USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1290 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 50 ASN : amide:sc= -0.067 K(o=-3.4,f=-5.8!) USER MOD Set 1.2: B 51 LYS NZ :NH3+ 136:sc= -3.33 (180deg=-7.84!) USER MOD Set 2.1: A 50 ASN :FLIP amide:sc= -2.76 F(o=-4.1!,f=-3) USER MOD Set 2.2: A 51 LYS NZ :NH3+ -165:sc= -0.121 (180deg=-0.573) USER MOD Set 2.3: A 53 LYS NZ :NH3+ -175:sc= -0.132 (180deg=0) USER MOD Set 3.1: A 45 MET CE :methyl 146:sc= -3.76! (180deg=-6!) USER MOD Set 3.2: A 49 GLN :FLIP amide:sc= -0.737 F(o=-5.6,f=-4.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= -0.476 (180deg=-1.88!) USER MOD Single : A 4 SER OG : rot 51:sc= 1.19 USER MOD Single : A 5 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0281) USER MOD Single : A 6 LYS NZ :NH3+ 152:sc= -0.398 (180deg=-1.47!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -162:sc= 0.281 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 HIS : no HD1:sc= -0.232 X(o=-0.23,f=-0.1) USER MOD Single : A 23 THR OG1 : rot -65:sc= -0.933 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 62:sc= 1.16 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc=-0.000339 X(o=-0.00034,f=-0.45) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 82:sc= 0.0987 USER MOD Single : A 56 ASN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 SER OG : rot -3:sc= 1.14 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -149:sc= -2.78 (180deg=-6.33!) USER MOD Single : B 1 MET N :NH3+ -168:sc= -0.0218 (180deg=-0.215) USER MOD Single : B 4 SER OG : rot -78:sc= 1.1 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ -175:sc= 0.0651 (180deg=0.061) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00595) USER MOD Single : B 11 LYS NZ :NH3+ -111:sc= -0.73 (180deg=-3.34!) USER MOD Single : B 12 THR OG1 : rot -113:sc= 0.232 USER MOD Single : B 13 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HD1:sc= -0.208 K(o=-0.21,f=-0.92) USER MOD Single : B 23 THR OG1 : rot -170:sc= -0.269 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 69:sc= 1.24 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.0542 X(o=-0.054,f=0) USER MOD Single : B 35 MET CE :methyl 175:sc= 0 (180deg=-0.0164) USER MOD Single : B 36 THR OG1 : rot 72:sc= 0.163 USER MOD Single : B 45 MET CE :methyl 133:sc= -2.33! (180deg=-5.56!) USER MOD Single : B 49 GLN :FLIP amide:sc= -0.541 F(o=-1.3,f=-0.54) USER MOD Single : B 53 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0311) USER MOD Single : B 56 ASN : amide:sc=-0.00127 X(o=-0.0013,f=0) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 SER OG : rot 118:sc= 0.72 USER MOD Single : B 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.290 15.408 -23.566 1.00 0.00 N ATOM 2 CA MET A 1 5.982 16.725 -23.567 1.00 0.00 C ATOM 3 C MET A 1 6.219 17.226 -22.145 1.00 0.00 C ATOM 4 O MET A 1 7.355 17.495 -21.753 1.00 0.00 O ATOM 5 CB MET A 1 5.134 17.736 -24.351 1.00 0.00 C ATOM 6 CG MET A 1 3.635 17.609 -24.114 1.00 0.00 C ATOM 7 SD MET A 1 2.706 17.348 -25.638 1.00 0.00 S ATOM 8 CE MET A 1 1.249 18.340 -25.323 1.00 0.00 C ATOM 0 H1 MET A 1 4.774 15.286 -24.461 1.00 0.00 H new ATOM 0 H2 MET A 1 5.992 14.647 -23.464 1.00 0.00 H new ATOM 0 H3 MET A 1 4.619 15.369 -22.772 1.00 0.00 H new ATOM 0 HA MET A 1 6.956 16.610 -24.043 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.449 18.744 -24.082 1.00 0.00 H new ATOM 0 HB3 MET A 1 5.334 17.613 -25.415 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.448 16.778 -23.433 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.272 18.512 -23.622 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.576 18.280 -26.178 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.740 17.967 -24.434 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.543 19.378 -25.165 1.00 0.00 H new ATOM 20 N VAL A 2 5.142 17.349 -21.375 1.00 0.00 N ATOM 21 CA VAL A 2 5.236 17.815 -19.997 1.00 0.00 C ATOM 22 C VAL A 2 3.964 17.487 -19.218 1.00 0.00 C ATOM 23 O VAL A 2 3.593 18.199 -18.285 1.00 0.00 O ATOM 24 CB VAL A 2 5.495 19.335 -19.936 1.00 0.00 C ATOM 25 CG1 VAL A 2 4.313 20.107 -20.505 1.00 0.00 C ATOM 26 CG2 VAL A 2 5.795 19.773 -18.509 1.00 0.00 C ATOM 0 H VAL A 2 4.194 17.132 -21.683 1.00 0.00 H new ATOM 0 HA VAL A 2 6.078 17.295 -19.540 1.00 0.00 H new ATOM 0 HB VAL A 2 6.369 19.557 -20.549 1.00 0.00 H new ATOM 0 HG11 VAL A 2 4.517 21.176 -20.452 1.00 0.00 H new ATOM 0 HG12 VAL A 2 4.156 19.819 -21.544 1.00 0.00 H new ATOM 0 HG13 VAL A 2 3.418 19.880 -19.927 1.00 0.00 H new ATOM 0 HG21 VAL A 2 5.975 20.848 -18.488 1.00 0.00 H new ATOM 0 HG22 VAL A 2 4.945 19.535 -17.869 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.680 19.250 -18.146 1.00 0.00 H new ATOM 36 N GLU A 3 3.298 16.405 -19.610 1.00 0.00 N ATOM 37 CA GLU A 3 2.066 15.981 -18.951 1.00 0.00 C ATOM 38 C GLU A 3 1.484 14.746 -19.634 1.00 0.00 C ATOM 39 O GLU A 3 0.300 14.710 -19.970 1.00 0.00 O ATOM 40 CB GLU A 3 1.039 17.116 -18.960 1.00 0.00 C ATOM 41 CG GLU A 3 0.832 17.737 -20.332 1.00 0.00 C ATOM 42 CD GLU A 3 -0.537 18.372 -20.484 1.00 0.00 C ATOM 43 OE1 GLU A 3 -1.447 18.012 -19.708 1.00 0.00 O ATOM 44 OE2 GLU A 3 -0.699 19.228 -21.378 1.00 0.00 O ATOM 0 H GLU A 3 3.591 15.805 -20.381 1.00 0.00 H new ATOM 0 HA GLU A 3 2.304 15.727 -17.918 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.085 16.735 -18.595 1.00 0.00 H new ATOM 0 HB3 GLU A 3 1.360 17.891 -18.264 1.00 0.00 H new ATOM 0 HG2 GLU A 3 1.600 18.491 -20.505 1.00 0.00 H new ATOM 0 HG3 GLU A 3 0.960 16.971 -21.097 1.00 0.00 H new ATOM 51 N SER A 4 2.326 13.737 -19.839 1.00 0.00 N ATOM 52 CA SER A 4 1.895 12.501 -20.484 1.00 0.00 C ATOM 53 C SER A 4 3.049 11.510 -20.587 1.00 0.00 C ATOM 54 O SER A 4 2.889 10.323 -20.305 1.00 0.00 O ATOM 55 CB SER A 4 1.334 12.795 -21.877 1.00 0.00 C ATOM 56 OG SER A 4 -0.079 12.898 -21.849 1.00 0.00 O ATOM 0 H SER A 4 3.309 13.751 -19.568 1.00 0.00 H new ATOM 0 HA SER A 4 1.111 12.056 -19.871 1.00 0.00 H new ATOM 0 HB2 SER A 4 1.762 13.723 -22.256 1.00 0.00 H new ATOM 0 HB3 SER A 4 1.630 12.004 -22.566 1.00 0.00 H new ATOM 0 HG SER A 4 -0.347 13.527 -21.147 1.00 0.00 H new ATOM 62 N LYS A 5 4.213 12.006 -20.993 1.00 0.00 N ATOM 63 CA LYS A 5 5.396 11.165 -21.135 1.00 0.00 C ATOM 64 C LYS A 5 6.462 11.549 -20.114 1.00 0.00 C ATOM 65 O LYS A 5 7.024 10.689 -19.436 1.00 0.00 O ATOM 66 CB LYS A 5 5.963 11.283 -22.551 1.00 0.00 C ATOM 67 CG LYS A 5 7.121 10.338 -22.822 1.00 0.00 C ATOM 68 CD LYS A 5 6.631 8.970 -23.276 1.00 0.00 C ATOM 69 CE LYS A 5 6.872 8.756 -24.762 1.00 0.00 C ATOM 70 NZ LYS A 5 6.160 9.765 -25.592 1.00 0.00 N ATOM 0 H LYS A 5 4.363 12.987 -21.230 1.00 0.00 H new ATOM 0 HA LYS A 5 5.101 10.131 -20.954 1.00 0.00 H new ATOM 0 HB2 LYS A 5 5.168 11.085 -23.270 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.295 12.308 -22.717 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.769 10.766 -23.587 1.00 0.00 H new ATOM 0 HG3 LYS A 5 7.722 10.229 -21.919 1.00 0.00 H new ATOM 0 HD2 LYS A 5 7.142 8.193 -22.708 1.00 0.00 H new ATOM 0 HD3 LYS A 5 5.567 8.874 -23.062 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.941 8.807 -24.967 1.00 0.00 H new ATOM 0 HE3 LYS A 5 6.541 7.756 -25.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 6.238 9.506 -26.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 5.157 9.794 -25.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 6.587 10.701 -25.442 1.00 0.00 H new ATOM 84 N LYS A 6 6.734 12.845 -20.010 1.00 0.00 N ATOM 85 CA LYS A 6 7.734 13.342 -19.073 1.00 0.00 C ATOM 86 C LYS A 6 7.197 13.321 -17.645 1.00 0.00 C ATOM 87 O LYS A 6 7.708 12.598 -16.790 1.00 0.00 O ATOM 88 CB LYS A 6 8.157 14.764 -19.455 1.00 0.00 C ATOM 89 CG LYS A 6 9.648 14.903 -19.719 1.00 0.00 C ATOM 90 CD LYS A 6 9.939 16.040 -20.685 1.00 0.00 C ATOM 91 CE LYS A 6 10.105 17.363 -19.954 1.00 0.00 C ATOM 92 NZ LYS A 6 11.082 17.260 -18.835 1.00 0.00 N ATOM 0 H LYS A 6 6.276 13.570 -20.563 1.00 0.00 H new ATOM 0 HA LYS A 6 8.604 12.687 -19.123 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.608 15.071 -20.345 1.00 0.00 H new ATOM 0 HB3 LYS A 6 7.873 15.447 -18.654 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.170 15.080 -18.779 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.035 13.969 -20.127 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.846 15.818 -21.248 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.127 16.122 -21.408 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.437 18.127 -20.657 1.00 0.00 H new ATOM 0 HE3 LYS A 6 9.140 17.686 -19.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 11.524 18.187 -18.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.589 16.956 -17.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.816 16.564 -19.078 1.00 0.00 H new ATOM 106 N ILE A 7 6.165 14.120 -17.393 1.00 0.00 N ATOM 107 CA ILE A 7 5.561 14.194 -16.069 1.00 0.00 C ATOM 108 C ILE A 7 4.090 13.796 -16.111 1.00 0.00 C ATOM 109 O ILE A 7 3.208 14.650 -16.196 1.00 0.00 O ATOM 110 CB ILE A 7 5.681 15.610 -15.476 1.00 0.00 C ATOM 111 CG1 ILE A 7 7.113 16.129 -15.621 1.00 0.00 C ATOM 112 CG2 ILE A 7 5.255 15.611 -14.015 1.00 0.00 C ATOM 113 CD1 ILE A 7 7.245 17.616 -15.378 1.00 0.00 C ATOM 0 H ILE A 7 5.730 14.725 -18.089 1.00 0.00 H new ATOM 0 HA ILE A 7 6.105 13.494 -15.435 1.00 0.00 H new ATOM 0 HB ILE A 7 5.017 16.276 -16.027 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.756 15.596 -14.921 1.00 0.00 H new ATOM 0 HG13 ILE A 7 7.474 15.900 -16.624 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.346 16.619 -13.610 1.00 0.00 H new ATOM 0 HG22 ILE A 7 4.219 15.281 -13.938 1.00 0.00 H new ATOM 0 HG23 ILE A 7 5.895 14.934 -13.449 1.00 0.00 H new ATOM 0 HD11 ILE A 7 8.287 17.913 -15.498 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.628 18.158 -16.095 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.915 17.850 -14.366 1.00 0.00 H new ATOM 125 N ALA A 8 3.832 12.492 -16.049 1.00 0.00 N ATOM 126 CA ALA A 8 2.467 11.984 -16.080 1.00 0.00 C ATOM 127 C ALA A 8 2.367 10.619 -15.406 1.00 0.00 C ATOM 128 O ALA A 8 3.317 9.836 -15.415 1.00 0.00 O ATOM 129 CB ALA A 8 1.968 11.907 -17.517 1.00 0.00 C ATOM 0 H ALA A 8 4.550 11.771 -15.977 1.00 0.00 H new ATOM 0 HA ALA A 8 1.836 12.676 -15.523 1.00 0.00 H new ATOM 0 HB1 ALA A 8 0.947 11.526 -17.528 1.00 0.00 H new ATOM 0 HB2 ALA A 8 1.989 12.901 -17.963 1.00 0.00 H new ATOM 0 HB3 ALA A 8 2.611 11.239 -18.090 1.00 0.00 H new ATOM 135 N LYS A 9 1.206 10.339 -14.829 1.00 0.00 N ATOM 136 CA LYS A 9 0.972 9.070 -14.149 1.00 0.00 C ATOM 137 C LYS A 9 0.807 7.949 -15.162 1.00 0.00 C ATOM 138 O LYS A 9 0.155 8.122 -16.192 1.00 0.00 O ATOM 139 CB LYS A 9 -0.273 9.167 -13.280 1.00 0.00 C ATOM 140 CG LYS A 9 -1.493 9.536 -14.077 1.00 0.00 C ATOM 141 CD LYS A 9 -2.486 10.345 -13.258 1.00 0.00 C ATOM 142 CE LYS A 9 -2.502 11.806 -13.682 1.00 0.00 C ATOM 143 NZ LYS A 9 -1.744 12.668 -12.733 1.00 0.00 N ATOM 0 H LYS A 9 0.409 10.975 -14.818 1.00 0.00 H new ATOM 0 HA LYS A 9 1.833 8.850 -13.518 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.442 8.212 -12.781 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -0.112 9.910 -12.499 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.193 10.110 -14.954 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.977 8.629 -14.440 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -3.484 9.921 -13.373 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.229 10.275 -12.201 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -2.073 11.899 -14.679 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -3.533 12.154 -13.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -1.779 13.656 -13.057 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -2.169 12.599 -11.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -0.754 12.352 -12.692 1.00 0.00 H new ATOM 157 N LYS A 10 1.405 6.799 -14.872 1.00 0.00 N ATOM 158 CA LYS A 10 1.323 5.659 -15.773 1.00 0.00 C ATOM 159 C LYS A 10 0.695 4.466 -15.063 1.00 0.00 C ATOM 160 O LYS A 10 1.031 4.169 -13.922 1.00 0.00 O ATOM 161 CB LYS A 10 2.720 5.301 -16.286 1.00 0.00 C ATOM 162 CG LYS A 10 3.400 6.423 -17.053 1.00 0.00 C ATOM 163 CD LYS A 10 4.833 6.630 -16.579 1.00 0.00 C ATOM 164 CE LYS A 10 5.735 7.088 -17.713 1.00 0.00 C ATOM 165 NZ LYS A 10 7.155 6.705 -17.480 1.00 0.00 N ATOM 0 H LYS A 10 1.948 6.633 -14.025 1.00 0.00 H new ATOM 0 HA LYS A 10 0.693 5.923 -16.622 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.347 5.021 -15.439 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.646 4.426 -16.931 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.397 6.192 -18.118 1.00 0.00 H new ATOM 0 HG3 LYS A 10 2.836 7.347 -16.926 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.849 7.370 -15.779 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.217 5.699 -16.161 1.00 0.00 H new ATOM 0 HE2 LYS A 10 5.390 6.652 -18.650 1.00 0.00 H new ATOM 0 HE3 LYS A 10 5.663 8.170 -17.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 7.739 7.035 -18.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.492 7.142 -16.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.227 5.670 -17.403 1.00 0.00 H new ATOM 179 N LYS A 11 -0.222 3.781 -15.731 1.00 0.00 N ATOM 180 CA LYS A 11 -0.872 2.629 -15.120 1.00 0.00 C ATOM 181 C LYS A 11 0.152 1.547 -14.820 1.00 0.00 C ATOM 182 O LYS A 11 0.666 0.891 -15.726 1.00 0.00 O ATOM 183 CB LYS A 11 -1.969 2.077 -16.030 1.00 0.00 C ATOM 184 CG LYS A 11 -3.045 3.095 -16.373 1.00 0.00 C ATOM 185 CD LYS A 11 -2.753 3.793 -17.693 1.00 0.00 C ATOM 186 CE LYS A 11 -2.789 5.305 -17.544 1.00 0.00 C ATOM 187 NZ LYS A 11 -1.819 5.976 -18.454 1.00 0.00 N ATOM 0 H LYS A 11 -0.529 3.997 -16.679 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.332 2.952 -14.186 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.516 1.715 -16.953 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.434 1.219 -15.545 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.013 2.597 -16.430 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.114 3.836 -15.576 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.773 3.486 -18.059 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.484 3.482 -18.439 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.795 5.667 -17.755 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -2.564 5.574 -16.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.874 7.006 -18.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.856 5.650 -18.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.049 5.741 -19.441 1.00 0.00 H new ATOM 201 N THR A 12 0.454 1.375 -13.539 1.00 0.00 N ATOM 202 CA THR A 12 1.427 0.384 -13.115 1.00 0.00 C ATOM 203 C THR A 12 0.746 -0.808 -12.449 1.00 0.00 C ATOM 204 O THR A 12 -0.289 -0.654 -11.806 1.00 0.00 O ATOM 205 CB THR A 12 2.442 1.009 -12.158 1.00 0.00 C ATOM 206 OG1 THR A 12 2.799 2.311 -12.586 1.00 0.00 O ATOM 207 CG2 THR A 12 3.717 0.202 -12.030 1.00 0.00 C ATOM 0 H THR A 12 0.037 1.911 -12.778 1.00 0.00 H new ATOM 0 HA THR A 12 1.948 0.027 -14.003 1.00 0.00 H new ATOM 0 HB THR A 12 1.947 1.035 -11.187 1.00 0.00 H new ATOM 0 HG1 THR A 12 3.635 2.580 -12.152 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.395 0.700 -11.337 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.481 -0.794 -11.655 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.194 0.118 -13.006 1.00 0.00 H new ATOM 215 N THR A 13 1.327 -1.997 -12.605 1.00 0.00 N ATOM 216 CA THR A 13 0.752 -3.201 -12.009 1.00 0.00 C ATOM 217 C THR A 13 1.689 -3.842 -10.993 1.00 0.00 C ATOM 218 O THR A 13 2.910 -3.827 -11.146 1.00 0.00 O ATOM 219 CB THR A 13 0.404 -4.235 -13.077 1.00 0.00 C ATOM 220 OG1 THR A 13 0.193 -3.618 -14.335 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.833 -5.036 -12.738 1.00 0.00 C ATOM 0 H THR A 13 2.186 -2.151 -13.133 1.00 0.00 H new ATOM 0 HA THR A 13 -0.156 -2.882 -11.497 1.00 0.00 H new ATOM 0 HB THR A 13 1.259 -4.910 -13.119 1.00 0.00 H new ATOM 0 HG1 THR A 13 -0.027 -4.302 -15.002 1.00 0.00 H new ATOM 0 HG21 THR A 13 -1.031 -5.754 -13.534 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.676 -5.568 -11.799 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.685 -4.364 -12.636 1.00 0.00 H new ATOM 229 N LEU A 14 1.086 -4.429 -9.968 1.00 0.00 N ATOM 230 CA LEU A 14 1.817 -5.116 -8.914 1.00 0.00 C ATOM 231 C LEU A 14 1.017 -6.327 -8.471 1.00 0.00 C ATOM 232 O LEU A 14 -0.190 -6.223 -8.267 1.00 0.00 O ATOM 233 CB LEU A 14 2.044 -4.198 -7.712 1.00 0.00 C ATOM 234 CG LEU A 14 2.235 -2.717 -8.033 1.00 0.00 C ATOM 235 CD1 LEU A 14 1.600 -1.869 -6.948 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.713 -2.382 -8.180 1.00 0.00 C ATOM 0 H LEU A 14 0.074 -4.442 -9.845 1.00 0.00 H new ATOM 0 HA LEU A 14 2.789 -5.419 -9.304 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.194 -4.297 -7.037 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.923 -4.549 -7.171 1.00 0.00 H new ATOM 0 HG LEU A 14 1.746 -2.499 -8.982 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.740 -0.814 -7.183 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.534 -2.090 -6.890 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.069 -2.093 -5.990 1.00 0.00 H new ATOM 0 HD21 LEU A 14 3.825 -1.322 -8.408 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.232 -2.609 -7.249 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.142 -2.975 -8.988 1.00 0.00 H new ATOM 248 N ALA A 15 1.664 -7.476 -8.323 1.00 0.00 N ATOM 249 CA ALA A 15 0.932 -8.661 -7.909 1.00 0.00 C ATOM 250 C ALA A 15 0.851 -8.752 -6.398 1.00 0.00 C ATOM 251 O ALA A 15 1.732 -9.306 -5.744 1.00 0.00 O ATOM 252 CB ALA A 15 1.569 -9.914 -8.491 1.00 0.00 C ATOM 0 H ALA A 15 2.663 -7.610 -8.478 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.085 -8.581 -8.294 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.007 -10.791 -8.170 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.559 -9.855 -9.579 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.598 -9.995 -8.141 1.00 0.00 H new ATOM 258 N PHE A 16 -0.245 -8.225 -5.870 1.00 0.00 N ATOM 259 CA PHE A 16 -0.520 -8.245 -4.449 1.00 0.00 C ATOM 260 C PHE A 16 -1.987 -7.989 -4.198 1.00 0.00 C ATOM 261 O PHE A 16 -2.742 -7.665 -5.107 1.00 0.00 O ATOM 262 CB PHE A 16 0.308 -7.218 -3.691 1.00 0.00 C ATOM 263 CG PHE A 16 1.784 -7.335 -3.938 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.394 -6.596 -4.939 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.562 -8.187 -3.169 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.753 -6.705 -5.169 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.920 -8.299 -3.395 1.00 0.00 C ATOM 268 CZ PHE A 16 4.517 -7.557 -4.395 1.00 0.00 C ATOM 0 H PHE A 16 -0.970 -7.769 -6.424 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.246 -9.235 -4.083 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.021 -6.218 -3.974 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.117 -7.326 -2.623 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.801 -5.928 -5.546 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.101 -8.769 -2.385 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.217 -6.125 -5.953 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.515 -8.967 -2.790 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.579 -7.643 -4.572 1.00 0.00 H new ATOM 278 N ASP A 17 -2.369 -8.110 -2.949 1.00 0.00 N ATOM 279 CA ASP A 17 -3.733 -7.873 -2.524 1.00 0.00 C ATOM 280 C ASP A 17 -3.980 -8.611 -1.250 1.00 0.00 C ATOM 281 O ASP A 17 -4.635 -8.114 -0.341 1.00 0.00 O ATOM 282 CB ASP A 17 -4.751 -8.307 -3.568 1.00 0.00 C ATOM 283 CG ASP A 17 -5.292 -7.138 -4.370 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.420 -7.248 -4.894 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.585 -6.113 -4.475 1.00 0.00 O ATOM 0 H ASP A 17 -1.740 -8.377 -2.192 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.855 -6.799 -2.380 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.289 -9.026 -4.245 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.577 -8.819 -3.075 1.00 0.00 H new ATOM 290 N GLU A 18 -3.437 -9.805 -1.169 1.00 0.00 N ATOM 291 CA GLU A 18 -3.609 -10.585 0.028 1.00 0.00 C ATOM 292 C GLU A 18 -3.319 -9.706 1.245 1.00 0.00 C ATOM 293 O GLU A 18 -4.208 -9.414 2.054 1.00 0.00 O ATOM 294 CB GLU A 18 -2.688 -11.808 0.020 1.00 0.00 C ATOM 295 CG GLU A 18 -2.710 -12.600 1.319 1.00 0.00 C ATOM 296 CD GLU A 18 -1.718 -12.076 2.338 1.00 0.00 C ATOM 297 OE1 GLU A 18 -2.108 -11.905 3.513 1.00 0.00 O ATOM 298 OE2 GLU A 18 -0.551 -11.838 1.963 1.00 0.00 O ATOM 0 H GLU A 18 -2.884 -10.247 -1.903 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.637 -10.944 0.074 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.978 -12.465 -0.800 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.667 -11.482 -0.179 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.713 -12.567 1.744 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.489 -13.646 1.106 1.00 0.00 H new ATOM 305 N ASP A 19 -2.072 -9.253 1.343 1.00 0.00 N ATOM 306 CA ASP A 19 -1.661 -8.392 2.443 1.00 0.00 C ATOM 307 C ASP A 19 -1.957 -6.928 2.154 1.00 0.00 C ATOM 308 O ASP A 19 -2.500 -6.224 3.003 1.00 0.00 O ATOM 309 CB ASP A 19 -0.171 -8.577 2.736 1.00 0.00 C ATOM 310 CG ASP A 19 0.095 -9.750 3.659 1.00 0.00 C ATOM 311 OD1 ASP A 19 1.057 -10.503 3.400 1.00 0.00 O ATOM 312 OD2 ASP A 19 -0.657 -9.915 4.641 1.00 0.00 O ATOM 0 H ASP A 19 -1.332 -9.468 0.675 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.239 -8.683 3.320 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.365 -8.727 1.799 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.224 -7.667 3.187 1.00 0.00 H new ATOM 317 N VAL A 20 -1.597 -6.463 0.963 1.00 0.00 N ATOM 318 CA VAL A 20 -1.836 -5.073 0.610 1.00 0.00 C ATOM 319 C VAL A 20 -3.329 -4.755 0.619 1.00 0.00 C ATOM 320 O VAL A 20 -3.736 -3.726 1.144 1.00 0.00 O ATOM 321 CB VAL A 20 -1.220 -4.697 -0.756 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.227 -5.155 -0.828 1.00 0.00 C ATOM 323 CG2 VAL A 20 -2.017 -5.289 -1.900 1.00 0.00 C ATOM 0 H VAL A 20 -1.146 -7.020 0.237 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.340 -4.470 1.370 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.252 -3.612 -0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.647 -4.883 -1.796 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.801 -4.674 -0.036 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.273 -6.237 -0.704 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.558 -5.006 -2.848 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.028 -6.375 -1.812 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.039 -4.912 -1.865 1.00 0.00 H new ATOM 333 N TYR A 21 -4.150 -5.644 0.055 1.00 0.00 N ATOM 334 CA TYR A 21 -5.592 -5.414 0.038 1.00 0.00 C ATOM 335 C TYR A 21 -6.151 -5.466 1.453 1.00 0.00 C ATOM 336 O TYR A 21 -6.943 -4.605 1.837 1.00 0.00 O ATOM 337 CB TYR A 21 -6.330 -6.418 -0.861 1.00 0.00 C ATOM 338 CG TYR A 21 -7.628 -5.883 -1.423 1.00 0.00 C ATOM 339 CD1 TYR A 21 -7.702 -4.602 -1.957 1.00 0.00 C ATOM 340 CD2 TYR A 21 -8.780 -6.659 -1.420 1.00 0.00 C ATOM 341 CE1 TYR A 21 -8.888 -4.110 -2.470 1.00 0.00 C ATOM 342 CE2 TYR A 21 -9.969 -6.175 -1.932 1.00 0.00 C ATOM 343 CZ TYR A 21 -10.017 -4.900 -2.455 1.00 0.00 C ATOM 344 OH TYR A 21 -11.200 -4.414 -2.966 1.00 0.00 O ATOM 0 H TYR A 21 -3.847 -6.512 -0.387 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.756 -4.421 -0.380 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.677 -6.704 -1.685 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.536 -7.323 -0.289 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.819 -3.981 -1.972 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.746 -7.658 -1.011 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.929 -3.112 -2.880 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -10.855 -6.792 -1.923 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.898 -5.096 -2.880 1.00 0.00 H new ATOM 354 N HIS A 22 -5.736 -6.461 2.244 1.00 0.00 N ATOM 355 CA HIS A 22 -6.222 -6.554 3.615 1.00 0.00 C ATOM 356 C HIS A 22 -5.683 -5.397 4.442 1.00 0.00 C ATOM 357 O HIS A 22 -6.415 -4.793 5.226 1.00 0.00 O ATOM 358 CB HIS A 22 -5.826 -7.891 4.244 1.00 0.00 C ATOM 359 CG HIS A 22 -6.848 -8.969 4.051 1.00 0.00 C ATOM 360 ND1 HIS A 22 -6.517 -10.290 3.838 1.00 0.00 N ATOM 361 CD2 HIS A 22 -8.201 -8.914 4.039 1.00 0.00 C ATOM 362 CE1 HIS A 22 -7.622 -11.002 3.703 1.00 0.00 C ATOM 363 NE2 HIS A 22 -8.656 -10.191 3.822 1.00 0.00 N ATOM 0 H HIS A 22 -5.082 -7.193 1.965 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.310 -6.497 3.599 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -4.879 -8.219 3.815 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -5.660 -7.746 5.311 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -8.808 -8.031 4.175 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -7.671 -12.066 3.526 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -9.636 -10.468 3.762 1.00 0.00 H new ATOM 372 N THR A 23 -4.408 -5.071 4.254 1.00 0.00 N ATOM 373 CA THR A 23 -3.807 -3.963 4.980 1.00 0.00 C ATOM 374 C THR A 23 -4.432 -2.650 4.532 1.00 0.00 C ATOM 375 O THR A 23 -4.792 -1.807 5.352 1.00 0.00 O ATOM 376 CB THR A 23 -2.300 -3.913 4.771 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.985 -3.819 3.392 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.571 -5.115 5.332 1.00 0.00 C ATOM 0 H THR A 23 -3.779 -5.553 3.612 1.00 0.00 H new ATOM 0 HA THR A 23 -3.997 -4.116 6.042 1.00 0.00 H new ATOM 0 HB THR A 23 -1.967 -3.027 5.312 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.275 -4.635 2.934 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.502 -5.011 5.147 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.749 -5.180 6.405 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.937 -6.021 4.848 1.00 0.00 H new ATOM 386 N LEU A 24 -4.587 -2.492 3.218 1.00 0.00 N ATOM 387 CA LEU A 24 -5.202 -1.290 2.671 1.00 0.00 C ATOM 388 C LEU A 24 -6.584 -1.092 3.280 1.00 0.00 C ATOM 389 O LEU A 24 -7.144 0.000 3.231 1.00 0.00 O ATOM 390 CB LEU A 24 -5.313 -1.374 1.145 1.00 0.00 C ATOM 391 CG LEU A 24 -4.245 -0.595 0.371 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.142 0.830 0.889 1.00 0.00 C ATOM 393 CD2 LEU A 24 -2.896 -1.291 0.467 1.00 0.00 C ATOM 0 H LEU A 24 -4.297 -3.177 2.520 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.569 -0.439 2.921 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.261 -2.422 0.850 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.295 -1.007 0.847 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.542 -0.562 -0.677 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.378 1.367 0.327 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.102 1.332 0.768 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.872 0.815 1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.152 -0.721 -0.090 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.595 -1.358 1.512 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.973 -2.294 0.047 1.00 0.00 H new ATOM 405 N LYS A 25 -7.135 -2.164 3.847 1.00 0.00 N ATOM 406 CA LYS A 25 -8.453 -2.110 4.451 1.00 0.00 C ATOM 407 C LYS A 25 -8.482 -1.222 5.689 1.00 0.00 C ATOM 408 O LYS A 25 -9.390 -0.404 5.840 1.00 0.00 O ATOM 409 CB LYS A 25 -8.945 -3.515 4.802 1.00 0.00 C ATOM 410 CG LYS A 25 -10.420 -3.570 5.171 1.00 0.00 C ATOM 411 CD LYS A 25 -11.302 -3.068 4.038 1.00 0.00 C ATOM 412 CE LYS A 25 -12.131 -1.865 4.464 1.00 0.00 C ATOM 413 NZ LYS A 25 -12.208 -0.835 3.392 1.00 0.00 N ATOM 0 H LYS A 25 -6.684 -3.078 3.898 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.123 -1.670 3.713 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.767 -4.176 3.954 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.356 -3.899 5.635 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.695 -4.595 5.420 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.595 -2.968 6.063 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.680 -2.798 3.184 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -11.964 -3.869 3.709 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -13.137 -2.192 4.726 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.696 -1.424 5.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.781 -0.033 3.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.250 -0.504 3.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.647 -1.248 2.544 1.00 0.00 H new ATOM 427 N LEU A 26 -7.499 -1.366 6.578 1.00 0.00 N ATOM 428 CA LEU A 26 -7.475 -0.536 7.779 1.00 0.00 C ATOM 429 C LEU A 26 -7.076 0.878 7.412 1.00 0.00 C ATOM 430 O LEU A 26 -7.688 1.845 7.856 1.00 0.00 O ATOM 431 CB LEU A 26 -6.533 -1.082 8.856 1.00 0.00 C ATOM 432 CG LEU A 26 -6.242 -2.575 8.778 1.00 0.00 C ATOM 433 CD1 LEU A 26 -5.087 -2.815 7.830 1.00 0.00 C ATOM 434 CD2 LEU A 26 -5.935 -3.134 10.159 1.00 0.00 C ATOM 0 H LEU A 26 -6.730 -2.030 6.493 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.480 -0.546 8.201 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.588 -0.542 8.795 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.962 -0.864 9.834 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.123 -3.092 8.399 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -4.878 -3.883 7.774 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.347 -2.443 6.839 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.203 -2.291 8.194 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.730 -4.202 10.082 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.063 -2.626 10.572 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -6.791 -2.975 10.814 1.00 0.00 H new ATOM 446 N VAL A 27 -6.052 0.985 6.579 1.00 0.00 N ATOM 447 CA VAL A 27 -5.568 2.282 6.125 1.00 0.00 C ATOM 448 C VAL A 27 -6.627 3.001 5.314 1.00 0.00 C ATOM 449 O VAL A 27 -6.837 4.198 5.478 1.00 0.00 O ATOM 450 CB VAL A 27 -4.293 2.172 5.274 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.055 2.502 6.092 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.172 0.808 4.678 1.00 0.00 C ATOM 0 H VAL A 27 -5.539 0.188 6.202 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.334 2.848 7.027 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.370 2.900 4.466 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.169 2.415 5.463 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.131 3.520 6.473 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.975 1.807 6.928 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.263 0.752 4.080 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.129 0.065 5.475 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.036 0.610 4.044 1.00 0.00 H new ATOM 462 N SER A 28 -7.291 2.277 4.425 1.00 0.00 N ATOM 463 CA SER A 28 -8.309 2.901 3.601 1.00 0.00 C ATOM 464 C SER A 28 -9.468 3.405 4.450 1.00 0.00 C ATOM 465 O SER A 28 -10.053 4.450 4.159 1.00 0.00 O ATOM 466 CB SER A 28 -8.818 1.937 2.527 1.00 0.00 C ATOM 467 OG SER A 28 -9.863 2.522 1.770 1.00 0.00 O ATOM 0 H SER A 28 -7.147 1.281 4.259 1.00 0.00 H new ATOM 0 HA SER A 28 -7.849 3.755 3.104 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.998 1.659 1.866 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.174 1.020 2.996 1.00 0.00 H new ATOM 0 HG SER A 28 -9.528 3.321 1.313 1.00 0.00 H new ATOM 473 N VAL A 29 -9.788 2.665 5.507 1.00 0.00 N ATOM 474 CA VAL A 29 -10.867 3.041 6.404 1.00 0.00 C ATOM 475 C VAL A 29 -10.394 4.116 7.374 1.00 0.00 C ATOM 476 O VAL A 29 -11.058 5.132 7.574 1.00 0.00 O ATOM 477 CB VAL A 29 -11.383 1.802 7.177 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.135 1.917 8.673 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.857 1.563 6.889 1.00 0.00 C ATOM 0 H VAL A 29 -9.312 1.799 5.761 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.689 3.444 5.812 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.816 0.941 6.823 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.513 1.026 9.174 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -10.065 2.011 8.858 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.649 2.797 9.060 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.199 0.688 7.442 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.434 2.435 7.197 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.996 1.394 5.821 1.00 0.00 H new ATOM 489 N TYR A 30 -9.236 3.872 7.973 1.00 0.00 N ATOM 490 CA TYR A 30 -8.656 4.805 8.928 1.00 0.00 C ATOM 491 C TYR A 30 -8.162 6.068 8.233 1.00 0.00 C ATOM 492 O TYR A 30 -8.097 7.133 8.847 1.00 0.00 O ATOM 493 CB TYR A 30 -7.504 4.153 9.693 1.00 0.00 C ATOM 494 CG TYR A 30 -7.945 3.398 10.927 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.648 4.039 11.939 1.00 0.00 C ATOM 496 CD2 TYR A 30 -7.659 2.048 11.080 1.00 0.00 C ATOM 497 CE1 TYR A 30 -9.054 3.355 13.070 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.061 1.356 12.207 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.758 2.015 13.199 1.00 0.00 C ATOM 500 OH TYR A 30 -9.160 1.331 14.322 1.00 0.00 O ATOM 0 H TYR A 30 -8.679 3.033 7.813 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.440 5.080 9.634 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.979 3.468 9.027 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.791 4.924 9.985 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -8.881 5.089 11.841 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.113 1.530 10.305 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -9.600 3.868 13.848 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -7.831 0.306 12.311 1.00 0.00 H new ATOM 0 HH TYR A 30 -8.873 0.396 14.256 1.00 0.00 H new ATOM 510 N LEU A 31 -7.813 5.956 6.951 1.00 0.00 N ATOM 511 CA LEU A 31 -7.329 7.109 6.207 1.00 0.00 C ATOM 512 C LEU A 31 -8.380 7.587 5.209 1.00 0.00 C ATOM 513 O LEU A 31 -8.181 8.590 4.524 1.00 0.00 O ATOM 514 CB LEU A 31 -6.025 6.779 5.462 1.00 0.00 C ATOM 515 CG LEU A 31 -4.942 6.006 6.245 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.568 6.605 5.978 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.220 5.991 7.743 1.00 0.00 C ATOM 0 H LEU A 31 -7.857 5.089 6.416 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.130 7.904 6.926 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.280 6.199 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.588 7.715 5.115 1.00 0.00 H new ATOM 0 HG LEU A 31 -4.964 4.974 5.894 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.814 6.050 6.537 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.346 6.546 4.912 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.558 7.648 6.294 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.433 5.436 8.254 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.245 7.014 8.119 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.181 5.512 7.930 1.00 0.00 H new ATOM 529 N ASN A 32 -9.496 6.861 5.116 1.00 0.00 N ATOM 530 CA ASN A 32 -10.556 7.218 4.181 1.00 0.00 C ATOM 531 C ASN A 32 -9.965 7.428 2.795 1.00 0.00 C ATOM 532 O ASN A 32 -10.414 8.283 2.032 1.00 0.00 O ATOM 533 CB ASN A 32 -11.276 8.486 4.646 1.00 0.00 C ATOM 534 CG ASN A 32 -12.240 8.218 5.785 1.00 0.00 C ATOM 535 OD1 ASN A 32 -11.846 7.732 6.846 1.00 0.00 O ATOM 536 ND2 ASN A 32 -13.512 8.535 5.571 1.00 0.00 N ATOM 0 H ASN A 32 -9.685 6.028 5.674 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.282 6.406 4.143 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -10.539 9.224 4.963 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -11.820 8.920 3.807 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.207 8.378 6.301 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.794 8.936 4.676 1.00 0.00 H new ATOM 543 N ARG A 33 -8.932 6.649 2.493 1.00 0.00 N ATOM 544 CA ARG A 33 -8.242 6.748 1.213 1.00 0.00 C ATOM 545 C ARG A 33 -8.276 5.426 0.458 1.00 0.00 C ATOM 546 O ARG A 33 -8.085 4.360 1.042 1.00 0.00 O ATOM 547 CB ARG A 33 -6.788 7.167 1.441 1.00 0.00 C ATOM 548 CG ARG A 33 -6.637 8.600 1.922 1.00 0.00 C ATOM 549 CD ARG A 33 -5.376 9.244 1.371 1.00 0.00 C ATOM 550 NE ARG A 33 -5.492 10.699 1.296 1.00 0.00 N ATOM 551 CZ ARG A 33 -5.517 11.495 2.362 1.00 0.00 C ATOM 552 NH1 ARG A 33 -5.433 10.985 3.584 1.00 0.00 N ATOM 553 NH2 ARG A 33 -5.625 12.808 2.205 1.00 0.00 N ATOM 0 H ARG A 33 -8.553 5.939 3.120 1.00 0.00 H new ATOM 0 HA ARG A 33 -8.756 7.498 0.612 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.336 6.497 2.173 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.233 7.044 0.511 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.507 9.181 1.616 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.609 8.618 3.012 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.528 8.980 2.003 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.169 8.845 0.378 1.00 0.00 H new ATOM 0 HE ARG A 33 -5.558 11.129 0.373 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -5.349 9.976 3.711 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -5.453 11.601 4.396 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.689 13.206 1.268 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -5.644 13.419 3.021 1.00 0.00 H new ATOM 567 N ASP A 34 -8.499 5.502 -0.850 1.00 0.00 N ATOM 568 CA ASP A 34 -8.528 4.308 -1.683 1.00 0.00 C ATOM 569 C ASP A 34 -7.206 3.563 -1.552 1.00 0.00 C ATOM 570 O ASP A 34 -6.220 4.126 -1.079 1.00 0.00 O ATOM 571 CB ASP A 34 -8.784 4.679 -3.145 1.00 0.00 C ATOM 572 CG ASP A 34 -10.253 4.920 -3.432 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.714 4.541 -4.530 1.00 0.00 O ATOM 574 OD2 ASP A 34 -10.943 5.489 -2.560 1.00 0.00 O ATOM 0 H ASP A 34 -8.661 6.374 -1.353 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.340 3.662 -1.348 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -8.216 5.575 -3.394 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.417 3.880 -3.789 1.00 0.00 H new ATOM 579 N MET A 35 -7.180 2.303 -1.963 1.00 0.00 N ATOM 580 CA MET A 35 -5.967 1.517 -1.872 1.00 0.00 C ATOM 581 C MET A 35 -4.845 2.178 -2.671 1.00 0.00 C ATOM 582 O MET A 35 -3.707 2.265 -2.209 1.00 0.00 O ATOM 583 CB MET A 35 -6.229 0.091 -2.366 1.00 0.00 C ATOM 584 CG MET A 35 -5.116 -0.464 -3.229 1.00 0.00 C ATOM 585 SD MET A 35 -5.237 -2.247 -3.469 1.00 0.00 S ATOM 586 CE MET A 35 -6.579 -2.341 -4.650 1.00 0.00 C ATOM 0 H MET A 35 -7.980 1.810 -2.359 1.00 0.00 H new ATOM 0 HA MET A 35 -5.652 1.466 -0.830 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.371 -0.563 -1.505 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.159 0.077 -2.934 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.135 0.030 -4.200 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.156 -0.229 -2.770 1.00 0.00 H new ATOM 0 HE1 MET A 35 -6.773 -3.385 -4.898 1.00 0.00 H new ATOM 0 HE2 MET A 35 -7.476 -1.898 -4.217 1.00 0.00 H new ATOM 0 HE3 MET A 35 -6.306 -1.798 -5.555 1.00 0.00 H new ATOM 596 N THR A 36 -5.179 2.649 -3.869 1.00 0.00 N ATOM 597 CA THR A 36 -4.204 3.310 -4.727 1.00 0.00 C ATOM 598 C THR A 36 -3.753 4.625 -4.106 1.00 0.00 C ATOM 599 O THR A 36 -2.581 4.991 -4.179 1.00 0.00 O ATOM 600 CB THR A 36 -4.800 3.562 -6.122 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.056 2.922 -6.256 1.00 0.00 O ATOM 602 CG2 THR A 36 -3.922 3.083 -7.258 1.00 0.00 C ATOM 0 H THR A 36 -6.116 2.585 -4.266 1.00 0.00 H new ATOM 0 HA THR A 36 -3.338 2.656 -4.829 1.00 0.00 H new ATOM 0 HB THR A 36 -4.894 4.646 -6.194 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.752 3.480 -5.852 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.410 3.296 -8.209 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.963 3.599 -7.219 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.761 2.009 -7.165 1.00 0.00 H new ATOM 610 N GLU A 37 -4.692 5.329 -3.485 1.00 0.00 N ATOM 611 CA GLU A 37 -4.387 6.599 -2.844 1.00 0.00 C ATOM 612 C GLU A 37 -3.470 6.388 -1.643 1.00 0.00 C ATOM 613 O GLU A 37 -2.592 7.204 -1.372 1.00 0.00 O ATOM 614 CB GLU A 37 -5.676 7.295 -2.404 1.00 0.00 C ATOM 615 CG GLU A 37 -5.566 8.810 -2.363 1.00 0.00 C ATOM 616 CD GLU A 37 -6.899 9.485 -2.113 1.00 0.00 C ATOM 617 OE1 GLU A 37 -7.006 10.242 -1.124 1.00 0.00 O ATOM 618 OE2 GLU A 37 -7.837 9.261 -2.906 1.00 0.00 O ATOM 0 H GLU A 37 -5.668 5.042 -3.413 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.873 7.233 -3.567 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.480 7.016 -3.085 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -5.955 6.932 -1.415 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -4.865 9.098 -1.580 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -5.154 9.166 -3.307 1.00 0.00 H new ATOM 625 N ILE A 38 -3.682 5.285 -0.931 1.00 0.00 N ATOM 626 CA ILE A 38 -2.876 4.958 0.242 1.00 0.00 C ATOM 627 C ILE A 38 -1.527 4.365 -0.162 1.00 0.00 C ATOM 628 O ILE A 38 -0.483 4.812 0.310 1.00 0.00 O ATOM 629 CB ILE A 38 -3.608 3.950 1.160 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.620 4.645 2.084 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.622 3.159 2.003 1.00 0.00 C ATOM 632 CD1 ILE A 38 -4.074 5.888 2.755 1.00 0.00 C ATOM 0 H ILE A 38 -4.407 4.601 -1.146 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.714 5.890 0.784 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.149 3.269 0.503 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -5.504 4.913 1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -4.943 3.941 2.850 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.165 2.459 2.638 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -1.946 2.607 1.350 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.046 3.843 2.627 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.843 6.325 3.392 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -3.208 5.623 3.362 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -3.777 6.611 1.995 1.00 0.00 H new ATOM 644 N ILE A 39 -1.551 3.346 -1.022 1.00 0.00 N ATOM 645 CA ILE A 39 -0.315 2.705 -1.453 1.00 0.00 C ATOM 646 C ILE A 39 0.600 3.710 -2.135 1.00 0.00 C ATOM 647 O ILE A 39 1.823 3.638 -2.013 1.00 0.00 O ATOM 648 CB ILE A 39 -0.579 1.529 -2.414 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.043 2.048 -3.774 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.605 0.576 -1.822 1.00 0.00 C ATOM 651 CD1 ILE A 39 0.079 2.171 -4.780 1.00 0.00 C ATOM 0 H ILE A 39 -2.401 2.954 -1.427 1.00 0.00 H new ATOM 0 HA ILE A 39 0.167 2.315 -0.557 1.00 0.00 H new ATOM 0 HB ILE A 39 0.352 0.980 -2.555 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.806 1.378 -4.170 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.513 3.023 -3.643 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.779 -0.248 -2.514 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -1.233 0.183 -0.876 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.540 1.109 -1.651 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.318 2.545 -5.724 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.831 2.864 -4.403 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.534 1.193 -4.939 1.00 0.00 H new ATOM 663 N GLU A 40 -0.004 4.652 -2.848 1.00 0.00 N ATOM 664 CA GLU A 40 0.757 5.674 -3.543 1.00 0.00 C ATOM 665 C GLU A 40 1.109 6.807 -2.592 1.00 0.00 C ATOM 666 O GLU A 40 2.093 7.517 -2.805 1.00 0.00 O ATOM 667 CB GLU A 40 -0.023 6.214 -4.744 1.00 0.00 C ATOM 668 CG GLU A 40 -0.343 5.160 -5.793 1.00 0.00 C ATOM 669 CD GLU A 40 0.893 4.645 -6.509 1.00 0.00 C ATOM 670 OE1 GLU A 40 0.865 4.561 -7.754 1.00 0.00 O ATOM 671 OE2 GLU A 40 1.887 4.324 -5.826 1.00 0.00 O ATOM 0 H GLU A 40 -1.015 4.727 -2.958 1.00 0.00 H new ATOM 0 HA GLU A 40 1.678 5.222 -3.910 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.955 6.656 -4.391 1.00 0.00 H new ATOM 0 HB3 GLU A 40 0.553 7.013 -5.210 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.855 4.324 -5.317 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -1.032 5.581 -6.525 1.00 0.00 H new ATOM 678 N GLU A 41 0.324 6.969 -1.528 1.00 0.00 N ATOM 679 CA GLU A 41 0.612 8.012 -0.553 1.00 0.00 C ATOM 680 C GLU A 41 1.637 7.506 0.451 1.00 0.00 C ATOM 681 O GLU A 41 2.414 8.281 1.011 1.00 0.00 O ATOM 682 CB GLU A 41 -0.659 8.458 0.171 1.00 0.00 C ATOM 683 CG GLU A 41 -1.400 9.577 -0.543 1.00 0.00 C ATOM 684 CD GLU A 41 -2.624 10.046 0.219 1.00 0.00 C ATOM 685 OE1 GLU A 41 -2.617 9.958 1.465 1.00 0.00 O ATOM 686 OE2 GLU A 41 -3.588 10.503 -0.430 1.00 0.00 O ATOM 0 H GLU A 41 -0.499 6.403 -1.324 1.00 0.00 H new ATOM 0 HA GLU A 41 1.017 8.875 -1.082 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -1.326 7.602 0.280 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.398 8.789 1.176 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -0.724 10.419 -0.690 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.702 9.234 -1.532 1.00 0.00 H new ATOM 693 N ALA A 42 1.641 6.193 0.662 1.00 0.00 N ATOM 694 CA ALA A 42 2.576 5.572 1.587 1.00 0.00 C ATOM 695 C ALA A 42 3.957 5.471 0.960 1.00 0.00 C ATOM 696 O ALA A 42 4.967 5.772 1.595 1.00 0.00 O ATOM 697 CB ALA A 42 2.080 4.193 1.992 1.00 0.00 C ATOM 0 H ALA A 42 1.006 5.540 0.203 1.00 0.00 H new ATOM 0 HA ALA A 42 2.645 6.195 2.479 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.790 3.740 2.684 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.108 4.284 2.476 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.987 3.565 1.106 1.00 0.00 H new ATOM 703 N VAL A 43 3.988 5.043 -0.297 1.00 0.00 N ATOM 704 CA VAL A 43 5.239 4.894 -1.030 1.00 0.00 C ATOM 705 C VAL A 43 6.073 6.158 -0.958 1.00 0.00 C ATOM 706 O VAL A 43 7.183 6.161 -0.428 1.00 0.00 O ATOM 707 CB VAL A 43 4.981 4.566 -2.523 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.921 5.467 -3.117 1.00 0.00 C ATOM 709 CG2 VAL A 43 6.255 4.681 -3.336 1.00 0.00 C ATOM 0 H VAL A 43 3.156 4.792 -0.832 1.00 0.00 H new ATOM 0 HA VAL A 43 5.778 4.071 -0.561 1.00 0.00 H new ATOM 0 HB VAL A 43 4.624 3.537 -2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.768 5.207 -4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.987 5.339 -2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.244 6.506 -3.044 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.044 4.445 -4.379 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.642 5.698 -3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.997 3.983 -2.950 1.00 0.00 H new ATOM 719 N VAL A 44 5.521 7.221 -1.500 1.00 0.00 N ATOM 720 CA VAL A 44 6.188 8.505 -1.520 1.00 0.00 C ATOM 721 C VAL A 44 6.523 8.947 -0.105 1.00 0.00 C ATOM 722 O VAL A 44 7.660 9.294 0.198 1.00 0.00 O ATOM 723 CB VAL A 44 5.300 9.559 -2.213 1.00 0.00 C ATOM 724 CG1 VAL A 44 5.412 10.928 -1.546 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.633 9.651 -3.692 1.00 0.00 C ATOM 0 H VAL A 44 4.600 7.221 -1.938 1.00 0.00 H new ATOM 0 HA VAL A 44 7.116 8.406 -2.083 1.00 0.00 H new ATOM 0 HB VAL A 44 4.265 9.233 -2.108 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.771 11.640 -2.066 1.00 0.00 H new ATOM 0 HG12 VAL A 44 5.100 10.852 -0.504 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.446 11.271 -1.591 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.996 10.400 -4.163 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.678 9.936 -3.813 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.464 8.683 -4.164 1.00 0.00 H new ATOM 735 N MET A 45 5.522 8.924 0.757 1.00 0.00 N ATOM 736 CA MET A 45 5.712 9.319 2.141 1.00 0.00 C ATOM 737 C MET A 45 6.797 8.481 2.802 1.00 0.00 C ATOM 738 O MET A 45 7.495 8.959 3.696 1.00 0.00 O ATOM 739 CB MET A 45 4.405 9.196 2.921 1.00 0.00 C ATOM 740 CG MET A 45 4.439 9.906 4.262 1.00 0.00 C ATOM 741 SD MET A 45 4.862 8.801 5.621 1.00 0.00 S ATOM 742 CE MET A 45 5.308 9.982 6.892 1.00 0.00 C ATOM 0 H MET A 45 4.572 8.637 0.524 1.00 0.00 H new ATOM 0 HA MET A 45 6.028 10.362 2.150 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.592 9.605 2.321 1.00 0.00 H new ATOM 0 HB3 MET A 45 4.183 8.141 3.081 1.00 0.00 H new ATOM 0 HG2 MET A 45 5.164 10.719 4.220 1.00 0.00 H new ATOM 0 HG3 MET A 45 3.466 10.357 4.455 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.016 9.594 7.868 1.00 0.00 H new ATOM 0 HE2 MET A 45 6.385 10.146 6.874 1.00 0.00 H new ATOM 0 HE3 MET A 45 4.794 10.926 6.708 1.00 0.00 H new ATOM 752 N TRP A 46 6.952 7.231 2.363 1.00 0.00 N ATOM 753 CA TRP A 46 7.975 6.369 2.938 1.00 0.00 C ATOM 754 C TRP A 46 9.353 6.834 2.499 1.00 0.00 C ATOM 755 O TRP A 46 10.238 7.044 3.325 1.00 0.00 O ATOM 756 CB TRP A 46 7.747 4.909 2.543 1.00 0.00 C ATOM 757 CG TRP A 46 8.794 3.977 3.075 1.00 0.00 C ATOM 758 CD1 TRP A 46 9.445 2.995 2.383 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.314 3.938 4.410 1.00 0.00 C ATOM 760 NE1 TRP A 46 10.335 2.349 3.205 1.00 0.00 N ATOM 761 CE2 TRP A 46 10.273 2.910 4.455 1.00 0.00 C ATOM 762 CE3 TRP A 46 9.061 4.674 5.572 1.00 0.00 C ATOM 763 CZ2 TRP A 46 10.980 2.600 5.614 1.00 0.00 C ATOM 764 CZ3 TRP A 46 9.764 4.365 6.723 1.00 0.00 C ATOM 765 CH2 TRP A 46 10.714 3.336 6.735 1.00 0.00 C ATOM 0 H TRP A 46 6.392 6.803 1.626 1.00 0.00 H new ATOM 0 HA TRP A 46 7.911 6.434 4.024 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.770 4.591 2.906 1.00 0.00 H new ATOM 0 HB3 TRP A 46 7.723 4.834 1.456 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.283 2.761 1.341 1.00 0.00 H new ATOM 0 HE1 TRP A 46 10.943 1.578 2.931 1.00 0.00 H new ATOM 0 HE3 TRP A 46 8.330 5.469 5.571 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 11.712 1.806 5.627 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 9.577 4.926 7.627 1.00 0.00 H new ATOM 0 HH2 TRP A 46 11.247 3.119 7.649 1.00 0.00 H new ATOM 776 N LEU A 47 9.525 7.017 1.197 1.00 0.00 N ATOM 777 CA LEU A 47 10.798 7.490 0.671 1.00 0.00 C ATOM 778 C LEU A 47 11.080 8.881 1.192 1.00 0.00 C ATOM 779 O LEU A 47 12.191 9.202 1.609 1.00 0.00 O ATOM 780 CB LEU A 47 10.796 7.552 -0.857 1.00 0.00 C ATOM 781 CG LEU A 47 9.465 7.913 -1.513 1.00 0.00 C ATOM 782 CD1 LEU A 47 9.430 9.400 -1.820 1.00 0.00 C ATOM 783 CD2 LEU A 47 9.254 7.097 -2.780 1.00 0.00 C ATOM 0 H LEU A 47 8.808 6.847 0.492 1.00 0.00 H new ATOM 0 HA LEU A 47 11.562 6.784 0.997 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.543 8.281 -1.172 1.00 0.00 H new ATOM 0 HB3 LEU A 47 11.116 6.583 -1.240 1.00 0.00 H new ATOM 0 HG LEU A 47 8.655 7.677 -0.823 1.00 0.00 H new ATOM 0 HD11 LEU A 47 8.479 9.653 -2.288 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.541 9.965 -0.895 1.00 0.00 H new ATOM 0 HD13 LEU A 47 10.246 9.651 -2.498 1.00 0.00 H new ATOM 0 HD21 LEU A 47 8.300 7.368 -3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 47 10.061 7.302 -3.483 1.00 0.00 H new ATOM 0 HD23 LEU A 47 9.249 6.035 -2.533 1.00 0.00 H new ATOM 795 N ILE A 48 10.058 9.711 1.143 1.00 0.00 N ATOM 796 CA ILE A 48 10.170 11.076 1.579 1.00 0.00 C ATOM 797 C ILE A 48 10.638 11.158 3.023 1.00 0.00 C ATOM 798 O ILE A 48 11.530 11.943 3.350 1.00 0.00 O ATOM 799 CB ILE A 48 8.824 11.802 1.396 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.968 12.869 0.325 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.324 12.405 2.698 1.00 0.00 C ATOM 802 CD1 ILE A 48 9.073 12.314 -1.078 1.00 0.00 C ATOM 0 H ILE A 48 9.132 9.454 0.800 1.00 0.00 H new ATOM 0 HA ILE A 48 10.921 11.571 0.963 1.00 0.00 H new ATOM 0 HB ILE A 48 8.079 11.071 1.081 1.00 0.00 H new ATOM 0 HG12 ILE A 48 8.111 13.541 0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.855 13.466 0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.372 12.908 2.524 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.188 11.615 3.436 1.00 0.00 H new ATOM 0 HG23 ILE A 48 9.053 13.126 3.069 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.173 13.135 -1.788 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.946 11.665 -1.148 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.175 11.741 -1.311 1.00 0.00 H new ATOM 814 N GLN A 49 10.036 10.355 3.890 1.00 0.00 N ATOM 815 CA GLN A 49 10.413 10.369 5.288 1.00 0.00 C ATOM 816 C GLN A 49 11.630 9.483 5.551 1.00 0.00 C ATOM 817 O GLN A 49 12.406 9.741 6.471 1.00 0.00 O ATOM 818 CB GLN A 49 9.233 9.935 6.170 1.00 0.00 C ATOM 819 CG GLN A 49 9.044 8.426 6.264 1.00 0.00 C ATOM 820 CD GLN A 49 8.031 8.032 7.322 1.00 0.00 C ATOM 821 OE1 GLN A 49 7.060 7.214 6.937 1.00 0.00 O flip ATOM 822 NE2 GLN A 49 8.123 8.457 8.474 1.00 0.00 N flip ATOM 0 H GLN A 49 9.295 9.696 3.650 1.00 0.00 H new ATOM 0 HA GLN A 49 10.686 11.393 5.545 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.378 10.335 7.174 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.318 10.381 5.779 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.721 8.043 5.296 1.00 0.00 H new ATOM 0 HG3 GLN A 49 10.001 7.957 6.490 1.00 0.00 H new ATOM 0 HE21 GLN A 49 8.886 9.085 8.727 1.00 0.00 H new ATOM 0 HE22 GLN A 49 7.436 8.182 9.176 1.00 0.00 H new ATOM 831 N ASN A 50 11.774 8.419 4.762 1.00 0.00 N ATOM 832 CA ASN A 50 12.885 7.484 4.947 1.00 0.00 C ATOM 833 C ASN A 50 14.051 7.740 3.997 1.00 0.00 C ATOM 834 O ASN A 50 15.171 8.005 4.432 1.00 0.00 O ATOM 835 CB ASN A 50 12.393 6.045 4.777 1.00 0.00 C ATOM 836 CG ASN A 50 13.246 5.049 5.538 1.00 0.00 C ATOM 837 OD1 ASN A 50 13.425 3.864 4.966 1.00 0.00 O flip ATOM 838 ND2 ASN A 50 13.740 5.342 6.627 1.00 0.00 N flip ATOM 0 H ASN A 50 11.143 8.184 3.996 1.00 0.00 H new ATOM 0 HA ASN A 50 13.257 7.642 5.959 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.361 5.974 5.121 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.394 5.786 3.718 1.00 0.00 H new ATOM 0 HD21 ASN A 50 13.576 6.265 7.030 1.00 0.00 H new ATOM 0 HD22 ASN A 50 14.313 4.662 7.127 1.00 0.00 H new ATOM 845 N LYS A 51 13.786 7.629 2.704 1.00 0.00 N ATOM 846 CA LYS A 51 14.819 7.817 1.688 1.00 0.00 C ATOM 847 C LYS A 51 15.453 9.201 1.771 1.00 0.00 C ATOM 848 O LYS A 51 16.673 9.323 1.881 1.00 0.00 O ATOM 849 CB LYS A 51 14.245 7.581 0.290 1.00 0.00 C ATOM 850 CG LYS A 51 14.347 6.135 -0.166 1.00 0.00 C ATOM 851 CD LYS A 51 13.397 5.238 0.611 1.00 0.00 C ATOM 852 CE LYS A 51 14.027 3.890 0.914 1.00 0.00 C ATOM 853 NZ LYS A 51 14.952 3.960 2.080 1.00 0.00 N ATOM 0 H LYS A 51 12.863 7.409 2.330 1.00 0.00 H new ATOM 0 HA LYS A 51 15.602 7.083 1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.198 7.885 0.279 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.770 8.217 -0.423 1.00 0.00 H new ATOM 0 HG2 LYS A 51 14.121 6.071 -1.230 1.00 0.00 H new ATOM 0 HG3 LYS A 51 15.370 5.783 -0.036 1.00 0.00 H new ATOM 0 HD2 LYS A 51 13.115 5.727 1.544 1.00 0.00 H new ATOM 0 HD3 LYS A 51 12.482 5.092 0.037 1.00 0.00 H new ATOM 0 HE2 LYS A 51 13.243 3.160 1.115 1.00 0.00 H new ATOM 0 HE3 LYS A 51 14.572 3.539 0.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 15.548 3.108 2.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 15.556 4.802 1.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 14.399 4.019 2.959 1.00 0.00 H new ATOM 867 N GLU A 52 14.626 10.242 1.716 1.00 0.00 N ATOM 868 CA GLU A 52 15.121 11.615 1.786 1.00 0.00 C ATOM 869 C GLU A 52 16.136 11.772 2.917 1.00 0.00 C ATOM 870 O GLU A 52 17.041 12.603 2.848 1.00 0.00 O ATOM 871 CB GLU A 52 13.959 12.588 1.989 1.00 0.00 C ATOM 872 CG GLU A 52 14.127 13.900 1.240 1.00 0.00 C ATOM 873 CD GLU A 52 13.957 13.742 -0.258 1.00 0.00 C ATOM 874 OE1 GLU A 52 14.310 12.666 -0.785 1.00 0.00 O ATOM 875 OE2 GLU A 52 13.469 14.693 -0.904 1.00 0.00 O ATOM 0 H GLU A 52 13.613 10.162 1.623 1.00 0.00 H new ATOM 0 HA GLU A 52 15.617 11.844 0.843 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.035 12.110 1.665 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.853 12.798 3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.399 14.621 1.610 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.116 14.309 1.449 1.00 0.00 H new ATOM 882 N LYS A 53 15.974 10.961 3.957 1.00 0.00 N ATOM 883 CA LYS A 53 16.867 10.994 5.109 1.00 0.00 C ATOM 884 C LYS A 53 17.445 9.608 5.386 1.00 0.00 C ATOM 885 O LYS A 53 17.736 9.270 6.532 1.00 0.00 O ATOM 886 CB LYS A 53 16.127 11.511 6.344 1.00 0.00 C ATOM 887 CG LYS A 53 14.977 10.620 6.785 1.00 0.00 C ATOM 888 CD LYS A 53 15.184 10.084 8.195 1.00 0.00 C ATOM 889 CE LYS A 53 15.292 8.567 8.208 1.00 0.00 C ATOM 890 NZ LYS A 53 14.056 7.926 8.736 1.00 0.00 N ATOM 0 H LYS A 53 15.228 10.269 4.025 1.00 0.00 H new ATOM 0 HA LYS A 53 17.689 11.673 4.882 1.00 0.00 H new ATOM 0 HB2 LYS A 53 16.835 11.609 7.167 1.00 0.00 H new ATOM 0 HB3 LYS A 53 15.742 12.509 6.135 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.045 11.183 6.744 1.00 0.00 H new ATOM 0 HG3 LYS A 53 14.877 9.786 6.090 1.00 0.00 H new ATOM 0 HD2 LYS A 53 16.089 10.517 8.620 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.354 10.396 8.829 1.00 0.00 H new ATOM 0 HE2 LYS A 53 15.483 8.208 7.197 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.144 8.269 8.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 14.201 6.899 8.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 13.840 8.312 9.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 13.262 8.119 8.092 1.00 0.00 H new ATOM 904 N LEU A 54 17.597 8.804 4.331 1.00 0.00 N ATOM 905 CA LEU A 54 18.124 7.445 4.463 1.00 0.00 C ATOM 906 C LEU A 54 19.459 7.447 5.206 1.00 0.00 C ATOM 907 O LEU A 54 20.502 7.756 4.628 1.00 0.00 O ATOM 908 CB LEU A 54 18.308 6.816 3.077 1.00 0.00 C ATOM 909 CG LEU A 54 19.038 5.467 3.065 1.00 0.00 C ATOM 910 CD1 LEU A 54 18.095 4.349 2.650 1.00 0.00 C ATOM 911 CD2 LEU A 54 20.243 5.519 2.136 1.00 0.00 C ATOM 0 H LEU A 54 17.362 9.072 3.375 1.00 0.00 H new ATOM 0 HA LEU A 54 17.408 6.858 5.037 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.326 6.684 2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 54 18.859 7.515 2.448 1.00 0.00 H new ATOM 0 HG LEU A 54 19.390 5.261 4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 54 18.633 3.401 2.648 1.00 0.00 H new ATOM 0 HD12 LEU A 54 17.265 4.293 3.354 1.00 0.00 H new ATOM 0 HD13 LEU A 54 17.710 4.550 1.650 1.00 0.00 H new ATOM 0 HD21 LEU A 54 20.748 4.553 2.141 1.00 0.00 H new ATOM 0 HD22 LEU A 54 19.912 5.751 1.124 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.933 6.291 2.478 1.00 0.00 H new ATOM 923 N PRO A 55 19.442 7.100 6.508 1.00 0.00 N ATOM 924 CA PRO A 55 20.645 7.061 7.338 1.00 0.00 C ATOM 925 C PRO A 55 21.464 5.794 7.114 1.00 0.00 C ATOM 926 O PRO A 55 20.938 4.774 6.670 1.00 0.00 O ATOM 927 CB PRO A 55 20.101 7.091 8.779 1.00 0.00 C ATOM 928 CG PRO A 55 18.610 7.185 8.662 1.00 0.00 C ATOM 929 CD PRO A 55 18.258 6.718 7.280 1.00 0.00 C ATOM 0 HA PRO A 55 21.317 7.887 7.106 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.393 6.193 9.324 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.503 7.942 9.329 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.122 6.567 9.416 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.273 8.209 8.823 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.081 5.643 7.247 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.356 7.201 6.905 1.00 0.00 H new ATOM 937 N ASN A 56 22.750 5.864 7.435 1.00 0.00 N ATOM 938 CA ASN A 56 23.638 4.719 7.281 1.00 0.00 C ATOM 939 C ASN A 56 23.390 3.693 8.383 1.00 0.00 C ATOM 940 O ASN A 56 23.627 2.499 8.201 1.00 0.00 O ATOM 941 CB ASN A 56 25.100 5.170 7.306 1.00 0.00 C ATOM 942 CG ASN A 56 26.014 4.211 6.570 1.00 0.00 C ATOM 943 OD1 ASN A 56 26.579 4.547 5.530 1.00 0.00 O ATOM 944 ND2 ASN A 56 26.163 3.006 7.109 1.00 0.00 N ATOM 0 H ASN A 56 23.201 6.701 7.803 1.00 0.00 H new ATOM 0 HA ASN A 56 23.429 4.253 6.318 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.180 6.160 6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.431 5.262 8.340 1.00 0.00 H new ATOM 0 HD21 ASN A 56 26.765 2.317 6.659 1.00 0.00 H new ATOM 0 HD22 ASN A 56 25.675 2.770 7.973 1.00 0.00 H new ATOM 951 N GLU A 57 22.910 4.170 9.530 1.00 0.00 N ATOM 952 CA GLU A 57 22.628 3.300 10.666 1.00 0.00 C ATOM 953 C GLU A 57 21.306 2.559 10.479 1.00 0.00 C ATOM 954 O GLU A 57 21.079 1.516 11.090 1.00 0.00 O ATOM 955 CB GLU A 57 22.588 4.114 11.960 1.00 0.00 C ATOM 956 CG GLU A 57 21.633 5.295 11.907 1.00 0.00 C ATOM 957 CD GLU A 57 22.343 6.607 11.642 1.00 0.00 C ATOM 958 OE1 GLU A 57 22.401 7.023 10.464 1.00 0.00 O ATOM 959 OE2 GLU A 57 22.841 7.220 12.609 1.00 0.00 O ATOM 0 H GLU A 57 22.709 5.156 9.696 1.00 0.00 H new ATOM 0 HA GLU A 57 23.428 2.563 10.729 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.298 3.460 12.782 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.591 4.478 12.181 1.00 0.00 H new ATOM 0 HG2 GLU A 57 20.892 5.123 11.127 1.00 0.00 H new ATOM 0 HG3 GLU A 57 21.092 5.363 12.851 1.00 0.00 H new ATOM 966 N LEU A 58 20.434 3.105 9.633 1.00 0.00 N ATOM 967 CA LEU A 58 19.136 2.490 9.370 1.00 0.00 C ATOM 968 C LEU A 58 19.244 1.424 8.282 1.00 0.00 C ATOM 969 O LEU A 58 18.357 0.583 8.145 1.00 0.00 O ATOM 970 CB LEU A 58 18.118 3.551 8.950 1.00 0.00 C ATOM 971 CG LEU A 58 17.176 4.027 10.059 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.149 5.002 9.503 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.486 2.842 10.722 1.00 0.00 C ATOM 0 H LEU A 58 20.603 3.970 9.120 1.00 0.00 H new ATOM 0 HA LEU A 58 18.800 2.014 10.291 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.657 4.414 8.558 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.518 3.152 8.132 1.00 0.00 H new ATOM 0 HG LEU A 58 17.768 4.544 10.814 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.488 5.330 10.305 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.660 5.866 9.078 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.562 4.510 8.727 1.00 0.00 H new ATOM 0 HD21 LEU A 58 15.821 3.201 11.507 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.907 2.295 9.978 1.00 0.00 H new ATOM 0 HD23 LEU A 58 17.236 2.181 11.156 1.00 0.00 H new ATOM 985 N LYS A 59 20.331 1.471 7.510 1.00 0.00 N ATOM 986 CA LYS A 59 20.560 0.515 6.425 1.00 0.00 C ATOM 987 C LYS A 59 20.088 -0.892 6.797 1.00 0.00 C ATOM 988 O LYS A 59 19.385 -1.541 6.025 1.00 0.00 O ATOM 989 CB LYS A 59 22.044 0.484 6.058 1.00 0.00 C ATOM 990 CG LYS A 59 22.298 0.355 4.565 1.00 0.00 C ATOM 991 CD LYS A 59 23.778 0.181 4.267 1.00 0.00 C ATOM 992 CE LYS A 59 24.258 -1.215 4.627 1.00 0.00 C ATOM 993 NZ LYS A 59 25.728 -1.256 4.860 1.00 0.00 N ATOM 0 H LYS A 59 21.071 2.165 7.617 1.00 0.00 H new ATOM 0 HA LYS A 59 19.976 0.846 5.566 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.519 1.395 6.422 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.520 -0.351 6.573 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.744 -0.497 4.172 1.00 0.00 H new ATOM 0 HG3 LYS A 59 21.924 1.242 4.053 1.00 0.00 H new ATOM 0 HD2 LYS A 59 23.962 0.369 3.209 1.00 0.00 H new ATOM 0 HD3 LYS A 59 24.352 0.920 4.826 1.00 0.00 H new ATOM 0 HE2 LYS A 59 23.739 -1.557 5.522 1.00 0.00 H new ATOM 0 HE3 LYS A 59 23.999 -1.906 3.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 26.014 -2.226 5.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 26.225 -0.954 3.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 25.973 -0.616 5.643 1.00 0.00 H new ATOM 1007 N PRO A 60 20.472 -1.387 7.986 1.00 0.00 N ATOM 1008 CA PRO A 60 20.082 -2.724 8.444 1.00 0.00 C ATOM 1009 C PRO A 60 18.581 -2.843 8.674 1.00 0.00 C ATOM 1010 O PRO A 60 17.995 -3.905 8.464 1.00 0.00 O ATOM 1011 CB PRO A 60 20.844 -2.899 9.767 1.00 0.00 C ATOM 1012 CG PRO A 60 21.887 -1.834 9.767 1.00 0.00 C ATOM 1013 CD PRO A 60 21.315 -0.698 8.972 1.00 0.00 C ATOM 0 HA PRO A 60 20.319 -3.487 7.703 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.176 -2.795 10.622 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.294 -3.890 9.833 1.00 0.00 H new ATOM 0 HG2 PRO A 60 22.124 -1.519 10.783 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.814 -2.195 9.321 1.00 0.00 H new ATOM 0 HD2 PRO A 60 20.735 -0.018 9.596 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.095 -0.105 8.494 1.00 0.00 H new ATOM 1021 N LYS A 61 17.962 -1.751 9.104 1.00 0.00 N ATOM 1022 CA LYS A 61 16.525 -1.747 9.355 1.00 0.00 C ATOM 1023 C LYS A 61 15.749 -1.935 8.058 1.00 0.00 C ATOM 1024 O LYS A 61 14.621 -2.426 8.069 1.00 0.00 O ATOM 1025 CB LYS A 61 16.090 -0.453 10.041 1.00 0.00 C ATOM 1026 CG LYS A 61 14.701 -0.537 10.656 1.00 0.00 C ATOM 1027 CD LYS A 61 13.634 -0.027 9.699 1.00 0.00 C ATOM 1028 CE LYS A 61 12.812 1.091 10.320 1.00 0.00 C ATOM 1029 NZ LYS A 61 11.789 0.567 11.267 1.00 0.00 N ATOM 0 H LYS A 61 18.428 -0.862 9.286 1.00 0.00 H new ATOM 0 HA LYS A 61 16.304 -2.582 10.020 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.810 -0.203 10.820 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.110 0.360 9.315 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.484 -1.570 10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.674 0.046 11.577 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.106 0.333 8.785 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.976 -0.849 9.416 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.474 1.780 10.845 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.319 1.660 9.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.250 1.360 11.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.142 -0.071 10.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.260 0.045 12.033 1.00 0.00 H new ATOM 1043 N ILE A 62 16.358 -1.558 6.933 1.00 0.00 N ATOM 1044 CA ILE A 62 15.707 -1.714 5.639 1.00 0.00 C ATOM 1045 C ILE A 62 15.284 -3.169 5.453 1.00 0.00 C ATOM 1046 O ILE A 62 14.285 -3.460 4.795 1.00 0.00 O ATOM 1047 CB ILE A 62 16.625 -1.256 4.477 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.529 0.261 4.296 1.00 0.00 C ATOM 1049 CG2 ILE A 62 16.267 -1.967 3.176 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.577 1.033 5.597 1.00 0.00 C ATOM 0 H ILE A 62 17.291 -1.147 6.894 1.00 0.00 H new ATOM 0 HA ILE A 62 14.824 -1.076 5.620 1.00 0.00 H new ATOM 0 HB ILE A 62 17.651 -1.521 4.733 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.346 0.594 3.656 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.600 0.498 3.777 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.928 -1.624 2.380 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.382 -3.043 3.306 1.00 0.00 H new ATOM 0 HG23 ILE A 62 15.234 -1.742 2.911 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.504 2.101 5.390 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.745 0.729 6.232 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.517 0.826 6.108 1.00 0.00 H new ATOM 1062 N ASP A 63 16.028 -4.074 6.085 1.00 0.00 N ATOM 1063 CA ASP A 63 15.707 -5.486 6.037 1.00 0.00 C ATOM 1064 C ASP A 63 14.484 -5.714 6.908 1.00 0.00 C ATOM 1065 O ASP A 63 13.602 -6.503 6.576 1.00 0.00 O ATOM 1066 CB ASP A 63 16.888 -6.325 6.533 1.00 0.00 C ATOM 1067 CG ASP A 63 17.333 -7.354 5.513 1.00 0.00 C ATOM 1068 OD1 ASP A 63 17.434 -7.001 4.319 1.00 0.00 O ATOM 1069 OD2 ASP A 63 17.583 -8.513 5.908 1.00 0.00 O ATOM 0 H ASP A 63 16.857 -3.848 6.635 1.00 0.00 H new ATOM 0 HA ASP A 63 15.500 -5.791 5.011 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.724 -5.667 6.770 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.609 -6.831 7.457 1.00 0.00 H new ATOM 1074 N GLU A 64 14.435 -4.974 8.015 1.00 0.00 N ATOM 1075 CA GLU A 64 13.318 -5.036 8.941 1.00 0.00 C ATOM 1076 C GLU A 64 12.040 -4.617 8.227 1.00 0.00 C ATOM 1077 O GLU A 64 11.007 -5.270 8.340 1.00 0.00 O ATOM 1078 CB GLU A 64 13.581 -4.116 10.138 1.00 0.00 C ATOM 1079 CG GLU A 64 13.693 -4.852 11.464 1.00 0.00 C ATOM 1080 CD GLU A 64 15.029 -5.551 11.631 1.00 0.00 C ATOM 1081 OE1 GLU A 64 15.422 -6.306 10.718 1.00 0.00 O ATOM 1082 OE2 GLU A 64 15.681 -5.341 12.675 1.00 0.00 O ATOM 0 H GLU A 64 15.167 -4.319 8.289 1.00 0.00 H new ATOM 0 HA GLU A 64 13.205 -6.058 9.303 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.502 -3.561 9.962 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.776 -3.384 10.206 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.552 -4.145 12.281 1.00 0.00 H new ATOM 0 HG3 GLU A 64 12.891 -5.587 11.537 1.00 0.00 H new ATOM 1089 N ILE A 65 12.133 -3.524 7.476 1.00 0.00 N ATOM 1090 CA ILE A 65 11.001 -3.003 6.720 1.00 0.00 C ATOM 1091 C ILE A 65 10.476 -4.045 5.737 1.00 0.00 C ATOM 1092 O ILE A 65 9.269 -4.179 5.552 1.00 0.00 O ATOM 1093 CB ILE A 65 11.397 -1.732 5.940 1.00 0.00 C ATOM 1094 CG1 ILE A 65 11.964 -0.679 6.895 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.205 -1.175 5.172 1.00 0.00 C ATOM 1096 CD1 ILE A 65 10.920 -0.076 7.810 1.00 0.00 C ATOM 0 H ILE A 65 12.989 -2.978 7.375 1.00 0.00 H new ATOM 0 HA ILE A 65 10.218 -2.757 7.437 1.00 0.00 H new ATOM 0 HB ILE A 65 12.169 -1.997 5.218 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.749 -1.133 7.500 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.430 0.116 6.313 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.508 -0.279 4.630 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.846 -1.923 4.465 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.407 -0.924 5.871 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.389 0.662 8.460 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.147 0.406 7.212 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.471 -0.862 8.418 1.00 0.00 H new ATOM 1108 N SER A 66 11.392 -4.774 5.105 1.00 0.00 N ATOM 1109 CA SER A 66 11.019 -5.797 4.131 1.00 0.00 C ATOM 1110 C SER A 66 10.643 -7.110 4.813 1.00 0.00 C ATOM 1111 O SER A 66 9.717 -7.798 4.386 1.00 0.00 O ATOM 1112 CB SER A 66 12.165 -6.033 3.147 1.00 0.00 C ATOM 1113 OG SER A 66 13.364 -6.360 3.828 1.00 0.00 O ATOM 0 H SER A 66 12.397 -4.676 5.249 1.00 0.00 H new ATOM 0 HA SER A 66 10.145 -5.435 3.590 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.900 -6.839 2.463 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.319 -5.139 2.542 1.00 0.00 H new ATOM 0 HG SER A 66 13.213 -6.316 4.795 1.00 0.00 H new ATOM 1119 N LYS A 67 11.368 -7.458 5.869 1.00 0.00 N ATOM 1120 CA LYS A 67 11.105 -8.694 6.595 1.00 0.00 C ATOM 1121 C LYS A 67 9.911 -8.540 7.538 1.00 0.00 C ATOM 1122 O LYS A 67 9.308 -9.531 7.949 1.00 0.00 O ATOM 1123 CB LYS A 67 12.351 -9.145 7.365 1.00 0.00 C ATOM 1124 CG LYS A 67 12.722 -8.246 8.534 1.00 0.00 C ATOM 1125 CD LYS A 67 12.911 -9.051 9.813 1.00 0.00 C ATOM 1126 CE LYS A 67 12.893 -8.159 11.043 1.00 0.00 C ATOM 1127 NZ LYS A 67 12.319 -8.857 12.226 1.00 0.00 N ATOM 0 H LYS A 67 12.140 -6.904 6.241 1.00 0.00 H new ATOM 0 HA LYS A 67 10.855 -9.464 5.865 1.00 0.00 H new ATOM 0 HB2 LYS A 67 12.188 -10.157 7.737 1.00 0.00 H new ATOM 0 HB3 LYS A 67 13.194 -9.191 6.675 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.640 -7.706 8.303 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.942 -7.500 8.683 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.122 -9.798 9.893 1.00 0.00 H new ATOM 0 HD3 LYS A 67 13.857 -9.590 9.768 1.00 0.00 H new ATOM 0 HE2 LYS A 67 13.908 -7.834 11.271 1.00 0.00 H new ATOM 0 HE3 LYS A 67 12.310 -7.262 10.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.324 -8.215 13.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 11.342 -9.145 12.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 12.890 -9.699 12.443 1.00 0.00 H new ATOM 1141 N ARG A 68 9.567 -7.298 7.870 1.00 0.00 N ATOM 1142 CA ARG A 68 8.435 -7.033 8.755 1.00 0.00 C ATOM 1143 C ARG A 68 7.160 -6.807 7.952 1.00 0.00 C ATOM 1144 O ARG A 68 6.066 -7.130 8.410 1.00 0.00 O ATOM 1145 CB ARG A 68 8.708 -5.818 9.645 1.00 0.00 C ATOM 1146 CG ARG A 68 9.816 -6.047 10.658 1.00 0.00 C ATOM 1147 CD ARG A 68 10.308 -4.736 11.256 1.00 0.00 C ATOM 1148 NE ARG A 68 10.586 -4.855 12.686 1.00 0.00 N ATOM 1149 CZ ARG A 68 11.032 -3.853 13.439 1.00 0.00 C ATOM 1150 NH1 ARG A 68 11.250 -2.658 12.904 1.00 0.00 N ATOM 1151 NH2 ARG A 68 11.262 -4.045 14.732 1.00 0.00 N ATOM 0 H ARG A 68 10.053 -6.463 7.542 1.00 0.00 H new ATOM 0 HA ARG A 68 8.301 -7.909 9.390 1.00 0.00 H new ATOM 0 HB2 ARG A 68 8.972 -4.968 9.015 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.793 -5.551 10.173 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.453 -6.697 11.454 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.647 -6.564 10.178 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.212 -4.418 10.737 1.00 0.00 H new ATOM 0 HD3 ARG A 68 9.558 -3.961 11.096 1.00 0.00 H new ATOM 0 HE ARG A 68 10.429 -5.759 13.132 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.076 -2.504 11.911 1.00 0.00 H new ATOM 0 HH12 ARG A 68 11.592 -1.893 13.486 1.00 0.00 H new ATOM 0 HH21 ARG A 68 11.097 -4.961 15.149 1.00 0.00 H new ATOM 0 HH22 ARG A 68 11.604 -3.276 15.309 1.00 0.00 H new ATOM 1165 N PHE A 69 7.304 -6.257 6.748 1.00 0.00 N ATOM 1166 CA PHE A 69 6.153 -6.003 5.890 1.00 0.00 C ATOM 1167 C PHE A 69 5.434 -7.315 5.587 1.00 0.00 C ATOM 1168 O PHE A 69 4.207 -7.365 5.510 1.00 0.00 O ATOM 1169 CB PHE A 69 6.591 -5.290 4.596 1.00 0.00 C ATOM 1170 CG PHE A 69 6.421 -6.104 3.339 1.00 0.00 C ATOM 1171 CD1 PHE A 69 5.163 -6.326 2.803 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.523 -6.644 2.696 1.00 0.00 C ATOM 1173 CE1 PHE A 69 5.007 -7.071 1.649 1.00 0.00 C ATOM 1174 CE2 PHE A 69 7.374 -7.390 1.542 1.00 0.00 C ATOM 1175 CZ PHE A 69 6.114 -7.604 1.019 1.00 0.00 C ATOM 0 H PHE A 69 8.201 -5.981 6.348 1.00 0.00 H new ATOM 0 HA PHE A 69 5.457 -5.344 6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 69 6.020 -4.367 4.495 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.639 -5.007 4.690 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.294 -5.912 3.293 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.511 -6.480 3.101 1.00 0.00 H new ATOM 0 HE1 PHE A 69 4.021 -7.236 1.241 1.00 0.00 H new ATOM 0 HE2 PHE A 69 8.241 -7.805 1.050 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.995 -8.188 0.118 1.00 0.00 H new ATOM 1185 N PHE A 70 6.217 -8.377 5.439 1.00 0.00 N ATOM 1186 CA PHE A 70 5.675 -9.701 5.172 1.00 0.00 C ATOM 1187 C PHE A 70 5.868 -10.590 6.397 1.00 0.00 C ATOM 1188 O PHE A 70 6.730 -11.469 6.412 1.00 0.00 O ATOM 1189 CB PHE A 70 6.361 -10.324 3.953 1.00 0.00 C ATOM 1190 CG PHE A 70 5.571 -11.436 3.323 1.00 0.00 C ATOM 1191 CD1 PHE A 70 5.977 -12.754 3.456 1.00 0.00 C ATOM 1192 CD2 PHE A 70 4.421 -11.162 2.599 1.00 0.00 C ATOM 1193 CE1 PHE A 70 5.252 -13.778 2.877 1.00 0.00 C ATOM 1194 CE2 PHE A 70 3.693 -12.183 2.017 1.00 0.00 C ATOM 1195 CZ PHE A 70 4.109 -13.492 2.158 1.00 0.00 C ATOM 0 H PHE A 70 7.235 -8.345 5.500 1.00 0.00 H new ATOM 0 HA PHE A 70 4.610 -9.611 4.958 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.537 -9.547 3.209 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.337 -10.706 4.251 1.00 0.00 H new ATOM 0 HD1 PHE A 70 6.870 -12.984 4.018 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.090 -10.140 2.488 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.579 -14.801 2.987 1.00 0.00 H new ATOM 0 HE2 PHE A 70 2.800 -11.957 1.453 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.541 -14.291 1.706 1.00 0.00 H new ATOM 1205 N PRO A 71 5.066 -10.360 7.452 1.00 0.00 N ATOM 1206 CA PRO A 71 5.154 -11.131 8.696 1.00 0.00 C ATOM 1207 C PRO A 71 4.672 -12.567 8.522 1.00 0.00 C ATOM 1208 O PRO A 71 3.838 -12.853 7.661 1.00 0.00 O ATOM 1209 CB PRO A 71 4.234 -10.366 9.649 1.00 0.00 C ATOM 1210 CG PRO A 71 3.255 -9.683 8.762 1.00 0.00 C ATOM 1211 CD PRO A 71 4.016 -9.326 7.516 1.00 0.00 C ATOM 0 HA PRO A 71 6.180 -11.219 9.052 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.735 -11.041 10.344 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.794 -9.648 10.248 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.412 -10.336 8.533 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.848 -8.793 9.241 1.00 0.00 H new ATOM 0 HD2 PRO A 71 3.376 -9.347 6.634 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.441 -8.324 7.577 1.00 0.00 H new ATOM 1219 N ALA A 72 5.200 -13.469 9.343 1.00 0.00 N ATOM 1220 CA ALA A 72 4.821 -14.875 9.279 1.00 0.00 C ATOM 1221 C ALA A 72 4.725 -15.485 10.672 1.00 0.00 C ATOM 1222 O ALA A 72 5.545 -15.196 11.544 1.00 0.00 O ATOM 1223 CB ALA A 72 5.818 -15.649 8.428 1.00 0.00 C ATOM 0 H ALA A 72 5.892 -13.251 10.060 1.00 0.00 H new ATOM 0 HA ALA A 72 3.836 -14.940 8.817 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.525 -16.698 8.387 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.832 -15.237 7.419 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.812 -15.567 8.867 1.00 0.00 H new ATOM 1229 N LYS A 73 3.720 -16.331 10.874 1.00 0.00 N ATOM 1230 CA LYS A 73 3.517 -16.983 12.162 1.00 0.00 C ATOM 1231 C LYS A 73 4.394 -18.225 12.288 1.00 0.00 C ATOM 1232 O LYS A 73 5.317 -18.381 11.460 1.00 0.00 O ATOM 1233 CB LYS A 73 2.046 -17.364 12.339 1.00 0.00 C ATOM 1234 CG LYS A 73 1.506 -18.243 11.222 1.00 0.00 C ATOM 1235 CD LYS A 73 0.576 -17.469 10.302 1.00 0.00 C ATOM 1236 CE LYS A 73 -0.146 -18.393 9.333 1.00 0.00 C ATOM 1237 NZ LYS A 73 -0.358 -17.751 8.007 1.00 0.00 N ATOM 1238 OXT LYS A 73 4.152 -19.029 13.212 1.00 0.00 O ATOM 0 H LYS A 73 3.034 -16.581 10.162 1.00 0.00 H new ATOM 0 HA LYS A 73 3.800 -16.279 12.945 1.00 0.00 H new ATOM 0 HB2 LYS A 73 1.926 -17.884 13.289 1.00 0.00 H new ATOM 0 HB3 LYS A 73 1.448 -16.454 12.396 1.00 0.00 H new ATOM 0 HG2 LYS A 73 2.336 -18.649 10.644 1.00 0.00 H new ATOM 0 HG3 LYS A 73 0.972 -19.091 11.651 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -0.155 -16.922 10.898 1.00 0.00 H new ATOM 0 HD3 LYS A 73 1.149 -16.729 9.743 1.00 0.00 H new ATOM 0 HE2 LYS A 73 0.432 -19.308 9.205 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -1.109 -18.681 9.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.853 -18.413 7.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.931 -16.891 8.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.562 -17.499 7.592 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 -7.945 -23.604 4.377 1.00 0.00 N ATOM 1254 CA MET B 1 -8.297 -22.615 3.325 1.00 0.00 C ATOM 1255 C MET B 1 -7.399 -22.766 2.102 1.00 0.00 C ATOM 1256 O MET B 1 -7.814 -22.472 0.982 1.00 0.00 O ATOM 1257 CB MET B 1 -8.155 -21.208 3.913 1.00 0.00 C ATOM 1258 CG MET B 1 -8.437 -20.096 2.914 1.00 0.00 C ATOM 1259 SD MET B 1 -10.199 -19.752 2.735 1.00 0.00 S ATOM 1260 CE MET B 1 -10.670 -21.008 1.549 1.00 0.00 C ATOM 0 H1 MET B 1 -8.689 -23.618 5.103 1.00 0.00 H new ATOM 0 H2 MET B 1 -7.860 -24.549 3.951 1.00 0.00 H new ATOM 0 H3 MET B 1 -7.039 -23.338 4.814 1.00 0.00 H new ATOM 0 HA MET B 1 -9.323 -22.787 3.001 1.00 0.00 H new ATOM 0 HB2 MET B 1 -8.836 -21.107 4.758 1.00 0.00 H new ATOM 0 HB3 MET B 1 -7.144 -21.087 4.302 1.00 0.00 H new ATOM 0 HG2 MET B 1 -7.924 -19.188 3.232 1.00 0.00 H new ATOM 0 HG3 MET B 1 -8.024 -20.372 1.944 1.00 0.00 H new ATOM 0 HE1 MET B 1 -11.491 -20.639 0.935 1.00 0.00 H new ATOM 0 HE2 MET B 1 -9.818 -21.244 0.911 1.00 0.00 H new ATOM 0 HE3 MET B 1 -10.988 -21.907 2.078 1.00 0.00 H new ATOM 1272 N VAL B 2 -6.166 -23.218 2.331 1.00 0.00 N ATOM 1273 CA VAL B 2 -5.194 -23.406 1.255 1.00 0.00 C ATOM 1274 C VAL B 2 -5.052 -22.141 0.404 1.00 0.00 C ATOM 1275 O VAL B 2 -5.832 -21.200 0.541 1.00 0.00 O ATOM 1276 CB VAL B 2 -5.564 -24.619 0.361 1.00 0.00 C ATOM 1277 CG1 VAL B 2 -6.726 -24.304 -0.573 1.00 0.00 C ATOM 1278 CG2 VAL B 2 -4.353 -25.090 -0.431 1.00 0.00 C ATOM 0 H VAL B 2 -5.816 -23.462 3.257 1.00 0.00 H new ATOM 0 HA VAL B 2 -4.232 -23.611 1.725 1.00 0.00 H new ATOM 0 HB VAL B 2 -5.886 -25.424 1.022 1.00 0.00 H new ATOM 0 HG11 VAL B 2 -6.952 -25.180 -1.181 1.00 0.00 H new ATOM 0 HG12 VAL B 2 -7.603 -24.034 0.015 1.00 0.00 H new ATOM 0 HG13 VAL B 2 -6.455 -23.472 -1.223 1.00 0.00 H new ATOM 0 HG21 VAL B 2 -4.633 -25.941 -1.052 1.00 0.00 H new ATOM 0 HG22 VAL B 2 -3.996 -24.279 -1.066 1.00 0.00 H new ATOM 0 HG23 VAL B 2 -3.561 -25.387 0.257 1.00 0.00 H new ATOM 1288 N GLU B 3 -4.048 -22.120 -0.467 1.00 0.00 N ATOM 1289 CA GLU B 3 -3.808 -20.965 -1.328 1.00 0.00 C ATOM 1290 C GLU B 3 -5.097 -20.505 -2.006 1.00 0.00 C ATOM 1291 O GLU B 3 -5.912 -21.324 -2.431 1.00 0.00 O ATOM 1292 CB GLU B 3 -2.756 -21.301 -2.386 1.00 0.00 C ATOM 1293 CG GLU B 3 -2.239 -20.085 -3.137 1.00 0.00 C ATOM 1294 CD GLU B 3 -1.992 -20.368 -4.605 1.00 0.00 C ATOM 1295 OE1 GLU B 3 -2.568 -19.654 -5.453 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -1.221 -21.303 -4.908 1.00 0.00 O ATOM 0 H GLU B 3 -3.388 -22.887 -0.596 1.00 0.00 H new ATOM 0 HA GLU B 3 -3.441 -20.152 -0.702 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -1.917 -21.805 -1.905 1.00 0.00 H new ATOM 0 HB3 GLU B 3 -3.183 -22.005 -3.101 1.00 0.00 H new ATOM 0 HG2 GLU B 3 -2.959 -19.272 -3.044 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -1.312 -19.745 -2.675 1.00 0.00 H new ATOM 1303 N SER B 4 -5.270 -19.188 -2.097 1.00 0.00 N ATOM 1304 CA SER B 4 -6.456 -18.594 -2.720 1.00 0.00 C ATOM 1305 C SER B 4 -7.633 -18.574 -1.751 1.00 0.00 C ATOM 1306 O SER B 4 -7.684 -19.357 -0.802 1.00 0.00 O ATOM 1307 CB SER B 4 -6.837 -19.346 -4.002 1.00 0.00 C ATOM 1308 OG SER B 4 -7.778 -20.373 -3.737 1.00 0.00 O ATOM 0 H SER B 4 -4.599 -18.505 -1.745 1.00 0.00 H new ATOM 0 HA SER B 4 -6.210 -17.565 -2.983 1.00 0.00 H new ATOM 0 HB2 SER B 4 -7.254 -18.646 -4.726 1.00 0.00 H new ATOM 0 HB3 SER B 4 -5.943 -19.777 -4.453 1.00 0.00 H new ATOM 0 HG SER B 4 -7.319 -21.144 -3.344 1.00 0.00 H new ATOM 1314 N LYS B 5 -8.577 -17.670 -1.999 1.00 0.00 N ATOM 1315 CA LYS B 5 -9.763 -17.534 -1.155 1.00 0.00 C ATOM 1316 C LYS B 5 -9.420 -16.902 0.194 1.00 0.00 C ATOM 1317 O LYS B 5 -10.265 -16.838 1.087 1.00 0.00 O ATOM 1318 CB LYS B 5 -10.428 -18.896 -0.938 1.00 0.00 C ATOM 1319 CG LYS B 5 -10.567 -19.715 -2.212 1.00 0.00 C ATOM 1320 CD LYS B 5 -11.946 -20.347 -2.322 1.00 0.00 C ATOM 1321 CE LYS B 5 -11.933 -21.796 -1.862 1.00 0.00 C ATOM 1322 NZ LYS B 5 -11.897 -22.742 -3.010 1.00 0.00 N ATOM 0 H LYS B 5 -8.544 -17.017 -2.782 1.00 0.00 H new ATOM 0 HA LYS B 5 -10.460 -16.875 -1.673 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -9.846 -19.464 -0.213 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -11.416 -18.744 -0.504 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -10.388 -19.077 -3.077 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -9.806 -20.495 -2.229 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -12.656 -19.780 -1.721 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -12.290 -20.295 -3.355 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -11.066 -21.967 -1.224 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -12.818 -21.993 -1.257 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -11.889 -23.719 -2.654 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -12.737 -22.597 -3.606 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -11.040 -22.572 -3.573 1.00 0.00 H new ATOM 1336 N LYS B 6 -8.182 -16.430 0.339 1.00 0.00 N ATOM 1337 CA LYS B 6 -7.742 -15.802 1.580 1.00 0.00 C ATOM 1338 C LYS B 6 -6.286 -15.359 1.483 1.00 0.00 C ATOM 1339 O LYS B 6 -5.989 -14.164 1.489 1.00 0.00 O ATOM 1340 CB LYS B 6 -7.913 -16.764 2.759 1.00 0.00 C ATOM 1341 CG LYS B 6 -8.197 -16.064 4.077 1.00 0.00 C ATOM 1342 CD LYS B 6 -9.233 -16.817 4.897 1.00 0.00 C ATOM 1343 CE LYS B 6 -8.596 -17.930 5.712 1.00 0.00 C ATOM 1344 NZ LYS B 6 -9.605 -18.914 6.191 1.00 0.00 N ATOM 0 H LYS B 6 -7.468 -16.472 -0.388 1.00 0.00 H new ATOM 0 HA LYS B 6 -8.363 -14.921 1.745 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -8.729 -17.453 2.540 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -7.008 -17.363 2.863 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -7.273 -15.975 4.649 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -8.551 -15.051 3.883 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -9.745 -16.123 5.564 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -9.989 -17.237 4.233 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -7.849 -18.442 5.106 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -8.073 -17.501 6.567 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -9.144 -19.609 6.812 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -10.350 -18.417 6.720 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -10.026 -19.404 5.376 1.00 0.00 H new ATOM 1358 N ILE B 7 -5.383 -16.329 1.395 1.00 0.00 N ATOM 1359 CA ILE B 7 -3.957 -16.040 1.299 1.00 0.00 C ATOM 1360 C ILE B 7 -3.459 -16.197 -0.134 1.00 0.00 C ATOM 1361 O ILE B 7 -2.966 -17.258 -0.519 1.00 0.00 O ATOM 1362 CB ILE B 7 -3.133 -16.961 2.219 1.00 0.00 C ATOM 1363 CG1 ILE B 7 -3.718 -16.966 3.635 1.00 0.00 C ATOM 1364 CG2 ILE B 7 -1.676 -16.521 2.244 1.00 0.00 C ATOM 1365 CD1 ILE B 7 -3.822 -18.349 4.240 1.00 0.00 C ATOM 0 H ILE B 7 -5.613 -17.323 1.388 1.00 0.00 H new ATOM 0 HA ILE B 7 -3.823 -15.006 1.617 1.00 0.00 H new ATOM 0 HB ILE B 7 -3.180 -17.976 1.824 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -3.097 -16.342 4.278 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -4.709 -16.513 3.612 1.00 0.00 H new ATOM 0 HG21 ILE B 7 -1.108 -17.182 2.898 1.00 0.00 H new ATOM 0 HG22 ILE B 7 -1.265 -16.567 1.236 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -1.611 -15.498 2.616 1.00 0.00 H new ATOM 0 HD11 ILE B 7 -4.244 -18.277 5.242 1.00 0.00 H new ATOM 0 HD12 ILE B 7 -4.467 -18.970 3.619 1.00 0.00 H new ATOM 0 HD13 ILE B 7 -2.830 -18.797 4.295 1.00 0.00 H new ATOM 1377 N ALA B 8 -3.591 -15.134 -0.921 1.00 0.00 N ATOM 1378 CA ALA B 8 -3.152 -15.156 -2.310 1.00 0.00 C ATOM 1379 C ALA B 8 -3.021 -13.744 -2.868 1.00 0.00 C ATOM 1380 O ALA B 8 -3.916 -12.915 -2.709 1.00 0.00 O ATOM 1381 CB ALA B 8 -4.116 -15.970 -3.159 1.00 0.00 C ATOM 0 H ALA B 8 -3.998 -14.248 -0.620 1.00 0.00 H new ATOM 0 HA ALA B 8 -2.169 -15.626 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -3.773 -15.976 -4.194 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -4.157 -16.993 -2.784 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -5.110 -15.525 -3.109 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.898 -13.480 -3.527 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.644 -12.170 -4.113 1.00 0.00 C ATOM 1389 C LYS B 9 -2.477 -11.976 -5.373 1.00 0.00 C ATOM 1390 O LYS B 9 -2.795 -12.936 -6.074 1.00 0.00 O ATOM 1391 CB LYS B 9 -0.157 -12.023 -4.440 1.00 0.00 C ATOM 1392 CG LYS B 9 0.592 -11.134 -3.464 1.00 0.00 C ATOM 1393 CD LYS B 9 1.537 -11.936 -2.583 1.00 0.00 C ATOM 1394 CE LYS B 9 0.775 -12.863 -1.650 1.00 0.00 C ATOM 1395 NZ LYS B 9 1.690 -13.757 -0.887 1.00 0.00 N ATOM 0 H LYS B 9 -1.148 -14.157 -3.669 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.928 -11.406 -3.390 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.305 -13.010 -4.448 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -0.053 -11.614 -5.445 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.158 -10.384 -4.016 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -0.122 -10.598 -2.838 1.00 0.00 H new ATOM 0 HD2 LYS B 9 2.211 -12.521 -3.209 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.155 -11.256 -1.997 1.00 0.00 H new ATOM 0 HE2 LYS B 9 0.182 -12.270 -0.953 1.00 0.00 H new ATOM 0 HE3 LYS B 9 0.076 -13.467 -2.229 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 1.132 -14.373 -0.262 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 2.238 -14.341 -1.551 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 2.340 -13.181 -0.315 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.838 -10.731 -5.643 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.651 -10.408 -6.811 1.00 0.00 C ATOM 1411 C LYS B 10 -2.992 -9.320 -7.656 1.00 0.00 C ATOM 1412 O LYS B 10 -2.385 -8.399 -7.123 1.00 0.00 O ATOM 1413 CB LYS B 10 -5.023 -9.929 -6.348 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.901 -11.025 -5.764 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.679 -10.526 -4.552 1.00 0.00 C ATOM 1416 CE LYS B 10 -8.101 -11.061 -4.545 1.00 0.00 C ATOM 1417 NZ LYS B 10 -8.959 -10.377 -5.552 1.00 0.00 N ATOM 0 H LYS B 10 -2.582 -9.926 -5.071 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.750 -11.304 -7.424 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.889 -9.148 -5.599 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.541 -9.475 -7.193 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.597 -11.380 -6.524 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.282 -11.875 -5.477 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -6.169 -10.833 -3.639 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.699 -9.436 -4.555 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.087 -12.132 -4.748 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.533 -10.931 -3.553 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.936 -10.723 -5.468 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -8.940 -9.351 -5.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.601 -10.579 -6.507 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.124 -9.407 -8.975 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.537 -8.388 -9.837 1.00 0.00 C ATOM 1433 C LYS B 11 -3.265 -7.067 -9.631 1.00 0.00 C ATOM 1434 O LYS B 11 -4.408 -6.902 -10.056 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.603 -8.801 -11.309 1.00 0.00 C ATOM 1436 CG LYS B 11 -2.148 -10.228 -11.565 1.00 0.00 C ATOM 1437 CD LYS B 11 -0.663 -10.293 -11.880 1.00 0.00 C ATOM 1438 CE LYS B 11 -0.040 -11.581 -11.366 1.00 0.00 C ATOM 1439 NZ LYS B 11 1.448 -11.516 -11.359 1.00 0.00 N ATOM 0 H LYS B 11 -3.620 -10.154 -9.462 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.487 -8.273 -9.569 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.627 -8.687 -11.663 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.985 -8.121 -11.896 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.362 -10.841 -10.690 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -2.716 -10.648 -12.395 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -0.515 -10.221 -12.958 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.157 -9.438 -11.431 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -0.399 -11.780 -10.356 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -0.364 -12.414 -11.989 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 1.827 -12.159 -12.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 1.754 -10.544 -11.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 1.803 -11.800 -10.424 1.00 0.00 H new ATOM 1453 N THR B 12 -2.597 -6.132 -8.966 1.00 0.00 N ATOM 1454 CA THR B 12 -3.180 -4.828 -8.688 1.00 0.00 C ATOM 1455 C THR B 12 -2.589 -3.762 -9.599 1.00 0.00 C ATOM 1456 O THR B 12 -1.424 -3.844 -9.983 1.00 0.00 O ATOM 1457 CB THR B 12 -2.956 -4.445 -7.225 1.00 0.00 C ATOM 1458 OG1 THR B 12 -2.713 -5.596 -6.436 1.00 0.00 O ATOM 1459 CG2 THR B 12 -4.128 -3.709 -6.611 1.00 0.00 C ATOM 0 H THR B 12 -1.649 -6.254 -8.609 1.00 0.00 H new ATOM 0 HA THR B 12 -4.251 -4.891 -8.879 1.00 0.00 H new ATOM 0 HB THR B 12 -2.092 -3.780 -7.231 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.455 -5.725 -5.809 1.00 0.00 H new ATOM 0 HG21 THR B 12 -3.902 -3.467 -5.572 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.311 -2.789 -7.166 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.016 -4.340 -6.652 1.00 0.00 H new ATOM 1467 N THR B 13 -3.393 -2.762 -9.947 1.00 0.00 N ATOM 1468 CA THR B 13 -2.926 -1.689 -10.817 1.00 0.00 C ATOM 1469 C THR B 13 -3.070 -0.322 -10.162 1.00 0.00 C ATOM 1470 O THR B 13 -4.029 -0.058 -9.438 1.00 0.00 O ATOM 1471 CB THR B 13 -3.688 -1.692 -12.142 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.160 -2.991 -12.455 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.851 -1.207 -13.304 1.00 0.00 C ATOM 0 H THR B 13 -4.363 -2.672 -9.643 1.00 0.00 H new ATOM 0 HA THR B 13 -1.868 -1.874 -11.002 1.00 0.00 H new ATOM 0 HB THR B 13 -4.521 -1.004 -12.000 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.645 -2.966 -13.306 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.446 -1.232 -14.217 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.521 -0.186 -13.114 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.981 -1.853 -13.421 1.00 0.00 H new ATOM 1481 N LEU B 14 -2.113 0.549 -10.456 1.00 0.00 N ATOM 1482 CA LEU B 14 -2.114 1.910 -9.940 1.00 0.00 C ATOM 1483 C LEU B 14 -1.721 2.862 -11.055 1.00 0.00 C ATOM 1484 O LEU B 14 -0.722 2.643 -11.736 1.00 0.00 O ATOM 1485 CB LEU B 14 -1.140 2.066 -8.770 1.00 0.00 C ATOM 1486 CG LEU B 14 -0.923 0.821 -7.911 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.504 0.793 -7.392 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -1.913 0.783 -6.756 1.00 0.00 C ATOM 0 H LEU B 14 -1.318 0.332 -11.057 1.00 0.00 H new ATOM 0 HA LEU B 14 -3.116 2.140 -9.577 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.175 2.383 -9.166 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.501 2.869 -8.127 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.091 -0.062 -8.528 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.651 -0.097 -6.781 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.197 0.774 -8.233 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.689 1.682 -6.789 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.740 -0.112 -6.158 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.779 1.667 -6.133 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -2.930 0.766 -7.149 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.503 3.910 -11.256 1.00 0.00 N ATOM 1501 CA ALA B 15 -2.205 4.859 -12.315 1.00 0.00 C ATOM 1502 C ALA B 15 -1.248 5.941 -11.835 1.00 0.00 C ATOM 1503 O ALA B 15 -1.666 7.017 -11.407 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.488 5.475 -12.852 1.00 0.00 C ATOM 0 H ALA B 15 -3.337 4.123 -10.709 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.714 4.318 -13.124 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -3.247 6.184 -13.645 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -4.130 4.689 -13.250 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -4.007 5.994 -12.046 1.00 0.00 H new ATOM 1510 N PHE B 16 0.039 5.632 -11.933 1.00 0.00 N ATOM 1511 CA PHE B 16 1.115 6.533 -11.537 1.00 0.00 C ATOM 1512 C PHE B 16 2.427 5.966 -12.022 1.00 0.00 C ATOM 1513 O PHE B 16 2.473 4.865 -12.553 1.00 0.00 O ATOM 1514 CB PHE B 16 1.183 6.725 -10.017 1.00 0.00 C ATOM 1515 CG PHE B 16 -0.054 7.324 -9.412 1.00 0.00 C ATOM 1516 CD1 PHE B 16 -1.014 6.515 -8.826 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.255 8.694 -9.426 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -2.153 7.062 -8.266 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.392 9.248 -8.868 1.00 0.00 C ATOM 1520 CZ PHE B 16 -2.342 8.429 -8.286 1.00 0.00 C ATOM 0 H PHE B 16 0.369 4.737 -12.294 1.00 0.00 H new ATOM 0 HA PHE B 16 0.918 7.507 -11.984 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.370 5.759 -9.549 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.034 7.364 -9.781 1.00 0.00 H new ATOM 0 HD1 PHE B 16 -0.871 5.445 -8.807 1.00 0.00 H new ATOM 0 HD2 PHE B 16 0.485 9.337 -9.878 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -2.894 6.420 -7.813 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -1.538 10.318 -8.887 1.00 0.00 H new ATOM 0 HZ PHE B 16 -3.231 8.858 -7.848 1.00 0.00 H new ATOM 1530 N ASP B 17 3.485 6.720 -11.852 1.00 0.00 N ATOM 1531 CA ASP B 17 4.803 6.292 -12.280 1.00 0.00 C ATOM 1532 C ASP B 17 5.703 7.484 -12.387 1.00 0.00 C ATOM 1533 O ASP B 17 6.884 7.421 -12.072 1.00 0.00 O ATOM 1534 CB ASP B 17 4.752 5.571 -13.626 1.00 0.00 C ATOM 1535 CG ASP B 17 4.893 4.066 -13.489 1.00 0.00 C ATOM 1536 OD1 ASP B 17 4.974 3.382 -14.530 1.00 0.00 O ATOM 1537 OD2 ASP B 17 4.924 3.573 -12.341 1.00 0.00 O ATOM 0 H ASP B 17 3.463 7.642 -11.417 1.00 0.00 H new ATOM 0 HA ASP B 17 5.188 5.593 -11.538 1.00 0.00 H new ATOM 0 HB2 ASP B 17 3.808 5.800 -14.121 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.548 5.950 -14.267 1.00 0.00 H new ATOM 1542 N GLU B 18 5.143 8.590 -12.826 1.00 0.00 N ATOM 1543 CA GLU B 18 5.938 9.786 -12.956 1.00 0.00 C ATOM 1544 C GLU B 18 6.758 10.005 -11.682 1.00 0.00 C ATOM 1545 O GLU B 18 7.994 9.998 -11.708 1.00 0.00 O ATOM 1546 CB GLU B 18 5.060 11.002 -13.262 1.00 0.00 C ATOM 1547 CG GLU B 18 3.900 11.192 -12.296 1.00 0.00 C ATOM 1548 CD GLU B 18 2.807 12.077 -12.862 1.00 0.00 C ATOM 1549 OE1 GLU B 18 1.618 11.742 -12.681 1.00 0.00 O ATOM 1550 OE2 GLU B 18 3.141 13.106 -13.487 1.00 0.00 O ATOM 0 H GLU B 18 4.163 8.684 -13.093 1.00 0.00 H new ATOM 0 HA GLU B 18 6.622 9.661 -13.795 1.00 0.00 H new ATOM 0 HB2 GLU B 18 5.681 11.898 -13.247 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.664 10.905 -14.273 1.00 0.00 H new ATOM 0 HG2 GLU B 18 3.479 10.219 -12.044 1.00 0.00 H new ATOM 0 HG3 GLU B 18 4.272 11.629 -11.369 1.00 0.00 H new ATOM 1557 N ASP B 19 6.063 10.153 -10.557 1.00 0.00 N ATOM 1558 CA ASP B 19 6.728 10.347 -9.277 1.00 0.00 C ATOM 1559 C ASP B 19 7.101 9.019 -8.639 1.00 0.00 C ATOM 1560 O ASP B 19 8.245 8.821 -8.230 1.00 0.00 O ATOM 1561 CB ASP B 19 5.840 11.156 -8.330 1.00 0.00 C ATOM 1562 CG ASP B 19 6.607 12.242 -7.602 1.00 0.00 C ATOM 1563 OD1 ASP B 19 6.828 12.096 -6.381 1.00 0.00 O ATOM 1564 OD2 ASP B 19 6.988 13.238 -8.252 1.00 0.00 O ATOM 0 H ASP B 19 5.044 10.142 -10.508 1.00 0.00 H new ATOM 0 HA ASP B 19 7.648 10.902 -9.462 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.026 11.608 -8.897 1.00 0.00 H new ATOM 0 HB3 ASP B 19 5.386 10.485 -7.601 1.00 0.00 H new ATOM 1569 N VAL B 20 6.139 8.108 -8.546 1.00 0.00 N ATOM 1570 CA VAL B 20 6.403 6.811 -7.947 1.00 0.00 C ATOM 1571 C VAL B 20 7.505 6.079 -8.708 1.00 0.00 C ATOM 1572 O VAL B 20 8.436 5.565 -8.100 1.00 0.00 O ATOM 1573 CB VAL B 20 5.134 5.935 -7.862 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.019 6.687 -7.158 1.00 0.00 C ATOM 1575 CG2 VAL B 20 4.682 5.486 -9.236 1.00 0.00 C ATOM 0 H VAL B 20 5.183 8.243 -8.874 1.00 0.00 H new ATOM 0 HA VAL B 20 6.739 6.995 -6.926 1.00 0.00 H new ATOM 0 HB VAL B 20 5.379 5.045 -7.283 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.131 6.057 -7.106 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.338 6.949 -6.149 1.00 0.00 H new ATOM 0 HG13 VAL B 20 3.786 7.596 -7.713 1.00 0.00 H new ATOM 0 HG21 VAL B 20 3.787 4.871 -9.142 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.460 6.359 -9.849 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.474 4.904 -9.707 1.00 0.00 H new ATOM 1585 N TYR B 21 7.419 6.050 -10.040 1.00 0.00 N ATOM 1586 CA TYR B 21 8.449 5.385 -10.837 1.00 0.00 C ATOM 1587 C TYR B 21 9.793 6.074 -10.641 1.00 0.00 C ATOM 1588 O TYR B 21 10.805 5.407 -10.427 1.00 0.00 O ATOM 1589 CB TYR B 21 8.088 5.341 -12.329 1.00 0.00 C ATOM 1590 CG TYR B 21 8.745 4.203 -13.079 1.00 0.00 C ATOM 1591 CD1 TYR B 21 8.834 2.934 -12.520 1.00 0.00 C ATOM 1592 CD2 TYR B 21 9.279 4.400 -14.347 1.00 0.00 C ATOM 1593 CE1 TYR B 21 9.437 1.895 -13.204 1.00 0.00 C ATOM 1594 CE2 TYR B 21 9.882 3.366 -15.036 1.00 0.00 C ATOM 1595 CZ TYR B 21 9.958 2.116 -14.461 1.00 0.00 C ATOM 1596 OH TYR B 21 10.559 1.083 -15.145 1.00 0.00 O ATOM 0 H TYR B 21 6.662 6.470 -10.580 1.00 0.00 H new ATOM 0 HA TYR B 21 8.516 4.355 -10.488 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.006 5.255 -12.430 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.377 6.285 -12.792 1.00 0.00 H new ATOM 0 HD1 TYR B 21 8.426 2.757 -11.536 1.00 0.00 H new ATOM 0 HD2 TYR B 21 9.221 5.378 -14.801 1.00 0.00 H new ATOM 0 HE1 TYR B 21 9.500 0.914 -12.756 1.00 0.00 H new ATOM 0 HE2 TYR B 21 10.292 3.536 -16.021 1.00 0.00 H new ATOM 0 HH TYR B 21 10.872 1.406 -16.016 1.00 0.00 H new ATOM 1606 N HIS B 22 9.814 7.411 -10.697 1.00 0.00 N ATOM 1607 CA HIS B 22 11.066 8.131 -10.500 1.00 0.00 C ATOM 1608 C HIS B 22 11.585 7.895 -9.089 1.00 0.00 C ATOM 1609 O HIS B 22 12.743 7.526 -8.901 1.00 0.00 O ATOM 1610 CB HIS B 22 10.879 9.627 -10.759 1.00 0.00 C ATOM 1611 CG HIS B 22 11.085 10.018 -12.189 1.00 0.00 C ATOM 1612 ND1 HIS B 22 10.314 9.526 -13.222 1.00 0.00 N ATOM 1613 CD2 HIS B 22 11.979 10.860 -12.758 1.00 0.00 C ATOM 1614 CE1 HIS B 22 10.727 10.046 -14.364 1.00 0.00 C ATOM 1615 NE2 HIS B 22 11.736 10.860 -14.109 1.00 0.00 N ATOM 0 H HIS B 22 8.999 7.999 -10.873 1.00 0.00 H new ATOM 0 HA HIS B 22 11.799 7.754 -11.213 1.00 0.00 H new ATOM 0 HB2 HIS B 22 9.874 9.917 -10.453 1.00 0.00 H new ATOM 0 HB3 HIS B 22 11.576 10.185 -10.134 1.00 0.00 H new ATOM 0 HD2 HIS B 22 12.742 11.427 -12.245 1.00 0.00 H new ATOM 0 HE1 HIS B 22 10.311 9.841 -15.339 1.00 0.00 H new ATOM 0 HE2 HIS B 22 12.251 11.401 -14.804 1.00 0.00 H new ATOM 1624 N THR B 23 10.721 8.084 -8.095 1.00 0.00 N ATOM 1625 CA THR B 23 11.117 7.858 -6.712 1.00 0.00 C ATOM 1626 C THR B 23 11.524 6.402 -6.529 1.00 0.00 C ATOM 1627 O THR B 23 12.487 6.097 -5.829 1.00 0.00 O ATOM 1628 CB THR B 23 9.988 8.209 -5.750 1.00 0.00 C ATOM 1629 OG1 THR B 23 8.890 7.330 -5.919 1.00 0.00 O ATOM 1630 CG2 THR B 23 9.476 9.624 -5.914 1.00 0.00 C ATOM 0 H THR B 23 9.756 8.389 -8.220 1.00 0.00 H new ATOM 0 HA THR B 23 11.964 8.506 -6.487 1.00 0.00 H new ATOM 0 HB THR B 23 10.420 8.112 -4.754 1.00 0.00 H new ATOM 0 HG1 THR B 23 8.122 7.665 -5.411 1.00 0.00 H new ATOM 0 HG21 THR B 23 8.674 9.806 -5.199 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.289 10.328 -5.735 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.096 9.758 -6.927 1.00 0.00 H new ATOM 1638 N LEU B 24 10.800 5.506 -7.196 1.00 0.00 N ATOM 1639 CA LEU B 24 11.109 4.083 -7.137 1.00 0.00 C ATOM 1640 C LEU B 24 12.535 3.847 -7.617 1.00 0.00 C ATOM 1641 O LEU B 24 13.132 2.806 -7.344 1.00 0.00 O ATOM 1642 CB LEU B 24 10.125 3.276 -7.993 1.00 0.00 C ATOM 1643 CG LEU B 24 9.064 2.503 -7.204 1.00 0.00 C ATOM 1644 CD1 LEU B 24 9.710 1.701 -6.090 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.019 3.449 -6.633 1.00 0.00 C ATOM 0 H LEU B 24 9.998 5.741 -7.781 1.00 0.00 H new ATOM 0 HA LEU B 24 11.015 3.749 -6.104 1.00 0.00 H new ATOM 0 HB2 LEU B 24 9.621 3.956 -8.680 1.00 0.00 H new ATOM 0 HB3 LEU B 24 10.690 2.570 -8.601 1.00 0.00 H new ATOM 0 HG LEU B 24 8.568 1.815 -7.888 1.00 0.00 H new ATOM 0 HD11 LEU B 24 8.942 1.158 -5.540 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.420 0.992 -6.516 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.233 2.376 -5.412 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.276 2.877 -6.077 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.501 4.164 -5.966 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.530 3.985 -7.447 1.00 0.00 H new ATOM 1657 N LYS B 25 13.078 4.828 -8.338 1.00 0.00 N ATOM 1658 CA LYS B 25 14.428 4.730 -8.855 1.00 0.00 C ATOM 1659 C LYS B 25 15.457 4.766 -7.732 1.00 0.00 C ATOM 1660 O LYS B 25 16.354 3.924 -7.682 1.00 0.00 O ATOM 1661 CB LYS B 25 14.708 5.852 -9.856 1.00 0.00 C ATOM 1662 CG LYS B 25 16.007 5.667 -10.623 1.00 0.00 C ATOM 1663 CD LYS B 25 17.147 6.437 -9.981 1.00 0.00 C ATOM 1664 CE LYS B 25 18.499 5.952 -10.481 1.00 0.00 C ATOM 1665 NZ LYS B 25 18.921 6.666 -11.717 1.00 0.00 N ATOM 0 H LYS B 25 12.598 5.696 -8.573 1.00 0.00 H new ATOM 0 HA LYS B 25 14.513 3.771 -9.366 1.00 0.00 H new ATOM 0 HB2 LYS B 25 13.882 5.911 -10.564 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.741 6.803 -9.325 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.259 4.607 -10.663 1.00 0.00 H new ATOM 0 HG3 LYS B 25 15.874 6.002 -11.652 1.00 0.00 H new ATOM 0 HD2 LYS B 25 17.037 7.500 -10.198 1.00 0.00 H new ATOM 0 HD3 LYS B 25 17.098 6.326 -8.898 1.00 0.00 H new ATOM 0 HE2 LYS B 25 19.248 6.099 -9.703 1.00 0.00 H new ATOM 0 HE3 LYS B 25 18.450 4.881 -10.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 19.847 6.307 -12.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 18.219 6.505 -12.468 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 18.992 7.685 -11.522 1.00 0.00 H new ATOM 1679 N LEU B 26 15.334 5.738 -6.830 1.00 0.00 N ATOM 1680 CA LEU B 26 16.280 5.838 -5.725 1.00 0.00 C ATOM 1681 C LEU B 26 16.115 4.656 -4.777 1.00 0.00 C ATOM 1682 O LEU B 26 17.094 4.044 -4.368 1.00 0.00 O ATOM 1683 CB LEU B 26 16.159 7.172 -4.980 1.00 0.00 C ATOM 1684 CG LEU B 26 14.739 7.642 -4.697 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.181 6.918 -3.488 1.00 0.00 C ATOM 1686 CD2 LEU B 26 14.708 9.150 -4.487 1.00 0.00 C ATOM 0 H LEU B 26 14.605 6.452 -6.842 1.00 0.00 H new ATOM 0 HA LEU B 26 17.285 5.806 -6.146 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.690 7.087 -4.032 1.00 0.00 H new ATOM 0 HB3 LEU B 26 16.667 7.940 -5.563 1.00 0.00 H new ATOM 0 HG LEU B 26 14.114 7.408 -5.558 1.00 0.00 H new ATOM 0 HD11 LEU B 26 13.165 7.262 -3.295 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.171 5.845 -3.679 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.806 7.126 -2.619 1.00 0.00 H new ATOM 0 HD21 LEU B 26 13.685 9.468 -4.286 1.00 0.00 H new ATOM 0 HD22 LEU B 26 15.343 9.413 -3.641 1.00 0.00 H new ATOM 0 HD23 LEU B 26 15.074 9.650 -5.384 1.00 0.00 H new ATOM 1698 N VAL B 27 14.871 4.323 -4.457 1.00 0.00 N ATOM 1699 CA VAL B 27 14.580 3.189 -3.577 1.00 0.00 C ATOM 1700 C VAL B 27 15.066 1.893 -4.186 1.00 0.00 C ATOM 1701 O VAL B 27 15.626 1.047 -3.495 1.00 0.00 O ATOM 1702 CB VAL B 27 13.076 3.034 -3.285 1.00 0.00 C ATOM 1703 CG1 VAL B 27 12.745 3.496 -1.883 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.258 3.777 -4.291 1.00 0.00 C ATOM 0 H VAL B 27 14.045 4.819 -4.791 1.00 0.00 H new ATOM 0 HA VAL B 27 15.103 3.399 -2.644 1.00 0.00 H new ATOM 0 HB VAL B 27 12.829 1.975 -3.360 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.677 3.376 -1.703 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.304 2.900 -1.162 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.016 4.546 -1.773 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.199 3.652 -4.063 1.00 0.00 H new ATOM 0 HG22 VAL B 27 12.514 4.836 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.463 3.386 -5.287 1.00 0.00 H new ATOM 1714 N SER B 28 14.830 1.718 -5.475 1.00 0.00 N ATOM 1715 CA SER B 28 15.239 0.492 -6.123 1.00 0.00 C ATOM 1716 C SER B 28 16.753 0.340 -6.100 1.00 0.00 C ATOM 1717 O SER B 28 17.275 -0.760 -5.903 1.00 0.00 O ATOM 1718 CB SER B 28 14.714 0.431 -7.558 1.00 0.00 C ATOM 1719 OG SER B 28 15.251 -0.684 -8.251 1.00 0.00 O ATOM 0 H SER B 28 14.367 2.396 -6.080 1.00 0.00 H new ATOM 0 HA SER B 28 14.806 -0.339 -5.566 1.00 0.00 H new ATOM 0 HB2 SER B 28 13.626 0.367 -7.548 1.00 0.00 H new ATOM 0 HB3 SER B 28 14.975 1.350 -8.083 1.00 0.00 H new ATOM 0 HG SER B 28 14.880 -1.511 -7.878 1.00 0.00 H new ATOM 1725 N VAL B 29 17.452 1.451 -6.290 1.00 0.00 N ATOM 1726 CA VAL B 29 18.904 1.456 -6.287 1.00 0.00 C ATOM 1727 C VAL B 29 19.433 1.437 -4.859 1.00 0.00 C ATOM 1728 O VAL B 29 20.344 0.679 -4.526 1.00 0.00 O ATOM 1729 CB VAL B 29 19.432 2.700 -7.039 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.202 3.639 -6.123 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.283 2.289 -8.232 1.00 0.00 C ATOM 0 H VAL B 29 17.030 2.366 -6.449 1.00 0.00 H new ATOM 0 HA VAL B 29 19.258 0.560 -6.798 1.00 0.00 H new ATOM 0 HB VAL B 29 18.564 3.248 -7.404 1.00 0.00 H new ATOM 0 HG11 VAL B 29 20.553 4.498 -6.695 1.00 0.00 H new ATOM 0 HG12 VAL B 29 19.549 3.980 -5.320 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.056 3.113 -5.697 1.00 0.00 H new ATOM 0 HG21 VAL B 29 20.644 3.180 -8.746 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.133 1.700 -7.887 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.683 1.692 -8.919 1.00 0.00 H new ATOM 1741 N TYR B 30 18.855 2.291 -4.024 1.00 0.00 N ATOM 1742 CA TYR B 30 19.265 2.395 -2.630 1.00 0.00 C ATOM 1743 C TYR B 30 18.796 1.196 -1.815 1.00 0.00 C ATOM 1744 O TYR B 30 19.391 0.879 -0.785 1.00 0.00 O ATOM 1745 CB TYR B 30 18.733 3.685 -2.000 1.00 0.00 C ATOM 1746 CG TYR B 30 19.642 4.877 -2.199 1.00 0.00 C ATOM 1747 CD1 TYR B 30 19.564 5.653 -3.348 1.00 0.00 C ATOM 1748 CD2 TYR B 30 20.581 5.226 -1.235 1.00 0.00 C ATOM 1749 CE1 TYR B 30 20.394 6.743 -3.532 1.00 0.00 C ATOM 1750 CE2 TYR B 30 21.414 6.314 -1.411 1.00 0.00 C ATOM 1751 CZ TYR B 30 21.317 7.069 -2.561 1.00 0.00 C ATOM 1752 OH TYR B 30 22.145 8.153 -2.740 1.00 0.00 O ATOM 0 H TYR B 30 18.099 2.923 -4.289 1.00 0.00 H new ATOM 0 HA TYR B 30 20.355 2.413 -2.618 1.00 0.00 H new ATOM 0 HB2 TYR B 30 17.755 3.910 -2.425 1.00 0.00 H new ATOM 0 HB3 TYR B 30 18.587 3.524 -0.932 1.00 0.00 H new ATOM 0 HD1 TYR B 30 18.842 5.401 -4.111 1.00 0.00 H new ATOM 0 HD2 TYR B 30 20.661 4.637 -0.333 1.00 0.00 H new ATOM 0 HE1 TYR B 30 20.320 7.336 -4.432 1.00 0.00 H new ATOM 0 HE2 TYR B 30 22.138 6.572 -0.652 1.00 0.00 H new ATOM 0 HH TYR B 30 22.735 8.246 -1.963 1.00 0.00 H new ATOM 1762 N LEU B 31 17.736 0.521 -2.262 1.00 0.00 N ATOM 1763 CA LEU B 31 17.239 -0.636 -1.531 1.00 0.00 C ATOM 1764 C LEU B 31 17.540 -1.927 -2.286 1.00 0.00 C ATOM 1765 O LEU B 31 17.266 -3.020 -1.794 1.00 0.00 O ATOM 1766 CB LEU B 31 15.728 -0.518 -1.268 1.00 0.00 C ATOM 1767 CG LEU B 31 15.210 0.848 -0.767 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.150 0.649 0.306 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.336 1.728 -0.232 1.00 0.00 C ATOM 0 H LEU B 31 17.217 0.752 -3.109 1.00 0.00 H new ATOM 0 HA LEU B 31 17.755 -0.665 -0.571 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.203 -0.762 -2.192 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.451 -1.275 -0.535 1.00 0.00 H new ATOM 0 HG LEU B 31 14.770 1.361 -1.622 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.794 1.620 0.650 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.316 0.082 -0.107 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.580 0.102 1.145 1.00 0.00 H new ATOM 0 HD21 LEU B 31 15.925 2.678 0.109 1.00 0.00 H new ATOM 0 HD22 LEU B 31 16.826 1.225 0.601 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.063 1.911 -1.024 1.00 0.00 H new ATOM 1781 N ASN B 32 18.104 -1.798 -3.490 1.00 0.00 N ATOM 1782 CA ASN B 32 18.430 -2.961 -4.305 1.00 0.00 C ATOM 1783 C ASN B 32 17.197 -3.834 -4.478 1.00 0.00 C ATOM 1784 O ASN B 32 17.284 -5.061 -4.515 1.00 0.00 O ATOM 1785 CB ASN B 32 19.564 -3.766 -3.663 1.00 0.00 C ATOM 1786 CG ASN B 32 20.676 -4.079 -4.644 1.00 0.00 C ATOM 1787 OD1 ASN B 32 20.956 -5.242 -4.933 1.00 0.00 O ATOM 1788 ND2 ASN B 32 21.319 -3.037 -5.162 1.00 0.00 N ATOM 0 H ASN B 32 18.342 -0.902 -3.916 1.00 0.00 H new ATOM 0 HA ASN B 32 18.763 -2.619 -5.285 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.972 -3.206 -2.821 1.00 0.00 H new ATOM 0 HB3 ASN B 32 19.164 -4.697 -3.262 1.00 0.00 H new ATOM 0 HD21 ASN B 32 22.078 -3.185 -5.827 1.00 0.00 H new ATOM 0 HD22 ASN B 32 21.054 -2.089 -4.894 1.00 0.00 H new ATOM 1795 N ARG B 33 16.044 -3.182 -4.568 1.00 0.00 N ATOM 1796 CA ARG B 33 14.777 -3.884 -4.720 1.00 0.00 C ATOM 1797 C ARG B 33 14.054 -3.448 -5.984 1.00 0.00 C ATOM 1798 O ARG B 33 14.425 -2.462 -6.618 1.00 0.00 O ATOM 1799 CB ARG B 33 13.878 -3.615 -3.508 1.00 0.00 C ATOM 1800 CG ARG B 33 14.368 -4.276 -2.231 1.00 0.00 C ATOM 1801 CD ARG B 33 13.701 -3.679 -1.002 1.00 0.00 C ATOM 1802 NE ARG B 33 13.947 -4.477 0.197 1.00 0.00 N ATOM 1803 CZ ARG B 33 15.110 -4.502 0.845 1.00 0.00 C ATOM 1804 NH1 ARG B 33 16.132 -3.772 0.417 1.00 0.00 N ATOM 1805 NH2 ARG B 33 15.251 -5.258 1.926 1.00 0.00 N ATOM 0 H ARG B 33 15.961 -2.166 -4.538 1.00 0.00 H new ATOM 0 HA ARG B 33 14.994 -4.950 -4.792 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.810 -2.539 -3.348 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.871 -3.969 -3.727 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.164 -5.346 -2.273 1.00 0.00 H new ATOM 0 HG3 ARG B 33 15.449 -4.160 -2.152 1.00 0.00 H new ATOM 0 HD2 ARG B 33 14.071 -2.666 -0.845 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.627 -3.603 -1.173 1.00 0.00 H new ATOM 0 HE ARG B 33 13.183 -5.048 0.559 1.00 0.00 H new ATOM 0 HH11 ARG B 33 16.029 -3.188 -0.413 1.00 0.00 H new ATOM 0 HH12 ARG B 33 17.020 -3.795 0.918 1.00 0.00 H new ATOM 0 HH21 ARG B 33 14.469 -5.820 2.261 1.00 0.00 H new ATOM 0 HH22 ARG B 33 16.142 -5.277 2.422 1.00 0.00 H new ATOM 1819 N ASP B 34 12.994 -4.172 -6.320 1.00 0.00 N ATOM 1820 CA ASP B 34 12.187 -3.839 -7.481 1.00 0.00 C ATOM 1821 C ASP B 34 11.128 -2.834 -7.061 1.00 0.00 C ATOM 1822 O ASP B 34 10.827 -2.713 -5.874 1.00 0.00 O ATOM 1823 CB ASP B 34 11.534 -5.093 -8.067 1.00 0.00 C ATOM 1824 CG ASP B 34 12.312 -5.658 -9.239 1.00 0.00 C ATOM 1825 OD1 ASP B 34 12.003 -5.288 -10.391 1.00 0.00 O ATOM 1826 OD2 ASP B 34 13.232 -6.470 -9.005 1.00 0.00 O ATOM 0 H ASP B 34 12.675 -4.992 -5.804 1.00 0.00 H new ATOM 0 HA ASP B 34 12.822 -3.407 -8.255 1.00 0.00 H new ATOM 0 HB2 ASP B 34 11.451 -5.853 -7.290 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.520 -4.854 -8.389 1.00 0.00 H new ATOM 1831 N MET B 35 10.566 -2.107 -8.015 1.00 0.00 N ATOM 1832 CA MET B 35 9.557 -1.122 -7.690 1.00 0.00 C ATOM 1833 C MET B 35 8.374 -1.781 -6.985 1.00 0.00 C ATOM 1834 O MET B 35 7.762 -1.190 -6.098 1.00 0.00 O ATOM 1835 CB MET B 35 9.112 -0.384 -8.958 1.00 0.00 C ATOM 1836 CG MET B 35 7.613 -0.199 -9.064 1.00 0.00 C ATOM 1837 SD MET B 35 7.116 0.685 -10.554 1.00 0.00 S ATOM 1838 CE MET B 35 7.274 -0.606 -11.785 1.00 0.00 C ATOM 0 H MET B 35 10.791 -2.182 -9.007 1.00 0.00 H new ATOM 0 HA MET B 35 9.984 -0.389 -7.005 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.592 0.594 -8.985 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.463 -0.936 -9.830 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.130 -1.176 -9.050 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.257 0.345 -8.189 1.00 0.00 H new ATOM 0 HE1 MET B 35 6.916 -0.238 -12.746 1.00 0.00 H new ATOM 0 HE2 MET B 35 8.321 -0.897 -11.875 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.682 -1.470 -11.484 1.00 0.00 H new ATOM 1848 N THR B 36 8.067 -3.013 -7.378 1.00 0.00 N ATOM 1849 CA THR B 36 6.965 -3.748 -6.772 1.00 0.00 C ATOM 1850 C THR B 36 7.316 -4.138 -5.341 1.00 0.00 C ATOM 1851 O THR B 36 6.462 -4.123 -4.456 1.00 0.00 O ATOM 1852 CB THR B 36 6.633 -5.004 -7.595 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.561 -5.174 -8.652 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.245 -4.997 -8.204 1.00 0.00 C ATOM 0 H THR B 36 8.564 -3.521 -8.110 1.00 0.00 H new ATOM 0 HA THR B 36 6.088 -3.102 -6.758 1.00 0.00 H new ATOM 0 HB THR B 36 6.685 -5.824 -6.879 1.00 0.00 H new ATOM 0 HG1 THR B 36 8.425 -5.456 -8.286 1.00 0.00 H new ATOM 0 HG21 THR B 36 5.090 -5.917 -8.768 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.500 -4.928 -7.411 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.145 -4.141 -8.872 1.00 0.00 H new ATOM 1862 N GLU B 37 8.581 -4.475 -5.117 1.00 0.00 N ATOM 1863 CA GLU B 37 9.041 -4.856 -3.789 1.00 0.00 C ATOM 1864 C GLU B 37 9.106 -3.633 -2.880 1.00 0.00 C ATOM 1865 O GLU B 37 8.780 -3.706 -1.697 1.00 0.00 O ATOM 1866 CB GLU B 37 10.413 -5.527 -3.870 1.00 0.00 C ATOM 1867 CG GLU B 37 10.496 -6.835 -3.100 1.00 0.00 C ATOM 1868 CD GLU B 37 10.963 -6.640 -1.671 1.00 0.00 C ATOM 1869 OE1 GLU B 37 10.423 -5.747 -0.986 1.00 0.00 O ATOM 1870 OE2 GLU B 37 11.868 -7.383 -1.235 1.00 0.00 O ATOM 0 H GLU B 37 9.304 -4.492 -5.836 1.00 0.00 H new ATOM 0 HA GLU B 37 8.330 -5.568 -3.369 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.655 -5.715 -4.916 1.00 0.00 H new ATOM 0 HB3 GLU B 37 11.167 -4.840 -3.486 1.00 0.00 H new ATOM 0 HG2 GLU B 37 9.517 -7.313 -3.096 1.00 0.00 H new ATOM 0 HG3 GLU B 37 11.179 -7.512 -3.613 1.00 0.00 H new ATOM 1877 N ILE B 38 9.522 -2.506 -3.451 1.00 0.00 N ATOM 1878 CA ILE B 38 9.624 -1.259 -2.703 1.00 0.00 C ATOM 1879 C ILE B 38 8.241 -0.664 -2.443 1.00 0.00 C ATOM 1880 O ILE B 38 7.923 -0.279 -1.318 1.00 0.00 O ATOM 1881 CB ILE B 38 10.458 -0.209 -3.466 1.00 0.00 C ATOM 1882 CG1 ILE B 38 11.906 -0.664 -3.664 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.437 1.134 -2.754 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.364 -0.581 -5.103 1.00 0.00 C ATOM 0 H ILE B 38 9.794 -2.432 -4.431 1.00 0.00 H new ATOM 0 HA ILE B 38 10.114 -1.501 -1.760 1.00 0.00 H new ATOM 0 HB ILE B 38 9.997 -0.098 -4.447 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.561 -0.051 -3.045 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.008 -1.692 -3.315 1.00 0.00 H new ATOM 0 HG21 ILE B 38 11.033 1.853 -3.316 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.410 1.492 -2.682 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.853 1.021 -1.753 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.398 -0.917 -5.176 1.00 0.00 H new ATOM 0 HD12 ILE B 38 11.732 -1.216 -5.723 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.293 0.450 -5.449 1.00 0.00 H new ATOM 1896 N ILE B 39 7.424 -0.573 -3.494 1.00 0.00 N ATOM 1897 CA ILE B 39 6.088 -0.001 -3.363 1.00 0.00 C ATOM 1898 C ILE B 39 5.247 -0.809 -2.393 1.00 0.00 C ATOM 1899 O ILE B 39 4.473 -0.256 -1.611 1.00 0.00 O ATOM 1900 CB ILE B 39 5.355 0.060 -4.715 1.00 0.00 C ATOM 1901 CG1 ILE B 39 5.167 -1.349 -5.268 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.117 0.933 -5.698 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.800 -1.931 -4.980 1.00 0.00 C ATOM 0 H ILE B 39 7.663 -0.885 -4.435 1.00 0.00 H new ATOM 0 HA ILE B 39 6.220 1.013 -2.986 1.00 0.00 H new ATOM 0 HB ILE B 39 4.372 0.507 -4.564 1.00 0.00 H new ATOM 0 HG12 ILE B 39 5.327 -1.332 -6.346 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.929 -2.003 -4.843 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.583 0.963 -6.648 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.202 1.943 -5.297 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.113 0.520 -5.855 1.00 0.00 H new ATOM 0 HD11 ILE B 39 3.735 -2.934 -5.402 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.645 -1.980 -3.902 1.00 0.00 H new ATOM 0 HD13 ILE B 39 3.034 -1.299 -5.429 1.00 0.00 H new ATOM 1915 N GLU B 40 5.400 -2.125 -2.453 1.00 0.00 N ATOM 1916 CA GLU B 40 4.650 -3.006 -1.582 1.00 0.00 C ATOM 1917 C GLU B 40 5.293 -3.070 -0.207 1.00 0.00 C ATOM 1918 O GLU B 40 4.633 -3.398 0.780 1.00 0.00 O ATOM 1919 CB GLU B 40 4.550 -4.406 -2.185 1.00 0.00 C ATOM 1920 CG GLU B 40 3.234 -5.100 -1.883 1.00 0.00 C ATOM 1921 CD GLU B 40 3.406 -6.327 -1.010 1.00 0.00 C ATOM 1922 OE1 GLU B 40 2.461 -6.662 -0.264 1.00 0.00 O ATOM 1923 OE2 GLU B 40 4.484 -6.953 -1.072 1.00 0.00 O ATOM 0 H GLU B 40 6.035 -2.600 -3.094 1.00 0.00 H new ATOM 0 HA GLU B 40 3.643 -2.603 -1.477 1.00 0.00 H new ATOM 0 HB2 GLU B 40 4.677 -4.338 -3.265 1.00 0.00 H new ATOM 0 HB3 GLU B 40 5.370 -5.016 -1.806 1.00 0.00 H new ATOM 0 HG2 GLU B 40 2.563 -4.398 -1.388 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.757 -5.390 -2.820 1.00 0.00 H new ATOM 1930 N GLU B 41 6.578 -2.736 -0.137 1.00 0.00 N ATOM 1931 CA GLU B 41 7.279 -2.743 1.136 1.00 0.00 C ATOM 1932 C GLU B 41 7.039 -1.426 1.860 1.00 0.00 C ATOM 1933 O GLU B 41 6.966 -1.379 3.089 1.00 0.00 O ATOM 1934 CB GLU B 41 8.778 -2.970 0.922 1.00 0.00 C ATOM 1935 CG GLU B 41 9.606 -2.869 2.194 1.00 0.00 C ATOM 1936 CD GLU B 41 11.003 -2.338 1.937 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.900 -3.150 1.625 1.00 0.00 O ATOM 1938 OE2 GLU B 41 11.201 -1.110 2.048 1.00 0.00 O ATOM 0 H GLU B 41 7.147 -2.461 -0.938 1.00 0.00 H new ATOM 0 HA GLU B 41 6.895 -3.560 1.747 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.927 -3.956 0.481 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.147 -2.240 0.202 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.098 -2.216 2.904 1.00 0.00 H new ATOM 0 HG3 GLU B 41 9.674 -3.853 2.658 1.00 0.00 H new ATOM 1945 N ALA B 42 6.908 -0.355 1.083 1.00 0.00 N ATOM 1946 CA ALA B 42 6.669 0.966 1.646 1.00 0.00 C ATOM 1947 C ALA B 42 5.226 1.102 2.114 1.00 0.00 C ATOM 1948 O ALA B 42 4.954 1.678 3.168 1.00 0.00 O ATOM 1949 CB ALA B 42 7.000 2.042 0.623 1.00 0.00 C ATOM 0 H ALA B 42 6.963 -0.378 0.065 1.00 0.00 H new ATOM 0 HA ALA B 42 7.320 1.093 2.511 1.00 0.00 H new ATOM 0 HB1 ALA B 42 6.817 3.025 1.057 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.049 1.961 0.336 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.372 1.912 -0.258 1.00 0.00 H new ATOM 1955 N VAL B 43 4.305 0.568 1.320 1.00 0.00 N ATOM 1956 CA VAL B 43 2.884 0.627 1.646 1.00 0.00 C ATOM 1957 C VAL B 43 2.595 -0.014 2.987 1.00 0.00 C ATOM 1958 O VAL B 43 2.111 0.631 3.918 1.00 0.00 O ATOM 1959 CB VAL B 43 2.024 -0.098 0.578 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.577 -1.465 0.250 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.590 -0.240 1.046 1.00 0.00 C ATOM 0 H VAL B 43 4.517 0.089 0.445 1.00 0.00 H new ATOM 0 HA VAL B 43 2.624 1.685 1.676 1.00 0.00 H new ATOM 0 HB VAL B 43 2.054 0.515 -0.323 1.00 0.00 H new ATOM 0 HG11 VAL B 43 1.948 -1.941 -0.502 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.591 -1.364 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.592 -2.077 1.152 1.00 0.00 H new ATOM 0 HG21 VAL B 43 0.006 -0.751 0.280 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.564 -0.819 1.969 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.166 0.748 1.226 1.00 0.00 H new ATOM 1971 N VAL B 44 2.877 -1.296 3.058 1.00 0.00 N ATOM 1972 CA VAL B 44 2.640 -2.069 4.254 1.00 0.00 C ATOM 1973 C VAL B 44 3.357 -1.458 5.448 1.00 0.00 C ATOM 1974 O VAL B 44 2.776 -1.306 6.518 1.00 0.00 O ATOM 1975 CB VAL B 44 3.086 -3.528 4.035 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.688 -4.137 5.295 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.925 -4.371 3.532 1.00 0.00 C ATOM 0 H VAL B 44 3.277 -1.831 2.287 1.00 0.00 H new ATOM 0 HA VAL B 44 1.571 -2.058 4.468 1.00 0.00 H new ATOM 0 HB VAL B 44 3.868 -3.519 3.276 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.988 -5.165 5.094 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.560 -3.557 5.599 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.947 -4.125 6.095 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.259 -5.398 3.383 1.00 0.00 H new ATOM 0 HG22 VAL B 44 1.119 -4.354 4.265 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.564 -3.966 2.587 1.00 0.00 H new ATOM 1987 N MET B 45 4.614 -1.101 5.258 1.00 0.00 N ATOM 1988 CA MET B 45 5.385 -0.501 6.333 1.00 0.00 C ATOM 1989 C MET B 45 4.725 0.787 6.812 1.00 0.00 C ATOM 1990 O MET B 45 4.820 1.134 7.989 1.00 0.00 O ATOM 1991 CB MET B 45 6.824 -0.232 5.884 1.00 0.00 C ATOM 1992 CG MET B 45 7.653 0.542 6.901 1.00 0.00 C ATOM 1993 SD MET B 45 7.529 -0.136 8.568 1.00 0.00 S ATOM 1994 CE MET B 45 7.709 -1.886 8.236 1.00 0.00 C ATOM 0 H MET B 45 5.119 -1.214 4.379 1.00 0.00 H new ATOM 0 HA MET B 45 5.413 -1.204 7.165 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.314 -1.184 5.679 1.00 0.00 H new ATOM 0 HB3 MET B 45 6.804 0.325 4.947 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.697 0.538 6.589 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.327 1.582 6.912 1.00 0.00 H new ATOM 0 HE1 MET B 45 8.428 -2.317 8.933 1.00 0.00 H new ATOM 0 HE2 MET B 45 6.745 -2.380 8.357 1.00 0.00 H new ATOM 0 HE3 MET B 45 8.064 -2.028 7.215 1.00 0.00 H new ATOM 2004 N TRP B 46 4.039 1.491 5.908 1.00 0.00 N ATOM 2005 CA TRP B 46 3.365 2.723 6.294 1.00 0.00 C ATOM 2006 C TRP B 46 2.178 2.404 7.188 1.00 0.00 C ATOM 2007 O TRP B 46 2.091 2.888 8.316 1.00 0.00 O ATOM 2008 CB TRP B 46 2.899 3.511 5.069 1.00 0.00 C ATOM 2009 CG TRP B 46 2.129 4.747 5.428 1.00 0.00 C ATOM 2010 CD1 TRP B 46 0.912 5.129 4.938 1.00 0.00 C ATOM 2011 CD2 TRP B 46 2.520 5.757 6.364 1.00 0.00 C ATOM 2012 NE1 TRP B 46 0.527 6.317 5.509 1.00 0.00 N ATOM 2013 CE2 TRP B 46 1.496 6.723 6.388 1.00 0.00 C ATOM 2014 CE3 TRP B 46 3.638 5.940 7.185 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 1.557 7.852 7.200 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 3.697 7.062 7.989 1.00 0.00 C ATOM 2017 CH2 TRP B 46 2.661 8.005 7.992 1.00 0.00 C ATOM 0 H TRP B 46 3.939 1.233 4.926 1.00 0.00 H new ATOM 0 HA TRP B 46 4.077 3.341 6.840 1.00 0.00 H new ATOM 0 HB2 TRP B 46 3.767 3.790 4.471 1.00 0.00 H new ATOM 0 HB3 TRP B 46 2.276 2.869 4.446 1.00 0.00 H new ATOM 0 HD1 TRP B 46 0.337 4.578 4.209 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -0.340 6.816 5.311 1.00 0.00 H new ATOM 0 HE3 TRP B 46 4.440 5.217 7.190 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 0.760 8.581 7.204 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 4.556 7.215 8.626 1.00 0.00 H new ATOM 0 HH2 TRP B 46 2.736 8.871 8.633 1.00 0.00 H new ATOM 2028 N LEU B 47 1.271 1.573 6.686 1.00 0.00 N ATOM 2029 CA LEU B 47 0.097 1.180 7.456 1.00 0.00 C ATOM 2030 C LEU B 47 0.515 0.589 8.786 1.00 0.00 C ATOM 2031 O LEU B 47 -0.070 0.875 9.827 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.738 0.135 6.717 1.00 0.00 C ATOM 2033 CG LEU B 47 0.029 -0.826 5.807 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.218 -2.159 6.510 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.705 -1.014 4.487 1.00 0.00 C ATOM 0 H LEU B 47 1.325 1.161 5.755 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.501 2.079 7.605 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.281 -0.454 7.456 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.483 0.656 6.115 1.00 0.00 H new ATOM 0 HG LEU B 47 1.009 -0.401 5.590 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.765 -2.840 5.858 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.781 -2.008 7.431 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.756 -2.587 6.746 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.144 -1.701 3.853 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.697 -1.424 4.677 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -0.801 -0.052 3.984 1.00 0.00 H new ATOM 2047 N ILE B 48 1.520 -0.264 8.730 1.00 0.00 N ATOM 2048 CA ILE B 48 2.014 -0.933 9.906 1.00 0.00 C ATOM 2049 C ILE B 48 2.580 0.045 10.920 1.00 0.00 C ATOM 2050 O ILE B 48 2.293 -0.053 12.113 1.00 0.00 O ATOM 2051 CB ILE B 48 3.073 -1.973 9.502 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.526 -3.368 9.733 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.379 -1.771 10.254 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.202 -3.632 9.040 1.00 0.00 C ATOM 0 H ILE B 48 2.011 -0.508 7.870 1.00 0.00 H new ATOM 0 HA ILE B 48 1.176 -1.438 10.386 1.00 0.00 H new ATOM 0 HB ILE B 48 3.295 -1.844 8.443 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.258 -4.097 9.386 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.402 -3.526 10.804 1.00 0.00 H new ATOM 0 HG21 ILE B 48 5.100 -2.526 9.940 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.774 -0.779 10.037 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.200 -1.864 11.325 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.876 -4.650 9.253 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.454 -2.928 9.404 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.323 -3.508 7.964 1.00 0.00 H new ATOM 2066 N GLN B 49 3.388 0.978 10.450 1.00 0.00 N ATOM 2067 CA GLN B 49 3.984 1.950 11.341 1.00 0.00 C ATOM 2068 C GLN B 49 3.007 3.085 11.652 1.00 0.00 C ATOM 2069 O GLN B 49 3.218 3.855 12.589 1.00 0.00 O ATOM 2070 CB GLN B 49 5.278 2.510 10.739 1.00 0.00 C ATOM 2071 CG GLN B 49 5.050 3.559 9.660 1.00 0.00 C ATOM 2072 CD GLN B 49 6.344 4.038 9.031 1.00 0.00 C ATOM 2073 OE1 GLN B 49 6.600 3.602 7.803 1.00 0.00 O flip ATOM 2074 NE2 GLN B 49 7.102 4.792 9.641 1.00 0.00 N flip ATOM 0 H GLN B 49 3.643 1.081 9.468 1.00 0.00 H new ATOM 0 HA GLN B 49 4.224 1.444 12.276 1.00 0.00 H new ATOM 0 HB2 GLN B 49 5.879 2.947 11.536 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.857 1.688 10.317 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.405 3.144 8.885 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.523 4.410 10.091 1.00 0.00 H new ATOM 0 HE21 GLN B 49 6.864 5.101 10.583 1.00 0.00 H new ATOM 0 HE22 GLN B 49 7.968 5.107 9.204 1.00 0.00 H new ATOM 2083 N ASN B 50 1.948 3.193 10.852 1.00 0.00 N ATOM 2084 CA ASN B 50 0.956 4.249 11.040 1.00 0.00 C ATOM 2085 C ASN B 50 -0.252 3.760 11.832 1.00 0.00 C ATOM 2086 O ASN B 50 -0.586 4.316 12.876 1.00 0.00 O ATOM 2087 CB ASN B 50 0.501 4.791 9.685 1.00 0.00 C ATOM 2088 CG ASN B 50 -0.161 6.150 9.799 1.00 0.00 C ATOM 2089 OD1 ASN B 50 0.093 6.900 10.742 1.00 0.00 O ATOM 2090 ND2 ASN B 50 -1.018 6.474 8.837 1.00 0.00 N ATOM 0 H ASN B 50 1.755 2.566 10.071 1.00 0.00 H new ATOM 0 HA ASN B 50 1.431 5.045 11.613 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.360 4.863 9.018 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -0.196 4.087 9.231 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -1.495 7.375 8.861 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -1.199 5.822 8.074 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.910 2.731 11.319 1.00 0.00 N ATOM 2098 CA LYS B 51 -2.096 2.175 11.965 1.00 0.00 C ATOM 2099 C LYS B 51 -1.773 1.612 13.347 1.00 0.00 C ATOM 2100 O LYS B 51 -2.394 1.988 14.341 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.714 1.082 11.090 1.00 0.00 C ATOM 2102 CG LYS B 51 -4.193 1.292 10.810 1.00 0.00 C ATOM 2103 CD LYS B 51 -4.421 1.856 9.417 1.00 0.00 C ATOM 2104 CE LYS B 51 -4.197 3.360 9.380 1.00 0.00 C ATOM 2105 NZ LYS B 51 -2.756 3.715 9.501 1.00 0.00 N ATOM 0 H LYS B 51 -0.644 2.261 10.454 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.812 2.987 12.091 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -2.176 1.038 10.143 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -2.578 0.117 11.578 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -4.722 0.344 10.911 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -4.612 1.972 11.552 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -3.747 1.369 8.712 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -5.437 1.631 9.094 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -4.592 3.762 8.447 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -4.755 3.829 10.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -2.522 4.456 8.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -2.564 4.064 10.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -2.174 2.873 9.316 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.805 0.702 13.400 1.00 0.00 N ATOM 2120 CA GLU B 52 -0.405 0.073 14.657 1.00 0.00 C ATOM 2121 C GLU B 52 -0.235 1.101 15.774 1.00 0.00 C ATOM 2122 O GLU B 52 -0.531 0.821 16.937 1.00 0.00 O ATOM 2123 CB GLU B 52 0.899 -0.704 14.467 1.00 0.00 C ATOM 2124 CG GLU B 52 1.104 -1.807 15.492 1.00 0.00 C ATOM 2125 CD GLU B 52 1.770 -3.035 14.903 1.00 0.00 C ATOM 2126 OE1 GLU B 52 2.978 -2.965 14.594 1.00 0.00 O ATOM 2127 OE2 GLU B 52 1.083 -4.067 14.750 1.00 0.00 O ATOM 0 H GLU B 52 -0.281 0.382 12.585 1.00 0.00 H new ATOM 0 HA GLU B 52 -1.200 -0.613 14.949 1.00 0.00 H new ATOM 0 HB2 GLU B 52 0.910 -1.141 13.468 1.00 0.00 H new ATOM 0 HB3 GLU B 52 1.737 -0.009 14.520 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.713 -1.427 16.312 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.140 -2.089 15.915 1.00 0.00 H new ATOM 2134 N LYS B 53 0.248 2.285 15.420 1.00 0.00 N ATOM 2135 CA LYS B 53 0.461 3.347 16.398 1.00 0.00 C ATOM 2136 C LYS B 53 -0.254 4.631 15.990 1.00 0.00 C ATOM 2137 O LYS B 53 0.188 5.727 16.331 1.00 0.00 O ATOM 2138 CB LYS B 53 1.957 3.616 16.568 1.00 0.00 C ATOM 2139 CG LYS B 53 2.666 3.958 15.266 1.00 0.00 C ATOM 2140 CD LYS B 53 3.492 5.229 15.394 1.00 0.00 C ATOM 2141 CE LYS B 53 2.802 6.412 14.735 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.158 7.700 15.392 1.00 0.00 N ATOM 0 H LYS B 53 0.500 2.535 14.464 1.00 0.00 H new ATOM 0 HA LYS B 53 0.043 3.014 17.348 1.00 0.00 H new ATOM 0 HB2 LYS B 53 2.092 4.437 17.272 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.428 2.737 17.009 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.313 3.131 14.976 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.930 4.081 14.472 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.664 5.448 16.448 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.470 5.076 14.937 1.00 0.00 H new ATOM 0 HE2 LYS B 53 3.079 6.453 13.682 1.00 0.00 H new ATOM 0 HE3 LYS B 53 1.722 6.271 14.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 2.615 8.473 14.957 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 2.933 7.646 16.406 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.175 7.881 15.272 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.357 4.491 15.257 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.127 5.647 14.799 1.00 0.00 C ATOM 2158 C LEU B 54 -2.517 6.548 15.969 1.00 0.00 C ATOM 2159 O LEU B 54 -3.453 6.244 16.708 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.387 5.187 14.064 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.134 6.290 13.311 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -3.497 6.533 11.952 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.604 5.926 13.156 1.00 0.00 C ATOM 0 H LEU B 54 -1.738 3.590 14.968 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.497 6.218 14.117 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.112 4.406 13.355 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -4.067 4.736 14.787 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.067 7.211 13.890 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -4.041 7.320 11.431 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -2.459 6.837 12.086 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -3.534 5.616 11.364 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.121 6.721 12.618 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -5.691 4.994 12.598 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -6.054 5.802 14.141 1.00 0.00 H new ATOM 2175 N PRO B 55 -1.801 7.672 16.158 1.00 0.00 N ATOM 2176 CA PRO B 55 -2.073 8.614 17.244 1.00 0.00 C ATOM 2177 C PRO B 55 -3.253 9.527 16.930 1.00 0.00 C ATOM 2178 O PRO B 55 -3.578 9.761 15.766 1.00 0.00 O ATOM 2179 CB PRO B 55 -0.776 9.435 17.352 1.00 0.00 C ATOM 2180 CG PRO B 55 0.172 8.851 16.350 1.00 0.00 C ATOM 2181 CD PRO B 55 -0.671 8.125 15.344 1.00 0.00 C ATOM 0 HA PRO B 55 -2.341 8.100 18.167 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -0.963 10.488 17.143 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -0.362 9.378 18.359 1.00 0.00 H new ATOM 0 HG2 PRO B 55 0.761 9.633 15.871 1.00 0.00 H new ATOM 0 HG3 PRO B 55 0.875 8.171 16.831 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -0.990 8.779 14.532 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.136 7.291 14.890 1.00 0.00 H new ATOM 2189 N ASN B 56 -3.886 10.047 17.975 1.00 0.00 N ATOM 2190 CA ASN B 56 -5.024 10.942 17.809 1.00 0.00 C ATOM 2191 C ASN B 56 -4.562 12.328 17.363 1.00 0.00 C ATOM 2192 O ASN B 56 -5.327 13.085 16.765 1.00 0.00 O ATOM 2193 CB ASN B 56 -5.813 11.050 19.115 1.00 0.00 C ATOM 2194 CG ASN B 56 -6.532 9.763 19.464 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -6.205 9.101 20.449 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -7.521 9.400 18.654 1.00 0.00 N ATOM 0 H ASN B 56 -3.631 9.864 18.945 1.00 0.00 H new ATOM 0 HA ASN B 56 -5.672 10.527 17.037 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -5.134 11.315 19.926 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -6.540 11.858 19.031 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.042 8.543 18.838 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -7.759 9.979 17.848 1.00 0.00 H new ATOM 2203 N GLU B 57 -3.305 12.652 17.658 1.00 0.00 N ATOM 2204 CA GLU B 57 -2.742 13.945 17.287 1.00 0.00 C ATOM 2205 C GLU B 57 -2.205 13.924 15.858 1.00 0.00 C ATOM 2206 O GLU B 57 -2.068 14.971 15.224 1.00 0.00 O ATOM 2207 CB GLU B 57 -1.625 14.334 18.258 1.00 0.00 C ATOM 2208 CG GLU B 57 -0.428 13.398 18.215 1.00 0.00 C ATOM 2209 CD GLU B 57 -0.412 12.417 19.371 1.00 0.00 C ATOM 2210 OE1 GLU B 57 -1.008 12.727 20.424 1.00 0.00 O ATOM 2211 OE2 GLU B 57 0.198 11.336 19.223 1.00 0.00 O ATOM 0 H GLU B 57 -2.659 12.037 18.152 1.00 0.00 H new ATOM 0 HA GLU B 57 -3.540 14.686 17.341 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -1.292 15.346 18.029 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -2.026 14.352 19.272 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -0.437 12.846 17.275 1.00 0.00 H new ATOM 0 HG3 GLU B 57 0.489 13.987 18.230 1.00 0.00 H new ATOM 2218 N LEU B 58 -1.900 12.731 15.354 1.00 0.00 N ATOM 2219 CA LEU B 58 -1.380 12.588 13.998 1.00 0.00 C ATOM 2220 C LEU B 58 -2.502 12.661 12.967 1.00 0.00 C ATOM 2221 O LEU B 58 -2.253 12.935 11.795 1.00 0.00 O ATOM 2222 CB LEU B 58 -0.625 11.266 13.846 1.00 0.00 C ATOM 2223 CG LEU B 58 0.841 11.404 13.429 1.00 0.00 C ATOM 2224 CD1 LEU B 58 1.733 11.551 14.651 1.00 0.00 C ATOM 2225 CD2 LEU B 58 1.270 10.210 12.592 1.00 0.00 C ATOM 0 H LEU B 58 -2.004 11.853 15.862 1.00 0.00 H new ATOM 0 HA LEU B 58 -0.692 13.414 13.821 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -0.669 10.729 14.793 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -1.141 10.653 13.107 1.00 0.00 H new ATOM 0 HG LEU B 58 0.944 12.303 12.822 1.00 0.00 H new ATOM 0 HD11 LEU B 58 2.771 11.648 14.334 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.440 12.439 15.211 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.628 10.671 15.286 1.00 0.00 H new ATOM 0 HD21 LEU B 58 2.315 10.324 12.304 1.00 0.00 H new ATOM 0 HD22 LEU B 58 1.152 9.296 13.174 1.00 0.00 H new ATOM 0 HD23 LEU B 58 0.651 10.152 11.697 1.00 0.00 H new ATOM 2237 N LYS B 59 -3.734 12.411 13.413 1.00 0.00 N ATOM 2238 CA LYS B 59 -4.904 12.444 12.534 1.00 0.00 C ATOM 2239 C LYS B 59 -4.789 13.545 11.477 1.00 0.00 C ATOM 2240 O LYS B 59 -4.901 13.277 10.282 1.00 0.00 O ATOM 2241 CB LYS B 59 -6.178 12.645 13.356 1.00 0.00 C ATOM 2242 CG LYS B 59 -7.348 11.800 12.879 1.00 0.00 C ATOM 2243 CD LYS B 59 -8.621 12.131 13.642 1.00 0.00 C ATOM 2244 CE LYS B 59 -9.249 13.423 13.146 1.00 0.00 C ATOM 2245 NZ LYS B 59 -10.156 13.193 11.987 1.00 0.00 N ATOM 0 H LYS B 59 -3.948 12.182 14.384 1.00 0.00 H new ATOM 0 HA LYS B 59 -4.952 11.486 12.016 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -5.969 12.406 14.399 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -6.462 13.697 13.320 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -7.507 11.966 11.814 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.111 10.744 13.005 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.334 11.314 13.534 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -8.397 12.219 14.705 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -9.808 13.889 13.957 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -8.463 14.121 12.858 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -10.563 14.099 11.680 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -9.618 12.772 11.203 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -10.921 12.547 12.268 1.00 0.00 H new ATOM 2259 N PRO B 60 -4.567 14.803 11.899 1.00 0.00 N ATOM 2260 CA PRO B 60 -4.443 15.928 10.967 1.00 0.00 C ATOM 2261 C PRO B 60 -3.218 15.810 10.068 1.00 0.00 C ATOM 2262 O PRO B 60 -3.221 16.297 8.936 1.00 0.00 O ATOM 2263 CB PRO B 60 -4.324 17.150 11.883 1.00 0.00 C ATOM 2264 CG PRO B 60 -3.840 16.610 13.183 1.00 0.00 C ATOM 2265 CD PRO B 60 -4.425 15.231 13.303 1.00 0.00 C ATOM 0 HA PRO B 60 -5.290 15.978 10.283 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -3.627 17.882 11.476 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -5.284 17.653 11.997 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -2.751 16.575 13.210 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -4.159 17.243 14.011 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -3.771 14.563 13.863 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -5.385 15.244 13.819 1.00 0.00 H new ATOM 2273 N LYS B 61 -2.173 15.159 10.567 1.00 0.00 N ATOM 2274 CA LYS B 61 -0.953 14.984 9.789 1.00 0.00 C ATOM 2275 C LYS B 61 -1.204 14.072 8.595 1.00 0.00 C ATOM 2276 O LYS B 61 -0.530 14.180 7.571 1.00 0.00 O ATOM 2277 CB LYS B 61 0.173 14.416 10.652 1.00 0.00 C ATOM 2278 CG LYS B 61 1.544 14.530 10.001 1.00 0.00 C ATOM 2279 CD LYS B 61 1.875 13.300 9.169 1.00 0.00 C ATOM 2280 CE LYS B 61 3.070 12.549 9.736 1.00 0.00 C ATOM 2281 NZ LYS B 61 4.357 13.211 9.388 1.00 0.00 N ATOM 0 H LYS B 61 -2.146 14.747 11.500 1.00 0.00 H new ATOM 0 HA LYS B 61 -0.647 15.965 9.426 1.00 0.00 H new ATOM 0 HB2 LYS B 61 0.188 14.939 11.608 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -0.035 13.367 10.865 1.00 0.00 H new ATOM 0 HG2 LYS B 61 1.574 15.417 9.368 1.00 0.00 H new ATOM 0 HG3 LYS B 61 2.303 14.663 10.772 1.00 0.00 H new ATOM 0 HD2 LYS B 61 1.010 12.638 9.136 1.00 0.00 H new ATOM 0 HD3 LYS B 61 2.086 13.600 8.142 1.00 0.00 H new ATOM 0 HE2 LYS B 61 2.977 12.484 10.820 1.00 0.00 H new ATOM 0 HE3 LYS B 61 3.072 11.528 9.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 5.147 12.669 9.793 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 4.458 13.251 8.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 4.366 14.177 9.774 1.00 0.00 H new ATOM 2295 N ILE B 62 -2.188 13.183 8.720 1.00 0.00 N ATOM 2296 CA ILE B 62 -2.525 12.272 7.632 1.00 0.00 C ATOM 2297 C ILE B 62 -2.763 13.069 6.354 1.00 0.00 C ATOM 2298 O ILE B 62 -2.436 12.618 5.253 1.00 0.00 O ATOM 2299 CB ILE B 62 -3.765 11.411 7.979 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.337 10.169 8.763 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.529 11.005 6.724 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -2.403 10.474 9.914 1.00 0.00 C ATOM 0 H ILE B 62 -2.761 13.076 9.557 1.00 0.00 H new ATOM 0 HA ILE B 62 -1.688 11.590 7.480 1.00 0.00 H new ATOM 0 HB ILE B 62 -4.432 12.013 8.596 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.225 9.669 9.149 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -2.848 9.471 8.084 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.393 10.402 7.003 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -4.865 11.898 6.198 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -3.876 10.424 6.073 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -2.141 9.548 10.425 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -1.498 10.947 9.533 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -2.897 11.148 10.614 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.292 14.279 6.515 1.00 0.00 N ATOM 2315 CA ASP B 63 -3.523 15.157 5.386 1.00 0.00 C ATOM 2316 C ASP B 63 -2.174 15.573 4.829 1.00 0.00 C ATOM 2317 O ASP B 63 -1.969 15.614 3.618 1.00 0.00 O ATOM 2318 CB ASP B 63 -4.332 16.384 5.817 1.00 0.00 C ATOM 2319 CG ASP B 63 -5.692 16.441 5.151 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -5.797 17.054 4.066 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -6.652 15.873 5.712 1.00 0.00 O ATOM 0 H ASP B 63 -3.566 14.668 7.417 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.098 14.638 4.619 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -4.461 16.369 6.899 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -3.773 17.288 5.575 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.243 15.841 5.746 1.00 0.00 N ATOM 2327 CA GLU B 64 0.112 16.215 5.379 1.00 0.00 C ATOM 2328 C GLU B 64 0.730 15.117 4.525 1.00 0.00 C ATOM 2329 O GLU B 64 1.378 15.386 3.518 1.00 0.00 O ATOM 2330 CB GLU B 64 0.956 16.455 6.634 1.00 0.00 C ATOM 2331 CG GLU B 64 1.426 17.894 6.783 1.00 0.00 C ATOM 2332 CD GLU B 64 2.513 18.047 7.830 1.00 0.00 C ATOM 2333 OE1 GLU B 64 3.294 17.091 8.018 1.00 0.00 O ATOM 2334 OE2 GLU B 64 2.582 19.123 8.460 1.00 0.00 O ATOM 0 H GLU B 64 -1.410 15.804 6.752 1.00 0.00 H new ATOM 0 HA GLU B 64 0.084 17.140 4.804 1.00 0.00 H new ATOM 0 HB2 GLU B 64 0.373 16.179 7.513 1.00 0.00 H new ATOM 0 HB3 GLU B 64 1.825 15.798 6.609 1.00 0.00 H new ATOM 0 HG2 GLU B 64 1.798 18.252 5.823 1.00 0.00 H new ATOM 0 HG3 GLU B 64 0.577 18.524 7.051 1.00 0.00 H new ATOM 2341 N ILE B 65 0.495 13.874 4.931 1.00 0.00 N ATOM 2342 CA ILE B 65 0.999 12.715 4.204 1.00 0.00 C ATOM 2343 C ILE B 65 0.505 12.729 2.764 1.00 0.00 C ATOM 2344 O ILE B 65 1.245 12.397 1.839 1.00 0.00 O ATOM 2345 CB ILE B 65 0.546 11.404 4.881 1.00 0.00 C ATOM 2346 CG1 ILE B 65 1.015 11.372 6.338 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.066 10.192 4.118 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.519 11.321 6.479 1.00 0.00 C ATOM 0 H ILE B 65 -0.045 13.643 5.765 1.00 0.00 H new ATOM 0 HA ILE B 65 2.088 12.766 4.214 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.543 11.366 4.867 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.638 12.255 6.854 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.581 10.504 6.834 1.00 0.00 H new ATOM 0 HG21 ILE B 65 0.734 9.280 4.614 1.00 0.00 H new ATOM 0 HG22 ILE B 65 0.681 10.211 3.098 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.155 10.216 4.095 1.00 0.00 H new ATOM 0 HD11 ILE B 65 2.785 11.300 7.536 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.900 10.424 5.991 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.958 12.202 6.012 1.00 0.00 H new ATOM 2360 N SER B 66 -0.755 13.113 2.585 1.00 0.00 N ATOM 2361 CA SER B 66 -1.359 13.165 1.259 1.00 0.00 C ATOM 2362 C SER B 66 -0.929 14.417 0.496 1.00 0.00 C ATOM 2363 O SER B 66 -0.474 14.329 -0.644 1.00 0.00 O ATOM 2364 CB SER B 66 -2.884 13.123 1.369 1.00 0.00 C ATOM 2365 OG SER B 66 -3.482 12.938 0.098 1.00 0.00 O ATOM 0 H SER B 66 -1.378 13.393 3.343 1.00 0.00 H new ATOM 0 HA SER B 66 -1.012 12.294 0.704 1.00 0.00 H new ATOM 0 HB2 SER B 66 -3.181 12.314 2.036 1.00 0.00 H new ATOM 0 HB3 SER B 66 -3.245 14.051 1.813 1.00 0.00 H new ATOM 0 HG SER B 66 -3.977 12.092 0.089 1.00 0.00 H new ATOM 2371 N LYS B 67 -1.082 15.581 1.123 1.00 0.00 N ATOM 2372 CA LYS B 67 -0.713 16.839 0.482 1.00 0.00 C ATOM 2373 C LYS B 67 0.794 16.919 0.247 1.00 0.00 C ATOM 2374 O LYS B 67 1.241 17.458 -0.765 1.00 0.00 O ATOM 2375 CB LYS B 67 -1.185 18.032 1.317 1.00 0.00 C ATOM 2376 CG LYS B 67 -0.847 17.921 2.795 1.00 0.00 C ATOM 2377 CD LYS B 67 -0.167 19.182 3.308 1.00 0.00 C ATOM 2378 CE LYS B 67 -1.178 20.191 3.829 1.00 0.00 C ATOM 2379 NZ LYS B 67 -1.005 20.453 5.284 1.00 0.00 N ATOM 0 H LYS B 67 -1.456 15.679 2.067 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.210 16.874 -0.488 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -0.736 18.942 0.919 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.265 18.135 1.208 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -1.758 17.740 3.365 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.194 17.063 2.957 1.00 0.00 H new ATOM 0 HD2 LYS B 67 0.531 18.922 4.104 1.00 0.00 H new ATOM 0 HD3 LYS B 67 0.418 19.633 2.506 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -1.075 21.126 3.278 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -2.187 19.822 3.645 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -1.714 21.146 5.599 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -1.129 19.566 5.813 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -0.051 20.830 5.458 1.00 0.00 H new ATOM 2393 N ARG B 68 1.575 16.374 1.177 1.00 0.00 N ATOM 2394 CA ARG B 68 3.029 16.385 1.045 1.00 0.00 C ATOM 2395 C ARG B 68 3.480 15.341 0.033 1.00 0.00 C ATOM 2396 O ARG B 68 4.480 15.528 -0.659 1.00 0.00 O ATOM 2397 CB ARG B 68 3.706 16.130 2.392 1.00 0.00 C ATOM 2398 CG ARG B 68 3.421 17.205 3.427 1.00 0.00 C ATOM 2399 CD ARG B 68 3.773 16.737 4.831 1.00 0.00 C ATOM 2400 NE ARG B 68 5.151 16.260 4.920 1.00 0.00 N ATOM 2401 CZ ARG B 68 6.209 17.062 5.025 1.00 0.00 C ATOM 2402 NH1 ARG B 68 6.050 18.380 5.055 1.00 0.00 N ATOM 2403 NH2 ARG B 68 7.428 16.546 5.100 1.00 0.00 N ATOM 0 H ARG B 68 1.229 15.923 2.024 1.00 0.00 H new ATOM 0 HA ARG B 68 3.324 17.373 0.693 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.374 15.167 2.780 1.00 0.00 H new ATOM 0 HB3 ARG B 68 4.783 16.059 2.241 1.00 0.00 H new ATOM 0 HG2 ARG B 68 3.992 18.102 3.188 1.00 0.00 H new ATOM 0 HG3 ARG B 68 2.367 17.479 3.388 1.00 0.00 H new ATOM 0 HD2 ARG B 68 3.627 17.557 5.534 1.00 0.00 H new ATOM 0 HD3 ARG B 68 3.093 15.938 5.128 1.00 0.00 H new ATOM 0 HE ARG B 68 5.312 15.253 4.901 1.00 0.00 H new ATOM 0 HH11 ARG B 68 5.114 18.782 4.998 1.00 0.00 H new ATOM 0 HH12 ARG B 68 6.863 18.990 5.136 1.00 0.00 H new ATOM 0 HH21 ARG B 68 7.556 15.534 5.077 1.00 0.00 H new ATOM 0 HH22 ARG B 68 8.238 17.161 5.180 1.00 0.00 H new ATOM 2417 N PHE B 69 2.730 14.245 -0.057 1.00 0.00 N ATOM 2418 CA PHE B 69 3.051 13.180 -0.999 1.00 0.00 C ATOM 2419 C PHE B 69 3.137 13.750 -2.414 1.00 0.00 C ATOM 2420 O PHE B 69 3.932 13.297 -3.237 1.00 0.00 O ATOM 2421 CB PHE B 69 2.002 12.058 -0.907 1.00 0.00 C ATOM 2422 CG PHE B 69 1.461 11.594 -2.234 1.00 0.00 C ATOM 2423 CD1 PHE B 69 2.288 10.978 -3.159 1.00 0.00 C ATOM 2424 CD2 PHE B 69 0.125 11.775 -2.553 1.00 0.00 C ATOM 2425 CE1 PHE B 69 1.794 10.552 -4.376 1.00 0.00 C ATOM 2426 CE2 PHE B 69 -0.375 11.350 -3.770 1.00 0.00 C ATOM 2427 CZ PHE B 69 0.460 10.738 -4.682 1.00 0.00 C ATOM 0 H PHE B 69 1.899 14.073 0.509 1.00 0.00 H new ATOM 0 HA PHE B 69 4.021 12.751 -0.747 1.00 0.00 H new ATOM 0 HB2 PHE B 69 2.445 11.206 -0.392 1.00 0.00 H new ATOM 0 HB3 PHE B 69 1.171 12.405 -0.292 1.00 0.00 H new ATOM 0 HD1 PHE B 69 3.332 10.829 -2.925 1.00 0.00 H new ATOM 0 HD2 PHE B 69 -0.533 12.253 -1.843 1.00 0.00 H new ATOM 0 HE1 PHE B 69 2.450 10.074 -5.088 1.00 0.00 H new ATOM 0 HE2 PHE B 69 -1.418 11.497 -4.007 1.00 0.00 H new ATOM 0 HZ PHE B 69 0.071 10.405 -5.633 1.00 0.00 H new ATOM 2437 N PHE B 70 2.321 14.766 -2.675 1.00 0.00 N ATOM 2438 CA PHE B 70 2.306 15.430 -3.970 1.00 0.00 C ATOM 2439 C PHE B 70 2.849 16.848 -3.824 1.00 0.00 C ATOM 2440 O PHE B 70 2.092 17.818 -3.826 1.00 0.00 O ATOM 2441 CB PHE B 70 0.886 15.464 -4.539 1.00 0.00 C ATOM 2442 CG PHE B 70 0.843 15.545 -6.039 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.726 14.396 -6.805 1.00 0.00 C ATOM 2444 CD2 PHE B 70 0.919 16.769 -6.681 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.685 14.467 -8.185 1.00 0.00 C ATOM 2446 CE2 PHE B 70 0.879 16.848 -8.061 1.00 0.00 C ATOM 2447 CZ PHE B 70 0.762 15.695 -8.813 1.00 0.00 C ATOM 0 H PHE B 70 1.658 15.148 -2.001 1.00 0.00 H new ATOM 0 HA PHE B 70 2.938 14.872 -4.661 1.00 0.00 H new ATOM 0 HB2 PHE B 70 0.352 14.570 -4.216 1.00 0.00 H new ATOM 0 HB3 PHE B 70 0.356 16.320 -4.121 1.00 0.00 H new ATOM 0 HD1 PHE B 70 0.666 13.434 -6.318 1.00 0.00 H new ATOM 0 HD2 PHE B 70 1.011 17.673 -6.097 1.00 0.00 H new ATOM 0 HE1 PHE B 70 0.593 13.564 -8.771 1.00 0.00 H new ATOM 0 HE2 PHE B 70 0.939 17.809 -8.550 1.00 0.00 H new ATOM 0 HZ PHE B 70 0.731 15.754 -9.891 1.00 0.00 H new ATOM 2457 N PRO B 71 4.179 16.982 -3.678 1.00 0.00 N ATOM 2458 CA PRO B 71 4.828 18.286 -3.511 1.00 0.00 C ATOM 2459 C PRO B 71 4.831 19.104 -4.798 1.00 0.00 C ATOM 2460 O PRO B 71 4.165 18.751 -5.771 1.00 0.00 O ATOM 2461 CB PRO B 71 6.257 17.916 -3.107 1.00 0.00 C ATOM 2462 CG PRO B 71 6.482 16.573 -3.707 1.00 0.00 C ATOM 2463 CD PRO B 71 5.152 15.872 -3.655 1.00 0.00 C ATOM 0 HA PRO B 71 4.310 18.910 -2.783 1.00 0.00 H new ATOM 0 HB2 PRO B 71 6.976 18.644 -3.483 1.00 0.00 H new ATOM 0 HB3 PRO B 71 6.368 17.889 -2.023 1.00 0.00 H new ATOM 0 HG2 PRO B 71 6.839 16.658 -4.733 1.00 0.00 H new ATOM 0 HG3 PRO B 71 7.238 16.018 -3.151 1.00 0.00 H new ATOM 0 HD2 PRO B 71 5.017 15.202 -4.504 1.00 0.00 H new ATOM 0 HD3 PRO B 71 5.051 15.268 -2.753 1.00 0.00 H new ATOM 2471 N ALA B 72 5.587 20.197 -4.795 1.00 0.00 N ATOM 2472 CA ALA B 72 5.678 21.065 -5.962 1.00 0.00 C ATOM 2473 C ALA B 72 7.055 21.717 -6.054 1.00 0.00 C ATOM 2474 O ALA B 72 7.642 22.096 -5.040 1.00 0.00 O ATOM 2475 CB ALA B 72 4.591 22.128 -5.915 1.00 0.00 C ATOM 0 H ALA B 72 6.145 20.502 -3.998 1.00 0.00 H new ATOM 0 HA ALA B 72 5.534 20.453 -6.852 1.00 0.00 H new ATOM 0 HB1 ALA B 72 4.671 22.769 -6.793 1.00 0.00 H new ATOM 0 HB2 ALA B 72 3.613 21.648 -5.904 1.00 0.00 H new ATOM 0 HB3 ALA B 72 4.709 22.730 -5.014 1.00 0.00 H new ATOM 2481 N LYS B 73 7.563 21.843 -7.275 1.00 0.00 N ATOM 2482 CA LYS B 73 8.872 22.448 -7.500 1.00 0.00 C ATOM 2483 C LYS B 73 9.966 21.658 -6.791 1.00 0.00 C ATOM 2484 O LYS B 73 10.127 21.840 -5.566 1.00 0.00 O ATOM 2485 CB LYS B 73 8.876 23.898 -7.013 1.00 0.00 C ATOM 2486 CG LYS B 73 8.015 24.826 -7.854 1.00 0.00 C ATOM 2487 CD LYS B 73 7.704 26.119 -7.119 1.00 0.00 C ATOM 2488 CE LYS B 73 7.635 27.301 -8.072 1.00 0.00 C ATOM 2489 NZ LYS B 73 6.230 27.643 -8.430 1.00 0.00 N ATOM 2490 OXT LYS B 73 10.652 20.863 -7.466 1.00 0.00 O ATOM 0 H LYS B 73 7.089 21.535 -8.124 1.00 0.00 H new ATOM 0 HA LYS B 73 9.074 22.431 -8.571 1.00 0.00 H new ATOM 0 HB2 LYS B 73 8.525 23.927 -5.981 1.00 0.00 H new ATOM 0 HB3 LYS B 73 9.901 24.269 -7.012 1.00 0.00 H new ATOM 0 HG2 LYS B 73 8.528 25.052 -8.788 1.00 0.00 H new ATOM 0 HG3 LYS B 73 7.084 24.322 -8.116 1.00 0.00 H new ATOM 0 HD2 LYS B 73 6.755 26.020 -6.592 1.00 0.00 H new ATOM 0 HD3 LYS B 73 8.469 26.303 -6.365 1.00 0.00 H new ATOM 0 HE2 LYS B 73 8.114 28.166 -7.613 1.00 0.00 H new ATOM 0 HE3 LYS B 73 8.195 27.070 -8.978 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 6.225 28.454 -9.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 5.781 26.826 -8.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 5.702 27.888 -7.568 1.00 0.00 H new TER 2504 LYS B 73