEU A 23 -6.648 -8.421 2.399 1.00 0.00 C ATOM 354 O LEU A 23 -6.177 -7.523 1.703 1.00 0.00 O ATOM 355 CB LEU A 23 -8.542 -7.380 3.657 1.00 0.00 C ATOM 356 CG LEU A 23 -9.680 -8.196 3.048 1.00 0.00 C ATOM 357 CD1 LEU A 23 -9.991 -9.410 3.907 1.00 0.00 C ATOM 358 CD2 LEU A 23 -10.917 -7.332 2.884 1.00 0.00 C ATOM 0 H LEU A 23 -5.779 -6.604 4.001 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.374 -9.056 4.306 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.847 -7.045 4.648 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.392 -6.487 3.051 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.365 -8.546 2.065 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.805 -9.977 3.455 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.105 -10.041 3.979 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.287 -9.084 4.904 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.721 -7.926 2.449 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.230 -6.956 3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.690 -6.492 2.227 1.00 0.00 H new ATOM 370 N THR A 24 -6.682 -9.688 2.019 1.00 0.00 N ATOM 371 CA THR A 24 -6.194 -10.105 0.714 1.00 0.00 C ATOM 372 C THR A 24 -7.161 -9.679 -0.388 1.00 0.00 C ATOM 373 O THR A 24 -8.256 -10.228 -0.525 1.00 0.00 O ATOM 374 CB THR A 24 -5.986 -11.632 0.659 1.00 0.00 C ATOM 375 OG1 THR A 24 -5.101 -12.039 1.712 1.00 0.00 O ATOM 376 CG2 THR A 24 -5.408 -12.057 -0.682 1.00 0.00 C ATOM 0 H THR A 24 -7.043 -10.447 2.597 1.00 0.00 H new ATOM 0 HA THR A 24 -5.233 -9.616 0.553 1.00 0.00 H new ATOM 0 HB THR A 24 -6.956 -12.113 0.785 1.00 0.00 H new ATOM 0 HG1 THR A 24 -4.973 -13.010 1.675 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.272 -13.138 -0.693 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.092 -11.769 -1.481 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.446 -11.568 -0.835 1.00 0.00 H new ATOM 384 N ILE A 25 -6.750 -8.687 -1.160 1.00 0.00 N ATOM 385 CA ILE A 25 -7.557 -8.177 -2.248 1.00 0.00 C ATOM 386 C ILE A 25 -6.792 -8.286 -3.560 1.00 0.00 C ATOM 387 O ILE A 25 -5.693 -7.752 -3.704 1.00 0.00 O ATOM 388 CB ILE A 25 -7.982 -6.709 -2.006 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.762 -5.842 -1.677 1.00 0.00 C ATOM 390 CG2 ILE A 25 -9.010 -6.637 -0.886 1.00 0.00 C ATOM 391 CD1 ILE A 25 -7.091 -4.380 -1.471 1.00 0.00 C ATOM 0 H ILE A 25 -5.852 -8.217 -1.049 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.462 -8.782 -2.301 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.436 -6.323 -2.919 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.286 -6.228 -0.776 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.036 -5.931 -2.485 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.301 -5.599 -0.725 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.888 -7.222 -1.160 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.578 -7.039 0.031 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -6.178 -3.830 -1.242 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.539 -3.977 -2.379 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.793 -4.278 -0.643 1.00 0.00 H new ATOM 403 N LYS A 26 -7.356 -9.011 -4.505 1.00 0.00 N ATOM 404 CA LYS A 26 -6.717 -9.178 -5.799 1.00 0.00 C ATOM 405 C LYS A 26 -7.221 -8.131 -6.773 1.00 0.00 C ATOM 406 O LYS A 26 -8.331 -7.620 -6.624 1.00 0.00 O ATOM 407 CB LYS A 26 -6.982 -10.571 -6.362 1.00 0.00 C ATOM 408 CG LYS A 26 -6.277 -11.685 -5.606 1.00 0.00 C ATOM 409 CD LYS A 26 -6.520 -13.026 -6.270 1.00 0.00 C ATOM 410 CE LYS A 26 -5.727 -14.138 -5.603 1.00 0.00 C ATOM 411 NZ LYS A 26 -5.927 -15.439 -6.287 1.00 0.00 N ATOM 0 H LYS A 26 -8.250 -9.492 -4.405 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.643 -9.056 -5.662 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -8.056 -10.759 -6.349 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -6.666 -10.597 -7.405 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -5.207 -11.483 -5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.634 -11.714 -4.577 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.583 -13.264 -6.231 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -6.246 -12.965 -7.323 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -4.667 -13.883 -5.608 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -6.029 -14.225 -4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -5.371 -16.174 -5.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.935 -15.694 -6.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -5.615 -15.363 -7.276 1.00 0.00 H new ATOM 425 N SER A 27 -6.403 -7.811 -7.761 1.00 0.00 N ATOM 426 CA SER A 27 -6.802 -6.898 -8.813 1.00 0.00 C ATOM 427 C SER A 27 -8.049 -7.436 -9.503 1.00 0.00 C ATOM 428 O SER A 27 -8.024 -8.513 -10.108 1.00 0.00 O ATOM 429 CB SER A 27 -5.663 -6.716 -9.816 1.00 0.00 C ATOM 430 OG SER A 27 -5.995 -5.759 -10.810 1.00 0.00 O ATOM 0 H SER A 27 -5.454 -8.173 -7.855 1.00 0.00 H new ATOM 0 HA SER A 27 -7.030 -5.924 -8.381 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.761 -6.400 -9.291 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.437 -7.671 -10.290 1.00 0.00 H new ATOM 0 HG SER A 27 -5.716 -4.868 -10.512 1.00 0.00 H new ATOM 436 N GLY A 28 -9.139 -6.698 -9.388 1.00 0.00 N ATOM 437 CA GLY A 28 -10.397 -7.148 -9.940 1.00 0.00 C ATOM 438 C GLY A 28 -11.398 -7.511 -8.866 1.00 0.00 C ATOM 439 O GLY A 28 -12.512 -7.938 -9.171 1.00 0.00 O ATOM 0 H GLY A 28 -9.175 -5.792 -8.921 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -10.814 -6.365 -10.573 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.222 -8.014 -10.578 1.00 0.00 H new ATOM 443 N ASP A 29 -11.013 -7.343 -7.606 1.00 0.00 N ATOM 444 CA ASP A 29 -11.924 -7.613 -6.500 1.00 0.00 C ATOM 445 C ASP A 29 -12.919 -6.473 -6.337 1.00 0.00 C ATOM 446 O ASP A 29 -12.791 -5.421 -6.971 1.00 0.00 O ATOM 447 CB ASP A 29 -11.177 -7.817 -5.178 1.00 0.00 C ATOM 448 CG ASP A 29 -11.585 -9.094 -4.480 1.00 0.00 C ATOM 449 OD1 ASP A 29 -12.788 -9.258 -4.169 1.00 0.00 O ATOM 450 OD2 ASP A 29 -10.703 -9.944 -4.238 1.00 0.00 O ATOM 0 H ASP A 29 -10.085 -7.024 -7.326 1.00 0.00 H new ATOM 0 HA ASP A 29 -12.452 -8.535 -6.743 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.104 -7.837 -5.369 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -11.368 -6.969 -4.520 1.00 0.00 H new ATOM 455 N LYS A 30 -13.898 -6.688 -5.478 1.00 0.00 N ATOM 456 CA LYS A 30 -14.942 -5.714 -5.227 1.00 0.00 C ATOM 457 C LYS A 30 -15.092 -5.512 -3.724 1.00 0.00 C ATOM 458 O LYS A 30 -15.437 -6.451 -3.004 1.00 0.00 O ATOM 459 CB LYS A 30 -16.241 -6.226 -5.821 1.00 0.00 C ATOM 460 CG LYS A 30 -17.220 -5.137 -6.206 1.00 0.00 C ATOM 461 CD LYS A 30 -18.285 -5.706 -7.111 1.00 0.00 C ATOM 462 CE LYS A 30 -19.248 -4.644 -7.609 1.00 0.00 C ATOM 463 NZ LYS A 30 -20.302 -5.227 -8.484 1.00 0.00 N ATOM 0 H LYS A 30 -13.991 -7.546 -4.934 1.00 0.00 H new ATOM 0 HA LYS A 30 -14.687 -4.759 -5.686 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -16.013 -6.823 -6.704 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -16.719 -6.891 -5.102 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -17.677 -4.713 -5.312 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -16.696 -4.326 -6.711 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -17.812 -6.192 -7.964 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -18.841 -6.475 -6.575 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -19.714 -4.147 -6.758 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -18.697 -3.882 -8.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -20.942 -4.473 -8.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -19.858 -5.679 -9.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -20.844 -5.936 -7.950 1.00 0.00 H new ATOM 477 N VAL A 31 -14.821 -4.309 -3.240 1.00 0.00 N ATOM 478 CA VAL A 31 -14.834 -4.075 -1.803 1.00 0.00 C ATOM 479 C VAL A 31 -15.704 -2.883 -1.417 1.00 0.00 C ATOM 480 O VAL A 31 -15.800 -1.897 -2.151 1.00 0.00 O ATOM 481 CB VAL A 31 -13.409 -3.866 -1.239 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.619 -5.164 -1.282 1.00 0.00 C ATOM 483 CG2 VAL A 31 -12.672 -2.772 -2.000 1.00 0.00 C ATOM 0 H VAL A 31 -14.593 -3.493 -3.808 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.263 -4.975 -1.363 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.505 -3.551 -0.200 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.620 -4.995 -0.881 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -13.128 -5.919 -0.683 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.543 -5.509 -2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -11.673 -2.647 -1.582 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -12.593 -3.050 -3.051 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.222 -1.835 -1.913 1.00 0.00 H new ATOM 493 N TYR A 32 -16.363 -3.005 -0.271 1.00 0.00 N ATOM 494 CA TYR A 32 -17.068 -1.890 0.341 1.00 0.00 C ATOM 495 C TYR A 32 -16.165 -1.224 1.367 1.00 0.00 C ATOM 496 O TYR A 32 -15.505 -1.901 2.151 1.00 0.00 O ATOM 497 CB TYR A 32 -18.361 -2.351 1.024 1.00 0.00 C ATOM 498 CG TYR A 32 -19.498 -2.642 0.073 1.00 0.00 C ATOM 499 CD1 TYR A 32 -20.291 -1.613 -0.423 1.00 0.00 C ATOM 500 CD2 TYR A 32 -19.787 -3.940 -0.317 1.00 0.00 C ATOM 501 CE1 TYR A 32 -21.340 -1.871 -1.283 1.00 0.00 C ATOM 502 CE2 TYR A 32 -20.834 -4.206 -1.179 1.00 0.00 C ATOM 503 CZ TYR A 32 -21.608 -3.169 -1.658 1.00 0.00 C ATOM 504 OH TYR A 32 -22.649 -3.432 -2.521 1.00 0.00 O ATOM 0 H TYR A 32 -16.423 -3.876 0.257 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.333 -1.183 -0.445 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -18.151 -3.249 1.605 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.680 -1.583 1.728 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -20.083 -0.594 -0.131 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -19.186 -4.755 0.058 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -21.946 -1.060 -1.659 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -21.046 -5.222 -1.477 1.00 0.00 H new ATOM 0 HH TYR A 32 -22.702 -4.397 -2.685 1.00 0.00 H new ATOM 514 N ILE A 33 -16.125 0.094 1.353 1.00 0.00 N ATOM 515 CA ILE A 33 -15.305 0.837 2.292 1.00 0.00 C ATOM 516 C ILE A 33 -16.128 1.210 3.518 1.00 0.00 C ATOM 517 O ILE A 33 -17.061 2.009 3.428 1.00 0.00 O ATOM 518 CB ILE A 33 -14.724 2.116 1.653 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.023 1.782 0.331 1.00 0.00 C ATOM 520 CG2 ILE A 33 -13.758 2.797 2.614 1.00 0.00 C ATOM 521 CD1 ILE A 33 -13.547 3.000 -0.433 1.00 0.00 C ATOM 0 H ILE A 33 -16.652 0.674 0.700 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.473 0.196 2.584 1.00 0.00 H new ATOM 0 HB ILE A 33 -15.544 2.803 1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.169 1.137 0.536 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.707 1.214 -0.299 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -13.357 3.697 2.149 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -14.285 3.065 3.530 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -12.941 2.116 2.852 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.062 2.684 -1.356 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.399 3.636 -0.671 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -12.837 3.558 0.177 1.00 0.00 H new ATOM 533 N LEU A 34 -15.789 0.601 4.647 1.00 0.00 N ATOM 534 CA LEU A 34 -16.490 0.848 5.901 1.00 0.00 C ATOM 535 C LEU A 34 -15.967 2.116 6.558 1.00 0.00 C ATOM 536 O LEU A 34 -16.733 3.018 6.894 1.00 0.00 O ATOM 537 CB LEU A 34 -16.304 -0.336 6.852 1.00 0.00 C ATOM 538 CG LEU A 34 -16.780 -1.686 6.317 1.00 0.00 C ATOM 539 CD1 LEU A 34 -16.440 -2.792 7.303 1.00 0.00 C ATOM 540 CD2 LEU A 34 -18.276 -1.655 6.047 1.00 0.00 C ATOM 0 H LEU A 34 -15.027 -0.073 4.720 1.00 0.00 H new ATOM 0 HA LEU A 34 -17.551 0.971 5.684 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.246 -0.416 7.103 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -16.837 -0.123 7.779 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.266 -1.888 5.377 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -16.784 -3.748 6.910 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -15.361 -2.828 7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -16.931 -2.593 8.256 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -18.597 -2.625 5.667 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -18.808 -1.434 6.972 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -18.497 -0.884 5.308 1.00 0.00 H new ATOM 552 N ASP A 35 -14.657 2.167 6.757 1.00 0.00 N ATOM 553 CA ASP A 35 -14.017 3.347 7.312 1.00 0.00 C ATOM 554 C ASP A 35 -12.988 3.890 6.340 1.00 0.00 C ATOM 555 O ASP A 35 -11.920 3.297 6.147 1.00 0.00 O ATOM 556 CB ASP A 35 -13.359 3.044 8.661 1.00 0.00 C ATOM 557 CG ASP A 35 -14.352 2.995 9.806 1.00 0.00 C ATOM 558 OD1 ASP A 35 -15.034 1.966 9.969 1.00 0.00 O ATOM 559 OD2 ASP A 35 -14.446 3.987 10.563 1.00 0.00 O ATOM 0 H ASP A 35 -14.017 1.402 6.541 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.788 4.100 7.476 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -12.837 2.089 8.598 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.607 3.805 8.871 1.00 0.00 H new ATOM 564 N ASP A 36 -13.337 5.004 5.715 1.00 0.00 N ATOM 565 CA ASP A 36 -12.475 5.689 4.759 1.00 0.00 C ATOM 566 C ASP A 36 -11.704 6.800 5.458 1.00 0.00 C ATOM 567 O ASP A 36 -10.674 7.268 4.979 1.00 0.00 O ATOM 568 CB ASP A 36 -13.330 6.287 3.638 1.00 0.00 C ATOM 569 CG ASP A 36 -14.297 7.349 4.141 1.00 0.00 C ATOM 570 OD1 ASP A 36 -14.940 7.129 5.188 1.00 0.00 O ATOM 571 OD2 ASP A 36 -14.423 8.397 3.479 1.00 0.00 O ATOM 0 H ASP A 36 -14.236 5.464 5.858 1.00 0.00 H new ATOM 0 HA ASP A 36 -11.768 4.974 4.338 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.677 6.724 2.882 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.892 5.490 3.151 1.00 0.00 H new ATOM 576 N LYS A 37 -12.220 7.221 6.599 1.00 0.00 N ATOM 577 CA LYS A 37 -11.613 8.301 7.355 1.00 0.00 C ATOM 578 C LYS A 37 -11.136 7.819 8.716 1.00 0.00 C ATOM 579 O LYS A 37 -10.907 8.626 9.621 1.00 0.00 O ATOM 580 CB LYS A 37 -12.614 9.441 7.521 1.00 0.00 C ATOM 581 CG LYS A 37 -13.009 10.087 6.204 1.00 0.00 C ATOM 582 CD LYS A 37 -14.076 11.146 6.404 1.00 0.00 C ATOM 583 CE LYS A 37 -15.392 10.533 6.855 1.00 0.00 C ATOM 584 NZ LYS A 37 -16.429 11.569 7.099 1.00 0.00 N ATOM 0 H LYS A 37 -13.061 6.830 7.023 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.744 8.660 6.803 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.509 9.061 8.015 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -12.186 10.199 8.176 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.131 10.536 5.740 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.376 9.323 5.518 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -13.737 11.870 7.146 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -14.228 11.691 5.473 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -15.747 9.835 6.096 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -15.231 9.958 7.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.312 11.112 7.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.101 12.220 7.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.601 12.101 6.222 1.00 0.00 H new ATOM 598 N LYS A 38 -10.976 6.506 8.858 1.00 0.00 N ATOM 599 CA LYS A 38 -10.488 5.931 10.104 1.00 0.00 C ATOM 600 C LYS A 38 -9.078 6.445 10.379 1.00 0.00 C ATOM 601 O LYS A 38 -8.756 6.858 11.491 1.00 0.00 O ATOM 602 CB LYS A 38 -10.490 4.403 10.035 1.00 0.00 C ATOM 603 CG LYS A 38 -10.397 3.739 11.397 1.00 0.00 C ATOM 604 CD LYS A 38 -10.363 2.226 11.284 1.00 0.00 C ATOM 605 CE LYS A 38 -10.514 1.560 12.642 1.00 0.00 C ATOM 606 NZ LYS A 38 -9.447 1.967 13.594 1.00 0.00 N ATOM 0 H LYS A 38 -11.177 5.824 8.127 1.00 0.00 H new ATOM 0 HA LYS A 38 -11.150 6.232 10.916 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -11.401 4.070 9.538 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.653 4.073 9.420 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -9.500 4.086 11.910 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.249 4.039 12.007 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.163 1.892 10.623 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -9.423 1.916 10.828 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -11.488 1.813 13.062 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -10.492 0.477 12.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -9.533 1.412 14.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -8.515 1.796 13.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -9.546 2.979 13.815 1.00 0.00 H new ATOM 620 N SER A 39 -8.250 6.426 9.346 1.00 0.00 N ATOM 621 CA SER A 39 -6.931 7.031 9.409 1.00 0.00 C ATOM 622 C SER A 39 -6.787 8.033 8.269 1.00 0.00 C ATOM 623 O SER A 39 -6.995 9.234 8.456 1.00 0.00 O ATOM 624 CB SER A 39 -5.845 5.955 9.332 1.00 0.00 C ATOM 625 OG SER A 39 -6.081 4.929 10.286 1.00 0.00 O ATOM 0 H SER A 39 -8.471 5.995 8.449 1.00 0.00 H new ATOM 0 HA SER A 39 -6.813 7.553 10.359 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.821 5.527 8.330 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.868 6.405 9.510 1.00 0.00 H new ATOM 0 HG SER A 39 -5.376 4.251 10.218 1.00 0.00 H new ATOM 631 N LYS A 40 -6.479 7.523 7.078 1.00 0.00 N ATOM 632 CA LYS A 40 -6.416 8.341 5.872 1.00 0.00 C ATOM 633 C LYS A 40 -6.144 7.461 4.663 1.00 0.00 C ATOM 634 O LYS A 40 -6.891 7.492 3.690 1.00 0.00 O ATOM 635 CB LYS A 40 -5.345 9.433 5.975 1.00 0.00 C ATOM 636 CG LYS A 40 -5.320 10.364 4.771 1.00 0.00 C ATOM 637 CD LYS A 40 -6.700 10.949 4.498 1.00 0.00 C ATOM 638 CE LYS A 40 -6.714 11.826 3.255 1.00 0.00 C ATOM 639 NZ LYS A 40 -5.902 13.059 3.428 1.00 0.00 N ATOM 0 H LYS A 40 -6.268 6.537 6.924 1.00 0.00 H new ATOM 0 HA LYS A 40 -7.381 8.835 5.758 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.520 10.020 6.877 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -4.367 8.964 6.084 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -4.608 11.171 4.947 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -4.973 9.819 3.893 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -7.419 10.139 4.378 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -7.021 11.536 5.359 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -6.332 11.257 2.407 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -7.742 12.100 3.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -6.009 13.665 2.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -6.227 13.573 4.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.901 12.802 3.544 1.00 0.00 H new ATOM 653 N ASP A 41 -5.072 6.683 4.730 1.00 0.00 N ATOM 654 CA ASP A 41 -4.735 5.764 3.647 1.00 0.00 C ATOM 655 C ASP A 41 -5.243 4.366 3.967 1.00 0.00 C ATOM 656 O ASP A 41 -5.882 3.724 3.147 1.00 0.00 O ATOM 657 CB ASP A 41 -3.224 5.727 3.419 1.00 0.00 C ATOM 658 CG ASP A 41 -2.848 5.068 2.103 1.00 0.00 C ATOM 659 OD1 ASP A 41 -2.893 3.824 2.017 1.00 0.00 O ATOM 660 OD2 ASP A 41 -2.510 5.802 1.149 1.00 0.00 O ATOM 0 H ASP A 41 -4.423 6.668 5.517 1.00 0.00 H new ATOM 0 HA ASP A 41 -5.216 6.120 2.736 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.833 6.744 3.437 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.750 5.189 4.239 1.00 0.00 H new ATOM 665 N TRP A 42 -4.964 3.904 5.174 1.00 0.00 N ATOM 666 CA TRP A 42 -5.406 2.582 5.591 1.00 0.00 C ATOM 667 C TRP A 42 -6.910 2.569 5.821 1.00 0.00 C ATOM 668 O TRP A 42 -7.417 3.172 6.772 1.00 0.00 O ATOM 669 CB TRP A 42 -4.658 2.128 6.844 1.00 0.00 C ATOM 670 CG TRP A 42 -3.282 1.609 6.548 1.00 0.00 C ATOM 671 CD1 TRP A 42 -2.108 2.306 6.585 1.00 0.00 C ATOM 672 CD2 TRP A 42 -2.943 0.276 6.153 1.00 0.00 C ATOM 673 NE1 TRP A 42 -1.060 1.480 6.257 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.548 0.232 5.980 1.00 0.00 C ATOM 675 CE3 TRP A 42 -3.684 -0.889 5.932 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -0.880 -0.925 5.593 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -3.020 -2.038 5.548 1.00 0.00 C ATOM 678 CH2 TRP A 42 -1.630 -2.050 5.382 1.00 0.00 C ATOM 0 H TRP A 42 -4.437 4.420 5.879 1.00 0.00 H new ATOM 0 HA TRP A 42 -5.178 1.877 4.791 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -4.583 2.964 7.539 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -5.235 1.349 7.343 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -2.017 3.353 6.835 1.00 0.00 H new ATOM 0 HE1 TRP A 42 -0.078 1.753 6.225 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.756 -0.891 6.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 0.192 -0.935 5.464 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -3.583 -2.943 5.373 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -1.140 -2.965 5.082 1.00 0.00 H new ATOM 689 N TRP A 43 -7.610 1.890 4.928 1.00 0.00 N ATOM 690 CA TRP A 43 -9.062 1.836 4.945 1.00 0.00 C ATOM 691 C TRP A 43 -9.557 0.468 5.374 1.00 0.00 C ATOM 692 O TRP A 43 -8.840 -0.526 5.267 1.00 0.00 O ATOM 693 CB TRP A 43 -9.611 2.150 3.554 1.00 0.00 C ATOM 694 CG TRP A 43 -9.423 3.573 3.142 1.00 0.00 C ATOM 695 CD1 TRP A 43 -9.107 4.618 3.955 1.00 0.00 C ATOM 696 CD2 TRP A 43 -9.557 4.114 1.824 1.00 0.00 C ATOM 697 NE1 TRP A 43 -9.047 5.775 3.231 1.00 0.00 N ATOM 698 CE2 TRP A 43 -9.320 5.496 1.922 1.00 0.00 C ATOM 699 CE3 TRP A 43 -9.854 3.569 0.570 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -9.378 6.341 0.821 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -9.910 4.410 -0.522 1.00 0.00 C ATOM 702 CH2 TRP A 43 -9.676 5.783 -0.389 1.00 0.00 C ATOM 0 H TRP A 43 -7.186 1.359 4.168 1.00 0.00 H new ATOM 0 HA TRP A 43 -9.414 2.577 5.663 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.123 1.503 2.826 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.674 1.911 3.530 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.930 4.543 5.018 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -8.833 6.699 3.607 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.036 2.510 0.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -9.194 7.401 0.919 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.138 4.002 -1.496 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.732 6.415 -1.263 1.00 0.00 H new ATOM 713 N MET A 44 -10.789 0.416 5.854 1.00 0.00 N ATOM 714 CA MET A 44 -11.416 -0.858 6.170 1.00 0.00 C ATOM 715 C MET A 44 -12.317 -1.271 5.024 1.00 0.00 C ATOM 716 O MET A 44 -13.426 -0.757 4.889 1.00 0.00 O ATOM 717 CB MET A 44 -12.245 -0.787 7.456 1.00 0.00 C ATOM 718 CG MET A 44 -11.498 -0.215 8.644 1.00 0.00 C ATOM 719 SD MET A 44 -12.345 -0.526 10.207 1.00 0.00 S ATOM 720 CE MET A 44 -12.311 -2.317 10.263 1.00 0.00 C ATOM 0 H MET A 44 -11.371 1.234 6.032 1.00 0.00 H new ATOM 0 HA MET A 44 -10.622 -1.590 6.321 1.00 0.00 H new ATOM 0 HB2 MET A 44 -13.131 -0.180 7.271 1.00 0.00 H new ATOM 0 HB3 MET A 44 -12.592 -1.789 7.707 1.00 0.00 H new ATOM 0 HG2 MET A 44 -10.499 -0.648 8.684 1.00 0.00 H new ATOM 0 HG3 MET A 44 -11.375 0.860 8.509 1.00 0.00 H new ATOM 0 HE1 MET A 44 -12.035 -2.645 11.265 1.00 0.00 H new ATOM 0 HE2 MET A 44 -13.297 -2.708 10.012 1.00 0.00 H new ATOM 0 HE3 MET A 44 -11.580 -2.690 9.545 1.00 0.00 H new ATOM 730 N CYS A 45 -11.837 -2.168 4.186 1.00 0.00 N ATOM 731 CA CYS A 45 -12.628 -2.643 3.065 1.00 0.00 C ATOM 732 C CYS A 45 -13.250 -3.985 3.407 1.00 0.00 C ATOM 733 O CYS A 45 -12.699 -4.741 4.206 1.00 0.00 O ATOM 734 CB CYS A 45 -11.770 -2.767 1.805 1.00 0.00 C ATOM 735 SG CYS A 45 -10.543 -4.089 1.876 1.00 0.00 S ATOM 0 H CYS A 45 -10.908 -2.582 4.258 1.00 0.00 H new ATOM 0 HA CYS A 45 -13.418 -1.919 2.868 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -12.423 -2.938 0.949 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -11.259 -1.820 1.632 1.00 0.00 H new ATOM 0 HG CYS A 45 -10.613 -4.684 3.030 1.00 0.00 H new ATOM 741 N GLN A 46 -14.399 -4.262 2.825 1.00 0.00 N ATOM 742 CA GLN A 46 -15.075 -5.525 3.036 1.00 0.00 C ATOM 743 C GLN A 46 -15.407 -6.172 1.696 1.00 0.00 C ATOM 744 O GLN A 46 -16.037 -5.549 0.839 1.00 0.00 O ATOM 745 CB GLN A 46 -16.349 -5.310 3.858 1.00 0.00 C ATOM 746 CG GLN A 46 -17.091 -6.596 4.172 1.00 0.00 C ATOM 747 CD GLN A 46 -18.365 -6.371 4.967 1.00 0.00 C ATOM 748 OE1 GLN A 46 -19.338 -7.110 4.821 1.00 0.00 O ATOM 749 NE2 GLN A 46 -18.367 -5.367 5.827 1.00 0.00 N ATOM 0 H GLN A 46 -14.887 -3.623 2.197 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.414 -6.192 3.589 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -16.089 -4.812 4.792 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.014 -4.640 3.314 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -17.337 -7.103 3.239 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.433 -7.260 4.732 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -17.542 -4.775 5.921 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -19.194 -5.185 6.396 1.00 0.00 H new ATOM 758 N LEU A 47 -14.962 -7.410 1.519 1.00 0.00 N ATOM 759 CA LEU A 47 -15.225 -8.161 0.298 1.00 0.00 C ATOM 760 C LEU A 47 -16.714 -8.454 0.169 1.00 0.00 C ATOM 761 O LEU A 47 -17.332 -8.990 1.089 1.00 0.00 O ATOM 762 CB LEU A 47 -14.429 -9.472 0.295 1.00 0.00 C ATOM 763 CG LEU A 47 -12.906 -9.318 0.298 1.00 0.00 C ATOM 764 CD1 LEU A 47 -12.238 -10.661 0.542 1.00 0.00 C ATOM 765 CD2 LEU A 47 -12.419 -8.719 -1.015 1.00 0.00 C ATOM 0 H LEU A 47 -14.413 -7.918 2.212 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.910 -7.558 -0.554 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -14.720 -10.055 1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -14.717 -10.049 -0.584 1.00 0.00 H new ATOM 0 HG LEU A 47 -12.635 -8.639 1.106 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.155 -10.534 0.541 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -12.556 -11.056 1.507 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -12.522 -11.357 -0.247 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -11.334 -8.619 -0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.704 -9.371 -1.840 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.870 -7.737 -1.156 1.00 0.00 H new ATOM 777 N VAL A 48 -17.277 -8.111 -0.979 1.00 0.00 N ATOM 778 CA VAL A 48 -18.716 -8.229 -1.208 1.00 0.00 C ATOM 779 C VAL A 48 -19.183 -9.686 -1.144 1.00 0.00 C ATOM 780 O VAL A 48 -20.308 -9.968 -0.726 1.00 0.00 O ATOM 781 CB VAL A 48 -19.106 -7.631 -2.578 1.00 0.00 C ATOM 782 CG1 VAL A 48 -20.613 -7.633 -2.766 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.555 -6.223 -2.727 1.00 0.00 C ATOM 0 H VAL A 48 -16.757 -7.745 -1.776 1.00 0.00 H new ATOM 0 HA VAL A 48 -19.209 -7.670 -0.413 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.666 -8.259 -3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.859 -7.207 -3.739 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.985 -8.656 -2.714 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -21.078 -7.037 -1.981 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -18.841 -5.821 -3.699 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -18.960 -5.589 -1.938 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.468 -6.248 -2.651 1.00 0.00 H new ATOM 793 N ASP A 49 -18.305 -10.603 -1.536 1.00 0.00 N ATOM 794 CA ASP A 49 -18.659 -12.018 -1.663 1.00 0.00 C ATOM 795 C ASP A 49 -19.142 -12.623 -0.347 1.00 0.00 C ATOM 796 O ASP A 49 -20.290 -13.054 -0.243 1.00 0.00 O ATOM 797 CB ASP A 49 -17.478 -12.825 -2.198 1.00 0.00 C ATOM 798 CG ASP A 49 -17.171 -12.510 -3.644 1.00 0.00 C ATOM 799 OD1 ASP A 49 -17.865 -13.042 -4.534 1.00 0.00 O ATOM 800 OD2 ASP A 49 -16.225 -11.735 -3.906 1.00 0.00 O ATOM 0 H ASP A 49 -17.336 -10.393 -1.773 1.00 0.00 H new ATOM 0 HA ASP A 49 -19.486 -12.067 -2.371 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -16.597 -12.621 -1.590 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -17.694 -13.889 -2.099 1.00 0.00 H new ATOM 805 N SER A 50 -18.269 -12.673 0.650 1.00 0.00 N ATOM 806 CA SER A 50 -18.609 -13.297 1.926 1.00 0.00 C ATOM 807 C SER A 50 -18.749 -12.261 3.040 1.00 0.00 C ATOM 808 O SER A 50 -19.277 -12.555 4.116 1.00 0.00 O ATOM 809 CB SER A 50 -17.541 -14.323 2.301 1.00 0.00 C ATOM 810 OG SER A 50 -17.326 -15.250 1.248 1.00 0.00 O ATOM 0 H SER A 50 -17.324 -12.292 0.603 1.00 0.00 H new ATOM 0 HA SER A 50 -19.572 -13.794 1.810 1.00 0.00 H new ATOM 0 HB2 SER A 50 -16.607 -13.811 2.534 1.00 0.00 H new ATOM 0 HB3 SER A 50 -17.846 -14.856 3.202 1.00 0.00 H new ATOM 0 HG SER A 50 -16.637 -15.894 1.514 1.00 0.00 H new ATOM 816 N GLY A 51 -18.288 -11.048 2.786 1.00 0.00 N ATOM 817 CA GLY A 51 -18.327 -10.023 3.807 1.00 0.00 C ATOM 818 C GLY A 51 -17.099 -10.057 4.692 1.00 0.00 C ATOM 819 O GLY A 51 -17.183 -9.807 5.895 1.00 0.00 O ATOM 0 H GLY A 51 -17.889 -10.755 1.895 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.407 -9.044 3.335 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -19.219 -10.155 4.419 1.00 0.00 H new ATOM 823 N LYS A 52 -15.959 -10.383 4.102 1.00 0.00 N ATOM 824 CA LYS A 52 -14.700 -10.393 4.835 1.00 0.00 C ATOM 825 C LYS A 52 -14.085 -9.002 4.800 1.00 0.00 C ATOM 826 O LYS A 52 -13.808 -8.476 3.725 1.00 0.00 O ATOM 827 CB LYS A 52 -13.727 -11.400 4.222 1.00 0.00 C ATOM 828 CG LYS A 52 -14.286 -12.810 4.109 1.00 0.00 C ATOM 829 CD LYS A 52 -13.261 -13.767 3.520 1.00 0.00 C ATOM 830 CE LYS A 52 -13.839 -15.157 3.310 1.00 0.00 C ATOM 831 NZ LYS A 52 -14.286 -15.780 4.585 1.00 0.00 N ATOM 0 H LYS A 52 -15.879 -10.644 3.119 1.00 0.00 H new ATOM 0 HA LYS A 52 -14.897 -10.685 5.867 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -13.439 -11.054 3.229 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.820 -11.427 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -14.591 -13.162 5.094 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -15.179 -12.800 3.484 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.903 -13.375 2.568 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.399 -13.829 4.184 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -14.682 -15.098 2.622 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -13.089 -15.793 2.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -14.546 -16.772 4.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -13.514 -15.739 5.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -15.111 -15.265 4.953 1.00 0.00 H new ATOM 845 N SER A 53 -13.883 -8.404 5.960 1.00 0.00 N ATOM 846 CA SER A 53 -13.379 -7.042 6.021 1.00 0.00 C ATOM 847 C SER A 53 -11.961 -7.009 6.589 1.00 0.00 C ATOM 848 O SER A 53 -11.579 -7.871 7.384 1.00 0.00 O ATOM 849 CB SER A 53 -14.311 -6.179 6.874 1.00 0.00 C ATOM 850 OG SER A 53 -15.608 -6.747 6.950 1.00 0.00 O ATOM 0 H SER A 53 -14.058 -8.835 6.867 1.00 0.00 H new ATOM 0 HA SER A 53 -13.347 -6.641 5.008 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.898 -6.074 7.877 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.374 -5.177 6.449 1.00 0.00 H new ATOM 0 HG SER A 53 -16.183 -6.177 7.502 1.00 0.00 H new ATOM 856 N GLY A 54 -11.182 -6.021 6.165 1.00 0.00 N ATOM 857 CA GLY A 54 -9.826 -5.877 6.654 1.00 0.00 C ATOM 858 C GLY A 54 -9.218 -4.549 6.251 1.00 0.00 C ATOM 859 O GLY A 54 -9.785 -3.825 5.426 1.00 0.00 O ATOM 0 H GLY A 54 -11.468 -5.314 5.488 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -9.821 -5.964 7.741 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.212 -6.690 6.266 1.00 0.00 H new ATOM 863 N LEU A 55 -8.069 -4.230 6.834 1.00 0.00 N ATOM 864 CA LEU A 55 -7.379 -2.973 6.559 1.00 0.00 C ATOM 865 C LEU A 55 -6.557 -3.076 5.278 1.00 0.00 C ATOM 866 O LEU A 55 -5.764 -4.002 5.110 1.00 0.00 O ATOM 867 CB LEU A 55 -6.460 -2.583 7.730 1.00 0.00 C ATOM 868 CG LEU A 55 -7.143 -1.956 8.957 1.00 0.00 C ATOM 869 CD1 LEU A 55 -7.891 -0.695 8.565 1.00 0.00 C ATOM 870 CD2 LEU A 55 -8.080 -2.945 9.636 1.00 0.00 C ATOM 0 H LEU A 55 -7.591 -4.830 7.506 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.138 -2.201 6.434 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.925 -3.475 8.056 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.713 -1.881 7.359 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.364 -1.690 9.672 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -8.368 -0.266 9.446 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.192 0.027 8.143 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -8.652 -0.939 7.824 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -8.546 -2.470 10.499 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.852 -3.257 8.932 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.514 -3.817 9.963 1.00 0.00 H new ATOM 882 N VAL A 56 -6.752 -2.120 4.379 1.00 0.00 N ATOM 883 CA VAL A 56 -6.014 -2.083 3.122 1.00 0.00 C ATOM 884 C VAL A 56 -5.603 -0.654 2.774 1.00 0.00 C ATOM 885 O VAL A 56 -6.275 0.304 3.154 1.00 0.00 O ATOM 886 CB VAL A 56 -6.836 -2.661 1.947 1.00 0.00 C ATOM 887 CG1 VAL A 56 -7.146 -4.135 2.169 1.00 0.00 C ATOM 888 CG2 VAL A 56 -8.115 -1.861 1.743 1.00 0.00 C ATOM 0 H VAL A 56 -7.418 -1.356 4.497 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.128 -2.701 3.267 1.00 0.00 H new ATOM 0 HB VAL A 56 -6.235 -2.580 1.041 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -7.725 -4.516 1.328 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -6.214 -4.694 2.251 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.721 -4.252 3.087 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.680 -2.283 0.912 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.719 -1.902 2.650 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.864 -0.824 1.521 1.00 0.00 H new ATOM 898 N PRO A 57 -4.469 -0.499 2.076 1.00 0.00 N ATOM 899 CA PRO A 57 -3.999 0.803 1.579 1.00 0.00 C ATOM 900 C PRO A 57 -4.957 1.453 0.585 1.00 0.00 C ATOM 901 O PRO A 57 -5.504 0.787 -0.301 1.00 0.00 O ATOM 902 CB PRO A 57 -2.692 0.453 0.862 1.00 0.00 C ATOM 903 CG PRO A 57 -2.253 -0.820 1.490 1.00 0.00 C ATOM 904 CD PRO A 57 -3.522 -1.576 1.750 1.00 0.00 C ATOM 0 HA PRO A 57 -3.901 1.520 2.394 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.847 0.334 -0.210 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.946 1.237 0.991 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.588 -1.378 0.831 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.705 -0.637 2.414 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.841 -2.147 0.878 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.412 -2.283 2.572 1.00 0.00 H new ATOM 912 N ALA A 58 -5.119 2.763 0.715 1.00 0.00 N ATOM 913 CA ALA A 58 -5.893 3.548 -0.235 1.00 0.00 C ATOM 914 C ALA A 58 -5.119 3.666 -1.535 1.00 0.00 C ATOM 915 O ALA A 58 -5.666 4.009 -2.583 1.00 0.00 O ATOM 916 CB ALA A 58 -6.190 4.929 0.328 1.00 0.00 C ATOM 0 H ALA A 58 -4.719 3.309 1.479 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.843 3.047 -0.422 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -6.769 5.501 -0.397 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -6.760 4.830 1.252 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.253 5.447 0.534 1.00 0.00 H new ATOM 922 N GLN A 59 -3.832 3.366 -1.443 1.00 0.00 N ATOM 923 CA GLN A 59 -2.945 3.331 -2.596 1.00 0.00 C ATOM 924 C GLN A 59 -3.380 2.252 -3.578 1.00 0.00 C ATOM 925 O GLN A 59 -2.958 2.245 -4.734 1.00 0.00 O ATOM 926 CB GLN A 59 -1.512 3.054 -2.135 1.00 0.00 C ATOM 927 CG GLN A 59 -0.997 4.071 -1.132 1.00 0.00 C ATOM 928 CD GLN A 59 -0.743 5.426 -1.756 1.00 0.00 C ATOM 929 OE1 GLN A 59 -0.322 5.522 -2.909 1.00 0.00 O ATOM 930 NE2 GLN A 59 -1.032 6.477 -1.014 1.00 0.00 N ATOM 0 H GLN A 59 -3.371 3.139 -0.562 1.00 0.00 H new ATOM 0 HA GLN A 59 -2.991 4.298 -3.097 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.467 2.060 -1.690 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -0.854 3.045 -3.004 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.720 4.177 -0.324 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.073 3.701 -0.687 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -1.378 6.350 -0.063 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -0.909 7.417 -1.391 1.00 0.00 H new ATOM 939 N PHE A 60 -4.218 1.331 -3.114 1.00 0.00 N ATOM 940 CA PHE A 60 -4.646 0.222 -3.953 1.00 0.00 C ATOM 941 C PHE A 60 -6.140 0.287 -4.247 1.00 0.00 C ATOM 942 O PHE A 60 -6.625 -0.375 -5.164 1.00 0.00 O ATOM 943 CB PHE A 60 -4.299 -1.115 -3.290 1.00 0.00 C ATOM 944 CG PHE A 60 -2.829 -1.304 -3.041 1.00 0.00 C ATOM 945 CD1 PHE A 60 -1.893 -0.850 -3.955 1.00 0.00 C ATOM 946 CD2 PHE A 60 -2.384 -1.928 -1.892 1.00 0.00 C ATOM 947 CE1 PHE A 60 -0.544 -1.018 -3.730 1.00 0.00 C ATOM 948 CE2 PHE A 60 -1.034 -2.099 -1.658 1.00 0.00 C ATOM 949 CZ PHE A 60 -0.113 -1.644 -2.580 1.00 0.00 C ATOM 0 H PHE A 60 -4.610 1.331 -2.172 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.113 0.301 -4.900 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -4.831 -1.189 -2.342 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -4.659 -1.927 -3.921 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.225 -0.357 -4.857 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.101 -2.286 -1.168 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.174 -0.660 -4.453 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.699 -2.588 -0.755 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.944 -1.778 -2.401 1.00 0.00 H new ATOM 959 N ILE A 61 -6.864 1.097 -3.490 1.00 0.00 N ATOM 960 CA ILE A 61 -8.315 1.155 -3.617 1.00 0.00 C ATOM 961 C ILE A 61 -8.753 2.398 -4.385 1.00 0.00 C ATOM 962 O ILE A 61 -8.480 3.523 -3.974 1.00 0.00 O ATOM 963 CB ILE A 61 -9.011 1.143 -2.236 1.00 0.00 C ATOM 964 CG1 ILE A 61 -8.636 -0.121 -1.456 1.00 0.00 C ATOM 965 CG2 ILE A 61 -10.525 1.240 -2.395 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.049 -1.405 -2.145 1.00 0.00 C ATOM 0 H ILE A 61 -6.474 1.721 -2.784 1.00 0.00 H new ATOM 0 HA ILE A 61 -8.615 0.265 -4.170 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.668 2.011 -1.674 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -7.557 -0.134 -1.299 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.101 -0.081 -0.471 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -10.995 1.230 -1.412 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -10.778 2.167 -2.909 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -10.885 0.392 -2.978 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -8.751 -2.258 -1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.131 -1.415 -2.278 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -8.563 -1.468 -3.119 1.00 0.00 H new ATOM 978 N GLU A 62 -9.421 2.181 -5.509 1.00 0.00 N ATOM 979 CA GLU A 62 -10.006 3.269 -6.277 1.00 0.00 C ATOM 980 C GLU A 62 -11.448 3.484 -5.833 1.00 0.00 C ATOM 981 O GLU A 62 -12.298 2.609 -6.023 1.00 0.00 O ATOM 982 CB GLU A 62 -9.965 2.939 -7.771 1.00 0.00 C ATOM 983 CG GLU A 62 -10.569 4.011 -8.664 1.00 0.00 C ATOM 984 CD GLU A 62 -9.692 5.237 -8.789 1.00 0.00 C ATOM 985 OE1 GLU A 62 -8.769 5.223 -9.635 1.00 0.00 O ATOM 986 OE2 GLU A 62 -9.926 6.222 -8.061 1.00 0.00 O ATOM 0 H GLU A 62 -9.571 1.256 -5.911 1.00 0.00 H new ATOM 0 HA GLU A 62 -9.433 4.180 -6.103 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.929 2.777 -8.067 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.495 2.001 -7.939 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -10.745 3.594 -9.656 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -11.540 4.304 -8.265 1.00 0.00 H new ATOM 993 N PRO A 63 -11.740 4.631 -5.205 1.00 0.00 N ATOM 994 CA PRO A 63 -13.097 4.974 -4.783 1.00 0.00 C ATOM 995 C PRO A 63 -14.035 5.069 -5.978 1.00 0.00 C ATOM 996 O PRO A 63 -13.807 5.859 -6.897 1.00 0.00 O ATOM 997 CB PRO A 63 -12.941 6.345 -4.110 1.00 0.00 C ATOM 998 CG PRO A 63 -11.488 6.458 -3.790 1.00 0.00 C ATOM 999 CD PRO A 63 -10.772 5.682 -4.855 1.00 0.00 C ATOM 0 HA PRO A 63 -13.528 4.223 -4.121 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -13.262 7.148 -4.773 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -13.550 6.413 -3.208 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -11.169 7.500 -3.785 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -11.273 6.054 -2.801 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -10.526 6.307 -5.714 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -9.835 5.262 -4.488 1.00 0.00 H new ATOM 1007 N VAL A 64 -15.080 4.258 -5.977 1.00 0.00 N ATOM 1008 CA VAL A 64 -15.996 4.220 -7.104 1.00 0.00 C ATOM 1009 C VAL A 64 -16.990 5.363 -7.037 1.00 0.00 C ATOM 1010 O VAL A 64 -17.985 5.295 -6.311 1.00 0.00 O ATOM 1011 CB VAL A 64 -16.776 2.900 -7.186 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -17.662 2.908 -8.419 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -15.826 1.716 -7.217 1.00 0.00 C ATOM 0 H VAL A 64 -15.314 3.622 -5.215 1.00 0.00 H new ATOM 0 HA VAL A 64 -15.376 4.313 -7.996 1.00 0.00 H new ATOM 0 HB VAL A 64 -17.402 2.803 -6.299 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -18.215 1.970 -8.476 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -18.364 3.740 -8.357 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -17.044 3.019 -9.310 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -16.399 0.791 -7.275 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -15.175 1.795 -8.088 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -15.221 1.711 -6.311 1.00 0.00 H new ATOM 1023 N ARG A 65 -16.700 6.411 -7.798 1.00 0.00 N ATOM 1024 CA ARG A 65 -17.553 7.582 -7.883 1.00 0.00 C ATOM 1025 C ARG A 65 -17.707 8.239 -6.505 1.00 0.00 C ATOM 1026 O ARG A 65 -18.644 8.998 -6.252 1.00 0.00 O ATOM 1027 CB ARG A 65 -18.906 7.183 -8.481 1.00 0.00 C ATOM 1028 CG ARG A 65 -19.775 8.352 -8.927 1.00 0.00 C ATOM 1029 CD ARG A 65 -19.022 9.294 -9.861 1.00 0.00 C ATOM 1030 NE ARG A 65 -18.264 8.578 -10.891 1.00 0.00 N ATOM 1031 CZ ARG A 65 -18.729 8.278 -12.105 1.00 0.00 C ATOM 1032 NH1 ARG A 65 -19.976 8.576 -12.447 1.00 0.00 N ATOM 1033 NH2 ARG A 65 -17.942 7.667 -12.981 1.00 0.00 N ATOM 0 H ARG A 65 -15.861 6.469 -8.375 1.00 0.00 H new ATOM 0 HA ARG A 65 -17.095 8.322 -8.539 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -18.731 6.531 -9.337 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -19.456 6.600 -7.743 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -20.663 7.973 -9.432 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -20.118 8.905 -8.052 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -19.731 9.969 -10.340 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -18.340 9.911 -9.276 1.00 0.00 H new ATOM 0 HE ARG A 65 -17.313 8.288 -10.663 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -20.591 9.040 -11.779 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -20.319 8.341 -13.378 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -16.984 7.428 -12.726 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -18.295 7.437 -13.910 1.00 0.00 H new ATOM 1047 N ASP A 66 -16.756 7.954 -5.626 1.00 0.00 N ATOM 1048 CA ASP A 66 -16.771 8.484 -4.275 1.00 0.00 C ATOM 1049 C ASP A 66 -15.931 9.750 -4.214 1.00 0.00 C ATOM 1050 O ASP A 66 -14.807 9.780 -4.711 1.00 0.00 O ATOM 1051 CB ASP A 66 -16.245 7.439 -3.288 1.00 0.00 C ATOM 1052 CG ASP A 66 -16.350 7.897 -1.848 1.00 0.00 C ATOM 1053 OD1 ASP A 66 -17.469 8.236 -1.409 1.00 0.00 O ATOM 1054 OD2 ASP A 66 -15.317 7.914 -1.149 1.00 0.00 O ATOM 0 H ASP A 66 -15.958 7.352 -5.830 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.796 8.728 -3.997 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -16.805 6.512 -3.413 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -15.204 7.216 -3.520 1.00 0.00 H new ATOM 1059 N LYS A 67 -16.480 10.794 -3.613 1.00 0.00 N ATOM 1060 CA LYS A 67 -15.847 12.106 -3.631 1.00 0.00 C ATOM 1061 C LYS A 67 -14.688 12.203 -2.639 1.00 0.00 C ATOM 1062 O LYS A 67 -14.889 12.347 -1.432 1.00 0.00 O ATOM 1063 CB LYS A 67 -16.887 13.199 -3.363 1.00 0.00 C ATOM 1064 CG LYS A 67 -17.730 12.959 -2.121 1.00 0.00 C ATOM 1065 CD LYS A 67 -18.837 13.992 -1.984 1.00 0.00 C ATOM 1066 CE LYS A 67 -19.702 13.708 -0.769 1.00 0.00 C ATOM 1067 NZ LYS A 67 -20.847 14.648 -0.666 1.00 0.00 N ATOM 0 H LYS A 67 -17.364 10.759 -3.106 1.00 0.00 H new ATOM 0 HA LYS A 67 -15.425 12.253 -4.625 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -16.375 14.156 -3.263 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -17.546 13.279 -4.227 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -18.167 11.961 -2.165 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -17.093 12.989 -1.237 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -18.401 14.988 -1.899 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -19.454 13.990 -2.882 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -20.077 12.686 -0.822 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -19.094 13.778 0.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -21.410 14.418 0.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -20.491 15.622 -0.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -21.443 14.564 -1.514 1.00 0.00 H new ATOM 1081 N LYS A 68 -13.472 12.114 -3.162 1.00 0.00 N ATOM 1082 CA LYS A 68 -12.267 12.273 -2.359 1.00 0.00 C ATOM 1083 C LYS A 68 -11.219 13.063 -3.122 1.00 0.00 C ATOM 1084 O LYS A 68 -11.014 12.850 -4.315 1.00 0.00 O ATOM 1085 CB LYS A 68 -11.707 10.913 -1.944 1.00 0.00 C ATOM 1086 CG LYS A 68 -12.402 10.336 -0.730 1.00 0.00 C ATOM 1087 CD LYS A 68 -11.983 8.905 -0.461 1.00 0.00 C ATOM 1088 CE LYS A 68 -12.563 8.412 0.851 1.00 0.00 C ATOM 1089 NZ LYS A 68 -14.020 8.691 0.953 1.00 0.00 N ATOM 0 H LYS A 68 -13.294 11.931 -4.149 1.00 0.00 H new ATOM 0 HA LYS A 68 -12.532 12.825 -1.457 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -11.803 10.216 -2.777 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -10.642 11.013 -1.734 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -12.176 10.950 0.142 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -13.481 10.376 -0.877 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -12.319 8.264 -1.276 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -10.895 8.839 -0.431 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -12.391 7.340 0.944 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -12.043 8.891 1.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -14.412 8.194 1.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -14.171 9.714 1.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -14.498 8.360 0.091 1.00 0.00 H new ATOM 1103 N HIS A 69 -10.579 13.995 -2.434 1.00 0.00 N ATOM 1104 CA HIS A 69 -9.576 14.858 -3.049 1.00 0.00 C ATOM 1105 C HIS A 69 -8.359 14.976 -2.138 1.00 0.00 C ATOM 1106 O HIS A 69 -8.332 14.397 -1.050 1.00 0.00 O ATOM 1107 CB HIS A 69 -10.159 16.254 -3.320 1.00 0.00 C ATOM 1108 CG HIS A 69 -11.317 16.266 -4.278 1.00 0.00 C ATOM 1109 ND1 HIS A 69 -11.189 16.597 -5.608 1.00 0.00 N ATOM 1110 CD2 HIS A 69 -12.627 15.980 -4.089 1.00 0.00 C ATOM 1111 CE1 HIS A 69 -12.367 16.510 -6.197 1.00 0.00 C ATOM 1112 NE2 HIS A 69 -13.258 16.136 -5.299 1.00 0.00 N ATOM 0 H HIS A 69 -10.736 14.176 -1.443 1.00 0.00 H new ATOM 0 HA HIS A 69 -9.274 14.414 -3.998 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -10.481 16.690 -2.374 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -9.370 16.894 -3.714 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -13.090 15.684 -3.159 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -12.568 16.711 -7.239 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -14.252 15.987 -5.474 1.00 0.00 H new ATOM 1121 N THR A 70 -7.343 15.693 -2.596 1.00 0.00 N ATOM 1122 CA THR A 70 -6.214 16.035 -1.748 1.00 0.00 C ATOM 1123 C THR A 70 -6.631 17.133 -0.773 1.00 0.00 C ATOM 1124 O THR A 70 -6.205 17.160 0.382 1.00 0.00 O ATOM 1125 CB THR A 70 -5.006 16.499 -2.587 1.00 0.00 C ATOM 1126 OG1 THR A 70 -4.669 15.486 -3.550 1.00 0.00 O ATOM 1127 CG2 THR A 70 -3.795 16.783 -1.709 1.00 0.00 C ATOM 0 H THR A 70 -7.279 16.048 -3.550 1.00 0.00 H new ATOM 0 HA THR A 70 -5.912 15.146 -1.194 1.00 0.00 H new ATOM 0 HB THR A 70 -5.284 17.422 -3.095 1.00 0.00 H new ATOM 0 HG1 THR A 70 -3.902 15.784 -4.083 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.962 17.108 -2.332 1.00 0.00 H new ATOM 0 HG22 THR A 70 -4.040 17.568 -0.994 1.00 0.00 H new ATOM 0 HG23 THR A 70 -3.515 15.877 -1.172 1.00 0.00 H new ATOM 1135 N GLU A 71 -7.482 18.028 -1.255 1.00 0.00 N ATOM 1136 CA GLU A 71 -8.115 19.032 -0.417 1.00 0.00 C ATOM 1137 C GLU A 71 -9.625 18.945 -0.580 1.00 0.00 C ATOM 1138 O GLU A 71 -10.144 19.440 -1.606 1.00 0.00 O ATOM 1139 CB GLU A 71 -7.636 20.442 -0.775 1.00 0.00 C ATOM 1140 CG GLU A 71 -6.210 20.742 -0.346 1.00 0.00 C ATOM 1141 CD GLU A 71 -6.028 20.698 1.156 1.00 0.00 C ATOM 1142 OE1 GLU A 71 -6.803 21.362 1.878 1.00 0.00 O ATOM 1143 OE2 GLU A 71 -5.088 20.022 1.624 1.00 0.00 O ATOM 1144 OXT GLU A 71 -10.284 18.349 0.291 1.00 0.00 O ATOM 0 H GLU A 71 -7.752 18.077 -2.237 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.839 18.837 0.619 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -7.715 20.578 -1.854 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.303 21.169 -0.312 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -5.537 20.022 -0.810 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -5.925 21.728 -0.713 1.00 0.00 H new TER 1151 GLU A 71 ATOM 1152 N MET B 1 20.256 -0.922 -8.982 1.00 0.00 N ATOM 1153 CA MET B 1 18.988 -0.694 -9.709 1.00 0.00 C ATOM 1154 C MET B 1 18.275 0.524 -9.155 1.00 0.00 C ATOM 1155 O MET B 1 18.692 1.103 -8.153 1.00 0.00 O ATOM 1156 CB MET B 1 18.062 -1.914 -9.607 1.00 0.00 C ATOM 1157 CG MET B 1 17.674 -2.283 -8.184 1.00 0.00 C ATOM 1158 SD MET B 1 16.734 -3.817 -8.096 1.00 0.00 S ATOM 1159 CE MET B 1 16.362 -3.886 -6.346 1.00 0.00 C ATOM 0 H1 MET B 1 20.535 -1.919 -9.076 1.00 0.00 H new ATOM 0 H2 MET B 1 21.000 -0.315 -9.382 1.00 0.00 H new ATOM 0 H3 MET B 1 20.126 -0.692 -7.976 1.00 0.00 H new ATOM 0 HA MET B 1 19.234 -0.529 -10.758 1.00 0.00 H new ATOM 0 HB2 MET B 1 17.156 -1.717 -10.180 1.00 0.00 H new ATOM 0 HB3 MET B 1 18.553 -2.769 -10.071 1.00 0.00 H new ATOM 0 HG2 MET B 1 18.576 -2.379 -7.579 1.00 0.00 H new ATOM 0 HG3 MET B 1 17.084 -1.475 -7.751 1.00 0.00 H new ATOM 0 HE1 MET B 1 15.781 -4.783 -6.133 1.00 0.00 H new ATOM 0 HE2 MET B 1 17.291 -3.911 -5.777 1.00 0.00 H new ATOM 0 HE3 MET B 1 15.786 -3.005 -6.061 1.00 0.00 H new ATOM 1171 N GLN B 2 17.204 0.918 -9.812 1.00 0.00 N ATOM 1172 CA GLN B 2 16.379 2.003 -9.331 1.00 0.00 C ATOM 1173 C GLN B 2 14.992 1.478 -9.006 1.00 0.00 C ATOM 1174 O GLN B 2 14.521 0.528 -9.633 1.00 0.00 O ATOM 1175 CB GLN B 2 16.298 3.107 -10.384 1.00 0.00 C ATOM 1176 CG GLN B 2 17.656 3.677 -10.765 1.00 0.00 C ATOM 1177 CD GLN B 2 17.582 4.659 -11.917 1.00 0.00 C ATOM 1178 OE1 GLN B 2 18.525 4.782 -12.700 1.00 0.00 O ATOM 1179 NE2 GLN B 2 16.467 5.361 -12.038 1.00 0.00 N ATOM 0 H GLN B 2 16.884 0.499 -10.685 1.00 0.00 H new ATOM 0 HA GLN B 2 16.822 2.421 -8.427 1.00 0.00 H new ATOM 0 HB2 GLN B 2 15.814 2.712 -11.277 1.00 0.00 H new ATOM 0 HB3 GLN B 2 15.666 3.912 -10.008 1.00 0.00 H new ATOM 0 HG2 GLN B 2 18.092 4.174 -9.898 1.00 0.00 H new ATOM 0 HG3 GLN B 2 18.325 2.859 -11.034 1.00 0.00 H new ATOM 0 HE21 GLN B 2 15.708 5.231 -11.370 1.00 0.00 H new ATOM 0 HE22 GLN B 2 16.367 6.032 -12.800 1.00 0.00 H new ATOM 1188 N ILE B 3 14.364 2.057 -7.998 1.00 0.00 N ATOM 1189 CA ILE B 3 12.982 1.739 -7.681 1.00 0.00 C ATOM 1190 C ILE B 3 12.185 3.016 -7.496 1.00 0.00 C ATOM 1191 O ILE B 3 12.647 3.961 -6.855 1.00 0.00 O ATOM 1192 CB ILE B 3 12.842 0.855 -6.420 1.00 0.00 C ATOM 1193 CG1 ILE B 3 13.573 1.481 -5.229 1.00 0.00 C ATOM 1194 CG2 ILE B 3 13.364 -0.548 -6.696 1.00 0.00 C ATOM 1195 CD1 ILE B 3 13.406 0.709 -3.935 1.00 0.00 C ATOM 0 H ILE B 3 14.790 2.751 -7.384 1.00 0.00 H new ATOM 0 HA ILE B 3 12.590 1.167 -8.522 1.00 0.00 H new ATOM 0 HB ILE B 3 11.784 0.787 -6.166 1.00 0.00 H new ATOM 0 HG12 ILE B 3 14.635 1.554 -5.464 1.00 0.00 H new ATOM 0 HG13 ILE B 3 13.208 2.498 -5.084 1.00 0.00 H new ATOM 0 HG21 ILE B 3 13.259 -1.158 -5.799 1.00 0.00 H new ATOM 0 HG22 ILE B 3 12.792 -0.996 -7.509 1.00 0.00 H new ATOM 0 HG23 ILE B 3 14.416 -0.496 -6.978 1.00 0.00 H new ATOM 0 HD11 ILE B 3 13.952 1.213 -3.137 1.00 0.00 H new ATOM 0 HD12 ILE B 3 12.349 0.658 -3.675 1.00 0.00 H new ATOM 0 HD13 ILE B 3 13.797 -0.301 -4.060 1.00 0.00 H new ATOM 1207 N PHE B 4 11.002 3.055 -8.077 1.00 0.00 N ATOM 1208 CA PHE B 4 10.160 4.234 -8.003 1.00 0.00 C ATOM 1209 C PHE B 4 9.273 4.166 -6.771 1.00 0.00 C ATOM 1210 O PHE B 4 8.213 3.546 -6.793 1.00 0.00 O ATOM 1211 CB PHE B 4 9.302 4.369 -9.266 1.00 0.00 C ATOM 1212 CG PHE B 4 10.104 4.434 -10.535 1.00 0.00 C ATOM 1213 CD1 PHE B 4 10.611 5.641 -10.987 1.00 0.00 C ATOM 1214 CD2 PHE B 4 10.355 3.286 -11.275 1.00 0.00 C ATOM 1215 CE1 PHE B 4 11.350 5.703 -12.154 1.00 0.00 C ATOM 1216 CE2 PHE B 4 11.093 3.344 -12.441 1.00 0.00 C ATOM 1217 CZ PHE B 4 11.592 4.554 -12.882 1.00 0.00 C ATOM 0 H PHE B 4 10.601 2.282 -8.607 1.00 0.00 H new ATOM 0 HA PHE B 4 10.802 5.112 -7.930 1.00 0.00 H new ATOM 0 HB2 PHE B 4 8.617 3.523 -9.322 1.00 0.00 H new ATOM 0 HB3 PHE B 4 8.691 5.268 -9.186 1.00 0.00 H new ATOM 0 HD1 PHE B 4 10.427 6.543 -10.422 1.00 0.00 H new ATOM 0 HD2 PHE B 4 9.969 2.337 -10.935 1.00 0.00 H new ATOM 0 HE1 PHE B 4 11.738 6.651 -12.497 1.00 0.00 H new ATOM 0 HE2 PHE B 4 11.280 2.444 -13.008 1.00 0.00 H new ATOM 0 HZ PHE B 4 12.170 4.602 -13.793 1.00 0.00 H new ATOM 1227 N VAL B 5 9.725 4.779 -5.692 1.00 0.00 N ATOM 1228 CA VAL B 5 8.987 4.756 -4.443 1.00 0.00 C ATOM 1229 C VAL B 5 7.932 5.854 -4.427 1.00 0.00 C ATOM 1230 O VAL B 5 8.240 7.025 -4.212 1.00 0.00 O ATOM 1231 CB VAL B 5 9.929 4.923 -3.230 1.00 0.00 C ATOM 1232 CG1 VAL B 5 9.148 4.880 -1.927 1.00 0.00 C ATOM 1233 CG2 VAL B 5 11.011 3.854 -3.242 1.00 0.00 C ATOM 0 H VAL B 5 10.601 5.300 -5.656 1.00 0.00 H new ATOM 0 HA VAL B 5 8.498 3.785 -4.368 1.00 0.00 H new ATOM 0 HB VAL B 5 10.409 5.899 -3.305 1.00 0.00 H new ATOM 0 HG11 VAL B 5 9.833 5.000 -1.088 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.415 5.687 -1.915 1.00 0.00 H new ATOM 0 HG13 VAL B 5 8.634 3.922 -1.842 1.00 0.00 H new ATOM 0 HG21 VAL B 5 11.665 3.988 -2.380 1.00 0.00 H new ATOM 0 HG22 VAL B 5 10.549 2.868 -3.197 1.00 0.00 H new ATOM 0 HG23 VAL B 5 11.596 3.939 -4.158 1.00 0.00 H new ATOM 1243 N LYS B 6 6.692 5.473 -4.691 1.00 0.00 N ATOM 1244 CA LYS B 6 5.584 6.412 -4.674 1.00 0.00 C ATOM 1245 C LYS B 6 4.981 6.478 -3.277 1.00 0.00 C ATOM 1246 O LYS B 6 4.337 5.533 -2.817 1.00 0.00 O ATOM 1247 CB LYS B 6 4.528 6.008 -5.702 1.00 0.00 C ATOM 1248 CG LYS B 6 5.064 5.953 -7.124 1.00 0.00 C ATOM 1249 CD LYS B 6 3.977 5.580 -8.118 1.00 0.00 C ATOM 1250 CE LYS B 6 2.946 6.687 -8.262 1.00 0.00 C ATOM 1251 NZ LYS B 6 3.524 7.915 -8.871 1.00 0.00 N ATOM 0 H LYS B 6 6.428 4.515 -4.921 1.00 0.00 H new ATOM 0 HA LYS B 6 5.954 7.402 -4.940 1.00 0.00 H new ATOM 0 HB2 LYS B 6 4.126 5.031 -5.435 1.00 0.00 H new ATOM 0 HB3 LYS B 6 3.700 6.716 -5.660 1.00 0.00 H new ATOM 0 HG2 LYS B 6 5.486 6.922 -7.392 1.00 0.00 H new ATOM 0 HG3 LYS B 6 5.874 5.226 -7.180 1.00 0.00 H new ATOM 0 HD2 LYS B 6 4.427 5.373 -9.089 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.485 4.664 -7.793 1.00 0.00 H new ATOM 0 HE2 LYS B 6 2.118 6.333 -8.877 1.00 0.00 H new ATOM 0 HE3 LYS B 6 2.535 6.928 -7.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 2.772 8.619 -9.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 4.251 8.307 -8.239 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 3.954 7.678 -9.788 1.00 0.00 H new ATOM 1265 N THR B 7 5.211 7.592 -2.604 1.00 0.00 N ATOM 1266 CA THR B 7 4.827 7.752 -1.214 1.00 0.00 C ATOM 1267 C THR B 7 3.327 7.983 -1.053 1.00 0.00 C ATOM 1268 O THR B 7 2.611 8.244 -2.024 1.00 0.00 O ATOM 1269 CB THR B 7 5.578 8.938 -0.581 1.00 0.00 C ATOM 1270 OG1 THR B 7 5.204 10.152 -1.247 1.00 0.00 O ATOM 1271 CG2 THR B 7 7.083 8.748 -0.681 1.00 0.00 C ATOM 0 H THR B 7 5.669 8.410 -3.006 1.00 0.00 H new ATOM 0 HA THR B 7 5.091 6.823 -0.709 1.00 0.00 H new ATOM 0 HB THR B 7 5.307 8.993 0.473 1.00 0.00 H new ATOM 0 HG1 THR B 7 5.016 10.846 -0.581 1.00 0.00 H new ATOM 0 HG21 THR B 7 7.588 9.600 -0.226 1.00 0.00 H new ATOM 0 HG22 THR B 7 7.370 7.835 -0.159 1.00 0.00 H new ATOM 0 HG23 THR B 7 7.371 8.672 -1.729 1.00 0.00 H new ATOM 1279 N LEU B 8 2.867 7.890 0.190 1.00 0.00 N ATOM 1280 CA LEU B 8 1.488 8.204 0.543 1.00 0.00 C ATOM 1281 C LEU B 8 1.179 9.652 0.161 1.00 0.00 C ATOM 1282 O LEU B 8 0.072 9.977 -0.264 1.00 0.00 O ATOM 1283 CB LEU B 8 1.302 7.986 2.053 1.00 0.00 C ATOM 1284 CG LEU B 8 -0.128 7.719 2.543 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -0.098 7.215 3.978 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -0.992 8.968 2.459 1.00 0.00 C ATOM 0 H LEU B 8 3.440 7.595 0.981 1.00 0.00 H new ATOM 0 HA LEU B 8 0.801 7.553 0.002 1.00 0.00 H new ATOM 0 HB2 LEU B 8 1.927 7.145 2.354 1.00 0.00 H new ATOM 0 HB3 LEU B 8 1.680 8.866 2.572 1.00 0.00 H new ATOM 0 HG LEU B 8 -0.566 6.961 1.893 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -1.116 7.028 4.319 1.00 0.00 H new ATOM 0 HD12 LEU B 8 0.477 6.290 4.027 1.00 0.00 H new ATOM 0 HD13 LEU B 8 0.367 7.965 4.618 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -1.997 8.740 2.814 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -0.558 9.753 3.078 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.041 9.307 1.424 1.00 0.00 H new ATOM 1298 N THR B 9 2.189 10.506 0.273 1.00 0.00 N ATOM 1299 CA THR B 9 2.046 11.920 -0.035 1.00 0.00 C ATOM 1300 C THR B 9 2.018 12.172 -1.545 1.00 0.00 C ATOM 1301 O THR B 9 1.846 13.304 -1.989 1.00 0.00 O ATOM 1302 CB THR B 9 3.184 12.732 0.611 1.00 0.00 C ATOM 1303 OG1 THR B 9 4.428 12.027 0.471 1.00 0.00 O ATOM 1304 CG2 THR B 9 2.900 12.984 2.085 1.00 0.00 C ATOM 0 H THR B 9 3.125 10.238 0.578 1.00 0.00 H new ATOM 0 HA THR B 9 1.092 12.247 0.378 1.00 0.00 H new ATOM 0 HB THR B 9 3.251 13.693 0.102 1.00 0.00 H new ATOM 0 HG1 THR B 9 5.148 12.549 0.882 1.00 0.00 H new ATOM 0 HG21 THR B 9 3.717 13.559 2.520 1.00 0.00 H new ATOM 0 HG22 THR B 9 1.969 13.543 2.186 1.00 0.00 H new ATOM 0 HG23 THR B 9 2.809 12.031 2.606 1.00 0.00 H new ATOM 1312 N GLY B 10 2.195 11.114 -2.327 1.00 0.00 N ATOM 1313 CA GLY B 10 2.101 11.230 -3.769 1.00 0.00 C ATOM 1314 C GLY B 10 3.404 11.661 -4.405 1.00 0.00 C ATOM 1315 O GLY B 10 3.410 12.250 -5.487 1.00 0.00 O ATOM 0 H GLY B 10 2.403 10.175 -1.986 1.00 0.00 H new ATOM 0 HA2 GLY B 10 1.797 10.271 -4.188 1.00 0.00 H new ATOM 0 HA3 GLY B 10 1.322 11.950 -4.022 1.00 0.00 H new ATOM 1319 N LYS B 11 4.512 11.382 -3.735 1.00 0.00 N ATOM 1320 CA LYS B 11 5.824 11.703 -4.271 1.00 0.00 C ATOM 1321 C LYS B 11 6.447 10.461 -4.886 1.00 0.00 C ATOM 1322 O LYS B 11 6.471 9.403 -4.262 1.00 0.00 O ATOM 1323 CB LYS B 11 6.743 12.248 -3.176 1.00 0.00 C ATOM 1324 CG LYS B 11 6.215 13.494 -2.484 1.00 0.00 C ATOM 1325 CD LYS B 11 7.196 14.006 -1.440 1.00 0.00 C ATOM 1326 CE LYS B 11 6.710 15.292 -0.788 1.00 0.00 C ATOM 1327 NZ LYS B 11 6.574 16.398 -1.774 1.00 0.00 N ATOM 0 H LYS B 11 4.528 10.934 -2.819 1.00 0.00 H new ATOM 0 HA LYS B 11 5.703 12.470 -5.036 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.901 11.470 -2.429 1.00 0.00 H new ATOM 0 HB3 LYS B 11 7.716 12.473 -3.612 1.00 0.00 H new ATOM 0 HG2 LYS B 11 6.030 14.272 -3.224 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.259 13.271 -2.009 1.00 0.00 H new ATOM 0 HD2 LYS B 11 7.343 13.244 -0.675 1.00 0.00 H new ATOM 0 HD3 LYS B 11 8.166 14.179 -1.907 1.00 0.00 H new ATOM 0 HE2 LYS B 11 5.748 15.114 -0.307 1.00 0.00 H new ATOM 0 HE3 LYS B 11 7.408 15.588 -0.005 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 6.457 17.300 -1.270 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 7.427 16.441 -2.368 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 5.742 16.227 -2.375 1.00 0.00 H new ATOM 1341 N THR B 12 6.928 10.581 -6.109 1.00 0.00 N ATOM 1342 CA THR B 12 7.601 9.476 -6.763 1.00 0.00 C ATOM 1343 C THR B 12 9.111 9.610 -6.584 1.00 0.00 C ATOM 1344 O THR B 12 9.790 10.263 -7.377 1.00 0.00 O ATOM 1345 CB THR B 12 7.247 9.416 -8.260 1.00 0.00 C ATOM 1346 OG1 THR B 12 5.822 9.499 -8.423 1.00 0.00 O ATOM 1347 CG2 THR B 12 7.761 8.129 -8.892 1.00 0.00 C ATOM 0 H THR B 12 6.865 11.431 -6.669 1.00 0.00 H new ATOM 0 HA THR B 12 7.264 8.548 -6.301 1.00 0.00 H new ATOM 0 HB THR B 12 7.725 10.258 -8.760 1.00 0.00 H new ATOM 0 HG1 THR B 12 5.599 9.462 -9.377 1.00 0.00 H new ATOM 0 HG21 THR B 12 7.497 8.112 -9.950 1.00 0.00 H new ATOM 0 HG22 THR B 12 8.845 8.080 -8.787 1.00 0.00 H new ATOM 0 HG23 THR B 12 7.309 7.272 -8.392 1.00 0.00 H new ATOM 1355 N ILE B 13 9.623 9.021 -5.515 1.00 0.00 N ATOM 1356 CA ILE B 13 11.033 9.129 -5.189 1.00 0.00 C ATOM 1357 C ILE B 13 11.795 7.930 -5.740 1.00 0.00 C ATOM 1358 O ILE B 13 11.643 6.809 -5.256 1.00 0.00 O ATOM 1359 CB ILE B 13 11.251 9.220 -3.659 1.00 0.00 C ATOM 1360 CG1 ILE B 13 10.369 10.319 -3.050 1.00 0.00 C ATOM 1361 CG2 ILE B 13 12.716 9.483 -3.342 1.00 0.00 C ATOM 1362 CD1 ILE B 13 10.682 11.711 -3.556 1.00 0.00 C ATOM 0 H ILE B 13 9.080 8.462 -4.857 1.00 0.00 H new ATOM 0 HA ILE B 13 11.410 10.043 -5.647 1.00 0.00 H new ATOM 0 HB ILE B 13 10.966 8.265 -3.218 1.00 0.00 H new ATOM 0 HG12 ILE B 13 9.324 10.092 -3.264 1.00 0.00 H new ATOM 0 HG13 ILE B 13 10.483 10.303 -1.966 1.00 0.00 H new ATOM 0 HG21 ILE B 13 12.849 9.544 -2.262 1.00 0.00 H new ATOM 0 HG22 ILE B 13 13.325 8.671 -3.738 1.00 0.00 H new ATOM 0 HG23 ILE B 13 13.024 10.423 -3.799 1.00 0.00 H new ATOM 0 HD11 ILE B 13 10.016 12.430 -3.078 1.00 0.00 H new ATOM 0 HD12 ILE B 13 11.716 11.961 -3.318 1.00 0.00 H new ATOM 0 HD13 ILE B 13 10.539 11.746 -4.636 1.00 0.00 H new ATOM 1374 N THR B 14 12.592 8.162 -6.768 1.00 0.00 N ATOM 1375 CA THR B 14 13.394 7.104 -7.359 1.00 0.00 C ATOM 1376 C THR B 14 14.600 6.793 -6.476 1.00 0.00 C ATOM 1377 O THR B 14 15.507 7.611 -6.341 1.00 0.00 O ATOM 1378 CB THR B 14 13.880 7.502 -8.763 1.00 0.00 C ATOM 1379 OG1 THR B 14 12.774 7.953 -9.556 1.00 0.00 O ATOM 1380 CG2 THR B 14 14.556 6.329 -9.457 1.00 0.00 C ATOM 0 H THR B 14 12.702 9.074 -7.211 1.00 0.00 H new ATOM 0 HA THR B 14 12.766 6.217 -7.441 1.00 0.00 H new ATOM 0 HB THR B 14 14.605 8.308 -8.654 1.00 0.00 H new ATOM 0 HG1 THR B 14 12.278 7.179 -9.896 1.00 0.00 H new ATOM 0 HG21 THR B 14 14.891 6.636 -10.448 1.00 0.00 H new ATOM 0 HG22 THR B 14 15.414 6.004 -8.869 1.00 0.00 H new ATOM 0 HG23 THR B 14 13.848 5.506 -9.552 1.00 0.00 H new ATOM 1388 N LEU B 15 14.599 5.612 -5.878 1.00 0.00 N ATOM 1389 CA LEU B 15 15.686 5.196 -5.001 1.00 0.00 C ATOM 1390 C LEU B 15 16.703 4.351 -5.750 1.00 0.00 C ATOM 1391 O LEU B 15 16.341 3.393 -6.437 1.00 0.00 O ATOM 1392 CB LEU B 15 15.148 4.405 -3.803 1.00 0.00 C ATOM 1393 CG LEU B 15 14.976 5.202 -2.506 1.00 0.00 C ATOM 1394 CD1 LEU B 15 16.290 5.855 -2.108 1.00 0.00 C ATOM 1395 CD2 LEU B 15 13.883 6.246 -2.650 1.00 0.00 C ATOM 0 H LEU B 15 13.856 4.922 -5.984 1.00 0.00 H new ATOM 0 HA LEU B 15 16.177 6.100 -4.641 1.00 0.00 H new ATOM 0 HB2 LEU B 15 14.183 3.978 -4.076 1.00 0.00 H new ATOM 0 HB3 LEU B 15 15.822 3.571 -3.609 1.00 0.00 H new ATOM 0 HG LEU B 15 14.678 4.510 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU B 15 16.152 6.418 -1.185 1.00 0.00 H new ATOM 0 HD12 LEU B 15 17.047 5.086 -1.954 1.00 0.00 H new ATOM 0 HD13 LEU B 15 16.615 6.531 -2.899 1.00 0.00 H new ATOM 0 HD21 LEU B 15 13.781 6.798 -1.715 1.00 0.00 H new ATOM 0 HD22 LEU B 15 14.143 6.936 -3.452 1.00 0.00 H new ATOM 0 HD23 LEU B 15 12.939 5.754 -2.886 1.00 0.00 H new ATOM 1407 N GLU B 16 17.970 4.716 -5.620 1.00 0.00 N ATOM 1408 CA GLU B 16 19.054 3.939 -6.193 1.00 0.00 C ATOM 1409 C GLU B 16 19.540 2.915 -5.172 1.00 0.00 C ATOM 1410 O GLU B 16 20.266 3.244 -4.228 1.00 0.00 O ATOM 1411 CB GLU B 16 20.191 4.866 -6.631 1.00 0.00 C ATOM 1412 CG GLU B 16 21.310 4.162 -7.380 1.00 0.00 C ATOM 1413 CD GLU B 16 22.329 5.133 -7.936 1.00 0.00 C ATOM 1414 OE1 GLU B 16 23.259 5.520 -7.195 1.00 0.00 O ATOM 1415 OE2 GLU B 16 22.203 5.523 -9.118 1.00 0.00 O ATOM 0 H GLU B 16 18.272 5.552 -5.119 1.00 0.00 H new ATOM 0 HA GLU B 16 18.698 3.407 -7.075 1.00 0.00 H new ATOM 0 HB2 GLU B 16 19.781 5.652 -7.266 1.00 0.00 H new ATOM 0 HB3 GLU B 16 20.608 5.353 -5.750 1.00 0.00 H new ATOM 0 HG2 GLU B 16 21.808 3.461 -6.710 1.00 0.00 H new ATOM 0 HG3 GLU B 16 20.886 3.577 -8.196 1.00 0.00 H new ATOM 1422 N VAL B 17 19.101 1.677 -5.347 1.00 0.00 N ATOM 1423 CA VAL B 17 19.409 0.606 -4.410 1.00 0.00 C ATOM 1424 C VAL B 17 19.788 -0.657 -5.173 1.00 0.00 C ATOM 1425 O VAL B 17 19.524 -0.768 -6.368 1.00 0.00 O ATOM 1426 CB VAL B 17 18.209 0.298 -3.477 1.00 0.00 C ATOM 1427 CG1 VAL B 17 17.841 1.516 -2.645 1.00 0.00 C ATOM 1428 CG2 VAL B 17 17.006 -0.185 -4.277 1.00 0.00 C ATOM 0 H VAL B 17 18.525 1.388 -6.137 1.00 0.00 H new ATOM 0 HA VAL B 17 20.245 0.937 -3.794 1.00 0.00 H new ATOM 0 HB VAL B 17 18.511 -0.501 -2.799 1.00 0.00 H new ATOM 0 HG11 VAL B 17 16.997 1.274 -1.999 1.00 0.00 H new ATOM 0 HG12 VAL B 17 18.694 1.810 -2.033 1.00 0.00 H new ATOM 0 HG13 VAL B 17 17.568 2.339 -3.306 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.178 -0.394 -3.599 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.708 0.586 -4.987 1.00 0.00 H new ATOM 0 HG23 VAL B 17 17.270 -1.094 -4.818 1.00 0.00 H new ATOM 1438 N GLU B 18 20.408 -1.604 -4.500 1.00 0.00 N ATOM 1439 CA GLU B 18 20.789 -2.846 -5.142 1.00 0.00 C ATOM 1440 C GLU B 18 19.983 -4.002 -4.561 1.00 0.00 C ATOM 1441 O GLU B 18 19.408 -3.882 -3.481 1.00 0.00 O ATOM 1442 CB GLU B 18 22.290 -3.092 -4.969 1.00 0.00 C ATOM 1443 CG GLU B 18 22.879 -3.961 -6.059 1.00 0.00 C ATOM 1444 CD GLU B 18 22.464 -3.478 -7.430 1.00 0.00 C ATOM 1445 OE1 GLU B 18 22.952 -2.416 -7.867 1.00 0.00 O ATOM 1446 OE2 GLU B 18 21.623 -4.147 -8.067 1.00 0.00 O ATOM 0 H GLU B 18 20.658 -1.539 -3.513 1.00 0.00 H new ATOM 0 HA GLU B 18 20.574 -2.775 -6.208 1.00 0.00 H new ATOM 0 HB2 GLU B 18 22.810 -2.134 -4.956 1.00 0.00 H new ATOM 0 HB3 GLU B 18 22.466 -3.563 -4.002 1.00 0.00 H new ATOM 0 HG2 GLU B 18 23.966 -3.956 -5.983 1.00 0.00 H new ATOM 0 HG3 GLU B 18 22.554 -4.992 -5.920 1.00 0.00 H new ATOM 1453 N SER B 19 19.941 -5.116 -5.278 1.00 0.00 N ATOM 1454 CA SER B 19 19.194 -6.285 -4.828 1.00 0.00 C ATOM 1455 C SER B 19 19.847 -6.908 -3.597 1.00 0.00 C ATOM 1456 O SER B 19 19.215 -7.676 -2.870 1.00 0.00 O ATOM 1457 CB SER B 19 19.101 -7.322 -5.953 1.00 0.00 C ATOM 1458 OG SER B 19 18.326 -8.441 -5.555 1.00 0.00 O ATOM 0 H SER B 19 20.415 -5.236 -6.173 1.00 0.00 H new ATOM 0 HA SER B 19 18.189 -5.961 -4.558 1.00 0.00 H new ATOM 0 HB2 SER B 19 18.657 -6.865 -6.837 1.00 0.00 H new ATOM 0 HB3 SER B 19 20.102 -7.650 -6.232 1.00 0.00 H new ATOM 0 HG SER B 19 18.281 -9.086 -6.291 1.00 0.00 H new ATOM 1464 N SER B 20 21.109 -6.569 -3.366 1.00 0.00 N ATOM 1465 CA SER B 20 21.843 -7.105 -2.235 1.00 0.00 C ATOM 1466 C SER B 20 21.757 -6.157 -1.037 1.00 0.00 C ATOM 1467 O SER B 20 22.269 -6.455 0.042 1.00 0.00 O ATOM 1468 CB SER B 20 23.301 -7.355 -2.628 1.00 0.00 C ATOM 1469 OG SER B 20 23.987 -8.101 -1.635 1.00 0.00 O ATOM 0 H SER B 20 21.643 -5.925 -3.949 1.00 0.00 H new ATOM 0 HA SER B 20 21.394 -8.055 -1.944 1.00 0.00 H new ATOM 0 HB2 SER B 20 23.336 -7.891 -3.576 1.00 0.00 H new ATOM 0 HB3 SER B 20 23.806 -6.401 -2.782 1.00 0.00 H new ATOM 0 HG SER B 20 23.651 -7.852 -0.749 1.00 0.00 H new ATOM 1475 N ASP B 21 21.105 -5.011 -1.226 1.00 0.00 N ATOM 1476 CA ASP B 21 20.875 -4.084 -0.123 1.00 0.00 C ATOM 1477 C ASP B 21 19.716 -4.575 0.725 1.00 0.00 C ATOM 1478 O ASP B 21 18.882 -5.358 0.263 1.00 0.00 O ATOM 1479 CB ASP B 21 20.567 -2.663 -0.619 1.00 0.00 C ATOM 1480 CG ASP B 21 21.790 -1.902 -1.091 1.00 0.00 C ATOM 1481 OD1 ASP B 21 22.684 -1.625 -0.268 1.00 0.00 O ATOM 1482 OD2 ASP B 21 21.849 -1.556 -2.285 1.00 0.00 O ATOM 0 H ASP B 21 20.730 -4.705 -2.124 1.00 0.00 H new ATOM 0 HA ASP B 21 21.790 -4.046 0.467 1.00 0.00 H new ATOM 0 HB2 ASP B 21 19.849 -2.721 -1.437 1.00 0.00 H new ATOM 0 HB3 ASP B 21 20.090 -2.103 0.185 1.00 0.00 H new ATOM 1487 N THR B 22 19.664 -4.125 1.964 1.00 0.00 N ATOM 1488 CA THR B 22 18.574 -4.482 2.849 1.00 0.00 C ATOM 1489 C THR B 22 17.470 -3.439 2.782 1.00 0.00 C ATOM 1490 O THR B 22 17.691 -2.319 2.318 1.00 0.00 O ATOM 1491 CB THR B 22 19.056 -4.626 4.305 1.00 0.00 C ATOM 1492 OG1 THR B 22 19.838 -3.485 4.690 1.00 0.00 O ATOM 1493 CG2 THR B 22 19.874 -5.895 4.474 1.00 0.00 C ATOM 0 H THR B 22 20.365 -3.511 2.380 1.00 0.00 H new ATOM 0 HA THR B 22 18.185 -5.444 2.516 1.00 0.00 H new ATOM 0 HB THR B 22 18.179 -4.686 4.949 1.00 0.00 H new ATOM 0 HG1 THR B 22 20.136 -3.590 5.618 1.00 0.00 H new ATOM 0 HG21 THR B 22 20.206 -5.979 5.509 1.00 0.00 H new ATOM 0 HG22 THR B 22 19.262 -6.759 4.218 1.00 0.00 H new ATOM 0 HG23 THR B 22 20.743 -5.858 3.817 1.00 0.00 H new ATOM 1501 N ILE B 23 16.280 -3.806 3.236 1.00 0.00 N ATOM 1502 CA ILE B 23 15.177 -2.863 3.322 1.00 0.00 C ATOM 1503 C ILE B 23 15.538 -1.747 4.299 1.00 0.00 C ATOM 1504 O ILE B 23 15.104 -0.607 4.148 1.00 0.00 O ATOM 1505 CB ILE B 23 13.878 -3.564 3.777 1.00 0.00 C ATOM 1506 CG1 ILE B 23 13.537 -4.718 2.829 1.00 0.00 C ATOM 1507 CG2 ILE B 23 12.719 -2.578 3.853 1.00 0.00 C ATOM 1508 CD1 ILE B 23 13.341 -4.291 1.391 1.00 0.00 C ATOM 0 H ILE B 23 16.055 -4.750 3.550 1.00 0.00 H new ATOM 0 HA ILE B 23 15.002 -2.443 2.332 1.00 0.00 H new ATOM 0 HB ILE B 23 14.043 -3.966 4.777 1.00 0.00 H new ATOM 0 HG12 ILE B 23 14.335 -5.459 2.872 1.00 0.00 H new ATOM 0 HG13 ILE B 23 12.628 -5.207 3.180 1.00 0.00 H new ATOM 0 HG21 ILE B 23 11.818 -3.100 4.176 1.00 0.00 H new ATOM 0 HG22 ILE B 23 12.958 -1.790 4.567 1.00 0.00 H new ATOM 0 HG23 ILE B 23 12.551 -2.138 2.870 1.00 0.00 H new ATOM 0 HD11 ILE B 23 13.103 -5.163 0.782 1.00 0.00 H new ATOM 0 HD12 ILE B 23 12.523 -3.573 1.333 1.00 0.00 H new ATOM 0 HD13 ILE B 23 14.256 -3.829 1.021 1.00 0.00 H new ATOM 1520 N ASP B 24 16.358 -2.095 5.287 1.00 0.00 N ATOM 1521 CA ASP B 24 16.899 -1.130 6.241 1.00 0.00 C ATOM 1522 C ASP B 24 17.639 -0.033 5.492 1.00 0.00 C ATOM 1523 O ASP B 24 17.413 1.157 5.716 1.00 0.00 O ATOM 1524 CB ASP B 24 17.876 -1.826 7.198 1.00 0.00 C ATOM 1525 CG ASP B 24 17.307 -3.085 7.819 1.00 0.00 C ATOM 1526 OD1 ASP B 24 17.115 -4.080 7.083 1.00 0.00 O ATOM 1527 OD2 ASP B 24 17.057 -3.094 9.043 1.00 0.00 O ATOM 0 H ASP B 24 16.666 -3.054 5.449 1.00 0.00 H new ATOM 0 HA ASP B 24 16.076 -0.701 6.812 1.00 0.00 H new ATOM 0 HB2 ASP B 24 18.789 -2.076 6.657 1.00 0.00 H new ATOM 0 HB3 ASP B 24 18.155 -1.132 7.991 1.00 0.00 H new ATOM 1532 N ASN B 25 18.514 -0.459 4.585 1.00 0.00 N ATOM 1533 CA ASN B 25 19.287 0.453 3.745 1.00 0.00 C ATOM 1534 C ASN B 25 18.369 1.370 2.948 1.00 0.00 C ATOM 1535 O ASN B 25 18.545 2.591 2.947 1.00 0.00 O ATOM 1536 CB ASN B 25 20.186 -0.343 2.789 1.00 0.00 C ATOM 1537 CG ASN B 25 20.871 0.527 1.750 1.00 0.00 C ATOM 1538 OD1 ASN B 25 20.341 0.746 0.656 1.00 0.00 O ATOM 1539 ND2 ASN B 25 22.052 1.031 2.080 1.00 0.00 N ATOM 0 H ASN B 25 18.707 -1.445 4.411 1.00 0.00 H new ATOM 0 HA ASN B 25 19.909 1.068 4.395 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.944 -0.871 3.368 1.00 0.00 H new ATOM 0 HB3 ASN B 25 19.587 -1.100 2.282 1.00 0.00 H new ATOM 0 HD21 ASN B 25 22.556 1.623 1.420 1.00 0.00 H new ATOM 0 HD22 ASN B 25 22.456 0.827 2.994 1.00 0.00 H new ATOM 1546 N VAL B 26 17.381 0.779 2.284 1.00 0.00 N ATOM 1547 CA VAL B 26 16.438 1.537 1.480 1.00 0.00 C ATOM 1548 C VAL B 26 15.679 2.537 2.348 1.00 0.00 C ATOM 1549 O VAL B 26 15.554 3.707 1.990 1.00 0.00 O ATOM 1550 CB VAL B 26 15.434 0.613 0.762 1.00 0.00 C ATOM 1551 CG1 VAL B 26 14.608 1.399 -0.236 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.153 -0.533 0.067 1.00 0.00 C ATOM 0 H VAL B 26 17.215 -0.227 2.289 1.00 0.00 H new ATOM 0 HA VAL B 26 17.013 2.073 0.725 1.00 0.00 H new ATOM 0 HB VAL B 26 14.765 0.192 1.513 1.00 0.00 H new ATOM 0 HG11 VAL B 26 13.905 0.731 -0.733 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.057 2.183 0.284 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.267 1.850 -0.978 1.00 0.00 H new ATOM 0 HG21 VAL B 26 15.424 -1.171 -0.432 1.00 0.00 H new ATOM 0 HG22 VAL B 26 16.849 -0.132 -0.670 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.702 -1.118 0.804 1.00 0.00 H new ATOM 1562 N LYS B 27 15.200 2.072 3.501 1.00 0.00 N ATOM 1563 CA LYS B 27 14.489 2.934 4.439 1.00 0.00 C ATOM 1564 C LYS B 27 15.368 4.098 4.882 1.00 0.00 C ATOM 1565 O LYS B 27 14.901 5.233 4.984 1.00 0.00 O ATOM 1566 CB LYS B 27 14.031 2.150 5.673 1.00 0.00 C ATOM 1567 CG LYS B 27 12.918 1.152 5.403 1.00 0.00 C ATOM 1568 CD LYS B 27 12.417 0.537 6.700 1.00 0.00 C ATOM 1569 CE LYS B 27 11.192 -0.334 6.483 1.00 0.00 C ATOM 1570 NZ LYS B 27 10.476 -0.609 7.760 1.00 0.00 N ATOM 0 H LYS B 27 15.292 1.103 3.806 1.00 0.00 H new ATOM 0 HA LYS B 27 13.613 3.322 3.920 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.887 1.618 6.089 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.694 2.855 6.433 1.00 0.00 H new ATOM 0 HG2 LYS B 27 12.095 1.649 4.889 1.00 0.00 H new ATOM 0 HG3 LYS B 27 13.281 0.367 4.739 1.00 0.00 H new ATOM 0 HD2 LYS B 27 13.211 -0.060 7.148 1.00 0.00 H new ATOM 0 HD3 LYS B 27 12.177 1.330 7.408 1.00 0.00 H new ATOM 0 HE2 LYS B 27 10.515 0.158 5.785 1.00 0.00 H new ATOM 0 HE3 LYS B 27 11.492 -1.276 6.024 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 9.592 -1.119 7.560 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 11.079 -1.189 8.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 10.257 0.290 8.235 1.00 0.00 H new ATOM 1584 N SER B 28 16.637 3.813 5.139 1.00 0.00 N ATOM 1585 CA SER B 28 17.570 4.828 5.597 1.00 0.00 C ATOM 1586 C SER B 28 17.829 5.858 4.501 1.00 0.00 C ATOM 1587 O SER B 28 17.966 7.047 4.782 1.00 0.00 O ATOM 1588 CB SER B 28 18.874 4.182 6.053 1.00 0.00 C ATOM 1589 OG SER B 28 19.748 5.135 6.637 1.00 0.00 O ATOM 0 H SER B 28 17.043 2.883 5.037 1.00 0.00 H new ATOM 0 HA SER B 28 17.127 5.346 6.448 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.658 3.394 6.774 1.00 0.00 H new ATOM 0 HB3 SER B 28 19.365 3.710 5.202 1.00 0.00 H new ATOM 0 HG SER B 28 20.574 4.691 6.921 1.00 0.00 H new ATOM 1595 N LYS B 29 17.882 5.401 3.253 1.00 0.00 N ATOM 1596 CA LYS B 29 18.059 6.298 2.116 1.00 0.00 C ATOM 1597 C LYS B 29 16.858 7.229 1.972 1.00 0.00 C ATOM 1598 O LYS B 29 17.008 8.421 1.701 1.00 0.00 O ATOM 1599 CB LYS B 29 18.269 5.504 0.823 1.00 0.00 C ATOM 1600 CG LYS B 29 19.629 4.827 0.738 1.00 0.00 C ATOM 1601 CD LYS B 29 19.759 3.972 -0.515 1.00 0.00 C ATOM 1602 CE LYS B 29 21.158 3.383 -0.643 1.00 0.00 C ATOM 1603 NZ LYS B 29 21.245 2.356 -1.720 1.00 0.00 N ATOM 0 H LYS B 29 17.805 4.415 3.004 1.00 0.00 H new ATOM 0 HA LYS B 29 18.948 6.901 2.300 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.490 4.746 0.741 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.152 6.175 -0.028 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.413 5.584 0.744 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.781 4.205 1.620 1.00 0.00 H new ATOM 0 HD2 LYS B 29 19.025 3.167 -0.486 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.535 4.576 -1.394 1.00 0.00 H new ATOM 0 HE2 LYS B 29 21.869 4.183 -0.849 1.00 0.00 H new ATOM 0 HE3 LYS B 29 21.449 2.935 0.307 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 22.244 2.158 -1.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 20.778 1.482 -1.405 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 20.774 2.711 -2.577 1.00 0.00 H new ATOM 1617 N ILE B 30 15.665 6.684 2.176 1.00 0.00 N ATOM 1618 CA ILE B 30 14.450 7.485 2.117 1.00 0.00 C ATOM 1619 C ILE B 30 14.396 8.445 3.305 1.00 0.00 C ATOM 1620 O ILE B 30 13.963 9.586 3.175 1.00 0.00 O ATOM 1621 CB ILE B 30 13.178 6.608 2.103 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.266 5.556 0.995 1.00 0.00 C ATOM 1623 CG2 ILE B 30 11.941 7.475 1.907 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.102 4.588 0.976 1.00 0.00 C ATOM 0 H ILE B 30 15.514 5.697 2.383 1.00 0.00 H new ATOM 0 HA ILE B 30 14.478 8.049 1.185 1.00 0.00 H new ATOM 0 HB ILE B 30 13.100 6.097 3.063 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.322 6.061 0.031 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.192 4.994 1.114 1.00 0.00 H new ATOM 0 HG21 ILE B 30 11.052 6.844 1.899 1.00 0.00 H new ATOM 0 HG22 ILE B 30 11.868 8.195 2.722 1.00 0.00 H new ATOM 0 HG23 ILE B 30 12.016 8.008 0.959 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.236 3.874 0.164 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.057 4.054 1.925 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.173 5.139 0.825 1.00 0.00 H new ATOM 1636 N GLN B 31 14.862 7.984 4.461 1.00 0.00 N ATOM 1637 CA GLN B 31 14.895 8.815 5.659 1.00 0.00 C ATOM 1638 C GLN B 31 15.915 9.944 5.500 1.00 0.00 C ATOM 1639 O GLN B 31 15.742 11.039 6.037 1.00 0.00 O ATOM 1640 CB GLN B 31 15.228 7.969 6.890 1.00 0.00 C ATOM 1641 CG GLN B 31 15.170 8.747 8.194 1.00 0.00 C ATOM 1642 CD GLN B 31 15.485 7.887 9.399 1.00 0.00 C ATOM 1643 OE1 GLN B 31 16.254 6.931 9.312 1.00 0.00 O ATOM 1644 NE2 GLN B 31 14.903 8.228 10.537 1.00 0.00 N ATOM 0 H GLN B 31 15.222 7.039 4.594 1.00 0.00 H new ATOM 0 HA GLN B 31 13.908 9.256 5.798 1.00 0.00 H new ATOM 0 HB2 GLN B 31 14.532 7.132 6.945 1.00 0.00 H new ATOM 0 HB3 GLN B 31 16.226 7.547 6.772 1.00 0.00 H new ATOM 0 HG2 GLN B 31 15.876 9.576 8.150 1.00 0.00 H new ATOM 0 HG3 GLN B 31 14.176 9.180 8.311 1.00 0.00 H new ATOM 0 HE21 GLN B 31 14.271 9.028 10.567 1.00 0.00 H new ATOM 0 HE22 GLN B 31 15.086 7.691 11.384 1.00 0.00 H new ATOM 1653 N ASP B 32 16.975 9.673 4.754 1.00 0.00 N ATOM 1654 CA ASP B 32 17.992 10.676 4.471 1.00 0.00 C ATOM 1655 C ASP B 32 17.435 11.782 3.579 1.00 0.00 C ATOM 1656 O ASP B 32 17.694 12.967 3.805 1.00 0.00 O ATOM 1657 CB ASP B 32 19.210 10.028 3.804 1.00 0.00 C ATOM 1658 CG ASP B 32 20.185 11.048 3.244 1.00 0.00 C ATOM 1659 OD1 ASP B 32 20.860 11.735 4.036 1.00 0.00 O ATOM 1660 OD2 ASP B 32 20.283 11.162 2.004 1.00 0.00 O ATOM 0 H ASP B 32 17.154 8.762 4.331 1.00 0.00 H new ATOM 0 HA ASP B 32 18.300 11.120 5.418 1.00 0.00 H new ATOM 0 HB2 ASP B 32 19.725 9.400 4.531 1.00 0.00 H new ATOM 0 HB3 ASP B 32 18.873 9.374 3.000 1.00 0.00 H new ATOM 1665 N LYS B 33 16.652 11.397 2.581 1.00 0.00 N ATOM 1666 CA LYS B 33 16.131 12.344 1.615 1.00 0.00 C ATOM 1667 C LYS B 33 14.816 12.978 2.082 1.00 0.00 C ATOM 1668 O LYS B 33 14.671 14.199 2.054 1.00 0.00 O ATOM 1669 CB LYS B 33 15.949 11.648 0.272 1.00 0.00 C ATOM 1670 CG LYS B 33 15.878 12.617 -0.888 1.00 0.00 C ATOM 1671 CD LYS B 33 16.144 11.926 -2.214 1.00 0.00 C ATOM 1672 CE LYS B 33 17.545 11.338 -2.263 1.00 0.00 C ATOM 1673 NZ LYS B 33 17.874 10.802 -3.608 1.00 0.00 N ATOM 0 H LYS B 33 16.365 10.431 2.422 1.00 0.00 H new ATOM 0 HA LYS B 33 16.851 13.156 1.511 1.00 0.00 H new ATOM 0 HB2 LYS B 33 16.776 10.957 0.111 1.00 0.00 H new ATOM 0 HB3 LYS B 33 15.037 11.052 0.298 1.00 0.00 H new ATOM 0 HG2 LYS B 33 14.894 13.084 -0.912 1.00 0.00 H new ATOM 0 HG3 LYS B 33 16.606 13.415 -0.741 1.00 0.00 H new ATOM 0 HD2 LYS B 33 15.410 11.135 -2.367 1.00 0.00 H new ATOM 0 HD3 LYS B 33 16.018 12.639 -3.029 1.00 0.00 H new ATOM 0 HE2 LYS B 33 18.270 12.105 -1.990 1.00 0.00 H new ATOM 0 HE3 LYS B 33 17.630 10.541 -1.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 18.837 10.410 -3.599 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 17.198 10.053 -3.858 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 17.818 11.567 -4.310 1.00 0.00 H new ATOM 1687 N GLU B 34 13.867 12.154 2.514 1.00 0.00 N ATOM 1688 CA GLU B 34 12.566 12.648 2.967 1.00 0.00 C ATOM 1689 C GLU B 34 12.586 12.990 4.455 1.00 0.00 C ATOM 1690 O GLU B 34 12.158 14.071 4.859 1.00 0.00 O ATOM 1691 CB GLU B 34 11.473 11.612 2.689 1.00 0.00 C ATOM 1692 CG GLU B 34 10.991 11.601 1.249 1.00 0.00 C ATOM 1693 CD GLU B 34 10.304 12.895 0.865 1.00 0.00 C ATOM 1694 OE1 GLU B 34 9.080 13.014 1.085 1.00 0.00 O ATOM 1695 OE2 GLU B 34 10.991 13.809 0.362 1.00 0.00 O ATOM 0 H GLU B 34 13.972 11.140 2.561 1.00 0.00 H new ATOM 0 HA GLU B 34 12.349 13.559 2.409 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.851 10.622 2.943 1.00 0.00 H new ATOM 0 HB3 GLU B 34 10.625 11.808 3.345 1.00 0.00 H new ATOM 0 HG2 GLU B 34 11.839 11.431 0.585 1.00 0.00 H new ATOM 0 HG3 GLU B 34 10.302 10.769 1.105 1.00 0.00 H new ATOM 1702 N GLY B 35 13.094 12.073 5.266 1.00 0.00 N ATOM 1703 CA GLY B 35 13.168 12.310 6.698 1.00 0.00 C ATOM 1704 C GLY B 35 12.037 11.648 7.457 1.00 0.00 C ATOM 1705 O GLY B 35 11.470 12.234 8.379 1.00 0.00 O ATOM 0 H GLY B 35 13.456 11.170 4.961 1.00 0.00 H new ATOM 0 HA2 GLY B 35 14.121 11.938 7.075 1.00 0.00 H new ATOM 0 HA3 GLY B 35 13.148 13.383 6.886 1.00 0.00 H new ATOM 1709 N ILE B 36 11.712 10.426 7.073 1.00 0.00 N ATOM 1710 CA ILE B 36 10.618 9.697 7.692 1.00 0.00 C ATOM 1711 C ILE B 36 11.156 8.500 8.481 1.00 0.00 C ATOM 1712 O ILE B 36 12.049 7.798 8.006 1.00 0.00 O ATOM 1713 CB ILE B 36 9.619 9.204 6.621 1.00 0.00 C ATOM 1714 CG1 ILE B 36 9.183 10.364 5.720 1.00 0.00 C ATOM 1715 CG2 ILE B 36 8.408 8.563 7.274 1.00 0.00 C ATOM 1716 CD1 ILE B 36 8.275 9.950 4.578 1.00 0.00 C ATOM 0 H ILE B 36 12.192 9.915 6.332 1.00 0.00 H new ATOM 0 HA ILE B 36 10.101 10.373 8.373 1.00 0.00 H new ATOM 0 HB ILE B 36 10.119 8.454 6.007 1.00 0.00 H new ATOM 0 HG12 ILE B 36 8.669 11.109 6.327 1.00 0.00 H new ATOM 0 HG13 ILE B 36 10.071 10.845 5.309 1.00 0.00 H new ATOM 0 HG21 ILE B 36 7.717 8.222 6.503 1.00 0.00 H new ATOM 0 HG22 ILE B 36 8.727 7.713 7.877 1.00 0.00 H new ATOM 0 HG23 ILE B 36 7.909 9.293 7.912 1.00 0.00 H new ATOM 0 HD11 ILE B 36 8.011 10.827 3.987 1.00 0.00 H new ATOM 0 HD12 ILE B 36 8.792 9.228 3.945 1.00 0.00 H new ATOM 0 HD13 ILE B 36 7.369 9.497 4.980 1.00 0.00 H new ATOM 1728 N PRO B 37 10.645 8.274 9.708 1.00 0.00 N ATOM 1729 CA PRO B 37 11.048 7.134 10.543 1.00 0.00 C ATOM 1730 C PRO B 37 10.918 5.794 9.809 1.00 0.00 C ATOM 1731 O PRO B 37 9.863 5.480 9.252 1.00 0.00 O ATOM 1732 CB PRO B 37 10.084 7.190 11.740 1.00 0.00 C ATOM 1733 CG PRO B 37 9.020 8.165 11.358 1.00 0.00 C ATOM 1734 CD PRO B 37 9.656 9.118 10.392 1.00 0.00 C ATOM 0 HA PRO B 37 12.098 7.200 10.829 1.00 0.00 H new ATOM 0 HB2 PRO B 37 9.659 6.208 11.946 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.601 7.510 12.645 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.171 7.656 10.901 1.00 0.00 H new ATOM 0 HG3 PRO B 37 8.642 8.692 12.234 1.00 0.00 H new ATOM 0 HD2 PRO B 37 8.928 9.534 9.695 1.00 0.00 H new ATOM 0 HD3 PRO B 37 10.125 9.959 10.903 1.00 0.00 H new ATOM 1742 N PRO B 38 11.995 4.985 9.816 1.00 0.00 N ATOM 1743 CA PRO B 38 12.060 3.721 9.067 1.00 0.00 C ATOM 1744 C PRO B 38 10.970 2.725 9.453 1.00 0.00 C ATOM 1745 O PRO B 38 10.432 2.024 8.596 1.00 0.00 O ATOM 1746 CB PRO B 38 13.444 3.163 9.419 1.00 0.00 C ATOM 1747 CG PRO B 38 14.229 4.344 9.868 1.00 0.00 C ATOM 1748 CD PRO B 38 13.244 5.248 10.549 1.00 0.00 C ATOM 0 HA PRO B 38 11.905 3.890 8.001 1.00 0.00 H new ATOM 0 HB2 PRO B 38 13.379 2.410 10.204 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.908 2.684 8.557 1.00 0.00 H new ATOM 0 HG2 PRO B 38 15.026 4.048 10.550 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.702 4.845 9.023 1.00 0.00 H new ATOM 0 HD2 PRO B 38 13.147 5.014 11.609 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.541 6.295 10.479 1.00 0.00 H new ATOM 1756 N ASP B 39 10.634 2.662 10.735 1.00 0.00 N ATOM 1757 CA ASP B 39 9.625 1.716 11.208 1.00 0.00 C ATOM 1758 C ASP B 39 8.245 2.110 10.696 1.00 0.00 C ATOM 1759 O ASP B 39 7.388 1.256 10.458 1.00 0.00 O ATOM 1760 CB ASP B 39 9.619 1.631 12.740 1.00 0.00 C ATOM 1761 CG ASP B 39 9.154 2.911 13.403 1.00 0.00 C ATOM 1762 OD1 ASP B 39 9.947 3.875 13.455 1.00 0.00 O ATOM 1763 OD2 ASP B 39 7.999 2.954 13.879 1.00 0.00 O ATOM 0 H ASP B 39 11.041 3.249 11.463 1.00 0.00 H new ATOM 0 HA ASP B 39 9.879 0.731 10.816 1.00 0.00 H new ATOM 0 HB2 ASP B 39 8.971 0.812 13.050 1.00 0.00 H new ATOM 0 HB3 ASP B 39 10.624 1.392 13.089 1.00 0.00 H new ATOM 1768 N GLN B 40 8.048 3.406 10.505 1.00 0.00 N ATOM 1769 CA GLN B 40 6.800 3.917 9.966 1.00 0.00 C ATOM 1770 C GLN B 40 6.778 3.751 8.449 1.00 0.00 C ATOM 1771 O GLN B 40 5.729 3.497 7.858 1.00 0.00 O ATOM 1772 CB GLN B 40 6.625 5.388 10.346 1.00 0.00 C ATOM 1773 CG GLN B 40 5.324 5.997 9.854 1.00 0.00 C ATOM 1774 CD GLN B 40 5.267 7.495 10.068 1.00 0.00 C ATOM 1775 OE1 GLN B 40 4.777 7.977 11.088 1.00 0.00 O ATOM 1776 NE2 GLN B 40 5.784 8.239 9.107 1.00 0.00 N ATOM 0 H GLN B 40 8.741 4.124 10.717 1.00 0.00 H new ATOM 0 HA GLN B 40 5.972 3.349 10.390 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.672 5.481 11.431 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.459 5.960 9.941 1.00 0.00 H new ATOM 0 HG2 GLN B 40 5.204 5.780 8.793 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.488 5.527 10.372 1.00 0.00 H new ATOM 0 HE21 GLN B 40 6.180 7.797 8.277 1.00 0.00 H new ATOM 0 HE22 GLN B 40 5.787 9.255 9.194 1.00 0.00 H new ATOM 1785 N GLN B 41 7.939 3.896 7.824 1.00 0.00 N ATOM 1786 CA GLN B 41 8.069 3.703 6.384 1.00 0.00 C ATOM 1787 C GLN B 41 7.863 2.237 6.017 1.00 0.00 C ATOM 1788 O GLN B 41 8.774 1.424 6.169 1.00 0.00 O ATOM 1789 CB GLN B 41 9.450 4.149 5.900 1.00 0.00 C ATOM 1790 CG GLN B 41 9.691 5.645 5.976 1.00 0.00 C ATOM 1791 CD GLN B 41 11.085 6.041 5.517 1.00 0.00 C ATOM 1792 OE1 GLN B 41 11.298 7.143 5.017 1.00 0.00 O ATOM 1793 NE2 GLN B 41 12.044 5.141 5.673 1.00 0.00 N ATOM 0 H GLN B 41 8.809 4.148 8.294 1.00 0.00 H new ATOM 0 HA GLN B 41 7.304 4.309 5.899 1.00 0.00 H new ATOM 0 HB2 GLN B 41 10.210 3.641 6.493 1.00 0.00 H new ATOM 0 HB3 GLN B 41 9.581 3.825 4.868 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.952 6.159 5.362 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.542 5.981 7.002 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.831 4.236 6.092 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.996 5.353 5.374 1.00 0.00 H new ATOM 1802 N ARG B 42 6.675 1.890 5.552 1.00 0.00 N ATOM 1803 CA ARG B 42 6.418 0.530 5.124 1.00 0.00 C ATOM 1804 C ARG B 42 6.207 0.478 3.616 1.00 0.00 C ATOM 1805 O ARG B 42 5.202 0.959 3.093 1.00 0.00 O ATOM 1806 CB ARG B 42 5.223 -0.057 5.874 1.00 0.00 C ATOM 1807 CG ARG B 42 4.881 -1.464 5.434 1.00 0.00 C ATOM 1808 CD ARG B 42 4.027 -2.182 6.466 1.00 0.00 C ATOM 1809 NE ARG B 42 4.800 -2.531 7.662 1.00 0.00 N ATOM 1810 CZ ARG B 42 4.417 -3.447 8.555 1.00 0.00 C ATOM 1811 NH1 ARG B 42 3.229 -4.032 8.456 1.00 0.00 N ATOM 1812 NH2 ARG B 42 5.210 -3.757 9.571 1.00 0.00 N ATOM 0 H ARG B 42 5.882 2.525 5.463 1.00 0.00 H new ATOM 0 HA ARG B 42 7.289 -0.080 5.363 1.00 0.00 H new ATOM 0 HB2 ARG B 42 5.437 -0.059 6.943 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.356 0.586 5.724 1.00 0.00 H new ATOM 0 HG2 ARG B 42 4.350 -1.429 4.483 1.00 0.00 H new ATOM 0 HG3 ARG B 42 5.799 -2.027 5.266 1.00 0.00 H new ATOM 0 HD2 ARG B 42 3.187 -1.547 6.748 1.00 0.00 H new ATOM 0 HD3 ARG B 42 3.609 -3.087 6.026 1.00 0.00 H new ATOM 0 HE ARG B 42 5.683 -2.045 7.821 1.00 0.00 H new ATOM 0 HH11 ARG B 42 2.600 -3.783 7.693 1.00 0.00 H new ATOM 0 HH12 ARG B 42 2.946 -4.731 9.143 1.00 0.00 H new ATOM 0 HH21 ARG B 42 6.114 -3.296 9.671 1.00 0.00 H new ATOM 0 HH22 ARG B 42 4.916 -4.457 10.252 1.00 0.00 H new ATOM 1826 N LEU B 43 7.187 -0.086 2.925 1.00 0.00 N ATOM 1827 CA LEU B 43 7.141 -0.202 1.477 1.00 0.00 C ATOM 1828 C LEU B 43 6.249 -1.365 1.068 1.00 0.00 C ATOM 1829 O LEU B 43 6.161 -2.366 1.779 1.00 0.00 O ATOM 1830 CB LEU B 43 8.550 -0.419 0.915 1.00 0.00 C ATOM 1831 CG LEU B 43 9.530 0.734 1.128 1.00 0.00 C ATOM 1832 CD1 LEU B 43 10.939 0.302 0.748 1.00 0.00 C ATOM 1833 CD2 LEU B 43 9.110 1.942 0.308 1.00 0.00 C ATOM 0 H LEU B 43 8.030 -0.473 3.349 1.00 0.00 H new ATOM 0 HA LEU B 43 6.732 0.724 1.073 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.969 -1.317 1.369 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.470 -0.611 -0.155 1.00 0.00 H new ATOM 0 HG LEU B 43 9.521 1.010 2.182 1.00 0.00 H new ATOM 0 HD11 LEU B 43 11.628 1.132 0.904 1.00 0.00 H new ATOM 0 HD12 LEU B 43 11.241 -0.542 1.368 1.00 0.00 H new ATOM 0 HD13 LEU B 43 10.958 0.006 -0.301 1.00 0.00 H new ATOM 0 HD21 LEU B 43 9.817 2.755 0.470 1.00 0.00 H new ATOM 0 HD22 LEU B 43 9.097 1.677 -0.749 1.00 0.00 H new ATOM 0 HD23 LEU B 43 8.114 2.261 0.614 1.00 0.00 H new ATOM 1845 N ILE B 44 5.577 -1.219 -0.062 1.00 0.00 N ATOM 1846 CA ILE B 44 4.777 -2.297 -0.615 1.00 0.00 C ATOM 1847 C ILE B 44 5.111 -2.493 -2.088 1.00 0.00 C ATOM 1848 O ILE B 44 4.975 -1.569 -2.898 1.00 0.00 O ATOM 1849 CB ILE B 44 3.263 -2.035 -0.466 1.00 0.00 C ATOM 1850 CG1 ILE B 44 2.910 -1.737 0.994 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.475 -3.238 -0.970 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.454 -1.388 1.206 1.00 0.00 C ATOM 0 H ILE B 44 5.570 -0.362 -0.615 1.00 0.00 H new ATOM 0 HA ILE B 44 5.019 -3.198 -0.052 1.00 0.00 H new ATOM 0 HB ILE B 44 2.997 -1.164 -1.065 1.00 0.00 H new ATOM 0 HG12 ILE B 44 3.159 -2.605 1.604 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.528 -0.911 1.347 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.408 -3.045 -0.861 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.707 -3.411 -2.021 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.745 -4.120 -0.389 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.278 -1.189 2.263 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.204 -0.501 0.624 1.00 0.00 H new ATOM 0 HD13 ILE B 44 0.830 -2.221 0.884 1.00 0.00 H new ATOM 1864 N PHE B 45 5.562 -3.691 -2.422 1.00 0.00 N ATOM 1865 CA PHE B 45 5.911 -4.036 -3.791 1.00 0.00 C ATOM 1866 C PHE B 45 4.874 -4.980 -4.385 1.00 0.00 C ATOM 1867 O PHE B 45 4.828 -6.164 -4.044 1.00 0.00 O ATOM 1868 CB PHE B 45 7.306 -4.672 -3.850 1.00 0.00 C ATOM 1869 CG PHE B 45 7.661 -5.237 -5.200 1.00 0.00 C ATOM 1870 CD1 PHE B 45 7.811 -4.407 -6.299 1.00 0.00 C ATOM 1871 CD2 PHE B 45 7.841 -6.603 -5.369 1.00 0.00 C ATOM 1872 CE1 PHE B 45 8.132 -4.928 -7.538 1.00 0.00 C ATOM 1873 CE2 PHE B 45 8.163 -7.127 -6.606 1.00 0.00 C ATOM 1874 CZ PHE B 45 8.309 -6.288 -7.692 1.00 0.00 C ATOM 0 H PHE B 45 5.696 -4.450 -1.754 1.00 0.00 H new ATOM 0 HA PHE B 45 5.924 -3.119 -4.381 1.00 0.00 H new ATOM 0 HB2 PHE B 45 8.048 -3.923 -3.574 1.00 0.00 H new ATOM 0 HB3 PHE B 45 7.364 -5.468 -3.107 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.676 -3.341 -6.186 1.00 0.00 H new ATOM 0 HD2 PHE B 45 7.728 -7.264 -4.523 1.00 0.00 H new ATOM 0 HE1 PHE B 45 8.245 -4.270 -8.387 1.00 0.00 H new ATOM 0 HE2 PHE B 45 8.300 -8.192 -6.723 1.00 0.00 H new ATOM 0 HZ PHE B 45 8.561 -6.695 -8.660 1.00 0.00 H new ATOM 1884 N ALA B 46 4.015 -4.425 -5.237 1.00 0.00 N ATOM 1885 CA ALA B 46 3.024 -5.199 -5.990 1.00 0.00 C ATOM 1886 C ALA B 46 2.053 -5.955 -5.079 1.00 0.00 C ATOM 1887 O ALA B 46 1.367 -6.874 -5.524 1.00 0.00 O ATOM 1888 CB ALA B 46 3.722 -6.166 -6.936 1.00 0.00 C ATOM 0 H ALA B 46 3.984 -3.423 -5.427 1.00 0.00 H new ATOM 0 HA ALA B 46 2.432 -4.488 -6.566 1.00 0.00 H new ATOM 0 HB1 ALA B 46 2.976 -6.735 -7.490 1.00 0.00 H new ATOM 0 HB2 ALA B 46 4.344 -5.606 -7.635 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.347 -6.850 -6.361 1.00 0.00 H new ATOM 1894 N GLY B 47 1.988 -5.555 -3.816 1.00 0.00 N ATOM 1895 CA GLY B 47 1.100 -6.211 -2.875 1.00 0.00 C ATOM 1896 C GLY B 47 1.858 -6.875 -1.746 1.00 0.00 C ATOM 1897 O GLY B 47 1.283 -7.212 -0.713 1.00 0.00 O ATOM 0 H GLY B 47 2.535 -4.787 -3.426 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.404 -5.480 -2.463 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.504 -6.958 -3.400 1.00 0.00 H new ATOM 1901 N LYS B 48 3.152 -7.064 -1.950 1.00 0.00 N ATOM 1902 CA LYS B 48 4.008 -7.644 -0.933 1.00 0.00 C ATOM 1903 C LYS B 48 4.573 -6.552 -0.036 1.00 0.00 C ATOM 1904 O LYS B 48 5.281 -5.657 -0.501 1.00 0.00 O ATOM 1905 CB LYS B 48 5.140 -8.443 -1.590 1.00 0.00 C ATOM 1906 CG LYS B 48 6.261 -8.855 -0.639 1.00 0.00 C ATOM 1907 CD LYS B 48 5.764 -9.738 0.498 1.00 0.00 C ATOM 1908 CE LYS B 48 5.331 -11.110 0.010 1.00 0.00 C ATOM 1909 NZ LYS B 48 4.908 -11.985 1.134 1.00 0.00 N ATOM 0 H LYS B 48 3.633 -6.822 -2.816 1.00 0.00 H new ATOM 0 HA LYS B 48 3.417 -8.323 -0.318 1.00 0.00 H new ATOM 0 HB2 LYS B 48 4.718 -9.340 -2.044 1.00 0.00 H new ATOM 0 HB3 LYS B 48 5.566 -7.848 -2.397 1.00 0.00 H new ATOM 0 HG2 LYS B 48 7.031 -9.387 -1.198 1.00 0.00 H new ATOM 0 HG3 LYS B 48 6.728 -7.962 -0.224 1.00 0.00 H new ATOM 0 HD2 LYS B 48 6.554 -9.851 1.241 1.00 0.00 H new ATOM 0 HD3 LYS B 48 4.926 -9.250 0.996 1.00 0.00 H new ATOM 0 HE2 LYS B 48 4.508 -11.002 -0.697 1.00 0.00 H new ATOM 0 HE3 LYS B 48 6.153 -11.581 -0.528 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 4.962 -12.981 0.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 5.536 -11.831 1.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 3.930 -11.756 1.403 1.00 0.00 H new ATOM 1923 N GLN B 49 4.229 -6.619 1.242 1.00 0.00 N ATOM 1924 CA GLN B 49 4.757 -5.692 2.232 1.00 0.00 C ATOM 1925 C GLN B 49 6.250 -5.928 2.420 1.00 0.00 C ATOM 1926 O GLN B 49 6.717 -7.064 2.359 1.00 0.00 O ATOM 1927 CB GLN B 49 4.027 -5.868 3.564 1.00 0.00 C ATOM 1928 CG GLN B 49 2.544 -5.541 3.497 1.00 0.00 C ATOM 1929 CD GLN B 49 1.807 -5.888 4.778 1.00 0.00 C ATOM 1930 OE1 GLN B 49 0.617 -6.193 4.760 1.00 0.00 O ATOM 1931 NE2 GLN B 49 2.513 -5.853 5.898 1.00 0.00 N ATOM 0 H GLN B 49 3.582 -7.311 1.619 1.00 0.00 H new ATOM 0 HA GLN B 49 4.600 -4.673 1.879 1.00 0.00 H new ATOM 0 HB2 GLN B 49 4.148 -6.898 3.901 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.497 -5.230 4.313 1.00 0.00 H new ATOM 0 HG2 GLN B 49 2.420 -4.478 3.288 1.00 0.00 H new ATOM 0 HG3 GLN B 49 2.094 -6.084 2.666 1.00 0.00 H new ATOM 0 HE21 GLN B 49 3.499 -5.595 5.871 1.00 0.00 H new ATOM 0 HE22 GLN B 49 2.070 -6.084 6.787 1.00 0.00 H new ATOM 1940 N LEU B 50 6.998 -4.858 2.624 1.00 0.00 N ATOM 1941 CA LEU B 50 8.440 -4.970 2.789 1.00 0.00 C ATOM 1942 C LEU B 50 8.863 -4.542 4.188 1.00 0.00 C ATOM 1943 O LEU B 50 8.905 -3.349 4.496 1.00 0.00 O ATOM 1944 CB LEU B 50 9.173 -4.110 1.756 1.00 0.00 C ATOM 1945 CG LEU B 50 8.699 -4.260 0.308 1.00 0.00 C ATOM 1946 CD1 LEU B 50 9.557 -3.419 -0.614 1.00 0.00 C ATOM 1947 CD2 LEU B 50 8.730 -5.713 -0.132 1.00 0.00 C ATOM 0 H LEU B 50 6.635 -3.906 2.679 1.00 0.00 H new ATOM 0 HA LEU B 50 8.706 -6.016 2.640 1.00 0.00 H new ATOM 0 HB2 LEU B 50 9.072 -3.064 2.045 1.00 0.00 H new ATOM 0 HB3 LEU B 50 10.235 -4.352 1.798 1.00 0.00 H new ATOM 0 HG LEU B 50 7.668 -3.911 0.254 1.00 0.00 H new ATOM 0 HD11 LEU B 50 9.209 -3.535 -1.641 1.00 0.00 H new ATOM 0 HD12 LEU B 50 9.485 -2.371 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU B 50 10.595 -3.745 -0.543 1.00 0.00 H new ATOM 0 HD21 LEU B 50 8.388 -5.788 -1.164 1.00 0.00 H new ATOM 0 HD22 LEU B 50 9.749 -6.094 -0.059 1.00 0.00 H new ATOM 0 HD23 LEU B 50 8.075 -6.302 0.511 1.00 0.00 H new ATOM 1959 N GLU B 51 9.166 -5.511 5.038 1.00 0.00 N ATOM 1960 CA GLU B 51 9.686 -5.213 6.362 1.00 0.00 C ATOM 1961 C GLU B 51 11.205 -5.148 6.325 1.00 0.00 C ATOM 1962 O GLU B 51 11.841 -5.758 5.461 1.00 0.00 O ATOM 1963 CB GLU B 51 9.253 -6.259 7.393 1.00 0.00 C ATOM 1964 CG GLU B 51 7.749 -6.342 7.616 1.00 0.00 C ATOM 1965 CD GLU B 51 7.055 -7.288 6.659 1.00 0.00 C ATOM 1966 OE1 GLU B 51 7.170 -8.519 6.848 1.00 0.00 O ATOM 1967 OE2 GLU B 51 6.374 -6.815 5.729 1.00 0.00 O ATOM 0 H GLU B 51 9.061 -6.505 4.836 1.00 0.00 H new ATOM 0 HA GLU B 51 9.277 -4.248 6.661 1.00 0.00 H new ATOM 0 HB2 GLU B 51 9.615 -7.236 7.074 1.00 0.00 H new ATOM 0 HB3 GLU B 51 9.737 -6.035 8.344 1.00 0.00 H new ATOM 0 HG2 GLU B 51 7.557 -6.665 8.639 1.00 0.00 H new ATOM 0 HG3 GLU B 51 7.317 -5.347 7.510 1.00 0.00 H new ATOM 1974 N ASP B 52 11.777 -4.407 7.257 1.00 0.00 N ATOM 1975 CA ASP B 52 13.223 -4.296 7.378 1.00 0.00 C ATOM 1976 C ASP B 52 13.796 -5.531 8.058 1.00 0.00 C ATOM 1977 O ASP B 52 13.063 -6.312 8.670 1.00 0.00 O ATOM 1978 CB ASP B 52 13.598 -3.036 8.160 1.00 0.00 C ATOM 1979 CG ASP B 52 12.777 -2.882 9.423 1.00 0.00 C ATOM 1980 OD1 ASP B 52 11.628 -2.400 9.320 1.00 0.00 O ATOM 1981 OD2 ASP B 52 13.266 -3.232 10.513 1.00 0.00 O ATOM 0 H ASP B 52 11.257 -3.867 7.949 1.00 0.00 H new ATOM 0 HA ASP B 52 13.648 -4.223 6.377 1.00 0.00 H new ATOM 0 HB2 ASP B 52 14.656 -3.072 8.419 1.00 0.00 H new ATOM 0 HB3 ASP B 52 13.455 -2.161 7.526 1.00 0.00 H new ATOM 1986 N GLY B 53 15.103 -5.703 7.950 1.00 0.00 N ATOM 1987 CA GLY B 53 15.734 -6.901 8.459 1.00 0.00 C ATOM 1988 C GLY B 53 16.009 -7.893 7.351 1.00 0.00 C ATOM 1989 O GLY B 53 16.704 -8.888 7.550 1.00 0.00 O ATOM 0 H GLY B 53 15.739 -5.033 7.518 1.00 0.00 H new ATOM 0 HA2 GLY B 53 16.669 -6.639 8.955 1.00 0.00 H new ATOM 0 HA3 GLY B 53 15.092 -7.361 9.210 1.00 0.00 H new ATOM 1993 N ARG B 54 15.454 -7.615 6.180 1.00 0.00 N ATOM 1994 CA ARG B 54 15.618 -8.473 5.016 1.00 0.00 C ATOM 1995 C ARG B 54 16.130 -7.644 3.841 1.00 0.00 C ATOM 1996 O ARG B 54 16.215 -6.420 3.942 1.00 0.00 O ATOM 1997 CB ARG B 54 14.279 -9.130 4.667 1.00 0.00 C ATOM 1998 CG ARG B 54 13.615 -9.801 5.860 1.00 0.00 C ATOM 1999 CD ARG B 54 12.201 -10.251 5.545 1.00 0.00 C ATOM 2000 NE ARG B 54 11.472 -10.614 6.758 1.00 0.00 N ATOM 2001 CZ ARG B 54 10.194 -10.299 6.981 1.00 0.00 C ATOM 2002 NH1 ARG B 54 9.510 -9.602 6.083 1.00 0.00 N ATOM 2003 NH2 ARG B 54 9.611 -10.652 8.118 1.00 0.00 N ATOM 0 H ARG B 54 14.879 -6.790 6.010 1.00 0.00 H new ATOM 0 HA ARG B 54 16.343 -9.256 5.236 1.00 0.00 H new ATOM 0 HB2 ARG B 54 13.606 -8.375 4.261 1.00 0.00 H new ATOM 0 HB3 ARG B 54 14.438 -9.870 3.883 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.209 -10.661 6.169 1.00 0.00 H new ATOM 0 HG3 ARG B 54 13.596 -9.108 6.701 1.00 0.00 H new ATOM 0 HD2 ARG B 54 11.671 -9.452 5.026 1.00 0.00 H new ATOM 0 HD3 ARG B 54 12.232 -11.105 4.869 1.00 0.00 H new ATOM 0 HE ARG B 54 11.969 -11.139 7.477 1.00 0.00 H new ATOM 0 HH11 ARG B 54 9.960 -9.304 5.218 1.00 0.00 H new ATOM 0 HH12 ARG B 54 8.534 -9.364 6.258 1.00 0.00 H new ATOM 0 HH21 ARG B 54 10.139 -11.165 8.824 1.00 0.00 H new ATOM 0 HH22 ARG B 54 8.634 -10.411 8.287 1.00 0.00 H new ATOM 2017 N THR B 55 16.470 -8.295 2.737 1.00 0.00 N ATOM 2018 CA THR B 55 16.992 -7.589 1.573 1.00 0.00 C ATOM 2019 C THR B 55 15.924 -7.453 0.493 1.00 0.00 C ATOM 2020 O THR B 55 14.816 -7.973 0.635 1.00 0.00 O ATOM 2021 CB THR B 55 18.216 -8.316 0.974 1.00 0.00 C ATOM 2022 OG1 THR B 55 17.828 -9.590 0.446 1.00 0.00 O ATOM 2023 CG2 THR B 55 19.302 -8.508 2.021 1.00 0.00 C ATOM 0 H THR B 55 16.395 -9.306 2.622 1.00 0.00 H new ATOM 0 HA THR B 55 17.296 -6.599 1.913 1.00 0.00 H new ATOM 0 HB THR B 55 18.613 -7.697 0.170 1.00 0.00 H new ATOM 0 HG1 THR B 55 17.473 -10.149 1.168 1.00 0.00 H new ATOM 0 HG21 THR B 55 20.152 -9.022 1.573 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.622 -7.536 2.396 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.911 -9.104 2.846 1.00 0.00 H new ATOM 2031 N LEU B 56 16.263 -6.754 -0.585 1.00 0.00 N ATOM 2032 CA LEU B 56 15.367 -6.633 -1.732 1.00 0.00 C ATOM 2033 C LEU B 56 15.163 -7.997 -2.382 1.00 0.00 C ATOM 2034 O LEU B 56 14.105 -8.286 -2.949 1.00 0.00 O ATOM 2035 CB LEU B 56 15.925 -5.651 -2.776 1.00 0.00 C ATOM 2036 CG LEU B 56 15.809 -4.155 -2.446 1.00 0.00 C ATOM 2037 CD1 LEU B 56 14.364 -3.771 -2.185 1.00 0.00 C ATOM 2038 CD2 LEU B 56 16.679 -3.781 -1.257 1.00 0.00 C ATOM 0 H LEU B 56 17.151 -6.263 -0.690 1.00 0.00 H new ATOM 0 HA LEU B 56 14.413 -6.249 -1.370 1.00 0.00 H new ATOM 0 HB2 LEU B 56 16.978 -5.884 -2.934 1.00 0.00 H new ATOM 0 HB3 LEU B 56 15.413 -5.832 -3.721 1.00 0.00 H new ATOM 0 HG LEU B 56 16.166 -3.599 -3.313 1.00 0.00 H new ATOM 0 HD11 LEU B 56 14.306 -2.707 -1.953 1.00 0.00 H new ATOM 0 HD12 LEU B 56 13.766 -3.982 -3.071 1.00 0.00 H new ATOM 0 HD13 LEU B 56 13.981 -4.347 -1.343 1.00 0.00 H new ATOM 0 HD21 LEU B 56 16.574 -2.716 -1.050 1.00 0.00 H new ATOM 0 HD22 LEU B 56 16.367 -4.353 -0.383 1.00 0.00 H new ATOM 0 HD23 LEU B 56 17.721 -4.005 -1.484 1.00 0.00 H new ATOM 2050 N SER B 57 16.179 -8.841 -2.272 1.00 0.00 N ATOM 2051 CA SER B 57 16.157 -10.163 -2.876 1.00 0.00 C ATOM 2052 C SER B 57 15.192 -11.084 -2.125 1.00 0.00 C ATOM 2053 O SER B 57 14.686 -12.055 -2.687 1.00 0.00 O ATOM 2054 CB SER B 57 17.573 -10.748 -2.875 1.00 0.00 C ATOM 2055 OG SER B 57 17.651 -11.956 -3.618 1.00 0.00 O ATOM 0 H SER B 57 17.038 -8.629 -1.764 1.00 0.00 H new ATOM 0 HA SER B 57 15.806 -10.079 -3.905 1.00 0.00 H new ATOM 0 HB2 SER B 57 18.266 -10.019 -3.294 1.00 0.00 H new ATOM 0 HB3 SER B 57 17.888 -10.933 -1.848 1.00 0.00 H new ATOM 0 HG SER B 57 18.570 -12.296 -3.594 1.00 0.00 H new ATOM 2061 N ASP B 58 14.912 -10.755 -0.865 1.00 0.00 N ATOM 2062 CA ASP B 58 14.020 -11.568 -0.038 1.00 0.00 C ATOM 2063 C ASP B 58 12.567 -11.394 -0.456 1.00 0.00 C ATOM 2064 O ASP B 58 11.687 -12.085 0.053 1.00 0.00 O ATOM 2065 CB ASP B 58 14.149 -11.206 1.447 1.00 0.00 C ATOM 2066 CG ASP B 58 15.440 -11.690 2.074 1.00 0.00 C ATOM 2067 OD1 ASP B 58 15.496 -12.856 2.511 1.00 0.00 O ATOM 2068 OD2 ASP B 58 16.397 -10.897 2.159 1.00 0.00 O ATOM 0 H ASP B 58 15.289 -9.932 -0.394 1.00 0.00 H new ATOM 0 HA ASP B 58 14.319 -12.606 -0.185 1.00 0.00 H new ATOM 0 HB2 ASP B 58 14.084 -10.123 1.556 1.00 0.00 H new ATOM 0 HB3 ASP B 58 13.307 -11.633 1.992 1.00 0.00 H new ATOM 2073 N TYR B 59 12.312 -10.468 -1.370 1.00 0.00 N ATOM 2074 CA TYR B 59 10.947 -10.182 -1.788 1.00 0.00 C ATOM 2075 C TYR B 59 10.772 -10.334 -3.295 1.00 0.00 C ATOM 2076 O TYR B 59 9.766 -9.889 -3.849 1.00 0.00 O ATOM 2077 CB TYR B 59 10.550 -8.771 -1.361 1.00 0.00 C ATOM 2078 CG TYR B 59 10.596 -8.551 0.132 1.00 0.00 C ATOM 2079 CD1 TYR B 59 9.574 -9.009 0.954 1.00 0.00 C ATOM 2080 CD2 TYR B 59 11.660 -7.881 0.723 1.00 0.00 C ATOM 2081 CE1 TYR B 59 9.609 -8.806 2.319 1.00 0.00 C ATOM 2082 CE2 TYR B 59 11.701 -7.674 2.087 1.00 0.00 C ATOM 2083 CZ TYR B 59 10.675 -8.138 2.879 1.00 0.00 C ATOM 2084 OH TYR B 59 10.712 -7.927 4.237 1.00 0.00 O ATOM 0 H TYR B 59 13.026 -9.906 -1.833 1.00 0.00 H new ATOM 0 HA TYR B 59 10.296 -10.908 -1.301 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.214 -8.055 -1.845 1.00 0.00 H new ATOM 0 HB3 TYR B 59 9.542 -8.563 -1.719 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.737 -9.533 0.517 1.00 0.00 H new ATOM 0 HD2 TYR B 59 12.468 -7.516 0.105 1.00 0.00 H new ATOM 0 HE1 TYR B 59 8.806 -9.169 2.943 1.00 0.00 H new ATOM 0 HE2 TYR B 59 12.535 -7.150 2.531 1.00 0.00 H new ATOM 0 HH TYR B 59 11.170 -7.081 4.424 1.00 0.00 H new ATOM 2094 N ASN B 60 11.755 -10.954 -3.955 1.00 0.00 N ATOM 2095 CA ASN B 60 11.671 -11.240 -5.395 1.00 0.00 C ATOM 2096 C ASN B 60 11.643 -9.938 -6.216 1.00 0.00 C ATOM 2097 O ASN B 60 11.219 -9.921 -7.373 1.00 0.00 O ATOM 2098 CB ASN B 60 10.417 -12.089 -5.687 1.00 0.00 C ATOM 2099 CG ASN B 60 10.374 -12.653 -7.098 1.00 0.00 C ATOM 2100 OD1 ASN B 60 11.403 -13.001 -7.681 1.00 0.00 O ATOM 2101 ND2 ASN B 60 9.177 -12.743 -7.659 1.00 0.00 N ATOM 0 H ASN B 60 12.620 -11.269 -3.516 1.00 0.00 H new ATOM 0 HA ASN B 60 12.558 -11.801 -5.689 1.00 0.00 H new ATOM 0 HB2 ASN B 60 10.373 -12.913 -4.975 1.00 0.00 H new ATOM 0 HB3 ASN B 60 9.529 -11.478 -5.523 1.00 0.00 H new ATOM 0 HD21 ASN B 60 9.084 -13.111 -8.606 1.00 0.00 H new ATOM 0 HD22 ASN B 60 8.349 -12.445 -7.144 1.00 0.00 H new ATOM 2108 N ILE B 61 12.123 -8.855 -5.616 1.00 0.00 N ATOM 2109 CA ILE B 61 12.092 -7.544 -6.255 1.00 0.00 C ATOM 2110 C ILE B 61 13.150 -7.443 -7.349 1.00 0.00 C ATOM 2111 O ILE B 61 14.302 -7.835 -7.153 1.00 0.00 O ATOM 2112 CB ILE B 61 12.298 -6.413 -5.223 1.00 0.00 C ATOM 2113 CG1 ILE B 61 11.228 -6.507 -4.132 1.00 0.00 C ATOM 2114 CG2 ILE B 61 12.254 -5.046 -5.896 1.00 0.00 C ATOM 2115 CD1 ILE B 61 11.382 -5.480 -3.032 1.00 0.00 C ATOM 0 H ILE B 61 12.540 -8.859 -4.685 1.00 0.00 H new ATOM 0 HA ILE B 61 11.107 -7.427 -6.707 1.00 0.00 H new ATOM 0 HB ILE B 61 13.282 -6.531 -4.769 1.00 0.00 H new ATOM 0 HG12 ILE B 61 10.246 -6.390 -4.589 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.258 -7.504 -3.692 1.00 0.00 H new ATOM 0 HG21 ILE B 61 12.402 -4.267 -5.148 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.043 -4.984 -6.645 1.00 0.00 H new ATOM 0 HG23 ILE B 61 11.286 -4.908 -6.377 1.00 0.00 H new ATOM 0 HD11 ILE B 61 10.587 -5.611 -2.298 1.00 0.00 H new ATOM 0 HD12 ILE B 61 12.349 -5.609 -2.547 1.00 0.00 H new ATOM 0 HD13 ILE B 61 11.321 -4.479 -3.458 1.00 0.00 H new ATOM 2127 N GLN B 62 12.745 -6.924 -8.501 1.00 0.00 N ATOM 2128 CA GLN B 62 13.638 -6.787 -9.643 1.00 0.00 C ATOM 2129 C GLN B 62 13.995 -5.325 -9.899 1.00 0.00 C ATOM 2130 O GLN B 62 13.557 -4.431 -9.174 1.00 0.00 O ATOM 2131 CB GLN B 62 13.003 -7.405 -10.891 1.00 0.00 C ATOM 2132 CG GLN B 62 11.569 -6.952 -11.144 1.00 0.00 C ATOM 2133 CD GLN B 62 10.984 -7.537 -12.416 1.00 0.00 C ATOM 2134 OE1 GLN B 62 9.785 -7.807 -12.495 1.00 0.00 O ATOM 2135 NE2 GLN B 62 11.817 -7.712 -13.427 1.00 0.00 N ATOM 0 H GLN B 62 11.796 -6.589 -8.669 1.00 0.00 H new ATOM 0 HA GLN B 62 14.560 -7.321 -9.412 1.00 0.00 H new ATOM 0 HB2 GLN B 62 13.612 -7.153 -11.759 1.00 0.00 H new ATOM 0 HB3 GLN B 62 13.019 -8.491 -10.795 1.00 0.00 H new ATOM 0 HG2 GLN B 62 10.947 -7.241 -10.297 1.00 0.00 H new ATOM 0 HG3 GLN B 62 11.542 -5.864 -11.204 1.00 0.00 H new ATOM 0 HE21 GLN B 62 12.804 -7.476 -13.322 1.00 0.00 H new ATOM 0 HE22 GLN B 62 11.473 -8.083 -14.313 1.00 0.00 H new ATOM 2144 N LYS B 63 14.773 -5.095 -10.948 1.00 0.00 N ATOM 2145 CA LYS B 63 15.277 -3.763 -11.262 1.00 0.00 C ATOM 2146 C LYS B 63 14.185 -2.862 -11.821 1.00 0.00 C ATOM 2147 O LYS B 63 13.271 -3.332 -12.506 1.00 0.00 O ATOM 2148 CB LYS B 63 16.411 -3.847 -12.285 1.00 0.00 C ATOM 2149 CG LYS B 63 17.656 -4.562 -11.793 1.00 0.00 C ATOM 2150 CD LYS B 63 18.758 -4.495 -12.835 1.00 0.00 C ATOM 2151 CE LYS B 63 20.077 -5.024 -12.301 1.00 0.00 C ATOM 2152 NZ LYS B 63 21.160 -4.905 -13.311 1.00 0.00 N ATOM 0 H LYS B 63 15.071 -5.819 -11.601 1.00 0.00 H new ATOM 0 HA LYS B 63 15.643 -3.335 -10.329 1.00 0.00 H new ATOM 0 HB2 LYS B 63 16.043 -4.358 -13.175 1.00 0.00 H new ATOM 0 HB3 LYS B 63 16.685 -2.836 -12.588 1.00 0.00 H new ATOM 0 HG2 LYS B 63 17.999 -4.108 -10.863 1.00 0.00 H new ATOM 0 HG3 LYS B 63 17.420 -5.603 -11.571 1.00 0.00 H new ATOM 0 HD2 LYS B 63 18.464 -5.072 -13.712 1.00 0.00 H new ATOM 0 HD3 LYS B 63 18.886 -3.463 -13.161 1.00 0.00 H new ATOM 0 HE2 LYS B 63 20.354 -4.473 -11.402 1.00 0.00 H new ATOM 0 HE3 LYS B 63 19.961 -6.068 -12.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 22.047 -5.275 -12.914 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 20.906 -5.451 -14.159 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 21.287 -3.905 -13.568 1.00 0.00 H new ATOM 2166 N GLU B 64 14.294 -1.566 -11.513 1.00 0.00 N ATOM 2167 CA GLU B 64 13.453 -0.526 -12.107 1.00 0.00 C ATOM 2168 C GLU B 64 11.986 -0.728 -11.739 1.00 0.00 C ATOM 2169 O GLU B 64 11.085 -0.330 -12.474 1.00 0.00 O ATOM 2170 CB GLU B 64 13.634 -0.486 -13.631 1.00 0.00 C ATOM 2171 CG GLU B 64 15.093 -0.539 -14.086 1.00 0.00 C ATOM 2172 CD GLU B 64 15.989 0.456 -13.365 1.00 0.00 C ATOM 2173 OE1 GLU B 64 16.133 1.598 -13.849 1.00 0.00 O ATOM 2174 OE2 GLU B 64 16.578 0.087 -12.323 1.00 0.00 O ATOM 0 H GLU B 64 14.973 -1.208 -10.841 1.00 0.00 H new ATOM 0 HA GLU B 64 13.769 0.435 -11.701 1.00 0.00 H new ATOM 0 HB2 GLU B 64 13.096 -1.325 -14.073 1.00 0.00 H new ATOM 0 HB3 GLU B 64 13.177 0.425 -14.017 1.00 0.00 H new ATOM 0 HG2 GLU B 64 15.479 -1.546 -13.926 1.00 0.00 H new ATOM 0 HG3 GLU B 64 15.138 -0.347 -15.158 1.00 0.00 H new ATOM 2181 N SER B 65 11.760 -1.326 -10.579 1.00 0.00 N ATOM 2182 CA SER B 65 10.406 -1.597 -10.104 1.00 0.00 C ATOM 2183 C SER B 65 9.748 -0.343 -9.519 1.00 0.00 C ATOM 2184 O SER B 65 10.428 0.554 -9.022 1.00 0.00 O ATOM 2185 CB SER B 65 10.440 -2.702 -9.049 1.00 0.00 C ATOM 2186 OG SER B 65 10.948 -3.909 -9.591 1.00 0.00 O ATOM 0 H SER B 65 12.497 -1.635 -9.945 1.00 0.00 H new ATOM 0 HA SER B 65 9.811 -1.918 -10.959 1.00 0.00 H new ATOM 0 HB2 SER B 65 11.059 -2.388 -8.209 1.00 0.00 H new ATOM 0 HB3 SER B 65 9.436 -2.869 -8.660 1.00 0.00 H new ATOM 0 HG SER B 65 11.893 -4.003 -9.350 1.00 0.00 H new ATOM 2192 N THR B 66 8.421 -0.285 -9.589 1.00 0.00 N ATOM 2193 CA THR B 66 7.662 0.800 -8.980 1.00 0.00 C ATOM 2194 C THR B 66 6.991 0.317 -7.692 1.00 0.00 C ATOM 2195 O THR B 66 6.254 -0.669 -7.696 1.00 0.00 O ATOM 2196 CB THR B 66 6.591 1.354 -9.945 1.00 0.00 C ATOM 2197 OG1 THR B 66 7.208 1.828 -11.152 1.00 0.00 O ATOM 2198 CG2 THR B 66 5.808 2.492 -9.303 1.00 0.00 C ATOM 0 H THR B 66 7.848 -0.982 -10.065 1.00 0.00 H new ATOM 0 HA THR B 66 8.362 1.603 -8.750 1.00 0.00 H new ATOM 0 HB THR B 66 5.902 0.542 -10.178 1.00 0.00 H new ATOM 0 HG1 THR B 66 8.038 2.299 -10.932 1.00 0.00 H new ATOM 0 HG21 THR B 66 5.061 2.862 -10.006 1.00 0.00 H new ATOM 0 HG22 THR B 66 5.311 2.129 -8.403 1.00 0.00 H new ATOM 0 HG23 THR B 66 6.490 3.300 -9.040 1.00 0.00 H new ATOM 2206 N LEU B 67 7.263 1.008 -6.592 1.00 0.00 N ATOM 2207 CA LEU B 67 6.742 0.622 -5.286 1.00 0.00 C ATOM 2208 C LEU B 67 5.893 1.742 -4.693 1.00 0.00 C ATOM 2209 O LEU B 67 5.861 2.855 -5.214 1.00 0.00 O ATOM 2210 CB LEU B 67 7.886 0.292 -4.313 1.00 0.00 C ATOM 2211 CG LEU B 67 8.687 -0.985 -4.609 1.00 0.00 C ATOM 2212 CD1 LEU B 67 9.585 -0.817 -5.823 1.00 0.00 C ATOM 2213 CD2 LEU B 67 9.515 -1.378 -3.400 1.00 0.00 C ATOM 0 H LEU B 67 7.846 1.845 -6.579 1.00 0.00 H new ATOM 0 HA LEU B 67 6.126 -0.266 -5.428 1.00 0.00 H new ATOM 0 HB2 LEU B 67 8.578 1.134 -4.301 1.00 0.00 H new ATOM 0 HB3 LEU B 67 7.468 0.208 -3.310 1.00 0.00 H new ATOM 0 HG LEU B 67 7.972 -1.778 -4.830 1.00 0.00 H new ATOM 0 HD11 LEU B 67 10.135 -1.741 -6.000 1.00 0.00 H new ATOM 0 HD12 LEU B 67 8.976 -0.584 -6.697 1.00 0.00 H new ATOM 0 HD13 LEU B 67 10.289 -0.004 -5.645 1.00 0.00 H new ATOM 0 HD21 LEU B 67 10.078 -2.284 -3.623 1.00 0.00 H new ATOM 0 HD22 LEU B 67 10.207 -0.572 -3.156 1.00 0.00 H new ATOM 0 HD23 LEU B 67 8.856 -1.560 -2.551 1.00 0.00 H new ATOM 2225 N HIS B 68 5.197 1.437 -3.608 1.00 0.00 N ATOM 2226 CA HIS B 68 4.453 2.446 -2.862 1.00 0.00 C ATOM 2227 C HIS B 68 4.935 2.487 -1.418 1.00 0.00 C ATOM 2228 O HIS B 68 5.194 1.444 -0.816 1.00 0.00 O ATOM 2229 CB HIS B 68 2.942 2.172 -2.900 1.00 0.00 C ATOM 2230 CG HIS B 68 2.279 2.558 -4.187 1.00 0.00 C ATOM 2231 ND1 HIS B 68 1.533 3.710 -4.333 1.00 0.00 N ATOM 2232 CD2 HIS B 68 2.232 1.929 -5.384 1.00 0.00 C ATOM 2233 CE1 HIS B 68 1.059 3.771 -5.563 1.00 0.00 C ATOM 2234 NE2 HIS B 68 1.467 2.703 -6.223 1.00 0.00 N ATOM 0 H HIS B 68 5.131 0.495 -3.222 1.00 0.00 H new ATOM 0 HA HIS B 68 4.633 3.412 -3.334 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.772 1.110 -2.721 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.466 2.713 -2.082 1.00 0.00 H new ATOM 0 HD1 HIS B 68 1.373 4.405 -3.604 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.708 0.992 -5.634 1.00 0.00 H new ATOM 0 HE1 HIS B 68 0.441 4.562 -5.963 1.00 0.00 H new ATOM 2243 N LEU B 69 5.071 3.688 -0.876 1.00 0.00 N ATOM 2244 CA LEU B 69 5.497 3.860 0.503 1.00 0.00 C ATOM 2245 C LEU B 69 4.322 4.288 1.371 1.00 0.00 C ATOM 2246 O LEU B 69 3.911 5.450 1.351 1.00 0.00 O ATOM 2247 CB LEU B 69 6.622 4.896 0.595 1.00 0.00 C ATOM 2248 CG LEU B 69 7.088 5.237 2.016 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.607 3.999 2.728 1.00 0.00 C ATOM 2250 CD2 LEU B 69 8.157 6.319 1.985 1.00 0.00 C ATOM 0 H LEU B 69 4.892 4.560 -1.373 1.00 0.00 H new ATOM 0 HA LEU B 69 5.874 2.904 0.866 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.478 4.529 0.028 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.288 5.814 0.110 1.00 0.00 H new ATOM 0 HG LEU B 69 6.229 5.615 2.571 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.931 4.267 3.734 1.00 0.00 H new ATOM 0 HD12 LEU B 69 6.813 3.255 2.789 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.449 3.586 2.173 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.474 6.546 3.003 1.00 0.00 H new ATOM 0 HD22 LEU B 69 9.013 5.969 1.408 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.751 7.218 1.522 1.00 0.00 H new ATOM 2262 N VAL B 70 3.779 3.342 2.116 1.00 0.00 N ATOM 2263 CA VAL B 70 2.661 3.620 3.000 1.00 0.00 C ATOM 2264 C VAL B 70 3.160 3.720 4.434 1.00 0.00 C ATOM 2265 O VAL B 70 3.894 2.854 4.913 1.00 0.00 O ATOM 2266 CB VAL B 70 1.568 2.534 2.897 1.00 0.00 C ATOM 2267 CG1 VAL B 70 0.345 2.923 3.710 1.00 0.00 C ATOM 2268 CG2 VAL B 70 1.184 2.302 1.442 1.00 0.00 C ATOM 0 H VAL B 70 4.095 2.372 2.126 1.00 0.00 H new ATOM 0 HA VAL B 70 2.215 4.567 2.695 1.00 0.00 H new ATOM 0 HB VAL B 70 1.970 1.606 3.304 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.412 2.144 3.623 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.626 3.041 4.756 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.057 3.864 3.334 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.413 1.534 1.387 1.00 0.00 H new ATOM 0 HG22 VAL B 70 0.803 3.229 1.014 1.00 0.00 H new ATOM 0 HG23 VAL B 70 2.061 1.977 0.882 1.00 0.00 H new ATOM 2278 N LEU B 71 2.781 4.787 5.110 1.00 0.00 N ATOM 2279 CA LEU B 71 3.248 5.028 6.460 1.00 0.00 C ATOM 2280 C LEU B 71 2.404 4.259 7.463 1.00 0.00 C ATOM 2281 O LEU B 71 1.177 4.321 7.441 1.00 0.00 O ATOM 2282 CB LEU B 71 3.237 6.526 6.785 1.00 0.00 C ATOM 2283 CG LEU B 71 4.247 7.385 6.008 1.00 0.00 C ATOM 2284 CD1 LEU B 71 5.618 6.725 5.996 1.00 0.00 C ATOM 2285 CD2 LEU B 71 3.767 7.654 4.590 1.00 0.00 C ATOM 0 H LEU B 71 2.150 5.501 4.746 1.00 0.00 H new ATOM 0 HA LEU B 71 4.276 4.674 6.530 1.00 0.00 H new ATOM 0 HB2 LEU B 71 2.236 6.913 6.594 1.00 0.00 H new ATOM 0 HB3 LEU B 71 3.428 6.649 7.851 1.00 0.00 H new ATOM 0 HG LEU B 71 4.331 8.344 6.519 1.00 0.00 H new ATOM 0 HD11 LEU B 71 6.318 7.350 5.441 1.00 0.00 H new ATOM 0 HD12 LEU B 71 5.973 6.604 7.020 1.00 0.00 H new ATOM 0 HD13 LEU B 71 5.547 5.747 5.519 1.00 0.00 H new ATOM 0 HD21 LEU B 71 4.503 8.264 4.066 1.00 0.00 H new ATOM 0 HD22 LEU B 71 3.639 6.708 4.064 1.00 0.00 H new ATOM 0 HD23 LEU B 71 2.815 8.183 4.622 1.00 0.00 H new ATOM 2297 N ARG B 72 3.081 3.506 8.314 1.00 0.00 N ATOM 2298 CA ARG B 72 2.431 2.704 9.336 1.00 0.00 C ATOM 2299 C ARG B 72 1.834 3.599 10.417 1.00 0.00 C ATOM 2300 O ARG B 72 2.495 4.509 10.914 1.00 0.00 O ATOM 2301 CB ARG B 72 3.444 1.732 9.952 1.00 0.00 C ATOM 2302 CG ARG B 72 2.842 0.764 10.959 1.00 0.00 C ATOM 2303 CD ARG B 72 3.889 -0.188 11.522 1.00 0.00 C ATOM 2304 NE ARG B 72 4.885 0.494 12.353 1.00 0.00 N ATOM 2305 CZ ARG B 72 5.624 -0.123 13.277 1.00 0.00 C ATOM 2306 NH1 ARG B 72 5.453 -1.424 13.505 1.00 0.00 N ATOM 2307 NH2 ARG B 72 6.524 0.560 13.981 1.00 0.00 N ATOM 0 H ARG B 72 4.098 3.434 8.315 1.00 0.00 H new ATOM 0 HA ARG B 72 1.623 2.135 8.877 1.00 0.00 H new ATOM 0 HB2 ARG B 72 3.916 1.161 9.153 1.00 0.00 H new ATOM 0 HB3 ARG B 72 4.231 2.306 10.441 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.385 1.325 11.774 1.00 0.00 H new ATOM 0 HG3 ARG B 72 2.048 0.190 10.482 1.00 0.00 H new ATOM 0 HD2 ARG B 72 3.394 -0.958 12.114 1.00 0.00 H new ATOM 0 HD3 ARG B 72 4.394 -0.694 10.699 1.00 0.00 H new ATOM 0 HE ARG B 72 5.021 1.496 12.218 1.00 0.00 H new ATOM 0 HH11 ARG B 72 4.758 -1.948 12.974 1.00 0.00 H new ATOM 0 HH12 ARG B 72 6.017 -1.897 14.211 1.00 0.00 H new ATOM 0 HH21 ARG B 72 6.651 1.558 13.815 1.00 0.00 H new ATOM 0 HH22 ARG B 72 7.087 0.085 14.686 1.00 0.00 H new ATOM 2321 N LEU B 73 0.590 3.326 10.786 1.00 0.00 N ATOM 2322 CA LEU B 73 -0.091 4.093 11.826 1.00 0.00 C ATOM 2323 C LEU B 73 0.286 3.580 13.212 1.00 0.00 C ATOM 2324 O LEU B 73 -0.496 3.673 14.158 1.00 0.00 O ATOM 2325 CB LEU B 73 -1.616 4.031 11.641 1.00 0.00 C ATOM 2326 CG LEU B 73 -2.205 4.991 10.595 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -1.816 6.426 10.905 1.00 0.00 C ATOM 2328 CD2 LEU B 73 -1.767 4.614 9.188 1.00 0.00 C ATOM 0 H LEU B 73 0.028 2.577 10.381 1.00 0.00 H new ATOM 0 HA LEU B 73 0.230 5.131 11.738 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -1.888 3.012 11.365 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -2.088 4.237 12.602 1.00 0.00 H new ATOM 0 HG LEU B 73 -3.291 4.906 10.642 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -2.243 7.089 10.153 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -2.195 6.701 11.889 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -0.730 6.519 10.896 1.00 0.00 H new ATOM 0 HD21 LEU B 73 -2.201 5.313 8.472 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -0.680 4.655 9.122 1.00 0.00 H new ATOM 0 HD23 LEU B 73 -2.106 3.604 8.960 1.00 0.00 H new ATOM 2340 N ARG B 74 1.498 3.058 13.329 1.00 0.00 N ATOM 2341 CA ARG B 74 1.997 2.533 14.587 1.00 0.00 C ATOM 2342 C ARG B 74 3.437 2.961 14.802 1.00 0.00 C ATOM 2343 O ARG B 74 4.224 3.009 13.856 1.00 0.00 O ATOM 2344 CB ARG B 74 1.920 1.007 14.619 1.00 0.00 C ATOM 2345 CG ARG B 74 0.516 0.455 14.777 1.00 0.00 C ATOM 2346 CD ARG B 74 0.550 -1.045 15.019 1.00 0.00 C ATOM 2347 NE ARG B 74 1.399 -1.387 16.160 1.00 0.00 N ATOM 2348 CZ ARG B 74 1.891 -2.606 16.388 1.00 0.00 C ATOM 2349 NH1 ARG B 74 1.632 -3.602 15.546 1.00 0.00 N ATOM 2350 NH2 ARG B 74 2.660 -2.821 17.449 1.00 0.00 N ATOM 0 H ARG B 74 2.160 2.987 12.556 1.00 0.00 H new ATOM 0 HA ARG B 74 1.370 2.934 15.383 1.00 0.00 H new ATOM 0 HB2 ARG B 74 2.351 0.614 13.698 1.00 0.00 H new ATOM 0 HB3 ARG B 74 2.536 0.641 15.440 1.00 0.00 H new ATOM 0 HG2 ARG B 74 0.017 0.951 15.609 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -0.067 0.670 13.882 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -0.462 -1.409 15.196 1.00 0.00 H new ATOM 0 HD3 ARG B 74 0.919 -1.550 14.126 1.00 0.00 H new ATOM 0 HE ARG B 74 1.629 -0.647 16.823 1.00 0.00 H new ATOM 0 HH11 ARG B 74 1.055 -3.436 14.722 1.00 0.00 H new ATOM 0 HH12 ARG B 74 2.010 -4.532 15.725 1.00 0.00 H new ATOM 0 HH21 ARG B 74 2.873 -2.055 18.088 1.00 0.00 H new ATOM 0 HH22 ARG B 74 3.037 -3.752 17.625 1.00 0.00 H new ATOM 2364 N GLY B 75 3.773 3.263 16.044 1.00 0.00 N ATOM 2365 CA GLY B 75 5.127 3.644 16.377 1.00 0.00 C ATOM 2366 C GLY B 75 5.619 2.937 17.621 1.00 0.00 C ATOM 2367 O GLY B 75 6.575 2.161 17.568 1.00 0.00 O ATOM 0 H GLY B 75 3.127 3.251 16.833 1.00 0.00 H new ATOM 0 HA2 GLY B 75 5.786 3.410 15.541 1.00 0.00 H new ATOM 0 HA3 GLY B 75 5.174 4.722 16.529 1.00 0.00 H new ATOM 2371 N GLY B 76 4.950 3.190 18.735 1.00 0.00 N ATOM 2372 CA GLY B 76 5.307 2.552 19.982 1.00 0.00 C ATOM 2373 C GLY B 76 4.092 2.255 20.828 1.00 0.00 C ATOM 2374 O GLY B 76 3.097 3.004 20.721 1.00 0.00 O ATOM 2375 OXT GLY B 76 4.117 1.279 21.600 1.00 0.00 O ATOM 0 H GLY B 76 4.160 3.832 18.796 1.00 0.00 H new ATOM 0 HA2 GLY B 76 5.842 1.625 19.776 1.00 0.00 H new ATOM 0 HA3 GLY B 76 5.988 3.196 20.538 1.00 0.00 H new TER 2379 GLY B 76