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: A 45 MET CE :methyl -173:sc= -1.07 (180deg=0) USER MOD Set 1.2: A 49 GLN : amide:sc= -0.971 K(o=-4.8,f=-2.2) USER MOD Set 1.3: B 45 MET CE :methyl -130:sc= -1.24 (180deg=-3.79!) USER MOD Set 1.4: B 49 GLN : amide:sc= -1.54 K(o=-4.8,f=-5.7!) USER MOD Set 2.1: A 35 MET CE :methyl -178:sc= -2.07 (180deg=-2.07) USER MOD Set 2.2: B 12 THR OG1 : rot -157:sc= 1.17 USER MOD Set 3.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 9 LYS NZ :NH3+ -136:sc= -0.259 (180deg=-1.52) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0183 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 153:sc= -0.0197 (180deg=-0.54) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 67:sc= -1.25 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= -0.49 K(o=-0.49,f=-1.3) USER MOD Single : A 23 THR OG1 : rot -67:sc= 0.158 USER MOD Single : A 25 LYS NZ :NH3+ 152:sc= -0.575 (180deg=-0.6) USER MOD Single : A 28 SER OG : rot 66:sc= 1.22 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.3!) USER MOD Single : A 36 THR OG1 : rot 85:sc= 0.0764 USER MOD Single : A 50 ASN : amide:sc= -6.29! C(o=-6.3!,f=-8.8!) USER MOD Single : A 51 LYS NZ :NH3+ -161:sc= -1.38 (180deg=-3.1!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.493 K(o=-0.49,f=-4.7!) USER MOD Single : A 59 LYS NZ :NH3+ -160:sc= -0.0918 (180deg=-0.465) USER MOD Single : A 61 LYS NZ :NH3+ -146:sc= -0.489 (180deg=-1.12) USER MOD Single : A 66 SER OG : rot -59:sc= 0.541 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 -150:sc= -0.287 (180deg=-1.48!) USER MOD Single : B 1 MET N :NH3+ 133:sc= -0.622 (180deg=-1.75!) USER MOD Single : B 4 SER OG : rot 70:sc= 1.16 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ 165:sc=-0.00417 (180deg=-0.113) USER MOD Single : B 9 LYS NZ :NH3+ -176:sc= -0.0824 (180deg=-0.123) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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= -0.337 K(o=-0.34,f=-1.1) USER MOD Single : B 23 THR OG1 : rot -56:sc= -1.66! USER MOD Single : B 25 LYS NZ :NH3+ -141:sc= -0.052 (180deg=-0.155) USER MOD Single : B 28 SER OG : rot 79:sc= 0.956 USER MOD Single : B 30 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 ASN : amide:sc= -0.319 K(o=-0.32,f=-2.6!) USER MOD Single : B 35 MET CE :methyl -123:sc= -0.695 (180deg=-3.48!) USER MOD Single : B 36 THR OG1 : rot 180:sc= 0.0583 USER MOD Single : B 50 ASN : amide:sc= -0.209 X(o=-0.21,f=-0.075) USER MOD Single : B 51 LYS NZ :NH3+ -139:sc= -1.88 (180deg=-3.21!) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= -0.107 K(o=-0.11,f=-1.8) USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0279) USER MOD Single : B 66 SER OG : rot -130:sc= 0.00239 USER MOD Single : B 67 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.106) USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.707 20.361 -12.764 1.00 0.00 N ATOM 2 CA MET A 1 -3.354 19.786 -12.544 1.00 0.00 C ATOM 3 C MET A 1 -2.639 19.533 -13.868 1.00 0.00 C ATOM 4 O MET A 1 -2.966 18.590 -14.588 1.00 0.00 O ATOM 5 CB MET A 1 -3.501 18.477 -11.765 1.00 0.00 C ATOM 6 CG MET A 1 -2.180 17.772 -11.503 1.00 0.00 C ATOM 7 SD MET A 1 -2.113 17.006 -9.872 1.00 0.00 S ATOM 8 CE MET A 1 -2.133 15.269 -10.312 1.00 0.00 C ATOM 0 H1 MET A 1 -5.169 20.522 -11.846 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.622 21.264 -13.272 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.278 19.699 -13.327 1.00 0.00 H new ATOM 0 HA MET A 1 -2.752 20.496 -11.977 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.988 18.684 -10.812 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.157 17.806 -12.319 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.022 17.009 -12.265 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.365 18.489 -11.597 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.096 14.664 -9.406 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.047 15.043 -10.862 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.269 15.042 -10.936 1.00 0.00 H new ATOM 20 N VAL A 2 -1.663 20.378 -14.180 1.00 0.00 N ATOM 21 CA VAL A 2 -0.903 20.241 -15.415 1.00 0.00 C ATOM 22 C VAL A 2 -0.199 18.889 -15.475 1.00 0.00 C ATOM 23 O VAL A 2 0.906 18.728 -14.957 1.00 0.00 O ATOM 24 CB VAL A 2 0.145 21.362 -15.560 1.00 0.00 C ATOM 25 CG1 VAL A 2 -0.538 22.711 -15.734 1.00 0.00 C ATOM 26 CG2 VAL A 2 1.079 21.381 -14.359 1.00 0.00 C ATOM 0 H VAL A 2 -1.380 21.164 -13.595 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.615 20.316 -16.237 1.00 0.00 H new ATOM 0 HB VAL A 2 0.741 21.163 -16.451 1.00 0.00 H new ATOM 0 HG11 VAL A 2 0.217 23.491 -15.835 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -1.161 22.691 -16.628 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -1.160 22.919 -14.863 1.00 0.00 H new ATOM 0 HG21 VAL A 2 1.811 22.179 -14.480 1.00 0.00 H new ATOM 0 HG22 VAL A 2 0.501 21.554 -13.451 1.00 0.00 H new ATOM 0 HG23 VAL A 2 1.595 20.424 -14.284 1.00 0.00 H new ATOM 36 N GLU A 3 -0.850 17.919 -16.108 1.00 0.00 N ATOM 37 CA GLU A 3 -0.294 16.577 -16.234 1.00 0.00 C ATOM 38 C GLU A 3 1.076 16.607 -16.902 1.00 0.00 C ATOM 39 O GLU A 3 1.285 17.322 -17.882 1.00 0.00 O ATOM 40 CB GLU A 3 -1.244 15.683 -17.034 1.00 0.00 C ATOM 41 CG GLU A 3 -0.828 14.221 -17.058 1.00 0.00 C ATOM 42 CD GLU A 3 -1.042 13.577 -18.413 1.00 0.00 C ATOM 43 OE1 GLU A 3 -0.616 14.170 -19.427 1.00 0.00 O ATOM 44 OE2 GLU A 3 -1.634 12.478 -18.463 1.00 0.00 O ATOM 0 H GLU A 3 -1.765 18.038 -16.543 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.175 16.169 -15.230 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -2.245 15.760 -16.610 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.302 16.053 -18.058 1.00 0.00 H new ATOM 0 HG2 GLU A 3 0.224 14.142 -16.784 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.395 13.673 -16.306 1.00 0.00 H new ATOM 51 N SER A 4 2.007 15.821 -16.366 1.00 0.00 N ATOM 52 CA SER A 4 3.362 15.747 -16.906 1.00 0.00 C ATOM 53 C SER A 4 4.160 17.005 -16.575 1.00 0.00 C ATOM 54 O SER A 4 5.180 16.940 -15.888 1.00 0.00 O ATOM 55 CB SER A 4 3.327 15.539 -18.424 1.00 0.00 C ATOM 56 OG SER A 4 2.329 14.600 -18.787 1.00 0.00 O ATOM 0 H SER A 4 1.846 15.224 -15.555 1.00 0.00 H new ATOM 0 HA SER A 4 3.855 14.894 -16.440 1.00 0.00 H new ATOM 0 HB2 SER A 4 3.134 16.490 -18.920 1.00 0.00 H new ATOM 0 HB3 SER A 4 4.301 15.191 -18.769 1.00 0.00 H new ATOM 0 HG SER A 4 2.326 14.486 -19.760 1.00 0.00 H new ATOM 62 N LYS A 5 3.694 18.148 -17.071 1.00 0.00 N ATOM 63 CA LYS A 5 4.368 19.422 -16.831 1.00 0.00 C ATOM 64 C LYS A 5 4.733 19.591 -15.358 1.00 0.00 C ATOM 65 O LYS A 5 5.713 20.258 -15.025 1.00 0.00 O ATOM 66 CB LYS A 5 3.480 20.584 -17.282 1.00 0.00 C ATOM 67 CG LYS A 5 2.974 20.444 -18.709 1.00 0.00 C ATOM 68 CD LYS A 5 1.469 20.647 -18.791 1.00 0.00 C ATOM 69 CE LYS A 5 0.952 20.420 -20.203 1.00 0.00 C ATOM 70 NZ LYS A 5 -0.515 20.655 -20.301 1.00 0.00 N ATOM 0 H LYS A 5 2.852 18.219 -17.642 1.00 0.00 H new ATOM 0 HA LYS A 5 5.290 19.424 -17.412 1.00 0.00 H new ATOM 0 HB2 LYS A 5 2.626 20.661 -16.608 1.00 0.00 H new ATOM 0 HB3 LYS A 5 4.041 21.515 -17.194 1.00 0.00 H new ATOM 0 HG2 LYS A 5 3.475 21.172 -19.347 1.00 0.00 H new ATOM 0 HG3 LYS A 5 3.230 19.456 -19.091 1.00 0.00 H new ATOM 0 HD2 LYS A 5 0.971 19.962 -18.105 1.00 0.00 H new ATOM 0 HD3 LYS A 5 1.219 21.658 -18.469 1.00 0.00 H new ATOM 0 HE2 LYS A 5 1.473 21.085 -20.892 1.00 0.00 H new ATOM 0 HE3 LYS A 5 1.178 19.400 -20.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.828 20.490 -21.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.014 20.003 -19.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.728 21.636 -20.030 1.00 0.00 H new ATOM 84 N LYS A 6 3.941 18.985 -14.481 1.00 0.00 N ATOM 85 CA LYS A 6 4.184 19.071 -13.047 1.00 0.00 C ATOM 86 C LYS A 6 4.154 17.689 -12.401 1.00 0.00 C ATOM 87 O LYS A 6 5.186 17.172 -11.973 1.00 0.00 O ATOM 88 CB LYS A 6 3.147 19.981 -12.384 1.00 0.00 C ATOM 89 CG LYS A 6 3.468 20.314 -10.936 1.00 0.00 C ATOM 90 CD LYS A 6 3.338 21.805 -10.663 1.00 0.00 C ATOM 91 CE LYS A 6 1.883 22.243 -10.627 1.00 0.00 C ATOM 92 NZ LYS A 6 1.656 23.482 -11.421 1.00 0.00 N ATOM 0 H LYS A 6 3.125 18.429 -14.738 1.00 0.00 H new ATOM 0 HA LYS A 6 5.177 19.496 -12.900 1.00 0.00 H new ATOM 0 HB2 LYS A 6 3.072 20.908 -12.953 1.00 0.00 H new ATOM 0 HB3 LYS A 6 2.171 19.499 -12.430 1.00 0.00 H new ATOM 0 HG2 LYS A 6 2.796 19.763 -10.278 1.00 0.00 H new ATOM 0 HG3 LYS A 6 4.482 19.988 -10.703 1.00 0.00 H new ATOM 0 HD2 LYS A 6 3.814 22.044 -9.712 1.00 0.00 H new ATOM 0 HD3 LYS A 6 3.868 22.364 -11.434 1.00 0.00 H new ATOM 0 HE2 LYS A 6 1.253 21.443 -11.015 1.00 0.00 H new ATOM 0 HE3 LYS A 6 1.581 22.414 -9.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 0.652 23.747 -11.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 2.237 24.253 -11.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 1.920 23.312 -12.412 1.00 0.00 H new ATOM 106 N ILE A 7 2.967 17.095 -12.334 1.00 0.00 N ATOM 107 CA ILE A 7 2.806 15.774 -11.740 1.00 0.00 C ATOM 108 C ILE A 7 2.242 14.782 -12.750 1.00 0.00 C ATOM 109 O ILE A 7 1.064 14.841 -13.102 1.00 0.00 O ATOM 110 CB ILE A 7 1.879 15.817 -10.511 1.00 0.00 C ATOM 111 CG1 ILE A 7 2.311 16.928 -9.552 1.00 0.00 C ATOM 112 CG2 ILE A 7 1.874 14.471 -9.802 1.00 0.00 C ATOM 113 CD1 ILE A 7 1.152 17.700 -8.961 1.00 0.00 C ATOM 0 H ILE A 7 2.103 17.508 -12.684 1.00 0.00 H new ATOM 0 HA ILE A 7 3.798 15.448 -11.427 1.00 0.00 H new ATOM 0 HB ILE A 7 0.866 16.032 -10.850 1.00 0.00 H new ATOM 0 HG12 ILE A 7 2.896 16.491 -8.743 1.00 0.00 H new ATOM 0 HG13 ILE A 7 2.966 17.620 -10.082 1.00 0.00 H new ATOM 0 HG21 ILE A 7 1.214 14.518 -8.936 1.00 0.00 H new ATOM 0 HG22 ILE A 7 1.519 13.700 -10.487 1.00 0.00 H new ATOM 0 HG23 ILE A 7 2.885 14.228 -9.475 1.00 0.00 H new ATOM 0 HD11 ILE A 7 1.532 18.471 -8.291 1.00 0.00 H new ATOM 0 HD12 ILE A 7 0.579 18.166 -9.762 1.00 0.00 H new ATOM 0 HD13 ILE A 7 0.509 17.020 -8.403 1.00 0.00 H new ATOM 125 N ALA A 8 3.089 13.868 -13.211 1.00 0.00 N ATOM 126 CA ALA A 8 2.669 12.861 -14.178 1.00 0.00 C ATOM 127 C ALA A 8 2.405 11.524 -13.493 1.00 0.00 C ATOM 128 O ALA A 8 2.603 11.384 -12.286 1.00 0.00 O ATOM 129 CB ALA A 8 3.718 12.707 -15.270 1.00 0.00 C ATOM 0 H ALA A 8 4.068 13.804 -12.931 1.00 0.00 H new ATOM 0 HA ALA A 8 1.737 13.194 -14.636 1.00 0.00 H new ATOM 0 HB1 ALA A 8 3.391 11.952 -15.985 1.00 0.00 H new ATOM 0 HB2 ALA A 8 3.851 13.659 -15.783 1.00 0.00 H new ATOM 0 HB3 ALA A 8 4.664 12.399 -14.825 1.00 0.00 H new ATOM 135 N LYS A 9 1.951 10.546 -14.268 1.00 0.00 N ATOM 136 CA LYS A 9 1.650 9.223 -13.736 1.00 0.00 C ATOM 137 C LYS A 9 1.455 8.218 -14.863 1.00 0.00 C ATOM 138 O LYS A 9 0.921 8.556 -15.919 1.00 0.00 O ATOM 139 CB LYS A 9 0.395 9.279 -12.877 1.00 0.00 C ATOM 140 CG LYS A 9 -0.781 9.826 -13.636 1.00 0.00 C ATOM 141 CD LYS A 9 -1.679 10.676 -12.753 1.00 0.00 C ATOM 142 CE LYS A 9 -0.967 11.931 -12.273 1.00 0.00 C ATOM 143 NZ LYS A 9 -0.590 11.840 -10.834 1.00 0.00 N ATOM 0 H LYS A 9 1.783 10.645 -15.269 1.00 0.00 H new ATOM 0 HA LYS A 9 2.493 8.901 -13.125 1.00 0.00 H new ATOM 0 HB2 LYS A 9 0.159 8.279 -12.514 1.00 0.00 H new ATOM 0 HB3 LYS A 9 0.582 9.900 -12.001 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -0.425 10.424 -14.475 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -1.358 9.002 -14.054 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -2.576 10.955 -13.306 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -2.004 10.090 -11.893 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -0.072 12.093 -12.873 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -1.613 12.796 -12.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -0.817 12.737 -10.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -1.119 11.066 -10.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 0.430 11.654 -10.753 1.00 0.00 H new ATOM 157 N LYS A 10 1.879 6.978 -14.635 1.00 0.00 N ATOM 158 CA LYS A 10 1.730 5.936 -15.641 1.00 0.00 C ATOM 159 C LYS A 10 1.023 4.730 -15.042 1.00 0.00 C ATOM 160 O LYS A 10 1.398 4.250 -13.977 1.00 0.00 O ATOM 161 CB LYS A 10 3.094 5.526 -16.197 1.00 0.00 C ATOM 162 CG LYS A 10 3.876 6.674 -16.813 1.00 0.00 C ATOM 163 CD LYS A 10 5.329 6.662 -16.362 1.00 0.00 C ATOM 164 CE LYS A 10 6.263 7.109 -17.476 1.00 0.00 C ATOM 165 NZ LYS A 10 5.746 8.312 -18.186 1.00 0.00 N ATOM 0 H LYS A 10 2.325 6.674 -13.769 1.00 0.00 H new ATOM 0 HA LYS A 10 1.128 6.329 -16.461 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.685 5.085 -15.394 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.951 4.751 -16.950 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.830 6.605 -17.900 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.415 7.621 -16.534 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.449 7.319 -15.500 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.602 5.658 -16.038 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.246 7.328 -17.059 1.00 0.00 H new ATOM 0 HE3 LYS A 10 6.393 6.295 -18.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.542 8.848 -18.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.108 8.016 -18.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 5.226 8.914 -17.516 1.00 0.00 H new ATOM 179 N LYS A 11 -0.005 4.236 -15.716 1.00 0.00 N ATOM 180 CA LYS A 11 -0.734 3.086 -15.205 1.00 0.00 C ATOM 181 C LYS A 11 0.190 1.885 -15.118 1.00 0.00 C ATOM 182 O LYS A 11 0.572 1.306 -16.135 1.00 0.00 O ATOM 183 CB LYS A 11 -1.932 2.764 -16.096 1.00 0.00 C ATOM 184 CG LYS A 11 -3.037 3.806 -16.031 1.00 0.00 C ATOM 185 CD LYS A 11 -2.859 4.880 -17.093 1.00 0.00 C ATOM 186 CE LYS A 11 -2.764 6.266 -16.474 1.00 0.00 C ATOM 187 NZ LYS A 11 -3.477 7.288 -17.288 1.00 0.00 N ATOM 0 H LYS A 11 -0.348 4.606 -16.602 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.104 3.326 -14.208 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -1.592 2.671 -17.128 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.340 1.796 -15.806 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.004 3.320 -16.163 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.044 4.268 -15.044 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.958 4.676 -17.671 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -3.698 4.848 -17.789 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.185 6.244 -15.469 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -1.716 6.548 -16.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.388 8.219 -16.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -3.059 7.327 -18.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -4.483 7.033 -17.362 1.00 0.00 H new ATOM 201 N THR A 12 0.557 1.523 -13.896 1.00 0.00 N ATOM 202 CA THR A 12 1.450 0.398 -13.681 1.00 0.00 C ATOM 203 C THR A 12 0.773 -0.700 -12.872 1.00 0.00 C ATOM 204 O THR A 12 -0.066 -0.423 -12.017 1.00 0.00 O ATOM 205 CB THR A 12 2.727 0.856 -12.975 1.00 0.00 C ATOM 206 OG1 THR A 12 3.328 1.932 -13.673 1.00 0.00 O ATOM 207 CG2 THR A 12 3.763 -0.240 -12.840 1.00 0.00 C ATOM 0 H THR A 12 0.250 1.991 -13.043 1.00 0.00 H new ATOM 0 HA THR A 12 1.710 -0.010 -14.658 1.00 0.00 H new ATOM 0 HB THR A 12 2.412 1.160 -11.977 1.00 0.00 H new ATOM 0 HG1 THR A 12 2.748 2.720 -13.621 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.643 0.152 -12.331 1.00 0.00 H new ATOM 0 HG22 THR A 12 3.347 -1.065 -12.262 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.046 -0.597 -13.830 1.00 0.00 H new ATOM 215 N THR A 13 1.140 -1.949 -13.146 1.00 0.00 N ATOM 216 CA THR A 13 0.555 -3.076 -12.431 1.00 0.00 C ATOM 217 C THR A 13 1.398 -3.468 -11.226 1.00 0.00 C ATOM 218 O THR A 13 2.626 -3.381 -11.246 1.00 0.00 O ATOM 219 CB THR A 13 0.381 -4.286 -13.347 1.00 0.00 C ATOM 220 OG1 THR A 13 0.211 -3.885 -14.695 1.00 0.00 O ATOM 221 CG2 THR A 13 -0.801 -5.146 -12.964 1.00 0.00 C ATOM 0 H THR A 13 1.832 -2.203 -13.851 1.00 0.00 H new ATOM 0 HA THR A 13 -0.426 -2.754 -12.083 1.00 0.00 H new ATOM 0 HB THR A 13 1.293 -4.872 -13.233 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.103 -4.678 -15.261 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.874 -5.990 -13.650 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.668 -5.515 -11.947 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.715 -4.554 -13.018 1.00 0.00 H new ATOM 229 N LEU A 14 0.713 -3.912 -10.186 1.00 0.00 N ATOM 230 CA LEU A 14 1.351 -4.344 -8.953 1.00 0.00 C ATOM 231 C LEU A 14 0.692 -5.632 -8.489 1.00 0.00 C ATOM 232 O LEU A 14 -0.512 -5.651 -8.243 1.00 0.00 O ATOM 233 CB LEU A 14 1.203 -3.259 -7.880 1.00 0.00 C ATOM 234 CG LEU A 14 2.510 -2.729 -7.294 1.00 0.00 C ATOM 235 CD1 LEU A 14 3.169 -3.785 -6.422 1.00 0.00 C ATOM 236 CD2 LEU A 14 3.450 -2.280 -8.401 1.00 0.00 C ATOM 0 H LEU A 14 -0.304 -3.983 -10.172 1.00 0.00 H new ATOM 0 HA LEU A 14 2.413 -4.516 -9.125 1.00 0.00 H new ATOM 0 HB2 LEU A 14 0.652 -2.422 -8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.596 -3.657 -7.067 1.00 0.00 H new ATOM 0 HG LEU A 14 2.283 -1.864 -6.671 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.099 -3.390 -6.013 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.498 -4.053 -5.606 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.383 -4.670 -7.021 1.00 0.00 H new ATOM 0 HD21 LEU A 14 4.375 -1.906 -7.963 1.00 0.00 H new ATOM 0 HD22 LEU A 14 3.673 -3.124 -9.054 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.977 -1.488 -8.981 1.00 0.00 H new ATOM 248 N ALA A 15 1.453 -6.718 -8.388 1.00 0.00 N ATOM 249 CA ALA A 15 0.850 -7.976 -7.979 1.00 0.00 C ATOM 250 C ALA A 15 0.818 -8.126 -6.471 1.00 0.00 C ATOM 251 O ALA A 15 1.752 -8.640 -5.859 1.00 0.00 O ATOM 252 CB ALA A 15 1.585 -9.150 -8.608 1.00 0.00 C ATOM 0 H ALA A 15 2.455 -6.752 -8.577 1.00 0.00 H new ATOM 0 HA ALA A 15 -0.181 -7.970 -8.332 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.120 -10.083 -8.290 1.00 0.00 H new ATOM 0 HB2 ALA A 15 1.535 -9.071 -9.694 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.628 -9.138 -8.291 1.00 0.00 H new ATOM 258 N PHE A 16 -0.302 -7.710 -5.898 1.00 0.00 N ATOM 259 CA PHE A 16 -0.547 -7.815 -4.475 1.00 0.00 C ATOM 260 C PHE A 16 -2.017 -7.663 -4.196 1.00 0.00 C ATOM 261 O PHE A 16 -2.801 -7.346 -5.084 1.00 0.00 O ATOM 262 CB PHE A 16 0.226 -6.783 -3.666 1.00 0.00 C ATOM 263 CG PHE A 16 1.715 -6.917 -3.791 1.00 0.00 C ATOM 264 CD1 PHE A 16 2.424 -7.718 -2.913 1.00 0.00 C ATOM 265 CD2 PHE A 16 2.403 -6.251 -4.791 1.00 0.00 C ATOM 266 CE1 PHE A 16 3.794 -7.855 -3.029 1.00 0.00 C ATOM 267 CE2 PHE A 16 3.774 -6.383 -4.912 1.00 0.00 C ATOM 268 CZ PHE A 16 4.469 -7.187 -4.031 1.00 0.00 C ATOM 0 H PHE A 16 -1.071 -7.286 -6.417 1.00 0.00 H new ATOM 0 HA PHE A 16 -0.199 -8.801 -4.167 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.069 -5.785 -3.989 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -0.052 -6.874 -2.616 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.900 -8.242 -2.128 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.863 -5.622 -5.484 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.336 -8.483 -2.337 1.00 0.00 H new ATOM 0 HE2 PHE A 16 4.301 -5.858 -5.695 1.00 0.00 H new ATOM 0 HZ PHE A 16 5.540 -7.293 -4.126 1.00 0.00 H new ATOM 278 N ASP A 17 -2.370 -7.856 -2.951 1.00 0.00 N ATOM 279 CA ASP A 17 -3.735 -7.708 -2.499 1.00 0.00 C ATOM 280 C ASP A 17 -3.932 -8.510 -1.255 1.00 0.00 C ATOM 281 O ASP A 17 -4.591 -8.077 -0.315 1.00 0.00 O ATOM 282 CB ASP A 17 -4.750 -8.135 -3.546 1.00 0.00 C ATOM 283 CG ASP A 17 -5.341 -6.956 -4.295 1.00 0.00 C ATOM 284 OD1 ASP A 17 -6.463 -7.092 -4.828 1.00 0.00 O ATOM 285 OD2 ASP A 17 -4.683 -5.896 -4.347 1.00 0.00 O ATOM 0 H ASP A 17 -1.716 -8.122 -2.215 1.00 0.00 H new ATOM 0 HA ASP A 17 -3.901 -6.648 -2.305 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.273 -8.810 -4.256 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.552 -8.694 -3.064 1.00 0.00 H new ATOM 290 N GLU A 18 -3.346 -9.683 -1.233 1.00 0.00 N ATOM 291 CA GLU A 18 -3.474 -10.514 -0.066 1.00 0.00 C ATOM 292 C GLU A 18 -3.155 -9.690 1.181 1.00 0.00 C ATOM 293 O GLU A 18 -4.023 -9.441 2.026 1.00 0.00 O ATOM 294 CB GLU A 18 -2.554 -11.731 -0.153 1.00 0.00 C ATOM 295 CG GLU A 18 -2.646 -12.651 1.052 1.00 0.00 C ATOM 296 CD GLU A 18 -1.678 -12.267 2.153 1.00 0.00 C ATOM 297 OE1 GLU A 18 -0.544 -11.854 1.831 1.00 0.00 O ATOM 298 OE2 GLU A 18 -2.053 -12.381 3.340 1.00 0.00 O ATOM 0 H GLU A 18 -2.789 -10.075 -1.992 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.499 -10.879 -0.006 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.799 -12.297 -1.051 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -1.524 -11.390 -0.262 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -3.663 -12.630 1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.446 -13.676 0.738 1.00 0.00 H new ATOM 305 N ASP A 19 -1.910 -9.233 1.266 1.00 0.00 N ATOM 306 CA ASP A 19 -1.480 -8.418 2.395 1.00 0.00 C ATOM 307 C ASP A 19 -1.794 -6.949 2.171 1.00 0.00 C ATOM 308 O ASP A 19 -2.318 -6.279 3.060 1.00 0.00 O ATOM 309 CB ASP A 19 0.018 -8.602 2.647 1.00 0.00 C ATOM 310 CG ASP A 19 0.367 -8.546 4.122 1.00 0.00 C ATOM 311 OD1 ASP A 19 1.310 -9.252 4.536 1.00 0.00 O ATOM 312 OD2 ASP A 19 -0.303 -7.795 4.863 1.00 0.00 O ATOM 0 H ASP A 19 -1.185 -9.412 0.571 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.033 -8.751 3.273 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.338 -9.560 2.237 1.00 0.00 H new ATOM 0 HB3 ASP A 19 0.571 -7.827 2.116 1.00 0.00 H new ATOM 317 N VAL A 20 -1.474 -6.444 0.987 1.00 0.00 N ATOM 318 CA VAL A 20 -1.735 -5.048 0.685 1.00 0.00 C ATOM 319 C VAL A 20 -3.231 -4.752 0.747 1.00 0.00 C ATOM 320 O VAL A 20 -3.636 -3.783 1.372 1.00 0.00 O ATOM 321 CB VAL A 20 -1.163 -4.626 -0.685 1.00 0.00 C ATOM 322 CG1 VAL A 20 0.282 -5.075 -0.814 1.00 0.00 C ATOM 323 CG2 VAL A 20 -1.989 -5.194 -1.817 1.00 0.00 C ATOM 0 H VAL A 20 -1.039 -6.973 0.231 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.223 -4.459 1.446 1.00 0.00 H new ATOM 0 HB VAL A 20 -1.203 -3.539 -0.747 1.00 0.00 H new ATOM 0 HG11 VAL A 20 0.672 -4.771 -1.785 1.00 0.00 H new ATOM 0 HG12 VAL A 20 0.877 -4.617 -0.024 1.00 0.00 H new ATOM 0 HG13 VAL A 20 0.335 -6.160 -0.726 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -1.564 -4.881 -2.770 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.987 -6.282 -1.758 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.013 -4.829 -1.739 1.00 0.00 H new ATOM 333 N TYR A 21 -4.057 -5.597 0.123 1.00 0.00 N ATOM 334 CA TYR A 21 -5.502 -5.379 0.162 1.00 0.00 C ATOM 335 C TYR A 21 -6.011 -5.488 1.592 1.00 0.00 C ATOM 336 O TYR A 21 -6.794 -4.649 2.036 1.00 0.00 O ATOM 337 CB TYR A 21 -6.269 -6.352 -0.746 1.00 0.00 C ATOM 338 CG TYR A 21 -7.576 -5.791 -1.259 1.00 0.00 C ATOM 339 CD1 TYR A 21 -7.596 -4.827 -2.259 1.00 0.00 C ATOM 340 CD2 TYR A 21 -8.789 -6.227 -0.742 1.00 0.00 C ATOM 341 CE1 TYR A 21 -8.789 -4.313 -2.730 1.00 0.00 C ATOM 342 CE2 TYR A 21 -9.987 -5.718 -1.208 1.00 0.00 C ATOM 343 CZ TYR A 21 -9.981 -4.762 -2.202 1.00 0.00 C ATOM 344 OH TYR A 21 -11.172 -4.253 -2.668 1.00 0.00 O ATOM 0 H TYR A 21 -3.758 -6.418 -0.403 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.684 -4.373 -0.217 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -5.639 -6.619 -1.594 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -6.468 -7.271 -0.195 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -6.664 -4.474 -2.675 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -8.797 -6.976 0.036 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.788 -3.564 -3.508 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -10.922 -6.067 -0.796 1.00 0.00 H new ATOM 0 HH TYR A 21 -11.917 -4.676 -2.192 1.00 0.00 H new ATOM 354 N HIS A 22 -5.562 -6.511 2.328 1.00 0.00 N ATOM 355 CA HIS A 22 -5.997 -6.662 3.710 1.00 0.00 C ATOM 356 C HIS A 22 -5.506 -5.485 4.542 1.00 0.00 C ATOM 357 O HIS A 22 -6.277 -4.876 5.281 1.00 0.00 O ATOM 358 CB HIS A 22 -5.494 -7.981 4.299 1.00 0.00 C ATOM 359 CG HIS A 22 -6.139 -8.339 5.601 1.00 0.00 C ATOM 360 ND1 HIS A 22 -6.118 -7.512 6.705 1.00 0.00 N ATOM 361 CD2 HIS A 22 -6.827 -9.444 5.976 1.00 0.00 C ATOM 362 CE1 HIS A 22 -6.764 -8.092 7.701 1.00 0.00 C ATOM 363 NE2 HIS A 22 -7.204 -9.264 7.284 1.00 0.00 N ATOM 0 H HIS A 22 -4.915 -7.226 1.996 1.00 0.00 H new ATOM 0 HA HIS A 22 -7.087 -6.678 3.730 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -5.674 -8.782 3.582 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -4.415 -7.918 4.443 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.039 -10.306 5.361 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -6.907 -7.678 8.688 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -7.738 -9.929 7.843 1.00 0.00 H new ATOM 372 N THR A 23 -4.227 -5.148 4.404 1.00 0.00 N ATOM 373 CA THR A 23 -3.671 -4.020 5.138 1.00 0.00 C ATOM 374 C THR A 23 -4.313 -2.727 4.655 1.00 0.00 C ATOM 375 O THR A 23 -4.661 -1.858 5.452 1.00 0.00 O ATOM 376 CB THR A 23 -2.159 -3.939 4.970 1.00 0.00 C ATOM 377 OG1 THR A 23 -1.810 -3.768 3.607 1.00 0.00 O ATOM 378 CG2 THR A 23 -1.432 -5.161 5.486 1.00 0.00 C ATOM 0 H THR A 23 -3.565 -5.634 3.799 1.00 0.00 H new ATOM 0 HA THR A 23 -3.886 -4.165 6.197 1.00 0.00 H new ATOM 0 HB THR A 23 -1.850 -3.078 5.563 1.00 0.00 H new ATOM 0 HG1 THR A 23 -2.036 -4.580 3.107 1.00 0.00 H new ATOM 0 HG21 THR A 23 -0.360 -5.037 5.335 1.00 0.00 H new ATOM 0 HG22 THR A 23 -1.637 -5.284 6.549 1.00 0.00 H new ATOM 0 HG23 THR A 23 -1.775 -6.043 4.946 1.00 0.00 H new ATOM 386 N LEU A 24 -4.501 -2.618 3.341 1.00 0.00 N ATOM 387 CA LEU A 24 -5.140 -1.443 2.763 1.00 0.00 C ATOM 388 C LEU A 24 -6.517 -1.257 3.389 1.00 0.00 C ATOM 389 O LEU A 24 -7.097 -0.177 3.327 1.00 0.00 O ATOM 390 CB LEU A 24 -5.275 -1.577 1.238 1.00 0.00 C ATOM 391 CG LEU A 24 -4.245 -0.794 0.410 1.00 0.00 C ATOM 392 CD1 LEU A 24 -4.105 0.630 0.921 1.00 0.00 C ATOM 393 CD2 LEU A 24 -2.895 -1.492 0.416 1.00 0.00 C ATOM 0 H LEU A 24 -4.221 -3.326 2.662 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.517 -0.573 2.971 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.199 -2.632 0.976 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.273 -1.248 0.949 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.607 -0.757 -0.617 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.370 1.162 0.318 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.067 1.138 0.852 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.777 0.613 1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.185 -0.916 -0.178 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.531 -1.572 1.440 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.999 -2.490 -0.010 1.00 0.00 H new ATOM 405 N LYS A 25 -7.034 -2.328 3.993 1.00 0.00 N ATOM 406 CA LYS A 25 -8.338 -2.288 4.626 1.00 0.00 C ATOM 407 C LYS A 25 -8.352 -1.359 5.833 1.00 0.00 C ATOM 408 O LYS A 25 -9.228 -0.502 5.946 1.00 0.00 O ATOM 409 CB LYS A 25 -8.778 -3.690 5.045 1.00 0.00 C ATOM 410 CG LYS A 25 -10.235 -3.765 5.469 1.00 0.00 C ATOM 411 CD LYS A 25 -10.382 -3.648 6.977 1.00 0.00 C ATOM 412 CE LYS A 25 -11.799 -3.264 7.370 1.00 0.00 C ATOM 413 NZ LYS A 25 -12.100 -1.842 7.048 1.00 0.00 N ATOM 0 H LYS A 25 -6.563 -3.231 4.053 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.041 -1.897 3.890 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.613 -4.377 4.215 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.150 -4.029 5.869 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.798 -2.967 4.984 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.665 -4.708 5.132 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.118 -4.597 7.444 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.683 -2.902 7.355 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.507 -3.911 6.852 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.937 -3.431 8.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.119 -1.734 6.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.820 -1.238 7.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -11.571 -1.559 6.198 1.00 0.00 H new ATOM 427 N LEU A 26 -7.389 -1.520 6.739 1.00 0.00 N ATOM 428 CA LEU A 26 -7.342 -0.666 7.922 1.00 0.00 C ATOM 429 C LEU A 26 -6.990 0.760 7.523 1.00 0.00 C ATOM 430 O LEU A 26 -7.612 1.713 7.984 1.00 0.00 O ATOM 431 CB LEU A 26 -6.364 -1.202 8.970 1.00 0.00 C ATOM 432 CG LEU A 26 -4.993 -1.586 8.439 1.00 0.00 C ATOM 433 CD1 LEU A 26 -4.113 -0.356 8.320 1.00 0.00 C ATOM 434 CD2 LEU A 26 -4.344 -2.631 9.335 1.00 0.00 C ATOM 0 H LEU A 26 -6.647 -2.217 6.679 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.331 -0.668 8.380 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.237 -0.446 9.745 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.809 -2.076 9.446 1.00 0.00 H new ATOM 0 HG LEU A 26 -5.113 -2.021 7.447 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -3.134 -0.645 7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -4.574 0.356 7.635 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.999 0.106 9.301 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.363 -2.893 8.938 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.232 -2.228 10.342 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.971 -3.522 9.368 1.00 0.00 H new ATOM 446 N VAL A 27 -6.011 0.892 6.641 1.00 0.00 N ATOM 447 CA VAL A 27 -5.592 2.203 6.150 1.00 0.00 C ATOM 448 C VAL A 27 -6.701 2.858 5.353 1.00 0.00 C ATOM 449 O VAL A 27 -6.958 4.047 5.500 1.00 0.00 O ATOM 450 CB VAL A 27 -4.338 2.124 5.263 1.00 0.00 C ATOM 451 CG1 VAL A 27 -3.101 2.537 6.038 1.00 0.00 C ATOM 452 CG2 VAL A 27 -4.167 0.749 4.700 1.00 0.00 C ATOM 0 H VAL A 27 -5.489 0.109 6.248 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.358 2.797 7.033 1.00 0.00 H new ATOM 0 HB VAL A 27 -4.471 2.819 4.434 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.227 2.473 5.390 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.217 3.562 6.390 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.968 1.873 6.892 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -3.273 0.720 4.077 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -4.065 0.032 5.515 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.038 0.492 4.098 1.00 0.00 H new ATOM 462 N SER A 28 -7.358 2.091 4.500 1.00 0.00 N ATOM 463 CA SER A 28 -8.425 2.650 3.694 1.00 0.00 C ATOM 464 C SER A 28 -9.569 3.141 4.572 1.00 0.00 C ATOM 465 O SER A 28 -10.190 4.165 4.280 1.00 0.00 O ATOM 466 CB SER A 28 -8.938 1.633 2.672 1.00 0.00 C ATOM 467 OG SER A 28 -10.113 2.101 2.033 1.00 0.00 O ATOM 0 H SER A 28 -7.175 1.099 4.350 1.00 0.00 H new ATOM 0 HA SER A 28 -8.016 3.502 3.150 1.00 0.00 H new ATOM 0 HB2 SER A 28 -8.166 1.441 1.926 1.00 0.00 H new ATOM 0 HB3 SER A 28 -9.144 0.685 3.169 1.00 0.00 H new ATOM 0 HG SER A 28 -9.899 2.889 1.491 1.00 0.00 H new ATOM 473 N VAL A 29 -9.833 2.414 5.653 1.00 0.00 N ATOM 474 CA VAL A 29 -10.890 2.778 6.579 1.00 0.00 C ATOM 475 C VAL A 29 -10.421 3.898 7.498 1.00 0.00 C ATOM 476 O VAL A 29 -11.111 4.902 7.683 1.00 0.00 O ATOM 477 CB VAL A 29 -11.329 1.545 7.407 1.00 0.00 C ATOM 478 CG1 VAL A 29 -11.022 1.707 8.888 1.00 0.00 C ATOM 479 CG2 VAL A 29 -12.805 1.250 7.191 1.00 0.00 C ATOM 0 H VAL A 29 -9.325 1.567 5.907 1.00 0.00 H new ATOM 0 HA VAL A 29 -11.748 3.133 6.009 1.00 0.00 H new ATOM 0 HB VAL A 29 -10.747 0.695 7.051 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.348 0.817 9.427 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -9.949 1.841 9.025 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -11.549 2.579 9.276 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.092 0.380 7.782 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.397 2.111 7.501 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.985 1.047 6.135 1.00 0.00 H new ATOM 489 N TYR A 30 -9.241 3.711 8.071 1.00 0.00 N ATOM 490 CA TYR A 30 -8.666 4.695 8.978 1.00 0.00 C ATOM 491 C TYR A 30 -8.232 5.951 8.229 1.00 0.00 C ATOM 492 O TYR A 30 -8.167 7.032 8.815 1.00 0.00 O ATOM 493 CB TYR A 30 -7.473 4.105 9.735 1.00 0.00 C ATOM 494 CG TYR A 30 -7.855 3.415 11.026 1.00 0.00 C ATOM 495 CD1 TYR A 30 -8.028 4.140 12.198 1.00 0.00 C ATOM 496 CD2 TYR A 30 -8.040 2.038 11.074 1.00 0.00 C ATOM 497 CE1 TYR A 30 -8.376 3.516 13.380 1.00 0.00 C ATOM 498 CE2 TYR A 30 -8.388 1.406 12.252 1.00 0.00 C ATOM 499 CZ TYR A 30 -8.555 2.149 13.402 1.00 0.00 C ATOM 500 OH TYR A 30 -8.902 1.524 14.578 1.00 0.00 O ATOM 0 H TYR A 30 -8.661 2.885 7.924 1.00 0.00 H new ATOM 0 HA TYR A 30 -9.440 4.970 9.695 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.961 3.392 9.089 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.763 4.902 9.955 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -7.888 5.211 12.185 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -7.910 1.453 10.176 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -8.507 4.095 14.282 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -8.529 0.335 12.272 1.00 0.00 H new ATOM 0 HH TYR A 30 -8.990 0.560 14.423 1.00 0.00 H new ATOM 510 N LEU A 31 -7.935 5.817 6.936 1.00 0.00 N ATOM 511 CA LEU A 31 -7.514 6.964 6.146 1.00 0.00 C ATOM 512 C LEU A 31 -8.619 7.391 5.184 1.00 0.00 C ATOM 513 O LEU A 31 -8.465 8.368 4.452 1.00 0.00 O ATOM 514 CB LEU A 31 -6.234 6.651 5.352 1.00 0.00 C ATOM 515 CG LEU A 31 -5.097 5.931 6.107 1.00 0.00 C ATOM 516 CD1 LEU A 31 -3.754 6.555 5.760 1.00 0.00 C ATOM 517 CD2 LEU A 31 -5.308 5.951 7.616 1.00 0.00 C ATOM 0 H LEU A 31 -7.978 4.936 6.423 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.306 7.780 6.838 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -6.510 6.040 4.493 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.840 7.589 4.962 1.00 0.00 H new ATOM 0 HG LEU A 31 -5.106 4.889 5.787 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.962 6.037 6.300 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.579 6.469 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.758 7.608 6.043 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -4.483 5.433 8.106 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.346 6.983 7.964 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -6.246 5.451 7.859 1.00 0.00 H new ATOM 529 N ASN A 32 -9.730 6.647 5.174 1.00 0.00 N ATOM 530 CA ASN A 32 -10.841 6.955 4.282 1.00 0.00 C ATOM 531 C ASN A 32 -10.319 7.178 2.870 1.00 0.00 C ATOM 532 O ASN A 32 -10.828 8.014 2.124 1.00 0.00 O ATOM 533 CB ASN A 32 -11.593 8.195 4.774 1.00 0.00 C ATOM 534 CG ASN A 32 -13.030 7.890 5.147 1.00 0.00 C ATOM 535 OD1 ASN A 32 -13.356 6.771 5.544 1.00 0.00 O ATOM 536 ND2 ASN A 32 -13.898 8.886 5.020 1.00 0.00 N ATOM 0 H ASN A 32 -9.879 5.834 5.771 1.00 0.00 H new ATOM 0 HA ASN A 32 -11.534 6.114 4.276 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -11.076 8.610 5.639 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -11.577 8.959 3.996 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -14.880 8.740 5.255 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -13.583 9.797 4.687 1.00 0.00 H new ATOM 543 N ARG A 33 -9.274 6.431 2.526 1.00 0.00 N ATOM 544 CA ARG A 33 -8.644 6.549 1.218 1.00 0.00 C ATOM 545 C ARG A 33 -8.768 5.261 0.417 1.00 0.00 C ATOM 546 O ARG A 33 -9.158 4.220 0.946 1.00 0.00 O ATOM 547 CB ARG A 33 -7.162 6.902 1.388 1.00 0.00 C ATOM 548 CG ARG A 33 -6.933 8.245 2.064 1.00 0.00 C ATOM 549 CD ARG A 33 -5.816 9.027 1.392 1.00 0.00 C ATOM 550 NE ARG A 33 -5.785 10.421 1.831 1.00 0.00 N ATOM 551 CZ ARG A 33 -5.086 11.375 1.219 1.00 0.00 C ATOM 552 NH1 ARG A 33 -4.357 11.090 0.147 1.00 0.00 N ATOM 553 NH2 ARG A 33 -5.116 12.618 1.682 1.00 0.00 N ATOM 0 H ARG A 33 -8.846 5.736 3.138 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.157 7.340 0.671 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -6.675 6.122 1.973 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -6.684 6.911 0.409 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -7.853 8.828 2.037 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.687 8.087 3.114 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.859 8.555 1.614 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -5.947 8.990 0.311 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.330 10.678 2.654 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -4.330 10.136 -0.212 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -3.824 11.825 -0.317 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -5.674 12.842 2.506 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.581 13.350 1.214 1.00 0.00 H new ATOM 567 N ASP A 34 -8.404 5.335 -0.857 1.00 0.00 N ATOM 568 CA ASP A 34 -8.441 4.173 -1.731 1.00 0.00 C ATOM 569 C ASP A 34 -7.110 3.440 -1.646 1.00 0.00 C ATOM 570 O ASP A 34 -6.094 4.035 -1.288 1.00 0.00 O ATOM 571 CB ASP A 34 -8.724 4.593 -3.175 1.00 0.00 C ATOM 572 CG ASP A 34 -9.588 3.588 -3.912 1.00 0.00 C ATOM 573 OD1 ASP A 34 -10.434 4.015 -4.724 1.00 0.00 O ATOM 574 OD2 ASP A 34 -9.416 2.372 -3.677 1.00 0.00 O ATOM 0 H ASP A 34 -8.079 6.191 -1.307 1.00 0.00 H new ATOM 0 HA ASP A 34 -9.243 3.509 -1.409 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.219 5.564 -3.177 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -7.780 4.715 -3.706 1.00 0.00 H new ATOM 579 N MET A 35 -7.107 2.153 -1.968 1.00 0.00 N ATOM 580 CA MET A 35 -5.890 1.367 -1.911 1.00 0.00 C ATOM 581 C MET A 35 -4.789 2.026 -2.743 1.00 0.00 C ATOM 582 O MET A 35 -3.632 2.075 -2.329 1.00 0.00 O ATOM 583 CB MET A 35 -6.175 -0.059 -2.391 1.00 0.00 C ATOM 584 CG MET A 35 -5.115 -0.619 -3.315 1.00 0.00 C ATOM 585 SD MET A 35 -5.340 -2.373 -3.662 1.00 0.00 S ATOM 586 CE MET A 35 -3.662 -2.972 -3.481 1.00 0.00 C ATOM 0 H MET A 35 -7.933 1.636 -2.270 1.00 0.00 H new ATOM 0 HA MET A 35 -5.539 1.319 -0.880 1.00 0.00 H new ATOM 0 HB2 MET A 35 -6.268 -0.712 -1.523 1.00 0.00 H new ATOM 0 HB3 MET A 35 -7.136 -0.073 -2.906 1.00 0.00 H new ATOM 0 HG2 MET A 35 -5.128 -0.064 -4.253 1.00 0.00 H new ATOM 0 HG3 MET A 35 -4.133 -0.466 -2.868 1.00 0.00 H new ATOM 0 HE1 MET A 35 -3.631 -4.039 -3.701 1.00 0.00 H new ATOM 0 HE2 MET A 35 -3.009 -2.440 -4.173 1.00 0.00 H new ATOM 0 HE3 MET A 35 -3.323 -2.802 -2.459 1.00 0.00 H new ATOM 596 N THR A 36 -5.161 2.544 -3.910 1.00 0.00 N ATOM 597 CA THR A 36 -4.202 3.210 -4.782 1.00 0.00 C ATOM 598 C THR A 36 -3.788 4.547 -4.177 1.00 0.00 C ATOM 599 O THR A 36 -2.647 4.975 -4.323 1.00 0.00 O ATOM 600 CB THR A 36 -4.797 3.423 -6.182 1.00 0.00 C ATOM 601 OG1 THR A 36 -6.004 2.698 -6.332 1.00 0.00 O ATOM 602 CG2 THR A 36 -3.875 3.013 -7.314 1.00 0.00 C ATOM 0 H THR A 36 -6.114 2.515 -4.271 1.00 0.00 H new ATOM 0 HA THR A 36 -3.321 2.575 -4.877 1.00 0.00 H new ATOM 0 HB THR A 36 -4.964 4.498 -6.251 1.00 0.00 H new ATOM 0 HG1 THR A 36 -6.749 3.227 -5.978 1.00 0.00 H new ATOM 0 HG21 THR A 36 -4.368 3.195 -8.269 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.956 3.596 -7.264 1.00 0.00 H new ATOM 0 HG23 THR A 36 -3.638 1.953 -7.224 1.00 0.00 H new ATOM 610 N GLU A 37 -4.721 5.193 -3.484 1.00 0.00 N ATOM 611 CA GLU A 37 -4.445 6.473 -2.842 1.00 0.00 C ATOM 612 C GLU A 37 -3.536 6.267 -1.634 1.00 0.00 C ATOM 613 O GLU A 37 -2.598 7.028 -1.410 1.00 0.00 O ATOM 614 CB GLU A 37 -5.748 7.148 -2.408 1.00 0.00 C ATOM 615 CG GLU A 37 -5.614 8.647 -2.193 1.00 0.00 C ATOM 616 CD GLU A 37 -5.556 9.420 -3.497 1.00 0.00 C ATOM 617 OE1 GLU A 37 -6.299 10.415 -3.631 1.00 0.00 O ATOM 618 OE2 GLU A 37 -4.765 9.032 -4.383 1.00 0.00 O ATOM 0 H GLU A 37 -5.673 4.851 -3.353 1.00 0.00 H new ATOM 0 HA GLU A 37 -3.942 7.120 -3.561 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.512 6.965 -3.164 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -6.096 6.686 -1.484 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -6.458 9.002 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -4.712 8.848 -1.615 1.00 0.00 H new ATOM 625 N ILE A 38 -3.821 5.219 -0.871 1.00 0.00 N ATOM 626 CA ILE A 38 -3.033 4.882 0.308 1.00 0.00 C ATOM 627 C ILE A 38 -1.635 4.424 -0.100 1.00 0.00 C ATOM 628 O ILE A 38 -0.633 4.906 0.427 1.00 0.00 O ATOM 629 CB ILE A 38 -3.700 3.742 1.102 1.00 0.00 C ATOM 630 CG1 ILE A 38 -4.917 4.232 1.892 1.00 0.00 C ATOM 631 CG2 ILE A 38 -2.718 3.076 2.046 1.00 0.00 C ATOM 632 CD1 ILE A 38 -6.181 3.470 1.571 1.00 0.00 C ATOM 0 H ILE A 38 -4.598 4.583 -1.050 1.00 0.00 H new ATOM 0 HA ILE A 38 -2.969 5.776 0.928 1.00 0.00 H new ATOM 0 HB ILE A 38 -4.037 3.011 0.367 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -4.709 4.145 2.958 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -5.075 5.290 1.683 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -3.221 2.277 2.590 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -1.889 2.659 1.474 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -2.337 3.812 2.753 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -7.005 3.866 2.164 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.412 3.578 0.511 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -6.039 2.415 1.806 1.00 0.00 H new ATOM 644 N ILE A 39 -1.575 3.482 -1.039 1.00 0.00 N ATOM 645 CA ILE A 39 -0.299 2.962 -1.505 1.00 0.00 C ATOM 646 C ILE A 39 0.480 4.044 -2.233 1.00 0.00 C ATOM 647 O ILE A 39 1.711 4.071 -2.199 1.00 0.00 O ATOM 648 CB ILE A 39 -0.486 1.755 -2.445 1.00 0.00 C ATOM 649 CG1 ILE A 39 -1.149 2.204 -3.748 1.00 0.00 C ATOM 650 CG2 ILE A 39 -1.308 0.669 -1.767 1.00 0.00 C ATOM 651 CD1 ILE A 39 -0.183 2.324 -4.906 1.00 0.00 C ATOM 0 H ILE A 39 -2.392 3.068 -1.488 1.00 0.00 H new ATOM 0 HA ILE A 39 0.256 2.634 -0.626 1.00 0.00 H new ATOM 0 HB ILE A 39 0.494 1.338 -2.679 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -1.933 1.494 -4.011 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -1.633 3.167 -3.587 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.429 -0.174 -2.447 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.797 0.336 -0.864 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -2.288 1.066 -1.504 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.722 2.646 -5.797 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.587 3.056 -4.663 1.00 0.00 H new ATOM 0 HD13 ILE A 39 0.282 1.356 -5.093 1.00 0.00 H new ATOM 663 N GLU A 40 -0.247 4.938 -2.894 1.00 0.00 N ATOM 664 CA GLU A 40 0.380 6.018 -3.628 1.00 0.00 C ATOM 665 C GLU A 40 0.695 7.183 -2.704 1.00 0.00 C ATOM 666 O GLU A 40 1.638 7.934 -2.948 1.00 0.00 O ATOM 667 CB GLU A 40 -0.505 6.492 -4.780 1.00 0.00 C ATOM 668 CG GLU A 40 0.116 7.616 -5.596 1.00 0.00 C ATOM 669 CD GLU A 40 -0.626 8.929 -5.438 1.00 0.00 C ATOM 670 OE1 GLU A 40 0.044 9.975 -5.304 1.00 0.00 O ATOM 671 OE2 GLU A 40 -1.874 8.911 -5.449 1.00 0.00 O ATOM 0 H GLU A 40 -1.266 4.932 -2.934 1.00 0.00 H new ATOM 0 HA GLU A 40 1.311 5.635 -4.045 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -0.715 5.649 -5.438 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.461 6.829 -4.379 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.154 7.750 -5.292 1.00 0.00 H new ATOM 0 HG3 GLU A 40 0.127 7.333 -6.649 1.00 0.00 H new ATOM 678 N GLU A 41 -0.078 7.327 -1.631 1.00 0.00 N ATOM 679 CA GLU A 41 0.180 8.407 -0.688 1.00 0.00 C ATOM 680 C GLU A 41 1.245 7.973 0.310 1.00 0.00 C ATOM 681 O GLU A 41 2.053 8.781 0.774 1.00 0.00 O ATOM 682 CB GLU A 41 -1.103 8.837 0.034 1.00 0.00 C ATOM 683 CG GLU A 41 -1.593 7.846 1.076 1.00 0.00 C ATOM 684 CD GLU A 41 -1.377 8.336 2.495 1.00 0.00 C ATOM 685 OE1 GLU A 41 -1.174 7.489 3.391 1.00 0.00 O ATOM 686 OE2 GLU A 41 -1.409 9.565 2.710 1.00 0.00 O ATOM 0 H GLU A 41 -0.868 6.726 -1.397 1.00 0.00 H new ATOM 0 HA GLU A 41 0.544 9.272 -1.243 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.930 9.799 0.517 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.889 8.988 -0.705 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.655 7.655 0.919 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.075 6.897 0.941 1.00 0.00 H new ATOM 693 N ALA A 42 1.251 6.680 0.622 1.00 0.00 N ATOM 694 CA ALA A 42 2.223 6.134 1.556 1.00 0.00 C ATOM 695 C ALA A 42 3.584 5.982 0.890 1.00 0.00 C ATOM 696 O ALA A 42 4.616 6.266 1.499 1.00 0.00 O ATOM 697 CB ALA A 42 1.745 4.796 2.100 1.00 0.00 C ATOM 0 H ALA A 42 0.596 5.996 0.242 1.00 0.00 H new ATOM 0 HA ALA A 42 2.325 6.830 2.388 1.00 0.00 H new ATOM 0 HB1 ALA A 42 2.484 4.402 2.797 1.00 0.00 H new ATOM 0 HB2 ALA A 42 0.795 4.932 2.617 1.00 0.00 H new ATOM 0 HB3 ALA A 42 1.613 4.095 1.276 1.00 0.00 H new ATOM 703 N VAL A 43 3.583 5.543 -0.366 1.00 0.00 N ATOM 704 CA VAL A 43 4.827 5.369 -1.109 1.00 0.00 C ATOM 705 C VAL A 43 5.665 6.628 -1.044 1.00 0.00 C ATOM 706 O VAL A 43 6.783 6.630 -0.529 1.00 0.00 O ATOM 707 CB VAL A 43 4.569 5.033 -2.598 1.00 0.00 C ATOM 708 CG1 VAL A 43 3.510 5.928 -3.197 1.00 0.00 C ATOM 709 CG2 VAL A 43 5.847 5.147 -3.409 1.00 0.00 C ATOM 0 H VAL A 43 2.740 5.303 -0.888 1.00 0.00 H new ATOM 0 HA VAL A 43 5.355 4.536 -0.644 1.00 0.00 H new ATOM 0 HB VAL A 43 4.211 4.004 -2.634 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.357 5.661 -4.243 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.575 5.802 -2.650 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.832 6.967 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.639 4.906 -4.451 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.231 6.165 -3.341 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.590 4.452 -3.017 1.00 0.00 H new ATOM 719 N VAL A 44 5.104 7.692 -1.580 1.00 0.00 N ATOM 720 CA VAL A 44 5.766 8.978 -1.609 1.00 0.00 C ATOM 721 C VAL A 44 6.188 9.398 -0.209 1.00 0.00 C ATOM 722 O VAL A 44 7.308 9.856 0.004 1.00 0.00 O ATOM 723 CB VAL A 44 4.845 10.043 -2.242 1.00 0.00 C ATOM 724 CG1 VAL A 44 4.902 11.367 -1.486 1.00 0.00 C ATOM 725 CG2 VAL A 44 5.191 10.246 -3.708 1.00 0.00 C ATOM 0 H VAL A 44 4.178 7.689 -2.007 1.00 0.00 H new ATOM 0 HA VAL A 44 6.663 8.889 -2.221 1.00 0.00 H new ATOM 0 HB VAL A 44 3.822 9.673 -2.172 1.00 0.00 H new ATOM 0 HG11 VAL A 44 4.239 12.088 -1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.585 11.211 -0.455 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.923 11.749 -1.498 1.00 0.00 H new ATOM 0 HG21 VAL A 44 4.531 11.000 -4.137 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.226 10.577 -3.795 1.00 0.00 H new ATOM 0 HG23 VAL A 44 5.065 9.306 -4.245 1.00 0.00 H new ATOM 735 N MET A 45 5.285 9.231 0.746 1.00 0.00 N ATOM 736 CA MET A 45 5.576 9.591 2.125 1.00 0.00 C ATOM 737 C MET A 45 6.780 8.814 2.643 1.00 0.00 C ATOM 738 O MET A 45 7.597 9.352 3.391 1.00 0.00 O ATOM 739 CB MET A 45 4.362 9.327 3.019 1.00 0.00 C ATOM 740 CG MET A 45 4.634 9.540 4.503 1.00 0.00 C ATOM 741 SD MET A 45 5.297 8.071 5.313 1.00 0.00 S ATOM 742 CE MET A 45 5.029 8.485 7.035 1.00 0.00 C ATOM 0 H MET A 45 4.351 8.851 0.593 1.00 0.00 H new ATOM 0 HA MET A 45 5.808 10.656 2.152 1.00 0.00 H new ATOM 0 HB2 MET A 45 3.546 9.981 2.711 1.00 0.00 H new ATOM 0 HB3 MET A 45 4.024 8.302 2.864 1.00 0.00 H new ATOM 0 HG2 MET A 45 5.337 10.364 4.624 1.00 0.00 H new ATOM 0 HG3 MET A 45 3.709 9.835 4.998 1.00 0.00 H new ATOM 0 HE1 MET A 45 5.499 7.732 7.668 1.00 0.00 H new ATOM 0 HE2 MET A 45 5.466 9.461 7.247 1.00 0.00 H new ATOM 0 HE3 MET A 45 3.959 8.515 7.240 1.00 0.00 H new ATOM 752 N TRP A 46 6.888 7.547 2.251 1.00 0.00 N ATOM 753 CA TRP A 46 8.001 6.722 2.699 1.00 0.00 C ATOM 754 C TRP A 46 9.305 7.196 2.083 1.00 0.00 C ATOM 755 O TRP A 46 10.287 7.411 2.789 1.00 0.00 O ATOM 756 CB TRP A 46 7.756 5.252 2.362 1.00 0.00 C ATOM 757 CG TRP A 46 8.303 4.310 3.392 1.00 0.00 C ATOM 758 CD1 TRP A 46 7.671 3.876 4.521 1.00 0.00 C ATOM 759 CD2 TRP A 46 9.594 3.691 3.390 1.00 0.00 C ATOM 760 NE1 TRP A 46 8.490 3.024 5.221 1.00 0.00 N ATOM 761 CE2 TRP A 46 9.676 2.894 4.548 1.00 0.00 C ATOM 762 CE3 TRP A 46 10.690 3.733 2.521 1.00 0.00 C ATOM 763 CZ2 TRP A 46 10.808 2.145 4.857 1.00 0.00 C ATOM 764 CZ3 TRP A 46 11.813 2.989 2.831 1.00 0.00 C ATOM 765 CH2 TRP A 46 11.865 2.204 3.990 1.00 0.00 C ATOM 0 H TRP A 46 6.227 7.076 1.633 1.00 0.00 H new ATOM 0 HA TRP A 46 8.077 6.819 3.782 1.00 0.00 H new ATOM 0 HB2 TRP A 46 6.684 5.084 2.258 1.00 0.00 H new ATOM 0 HB3 TRP A 46 8.209 5.027 1.396 1.00 0.00 H new ATOM 0 HD1 TRP A 46 6.673 4.161 4.820 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.253 2.563 6.100 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.659 4.335 1.625 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.850 1.539 5.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 12.665 3.013 2.168 1.00 0.00 H new ATOM 0 HH2 TRP A 46 12.757 1.634 4.204 1.00 0.00 H new ATOM 776 N LEU A 47 9.317 7.368 0.767 1.00 0.00 N ATOM 777 CA LEU A 47 10.520 7.835 0.091 1.00 0.00 C ATOM 778 C LEU A 47 10.924 9.194 0.613 1.00 0.00 C ATOM 779 O LEU A 47 12.100 9.460 0.854 1.00 0.00 O ATOM 780 CB LEU A 47 10.324 7.960 -1.416 1.00 0.00 C ATOM 781 CG LEU A 47 8.925 8.342 -1.885 1.00 0.00 C ATOM 782 CD1 LEU A 47 8.896 9.823 -2.203 1.00 0.00 C ATOM 783 CD2 LEU A 47 8.515 7.516 -3.097 1.00 0.00 C ATOM 0 H LEU A 47 8.520 7.194 0.155 1.00 0.00 H new ATOM 0 HA LEU A 47 11.292 7.092 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 47 11.026 8.704 -1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 47 10.591 7.009 -1.876 1.00 0.00 H new ATOM 0 HG LEU A 47 8.209 8.132 -1.091 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.898 10.103 -2.539 1.00 0.00 H new ATOM 0 HD12 LEU A 47 9.151 10.392 -1.309 1.00 0.00 H new ATOM 0 HD13 LEU A 47 9.618 10.040 -2.990 1.00 0.00 H new ATOM 0 HD21 LEU A 47 7.513 7.807 -3.413 1.00 0.00 H new ATOM 0 HD22 LEU A 47 9.218 7.691 -3.911 1.00 0.00 H new ATOM 0 HD23 LEU A 47 8.520 6.458 -2.835 1.00 0.00 H new ATOM 795 N ILE A 48 9.939 10.065 0.765 1.00 0.00 N ATOM 796 CA ILE A 48 10.194 11.402 1.232 1.00 0.00 C ATOM 797 C ILE A 48 10.881 11.390 2.583 1.00 0.00 C ATOM 798 O ILE A 48 11.866 12.096 2.794 1.00 0.00 O ATOM 799 CB ILE A 48 8.882 12.198 1.318 1.00 0.00 C ATOM 800 CG1 ILE A 48 8.832 13.229 0.210 1.00 0.00 C ATOM 801 CG2 ILE A 48 8.739 12.878 2.668 1.00 0.00 C ATOM 802 CD1 ILE A 48 8.943 12.655 -1.182 1.00 0.00 C ATOM 0 H ILE A 48 8.959 9.862 0.570 1.00 0.00 H new ATOM 0 HA ILE A 48 10.859 11.884 0.515 1.00 0.00 H new ATOM 0 HB ILE A 48 8.052 11.500 1.202 1.00 0.00 H new ATOM 0 HG12 ILE A 48 7.896 13.783 0.288 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.640 13.945 0.360 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.801 13.433 2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.741 12.125 3.456 1.00 0.00 H new ATOM 0 HG23 ILE A 48 9.572 13.564 2.820 1.00 0.00 H new ATOM 0 HD11 ILE A 48 8.898 13.462 -1.913 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.891 12.126 -1.283 1.00 0.00 H new ATOM 0 HD13 ILE A 48 8.120 11.962 -1.356 1.00 0.00 H new ATOM 814 N GLN A 49 10.346 10.610 3.508 1.00 0.00 N ATOM 815 CA GLN A 49 10.914 10.552 4.836 1.00 0.00 C ATOM 816 C GLN A 49 12.088 9.577 4.909 1.00 0.00 C ATOM 817 O GLN A 49 12.929 9.678 5.802 1.00 0.00 O ATOM 818 CB GLN A 49 9.843 10.166 5.859 1.00 0.00 C ATOM 819 CG GLN A 49 9.391 8.716 5.756 1.00 0.00 C ATOM 820 CD GLN A 49 9.446 7.992 7.086 1.00 0.00 C ATOM 821 OE1 GLN A 49 10.503 7.526 7.510 1.00 0.00 O ATOM 822 NE2 GLN A 49 8.302 7.893 7.754 1.00 0.00 N ATOM 0 H GLN A 49 9.529 10.017 3.363 1.00 0.00 H new ATOM 0 HA GLN A 49 11.293 11.546 5.073 1.00 0.00 H new ATOM 0 HB2 GLN A 49 10.230 10.346 6.862 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.978 10.817 5.729 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.372 8.684 5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 49 10.021 8.193 5.036 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.448 8.294 7.366 1.00 0.00 H new ATOM 0 HE22 GLN A 49 8.277 7.416 8.655 1.00 0.00 H new ATOM 831 N ASN A 50 12.130 8.618 3.986 1.00 0.00 N ATOM 832 CA ASN A 50 13.196 7.617 3.987 1.00 0.00 C ATOM 833 C ASN A 50 14.321 7.953 3.012 1.00 0.00 C ATOM 834 O ASN A 50 15.472 8.109 3.411 1.00 0.00 O ATOM 835 CB ASN A 50 12.625 6.233 3.664 1.00 0.00 C ATOM 836 CG ASN A 50 13.661 5.134 3.806 1.00 0.00 C ATOM 837 OD1 ASN A 50 14.548 4.988 2.966 1.00 0.00 O ATOM 838 ND2 ASN A 50 13.551 4.354 4.876 1.00 0.00 N ATOM 0 H ASN A 50 11.447 8.513 3.236 1.00 0.00 H new ATOM 0 HA ASN A 50 13.626 7.616 4.989 1.00 0.00 H new ATOM 0 HB2 ASN A 50 11.785 6.025 4.327 1.00 0.00 H new ATOM 0 HB3 ASN A 50 12.235 6.232 2.646 1.00 0.00 H new ATOM 0 HD21 ASN A 50 14.218 3.598 5.026 1.00 0.00 H new ATOM 0 HD22 ASN A 50 12.799 4.512 5.547 1.00 0.00 H new ATOM 845 N LYS A 51 13.983 8.035 1.735 1.00 0.00 N ATOM 846 CA LYS A 51 14.965 8.322 0.691 1.00 0.00 C ATOM 847 C LYS A 51 15.716 9.626 0.949 1.00 0.00 C ATOM 848 O LYS A 51 16.941 9.634 1.072 1.00 0.00 O ATOM 849 CB LYS A 51 14.278 8.384 -0.675 1.00 0.00 C ATOM 850 CG LYS A 51 14.979 7.561 -1.742 1.00 0.00 C ATOM 851 CD LYS A 51 14.576 6.098 -1.666 1.00 0.00 C ATOM 852 CE LYS A 51 15.533 5.299 -0.795 1.00 0.00 C ATOM 853 NZ LYS A 51 16.956 5.533 -1.168 1.00 0.00 N ATOM 0 H LYS A 51 13.031 7.907 1.391 1.00 0.00 H new ATOM 0 HA LYS A 51 15.694 7.512 0.702 1.00 0.00 H new ATOM 0 HB2 LYS A 51 13.251 8.033 -0.573 1.00 0.00 H new ATOM 0 HB3 LYS A 51 14.229 9.423 -1.002 1.00 0.00 H new ATOM 0 HG2 LYS A 51 14.735 7.957 -2.728 1.00 0.00 H new ATOM 0 HG3 LYS A 51 16.059 7.650 -1.621 1.00 0.00 H new ATOM 0 HD2 LYS A 51 13.566 6.019 -1.265 1.00 0.00 H new ATOM 0 HD3 LYS A 51 14.555 5.673 -2.670 1.00 0.00 H new ATOM 0 HE2 LYS A 51 15.383 5.569 0.250 1.00 0.00 H new ATOM 0 HE3 LYS A 51 15.305 4.237 -0.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 17.544 4.761 -0.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 17.043 5.565 -2.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 17.276 6.437 -0.766 1.00 0.00 H new ATOM 867 N GLU A 52 14.978 10.728 1.010 1.00 0.00 N ATOM 868 CA GLU A 52 15.570 12.045 1.231 1.00 0.00 C ATOM 869 C GLU A 52 16.601 12.030 2.357 1.00 0.00 C ATOM 870 O GLU A 52 17.580 12.775 2.321 1.00 0.00 O ATOM 871 CB GLU A 52 14.477 13.063 1.554 1.00 0.00 C ATOM 872 CG GLU A 52 13.517 13.311 0.402 1.00 0.00 C ATOM 873 CD GLU A 52 13.090 14.762 0.300 1.00 0.00 C ATOM 874 OE1 GLU A 52 13.876 15.642 0.710 1.00 0.00 O ATOM 875 OE2 GLU A 52 11.970 15.018 -0.189 1.00 0.00 O ATOM 0 H GLU A 52 13.963 10.737 0.909 1.00 0.00 H new ATOM 0 HA GLU A 52 16.083 12.328 0.312 1.00 0.00 H new ATOM 0 HB2 GLU A 52 13.912 12.715 2.418 1.00 0.00 H new ATOM 0 HB3 GLU A 52 14.943 14.007 1.837 1.00 0.00 H new ATOM 0 HG2 GLU A 52 13.991 13.009 -0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 52 12.634 12.684 0.529 1.00 0.00 H new ATOM 882 N LYS A 53 16.368 11.196 3.363 1.00 0.00 N ATOM 883 CA LYS A 53 17.274 11.109 4.502 1.00 0.00 C ATOM 884 C LYS A 53 17.749 9.680 4.743 1.00 0.00 C ATOM 885 O LYS A 53 18.038 9.309 5.878 1.00 0.00 O ATOM 886 CB LYS A 53 16.591 11.649 5.761 1.00 0.00 C ATOM 887 CG LYS A 53 15.374 10.845 6.186 1.00 0.00 C ATOM 888 CD LYS A 53 15.209 10.843 7.697 1.00 0.00 C ATOM 889 CE LYS A 53 15.948 9.681 8.339 1.00 0.00 C ATOM 890 NZ LYS A 53 15.014 8.621 8.809 1.00 0.00 N ATOM 0 H LYS A 53 15.563 10.572 3.414 1.00 0.00 H new ATOM 0 HA LYS A 53 18.149 11.716 4.271 1.00 0.00 H new ATOM 0 HB2 LYS A 53 17.312 11.661 6.579 1.00 0.00 H new ATOM 0 HB3 LYS A 53 16.291 12.682 5.586 1.00 0.00 H new ATOM 0 HG2 LYS A 53 14.480 11.262 5.722 1.00 0.00 H new ATOM 0 HG3 LYS A 53 15.470 9.820 5.828 1.00 0.00 H new ATOM 0 HD2 LYS A 53 15.582 11.782 8.105 1.00 0.00 H new ATOM 0 HD3 LYS A 53 14.150 10.784 7.948 1.00 0.00 H new ATOM 0 HE2 LYS A 53 16.649 9.255 7.621 1.00 0.00 H new ATOM 0 HE3 LYS A 53 16.537 10.046 9.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 15.557 7.846 9.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 14.361 9.021 9.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 14.470 8.255 8.002 1.00 0.00 H new ATOM 904 N LEU A 54 17.828 8.881 3.679 1.00 0.00 N ATOM 905 CA LEU A 54 18.264 7.488 3.797 1.00 0.00 C ATOM 906 C LEU A 54 19.615 7.404 4.508 1.00 0.00 C ATOM 907 O LEU A 54 20.660 7.643 3.904 1.00 0.00 O ATOM 908 CB LEU A 54 18.374 6.847 2.411 1.00 0.00 C ATOM 909 CG LEU A 54 18.637 5.339 2.416 1.00 0.00 C ATOM 910 CD1 LEU A 54 17.327 4.568 2.369 1.00 0.00 C ATOM 911 CD2 LEU A 54 19.528 4.951 1.244 1.00 0.00 C ATOM 0 H LEU A 54 17.597 9.172 2.729 1.00 0.00 H new ATOM 0 HA LEU A 54 17.521 6.949 4.385 1.00 0.00 H new ATOM 0 HB2 LEU A 54 17.451 7.038 1.864 1.00 0.00 H new ATOM 0 HB3 LEU A 54 19.177 7.339 1.862 1.00 0.00 H new ATOM 0 HG LEU A 54 19.153 5.082 3.341 1.00 0.00 H new ATOM 0 HD11 LEU A 54 17.534 3.498 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.723 4.824 3.239 1.00 0.00 H new ATOM 0 HD13 LEU A 54 16.784 4.829 1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 54 19.705 3.876 1.262 1.00 0.00 H new ATOM 0 HD22 LEU A 54 19.038 5.222 0.309 1.00 0.00 H new ATOM 0 HD23 LEU A 54 20.480 5.477 1.321 1.00 0.00 H new ATOM 923 N PRO A 55 19.608 7.070 5.813 1.00 0.00 N ATOM 924 CA PRO A 55 20.827 6.964 6.614 1.00 0.00 C ATOM 925 C PRO A 55 21.562 5.647 6.391 1.00 0.00 C ATOM 926 O PRO A 55 20.972 4.662 5.946 1.00 0.00 O ATOM 927 CB PRO A 55 20.325 7.052 8.066 1.00 0.00 C ATOM 928 CG PRO A 55 18.838 7.223 7.990 1.00 0.00 C ATOM 929 CD PRO A 55 18.422 6.770 6.619 1.00 0.00 C ATOM 0 HA PRO A 55 21.544 7.741 6.350 1.00 0.00 H new ATOM 0 HB2 PRO A 55 20.584 6.151 8.622 1.00 0.00 H new ATOM 0 HB3 PRO A 55 20.786 7.891 8.586 1.00 0.00 H new ATOM 0 HG2 PRO A 55 18.341 6.633 8.760 1.00 0.00 H new ATOM 0 HG3 PRO A 55 18.559 8.264 8.155 1.00 0.00 H new ATOM 0 HD2 PRO A 55 18.176 5.708 6.600 1.00 0.00 H new ATOM 0 HD3 PRO A 55 17.543 7.307 6.263 1.00 0.00 H new ATOM 937 N ASN A 56 22.850 5.635 6.719 1.00 0.00 N ATOM 938 CA ASN A 56 23.663 4.435 6.571 1.00 0.00 C ATOM 939 C ASN A 56 23.339 3.436 7.677 1.00 0.00 C ATOM 940 O ASN A 56 23.415 2.223 7.478 1.00 0.00 O ATOM 941 CB ASN A 56 25.151 4.792 6.605 1.00 0.00 C ATOM 942 CG ASN A 56 25.493 5.934 5.669 1.00 0.00 C ATOM 943 OD1 ASN A 56 24.845 6.981 5.684 1.00 0.00 O ATOM 944 ND2 ASN A 56 26.517 5.739 4.845 1.00 0.00 N ATOM 0 H ASN A 56 23.352 6.442 7.089 1.00 0.00 H new ATOM 0 HA ASN A 56 23.434 3.979 5.608 1.00 0.00 H new ATOM 0 HB2 ASN A 56 25.434 5.063 7.622 1.00 0.00 H new ATOM 0 HB3 ASN A 56 25.739 3.915 6.333 1.00 0.00 H new ATOM 0 HD21 ASN A 56 26.793 6.472 4.192 1.00 0.00 H new ATOM 0 HD22 ASN A 56 27.027 4.856 4.865 1.00 0.00 H new ATOM 951 N GLU A 57 22.972 3.960 8.844 1.00 0.00 N ATOM 952 CA GLU A 57 22.628 3.122 9.988 1.00 0.00 C ATOM 953 C GLU A 57 21.254 2.486 9.803 1.00 0.00 C ATOM 954 O GLU A 57 20.948 1.460 10.413 1.00 0.00 O ATOM 955 CB GLU A 57 22.651 3.949 11.275 1.00 0.00 C ATOM 956 CG GLU A 57 21.734 5.160 11.235 1.00 0.00 C ATOM 957 CD GLU A 57 21.117 5.468 12.585 1.00 0.00 C ATOM 958 OE1 GLU A 57 20.108 4.823 12.938 1.00 0.00 O ATOM 959 OE2 GLU A 57 21.641 6.357 13.290 1.00 0.00 O ATOM 0 H GLU A 57 22.905 4.962 9.022 1.00 0.00 H new ATOM 0 HA GLU A 57 23.369 2.326 10.061 1.00 0.00 H new ATOM 0 HB2 GLU A 57 22.363 3.312 12.111 1.00 0.00 H new ATOM 0 HB3 GLU A 57 23.671 4.282 11.465 1.00 0.00 H new ATOM 0 HG2 GLU A 57 22.298 6.027 10.891 1.00 0.00 H new ATOM 0 HG3 GLU A 57 20.941 4.987 10.508 1.00 0.00 H new ATOM 966 N LEU A 58 20.429 3.098 8.958 1.00 0.00 N ATOM 967 CA LEU A 58 19.089 2.587 8.691 1.00 0.00 C ATOM 968 C LEU A 58 19.148 1.376 7.765 1.00 0.00 C ATOM 969 O LEU A 58 18.268 0.519 7.802 1.00 0.00 O ATOM 970 CB LEU A 58 18.220 3.677 8.060 1.00 0.00 C ATOM 971 CG LEU A 58 17.037 4.142 8.912 1.00 0.00 C ATOM 972 CD1 LEU A 58 16.194 5.153 8.147 1.00 0.00 C ATOM 973 CD2 LEU A 58 16.189 2.954 9.338 1.00 0.00 C ATOM 0 H LEU A 58 20.665 3.948 8.447 1.00 0.00 H new ATOM 0 HA LEU A 58 18.647 2.282 9.640 1.00 0.00 H new ATOM 0 HB2 LEU A 58 18.850 4.539 7.840 1.00 0.00 H new ATOM 0 HB3 LEU A 58 17.839 3.309 7.107 1.00 0.00 H new ATOM 0 HG LEU A 58 17.426 4.626 9.808 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.357 5.473 8.768 1.00 0.00 H new ATOM 0 HD12 LEU A 58 16.806 6.017 7.890 1.00 0.00 H new ATOM 0 HD13 LEU A 58 15.814 4.694 7.235 1.00 0.00 H new ATOM 0 HD21 LEU A 58 15.352 3.303 9.943 1.00 0.00 H new ATOM 0 HD22 LEU A 58 15.809 2.442 8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 58 16.797 2.264 9.923 1.00 0.00 H new ATOM 985 N LYS A 59 20.191 1.323 6.933 1.00 0.00 N ATOM 986 CA LYS A 59 20.379 0.224 5.985 1.00 0.00 C ATOM 987 C LYS A 59 19.941 -1.120 6.571 1.00 0.00 C ATOM 988 O LYS A 59 19.119 -1.818 5.981 1.00 0.00 O ATOM 989 CB LYS A 59 21.844 0.149 5.546 1.00 0.00 C ATOM 990 CG LYS A 59 22.034 -0.443 4.160 1.00 0.00 C ATOM 991 CD LYS A 59 22.384 -1.921 4.227 1.00 0.00 C ATOM 992 CE LYS A 59 23.791 -2.136 4.762 1.00 0.00 C ATOM 993 NZ LYS A 59 24.821 -1.524 3.877 1.00 0.00 N ATOM 0 H LYS A 59 20.922 2.034 6.898 1.00 0.00 H new ATOM 0 HA LYS A 59 19.749 0.429 5.120 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.272 1.151 5.566 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.400 -0.450 6.267 1.00 0.00 H new ATOM 0 HG2 LYS A 59 21.122 -0.310 3.579 1.00 0.00 H new ATOM 0 HG3 LYS A 59 22.825 0.096 3.639 1.00 0.00 H new ATOM 0 HD2 LYS A 59 21.668 -2.437 4.866 1.00 0.00 H new ATOM 0 HD3 LYS A 59 22.300 -2.361 3.233 1.00 0.00 H new ATOM 0 HE2 LYS A 59 23.869 -1.707 5.761 1.00 0.00 H new ATOM 0 HE3 LYS A 59 23.984 -3.205 4.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 25.746 -1.960 4.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 24.562 -1.681 2.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 24.876 -0.502 4.063 1.00 0.00 H new ATOM 1007 N PRO A 60 20.480 -1.509 7.741 1.00 0.00 N ATOM 1008 CA PRO A 60 20.120 -2.779 8.379 1.00 0.00 C ATOM 1009 C PRO A 60 18.635 -2.857 8.710 1.00 0.00 C ATOM 1010 O PRO A 60 18.052 -3.941 8.730 1.00 0.00 O ATOM 1011 CB PRO A 60 20.961 -2.801 9.661 1.00 0.00 C ATOM 1012 CG PRO A 60 21.354 -1.382 9.893 1.00 0.00 C ATOM 1013 CD PRO A 60 21.471 -0.759 8.532 1.00 0.00 C ATOM 0 HA PRO A 60 20.312 -3.628 7.723 1.00 0.00 H new ATOM 0 HB2 PRO A 60 20.388 -3.194 10.501 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.837 -3.439 9.547 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.609 -0.864 10.497 1.00 0.00 H new ATOM 0 HG3 PRO A 60 22.299 -1.322 10.433 1.00 0.00 H new ATOM 0 HD2 PRO A 60 21.246 0.307 8.555 1.00 0.00 H new ATOM 0 HD3 PRO A 60 22.476 -0.864 8.125 1.00 0.00 H new ATOM 1021 N LYS A 61 18.026 -1.705 8.963 1.00 0.00 N ATOM 1022 CA LYS A 61 16.605 -1.656 9.283 1.00 0.00 C ATOM 1023 C LYS A 61 15.765 -1.944 8.045 1.00 0.00 C ATOM 1024 O LYS A 61 14.648 -2.447 8.148 1.00 0.00 O ATOM 1025 CB LYS A 61 16.222 -0.300 9.872 1.00 0.00 C ATOM 1026 CG LYS A 61 14.863 -0.303 10.557 1.00 0.00 C ATOM 1027 CD LYS A 61 13.748 0.050 9.587 1.00 0.00 C ATOM 1028 CE LYS A 61 13.191 1.440 9.857 1.00 0.00 C ATOM 1029 NZ LYS A 61 11.904 1.387 10.603 1.00 0.00 N ATOM 0 H LYS A 61 18.491 -0.797 8.953 1.00 0.00 H new ATOM 0 HA LYS A 61 16.405 -2.424 10.030 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.983 0.004 10.591 1.00 0.00 H new ATOM 0 HB3 LYS A 61 16.219 0.446 9.077 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.674 -1.286 10.988 1.00 0.00 H new ATOM 0 HG3 LYS A 61 14.869 0.410 11.381 1.00 0.00 H new ATOM 0 HD2 LYS A 61 14.124 0.000 8.565 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.948 -0.686 9.668 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.918 2.018 10.428 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.041 1.961 8.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.291 2.169 10.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.430 0.481 10.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.090 1.475 11.622 1.00 0.00 H new ATOM 1043 N ILE A 62 16.308 -1.638 6.866 1.00 0.00 N ATOM 1044 CA ILE A 62 15.593 -1.893 5.622 1.00 0.00 C ATOM 1045 C ILE A 62 15.136 -3.347 5.589 1.00 0.00 C ATOM 1046 O ILE A 62 14.075 -3.669 5.049 1.00 0.00 O ATOM 1047 CB ILE A 62 16.463 -1.566 4.384 1.00 0.00 C ATOM 1048 CG1 ILE A 62 16.415 -0.065 4.090 1.00 0.00 C ATOM 1049 CG2 ILE A 62 16.010 -2.357 3.161 1.00 0.00 C ATOM 1050 CD1 ILE A 62 16.652 0.797 5.310 1.00 0.00 C ATOM 0 H ILE A 62 17.230 -1.218 6.750 1.00 0.00 H new ATOM 0 HA ILE A 62 14.723 -1.237 5.585 1.00 0.00 H new ATOM 0 HB ILE A 62 17.490 -1.856 4.608 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.165 0.173 3.335 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.443 0.183 3.663 1.00 0.00 H new ATOM 0 HG21 ILE A 62 16.642 -2.104 2.310 1.00 0.00 H new ATOM 0 HG22 ILE A 62 16.090 -3.424 3.368 1.00 0.00 H new ATOM 0 HG23 ILE A 62 14.974 -2.109 2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.604 1.849 5.027 1.00 0.00 H new ATOM 0 HD12 ILE A 62 15.888 0.587 6.058 1.00 0.00 H new ATOM 0 HD13 ILE A 62 17.636 0.578 5.725 1.00 0.00 H new ATOM 1062 N ASP A 63 15.927 -4.217 6.213 1.00 0.00 N ATOM 1063 CA ASP A 63 15.585 -5.621 6.298 1.00 0.00 C ATOM 1064 C ASP A 63 14.336 -5.752 7.150 1.00 0.00 C ATOM 1065 O ASP A 63 13.406 -6.482 6.809 1.00 0.00 O ATOM 1066 CB ASP A 63 16.741 -6.420 6.911 1.00 0.00 C ATOM 1067 CG ASP A 63 17.149 -7.598 6.048 1.00 0.00 C ATOM 1068 OD1 ASP A 63 16.264 -8.196 5.401 1.00 0.00 O ATOM 1069 OD2 ASP A 63 18.355 -7.921 6.018 1.00 0.00 O ATOM 0 H ASP A 63 16.807 -3.967 6.665 1.00 0.00 H new ATOM 0 HA ASP A 63 15.400 -6.021 5.301 1.00 0.00 H new ATOM 0 HB2 ASP A 63 17.599 -5.763 7.053 1.00 0.00 H new ATOM 0 HB3 ASP A 63 16.448 -6.780 7.897 1.00 0.00 H new ATOM 1074 N GLU A 64 14.314 -4.992 8.244 1.00 0.00 N ATOM 1075 CA GLU A 64 13.170 -4.972 9.143 1.00 0.00 C ATOM 1076 C GLU A 64 11.930 -4.544 8.370 1.00 0.00 C ATOM 1077 O GLU A 64 10.890 -5.190 8.438 1.00 0.00 O ATOM 1078 CB GLU A 64 13.426 -4.017 10.313 1.00 0.00 C ATOM 1079 CG GLU A 64 13.750 -4.727 11.617 1.00 0.00 C ATOM 1080 CD GLU A 64 15.232 -4.710 11.938 1.00 0.00 C ATOM 1081 OE1 GLU A 64 15.772 -3.613 12.190 1.00 0.00 O ATOM 1082 OE2 GLU A 64 15.852 -5.795 11.939 1.00 0.00 O ATOM 0 H GLU A 64 15.080 -4.381 8.526 1.00 0.00 H new ATOM 0 HA GLU A 64 13.014 -5.972 9.549 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.251 -3.353 10.056 1.00 0.00 H new ATOM 0 HB3 GLU A 64 12.546 -3.390 10.459 1.00 0.00 H new ATOM 0 HG2 GLU A 64 13.200 -4.253 12.430 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.406 -5.760 11.559 1.00 0.00 H new ATOM 1089 N ILE A 65 12.064 -3.461 7.608 1.00 0.00 N ATOM 1090 CA ILE A 65 10.969 -2.949 6.789 1.00 0.00 C ATOM 1091 C ILE A 65 10.371 -4.064 5.940 1.00 0.00 C ATOM 1092 O ILE A 65 9.163 -4.110 5.722 1.00 0.00 O ATOM 1093 CB ILE A 65 11.458 -1.811 5.864 1.00 0.00 C ATOM 1094 CG1 ILE A 65 12.085 -0.693 6.695 1.00 0.00 C ATOM 1095 CG2 ILE A 65 10.312 -1.268 5.018 1.00 0.00 C ATOM 1096 CD1 ILE A 65 11.142 -0.138 7.736 1.00 0.00 C ATOM 0 H ILE A 65 12.925 -2.919 7.541 1.00 0.00 H new ATOM 0 HA ILE A 65 10.206 -2.557 7.462 1.00 0.00 H new ATOM 0 HB ILE A 65 12.213 -2.215 5.190 1.00 0.00 H new ATOM 0 HG12 ILE A 65 12.981 -1.071 7.188 1.00 0.00 H new ATOM 0 HG13 ILE A 65 12.402 0.112 6.032 1.00 0.00 H new ATOM 0 HG21 ILE A 65 10.681 -0.468 4.376 1.00 0.00 H new ATOM 0 HG22 ILE A 65 9.903 -2.069 4.402 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.531 -0.878 5.671 1.00 0.00 H new ATOM 0 HD11 ILE A 65 11.642 0.653 8.295 1.00 0.00 H new ATOM 0 HD12 ILE A 65 10.257 0.268 7.246 1.00 0.00 H new ATOM 0 HD13 ILE A 65 10.845 -0.934 8.419 1.00 0.00 H new ATOM 1108 N SER A 66 11.231 -4.960 5.466 1.00 0.00 N ATOM 1109 CA SER A 66 10.794 -6.079 4.639 1.00 0.00 C ATOM 1110 C SER A 66 10.267 -7.232 5.492 1.00 0.00 C ATOM 1111 O SER A 66 9.123 -7.656 5.338 1.00 0.00 O ATOM 1112 CB SER A 66 11.946 -6.567 3.759 1.00 0.00 C ATOM 1113 OG SER A 66 12.897 -7.293 4.519 1.00 0.00 O ATOM 0 H SER A 66 12.236 -4.933 5.641 1.00 0.00 H new ATOM 0 HA SER A 66 9.980 -5.726 4.006 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.556 -7.198 2.961 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.431 -5.714 3.283 1.00 0.00 H new ATOM 0 HG SER A 66 13.255 -6.720 5.228 1.00 0.00 H new ATOM 1119 N LYS A 67 11.108 -7.743 6.387 1.00 0.00 N ATOM 1120 CA LYS A 67 10.712 -8.853 7.249 1.00 0.00 C ATOM 1121 C LYS A 67 9.544 -8.466 8.155 1.00 0.00 C ATOM 1122 O LYS A 67 8.827 -9.333 8.657 1.00 0.00 O ATOM 1123 CB LYS A 67 11.899 -9.331 8.090 1.00 0.00 C ATOM 1124 CG LYS A 67 12.708 -8.200 8.702 1.00 0.00 C ATOM 1125 CD LYS A 67 12.879 -8.377 10.204 1.00 0.00 C ATOM 1126 CE LYS A 67 14.331 -8.215 10.627 1.00 0.00 C ATOM 1127 NZ LYS A 67 14.924 -9.501 11.084 1.00 0.00 N ATOM 0 H LYS A 67 12.061 -7.410 6.534 1.00 0.00 H new ATOM 0 HA LYS A 67 10.384 -9.670 6.606 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.531 -9.976 8.888 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.554 -9.938 7.466 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.688 -8.156 8.227 1.00 0.00 H new ATOM 0 HG3 LYS A 67 12.214 -7.249 8.502 1.00 0.00 H new ATOM 0 HD2 LYS A 67 12.263 -7.647 10.729 1.00 0.00 H new ATOM 0 HD3 LYS A 67 12.522 -9.364 10.497 1.00 0.00 H new ATOM 0 HE2 LYS A 67 14.911 -7.825 9.791 1.00 0.00 H new ATOM 0 HE3 LYS A 67 14.395 -7.480 11.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 15.914 -9.347 11.363 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.387 -9.861 11.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 14.887 -10.195 10.310 1.00 0.00 H new ATOM 1141 N ARG A 68 9.350 -7.165 8.361 1.00 0.00 N ATOM 1142 CA ARG A 68 8.260 -6.684 9.205 1.00 0.00 C ATOM 1143 C ARG A 68 6.988 -6.495 8.389 1.00 0.00 C ATOM 1144 O ARG A 68 5.891 -6.782 8.865 1.00 0.00 O ATOM 1145 CB ARG A 68 8.636 -5.369 9.892 1.00 0.00 C ATOM 1146 CG ARG A 68 9.755 -5.516 10.908 1.00 0.00 C ATOM 1147 CD ARG A 68 10.331 -4.164 11.307 1.00 0.00 C ATOM 1148 NE ARG A 68 9.499 -3.484 12.297 1.00 0.00 N ATOM 1149 CZ ARG A 68 9.693 -2.228 12.692 1.00 0.00 C ATOM 1150 NH1 ARG A 68 10.686 -1.510 12.181 1.00 0.00 N ATOM 1151 NH2 ARG A 68 8.893 -1.688 13.602 1.00 0.00 N ATOM 0 H ARG A 68 9.930 -6.429 7.957 1.00 0.00 H new ATOM 0 HA ARG A 68 8.079 -7.438 9.971 1.00 0.00 H new ATOM 0 HB2 ARG A 68 8.936 -4.645 9.134 1.00 0.00 H new ATOM 0 HB3 ARG A 68 7.755 -4.963 10.389 1.00 0.00 H new ATOM 0 HG2 ARG A 68 9.378 -6.027 11.794 1.00 0.00 H new ATOM 0 HG3 ARG A 68 10.546 -6.140 10.492 1.00 0.00 H new ATOM 0 HD2 ARG A 68 11.334 -4.302 11.710 1.00 0.00 H new ATOM 0 HD3 ARG A 68 10.427 -3.536 10.422 1.00 0.00 H new ATOM 0 HE ARG A 68 8.724 -4.003 12.710 1.00 0.00 H new ATOM 0 HH11 ARG A 68 11.305 -1.921 11.482 1.00 0.00 H new ATOM 0 HH12 ARG A 68 10.830 -0.548 12.487 1.00 0.00 H new ATOM 0 HH21 ARG A 68 8.129 -2.235 13.999 1.00 0.00 H new ATOM 0 HH22 ARG A 68 9.042 -0.725 13.905 1.00 0.00 H new ATOM 1165 N PHE A 69 7.136 -6.017 7.154 1.00 0.00 N ATOM 1166 CA PHE A 69 5.986 -5.805 6.282 1.00 0.00 C ATOM 1167 C PHE A 69 5.171 -7.094 6.175 1.00 0.00 C ATOM 1168 O PHE A 69 3.942 -7.067 6.114 1.00 0.00 O ATOM 1169 CB PHE A 69 6.446 -5.304 4.899 1.00 0.00 C ATOM 1170 CG PHE A 69 6.263 -6.288 3.769 1.00 0.00 C ATOM 1171 CD1 PHE A 69 4.999 -6.578 3.279 1.00 0.00 C ATOM 1172 CD2 PHE A 69 7.357 -6.916 3.197 1.00 0.00 C ATOM 1173 CE1 PHE A 69 4.831 -7.477 2.243 1.00 0.00 C ATOM 1174 CE2 PHE A 69 7.195 -7.817 2.162 1.00 0.00 C ATOM 1175 CZ PHE A 69 5.930 -8.098 1.684 1.00 0.00 C ATOM 0 H PHE A 69 8.035 -5.771 6.739 1.00 0.00 H new ATOM 0 HA PHE A 69 5.344 -5.036 6.711 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.898 -4.393 4.659 1.00 0.00 H new ATOM 0 HB3 PHE A 69 7.501 -5.035 4.959 1.00 0.00 H new ATOM 0 HD1 PHE A 69 4.135 -6.096 3.712 1.00 0.00 H new ATOM 0 HD2 PHE A 69 8.349 -6.699 3.565 1.00 0.00 H new ATOM 0 HE1 PHE A 69 3.841 -7.694 1.871 1.00 0.00 H new ATOM 0 HE2 PHE A 69 8.057 -8.301 1.727 1.00 0.00 H new ATOM 0 HZ PHE A 69 5.801 -8.802 0.875 1.00 0.00 H new ATOM 1185 N PHE A 70 5.873 -8.221 6.184 1.00 0.00 N ATOM 1186 CA PHE A 70 5.233 -9.526 6.119 1.00 0.00 C ATOM 1187 C PHE A 70 5.407 -10.247 7.453 1.00 0.00 C ATOM 1188 O PHE A 70 6.243 -11.141 7.581 1.00 0.00 O ATOM 1189 CB PHE A 70 5.826 -10.362 4.984 1.00 0.00 C ATOM 1190 CG PHE A 70 4.850 -11.334 4.383 1.00 0.00 C ATOM 1191 CD1 PHE A 70 4.291 -11.095 3.137 1.00 0.00 C ATOM 1192 CD2 PHE A 70 4.489 -12.485 5.066 1.00 0.00 C ATOM 1193 CE1 PHE A 70 3.392 -11.986 2.583 1.00 0.00 C ATOM 1194 CE2 PHE A 70 3.591 -13.379 4.516 1.00 0.00 C ATOM 1195 CZ PHE A 70 3.041 -13.130 3.274 1.00 0.00 C ATOM 0 H PHE A 70 6.891 -8.255 6.236 1.00 0.00 H new ATOM 0 HA PHE A 70 4.170 -9.388 5.920 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.189 -9.694 4.203 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.689 -10.911 5.360 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.561 -10.202 2.593 1.00 0.00 H new ATOM 0 HD2 PHE A 70 4.914 -12.685 6.038 1.00 0.00 H new ATOM 0 HE1 PHE A 70 2.964 -11.789 1.611 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.319 -14.273 5.057 1.00 0.00 H new ATOM 0 HZ PHE A 70 2.338 -13.828 2.844 1.00 0.00 H new ATOM 1205 N PRO A 71 4.624 -9.851 8.471 1.00 0.00 N ATOM 1206 CA PRO A 71 4.702 -10.449 9.807 1.00 0.00 C ATOM 1207 C PRO A 71 4.090 -11.844 9.857 1.00 0.00 C ATOM 1208 O PRO A 71 3.787 -12.437 8.822 1.00 0.00 O ATOM 1209 CB PRO A 71 3.895 -9.477 10.669 1.00 0.00 C ATOM 1210 CG PRO A 71 2.908 -8.879 9.732 1.00 0.00 C ATOM 1211 CD PRO A 71 3.606 -8.783 8.402 1.00 0.00 C ATOM 0 HA PRO A 71 5.732 -10.583 10.137 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.399 -9.993 11.491 1.00 0.00 H new ATOM 0 HB3 PRO A 71 4.535 -8.714 11.112 1.00 0.00 H new ATOM 0 HG2 PRO A 71 2.014 -9.498 9.660 1.00 0.00 H new ATOM 0 HG3 PRO A 71 2.588 -7.896 10.077 1.00 0.00 H new ATOM 0 HD2 PRO A 71 2.915 -8.940 7.574 1.00 0.00 H new ATOM 0 HD3 PRO A 71 4.061 -7.803 8.257 1.00 0.00 H new ATOM 1219 N ALA A 72 3.911 -12.363 11.068 1.00 0.00 N ATOM 1220 CA ALA A 72 3.336 -13.690 11.253 1.00 0.00 C ATOM 1221 C ALA A 72 2.013 -13.614 12.008 1.00 0.00 C ATOM 1222 O ALA A 72 1.984 -13.671 13.238 1.00 0.00 O ATOM 1223 CB ALA A 72 4.316 -14.591 11.989 1.00 0.00 C ATOM 0 H ALA A 72 4.156 -11.885 11.935 1.00 0.00 H new ATOM 0 HA ALA A 72 3.138 -14.115 10.269 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.874 -15.579 12.120 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.235 -14.679 11.410 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.542 -14.162 12.965 1.00 0.00 H new ATOM 1229 N LYS A 73 0.919 -13.484 11.264 1.00 0.00 N ATOM 1230 CA LYS A 73 -0.408 -13.402 11.862 1.00 0.00 C ATOM 1231 C LYS A 73 -1.315 -14.507 11.332 1.00 0.00 C ATOM 1232 O LYS A 73 -2.064 -15.096 12.140 1.00 0.00 O ATOM 1233 CB LYS A 73 -1.034 -12.035 11.581 1.00 0.00 C ATOM 1234 CG LYS A 73 -2.147 -11.665 12.548 1.00 0.00 C ATOM 1235 CD LYS A 73 -1.637 -10.779 13.674 1.00 0.00 C ATOM 1236 CE LYS A 73 -1.840 -9.306 13.358 1.00 0.00 C ATOM 1237 NZ LYS A 73 -0.745 -8.463 13.915 1.00 0.00 N ATOM 1238 OXT LYS A 73 -1.269 -14.776 10.113 1.00 0.00 O ATOM 0 H LYS A 73 0.926 -13.433 10.245 1.00 0.00 H new ATOM 0 HA LYS A 73 -0.301 -13.531 12.939 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -0.256 -11.272 11.626 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -1.429 -12.028 10.565 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -2.942 -11.149 12.009 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -2.583 -12.572 12.967 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.157 -11.029 14.599 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -0.578 -10.974 13.841 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -1.889 -9.170 12.278 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -2.796 -8.976 13.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -0.920 -7.466 13.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -0.714 -8.573 14.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 0.164 -8.761 13.507 1.00 0.00 H new TER 1252 LYS A 73 ATOM 1253 N MET B 1 2.139 -20.618 -0.579 1.00 0.00 N ATOM 1254 CA MET B 1 3.587 -20.327 -0.755 1.00 0.00 C ATOM 1255 C MET B 1 3.816 -19.290 -1.850 1.00 0.00 C ATOM 1256 O MET B 1 4.475 -18.274 -1.628 1.00 0.00 O ATOM 1257 CB MET B 1 4.319 -21.629 -1.097 1.00 0.00 C ATOM 1258 CG MET B 1 3.619 -22.468 -2.156 1.00 0.00 C ATOM 1259 SD MET B 1 3.616 -24.228 -1.760 1.00 0.00 S ATOM 1260 CE MET B 1 5.296 -24.450 -1.179 1.00 0.00 C ATOM 0 H1 MET B 1 1.994 -21.647 -0.540 1.00 0.00 H new ATOM 0 H2 MET B 1 1.804 -20.188 0.306 1.00 0.00 H new ATOM 0 H3 MET B 1 1.606 -20.223 -1.380 1.00 0.00 H new ATOM 0 HA MET B 1 3.978 -19.914 0.175 1.00 0.00 H new ATOM 0 HB2 MET B 1 5.324 -21.389 -1.443 1.00 0.00 H new ATOM 0 HB3 MET B 1 4.427 -22.223 -0.190 1.00 0.00 H new ATOM 0 HG2 MET B 1 2.591 -22.123 -2.266 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.111 -22.317 -3.117 1.00 0.00 H new ATOM 0 HE1 MET B 1 5.625 -25.466 -1.397 1.00 0.00 H new ATOM 0 HE2 MET B 1 5.952 -23.740 -1.683 1.00 0.00 H new ATOM 0 HE3 MET B 1 5.334 -24.279 -0.103 1.00 0.00 H new ATOM 1272 N VAL B 2 3.266 -19.550 -3.033 1.00 0.00 N ATOM 1273 CA VAL B 2 3.412 -18.636 -4.160 1.00 0.00 C ATOM 1274 C VAL B 2 2.054 -18.126 -4.632 1.00 0.00 C ATOM 1275 O VAL B 2 1.302 -18.849 -5.285 1.00 0.00 O ATOM 1276 CB VAL B 2 4.133 -19.311 -5.342 1.00 0.00 C ATOM 1277 CG1 VAL B 2 5.621 -19.437 -5.059 1.00 0.00 C ATOM 1278 CG2 VAL B 2 3.521 -20.673 -5.635 1.00 0.00 C ATOM 0 H VAL B 2 2.716 -20.385 -3.235 1.00 0.00 H new ATOM 0 HA VAL B 2 4.012 -17.796 -3.811 1.00 0.00 H new ATOM 0 HB VAL B 2 4.007 -18.685 -6.225 1.00 0.00 H new ATOM 0 HG11 VAL B 2 6.113 -19.916 -5.905 1.00 0.00 H new ATOM 0 HG12 VAL B 2 6.047 -18.446 -4.905 1.00 0.00 H new ATOM 0 HG13 VAL B 2 5.771 -20.040 -4.163 1.00 0.00 H new ATOM 0 HG21 VAL B 2 4.044 -21.134 -6.473 1.00 0.00 H new ATOM 0 HG22 VAL B 2 3.613 -21.310 -4.755 1.00 0.00 H new ATOM 0 HG23 VAL B 2 2.467 -20.552 -5.887 1.00 0.00 H new ATOM 1288 N GLU B 3 1.749 -16.876 -4.294 1.00 0.00 N ATOM 1289 CA GLU B 3 0.482 -16.255 -4.678 1.00 0.00 C ATOM 1290 C GLU B 3 -0.695 -17.199 -4.434 1.00 0.00 C ATOM 1291 O GLU B 3 -1.616 -17.281 -5.247 1.00 0.00 O ATOM 1292 CB GLU B 3 0.520 -15.829 -6.148 1.00 0.00 C ATOM 1293 CG GLU B 3 0.587 -16.992 -7.125 1.00 0.00 C ATOM 1294 CD GLU B 3 0.129 -16.609 -8.518 1.00 0.00 C ATOM 1295 OE1 GLU B 3 0.997 -16.375 -9.385 1.00 0.00 O ATOM 1296 OE2 GLU B 3 -1.097 -16.543 -8.743 1.00 0.00 O ATOM 0 H GLU B 3 2.365 -16.270 -3.752 1.00 0.00 H new ATOM 0 HA GLU B 3 0.342 -15.371 -4.056 1.00 0.00 H new ATOM 0 HB2 GLU B 3 -0.367 -15.234 -6.367 1.00 0.00 H new ATOM 0 HB3 GLU B 3 1.384 -15.184 -6.307 1.00 0.00 H new ATOM 0 HG2 GLU B 3 1.611 -17.364 -7.172 1.00 0.00 H new ATOM 0 HG3 GLU B 3 -0.032 -17.809 -6.755 1.00 0.00 H new ATOM 1303 N SER B 4 -0.656 -17.907 -3.310 1.00 0.00 N ATOM 1304 CA SER B 4 -1.719 -18.843 -2.959 1.00 0.00 C ATOM 1305 C SER B 4 -1.434 -19.513 -1.618 1.00 0.00 C ATOM 1306 O SER B 4 -0.328 -19.419 -1.087 1.00 0.00 O ATOM 1307 CB SER B 4 -1.872 -19.906 -4.048 1.00 0.00 C ATOM 1308 OG SER B 4 -2.777 -19.479 -5.053 1.00 0.00 O ATOM 0 H SER B 4 0.099 -17.851 -2.627 1.00 0.00 H new ATOM 0 HA SER B 4 -2.649 -18.281 -2.875 1.00 0.00 H new ATOM 0 HB2 SER B 4 -0.900 -20.116 -4.495 1.00 0.00 H new ATOM 0 HB3 SER B 4 -2.227 -20.836 -3.605 1.00 0.00 H new ATOM 0 HG SER B 4 -2.373 -18.751 -5.569 1.00 0.00 H new ATOM 1314 N LYS B 5 -2.442 -20.192 -1.077 1.00 0.00 N ATOM 1315 CA LYS B 5 -2.306 -20.882 0.202 1.00 0.00 C ATOM 1316 C LYS B 5 -2.034 -19.892 1.333 1.00 0.00 C ATOM 1317 O LYS B 5 -2.944 -19.520 2.075 1.00 0.00 O ATOM 1318 CB LYS B 5 -1.184 -21.920 0.130 1.00 0.00 C ATOM 1319 CG LYS B 5 -1.667 -23.309 -0.256 1.00 0.00 C ATOM 1320 CD LYS B 5 -0.729 -24.388 0.260 1.00 0.00 C ATOM 1321 CE LYS B 5 -1.068 -24.786 1.687 1.00 0.00 C ATOM 1322 NZ LYS B 5 -0.394 -26.052 2.086 1.00 0.00 N ATOM 0 H LYS B 5 -3.363 -20.279 -1.506 1.00 0.00 H new ATOM 0 HA LYS B 5 -3.247 -21.391 0.412 1.00 0.00 H new ATOM 0 HB2 LYS B 5 -0.439 -21.589 -0.594 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.686 -21.973 1.098 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -2.667 -23.472 0.146 1.00 0.00 H new ATOM 0 HG3 LYS B 5 -1.744 -23.380 -1.341 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -0.789 -25.263 -0.387 1.00 0.00 H new ATOM 0 HD3 LYS B 5 0.299 -24.029 0.216 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -0.771 -23.987 2.367 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -2.147 -24.903 1.784 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -0.651 -26.288 3.066 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -0.696 -26.820 1.454 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 0.637 -25.933 2.018 1.00 0.00 H new ATOM 1336 N LYS B 6 -0.779 -19.471 1.462 1.00 0.00 N ATOM 1337 CA LYS B 6 -0.394 -18.527 2.504 1.00 0.00 C ATOM 1338 C LYS B 6 -0.077 -17.158 1.912 1.00 0.00 C ATOM 1339 O LYS B 6 -0.786 -16.183 2.162 1.00 0.00 O ATOM 1340 CB LYS B 6 0.819 -19.054 3.276 1.00 0.00 C ATOM 1341 CG LYS B 6 0.942 -18.483 4.679 1.00 0.00 C ATOM 1342 CD LYS B 6 2.262 -18.873 5.325 1.00 0.00 C ATOM 1343 CE LYS B 6 3.285 -17.754 5.221 1.00 0.00 C ATOM 1344 NZ LYS B 6 2.970 -16.625 6.139 1.00 0.00 N ATOM 0 H LYS B 6 -0.013 -19.769 0.858 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.235 -18.420 3.189 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.755 -20.140 3.339 1.00 0.00 H new ATOM 0 HB3 LYS B 6 1.725 -18.820 2.717 1.00 0.00 H new ATOM 0 HG2 LYS B 6 0.862 -17.397 4.639 1.00 0.00 H new ATOM 0 HG3 LYS B 6 0.115 -18.841 5.293 1.00 0.00 H new ATOM 0 HD2 LYS B 6 2.096 -19.120 6.374 1.00 0.00 H new ATOM 0 HD3 LYS B 6 2.652 -19.770 4.845 1.00 0.00 H new ATOM 0 HE2 LYS B 6 4.275 -18.145 5.454 1.00 0.00 H new ATOM 0 HE3 LYS B 6 3.320 -17.388 4.195 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 3.803 -16.009 6.230 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 2.174 -16.077 5.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 2.712 -17.000 7.074 1.00 0.00 H new ATOM 1358 N ILE B 7 0.992 -17.092 1.125 1.00 0.00 N ATOM 1359 CA ILE B 7 1.402 -15.842 0.498 1.00 0.00 C ATOM 1360 C ILE B 7 0.651 -15.610 -0.808 1.00 0.00 C ATOM 1361 O ILE B 7 1.171 -15.877 -1.891 1.00 0.00 O ATOM 1362 CB ILE B 7 2.918 -15.824 0.217 1.00 0.00 C ATOM 1363 CG1 ILE B 7 3.700 -16.204 1.476 1.00 0.00 C ATOM 1364 CG2 ILE B 7 3.348 -14.453 -0.285 1.00 0.00 C ATOM 1365 CD1 ILE B 7 4.874 -17.120 1.204 1.00 0.00 C ATOM 0 H ILE B 7 1.589 -17.889 0.907 1.00 0.00 H new ATOM 0 HA ILE B 7 1.161 -15.043 1.199 1.00 0.00 H new ATOM 0 HB ILE B 7 3.136 -16.559 -0.558 1.00 0.00 H new ATOM 0 HG12 ILE B 7 4.062 -15.295 1.957 1.00 0.00 H new ATOM 0 HG13 ILE B 7 3.025 -16.691 2.180 1.00 0.00 H new ATOM 0 HG21 ILE B 7 4.421 -14.456 -0.479 1.00 0.00 H new ATOM 0 HG22 ILE B 7 2.814 -14.219 -1.206 1.00 0.00 H new ATOM 0 HG23 ILE B 7 3.118 -13.701 0.469 1.00 0.00 H new ATOM 0 HD11 ILE B 7 5.382 -17.348 2.141 1.00 0.00 H new ATOM 0 HD12 ILE B 7 4.517 -18.045 0.751 1.00 0.00 H new ATOM 0 HD13 ILE B 7 5.570 -16.628 0.524 1.00 0.00 H new ATOM 1377 N ALA B 8 -0.575 -15.109 -0.698 1.00 0.00 N ATOM 1378 CA ALA B 8 -1.397 -14.838 -1.870 1.00 0.00 C ATOM 1379 C ALA B 8 -1.143 -13.431 -2.398 1.00 0.00 C ATOM 1380 O ALA B 8 -0.507 -12.616 -1.732 1.00 0.00 O ATOM 1381 CB ALA B 8 -2.871 -15.024 -1.536 1.00 0.00 C ATOM 0 H ALA B 8 -1.021 -14.883 0.191 1.00 0.00 H new ATOM 0 HA ALA B 8 -1.124 -15.547 -2.651 1.00 0.00 H new ATOM 0 HB1 ALA B 8 -3.473 -14.818 -2.421 1.00 0.00 H new ATOM 0 HB2 ALA B 8 -3.044 -16.050 -1.210 1.00 0.00 H new ATOM 0 HB3 ALA B 8 -3.153 -14.337 -0.738 1.00 0.00 H new ATOM 1387 N LYS B 9 -1.638 -13.153 -3.598 1.00 0.00 N ATOM 1388 CA LYS B 9 -1.460 -11.841 -4.209 1.00 0.00 C ATOM 1389 C LYS B 9 -2.361 -11.676 -5.425 1.00 0.00 C ATOM 1390 O LYS B 9 -2.685 -12.647 -6.108 1.00 0.00 O ATOM 1391 CB LYS B 9 0.000 -11.642 -4.612 1.00 0.00 C ATOM 1392 CG LYS B 9 0.763 -10.730 -3.670 1.00 0.00 C ATOM 1393 CD LYS B 9 1.819 -11.493 -2.887 1.00 0.00 C ATOM 1394 CE LYS B 9 1.933 -10.978 -1.465 1.00 0.00 C ATOM 1395 NZ LYS B 9 3.337 -11.013 -0.968 1.00 0.00 N ATOM 0 H LYS B 9 -2.165 -13.816 -4.166 1.00 0.00 H new ATOM 0 HA LYS B 9 -1.736 -11.085 -3.474 1.00 0.00 H new ATOM 0 HB2 LYS B 9 0.495 -12.612 -4.648 1.00 0.00 H new ATOM 0 HB3 LYS B 9 0.038 -11.227 -5.619 1.00 0.00 H new ATOM 0 HG2 LYS B 9 1.238 -9.932 -4.240 1.00 0.00 H new ATOM 0 HG3 LYS B 9 0.067 -10.256 -2.978 1.00 0.00 H new ATOM 0 HD2 LYS B 9 1.568 -12.554 -2.872 1.00 0.00 H new ATOM 0 HD3 LYS B 9 2.783 -11.401 -3.387 1.00 0.00 H new ATOM 0 HE2 LYS B 9 1.558 -9.956 -1.419 1.00 0.00 H new ATOM 0 HE3 LYS B 9 1.302 -11.579 -0.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 3.360 -10.717 0.029 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 3.711 -11.980 -1.051 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 3.922 -10.366 -1.535 1.00 0.00 H new ATOM 1409 N LYS B 10 -2.758 -10.438 -5.693 1.00 0.00 N ATOM 1410 CA LYS B 10 -3.619 -10.146 -6.832 1.00 0.00 C ATOM 1411 C LYS B 10 -3.014 -9.042 -7.694 1.00 0.00 C ATOM 1412 O LYS B 10 -2.420 -8.102 -7.175 1.00 0.00 O ATOM 1413 CB LYS B 10 -4.997 -9.714 -6.340 1.00 0.00 C ATOM 1414 CG LYS B 10 -5.828 -10.841 -5.748 1.00 0.00 C ATOM 1415 CD LYS B 10 -6.621 -10.370 -4.535 1.00 0.00 C ATOM 1416 CE LYS B 10 -8.020 -10.966 -4.516 1.00 0.00 C ATOM 1417 NZ LYS B 10 -9.060 -9.951 -4.842 1.00 0.00 N ATOM 0 H LYS B 10 -2.498 -9.622 -5.139 1.00 0.00 H new ATOM 0 HA LYS B 10 -3.713 -11.049 -7.436 1.00 0.00 H new ATOM 0 HB2 LYS B 10 -4.874 -8.934 -5.588 1.00 0.00 H new ATOM 0 HB3 LYS B 10 -5.545 -9.271 -7.172 1.00 0.00 H new ATOM 0 HG2 LYS B 10 -6.512 -11.227 -6.504 1.00 0.00 H new ATOM 0 HG3 LYS B 10 -5.174 -11.664 -5.460 1.00 0.00 H new ATOM 0 HD2 LYS B 10 -6.093 -10.650 -3.623 1.00 0.00 H new ATOM 0 HD3 LYS B 10 -6.688 -9.282 -4.543 1.00 0.00 H new ATOM 0 HE2 LYS B 10 -8.075 -11.786 -5.232 1.00 0.00 H new ATOM 0 HE3 LYS B 10 -8.221 -11.389 -3.532 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 -9.999 -10.397 -4.819 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 -9.025 -9.181 -4.144 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 -8.883 -9.566 -5.792 1.00 0.00 H new ATOM 1431 N LYS B 11 -3.173 -9.141 -9.007 1.00 0.00 N ATOM 1432 CA LYS B 11 -2.636 -8.114 -9.892 1.00 0.00 C ATOM 1433 C LYS B 11 -3.457 -6.839 -9.762 1.00 0.00 C ATOM 1434 O LYS B 11 -4.594 -6.769 -10.228 1.00 0.00 O ATOM 1435 CB LYS B 11 -2.630 -8.591 -11.345 1.00 0.00 C ATOM 1436 CG LYS B 11 -1.931 -9.926 -11.546 1.00 0.00 C ATOM 1437 CD LYS B 11 -2.903 -11.092 -11.428 1.00 0.00 C ATOM 1438 CE LYS B 11 -2.575 -11.973 -10.234 1.00 0.00 C ATOM 1439 NZ LYS B 11 -1.583 -13.029 -10.578 1.00 0.00 N ATOM 0 H LYS B 11 -3.659 -9.905 -9.476 1.00 0.00 H new ATOM 0 HA LYS B 11 -1.606 -7.911 -9.598 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -3.659 -8.673 -11.696 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.141 -7.838 -11.964 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -1.457 -9.945 -12.527 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -1.138 -10.037 -10.807 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -3.920 -10.711 -11.332 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -2.871 -11.687 -12.340 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -2.183 -11.357 -9.425 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.489 -12.440 -9.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -1.387 -13.608 -9.737 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.967 -13.633 -11.332 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -0.702 -12.584 -10.906 1.00 0.00 H new ATOM 1453 N THR B 12 -2.875 -5.835 -9.118 1.00 0.00 N ATOM 1454 CA THR B 12 -3.552 -4.563 -8.917 1.00 0.00 C ATOM 1455 C THR B 12 -2.815 -3.439 -9.634 1.00 0.00 C ATOM 1456 O THR B 12 -1.609 -3.277 -9.472 1.00 0.00 O ATOM 1457 CB THR B 12 -3.663 -4.249 -7.425 1.00 0.00 C ATOM 1458 OG1 THR B 12 -3.877 -5.434 -6.678 1.00 0.00 O ATOM 1459 CG2 THR B 12 -4.789 -3.292 -7.096 1.00 0.00 C ATOM 0 H THR B 12 -1.934 -5.879 -8.726 1.00 0.00 H new ATOM 0 HA THR B 12 -4.555 -4.642 -9.337 1.00 0.00 H new ATOM 0 HB THR B 12 -2.717 -3.778 -7.159 1.00 0.00 H new ATOM 0 HG1 THR B 12 -4.306 -5.211 -5.826 1.00 0.00 H new ATOM 0 HG21 THR B 12 -4.811 -3.112 -6.021 1.00 0.00 H new ATOM 0 HG22 THR B 12 -4.629 -2.349 -7.618 1.00 0.00 H new ATOM 0 HG23 THR B 12 -5.738 -3.725 -7.411 1.00 0.00 H new ATOM 1467 N THR B 13 -3.544 -2.668 -10.435 1.00 0.00 N ATOM 1468 CA THR B 13 -2.939 -1.571 -11.180 1.00 0.00 C ATOM 1469 C THR B 13 -3.026 -0.251 -10.430 1.00 0.00 C ATOM 1470 O THR B 13 -4.002 0.028 -9.734 1.00 0.00 O ATOM 1471 CB THR B 13 -3.600 -1.412 -12.547 1.00 0.00 C ATOM 1472 OG1 THR B 13 -4.138 -2.642 -12.998 1.00 0.00 O ATOM 1473 CG2 THR B 13 -2.648 -0.906 -13.608 1.00 0.00 C ATOM 0 H THR B 13 -4.547 -2.782 -10.584 1.00 0.00 H new ATOM 0 HA THR B 13 -1.887 -1.826 -11.307 1.00 0.00 H new ATOM 0 HB THR B 13 -4.389 -0.674 -12.403 1.00 0.00 H new ATOM 0 HG1 THR B 13 -4.557 -2.514 -13.874 1.00 0.00 H new ATOM 0 HG21 THR B 13 -3.176 -0.814 -14.557 1.00 0.00 H new ATOM 0 HG22 THR B 13 -2.259 0.069 -13.313 1.00 0.00 H new ATOM 0 HG23 THR B 13 -1.821 -1.608 -13.720 1.00 0.00 H new ATOM 1481 N LEU B 14 -1.998 0.565 -10.612 1.00 0.00 N ATOM 1482 CA LEU B 14 -1.928 1.880 -9.999 1.00 0.00 C ATOM 1483 C LEU B 14 -1.457 2.883 -11.044 1.00 0.00 C ATOM 1484 O LEU B 14 -0.470 2.641 -11.739 1.00 0.00 O ATOM 1485 CB LEU B 14 -0.979 1.877 -8.794 1.00 0.00 C ATOM 1486 CG LEU B 14 -0.944 0.574 -7.988 1.00 0.00 C ATOM 1487 CD1 LEU B 14 0.446 0.335 -7.422 1.00 0.00 C ATOM 1488 CD2 LEU B 14 -1.977 0.605 -6.871 1.00 0.00 C ATOM 0 H LEU B 14 -1.190 0.333 -11.189 1.00 0.00 H new ATOM 0 HA LEU B 14 -2.917 2.160 -9.636 1.00 0.00 H new ATOM 0 HB2 LEU B 14 0.029 2.093 -9.147 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.264 2.690 -8.126 1.00 0.00 H new ATOM 0 HG LEU B 14 -1.190 -0.250 -8.658 1.00 0.00 H new ATOM 0 HD11 LEU B 14 0.452 -0.594 -6.853 1.00 0.00 H new ATOM 0 HD12 LEU B 14 1.164 0.265 -8.239 1.00 0.00 H new ATOM 0 HD13 LEU B 14 0.720 1.163 -6.768 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -1.936 -0.329 -6.311 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -1.764 1.439 -6.202 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -2.972 0.728 -7.299 1.00 0.00 H new ATOM 1500 N ALA B 15 -2.173 3.990 -11.181 1.00 0.00 N ATOM 1501 CA ALA B 15 -1.818 4.989 -12.178 1.00 0.00 C ATOM 1502 C ALA B 15 -0.802 5.988 -11.644 1.00 0.00 C ATOM 1503 O ALA B 15 -1.155 7.074 -11.186 1.00 0.00 O ATOM 1504 CB ALA B 15 -3.062 5.708 -12.676 1.00 0.00 C ATOM 0 H ALA B 15 -2.995 4.218 -10.621 1.00 0.00 H new ATOM 0 HA ALA B 15 -1.353 4.466 -13.014 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -2.779 6.452 -13.421 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -3.744 4.986 -13.125 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -3.556 6.202 -11.839 1.00 0.00 H new ATOM 1510 N PHE B 16 0.465 5.604 -11.740 1.00 0.00 N ATOM 1511 CA PHE B 16 1.586 6.430 -11.304 1.00 0.00 C ATOM 1512 C PHE B 16 2.868 5.846 -11.849 1.00 0.00 C ATOM 1513 O PHE B 16 2.861 4.785 -12.457 1.00 0.00 O ATOM 1514 CB PHE B 16 1.676 6.528 -9.776 1.00 0.00 C ATOM 1515 CG PHE B 16 0.391 6.938 -9.114 1.00 0.00 C ATOM 1516 CD1 PHE B 16 0.069 8.278 -8.967 1.00 0.00 C ATOM 1517 CD2 PHE B 16 -0.498 5.984 -8.646 1.00 0.00 C ATOM 1518 CE1 PHE B 16 -1.115 8.659 -8.366 1.00 0.00 C ATOM 1519 CE2 PHE B 16 -1.684 6.359 -8.041 1.00 0.00 C ATOM 1520 CZ PHE B 16 -1.994 7.698 -7.902 1.00 0.00 C ATOM 0 H PHE B 16 0.747 4.703 -12.126 1.00 0.00 H new ATOM 0 HA PHE B 16 1.428 7.439 -11.686 1.00 0.00 H new ATOM 0 HB2 PHE B 16 1.986 5.562 -9.378 1.00 0.00 H new ATOM 0 HB3 PHE B 16 2.453 7.245 -9.513 1.00 0.00 H new ATOM 0 HD1 PHE B 16 0.752 9.033 -9.327 1.00 0.00 H new ATOM 0 HD2 PHE B 16 -0.262 4.936 -8.755 1.00 0.00 H new ATOM 0 HE1 PHE B 16 -1.354 9.707 -8.259 1.00 0.00 H new ATOM 0 HE2 PHE B 16 -2.367 5.606 -7.678 1.00 0.00 H new ATOM 0 HZ PHE B 16 -2.921 7.993 -7.432 1.00 0.00 H new ATOM 1530 N ASP B 17 3.960 6.549 -11.645 1.00 0.00 N ATOM 1531 CA ASP B 17 5.262 6.113 -12.122 1.00 0.00 C ATOM 1532 C ASP B 17 6.178 7.302 -12.204 1.00 0.00 C ATOM 1533 O ASP B 17 7.364 7.215 -11.914 1.00 0.00 O ATOM 1534 CB ASP B 17 5.168 5.446 -13.495 1.00 0.00 C ATOM 1535 CG ASP B 17 5.242 3.933 -13.412 1.00 0.00 C ATOM 1536 OD1 ASP B 17 4.917 3.381 -12.340 1.00 0.00 O ATOM 1537 OD2 ASP B 17 5.624 3.301 -14.419 1.00 0.00 O ATOM 0 H ASP B 17 3.975 7.438 -11.145 1.00 0.00 H new ATOM 0 HA ASP B 17 5.653 5.377 -11.420 1.00 0.00 H new ATOM 0 HB2 ASP B 17 4.232 5.735 -13.972 1.00 0.00 H new ATOM 0 HB3 ASP B 17 5.976 5.812 -14.129 1.00 0.00 H new ATOM 1542 N GLU B 18 5.621 8.431 -12.587 1.00 0.00 N ATOM 1543 CA GLU B 18 6.419 9.631 -12.686 1.00 0.00 C ATOM 1544 C GLU B 18 7.245 9.811 -11.414 1.00 0.00 C ATOM 1545 O GLU B 18 8.480 9.775 -11.442 1.00 0.00 O ATOM 1546 CB GLU B 18 5.534 10.855 -12.922 1.00 0.00 C ATOM 1547 CG GLU B 18 6.320 12.135 -13.156 1.00 0.00 C ATOM 1548 CD GLU B 18 6.216 13.105 -11.997 1.00 0.00 C ATOM 1549 OE1 GLU B 18 6.056 14.319 -12.250 1.00 0.00 O ATOM 1550 OE2 GLU B 18 6.293 12.653 -10.835 1.00 0.00 O ATOM 0 H GLU B 18 4.637 8.542 -12.831 1.00 0.00 H new ATOM 0 HA GLU B 18 7.092 9.531 -13.537 1.00 0.00 H new ATOM 0 HB2 GLU B 18 4.893 10.669 -13.783 1.00 0.00 H new ATOM 0 HB3 GLU B 18 4.880 10.992 -12.061 1.00 0.00 H new ATOM 0 HG2 GLU B 18 7.368 11.887 -13.324 1.00 0.00 H new ATOM 0 HG3 GLU B 18 5.957 12.619 -14.063 1.00 0.00 H new ATOM 1557 N ASP B 19 6.553 9.975 -10.292 1.00 0.00 N ATOM 1558 CA ASP B 19 7.225 10.149 -9.012 1.00 0.00 C ATOM 1559 C ASP B 19 7.579 8.811 -8.384 1.00 0.00 C ATOM 1560 O ASP B 19 8.701 8.621 -7.916 1.00 0.00 O ATOM 1561 CB ASP B 19 6.351 10.963 -8.055 1.00 0.00 C ATOM 1562 CG ASP B 19 6.656 12.447 -8.117 1.00 0.00 C ATOM 1563 OD1 ASP B 19 5.751 13.253 -7.817 1.00 0.00 O ATOM 1564 OD2 ASP B 19 7.802 12.804 -8.464 1.00 0.00 O ATOM 0 H ASP B 19 5.534 9.991 -10.243 1.00 0.00 H new ATOM 0 HA ASP B 19 8.152 10.692 -9.197 1.00 0.00 H new ATOM 0 HB2 ASP B 19 5.301 10.800 -8.298 1.00 0.00 H new ATOM 0 HB3 ASP B 19 6.502 10.606 -7.036 1.00 0.00 H new ATOM 1569 N VAL B 20 6.631 7.882 -8.371 1.00 0.00 N ATOM 1570 CA VAL B 20 6.890 6.578 -7.790 1.00 0.00 C ATOM 1571 C VAL B 20 7.990 5.855 -8.561 1.00 0.00 C ATOM 1572 O VAL B 20 8.933 5.355 -7.962 1.00 0.00 O ATOM 1573 CB VAL B 20 5.619 5.703 -7.719 1.00 0.00 C ATOM 1574 CG1 VAL B 20 4.503 6.448 -7.005 1.00 0.00 C ATOM 1575 CG2 VAL B 20 5.168 5.279 -9.101 1.00 0.00 C ATOM 0 H VAL B 20 5.692 8.007 -8.750 1.00 0.00 H new ATOM 0 HA VAL B 20 7.224 6.747 -6.766 1.00 0.00 H new ATOM 0 HB VAL B 20 5.861 4.804 -7.153 1.00 0.00 H new ATOM 0 HG11 VAL B 20 3.614 5.819 -6.963 1.00 0.00 H new ATOM 0 HG12 VAL B 20 4.821 6.695 -5.992 1.00 0.00 H new ATOM 0 HG13 VAL B 20 4.273 7.365 -7.547 1.00 0.00 H new ATOM 0 HG21 VAL B 20 4.272 4.664 -9.019 1.00 0.00 H new ATOM 0 HG22 VAL B 20 4.948 6.163 -9.699 1.00 0.00 H new ATOM 0 HG23 VAL B 20 5.959 4.704 -9.581 1.00 0.00 H new ATOM 1585 N TYR B 21 7.892 5.819 -9.891 1.00 0.00 N ATOM 1586 CA TYR B 21 8.922 5.160 -10.692 1.00 0.00 C ATOM 1587 C TYR B 21 10.268 5.841 -10.479 1.00 0.00 C ATOM 1588 O TYR B 21 11.284 5.167 -10.306 1.00 0.00 O ATOM 1589 CB TYR B 21 8.570 5.134 -12.186 1.00 0.00 C ATOM 1590 CG TYR B 21 9.192 3.974 -12.929 1.00 0.00 C ATOM 1591 CD1 TYR B 21 8.514 2.769 -13.069 1.00 0.00 C ATOM 1592 CD2 TYR B 21 10.457 4.085 -13.491 1.00 0.00 C ATOM 1593 CE1 TYR B 21 9.082 1.707 -13.748 1.00 0.00 C ATOM 1594 CE2 TYR B 21 11.031 3.027 -14.171 1.00 0.00 C ATOM 1595 CZ TYR B 21 10.340 1.842 -14.297 1.00 0.00 C ATOM 1596 OH TYR B 21 10.908 0.787 -14.974 1.00 0.00 O ATOM 0 H TYR B 21 7.127 6.229 -10.426 1.00 0.00 H new ATOM 0 HA TYR B 21 8.981 4.125 -10.357 1.00 0.00 H new ATOM 0 HB2 TYR B 21 7.487 5.087 -12.296 1.00 0.00 H new ATOM 0 HB3 TYR B 21 8.897 6.067 -12.645 1.00 0.00 H new ATOM 0 HD1 TYR B 21 7.528 2.660 -12.641 1.00 0.00 H new ATOM 0 HD2 TYR B 21 11.001 5.013 -13.395 1.00 0.00 H new ATOM 0 HE1 TYR B 21 8.543 0.776 -13.848 1.00 0.00 H new ATOM 0 HE2 TYR B 21 12.016 3.129 -14.601 1.00 0.00 H new ATOM 0 HH TYR B 21 11.795 1.047 -15.299 1.00 0.00 H new ATOM 1606 N HIS B 22 10.287 7.179 -10.471 1.00 0.00 N ATOM 1607 CA HIS B 22 11.537 7.895 -10.253 1.00 0.00 C ATOM 1608 C HIS B 22 12.043 7.639 -8.840 1.00 0.00 C ATOM 1609 O HIS B 22 13.201 7.269 -8.646 1.00 0.00 O ATOM 1610 CB HIS B 22 11.353 9.395 -10.490 1.00 0.00 C ATOM 1611 CG HIS B 22 12.644 10.145 -10.612 1.00 0.00 C ATOM 1612 ND1 HIS B 22 13.600 10.165 -9.619 1.00 0.00 N ATOM 1613 CD2 HIS B 22 13.135 10.904 -11.620 1.00 0.00 C ATOM 1614 CE1 HIS B 22 14.622 10.904 -10.011 1.00 0.00 C ATOM 1615 NE2 HIS B 22 14.366 11.363 -11.222 1.00 0.00 N ATOM 0 H HIS B 22 9.468 7.771 -10.610 1.00 0.00 H new ATOM 0 HA HIS B 22 12.275 7.528 -10.966 1.00 0.00 H new ATOM 0 HB2 HIS B 22 10.770 9.542 -11.399 1.00 0.00 H new ATOM 0 HB3 HIS B 22 10.774 9.816 -9.668 1.00 0.00 H new ATOM 0 HD2 HIS B 22 12.649 11.110 -12.562 1.00 0.00 H new ATOM 0 HE1 HIS B 22 15.516 11.100 -9.438 1.00 0.00 H new ATOM 0 HE2 HIS B 22 14.982 11.961 -11.772 1.00 0.00 H new ATOM 1624 N THR B 23 11.170 7.816 -7.852 1.00 0.00 N ATOM 1625 CA THR B 23 11.549 7.574 -6.467 1.00 0.00 C ATOM 1626 C THR B 23 11.959 6.118 -6.293 1.00 0.00 C ATOM 1627 O THR B 23 12.914 5.801 -5.581 1.00 0.00 O ATOM 1628 CB THR B 23 10.407 7.907 -5.514 1.00 0.00 C ATOM 1629 OG1 THR B 23 9.257 7.137 -5.818 1.00 0.00 O ATOM 1630 CG2 THR B 23 10.007 9.365 -5.539 1.00 0.00 C ATOM 0 H THR B 23 10.206 8.123 -7.984 1.00 0.00 H new ATOM 0 HA THR B 23 12.390 8.224 -6.226 1.00 0.00 H new ATOM 0 HB THR B 23 10.787 7.672 -4.520 1.00 0.00 H new ATOM 0 HG1 THR B 23 9.008 7.277 -6.755 1.00 0.00 H new ATOM 0 HG21 THR B 23 9.189 9.530 -4.837 1.00 0.00 H new ATOM 0 HG22 THR B 23 10.860 9.981 -5.254 1.00 0.00 H new ATOM 0 HG23 THR B 23 9.683 9.636 -6.544 1.00 0.00 H new ATOM 1638 N LEU B 24 11.242 5.232 -6.977 1.00 0.00 N ATOM 1639 CA LEU B 24 11.546 3.811 -6.927 1.00 0.00 C ATOM 1640 C LEU B 24 12.974 3.573 -7.400 1.00 0.00 C ATOM 1641 O LEU B 24 13.560 2.524 -7.135 1.00 0.00 O ATOM 1642 CB LEU B 24 10.565 3.011 -7.790 1.00 0.00 C ATOM 1643 CG LEU B 24 9.470 2.273 -7.014 1.00 0.00 C ATOM 1644 CD1 LEU B 24 10.071 1.468 -5.877 1.00 0.00 C ATOM 1645 CD2 LEU B 24 8.439 3.249 -6.474 1.00 0.00 C ATOM 0 H LEU B 24 10.449 5.475 -7.570 1.00 0.00 H new ATOM 0 HA LEU B 24 11.446 3.472 -5.896 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.091 3.690 -8.499 1.00 0.00 H new ATOM 0 HB3 LEU B 24 11.129 2.283 -8.374 1.00 0.00 H new ATOM 0 HG LEU B 24 8.973 1.590 -7.702 1.00 0.00 H new ATOM 0 HD11 LEU B 24 9.277 0.951 -5.338 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.772 0.737 -6.280 1.00 0.00 H new ATOM 0 HD13 LEU B 24 10.596 2.137 -5.195 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.672 2.702 -5.927 1.00 0.00 H new ATOM 0 HD22 LEU B 24 8.925 3.959 -5.805 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.979 3.788 -7.302 1.00 0.00 H new ATOM 1657 N LYS B 25 13.524 4.555 -8.109 1.00 0.00 N ATOM 1658 CA LYS B 25 14.875 4.453 -8.625 1.00 0.00 C ATOM 1659 C LYS B 25 15.907 4.422 -7.505 1.00 0.00 C ATOM 1660 O LYS B 25 16.803 3.579 -7.511 1.00 0.00 O ATOM 1661 CB LYS B 25 15.173 5.606 -9.585 1.00 0.00 C ATOM 1662 CG LYS B 25 16.443 5.408 -10.399 1.00 0.00 C ATOM 1663 CD LYS B 25 16.418 4.093 -11.165 1.00 0.00 C ATOM 1664 CE LYS B 25 17.421 3.098 -10.603 1.00 0.00 C ATOM 1665 NZ LYS B 25 16.806 1.762 -10.371 1.00 0.00 N ATOM 0 H LYS B 25 13.050 5.429 -8.336 1.00 0.00 H new ATOM 0 HA LYS B 25 14.945 3.511 -9.168 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.330 5.728 -10.266 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.258 6.531 -9.014 1.00 0.00 H new ATOM 0 HG2 LYS B 25 16.560 6.235 -11.099 1.00 0.00 H new ATOM 0 HG3 LYS B 25 17.308 5.427 -9.736 1.00 0.00 H new ATOM 0 HD2 LYS B 25 15.417 3.665 -11.121 1.00 0.00 H new ATOM 0 HD3 LYS B 25 16.639 4.279 -12.216 1.00 0.00 H new ATOM 0 HE2 LYS B 25 18.259 2.997 -11.293 1.00 0.00 H new ATOM 0 HE3 LYS B 25 17.825 3.480 -9.665 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 17.178 1.357 -9.488 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 15.774 1.863 -10.298 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 17.037 1.131 -11.165 1.00 0.00 H new ATOM 1679 N LEU B 26 15.786 5.329 -6.535 1.00 0.00 N ATOM 1680 CA LEU B 26 16.738 5.342 -5.429 1.00 0.00 C ATOM 1681 C LEU B 26 16.503 4.134 -4.546 1.00 0.00 C ATOM 1682 O LEU B 26 17.431 3.399 -4.224 1.00 0.00 O ATOM 1683 CB LEU B 26 16.660 6.624 -4.593 1.00 0.00 C ATOM 1684 CG LEU B 26 16.097 7.843 -5.311 1.00 0.00 C ATOM 1685 CD1 LEU B 26 14.590 7.844 -5.194 1.00 0.00 C ATOM 1686 CD2 LEU B 26 16.687 9.123 -4.736 1.00 0.00 C ATOM 0 H LEU B 26 15.060 6.044 -6.493 1.00 0.00 H new ATOM 0 HA LEU B 26 17.738 5.307 -5.861 1.00 0.00 H new ATOM 0 HB2 LEU B 26 16.047 6.427 -3.714 1.00 0.00 H new ATOM 0 HB3 LEU B 26 17.661 6.865 -4.236 1.00 0.00 H new ATOM 0 HG LEU B 26 16.370 7.796 -6.365 1.00 0.00 H new ATOM 0 HD11 LEU B 26 14.186 8.716 -5.708 1.00 0.00 H new ATOM 0 HD12 LEU B 26 14.189 6.938 -5.648 1.00 0.00 H new ATOM 0 HD13 LEU B 26 14.307 7.879 -4.142 1.00 0.00 H new ATOM 0 HD21 LEU B 26 16.273 9.983 -5.262 1.00 0.00 H new ATOM 0 HD22 LEU B 26 16.441 9.193 -3.676 1.00 0.00 H new ATOM 0 HD23 LEU B 26 17.770 9.111 -4.857 1.00 0.00 H new ATOM 1698 N VAL B 27 15.248 3.923 -4.175 1.00 0.00 N ATOM 1699 CA VAL B 27 14.883 2.783 -3.341 1.00 0.00 C ATOM 1700 C VAL B 27 15.280 1.481 -4.000 1.00 0.00 C ATOM 1701 O VAL B 27 15.764 0.568 -3.339 1.00 0.00 O ATOM 1702 CB VAL B 27 13.374 2.722 -3.051 1.00 0.00 C ATOM 1703 CG1 VAL B 27 13.073 3.158 -1.633 1.00 0.00 C ATOM 1704 CG2 VAL B 27 12.612 3.557 -4.031 1.00 0.00 C ATOM 0 H VAL B 27 14.466 4.524 -4.437 1.00 0.00 H new ATOM 0 HA VAL B 27 15.420 2.920 -2.402 1.00 0.00 H new ATOM 0 HB VAL B 27 13.054 1.686 -3.160 1.00 0.00 H new ATOM 0 HG11 VAL B 27 11.999 3.105 -1.456 1.00 0.00 H new ATOM 0 HG12 VAL B 27 13.589 2.501 -0.933 1.00 0.00 H new ATOM 0 HG13 VAL B 27 13.414 4.183 -1.487 1.00 0.00 H new ATOM 0 HG21 VAL B 27 11.547 3.499 -3.807 1.00 0.00 H new ATOM 0 HG22 VAL B 27 12.942 4.593 -3.960 1.00 0.00 H new ATOM 0 HG23 VAL B 27 12.791 3.187 -5.041 1.00 0.00 H new ATOM 1714 N SER B 28 15.054 1.377 -5.299 1.00 0.00 N ATOM 1715 CA SER B 28 15.382 0.149 -5.991 1.00 0.00 C ATOM 1716 C SER B 28 16.879 -0.123 -5.948 1.00 0.00 C ATOM 1717 O SER B 28 17.304 -1.264 -5.753 1.00 0.00 O ATOM 1718 CB SER B 28 14.885 0.182 -7.437 1.00 0.00 C ATOM 1719 OG SER B 28 13.475 0.051 -7.495 1.00 0.00 O ATOM 0 H SER B 28 14.654 2.112 -5.882 1.00 0.00 H new ATOM 0 HA SER B 28 14.874 -0.665 -5.474 1.00 0.00 H new ATOM 0 HB2 SER B 28 15.186 1.118 -7.907 1.00 0.00 H new ATOM 0 HB3 SER B 28 15.352 -0.624 -8.004 1.00 0.00 H new ATOM 0 HG SER B 28 13.057 0.912 -7.283 1.00 0.00 H new ATOM 1725 N VAL B 29 17.667 0.930 -6.121 1.00 0.00 N ATOM 1726 CA VAL B 29 19.113 0.820 -6.099 1.00 0.00 C ATOM 1727 C VAL B 29 19.620 0.712 -4.667 1.00 0.00 C ATOM 1728 O VAL B 29 20.468 -0.123 -4.353 1.00 0.00 O ATOM 1729 CB VAL B 29 19.747 2.045 -6.800 1.00 0.00 C ATOM 1730 CG1 VAL B 29 20.575 2.888 -5.841 1.00 0.00 C ATOM 1731 CG2 VAL B 29 20.578 1.611 -7.997 1.00 0.00 C ATOM 0 H VAL B 29 17.321 1.877 -6.279 1.00 0.00 H new ATOM 0 HA VAL B 29 19.402 -0.084 -6.635 1.00 0.00 H new ATOM 0 HB VAL B 29 18.930 2.673 -7.155 1.00 0.00 H new ATOM 0 HG11 VAL B 29 21.000 3.736 -6.377 1.00 0.00 H new ATOM 0 HG12 VAL B 29 19.939 3.251 -5.033 1.00 0.00 H new ATOM 0 HG13 VAL B 29 21.379 2.281 -5.425 1.00 0.00 H new ATOM 0 HG21 VAL B 29 21.014 2.488 -8.475 1.00 0.00 H new ATOM 0 HG22 VAL B 29 21.374 0.945 -7.665 1.00 0.00 H new ATOM 0 HG23 VAL B 29 19.942 1.088 -8.711 1.00 0.00 H new ATOM 1741 N TYR B 30 19.096 1.576 -3.810 1.00 0.00 N ATOM 1742 CA TYR B 30 19.495 1.602 -2.410 1.00 0.00 C ATOM 1743 C TYR B 30 18.918 0.420 -1.638 1.00 0.00 C ATOM 1744 O TYR B 30 19.475 0.017 -0.617 1.00 0.00 O ATOM 1745 CB TYR B 30 19.065 2.913 -1.748 1.00 0.00 C ATOM 1746 CG TYR B 30 20.137 3.978 -1.768 1.00 0.00 C ATOM 1747 CD1 TYR B 30 21.285 3.849 -0.996 1.00 0.00 C ATOM 1748 CD2 TYR B 30 20.003 5.114 -2.559 1.00 0.00 C ATOM 1749 CE1 TYR B 30 22.269 4.820 -1.012 1.00 0.00 C ATOM 1750 CE2 TYR B 30 20.982 6.088 -2.580 1.00 0.00 C ATOM 1751 CZ TYR B 30 22.112 5.937 -1.804 1.00 0.00 C ATOM 1752 OH TYR B 30 23.089 6.905 -1.823 1.00 0.00 O ATOM 0 H TYR B 30 18.392 2.270 -4.060 1.00 0.00 H new ATOM 0 HA TYR B 30 20.582 1.528 -2.383 1.00 0.00 H new ATOM 0 HB2 TYR B 30 18.177 3.292 -2.254 1.00 0.00 H new ATOM 0 HB3 TYR B 30 18.782 2.713 -0.715 1.00 0.00 H new ATOM 0 HD1 TYR B 30 21.411 2.976 -0.373 1.00 0.00 H new ATOM 0 HD2 TYR B 30 19.119 5.237 -3.167 1.00 0.00 H new ATOM 0 HE1 TYR B 30 23.156 4.704 -0.407 1.00 0.00 H new ATOM 0 HE2 TYR B 30 20.863 6.964 -3.201 1.00 0.00 H new ATOM 0 HH TYR B 30 22.824 7.625 -2.433 1.00 0.00 H new ATOM 1762 N LEU B 31 17.807 -0.142 -2.116 1.00 0.00 N ATOM 1763 CA LEU B 31 17.203 -1.275 -1.432 1.00 0.00 C ATOM 1764 C LEU B 31 17.388 -2.551 -2.247 1.00 0.00 C ATOM 1765 O LEU B 31 16.988 -3.633 -1.816 1.00 0.00 O ATOM 1766 CB LEU B 31 15.707 -1.032 -1.171 1.00 0.00 C ATOM 1767 CG LEU B 31 15.306 0.356 -0.626 1.00 0.00 C ATOM 1768 CD1 LEU B 31 14.228 0.217 0.438 1.00 0.00 C ATOM 1769 CD2 LEU B 31 16.498 1.121 -0.061 1.00 0.00 C ATOM 0 H LEU B 31 17.319 0.164 -2.957 1.00 0.00 H new ATOM 0 HA LEU B 31 17.705 -1.390 -0.471 1.00 0.00 H new ATOM 0 HB2 LEU B 31 15.169 -1.197 -2.105 1.00 0.00 H new ATOM 0 HB3 LEU B 31 15.360 -1.786 -0.465 1.00 0.00 H new ATOM 0 HG LEU B 31 14.916 0.929 -1.467 1.00 0.00 H new ATOM 0 HD11 LEU B 31 13.956 1.204 0.812 1.00 0.00 H new ATOM 0 HD12 LEU B 31 13.349 -0.261 0.005 1.00 0.00 H new ATOM 0 HD13 LEU B 31 14.605 -0.391 1.260 1.00 0.00 H new ATOM 0 HD21 LEU B 31 16.165 2.091 0.310 1.00 0.00 H new ATOM 0 HD22 LEU B 31 16.941 0.552 0.757 1.00 0.00 H new ATOM 0 HD23 LEU B 31 17.241 1.268 -0.845 1.00 0.00 H new ATOM 1781 N ASN B 32 17.988 -2.423 -3.434 1.00 0.00 N ATOM 1782 CA ASN B 32 18.205 -3.573 -4.303 1.00 0.00 C ATOM 1783 C ASN B 32 16.911 -4.357 -4.446 1.00 0.00 C ATOM 1784 O ASN B 32 16.909 -5.587 -4.479 1.00 0.00 O ATOM 1785 CB ASN B 32 19.306 -4.472 -3.737 1.00 0.00 C ATOM 1786 CG ASN B 32 20.175 -5.077 -4.821 1.00 0.00 C ATOM 1787 OD1 ASN B 32 20.182 -4.608 -5.959 1.00 0.00 O ATOM 1788 ND2 ASN B 32 20.913 -6.126 -4.474 1.00 0.00 N ATOM 0 H ASN B 32 18.329 -1.538 -3.810 1.00 0.00 H new ATOM 0 HA ASN B 32 18.521 -3.219 -5.284 1.00 0.00 H new ATOM 0 HB2 ASN B 32 19.930 -3.892 -3.057 1.00 0.00 H new ATOM 0 HB3 ASN B 32 18.853 -5.271 -3.151 1.00 0.00 H new ATOM 0 HD21 ASN B 32 21.516 -6.575 -5.163 1.00 0.00 H new ATOM 0 HD22 ASN B 32 20.876 -6.482 -3.519 1.00 0.00 H new ATOM 1795 N ARG B 33 15.805 -3.623 -4.505 1.00 0.00 N ATOM 1796 CA ARG B 33 14.486 -4.238 -4.615 1.00 0.00 C ATOM 1797 C ARG B 33 13.756 -3.789 -5.873 1.00 0.00 C ATOM 1798 O ARG B 33 14.075 -2.752 -6.456 1.00 0.00 O ATOM 1799 CB ARG B 33 13.640 -3.886 -3.384 1.00 0.00 C ATOM 1800 CG ARG B 33 14.077 -4.608 -2.122 1.00 0.00 C ATOM 1801 CD ARG B 33 12.923 -4.790 -1.151 1.00 0.00 C ATOM 1802 NE ARG B 33 13.390 -5.091 0.201 1.00 0.00 N ATOM 1803 CZ ARG B 33 13.847 -6.283 0.578 1.00 0.00 C ATOM 1804 NH1 ARG B 33 13.890 -7.289 -0.285 1.00 0.00 N ATOM 1805 NH2 ARG B 33 14.263 -6.468 1.824 1.00 0.00 N ATOM 0 H ARG B 33 15.795 -2.603 -4.479 1.00 0.00 H new ATOM 0 HA ARG B 33 14.631 -5.317 -4.673 1.00 0.00 H new ATOM 0 HB2 ARG B 33 13.691 -2.811 -3.214 1.00 0.00 H new ATOM 0 HB3 ARG B 33 12.597 -4.128 -3.589 1.00 0.00 H new ATOM 0 HG2 ARG B 33 14.489 -5.582 -2.384 1.00 0.00 H new ATOM 0 HG3 ARG B 33 14.875 -4.044 -1.638 1.00 0.00 H new ATOM 0 HD2 ARG B 33 12.318 -3.884 -1.133 1.00 0.00 H new ATOM 0 HD3 ARG B 33 12.278 -5.597 -1.500 1.00 0.00 H new ATOM 0 HE ARG B 33 13.364 -4.345 0.896 1.00 0.00 H new ATOM 0 HH11 ARG B 33 13.572 -7.152 -1.244 1.00 0.00 H new ATOM 0 HH12 ARG B 33 14.241 -8.200 0.011 1.00 0.00 H new ATOM 0 HH21 ARG B 33 14.232 -5.697 2.492 1.00 0.00 H new ATOM 0 HH22 ARG B 33 14.613 -7.381 2.114 1.00 0.00 H new ATOM 1819 N ASP B 34 12.755 -4.565 -6.270 1.00 0.00 N ATOM 1820 CA ASP B 34 11.952 -4.233 -7.436 1.00 0.00 C ATOM 1821 C ASP B 34 10.947 -3.160 -7.049 1.00 0.00 C ATOM 1822 O ASP B 34 10.533 -3.087 -5.892 1.00 0.00 O ATOM 1823 CB ASP B 34 11.232 -5.474 -7.969 1.00 0.00 C ATOM 1824 CG ASP B 34 11.371 -5.623 -9.471 1.00 0.00 C ATOM 1825 OD1 ASP B 34 10.400 -6.076 -10.114 1.00 0.00 O ATOM 1826 OD2 ASP B 34 12.448 -5.285 -10.004 1.00 0.00 O ATOM 0 H ASP B 34 12.481 -5.428 -5.800 1.00 0.00 H new ATOM 0 HA ASP B 34 12.600 -3.860 -8.229 1.00 0.00 H new ATOM 0 HB2 ASP B 34 11.634 -6.362 -7.480 1.00 0.00 H new ATOM 0 HB3 ASP B 34 10.175 -5.417 -7.709 1.00 0.00 H new ATOM 1831 N MET B 35 10.560 -2.320 -8.001 1.00 0.00 N ATOM 1832 CA MET B 35 9.617 -1.257 -7.718 1.00 0.00 C ATOM 1833 C MET B 35 8.399 -1.801 -6.973 1.00 0.00 C ATOM 1834 O MET B 35 7.871 -1.151 -6.075 1.00 0.00 O ATOM 1835 CB MET B 35 9.218 -0.551 -9.019 1.00 0.00 C ATOM 1836 CG MET B 35 7.728 -0.326 -9.164 1.00 0.00 C ATOM 1837 SD MET B 35 7.289 0.488 -10.711 1.00 0.00 S ATOM 1838 CE MET B 35 6.026 1.627 -10.149 1.00 0.00 C ATOM 0 H MET B 35 10.884 -2.357 -8.967 1.00 0.00 H new ATOM 0 HA MET B 35 10.092 -0.522 -7.068 1.00 0.00 H new ATOM 0 HB2 MET B 35 9.727 0.411 -9.069 1.00 0.00 H new ATOM 0 HB3 MET B 35 9.570 -1.142 -9.864 1.00 0.00 H new ATOM 0 HG2 MET B 35 7.213 -1.285 -9.105 1.00 0.00 H new ATOM 0 HG3 MET B 35 7.374 0.278 -8.328 1.00 0.00 H new ATOM 0 HE1 MET B 35 5.103 1.449 -10.701 1.00 0.00 H new ATOM 0 HE2 MET B 35 5.847 1.475 -9.085 1.00 0.00 H new ATOM 0 HE3 MET B 35 6.358 2.651 -10.318 1.00 0.00 H new ATOM 1848 N THR B 36 7.972 -3.005 -7.337 1.00 0.00 N ATOM 1849 CA THR B 36 6.833 -3.628 -6.677 1.00 0.00 C ATOM 1850 C THR B 36 7.186 -3.961 -5.233 1.00 0.00 C ATOM 1851 O THR B 36 6.485 -3.562 -4.306 1.00 0.00 O ATOM 1852 CB THR B 36 6.404 -4.905 -7.411 1.00 0.00 C ATOM 1853 OG1 THR B 36 7.531 -5.578 -7.943 1.00 0.00 O ATOM 1854 CG2 THR B 36 5.437 -4.668 -8.551 1.00 0.00 C ATOM 0 H THR B 36 8.393 -3.564 -8.079 1.00 0.00 H new ATOM 0 HA THR B 36 6.002 -2.923 -6.695 1.00 0.00 H new ATOM 0 HB THR B 36 5.896 -5.503 -6.654 1.00 0.00 H new ATOM 0 HG1 THR B 36 7.238 -6.391 -8.406 1.00 0.00 H new ATOM 0 HG21 THR B 36 5.184 -5.620 -9.017 1.00 0.00 H new ATOM 0 HG22 THR B 36 4.531 -4.199 -8.168 1.00 0.00 H new ATOM 0 HG23 THR B 36 5.899 -4.014 -9.290 1.00 0.00 H new ATOM 1862 N GLU B 37 8.283 -4.691 -5.054 1.00 0.00 N ATOM 1863 CA GLU B 37 8.740 -5.081 -3.725 1.00 0.00 C ATOM 1864 C GLU B 37 8.926 -3.861 -2.827 1.00 0.00 C ATOM 1865 O GLU B 37 8.698 -3.928 -1.622 1.00 0.00 O ATOM 1866 CB GLU B 37 10.053 -5.861 -3.826 1.00 0.00 C ATOM 1867 CG GLU B 37 9.979 -7.256 -3.227 1.00 0.00 C ATOM 1868 CD GLU B 37 10.116 -8.348 -4.271 1.00 0.00 C ATOM 1869 OE1 GLU B 37 10.652 -9.426 -3.936 1.00 0.00 O ATOM 1870 OE2 GLU B 37 9.685 -8.127 -5.422 1.00 0.00 O ATOM 0 H GLU B 37 8.873 -5.025 -5.816 1.00 0.00 H new ATOM 0 HA GLU B 37 7.977 -5.719 -3.280 1.00 0.00 H new ATOM 0 HB2 GLU B 37 10.340 -5.940 -4.875 1.00 0.00 H new ATOM 0 HB3 GLU B 37 10.839 -5.299 -3.322 1.00 0.00 H new ATOM 0 HG2 GLU B 37 10.767 -7.370 -2.482 1.00 0.00 H new ATOM 0 HG3 GLU B 37 9.029 -7.374 -2.706 1.00 0.00 H new ATOM 1877 N ILE B 38 9.343 -2.748 -3.422 1.00 0.00 N ATOM 1878 CA ILE B 38 9.560 -1.516 -2.672 1.00 0.00 C ATOM 1879 C ILE B 38 8.233 -0.828 -2.349 1.00 0.00 C ATOM 1880 O ILE B 38 7.952 -0.526 -1.190 1.00 0.00 O ATOM 1881 CB ILE B 38 10.451 -0.536 -3.460 1.00 0.00 C ATOM 1882 CG1 ILE B 38 11.928 -0.937 -3.394 1.00 0.00 C ATOM 1883 CG2 ILE B 38 10.290 0.883 -2.951 1.00 0.00 C ATOM 1884 CD1 ILE B 38 12.575 -1.057 -4.753 1.00 0.00 C ATOM 0 H ILE B 38 9.537 -2.674 -4.421 1.00 0.00 H new ATOM 0 HA ILE B 38 10.060 -1.791 -1.743 1.00 0.00 H new ATOM 0 HB ILE B 38 10.124 -0.581 -4.499 1.00 0.00 H new ATOM 0 HG12 ILE B 38 12.472 -0.199 -2.804 1.00 0.00 H new ATOM 0 HG13 ILE B 38 12.016 -1.890 -2.872 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.931 1.551 -3.526 1.00 0.00 H new ATOM 0 HG22 ILE B 38 9.251 1.193 -3.061 1.00 0.00 H new ATOM 0 HG23 ILE B 38 10.572 0.926 -1.899 1.00 0.00 H new ATOM 0 HD11 ILE B 38 13.620 -1.344 -4.634 1.00 0.00 H new ATOM 0 HD12 ILE B 38 12.055 -1.816 -5.338 1.00 0.00 H new ATOM 0 HD13 ILE B 38 12.518 -0.099 -5.269 1.00 0.00 H new ATOM 1896 N ILE B 39 7.420 -0.573 -3.378 1.00 0.00 N ATOM 1897 CA ILE B 39 6.137 0.090 -3.168 1.00 0.00 C ATOM 1898 C ILE B 39 5.245 -0.759 -2.278 1.00 0.00 C ATOM 1899 O ILE B 39 4.492 -0.238 -1.453 1.00 0.00 O ATOM 1900 CB ILE B 39 5.403 0.388 -4.496 1.00 0.00 C ATOM 1901 CG1 ILE B 39 4.740 -0.876 -5.046 1.00 0.00 C ATOM 1902 CG2 ILE B 39 6.359 0.981 -5.519 1.00 0.00 C ATOM 1903 CD1 ILE B 39 3.302 -1.039 -4.602 1.00 0.00 C ATOM 0 H ILE B 39 7.625 -0.812 -4.348 1.00 0.00 H new ATOM 0 HA ILE B 39 6.349 1.043 -2.684 1.00 0.00 H new ATOM 0 HB ILE B 39 4.622 1.121 -4.294 1.00 0.00 H new ATOM 0 HG12 ILE B 39 4.776 -0.853 -6.135 1.00 0.00 H new ATOM 0 HG13 ILE B 39 5.313 -1.747 -4.727 1.00 0.00 H new ATOM 0 HG21 ILE B 39 5.821 1.183 -6.445 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.776 1.911 -5.131 1.00 0.00 H new ATOM 0 HG23 ILE B 39 7.166 0.275 -5.714 1.00 0.00 H new ATOM 0 HD11 ILE B 39 2.892 -1.955 -5.027 1.00 0.00 H new ATOM 0 HD12 ILE B 39 3.261 -1.094 -3.514 1.00 0.00 H new ATOM 0 HD13 ILE B 39 2.717 -0.186 -4.945 1.00 0.00 H new ATOM 1915 N GLU B 40 5.344 -2.072 -2.442 1.00 0.00 N ATOM 1916 CA GLU B 40 4.554 -2.990 -1.647 1.00 0.00 C ATOM 1917 C GLU B 40 5.150 -3.115 -0.251 1.00 0.00 C ATOM 1918 O GLU B 40 4.446 -3.429 0.708 1.00 0.00 O ATOM 1919 CB GLU B 40 4.477 -4.364 -2.318 1.00 0.00 C ATOM 1920 CG GLU B 40 5.783 -5.141 -2.274 1.00 0.00 C ATOM 1921 CD GLU B 40 5.722 -6.339 -1.346 1.00 0.00 C ATOM 1922 OE1 GLU B 40 4.831 -6.368 -0.472 1.00 0.00 O ATOM 1923 OE2 GLU B 40 6.567 -7.247 -1.493 1.00 0.00 O ATOM 0 H GLU B 40 5.963 -2.520 -3.118 1.00 0.00 H new ATOM 0 HA GLU B 40 3.541 -2.595 -1.567 1.00 0.00 H new ATOM 0 HB2 GLU B 40 3.698 -4.952 -1.832 1.00 0.00 H new ATOM 0 HB3 GLU B 40 4.177 -4.234 -3.358 1.00 0.00 H new ATOM 0 HG2 GLU B 40 6.034 -5.478 -3.280 1.00 0.00 H new ATOM 0 HG3 GLU B 40 6.585 -4.477 -1.951 1.00 0.00 H new ATOM 1930 N GLU B 41 6.450 -2.843 -0.135 1.00 0.00 N ATOM 1931 CA GLU B 41 7.110 -2.904 1.161 1.00 0.00 C ATOM 1932 C GLU B 41 6.914 -1.589 1.903 1.00 0.00 C ATOM 1933 O GLU B 41 6.843 -1.556 3.132 1.00 0.00 O ATOM 1934 CB GLU B 41 8.603 -3.207 0.999 1.00 0.00 C ATOM 1935 CG GLU B 41 9.377 -3.185 2.307 1.00 0.00 C ATOM 1936 CD GLU B 41 10.847 -3.506 2.119 1.00 0.00 C ATOM 1937 OE1 GLU B 41 11.155 -4.484 1.405 1.00 0.00 O ATOM 1938 OE2 GLU B 41 11.690 -2.781 2.687 1.00 0.00 O ATOM 0 H GLU B 41 7.056 -2.582 -0.913 1.00 0.00 H new ATOM 0 HA GLU B 41 6.663 -3.711 1.741 1.00 0.00 H new ATOM 0 HB2 GLU B 41 8.717 -4.187 0.536 1.00 0.00 H new ATOM 0 HB3 GLU B 41 9.040 -2.479 0.316 1.00 0.00 H new ATOM 0 HG2 GLU B 41 9.279 -2.201 2.766 1.00 0.00 H new ATOM 0 HG3 GLU B 41 8.937 -3.904 2.998 1.00 0.00 H new ATOM 1945 N ALA B 42 6.811 -0.503 1.139 1.00 0.00 N ATOM 1946 CA ALA B 42 6.609 0.819 1.715 1.00 0.00 C ATOM 1947 C ALA B 42 5.162 0.999 2.154 1.00 0.00 C ATOM 1948 O ALA B 42 4.888 1.551 3.219 1.00 0.00 O ATOM 1949 CB ALA B 42 7.000 1.897 0.715 1.00 0.00 C ATOM 0 H ALA B 42 6.864 -0.516 0.120 1.00 0.00 H new ATOM 0 HA ALA B 42 7.247 0.912 2.594 1.00 0.00 H new ATOM 0 HB1 ALA B 42 6.844 2.880 1.160 1.00 0.00 H new ATOM 0 HB2 ALA B 42 8.051 1.782 0.449 1.00 0.00 H new ATOM 0 HB3 ALA B 42 6.386 1.802 -0.181 1.00 0.00 H new ATOM 1955 N VAL B 43 4.237 0.520 1.325 1.00 0.00 N ATOM 1956 CA VAL B 43 2.812 0.620 1.626 1.00 0.00 C ATOM 1957 C VAL B 43 2.497 0.020 2.982 1.00 0.00 C ATOM 1958 O VAL B 43 2.030 0.701 3.893 1.00 0.00 O ATOM 1959 CB VAL B 43 1.951 -0.113 0.565 1.00 0.00 C ATOM 1960 CG1 VAL B 43 2.496 -1.489 0.257 1.00 0.00 C ATOM 1961 CG2 VAL B 43 0.512 -0.236 1.027 1.00 0.00 C ATOM 0 H VAL B 43 4.449 0.059 0.440 1.00 0.00 H new ATOM 0 HA VAL B 43 2.570 1.683 1.621 1.00 0.00 H new ATOM 0 HB VAL B 43 1.989 0.487 -0.344 1.00 0.00 H new ATOM 0 HG11 VAL B 43 1.866 -1.971 -0.490 1.00 0.00 H new ATOM 0 HG12 VAL B 43 3.512 -1.400 -0.128 1.00 0.00 H new ATOM 0 HG13 VAL B 43 2.504 -2.089 1.167 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -0.072 -0.754 0.266 1.00 0.00 H new ATOM 0 HG22 VAL B 43 0.476 -0.801 1.958 1.00 0.00 H new ATOM 0 HG23 VAL B 43 0.096 0.758 1.190 1.00 0.00 H new ATOM 1971 N VAL B 44 2.754 -1.267 3.090 1.00 0.00 N ATOM 1972 CA VAL B 44 2.504 -1.998 4.312 1.00 0.00 C ATOM 1973 C VAL B 44 3.232 -1.346 5.475 1.00 0.00 C ATOM 1974 O VAL B 44 2.642 -1.062 6.513 1.00 0.00 O ATOM 1975 CB VAL B 44 2.937 -3.467 4.150 1.00 0.00 C ATOM 1976 CG1 VAL B 44 3.578 -4.011 5.421 1.00 0.00 C ATOM 1977 CG2 VAL B 44 1.758 -4.330 3.731 1.00 0.00 C ATOM 0 H VAL B 44 3.141 -1.833 2.335 1.00 0.00 H new ATOM 0 HA VAL B 44 1.435 -1.976 4.524 1.00 0.00 H new ATOM 0 HB VAL B 44 3.691 -3.502 3.364 1.00 0.00 H new ATOM 0 HG11 VAL B 44 3.869 -5.050 5.266 1.00 0.00 H new ATOM 0 HG12 VAL B 44 4.460 -3.419 5.666 1.00 0.00 H new ATOM 0 HG13 VAL B 44 2.864 -3.954 6.242 1.00 0.00 H new ATOM 0 HG21 VAL B 44 2.085 -5.364 3.622 1.00 0.00 H new ATOM 0 HG22 VAL B 44 0.978 -4.274 4.490 1.00 0.00 H new ATOM 0 HG23 VAL B 44 1.365 -3.972 2.780 1.00 0.00 H new ATOM 1987 N MET B 45 4.518 -1.095 5.291 1.00 0.00 N ATOM 1988 CA MET B 45 5.311 -0.460 6.329 1.00 0.00 C ATOM 1989 C MET B 45 4.662 0.852 6.757 1.00 0.00 C ATOM 1990 O MET B 45 4.736 1.239 7.923 1.00 0.00 O ATOM 1991 CB MET B 45 6.736 -0.208 5.844 1.00 0.00 C ATOM 1992 CG MET B 45 7.690 0.177 6.960 1.00 0.00 C ATOM 1993 SD MET B 45 7.767 -1.068 8.264 1.00 0.00 S ATOM 1994 CE MET B 45 7.775 -0.031 9.724 1.00 0.00 C ATOM 0 H MET B 45 5.031 -1.320 4.439 1.00 0.00 H new ATOM 0 HA MET B 45 5.354 -1.131 7.187 1.00 0.00 H new ATOM 0 HB2 MET B 45 7.109 -1.106 5.350 1.00 0.00 H new ATOM 0 HB3 MET B 45 6.723 0.585 5.096 1.00 0.00 H new ATOM 0 HG2 MET B 45 8.687 0.327 6.546 1.00 0.00 H new ATOM 0 HG3 MET B 45 7.377 1.129 7.389 1.00 0.00 H new ATOM 0 HE1 MET B 45 8.591 -0.333 10.380 1.00 0.00 H new ATOM 0 HE2 MET B 45 7.912 1.010 9.430 1.00 0.00 H new ATOM 0 HE3 MET B 45 6.827 -0.138 10.251 1.00 0.00 H new ATOM 2004 N TRP B 46 4.007 1.526 5.810 1.00 0.00 N ATOM 2005 CA TRP B 46 3.333 2.780 6.112 1.00 0.00 C ATOM 2006 C TRP B 46 2.189 2.527 7.080 1.00 0.00 C ATOM 2007 O TRP B 46 2.170 3.058 8.191 1.00 0.00 O ATOM 2008 CB TRP B 46 2.801 3.428 4.832 1.00 0.00 C ATOM 2009 CG TRP B 46 2.398 4.859 5.011 1.00 0.00 C ATOM 2010 CD1 TRP B 46 3.080 5.958 4.579 1.00 0.00 C ATOM 2011 CD2 TRP B 46 1.223 5.348 5.670 1.00 0.00 C ATOM 2012 NE1 TRP B 46 2.402 7.101 4.928 1.00 0.00 N ATOM 2013 CE2 TRP B 46 1.259 6.753 5.598 1.00 0.00 C ATOM 2014 CE3 TRP B 46 0.142 4.736 6.313 1.00 0.00 C ATOM 2015 CZ2 TRP B 46 0.260 7.554 6.144 1.00 0.00 C ATOM 2016 CZ3 TRP B 46 -0.850 5.532 6.854 1.00 0.00 C ATOM 2017 CH2 TRP B 46 -0.785 6.929 6.766 1.00 0.00 C ATOM 0 H TRP B 46 3.932 1.225 4.838 1.00 0.00 H new ATOM 0 HA TRP B 46 4.050 3.461 6.570 1.00 0.00 H new ATOM 0 HB2 TRP B 46 3.567 3.368 4.058 1.00 0.00 H new ATOM 0 HB3 TRP B 46 1.943 2.859 4.475 1.00 0.00 H new ATOM 0 HD1 TRP B 46 4.016 5.934 4.041 1.00 0.00 H new ATOM 0 HE1 TRP B 46 2.701 8.054 4.722 1.00 0.00 H new ATOM 0 HE3 TRP B 46 0.083 3.660 6.385 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 0.309 8.631 6.079 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -1.689 5.070 7.353 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -1.576 7.524 7.198 1.00 0.00 H new ATOM 2028 N LEU B 47 1.245 1.695 6.658 1.00 0.00 N ATOM 2029 CA LEU B 47 0.105 1.350 7.497 1.00 0.00 C ATOM 2030 C LEU B 47 0.580 0.785 8.819 1.00 0.00 C ATOM 2031 O LEU B 47 0.055 1.109 9.881 1.00 0.00 O ATOM 2032 CB LEU B 47 -0.788 0.298 6.831 1.00 0.00 C ATOM 2033 CG LEU B 47 -0.089 -0.704 5.911 1.00 0.00 C ATOM 2034 CD1 LEU B 47 0.136 -2.013 6.648 1.00 0.00 C ATOM 2035 CD2 LEU B 47 -0.911 -0.935 4.651 1.00 0.00 C ATOM 0 H LEU B 47 1.246 1.248 5.741 1.00 0.00 H new ATOM 0 HA LEU B 47 -0.466 2.266 7.650 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -1.302 -0.259 7.614 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -1.553 0.816 6.253 1.00 0.00 H new ATOM 0 HG LEU B 47 0.878 -0.296 5.616 1.00 0.00 H new ATOM 0 HD11 LEU B 47 0.634 -2.722 5.987 1.00 0.00 H new ATOM 0 HD12 LEU B 47 0.759 -1.835 7.524 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -0.824 -2.423 6.963 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.398 -1.651 4.008 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -1.891 -1.328 4.923 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -1.033 0.008 4.118 1.00 0.00 H new ATOM 2047 N ILE B 48 1.563 -0.089 8.730 1.00 0.00 N ATOM 2048 CA ILE B 48 2.110 -0.745 9.891 1.00 0.00 C ATOM 2049 C ILE B 48 2.784 0.232 10.837 1.00 0.00 C ATOM 2050 O ILE B 48 2.634 0.128 12.053 1.00 0.00 O ATOM 2051 CB ILE B 48 3.091 -1.844 9.456 1.00 0.00 C ATOM 2052 CG1 ILE B 48 2.518 -3.200 9.820 1.00 0.00 C ATOM 2053 CG2 ILE B 48 4.466 -1.649 10.075 1.00 0.00 C ATOM 2054 CD1 ILE B 48 1.159 -3.470 9.201 1.00 0.00 C ATOM 0 H ILE B 48 2.001 -0.361 7.850 1.00 0.00 H new ATOM 0 HA ILE B 48 1.283 -1.196 10.439 1.00 0.00 H new ATOM 0 HB ILE B 48 3.221 -1.785 8.375 1.00 0.00 H new ATOM 0 HG12 ILE B 48 3.214 -3.977 9.502 1.00 0.00 H new ATOM 0 HG13 ILE B 48 2.435 -3.271 10.904 1.00 0.00 H new ATOM 0 HG21 ILE B 48 5.131 -2.446 9.743 1.00 0.00 H new ATOM 0 HG22 ILE B 48 4.871 -0.686 9.765 1.00 0.00 H new ATOM 0 HG23 ILE B 48 4.383 -1.675 11.162 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.811 -4.457 9.504 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.449 -2.715 9.539 1.00 0.00 H new ATOM 0 HD13 ILE B 48 1.240 -3.432 8.115 1.00 0.00 H new ATOM 2066 N GLN B 49 3.529 1.176 10.287 1.00 0.00 N ATOM 2067 CA GLN B 49 4.213 2.146 11.119 1.00 0.00 C ATOM 2068 C GLN B 49 3.261 3.261 11.549 1.00 0.00 C ATOM 2069 O GLN B 49 3.543 3.998 12.494 1.00 0.00 O ATOM 2070 CB GLN B 49 5.423 2.732 10.385 1.00 0.00 C ATOM 2071 CG GLN B 49 5.063 3.742 9.305 1.00 0.00 C ATOM 2072 CD GLN B 49 6.260 4.156 8.471 1.00 0.00 C ATOM 2073 OE1 GLN B 49 7.002 3.313 7.968 1.00 0.00 O ATOM 2074 NE2 GLN B 49 6.451 5.461 8.320 1.00 0.00 N ATOM 0 H GLN B 49 3.673 1.290 9.284 1.00 0.00 H new ATOM 0 HA GLN B 49 4.566 1.633 12.013 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.079 3.211 11.112 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.990 1.918 9.932 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.301 3.315 8.653 1.00 0.00 H new ATOM 0 HG3 GLN B 49 4.626 4.626 9.770 1.00 0.00 H new ATOM 0 HE21 GLN B 49 5.810 6.124 8.756 1.00 0.00 H new ATOM 0 HE22 GLN B 49 7.239 5.801 7.768 1.00 0.00 H new ATOM 2083 N ASN B 50 2.138 3.388 10.842 1.00 0.00 N ATOM 2084 CA ASN B 50 1.158 4.426 11.153 1.00 0.00 C ATOM 2085 C ASN B 50 0.015 3.895 12.012 1.00 0.00 C ATOM 2086 O ASN B 50 -0.218 4.373 13.121 1.00 0.00 O ATOM 2087 CB ASN B 50 0.601 5.027 9.862 1.00 0.00 C ATOM 2088 CG ASN B 50 0.116 6.451 10.050 1.00 0.00 C ATOM 2089 OD1 ASN B 50 -0.885 6.695 10.723 1.00 0.00 O ATOM 2090 ND2 ASN B 50 0.827 7.400 9.453 1.00 0.00 N ATOM 0 H ASN B 50 1.886 2.789 10.056 1.00 0.00 H new ATOM 0 HA ASN B 50 1.672 5.198 11.726 1.00 0.00 H new ATOM 0 HB2 ASN B 50 1.373 5.008 9.093 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -0.223 4.410 9.503 1.00 0.00 H new ATOM 0 HD21 ASN B 50 0.550 8.378 9.543 1.00 0.00 H new ATOM 0 HD22 ASN B 50 1.650 7.152 8.905 1.00 0.00 H new ATOM 2097 N LYS B 51 -0.709 2.920 11.478 1.00 0.00 N ATOM 2098 CA LYS B 51 -1.854 2.329 12.171 1.00 0.00 C ATOM 2099 C LYS B 51 -1.508 1.891 13.592 1.00 0.00 C ATOM 2100 O LYS B 51 -2.221 2.224 14.539 1.00 0.00 O ATOM 2101 CB LYS B 51 -2.395 1.139 11.377 1.00 0.00 C ATOM 2102 CG LYS B 51 -3.916 1.069 11.344 1.00 0.00 C ATOM 2103 CD LYS B 51 -4.531 2.339 10.768 1.00 0.00 C ATOM 2104 CE LYS B 51 -3.900 2.724 9.438 1.00 0.00 C ATOM 2105 NZ LYS B 51 -2.967 3.875 9.577 1.00 0.00 N ATOM 0 H LYS B 51 -0.524 2.517 10.560 1.00 0.00 H new ATOM 0 HA LYS B 51 -2.620 3.101 12.243 1.00 0.00 H new ATOM 0 HB2 LYS B 51 -2.020 1.194 10.355 1.00 0.00 H new ATOM 0 HB3 LYS B 51 -2.006 0.217 11.810 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -4.227 0.212 10.747 1.00 0.00 H new ATOM 0 HG3 LYS B 51 -4.294 0.908 12.354 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -5.603 2.194 10.633 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -4.407 3.156 11.478 1.00 0.00 H new ATOM 0 HE2 LYS B 51 -3.362 1.868 9.031 1.00 0.00 H new ATOM 0 HE3 LYS B 51 -4.684 2.977 8.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 -3.091 4.522 8.772 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 -3.170 4.382 10.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -1.987 3.527 9.594 1.00 0.00 H new ATOM 2119 N GLU B 52 -0.422 1.135 13.739 1.00 0.00 N ATOM 2120 CA GLU B 52 0.000 0.645 15.052 1.00 0.00 C ATOM 2121 C GLU B 52 -0.048 1.749 16.106 1.00 0.00 C ATOM 2122 O GLU B 52 -0.411 1.508 17.257 1.00 0.00 O ATOM 2123 CB GLU B 52 1.412 0.062 14.975 1.00 0.00 C ATOM 2124 CG GLU B 52 1.438 -1.456 14.921 1.00 0.00 C ATOM 2125 CD GLU B 52 2.796 -2.004 14.525 1.00 0.00 C ATOM 2126 OE1 GLU B 52 2.868 -3.191 14.143 1.00 0.00 O ATOM 2127 OE2 GLU B 52 3.786 -1.246 14.596 1.00 0.00 O ATOM 0 H GLU B 52 0.181 0.848 12.968 1.00 0.00 H new ATOM 0 HA GLU B 52 -0.698 -0.138 15.350 1.00 0.00 H new ATOM 0 HB2 GLU B 52 1.912 0.458 14.091 1.00 0.00 H new ATOM 0 HB3 GLU B 52 1.983 0.397 15.841 1.00 0.00 H new ATOM 0 HG2 GLU B 52 1.160 -1.855 15.896 1.00 0.00 H new ATOM 0 HG3 GLU B 52 0.689 -1.803 14.209 1.00 0.00 H new ATOM 2134 N LYS B 53 0.326 2.957 15.705 1.00 0.00 N ATOM 2135 CA LYS B 53 0.332 4.097 16.614 1.00 0.00 C ATOM 2136 C LYS B 53 -0.488 5.253 16.050 1.00 0.00 C ATOM 2137 O LYS B 53 -0.205 6.414 16.333 1.00 0.00 O ATOM 2138 CB LYS B 53 1.768 4.556 16.875 1.00 0.00 C ATOM 2139 CG LYS B 53 2.571 4.789 15.605 1.00 0.00 C ATOM 2140 CD LYS B 53 3.463 6.015 15.727 1.00 0.00 C ATOM 2141 CE LYS B 53 2.819 7.237 15.094 1.00 0.00 C ATOM 2142 NZ LYS B 53 3.815 8.086 14.385 1.00 0.00 N ATOM 0 H LYS B 53 0.630 3.173 14.756 1.00 0.00 H new ATOM 0 HA LYS B 53 -0.121 3.782 17.554 1.00 0.00 H new ATOM 0 HB2 LYS B 53 1.746 5.478 17.456 1.00 0.00 H new ATOM 0 HB3 LYS B 53 2.275 3.808 17.484 1.00 0.00 H new ATOM 0 HG2 LYS B 53 3.183 3.912 15.394 1.00 0.00 H new ATOM 0 HG3 LYS B 53 1.892 4.914 14.762 1.00 0.00 H new ATOM 0 HD2 LYS B 53 3.668 6.214 16.779 1.00 0.00 H new ATOM 0 HD3 LYS B 53 4.422 5.818 15.247 1.00 0.00 H new ATOM 0 HE2 LYS B 53 2.049 6.918 14.392 1.00 0.00 H new ATOM 0 HE3 LYS B 53 2.323 7.826 15.865 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 3.335 8.909 13.967 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 4.537 8.411 15.060 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 4.270 7.532 13.632 1.00 0.00 H new ATOM 2156 N LEU B 54 -1.498 4.926 15.244 1.00 0.00 N ATOM 2157 CA LEU B 54 -2.351 5.941 14.629 1.00 0.00 C ATOM 2158 C LEU B 54 -2.945 6.878 15.680 1.00 0.00 C ATOM 2159 O LEU B 54 -3.907 6.528 16.364 1.00 0.00 O ATOM 2160 CB LEU B 54 -3.477 5.275 13.832 1.00 0.00 C ATOM 2161 CG LEU B 54 -4.558 6.226 13.307 1.00 0.00 C ATOM 2162 CD1 LEU B 54 -4.834 5.964 11.834 1.00 0.00 C ATOM 2163 CD2 LEU B 54 -5.835 6.087 14.124 1.00 0.00 C ATOM 0 H LEU B 54 -1.745 3.966 15.002 1.00 0.00 H new ATOM 0 HA LEU B 54 -1.732 6.533 13.955 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.038 4.748 12.985 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -3.952 4.524 14.464 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.194 7.248 13.410 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.604 6.649 11.481 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -3.920 6.118 11.260 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -5.175 4.937 11.705 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -6.591 6.770 13.737 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -6.202 5.063 14.055 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -5.628 6.329 15.167 1.00 0.00 H new ATOM 2175 N PRO B 55 -2.375 8.089 15.821 1.00 0.00 N ATOM 2176 CA PRO B 55 -2.843 9.083 16.790 1.00 0.00 C ATOM 2177 C PRO B 55 -4.149 9.741 16.360 1.00 0.00 C ATOM 2178 O PRO B 55 -4.504 9.730 15.181 1.00 0.00 O ATOM 2179 CB PRO B 55 -1.714 10.129 16.822 1.00 0.00 C ATOM 2180 CG PRO B 55 -0.593 9.541 16.029 1.00 0.00 C ATOM 2181 CD PRO B 55 -1.228 8.593 15.057 1.00 0.00 C ATOM 0 HA PRO B 55 -3.049 8.629 17.759 1.00 0.00 H new ATOM 0 HB2 PRO B 55 -2.044 11.074 16.391 1.00 0.00 H new ATOM 0 HB3 PRO B 55 -1.402 10.337 17.846 1.00 0.00 H new ATOM 0 HG2 PRO B 55 -0.034 10.318 15.508 1.00 0.00 H new ATOM 0 HG3 PRO B 55 0.113 9.021 16.677 1.00 0.00 H new ATOM 0 HD2 PRO B 55 -1.538 9.096 14.141 1.00 0.00 H new ATOM 0 HD3 PRO B 55 -0.548 7.792 14.766 1.00 0.00 H new ATOM 2189 N ASN B 56 -4.852 10.329 17.322 1.00 0.00 N ATOM 2190 CA ASN B 56 -6.111 11.007 17.041 1.00 0.00 C ATOM 2191 C ASN B 56 -5.854 12.352 16.365 1.00 0.00 C ATOM 2192 O ASN B 56 -6.699 12.860 15.628 1.00 0.00 O ATOM 2193 CB ASN B 56 -6.906 11.213 18.332 1.00 0.00 C ATOM 2194 CG ASN B 56 -7.265 9.904 19.006 1.00 0.00 C ATOM 2195 OD1 ASN B 56 -6.392 9.109 19.353 1.00 0.00 O ATOM 2196 ND2 ASN B 56 -8.560 9.672 19.194 1.00 0.00 N ATOM 0 H ASN B 56 -4.571 10.349 18.302 1.00 0.00 H new ATOM 0 HA ASN B 56 -6.694 10.381 16.365 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -6.323 11.825 19.020 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -7.819 11.766 18.109 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -8.863 8.807 19.642 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -9.250 10.359 18.891 1.00 0.00 H new ATOM 2203 N GLU B 57 -4.679 12.920 16.624 1.00 0.00 N ATOM 2204 CA GLU B 57 -4.300 14.203 16.042 1.00 0.00 C ATOM 2205 C GLU B 57 -3.753 14.030 14.626 1.00 0.00 C ATOM 2206 O GLU B 57 -3.642 15.000 13.875 1.00 0.00 O ATOM 2207 CB GLU B 57 -3.256 14.894 16.922 1.00 0.00 C ATOM 2208 CG GLU B 57 -1.928 14.157 16.982 1.00 0.00 C ATOM 2209 CD GLU B 57 -0.848 14.957 17.682 1.00 0.00 C ATOM 2210 OE1 GLU B 57 0.301 14.960 17.191 1.00 0.00 O ATOM 2211 OE2 GLU B 57 -1.150 15.581 18.721 1.00 0.00 O ATOM 0 H GLU B 57 -3.972 12.510 17.235 1.00 0.00 H new ATOM 0 HA GLU B 57 -5.195 14.823 15.988 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -3.086 15.903 16.546 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -3.653 14.994 17.932 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -2.066 13.209 17.501 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -1.601 13.921 15.969 1.00 0.00 H new ATOM 2218 N LEU B 58 -3.407 12.797 14.268 1.00 0.00 N ATOM 2219 CA LEU B 58 -2.870 12.510 12.941 1.00 0.00 C ATOM 2220 C LEU B 58 -3.988 12.322 11.920 1.00 0.00 C ATOM 2221 O LEU B 58 -3.741 12.354 10.714 1.00 0.00 O ATOM 2222 CB LEU B 58 -1.988 11.262 12.981 1.00 0.00 C ATOM 2223 CG LEU B 58 -0.555 11.464 12.482 1.00 0.00 C ATOM 2224 CD1 LEU B 58 0.363 11.851 13.632 1.00 0.00 C ATOM 2225 CD2 LEU B 58 -0.048 10.207 11.790 1.00 0.00 C ATOM 0 H LEU B 58 -3.488 11.982 14.876 1.00 0.00 H new ATOM 0 HA LEU B 58 -2.267 13.365 12.635 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.951 10.895 14.007 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -2.459 10.484 12.381 1.00 0.00 H new ATOM 0 HG LEU B 58 -0.555 12.278 11.757 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.377 11.990 13.257 1.00 0.00 H new ATOM 0 HD12 LEU B 58 0.012 12.780 14.081 1.00 0.00 H new ATOM 0 HD13 LEU B 58 0.359 11.061 14.383 1.00 0.00 H new ATOM 0 HD21 LEU B 58 0.972 10.370 11.442 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -0.063 9.374 12.492 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -0.689 9.976 10.939 1.00 0.00 H new ATOM 2237 N LYS B 59 -5.217 12.130 12.405 1.00 0.00 N ATOM 2238 CA LYS B 59 -6.373 11.944 11.528 1.00 0.00 C ATOM 2239 C LYS B 59 -6.301 12.890 10.330 1.00 0.00 C ATOM 2240 O LYS B 59 -6.370 12.457 9.180 1.00 0.00 O ATOM 2241 CB LYS B 59 -7.672 12.175 12.304 1.00 0.00 C ATOM 2242 CG LYS B 59 -8.546 10.936 12.410 1.00 0.00 C ATOM 2243 CD LYS B 59 -9.814 11.214 13.200 1.00 0.00 C ATOM 2244 CE LYS B 59 -10.758 12.129 12.435 1.00 0.00 C ATOM 2245 NZ LYS B 59 -11.896 11.376 11.835 1.00 0.00 N ATOM 0 H LYS B 59 -5.436 12.099 13.401 1.00 0.00 H new ATOM 0 HA LYS B 59 -6.360 10.918 11.159 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -7.429 12.525 13.307 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -8.239 12.969 11.818 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -8.808 10.588 11.411 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -7.985 10.134 12.890 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -10.318 10.274 13.423 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -9.556 11.672 14.155 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -11.144 12.896 13.106 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -10.207 12.643 11.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -12.516 12.035 11.322 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -11.529 10.661 11.175 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -12.437 10.906 12.589 1.00 0.00 H new ATOM 2259 N PRO B 60 -6.143 14.200 10.587 1.00 0.00 N ATOM 2260 CA PRO B 60 -6.043 15.201 9.528 1.00 0.00 C ATOM 2261 C PRO B 60 -4.660 15.208 8.886 1.00 0.00 C ATOM 2262 O PRO B 60 -4.500 15.621 7.737 1.00 0.00 O ATOM 2263 CB PRO B 60 -6.303 16.513 10.263 1.00 0.00 C ATOM 2264 CG PRO B 60 -5.808 16.270 11.647 1.00 0.00 C ATOM 2265 CD PRO B 60 -6.036 14.807 11.930 1.00 0.00 C ATOM 0 HA PRO B 60 -6.739 15.015 8.710 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -5.775 17.343 9.793 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -7.363 16.767 10.259 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -4.751 16.522 11.731 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -6.342 16.892 12.365 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -5.212 14.377 12.499 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -6.943 14.649 12.514 1.00 0.00 H new ATOM 2273 N LYS B 61 -3.661 14.740 9.634 1.00 0.00 N ATOM 2274 CA LYS B 61 -2.297 14.687 9.127 1.00 0.00 C ATOM 2275 C LYS B 61 -2.215 13.772 7.913 1.00 0.00 C ATOM 2276 O LYS B 61 -1.367 13.956 7.041 1.00 0.00 O ATOM 2277 CB LYS B 61 -1.333 14.205 10.211 1.00 0.00 C ATOM 2278 CG LYS B 61 0.109 14.620 9.965 1.00 0.00 C ATOM 2279 CD LYS B 61 0.867 13.563 9.179 1.00 0.00 C ATOM 2280 CE LYS B 61 1.810 12.773 10.073 1.00 0.00 C ATOM 2281 NZ LYS B 61 2.996 13.577 10.479 1.00 0.00 N ATOM 0 H LYS B 61 -3.773 14.395 10.587 1.00 0.00 H new ATOM 0 HA LYS B 61 -2.008 15.695 8.829 1.00 0.00 H new ATOM 0 HB2 LYS B 61 -1.657 14.597 11.175 1.00 0.00 H new ATOM 0 HB3 LYS B 61 -1.385 13.118 10.275 1.00 0.00 H new ATOM 0 HG2 LYS B 61 0.129 15.564 9.420 1.00 0.00 H new ATOM 0 HG3 LYS B 61 0.607 14.792 10.919 1.00 0.00 H new ATOM 0 HD2 LYS B 61 0.159 12.883 8.705 1.00 0.00 H new ATOM 0 HD3 LYS B 61 1.435 14.040 8.380 1.00 0.00 H new ATOM 0 HE2 LYS B 61 1.274 12.442 10.963 1.00 0.00 H new ATOM 0 HE3 LYS B 61 2.141 11.877 9.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 61 3.692 12.959 10.942 1.00 0.00 H new ATOM 0 HZ2 LYS B 61 3.425 14.012 9.637 1.00 0.00 H new ATOM 0 HZ3 LYS B 61 2.700 14.322 11.141 1.00 0.00 H new ATOM 2295 N ILE B 62 -3.111 12.790 7.848 1.00 0.00 N ATOM 2296 CA ILE B 62 -3.137 11.869 6.719 1.00 0.00 C ATOM 2297 C ILE B 62 -3.148 12.669 5.419 1.00 0.00 C ATOM 2298 O ILE B 62 -2.443 12.343 4.459 1.00 0.00 O ATOM 2299 CB ILE B 62 -4.361 10.923 6.799 1.00 0.00 C ATOM 2300 CG1 ILE B 62 -3.969 9.620 7.497 1.00 0.00 C ATOM 2301 CG2 ILE B 62 -4.937 10.633 5.416 1.00 0.00 C ATOM 2302 CD1 ILE B 62 -3.390 9.829 8.878 1.00 0.00 C ATOM 0 H ILE B 62 -3.822 12.614 8.558 1.00 0.00 H new ATOM 0 HA ILE B 62 -2.244 11.244 6.748 1.00 0.00 H new ATOM 0 HB ILE B 62 -5.136 11.423 7.380 1.00 0.00 H new ATOM 0 HG12 ILE B 62 -4.847 8.979 7.573 1.00 0.00 H new ATOM 0 HG13 ILE B 62 -3.240 9.092 6.882 1.00 0.00 H new ATOM 0 HG21 ILE B 62 -5.794 9.966 5.511 1.00 0.00 H new ATOM 0 HG22 ILE B 62 -5.253 11.566 4.951 1.00 0.00 H new ATOM 0 HG23 ILE B 62 -4.176 10.159 4.797 1.00 0.00 H new ATOM 0 HD11 ILE B 62 -3.134 8.864 9.315 1.00 0.00 H new ATOM 0 HD12 ILE B 62 -2.493 10.445 8.807 1.00 0.00 H new ATOM 0 HD13 ILE B 62 -4.125 10.329 9.509 1.00 0.00 H new ATOM 2314 N ASP B 63 -3.921 13.752 5.419 1.00 0.00 N ATOM 2315 CA ASP B 63 -3.989 14.632 4.270 1.00 0.00 C ATOM 2316 C ASP B 63 -2.622 15.266 4.073 1.00 0.00 C ATOM 2317 O ASP B 63 -2.132 15.388 2.951 1.00 0.00 O ATOM 2318 CB ASP B 63 -5.056 15.709 4.482 1.00 0.00 C ATOM 2319 CG ASP B 63 -6.174 15.624 3.461 1.00 0.00 C ATOM 2320 OD1 ASP B 63 -6.421 16.632 2.767 1.00 0.00 O ATOM 2321 OD2 ASP B 63 -6.801 14.548 3.357 1.00 0.00 O ATOM 0 H ASP B 63 -4.506 14.036 6.205 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.265 14.063 3.382 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -5.474 15.610 5.484 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -4.591 16.693 4.426 1.00 0.00 H new ATOM 2326 N GLU B 64 -1.997 15.632 5.193 1.00 0.00 N ATOM 2327 CA GLU B 64 -0.669 16.220 5.171 1.00 0.00 C ATOM 2328 C GLU B 64 0.312 15.239 4.543 1.00 0.00 C ATOM 2329 O GLU B 64 1.110 15.604 3.687 1.00 0.00 O ATOM 2330 CB GLU B 64 -0.218 16.592 6.587 1.00 0.00 C ATOM 2331 CG GLU B 64 -0.869 17.858 7.119 1.00 0.00 C ATOM 2332 CD GLU B 64 -0.271 18.311 8.436 1.00 0.00 C ATOM 2333 OE1 GLU B 64 0.972 18.370 8.534 1.00 0.00 O ATOM 2334 OE2 GLU B 64 -1.047 18.610 9.369 1.00 0.00 O ATOM 0 H GLU B 64 -2.396 15.529 6.126 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.696 17.132 4.575 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.445 15.766 7.261 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.864 16.720 6.593 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -0.762 18.654 6.382 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -1.937 17.686 7.249 1.00 0.00 H new ATOM 2341 N ILE B 65 0.222 13.980 4.955 1.00 0.00 N ATOM 2342 CA ILE B 65 1.080 12.929 4.417 1.00 0.00 C ATOM 2343 C ILE B 65 1.083 12.962 2.893 1.00 0.00 C ATOM 2344 O ILE B 65 2.132 12.864 2.268 1.00 0.00 O ATOM 2345 CB ILE B 65 0.612 11.538 4.895 1.00 0.00 C ATOM 2346 CG1 ILE B 65 0.651 11.457 6.423 1.00 0.00 C ATOM 2347 CG2 ILE B 65 1.467 10.442 4.279 1.00 0.00 C ATOM 2348 CD1 ILE B 65 2.048 11.544 6.997 1.00 0.00 C ATOM 0 H ILE B 65 -0.439 13.660 5.663 1.00 0.00 H new ATOM 0 HA ILE B 65 2.091 13.110 4.782 1.00 0.00 H new ATOM 0 HB ILE B 65 -0.417 11.391 4.568 1.00 0.00 H new ATOM 0 HG12 ILE B 65 0.046 12.263 6.837 1.00 0.00 H new ATOM 0 HG13 ILE B 65 0.194 10.520 6.741 1.00 0.00 H new ATOM 0 HG21 ILE B 65 1.120 9.470 4.629 1.00 0.00 H new ATOM 0 HG22 ILE B 65 1.388 10.486 3.193 1.00 0.00 H new ATOM 0 HG23 ILE B 65 2.507 10.583 4.573 1.00 0.00 H new ATOM 0 HD11 ILE B 65 1.999 11.480 8.084 1.00 0.00 H new ATOM 0 HD12 ILE B 65 2.652 10.722 6.612 1.00 0.00 H new ATOM 0 HD13 ILE B 65 2.501 12.493 6.709 1.00 0.00 H new ATOM 2360 N SER B 66 -0.096 13.089 2.300 1.00 0.00 N ATOM 2361 CA SER B 66 -0.204 13.119 0.845 1.00 0.00 C ATOM 2362 C SER B 66 0.053 14.511 0.266 1.00 0.00 C ATOM 2363 O SER B 66 0.809 14.656 -0.691 1.00 0.00 O ATOM 2364 CB SER B 66 -1.579 12.616 0.404 1.00 0.00 C ATOM 2365 OG SER B 66 -1.628 12.432 -1.001 1.00 0.00 O ATOM 0 H SER B 66 -0.983 13.172 2.796 1.00 0.00 H new ATOM 0 HA SER B 66 0.571 12.458 0.456 1.00 0.00 H new ATOM 0 HB2 SER B 66 -1.803 11.674 0.905 1.00 0.00 H new ATOM 0 HB3 SER B 66 -2.345 13.329 0.708 1.00 0.00 H new ATOM 0 HG SER B 66 -2.423 12.877 -1.362 1.00 0.00 H new ATOM 2371 N LYS B 67 -0.592 15.527 0.825 1.00 0.00 N ATOM 2372 CA LYS B 67 -0.433 16.892 0.325 1.00 0.00 C ATOM 2373 C LYS B 67 0.950 17.464 0.642 1.00 0.00 C ATOM 2374 O LYS B 67 1.424 18.368 -0.048 1.00 0.00 O ATOM 2375 CB LYS B 67 -1.522 17.800 0.903 1.00 0.00 C ATOM 2376 CG LYS B 67 -1.430 17.978 2.410 1.00 0.00 C ATOM 2377 CD LYS B 67 -1.392 19.448 2.800 1.00 0.00 C ATOM 2378 CE LYS B 67 -2.282 19.728 4.002 1.00 0.00 C ATOM 2379 NZ LYS B 67 -1.957 21.032 4.642 1.00 0.00 N ATOM 0 H LYS B 67 -1.226 15.436 1.619 1.00 0.00 H new ATOM 0 HA LYS B 67 -0.531 16.853 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.459 18.778 0.426 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.499 17.386 0.653 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -2.284 17.497 2.886 1.00 0.00 H new ATOM 0 HG3 LYS B 67 -0.535 17.479 2.782 1.00 0.00 H new ATOM 0 HD2 LYS B 67 -0.367 19.739 3.029 1.00 0.00 H new ATOM 0 HD3 LYS B 67 -1.715 20.058 1.956 1.00 0.00 H new ATOM 0 HE2 LYS B 67 -3.326 19.728 3.689 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -2.168 18.927 4.732 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 -2.321 21.041 5.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 -0.926 21.164 4.657 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 -2.397 21.804 4.101 1.00 0.00 H new ATOM 2393 N ARG B 68 1.590 16.952 1.688 1.00 0.00 N ATOM 2394 CA ARG B 68 2.911 17.437 2.085 1.00 0.00 C ATOM 2395 C ARG B 68 4.035 16.570 1.528 1.00 0.00 C ATOM 2396 O ARG B 68 5.126 17.067 1.251 1.00 0.00 O ATOM 2397 CB ARG B 68 3.018 17.513 3.606 1.00 0.00 C ATOM 2398 CG ARG B 68 1.938 18.376 4.231 1.00 0.00 C ATOM 2399 CD ARG B 68 2.181 18.588 5.718 1.00 0.00 C ATOM 2400 NE ARG B 68 3.085 19.707 5.973 1.00 0.00 N ATOM 2401 CZ ARG B 68 2.700 20.981 6.001 1.00 0.00 C ATOM 2402 NH1 ARG B 68 1.431 21.305 5.785 1.00 0.00 N ATOM 2403 NH2 ARG B 68 3.588 21.935 6.246 1.00 0.00 N ATOM 0 H ARG B 68 1.219 16.205 2.275 1.00 0.00 H new ATOM 0 HA ARG B 68 3.024 18.436 1.663 1.00 0.00 H new ATOM 0 HB2 ARG B 68 2.957 16.507 4.020 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.996 17.911 3.877 1.00 0.00 H new ATOM 0 HG2 ARG B 68 1.905 19.341 3.726 1.00 0.00 H new ATOM 0 HG3 ARG B 68 0.966 17.906 4.084 1.00 0.00 H new ATOM 0 HD2 ARG B 68 1.230 18.770 6.218 1.00 0.00 H new ATOM 0 HD3 ARG B 68 2.599 17.679 6.150 1.00 0.00 H new ATOM 0 HE ARG B 68 4.070 19.500 6.139 1.00 0.00 H new ATOM 0 HH11 ARG B 68 0.743 20.576 5.596 1.00 0.00 H new ATOM 0 HH12 ARG B 68 1.143 22.283 5.808 1.00 0.00 H new ATOM 0 HH21 ARG B 68 4.565 21.692 6.413 1.00 0.00 H new ATOM 0 HH22 ARG B 68 3.294 22.912 6.268 1.00 0.00 H new ATOM 2417 N PHE B 69 3.774 15.278 1.355 1.00 0.00 N ATOM 2418 CA PHE B 69 4.786 14.378 0.818 1.00 0.00 C ATOM 2419 C PHE B 69 4.570 14.207 -0.679 1.00 0.00 C ATOM 2420 O PHE B 69 5.514 14.012 -1.443 1.00 0.00 O ATOM 2421 CB PHE B 69 4.765 13.030 1.553 1.00 0.00 C ATOM 2422 CG PHE B 69 4.953 13.162 3.048 1.00 0.00 C ATOM 2423 CD1 PHE B 69 4.106 13.957 3.810 1.00 0.00 C ATOM 2424 CD2 PHE B 69 5.985 12.498 3.690 1.00 0.00 C ATOM 2425 CE1 PHE B 69 4.289 14.081 5.174 1.00 0.00 C ATOM 2426 CE2 PHE B 69 6.171 12.619 5.054 1.00 0.00 C ATOM 2427 CZ PHE B 69 5.322 13.413 5.797 1.00 0.00 C ATOM 0 H PHE B 69 2.882 14.836 1.576 1.00 0.00 H new ATOM 0 HA PHE B 69 5.774 14.811 0.976 1.00 0.00 H new ATOM 0 HB2 PHE B 69 3.816 12.531 1.356 1.00 0.00 H new ATOM 0 HB3 PHE B 69 5.551 12.392 1.150 1.00 0.00 H new ATOM 0 HD1 PHE B 69 3.295 14.484 3.330 1.00 0.00 H new ATOM 0 HD2 PHE B 69 6.655 11.876 3.115 1.00 0.00 H new ATOM 0 HE1 PHE B 69 3.622 14.702 5.753 1.00 0.00 H new ATOM 0 HE2 PHE B 69 6.980 12.092 5.538 1.00 0.00 H new ATOM 0 HZ PHE B 69 5.466 13.511 6.863 1.00 0.00 H new ATOM 2437 N PHE B 70 3.313 14.340 -1.089 1.00 0.00 N ATOM 2438 CA PHE B 70 2.936 14.263 -2.492 1.00 0.00 C ATOM 2439 C PHE B 70 2.184 15.540 -2.862 1.00 0.00 C ATOM 2440 O PHE B 70 1.059 15.494 -3.360 1.00 0.00 O ATOM 2441 CB PHE B 70 2.061 13.034 -2.754 1.00 0.00 C ATOM 2442 CG PHE B 70 1.863 12.740 -4.214 1.00 0.00 C ATOM 2443 CD1 PHE B 70 0.607 12.840 -4.790 1.00 0.00 C ATOM 2444 CD2 PHE B 70 2.934 12.365 -5.010 1.00 0.00 C ATOM 2445 CE1 PHE B 70 0.421 12.571 -6.133 1.00 0.00 C ATOM 2446 CE2 PHE B 70 2.754 12.094 -6.353 1.00 0.00 C ATOM 2447 CZ PHE B 70 1.497 12.198 -6.915 1.00 0.00 C ATOM 0 H PHE B 70 2.529 14.504 -0.457 1.00 0.00 H new ATOM 0 HA PHE B 70 3.832 14.167 -3.106 1.00 0.00 H new ATOM 0 HB2 PHE B 70 2.514 12.166 -2.275 1.00 0.00 H new ATOM 0 HB3 PHE B 70 1.088 13.184 -2.286 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -0.237 13.132 -4.182 1.00 0.00 H new ATOM 0 HD2 PHE B 70 3.920 12.284 -4.576 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -0.563 12.652 -6.570 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.596 11.801 -6.963 1.00 0.00 H new ATOM 0 HZ PHE B 70 1.355 11.988 -7.965 1.00 0.00 H new ATOM 2457 N PRO B 71 2.803 16.707 -2.595 1.00 0.00 N ATOM 2458 CA PRO B 71 2.199 18.017 -2.869 1.00 0.00 C ATOM 2459 C PRO B 71 1.871 18.215 -4.345 1.00 0.00 C ATOM 2460 O PRO B 71 1.871 17.262 -5.125 1.00 0.00 O ATOM 2461 CB PRO B 71 3.275 19.016 -2.419 1.00 0.00 C ATOM 2462 CG PRO B 71 4.540 18.232 -2.382 1.00 0.00 C ATOM 2463 CD PRO B 71 4.138 16.844 -1.989 1.00 0.00 C ATOM 0 HA PRO B 71 1.247 18.136 -2.351 1.00 0.00 H new ATOM 0 HB2 PRO B 71 3.350 19.853 -3.113 1.00 0.00 H new ATOM 0 HB3 PRO B 71 3.041 19.433 -1.440 1.00 0.00 H new ATOM 0 HG2 PRO B 71 5.034 18.237 -3.354 1.00 0.00 H new ATOM 0 HG3 PRO B 71 5.243 18.655 -1.665 1.00 0.00 H new ATOM 0 HD2 PRO B 71 4.834 16.098 -2.371 1.00 0.00 H new ATOM 0 HD3 PRO B 71 4.105 16.724 -0.906 1.00 0.00 H new ATOM 2471 N ALA B 72 1.593 19.459 -4.720 1.00 0.00 N ATOM 2472 CA ALA B 72 1.264 19.786 -6.102 1.00 0.00 C ATOM 2473 C ALA B 72 2.392 20.570 -6.765 1.00 0.00 C ATOM 2474 O ALA B 72 2.581 20.498 -7.979 1.00 0.00 O ATOM 2475 CB ALA B 72 -0.035 20.576 -6.161 1.00 0.00 C ATOM 0 H ALA B 72 1.589 20.258 -4.086 1.00 0.00 H new ATOM 0 HA ALA B 72 1.135 18.852 -6.650 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.269 20.814 -7.199 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -0.842 19.981 -5.734 1.00 0.00 H new ATOM 0 HB3 ALA B 72 0.075 21.500 -5.593 1.00 0.00 H new ATOM 2481 N LYS B 73 3.141 21.319 -5.961 1.00 0.00 N ATOM 2482 CA LYS B 73 4.250 22.116 -6.472 1.00 0.00 C ATOM 2483 C LYS B 73 5.461 21.236 -6.769 1.00 0.00 C ATOM 2484 O LYS B 73 5.919 20.530 -5.847 1.00 0.00 O ATOM 2485 CB LYS B 73 4.631 23.203 -5.466 1.00 0.00 C ATOM 2486 CG LYS B 73 5.594 24.238 -6.026 1.00 0.00 C ATOM 2487 CD LYS B 73 4.862 25.493 -6.476 1.00 0.00 C ATOM 2488 CE LYS B 73 4.077 25.252 -7.756 1.00 0.00 C ATOM 2489 NZ LYS B 73 4.158 26.414 -8.684 1.00 0.00 N ATOM 2490 OXT LYS B 73 5.939 21.260 -7.923 1.00 0.00 O ATOM 0 H LYS B 73 3.000 21.390 -4.953 1.00 0.00 H new ATOM 0 HA LYS B 73 3.928 22.587 -7.401 1.00 0.00 H new ATOM 0 HB2 LYS B 73 3.726 23.707 -5.127 1.00 0.00 H new ATOM 0 HB3 LYS B 73 5.082 22.735 -4.591 1.00 0.00 H new ATOM 0 HG2 LYS B 73 6.332 24.498 -5.267 1.00 0.00 H new ATOM 0 HG3 LYS B 73 6.139 23.812 -6.868 1.00 0.00 H new ATOM 0 HD2 LYS B 73 4.184 25.822 -5.689 1.00 0.00 H new ATOM 0 HD3 LYS B 73 5.580 26.297 -6.635 1.00 0.00 H new ATOM 0 HE2 LYS B 73 4.460 24.362 -8.255 1.00 0.00 H new ATOM 0 HE3 LYS B 73 3.033 25.056 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 3.610 26.210 -9.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 3.769 27.258 -8.218 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 5.151 26.586 -8.939 1.00 0.00 H new TER 2504 LYS B 73