USER MOD reduce.3.24.130724 H: found=0, std=0, add=636, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 628 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 43 TYR OH : rot 180:sc= 0.201 USER MOD Set 1.2: A 54 LYS NZ :NH3+ 137:sc= 1.38 (180deg=0.492) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0479 (180deg=-0.389) USER MOD Single : A 1 MET N :NH3+ -179:sc= -0.186 (180deg=-0.216) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.0099) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0185 X(o=-0.018,f=0) USER MOD Single : A 9 SER OG : rot -68:sc= 0.0954 USER MOD Single : A 10 HIS : no HE2:sc= -0.669 K(o=-0.67,f=-5.7!) USER MOD Single : A 11 MET CE :methyl 169:sc= -0.0744 (180deg=-0.212) USER MOD Single : A 13 LYS NZ :NH3+ 160:sc= 1.38 (180deg=1.29) USER MOD Single : A 15 THR OG1 : rot -76:sc= 0.283 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0184 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 130:sc= 0.929 USER MOD Single : A 24 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0287) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 28 THR OG1 : rot -160:sc= 0.932 USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ -169:sc= -0.0254 (180deg=-0.194) USER MOD Single : A 36 TYR OH : rot -13:sc= 0.052 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HD1:sc= -0.416 X(o=-0.42,f=-0.69) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.0379 X(o=-0.038,f=-0.038) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot -72:sc= 1.19 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ -168:sc=-0.00504 (180deg=-0.179) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.903 20.846 -27.591 1.00 0.00 N ATOM 2 CA MET A 1 -7.876 21.683 -28.243 1.00 0.00 C ATOM 3 C MET A 1 -7.269 22.680 -27.254 1.00 0.00 C ATOM 4 O MET A 1 -6.527 23.579 -27.649 1.00 0.00 O ATOM 5 CB MET A 1 -8.475 22.431 -29.433 1.00 0.00 C ATOM 6 CG MET A 1 -8.931 21.524 -30.560 1.00 0.00 C ATOM 7 SD MET A 1 -7.586 20.540 -31.248 1.00 0.00 S ATOM 8 CE MET A 1 -6.566 21.820 -31.985 1.00 0.00 C ATOM 0 H1 MET A 1 -9.286 20.167 -28.280 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.476 20.329 -26.796 1.00 0.00 H new ATOM 0 H3 MET A 1 -9.671 21.451 -27.237 1.00 0.00 H new ATOM 0 HA MET A 1 -7.083 21.024 -28.598 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.324 23.022 -29.089 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.735 23.131 -29.820 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.712 20.858 -30.192 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.375 22.129 -31.351 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.861 21.367 -32.682 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.200 22.528 -32.518 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.017 22.343 -31.202 1.00 0.00 H new ATOM 20 N GLY A 2 -7.574 22.509 -25.971 1.00 0.00 N ATOM 21 CA GLY A 2 -7.040 23.405 -24.965 1.00 0.00 C ATOM 22 C GLY A 2 -6.144 22.679 -23.991 1.00 0.00 C ATOM 23 O GLY A 2 -6.243 21.457 -23.840 1.00 0.00 O ATOM 0 H GLY A 2 -8.178 21.769 -25.613 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -6.479 24.204 -25.450 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -7.861 23.875 -24.424 1.00 0.00 H new ATOM 27 N HIS A 3 -5.274 23.412 -23.320 1.00 0.00 N ATOM 28 CA HIS A 3 -4.358 22.804 -22.368 1.00 0.00 C ATOM 29 C HIS A 3 -5.065 22.543 -21.040 1.00 0.00 C ATOM 30 O HIS A 3 -5.310 23.461 -20.259 1.00 0.00 O ATOM 31 CB HIS A 3 -3.119 23.687 -22.158 1.00 0.00 C ATOM 32 CG HIS A 3 -2.076 23.073 -21.270 1.00 0.00 C ATOM 33 ND1 HIS A 3 -1.230 22.072 -21.687 1.00 0.00 N ATOM 34 CD2 HIS A 3 -1.751 23.318 -19.980 1.00 0.00 C ATOM 35 CE1 HIS A 3 -0.431 21.730 -20.694 1.00 0.00 C ATOM 36 NE2 HIS A 3 -0.724 22.468 -19.650 1.00 0.00 N ATOM 0 H HIS A 3 -5.181 24.423 -23.415 1.00 0.00 H new ATOM 0 HA HIS A 3 -4.026 21.850 -22.776 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -2.673 23.906 -23.128 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -3.432 24.639 -21.729 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -2.213 24.047 -19.330 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.335 20.970 -20.734 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -0.264 22.419 -18.741 1.00 0.00 H new ATOM 44 N HIS A 4 -5.395 21.288 -20.803 1.00 0.00 N ATOM 45 CA HIS A 4 -6.094 20.888 -19.588 1.00 0.00 C ATOM 46 C HIS A 4 -5.148 20.760 -18.410 1.00 0.00 C ATOM 47 O HIS A 4 -3.934 20.654 -18.580 1.00 0.00 O ATOM 48 CB HIS A 4 -6.830 19.559 -19.780 1.00 0.00 C ATOM 49 CG HIS A 4 -8.046 19.640 -20.644 1.00 0.00 C ATOM 50 ND1 HIS A 4 -8.144 19.013 -21.869 1.00 0.00 N ATOM 51 CD2 HIS A 4 -9.236 20.247 -20.438 1.00 0.00 C ATOM 52 CE1 HIS A 4 -9.344 19.238 -22.376 1.00 0.00 C ATOM 53 NE2 HIS A 4 -10.022 19.982 -21.522 1.00 0.00 N ATOM 0 H HIS A 4 -5.190 20.518 -21.440 1.00 0.00 H new ATOM 0 HA HIS A 4 -6.817 21.675 -19.377 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -6.140 18.836 -20.214 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -7.120 19.175 -18.802 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -9.514 20.834 -19.575 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -9.707 18.875 -23.326 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -10.980 20.307 -21.651 1.00 0.00 H new ATOM 61 N HIS A 5 -5.719 20.789 -17.218 1.00 0.00 N ATOM 62 CA HIS A 5 -4.965 20.622 -15.985 1.00 0.00 C ATOM 63 C HIS A 5 -5.319 19.286 -15.346 1.00 0.00 C ATOM 64 O HIS A 5 -4.930 18.989 -14.215 1.00 0.00 O ATOM 65 CB HIS A 5 -5.245 21.775 -15.012 1.00 0.00 C ATOM 66 CG HIS A 5 -4.712 23.098 -15.470 1.00 0.00 C ATOM 67 ND1 HIS A 5 -3.469 23.571 -15.110 1.00 0.00 N ATOM 68 CD2 HIS A 5 -5.255 24.058 -16.266 1.00 0.00 C ATOM 69 CE1 HIS A 5 -3.273 24.753 -15.658 1.00 0.00 C ATOM 70 NE2 HIS A 5 -4.340 25.070 -16.362 1.00 0.00 N ATOM 0 H HIS A 5 -6.719 20.929 -17.076 1.00 0.00 H new ATOM 0 HA HIS A 5 -3.901 20.635 -16.220 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -6.322 21.859 -14.864 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -4.808 21.534 -14.043 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -6.227 24.027 -16.735 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -2.386 25.360 -15.548 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -4.464 25.932 -16.893 1.00 0.00 H new ATOM 78 N HIS A 6 -6.065 18.480 -16.087 1.00 0.00 N ATOM 79 CA HIS A 6 -6.476 17.167 -15.622 1.00 0.00 C ATOM 80 C HIS A 6 -5.726 16.089 -16.370 1.00 0.00 C ATOM 81 O HIS A 6 -5.213 16.335 -17.464 1.00 0.00 O ATOM 82 CB HIS A 6 -7.979 16.963 -15.812 1.00 0.00 C ATOM 83 CG HIS A 6 -8.836 17.833 -14.945 1.00 0.00 C ATOM 84 ND1 HIS A 6 -9.761 18.721 -15.453 1.00 0.00 N ATOM 85 CD2 HIS A 6 -8.924 17.935 -13.600 1.00 0.00 C ATOM 86 CE1 HIS A 6 -10.378 19.330 -14.451 1.00 0.00 C ATOM 87 NE2 HIS A 6 -9.891 18.870 -13.323 1.00 0.00 N ATOM 0 H HIS A 6 -6.400 18.717 -17.021 1.00 0.00 H new ATOM 0 HA HIS A 6 -6.245 17.102 -14.559 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -8.230 17.152 -16.856 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -8.220 15.919 -15.610 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -8.342 17.383 -12.877 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -11.151 20.078 -14.547 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -10.184 19.160 -12.390 1.00 0.00 H new ATOM 95 N HIS A 7 -5.680 14.895 -15.780 1.00 0.00 N ATOM 96 CA HIS A 7 -4.958 13.753 -16.345 1.00 0.00 C ATOM 97 C HIS A 7 -3.475 14.065 -16.382 1.00 0.00 C ATOM 98 O HIS A 7 -2.844 14.090 -17.446 1.00 0.00 O ATOM 99 CB HIS A 7 -5.479 13.371 -17.747 1.00 0.00 C ATOM 100 CG HIS A 7 -6.920 12.945 -17.772 1.00 0.00 C ATOM 101 ND1 HIS A 7 -7.343 11.685 -17.413 1.00 0.00 N ATOM 102 CD2 HIS A 7 -8.042 13.629 -18.110 1.00 0.00 C ATOM 103 CE1 HIS A 7 -8.661 11.612 -17.529 1.00 0.00 C ATOM 104 NE2 HIS A 7 -9.105 12.773 -17.947 1.00 0.00 N ATOM 0 H HIS A 7 -6.143 14.691 -14.894 1.00 0.00 H new ATOM 0 HA HIS A 7 -5.131 12.888 -15.704 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -5.352 14.223 -18.415 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -4.865 12.562 -18.143 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -8.091 14.655 -18.445 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -9.267 10.744 -17.316 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -10.083 13.004 -18.123 1.00 0.00 H new ATOM 112 N HIS A 8 -2.931 14.321 -15.192 1.00 0.00 N ATOM 113 CA HIS A 8 -1.535 14.685 -15.030 1.00 0.00 C ATOM 114 C HIS A 8 -0.612 13.586 -15.535 1.00 0.00 C ATOM 115 O HIS A 8 -0.624 12.463 -15.035 1.00 0.00 O ATOM 116 CB HIS A 8 -1.235 15.001 -13.552 1.00 0.00 C ATOM 117 CG HIS A 8 0.181 15.446 -13.286 1.00 0.00 C ATOM 118 ND1 HIS A 8 0.556 16.770 -13.230 1.00 0.00 N ATOM 119 CD2 HIS A 8 1.313 14.728 -13.055 1.00 0.00 C ATOM 120 CE1 HIS A 8 1.851 16.850 -12.976 1.00 0.00 C ATOM 121 NE2 HIS A 8 2.333 15.624 -12.863 1.00 0.00 N ATOM 0 H HIS A 8 -3.452 14.280 -14.316 1.00 0.00 H new ATOM 0 HA HIS A 8 -1.349 15.577 -15.629 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -1.918 15.781 -13.214 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -1.443 14.114 -12.954 1.00 0.00 H new ATOM 0 HD2 HIS A 8 1.393 13.651 -13.028 1.00 0.00 H new ATOM 0 HE1 HIS A 8 2.419 17.763 -12.877 1.00 0.00 H new ATOM 0 HE2 HIS A 8 3.304 15.384 -12.665 1.00 0.00 H new ATOM 129 N SER A 9 0.165 13.922 -16.530 1.00 0.00 N ATOM 130 CA SER A 9 1.136 13.020 -17.101 1.00 0.00 C ATOM 131 C SER A 9 2.215 13.834 -17.795 1.00 0.00 C ATOM 132 O SER A 9 1.960 14.965 -18.230 1.00 0.00 O ATOM 133 CB SER A 9 0.448 12.053 -18.088 1.00 0.00 C ATOM 134 OG SER A 9 -0.379 12.758 -19.017 1.00 0.00 O ATOM 0 H SER A 9 0.143 14.840 -16.974 1.00 0.00 H new ATOM 0 HA SER A 9 1.594 12.420 -16.315 1.00 0.00 H new ATOM 0 HB2 SER A 9 1.204 11.485 -18.630 1.00 0.00 H new ATOM 0 HB3 SER A 9 -0.155 11.334 -17.534 1.00 0.00 H new ATOM 0 HG SER A 9 -1.150 13.138 -18.546 1.00 0.00 H new ATOM 140 N HIS A 10 3.412 13.287 -17.900 1.00 0.00 N ATOM 141 CA HIS A 10 4.486 14.006 -18.554 1.00 0.00 C ATOM 142 C HIS A 10 4.469 13.737 -20.051 1.00 0.00 C ATOM 143 O HIS A 10 5.157 12.853 -20.552 1.00 0.00 O ATOM 144 CB HIS A 10 5.860 13.666 -17.945 1.00 0.00 C ATOM 145 CG HIS A 10 6.992 14.485 -18.513 1.00 0.00 C ATOM 146 ND1 HIS A 10 8.085 13.928 -19.150 1.00 0.00 N ATOM 147 CD2 HIS A 10 7.193 15.822 -18.536 1.00 0.00 C ATOM 148 CE1 HIS A 10 8.901 14.895 -19.542 1.00 0.00 C ATOM 149 NE2 HIS A 10 8.382 16.049 -19.182 1.00 0.00 N ATOM 0 H HIS A 10 3.661 12.363 -17.547 1.00 0.00 H new ATOM 0 HA HIS A 10 4.320 15.071 -18.390 1.00 0.00 H new ATOM 0 HB2 HIS A 10 5.818 13.819 -16.867 1.00 0.00 H new ATOM 0 HB3 HIS A 10 6.069 12.609 -18.109 1.00 0.00 H new ATOM 0 HD1 HIS A 10 8.239 12.930 -19.295 1.00 0.00 H new ATOM 0 HD2 HIS A 10 6.538 16.574 -18.122 1.00 0.00 H new ATOM 0 HE1 HIS A 10 9.834 14.759 -20.068 1.00 0.00 H new ATOM 157 N MET A 11 3.630 14.475 -20.742 1.00 0.00 N ATOM 158 CA MET A 11 3.519 14.378 -22.183 1.00 0.00 C ATOM 159 C MET A 11 4.549 15.284 -22.828 1.00 0.00 C ATOM 160 O MET A 11 4.924 16.310 -22.256 1.00 0.00 O ATOM 161 CB MET A 11 2.107 14.752 -22.646 1.00 0.00 C ATOM 162 CG MET A 11 1.597 16.072 -22.088 1.00 0.00 C ATOM 163 SD MET A 11 -0.066 16.473 -22.667 1.00 0.00 S ATOM 164 CE MET A 11 -0.351 18.018 -21.800 1.00 0.00 C ATOM 0 H MET A 11 3.003 15.161 -20.321 1.00 0.00 H new ATOM 0 HA MET A 11 3.706 13.348 -22.486 1.00 0.00 H new ATOM 0 HB2 MET A 11 2.095 14.802 -23.735 1.00 0.00 H new ATOM 0 HB3 MET A 11 1.419 13.958 -22.356 1.00 0.00 H new ATOM 0 HG2 MET A 11 1.598 16.027 -20.999 1.00 0.00 H new ATOM 0 HG3 MET A 11 2.280 16.872 -22.374 1.00 0.00 H new ATOM 0 HE1 MET A 11 -1.247 18.497 -22.195 1.00 0.00 H new ATOM 0 HE2 MET A 11 -0.484 17.819 -20.737 1.00 0.00 H new ATOM 0 HE3 MET A 11 0.505 18.678 -21.941 1.00 0.00 H new ATOM 174 N VAL A 12 5.005 14.929 -24.005 1.00 0.00 N ATOM 175 CA VAL A 12 6.031 15.720 -24.659 1.00 0.00 C ATOM 176 C VAL A 12 5.450 16.865 -25.466 1.00 0.00 C ATOM 177 O VAL A 12 5.099 16.723 -26.640 1.00 0.00 O ATOM 178 CB VAL A 12 6.986 14.858 -25.523 1.00 0.00 C ATOM 179 CG1 VAL A 12 7.912 14.046 -24.622 1.00 0.00 C ATOM 180 CG2 VAL A 12 6.197 13.928 -26.446 1.00 0.00 C ATOM 0 H VAL A 12 4.691 14.111 -24.527 1.00 0.00 H new ATOM 0 HA VAL A 12 6.626 16.155 -23.856 1.00 0.00 H new ATOM 0 HB VAL A 12 7.585 15.524 -26.144 1.00 0.00 H new ATOM 0 HG11 VAL A 12 8.580 13.443 -25.236 1.00 0.00 H new ATOM 0 HG12 VAL A 12 8.501 14.722 -24.002 1.00 0.00 H new ATOM 0 HG13 VAL A 12 7.317 13.393 -23.983 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.890 13.334 -27.042 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.572 13.265 -25.847 1.00 0.00 H new ATOM 0 HG23 VAL A 12 5.566 14.522 -27.108 1.00 0.00 H new ATOM 190 N LYS A 13 5.327 18.000 -24.809 1.00 0.00 N ATOM 191 CA LYS A 13 4.842 19.208 -25.430 1.00 0.00 C ATOM 192 C LYS A 13 5.684 20.380 -24.981 1.00 0.00 C ATOM 193 O LYS A 13 5.463 20.938 -23.902 1.00 0.00 O ATOM 194 CB LYS A 13 3.373 19.438 -25.082 1.00 0.00 C ATOM 195 CG LYS A 13 2.445 18.407 -25.684 1.00 0.00 C ATOM 196 CD LYS A 13 0.994 18.687 -25.324 1.00 0.00 C ATOM 197 CE LYS A 13 0.039 17.758 -26.068 1.00 0.00 C ATOM 198 NZ LYS A 13 0.258 16.326 -25.735 1.00 0.00 N ATOM 0 H LYS A 13 5.563 18.107 -23.823 1.00 0.00 H new ATOM 0 HA LYS A 13 4.920 19.108 -26.513 1.00 0.00 H new ATOM 0 HB2 LYS A 13 3.259 19.430 -23.998 1.00 0.00 H new ATOM 0 HB3 LYS A 13 3.076 20.429 -25.427 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.558 18.403 -26.768 1.00 0.00 H new ATOM 0 HG3 LYS A 13 2.724 17.414 -25.331 1.00 0.00 H new ATOM 0 HD2 LYS A 13 0.856 18.566 -24.250 1.00 0.00 H new ATOM 0 HD3 LYS A 13 0.753 19.723 -25.562 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -0.988 18.030 -25.826 1.00 0.00 H new ATOM 0 HE3 LYS A 13 0.162 17.900 -27.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -0.592 15.779 -25.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 1.069 15.964 -26.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 0.451 16.232 -24.717 1.00 0.00 H new ATOM 212 N GLU A 14 6.661 20.735 -25.807 1.00 0.00 N ATOM 213 CA GLU A 14 7.595 21.813 -25.508 1.00 0.00 C ATOM 214 C GLU A 14 8.440 21.481 -24.273 1.00 0.00 C ATOM 215 O GLU A 14 8.282 22.082 -23.201 1.00 0.00 O ATOM 216 CB GLU A 14 6.867 23.151 -25.331 1.00 0.00 C ATOM 217 CG GLU A 14 7.793 24.324 -25.064 1.00 0.00 C ATOM 218 CD GLU A 14 7.035 25.608 -24.853 1.00 0.00 C ATOM 219 OE1 GLU A 14 6.535 25.831 -23.732 1.00 0.00 O ATOM 220 OE2 GLU A 14 6.916 26.401 -25.814 1.00 0.00 O ATOM 0 H GLU A 14 6.828 20.282 -26.705 1.00 0.00 H new ATOM 0 HA GLU A 14 8.267 21.913 -26.360 1.00 0.00 H new ATOM 0 HB2 GLU A 14 6.284 23.358 -26.228 1.00 0.00 H new ATOM 0 HB3 GLU A 14 6.161 23.063 -24.505 1.00 0.00 H new ATOM 0 HG2 GLU A 14 8.400 24.113 -24.183 1.00 0.00 H new ATOM 0 HG3 GLU A 14 8.479 24.442 -25.903 1.00 0.00 H new ATOM 227 N THR A 15 9.300 20.494 -24.417 1.00 0.00 N ATOM 228 CA THR A 15 10.176 20.110 -23.362 1.00 0.00 C ATOM 229 C THR A 15 11.423 20.977 -23.370 1.00 0.00 C ATOM 230 O THR A 15 11.980 21.287 -24.429 1.00 0.00 O ATOM 231 CB THR A 15 10.552 18.634 -23.473 1.00 0.00 C ATOM 232 OG1 THR A 15 9.372 17.822 -23.379 1.00 0.00 O ATOM 233 CG2 THR A 15 11.541 18.231 -22.396 1.00 0.00 C ATOM 0 H THR A 15 9.401 19.945 -25.271 1.00 0.00 H new ATOM 0 HA THR A 15 9.654 20.256 -22.416 1.00 0.00 H new ATOM 0 HB THR A 15 11.027 18.480 -24.442 1.00 0.00 H new ATOM 0 HG1 THR A 15 9.078 17.779 -22.445 1.00 0.00 H new ATOM 0 HG21 THR A 15 11.787 17.175 -22.505 1.00 0.00 H new ATOM 0 HG22 THR A 15 12.449 18.827 -22.494 1.00 0.00 H new ATOM 0 HG23 THR A 15 11.099 18.402 -21.414 1.00 0.00 H new ATOM 241 N THR A 16 11.850 21.361 -22.201 1.00 0.00 N ATOM 242 CA THR A 16 13.005 22.193 -22.057 1.00 0.00 C ATOM 243 C THR A 16 13.844 21.727 -20.885 1.00 0.00 C ATOM 244 O THR A 16 13.480 20.777 -20.209 1.00 0.00 O ATOM 245 CB THR A 16 12.614 23.695 -21.911 1.00 0.00 C ATOM 246 OG1 THR A 16 13.783 24.519 -21.756 1.00 0.00 O ATOM 247 CG2 THR A 16 11.675 23.907 -20.729 1.00 0.00 C ATOM 0 H THR A 16 11.404 21.104 -21.320 1.00 0.00 H new ATOM 0 HA THR A 16 13.602 22.105 -22.965 1.00 0.00 H new ATOM 0 HB THR A 16 12.096 23.986 -22.825 1.00 0.00 H new ATOM 0 HG1 THR A 16 13.513 25.457 -21.668 1.00 0.00 H new ATOM 0 HG21 THR A 16 11.420 24.964 -20.652 1.00 0.00 H new ATOM 0 HG22 THR A 16 10.766 23.324 -20.877 1.00 0.00 H new ATOM 0 HG23 THR A 16 12.167 23.585 -19.811 1.00 0.00 H new ATOM 255 N TYR A 17 14.949 22.401 -20.654 1.00 0.00 N ATOM 256 CA TYR A 17 15.900 22.038 -19.592 1.00 0.00 C ATOM 257 C TYR A 17 15.203 21.965 -18.243 1.00 0.00 C ATOM 258 O TYR A 17 15.512 21.111 -17.415 1.00 0.00 O ATOM 259 CB TYR A 17 17.036 23.069 -19.546 1.00 0.00 C ATOM 260 CG TYR A 17 17.809 23.156 -20.842 1.00 0.00 C ATOM 261 CD1 TYR A 17 18.725 22.178 -21.195 1.00 0.00 C ATOM 262 CD2 TYR A 17 17.604 24.209 -21.723 1.00 0.00 C ATOM 263 CE1 TYR A 17 19.422 22.247 -22.382 1.00 0.00 C ATOM 264 CE2 TYR A 17 18.294 24.286 -22.916 1.00 0.00 C ATOM 265 CZ TYR A 17 19.200 23.301 -23.241 1.00 0.00 C ATOM 266 OH TYR A 17 19.888 23.369 -24.434 1.00 0.00 O ATOM 0 H TYR A 17 15.227 23.222 -21.192 1.00 0.00 H new ATOM 0 HA TYR A 17 16.313 21.054 -19.813 1.00 0.00 H new ATOM 0 HB2 TYR A 17 16.620 24.049 -19.311 1.00 0.00 H new ATOM 0 HB3 TYR A 17 17.721 22.811 -18.738 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.896 21.346 -20.528 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.892 24.981 -21.471 1.00 0.00 H new ATOM 0 HE1 TYR A 17 20.138 21.480 -22.637 1.00 0.00 H new ATOM 0 HE2 TYR A 17 18.125 25.113 -23.590 1.00 0.00 H new ATOM 0 HH TYR A 17 19.615 24.173 -24.924 1.00 0.00 H new ATOM 276 N TYR A 18 14.242 22.851 -18.043 1.00 0.00 N ATOM 277 CA TYR A 18 13.487 22.881 -16.828 1.00 0.00 C ATOM 278 C TYR A 18 12.567 21.671 -16.763 1.00 0.00 C ATOM 279 O TYR A 18 12.384 21.080 -15.714 1.00 0.00 O ATOM 280 CB TYR A 18 12.682 24.162 -16.773 1.00 0.00 C ATOM 281 CG TYR A 18 13.505 25.403 -16.490 1.00 0.00 C ATOM 282 CD1 TYR A 18 14.532 25.813 -17.346 1.00 0.00 C ATOM 283 CD2 TYR A 18 13.229 26.186 -15.383 1.00 0.00 C ATOM 284 CE1 TYR A 18 15.254 26.969 -17.087 1.00 0.00 C ATOM 285 CE2 TYR A 18 13.951 27.332 -15.118 1.00 0.00 C ATOM 286 CZ TYR A 18 14.958 27.719 -15.969 1.00 0.00 C ATOM 287 OH TYR A 18 15.665 28.871 -15.707 1.00 0.00 O ATOM 0 H TYR A 18 13.973 23.562 -18.723 1.00 0.00 H new ATOM 0 HA TYR A 18 14.163 22.848 -15.973 1.00 0.00 H new ATOM 0 HB2 TYR A 18 12.163 24.293 -17.723 1.00 0.00 H new ATOM 0 HB3 TYR A 18 11.917 24.064 -16.003 1.00 0.00 H new ATOM 0 HD1 TYR A 18 14.766 25.222 -18.219 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.433 25.895 -14.713 1.00 0.00 H new ATOM 0 HE1 TYR A 18 16.043 27.279 -17.757 1.00 0.00 H new ATOM 0 HE2 TYR A 18 13.725 27.924 -14.243 1.00 0.00 H new ATOM 0 HH TYR A 18 15.040 29.605 -15.530 1.00 0.00 H new ATOM 297 N ASP A 19 11.989 21.318 -17.911 1.00 0.00 N ATOM 298 CA ASP A 19 11.106 20.151 -18.016 1.00 0.00 C ATOM 299 C ASP A 19 11.880 18.848 -17.806 1.00 0.00 C ATOM 300 O ASP A 19 11.402 17.921 -17.156 1.00 0.00 O ATOM 301 CB ASP A 19 10.410 20.122 -19.375 1.00 0.00 C ATOM 302 CG ASP A 19 9.332 19.053 -19.426 1.00 0.00 C ATOM 303 OD1 ASP A 19 8.532 18.975 -18.476 1.00 0.00 O ATOM 304 OD2 ASP A 19 9.287 18.288 -20.406 1.00 0.00 O ATOM 0 H ASP A 19 12.116 21.825 -18.787 1.00 0.00 H new ATOM 0 HA ASP A 19 10.355 20.238 -17.231 1.00 0.00 H new ATOM 0 HB2 ASP A 19 9.967 21.097 -19.579 1.00 0.00 H new ATOM 0 HB3 ASP A 19 11.145 19.936 -20.158 1.00 0.00 H new ATOM 309 N VAL A 20 13.073 18.797 -18.366 1.00 0.00 N ATOM 310 CA VAL A 20 13.965 17.642 -18.247 1.00 0.00 C ATOM 311 C VAL A 20 14.314 17.415 -16.782 1.00 0.00 C ATOM 312 O VAL A 20 14.333 16.287 -16.296 1.00 0.00 O ATOM 313 CB VAL A 20 15.266 17.857 -19.056 1.00 0.00 C ATOM 314 CG1 VAL A 20 16.160 16.650 -18.980 1.00 0.00 C ATOM 315 CG2 VAL A 20 14.956 18.176 -20.491 1.00 0.00 C ATOM 0 H VAL A 20 13.461 19.559 -18.923 1.00 0.00 H new ATOM 0 HA VAL A 20 13.449 16.770 -18.648 1.00 0.00 H new ATOM 0 HB VAL A 20 15.791 18.703 -18.613 1.00 0.00 H new ATOM 0 HG11 VAL A 20 17.066 16.831 -19.558 1.00 0.00 H new ATOM 0 HG12 VAL A 20 16.425 16.459 -17.940 1.00 0.00 H new ATOM 0 HG13 VAL A 20 15.637 15.784 -19.386 1.00 0.00 H new ATOM 0 HG21 VAL A 20 15.886 18.323 -21.040 1.00 0.00 H new ATOM 0 HG22 VAL A 20 14.399 17.351 -20.935 1.00 0.00 H new ATOM 0 HG23 VAL A 20 14.358 19.086 -20.540 1.00 0.00 H new ATOM 325 N LEU A 21 14.573 18.511 -16.092 1.00 0.00 N ATOM 326 CA LEU A 21 14.897 18.484 -14.657 1.00 0.00 C ATOM 327 C LEU A 21 13.620 18.429 -13.828 1.00 0.00 C ATOM 328 O LEU A 21 13.666 18.248 -12.617 1.00 0.00 O ATOM 329 CB LEU A 21 15.702 19.735 -14.272 1.00 0.00 C ATOM 330 CG LEU A 21 17.224 19.705 -14.549 1.00 0.00 C ATOM 331 CD1 LEU A 21 17.977 19.689 -13.253 1.00 0.00 C ATOM 332 CD2 LEU A 21 17.634 18.498 -15.366 1.00 0.00 C ATOM 0 H LEU A 21 14.568 19.447 -16.498 1.00 0.00 H new ATOM 0 HA LEU A 21 15.494 17.595 -14.455 1.00 0.00 H new ATOM 0 HB2 LEU A 21 15.278 20.587 -14.803 1.00 0.00 H new ATOM 0 HB3 LEU A 21 15.555 19.918 -13.208 1.00 0.00 H new ATOM 0 HG LEU A 21 17.463 20.601 -15.122 1.00 0.00 H new ATOM 0 HD11 LEU A 21 19.048 19.668 -13.455 1.00 0.00 H new ATOM 0 HD12 LEU A 21 17.733 20.583 -12.680 1.00 0.00 H new ATOM 0 HD13 LEU A 21 17.698 18.804 -12.681 1.00 0.00 H new ATOM 0 HD21 LEU A 21 18.711 18.521 -15.534 1.00 0.00 H new ATOM 0 HD22 LEU A 21 17.371 17.588 -14.828 1.00 0.00 H new ATOM 0 HD23 LEU A 21 17.116 18.515 -16.325 1.00 0.00 H new ATOM 344 N GLY A 22 12.479 18.559 -14.502 1.00 0.00 N ATOM 345 CA GLY A 22 11.197 18.517 -13.830 1.00 0.00 C ATOM 346 C GLY A 22 11.060 19.599 -12.786 1.00 0.00 C ATOM 347 O GLY A 22 10.407 19.403 -11.759 1.00 0.00 O ATOM 0 H GLY A 22 12.424 18.694 -15.512 1.00 0.00 H new ATOM 0 HA2 GLY A 22 10.400 18.623 -14.566 1.00 0.00 H new ATOM 0 HA3 GLY A 22 11.068 17.543 -13.359 1.00 0.00 H new ATOM 351 N VAL A 23 11.633 20.747 -13.056 1.00 0.00 N ATOM 352 CA VAL A 23 11.659 21.813 -12.091 1.00 0.00 C ATOM 353 C VAL A 23 10.836 23.012 -12.581 1.00 0.00 C ATOM 354 O VAL A 23 10.500 23.106 -13.769 1.00 0.00 O ATOM 355 CB VAL A 23 13.125 22.247 -11.802 1.00 0.00 C ATOM 356 CG1 VAL A 23 13.594 23.333 -12.745 1.00 0.00 C ATOM 357 CG2 VAL A 23 13.316 22.635 -10.344 1.00 0.00 C ATOM 0 H VAL A 23 12.089 20.965 -13.942 1.00 0.00 H new ATOM 0 HA VAL A 23 11.213 21.446 -11.166 1.00 0.00 H new ATOM 0 HB VAL A 23 13.758 21.380 -11.989 1.00 0.00 H new ATOM 0 HG11 VAL A 23 14.622 23.604 -12.505 1.00 0.00 H new ATOM 0 HG12 VAL A 23 13.544 22.970 -13.772 1.00 0.00 H new ATOM 0 HG13 VAL A 23 12.954 24.209 -12.638 1.00 0.00 H new ATOM 0 HG21 VAL A 23 14.352 22.932 -10.179 1.00 0.00 H new ATOM 0 HG22 VAL A 23 12.656 23.467 -10.100 1.00 0.00 H new ATOM 0 HG23 VAL A 23 13.077 21.784 -9.707 1.00 0.00 H new ATOM 367 N LYS A 24 10.502 23.907 -11.665 1.00 0.00 N ATOM 368 CA LYS A 24 9.730 25.089 -11.987 1.00 0.00 C ATOM 369 C LYS A 24 10.644 26.213 -12.478 1.00 0.00 C ATOM 370 O LYS A 24 11.832 26.230 -12.180 1.00 0.00 O ATOM 371 CB LYS A 24 8.953 25.579 -10.760 1.00 0.00 C ATOM 372 CG LYS A 24 7.891 24.616 -10.245 1.00 0.00 C ATOM 373 CD LYS A 24 7.109 25.230 -9.096 1.00 0.00 C ATOM 374 CE LYS A 24 5.964 24.331 -8.642 1.00 0.00 C ATOM 375 NZ LYS A 24 6.441 23.036 -8.099 1.00 0.00 N ATOM 0 H LYS A 24 10.759 23.832 -10.681 1.00 0.00 H new ATOM 0 HA LYS A 24 9.028 24.821 -12.777 1.00 0.00 H new ATOM 0 HB2 LYS A 24 9.661 25.779 -9.956 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.474 26.527 -11.006 1.00 0.00 H new ATOM 0 HG2 LYS A 24 7.209 24.354 -11.054 1.00 0.00 H new ATOM 0 HG3 LYS A 24 8.364 23.691 -9.914 1.00 0.00 H new ATOM 0 HD2 LYS A 24 7.781 25.414 -8.257 1.00 0.00 H new ATOM 0 HD3 LYS A 24 6.711 26.197 -9.404 1.00 0.00 H new ATOM 0 HE2 LYS A 24 5.380 24.848 -7.880 1.00 0.00 H new ATOM 0 HE3 LYS A 24 5.297 24.145 -9.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.636 22.504 -7.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 6.887 22.484 -8.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 7.135 23.210 -7.345 1.00 0.00 H new ATOM 389 N PRO A 25 10.087 27.172 -13.216 1.00 0.00 N ATOM 390 CA PRO A 25 10.835 28.329 -13.712 1.00 0.00 C ATOM 391 C PRO A 25 11.265 29.258 -12.574 1.00 0.00 C ATOM 392 O PRO A 25 12.166 30.081 -12.731 1.00 0.00 O ATOM 393 CB PRO A 25 9.846 29.044 -14.646 1.00 0.00 C ATOM 394 CG PRO A 25 8.703 28.098 -14.833 1.00 0.00 C ATOM 395 CD PRO A 25 8.684 27.213 -13.624 1.00 0.00 C ATOM 0 HA PRO A 25 11.756 28.031 -14.212 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.508 29.984 -14.211 1.00 0.00 H new ATOM 0 HB3 PRO A 25 10.314 29.285 -15.600 1.00 0.00 H new ATOM 0 HG2 PRO A 25 7.763 28.640 -14.932 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.830 27.511 -15.742 1.00 0.00 H new ATOM 0 HD2 PRO A 25 8.048 27.620 -12.838 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.304 26.219 -13.859 1.00 0.00 H new ATOM 403 N ASN A 26 10.629 29.086 -11.424 1.00 0.00 N ATOM 404 CA ASN A 26 10.878 29.921 -10.262 1.00 0.00 C ATOM 405 C ASN A 26 11.696 29.161 -9.261 1.00 0.00 C ATOM 406 O ASN A 26 11.851 29.581 -8.113 1.00 0.00 O ATOM 407 CB ASN A 26 9.563 30.360 -9.620 1.00 0.00 C ATOM 408 CG ASN A 26 8.784 31.343 -10.470 1.00 0.00 C ATOM 409 OD1 ASN A 26 9.361 32.121 -11.226 1.00 0.00 O ATOM 410 ND2 ASN A 26 7.467 31.308 -10.353 1.00 0.00 N ATOM 0 H ASN A 26 9.926 28.363 -11.272 1.00 0.00 H new ATOM 0 HA ASN A 26 11.422 30.809 -10.584 1.00 0.00 H new ATOM 0 HB2 ASN A 26 8.946 29.481 -9.434 1.00 0.00 H new ATOM 0 HB3 ASN A 26 9.772 30.813 -8.651 1.00 0.00 H new ATOM 0 HD21 ASN A 26 6.889 31.943 -10.903 1.00 0.00 H new ATOM 0 HD22 ASN A 26 7.029 30.646 -9.713 1.00 0.00 H new ATOM 417 N ALA A 27 12.213 28.028 -9.692 1.00 0.00 N ATOM 418 CA ALA A 27 12.987 27.182 -8.846 1.00 0.00 C ATOM 419 C ALA A 27 14.279 27.845 -8.422 1.00 0.00 C ATOM 420 O ALA A 27 14.897 28.600 -9.180 1.00 0.00 O ATOM 421 CB ALA A 27 13.251 25.891 -9.547 1.00 0.00 C ATOM 0 H ALA A 27 12.100 27.679 -10.644 1.00 0.00 H new ATOM 0 HA ALA A 27 12.420 26.988 -7.936 1.00 0.00 H new ATOM 0 HB1 ALA A 27 13.843 25.241 -8.902 1.00 0.00 H new ATOM 0 HB2 ALA A 27 12.304 25.404 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA A 27 13.799 26.083 -10.470 1.00 0.00 H new ATOM 427 N THR A 28 14.667 27.562 -7.207 1.00 0.00 N ATOM 428 CA THR A 28 15.854 28.117 -6.619 1.00 0.00 C ATOM 429 C THR A 28 17.052 27.344 -7.011 1.00 0.00 C ATOM 430 O THR A 28 16.945 26.251 -7.560 1.00 0.00 O ATOM 431 CB THR A 28 15.746 28.088 -5.094 1.00 0.00 C ATOM 432 OG1 THR A 28 15.664 26.728 -4.643 1.00 0.00 O ATOM 433 CG2 THR A 28 14.517 28.803 -4.675 1.00 0.00 C ATOM 0 H THR A 28 14.158 26.929 -6.589 1.00 0.00 H new ATOM 0 HA THR A 28 15.950 29.143 -6.976 1.00 0.00 H new ATOM 0 HB THR A 28 16.624 28.569 -4.663 1.00 0.00 H new ATOM 0 HG1 THR A 28 15.285 26.705 -3.740 1.00 0.00 H new ATOM 0 HG21 THR A 28 14.438 28.784 -3.588 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.563 29.837 -5.017 1.00 0.00 H new ATOM 0 HG23 THR A 28 13.645 28.315 -5.111 1.00 0.00 H new ATOM 441 N GLN A 29 18.196 27.912 -6.749 1.00 0.00 N ATOM 442 CA GLN A 29 19.443 27.218 -6.955 1.00 0.00 C ATOM 443 C GLN A 29 19.436 25.908 -6.179 1.00 0.00 C ATOM 444 O GLN A 29 19.938 24.884 -6.653 1.00 0.00 O ATOM 445 CB GLN A 29 20.612 28.099 -6.549 1.00 0.00 C ATOM 446 CG GLN A 29 21.969 27.414 -6.665 1.00 0.00 C ATOM 447 CD GLN A 29 23.127 28.356 -6.407 1.00 0.00 C ATOM 448 OE1 GLN A 29 23.056 29.548 -6.706 1.00 0.00 O ATOM 449 NE2 GLN A 29 24.196 27.834 -5.846 1.00 0.00 N ATOM 0 H GLN A 29 18.294 28.861 -6.389 1.00 0.00 H new ATOM 0 HA GLN A 29 19.558 26.987 -8.014 1.00 0.00 H new ATOM 0 HB2 GLN A 29 20.613 28.994 -7.171 1.00 0.00 H new ATOM 0 HB3 GLN A 29 20.468 28.426 -5.519 1.00 0.00 H new ATOM 0 HG2 GLN A 29 22.015 26.587 -5.957 1.00 0.00 H new ATOM 0 HG3 GLN A 29 22.070 26.986 -7.662 1.00 0.00 H new ATOM 0 HE21 GLN A 29 24.216 26.841 -5.613 1.00 0.00 H new ATOM 0 HE22 GLN A 29 25.005 28.422 -5.644 1.00 0.00 H new ATOM 458 N GLU A 30 18.829 25.946 -5.002 1.00 0.00 N ATOM 459 CA GLU A 30 18.690 24.774 -4.166 1.00 0.00 C ATOM 460 C GLU A 30 17.754 23.778 -4.840 1.00 0.00 C ATOM 461 O GLU A 30 18.020 22.578 -4.871 1.00 0.00 O ATOM 462 CB GLU A 30 18.123 25.181 -2.797 1.00 0.00 C ATOM 463 CG GLU A 30 17.948 24.026 -1.823 1.00 0.00 C ATOM 464 CD GLU A 30 17.381 24.471 -0.490 1.00 0.00 C ATOM 465 OE1 GLU A 30 16.178 24.804 -0.432 1.00 0.00 O ATOM 466 OE2 GLU A 30 18.132 24.481 0.515 1.00 0.00 O ATOM 0 H GLU A 30 18.421 26.792 -4.604 1.00 0.00 H new ATOM 0 HA GLU A 30 19.666 24.310 -4.024 1.00 0.00 H new ATOM 0 HB2 GLU A 30 18.785 25.922 -2.349 1.00 0.00 H new ATOM 0 HB3 GLU A 30 17.158 25.665 -2.946 1.00 0.00 H new ATOM 0 HG2 GLU A 30 17.287 23.280 -2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 30 18.911 23.543 -1.661 1.00 0.00 H new ATOM 473 N GLU A 31 16.668 24.300 -5.395 1.00 0.00 N ATOM 474 CA GLU A 31 15.673 23.505 -6.043 1.00 0.00 C ATOM 475 C GLU A 31 16.201 22.867 -7.325 1.00 0.00 C ATOM 476 O GLU A 31 15.834 21.739 -7.658 1.00 0.00 O ATOM 477 CB GLU A 31 14.427 24.343 -6.299 1.00 0.00 C ATOM 478 CG GLU A 31 13.309 23.559 -6.931 1.00 0.00 C ATOM 479 CD GLU A 31 11.942 24.114 -6.600 1.00 0.00 C ATOM 480 OE1 GLU A 31 11.723 25.335 -6.767 1.00 0.00 O ATOM 481 OE2 GLU A 31 11.085 23.331 -6.138 1.00 0.00 O ATOM 0 H GLU A 31 16.465 25.300 -5.400 1.00 0.00 H new ATOM 0 HA GLU A 31 15.405 22.682 -5.380 1.00 0.00 H new ATOM 0 HB2 GLU A 31 14.079 24.764 -5.356 1.00 0.00 H new ATOM 0 HB3 GLU A 31 14.686 25.181 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 31 13.442 23.554 -8.013 1.00 0.00 H new ATOM 0 HG3 GLU A 31 13.365 22.523 -6.598 1.00 0.00 H new ATOM 488 N LEU A 32 17.052 23.588 -8.037 1.00 0.00 N ATOM 489 CA LEU A 32 17.654 23.071 -9.257 1.00 0.00 C ATOM 490 C LEU A 32 18.482 21.835 -8.947 1.00 0.00 C ATOM 491 O LEU A 32 18.408 20.827 -9.653 1.00 0.00 O ATOM 492 CB LEU A 32 18.515 24.135 -9.920 1.00 0.00 C ATOM 493 CG LEU A 32 17.777 25.177 -10.764 1.00 0.00 C ATOM 494 CD1 LEU A 32 16.284 25.176 -10.478 1.00 0.00 C ATOM 495 CD2 LEU A 32 18.351 26.557 -10.533 1.00 0.00 C ATOM 0 H LEU A 32 17.342 24.534 -7.791 1.00 0.00 H new ATOM 0 HA LEU A 32 16.858 22.795 -9.949 1.00 0.00 H new ATOM 0 HB2 LEU A 32 19.072 24.657 -9.142 1.00 0.00 H new ATOM 0 HB3 LEU A 32 19.246 23.636 -10.556 1.00 0.00 H new ATOM 0 HG LEU A 32 17.918 24.906 -11.810 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.795 25.929 -11.096 1.00 0.00 H new ATOM 0 HD12 LEU A 32 15.870 24.194 -10.707 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.115 25.405 -9.426 1.00 0.00 H new ATOM 0 HD21 LEU A 32 17.812 27.282 -11.143 1.00 0.00 H new ATOM 0 HD22 LEU A 32 18.250 26.821 -9.480 1.00 0.00 H new ATOM 0 HD23 LEU A 32 19.405 26.563 -10.809 1.00 0.00 H new ATOM 507 N LYS A 33 19.274 21.919 -7.876 1.00 0.00 N ATOM 508 CA LYS A 33 20.043 20.780 -7.404 1.00 0.00 C ATOM 509 C LYS A 33 19.117 19.683 -6.899 1.00 0.00 C ATOM 510 O LYS A 33 19.351 18.499 -7.133 1.00 0.00 O ATOM 511 CB LYS A 33 21.020 21.186 -6.301 1.00 0.00 C ATOM 512 CG LYS A 33 21.873 20.025 -5.808 1.00 0.00 C ATOM 513 CD LYS A 33 22.851 20.452 -4.729 1.00 0.00 C ATOM 514 CE LYS A 33 23.695 19.274 -4.267 1.00 0.00 C ATOM 515 NZ LYS A 33 24.678 19.664 -3.230 1.00 0.00 N ATOM 0 H LYS A 33 19.395 22.767 -7.323 1.00 0.00 H new ATOM 0 HA LYS A 33 20.620 20.400 -8.247 1.00 0.00 H new ATOM 0 HB2 LYS A 33 21.672 21.977 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS A 33 20.461 21.601 -5.462 1.00 0.00 H new ATOM 0 HG2 LYS A 33 21.225 19.240 -5.419 1.00 0.00 H new ATOM 0 HG3 LYS A 33 22.423 19.598 -6.647 1.00 0.00 H new ATOM 0 HD2 LYS A 33 23.499 21.241 -5.111 1.00 0.00 H new ATOM 0 HD3 LYS A 33 22.306 20.869 -3.882 1.00 0.00 H new ATOM 0 HE2 LYS A 33 23.043 18.494 -3.873 1.00 0.00 H new ATOM 0 HE3 LYS A 33 24.220 18.848 -5.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.231 18.831 -2.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 25.317 20.389 -3.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 24.177 20.046 -2.403 1.00 0.00 H new ATOM 529 N LYS A 34 18.063 20.098 -6.212 1.00 0.00 N ATOM 530 CA LYS A 34 17.089 19.187 -5.637 1.00 0.00 C ATOM 531 C LYS A 34 16.455 18.328 -6.728 1.00 0.00 C ATOM 532 O LYS A 34 16.299 17.116 -6.563 1.00 0.00 O ATOM 533 CB LYS A 34 16.012 19.991 -4.897 1.00 0.00 C ATOM 534 CG LYS A 34 14.989 19.156 -4.146 1.00 0.00 C ATOM 535 CD LYS A 34 13.986 20.053 -3.421 1.00 0.00 C ATOM 536 CE LYS A 34 12.968 19.244 -2.629 1.00 0.00 C ATOM 537 NZ LYS A 34 12.209 18.301 -3.490 1.00 0.00 N ATOM 0 H LYS A 34 17.860 21.082 -6.038 1.00 0.00 H new ATOM 0 HA LYS A 34 17.591 18.526 -4.931 1.00 0.00 H new ATOM 0 HB2 LYS A 34 16.502 20.661 -4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 34 15.488 20.618 -5.619 1.00 0.00 H new ATOM 0 HG2 LYS A 34 14.463 18.503 -4.843 1.00 0.00 H new ATOM 0 HG3 LYS A 34 15.495 18.512 -3.426 1.00 0.00 H new ATOM 0 HD2 LYS A 34 14.520 20.724 -2.747 1.00 0.00 H new ATOM 0 HD3 LYS A 34 13.467 20.678 -4.148 1.00 0.00 H new ATOM 0 HE2 LYS A 34 13.480 18.686 -1.845 1.00 0.00 H new ATOM 0 HE3 LYS A 34 12.273 19.922 -2.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 11.408 17.909 -2.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.852 18.805 -4.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 12.834 17.527 -3.793 1.00 0.00 H new ATOM 551 N ALA A 35 16.089 18.964 -7.833 1.00 0.00 N ATOM 552 CA ALA A 35 15.505 18.262 -8.962 1.00 0.00 C ATOM 553 C ALA A 35 16.491 17.256 -9.526 1.00 0.00 C ATOM 554 O ALA A 35 16.171 16.076 -9.679 1.00 0.00 O ATOM 555 CB ALA A 35 15.094 19.252 -10.041 1.00 0.00 C ATOM 0 H ALA A 35 16.188 19.970 -7.969 1.00 0.00 H new ATOM 0 HA ALA A 35 14.619 17.728 -8.618 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.658 18.713 -10.882 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.360 19.948 -9.636 1.00 0.00 H new ATOM 0 HB3 ALA A 35 15.970 19.805 -10.380 1.00 0.00 H new ATOM 561 N TYR A 36 17.707 17.721 -9.792 1.00 0.00 N ATOM 562 CA TYR A 36 18.745 16.864 -10.345 1.00 0.00 C ATOM 563 C TYR A 36 19.032 15.699 -9.436 1.00 0.00 C ATOM 564 O TYR A 36 19.124 14.575 -9.891 1.00 0.00 O ATOM 565 CB TYR A 36 20.031 17.641 -10.610 1.00 0.00 C ATOM 566 CG TYR A 36 21.176 16.759 -11.094 1.00 0.00 C ATOM 567 CD1 TYR A 36 21.196 16.258 -12.393 1.00 0.00 C ATOM 568 CD2 TYR A 36 22.234 16.431 -10.249 1.00 0.00 C ATOM 569 CE1 TYR A 36 22.233 15.455 -12.834 1.00 0.00 C ATOM 570 CE2 TYR A 36 23.275 15.633 -10.685 1.00 0.00 C ATOM 571 CZ TYR A 36 23.268 15.145 -11.977 1.00 0.00 C ATOM 572 OH TYR A 36 24.304 14.351 -12.411 1.00 0.00 O ATOM 0 H TYR A 36 17.996 18.686 -9.633 1.00 0.00 H new ATOM 0 HA TYR A 36 18.369 16.484 -11.295 1.00 0.00 H new ATOM 0 HB2 TYR A 36 19.835 18.412 -11.355 1.00 0.00 H new ATOM 0 HB3 TYR A 36 20.335 18.151 -9.696 1.00 0.00 H new ATOM 0 HD1 TYR A 36 20.388 16.500 -13.068 1.00 0.00 H new ATOM 0 HD2 TYR A 36 22.241 16.807 -9.236 1.00 0.00 H new ATOM 0 HE1 TYR A 36 22.232 15.073 -13.844 1.00 0.00 H new ATOM 0 HE2 TYR A 36 24.090 15.392 -10.019 1.00 0.00 H new ATOM 0 HH TYR A 36 24.058 13.927 -13.259 1.00 0.00 H new ATOM 582 N ARG A 37 19.155 15.971 -8.147 1.00 0.00 N ATOM 583 CA ARG A 37 19.450 14.937 -7.173 1.00 0.00 C ATOM 584 C ARG A 37 18.376 13.865 -7.188 1.00 0.00 C ATOM 585 O ARG A 37 18.684 12.682 -7.203 1.00 0.00 O ATOM 586 CB ARG A 37 19.523 15.537 -5.767 1.00 0.00 C ATOM 587 CG ARG A 37 19.867 14.526 -4.684 1.00 0.00 C ATOM 588 CD ARG A 37 19.819 15.157 -3.303 1.00 0.00 C ATOM 589 NE ARG A 37 18.464 15.619 -2.967 1.00 0.00 N ATOM 590 CZ ARG A 37 18.097 16.076 -1.762 1.00 0.00 C ATOM 591 NH1 ARG A 37 18.974 16.101 -0.763 1.00 0.00 N ATOM 592 NH2 ARG A 37 16.848 16.494 -1.555 1.00 0.00 N ATOM 0 H ARG A 37 19.054 16.905 -7.751 1.00 0.00 H new ATOM 0 HA ARG A 37 20.410 14.494 -7.437 1.00 0.00 H new ATOM 0 HB2 ARG A 37 20.270 16.331 -5.760 1.00 0.00 H new ATOM 0 HB3 ARG A 37 18.565 15.998 -5.529 1.00 0.00 H new ATOM 0 HG2 ARG A 37 19.168 13.690 -4.729 1.00 0.00 H new ATOM 0 HG3 ARG A 37 20.862 14.120 -4.866 1.00 0.00 H new ATOM 0 HD2 ARG A 37 20.152 14.433 -2.559 1.00 0.00 H new ATOM 0 HD3 ARG A 37 20.512 15.998 -3.262 1.00 0.00 H new ATOM 0 HE ARG A 37 17.756 15.590 -3.701 1.00 0.00 H new ATOM 0 HH11 ARG A 37 19.928 15.772 -0.913 1.00 0.00 H new ATOM 0 HH12 ARG A 37 18.693 16.449 0.154 1.00 0.00 H new ATOM 0 HH21 ARG A 37 16.168 16.467 -2.315 1.00 0.00 H new ATOM 0 HH22 ARG A 37 16.572 16.841 -0.636 1.00 0.00 H new ATOM 606 N LYS A 38 17.119 14.294 -7.212 1.00 0.00 N ATOM 607 CA LYS A 38 16.008 13.369 -7.182 1.00 0.00 C ATOM 608 C LYS A 38 15.986 12.502 -8.442 1.00 0.00 C ATOM 609 O LYS A 38 15.821 11.276 -8.366 1.00 0.00 O ATOM 610 CB LYS A 38 14.692 14.132 -6.992 1.00 0.00 C ATOM 611 CG LYS A 38 13.475 13.241 -6.816 1.00 0.00 C ATOM 612 CD LYS A 38 12.243 14.066 -6.486 1.00 0.00 C ATOM 613 CE LYS A 38 11.022 13.188 -6.275 1.00 0.00 C ATOM 614 NZ LYS A 38 9.845 13.980 -5.853 1.00 0.00 N ATOM 0 H LYS A 38 16.851 15.277 -7.252 1.00 0.00 H new ATOM 0 HA LYS A 38 16.131 12.697 -6.333 1.00 0.00 H new ATOM 0 HB2 LYS A 38 14.783 14.780 -6.120 1.00 0.00 H new ATOM 0 HB3 LYS A 38 14.533 14.779 -7.854 1.00 0.00 H new ATOM 0 HG2 LYS A 38 13.302 12.670 -7.728 1.00 0.00 H new ATOM 0 HG3 LYS A 38 13.659 12.520 -6.019 1.00 0.00 H new ATOM 0 HD2 LYS A 38 12.428 14.654 -5.587 1.00 0.00 H new ATOM 0 HD3 LYS A 38 12.049 14.771 -7.294 1.00 0.00 H new ATOM 0 HE2 LYS A 38 10.791 12.657 -7.199 1.00 0.00 H new ATOM 0 HE3 LYS A 38 11.242 12.433 -5.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 9.031 13.347 -5.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 10.057 14.467 -4.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 9.619 14.684 -6.585 1.00 0.00 H new ATOM 628 N LEU A 39 16.174 13.138 -9.595 1.00 0.00 N ATOM 629 CA LEU A 39 16.200 12.429 -10.864 1.00 0.00 C ATOM 630 C LEU A 39 17.388 11.496 -10.932 1.00 0.00 C ATOM 631 O LEU A 39 17.276 10.369 -11.377 1.00 0.00 O ATOM 632 CB LEU A 39 16.284 13.406 -12.006 1.00 0.00 C ATOM 633 CG LEU A 39 15.243 14.495 -11.995 1.00 0.00 C ATOM 634 CD1 LEU A 39 15.450 15.440 -13.152 1.00 0.00 C ATOM 635 CD2 LEU A 39 13.836 13.915 -12.012 1.00 0.00 C ATOM 0 H LEU A 39 16.311 14.146 -9.673 1.00 0.00 H new ATOM 0 HA LEU A 39 15.281 11.849 -10.941 1.00 0.00 H new ATOM 0 HB2 LEU A 39 17.271 13.868 -11.996 1.00 0.00 H new ATOM 0 HB3 LEU A 39 16.200 12.854 -12.942 1.00 0.00 H new ATOM 0 HG LEU A 39 15.356 15.058 -11.069 1.00 0.00 H new ATOM 0 HD11 LEU A 39 14.688 16.219 -13.126 1.00 0.00 H new ATOM 0 HD12 LEU A 39 16.437 15.895 -13.078 1.00 0.00 H new ATOM 0 HD13 LEU A 39 15.374 14.889 -14.090 1.00 0.00 H new ATOM 0 HD21 LEU A 39 13.108 14.726 -12.004 1.00 0.00 H new ATOM 0 HD22 LEU A 39 13.701 13.315 -12.912 1.00 0.00 H new ATOM 0 HD23 LEU A 39 13.690 13.288 -11.133 1.00 0.00 H new ATOM 647 N ALA A 40 18.519 11.985 -10.470 1.00 0.00 N ATOM 648 CA ALA A 40 19.772 11.222 -10.492 1.00 0.00 C ATOM 649 C ALA A 40 19.657 9.933 -9.707 1.00 0.00 C ATOM 650 O ALA A 40 20.154 8.900 -10.131 1.00 0.00 O ATOM 651 CB ALA A 40 20.922 12.063 -9.958 1.00 0.00 C ATOM 0 H ALA A 40 18.607 12.918 -10.068 1.00 0.00 H new ATOM 0 HA ALA A 40 19.976 10.962 -11.531 1.00 0.00 H new ATOM 0 HB1 ALA A 40 21.842 11.479 -9.983 1.00 0.00 H new ATOM 0 HB2 ALA A 40 21.040 12.953 -10.577 1.00 0.00 H new ATOM 0 HB3 ALA A 40 20.709 12.361 -8.931 1.00 0.00 H new ATOM 657 N LEU A 41 18.998 10.001 -8.575 1.00 0.00 N ATOM 658 CA LEU A 41 18.802 8.851 -7.729 1.00 0.00 C ATOM 659 C LEU A 41 17.967 7.797 -8.447 1.00 0.00 C ATOM 660 O LEU A 41 18.266 6.600 -8.393 1.00 0.00 O ATOM 661 CB LEU A 41 18.096 9.276 -6.448 1.00 0.00 C ATOM 662 CG LEU A 41 18.889 10.193 -5.517 1.00 0.00 C ATOM 663 CD1 LEU A 41 18.026 10.651 -4.349 1.00 0.00 C ATOM 664 CD2 LEU A 41 20.149 9.499 -5.021 1.00 0.00 C ATOM 0 H LEU A 41 18.582 10.859 -8.214 1.00 0.00 H new ATOM 0 HA LEU A 41 19.775 8.422 -7.488 1.00 0.00 H new ATOM 0 HB2 LEU A 41 17.168 9.780 -6.718 1.00 0.00 H new ATOM 0 HB3 LEU A 41 17.821 8.379 -5.894 1.00 0.00 H new ATOM 0 HG LEU A 41 19.190 11.075 -6.082 1.00 0.00 H new ATOM 0 HD11 LEU A 41 18.610 11.303 -3.699 1.00 0.00 H new ATOM 0 HD12 LEU A 41 17.161 11.196 -4.727 1.00 0.00 H new ATOM 0 HD13 LEU A 41 17.688 9.782 -3.784 1.00 0.00 H new ATOM 0 HD21 LEU A 41 20.698 10.170 -4.360 1.00 0.00 H new ATOM 0 HD22 LEU A 41 19.876 8.596 -4.476 1.00 0.00 H new ATOM 0 HD23 LEU A 41 20.777 9.234 -5.871 1.00 0.00 H new ATOM 676 N LYS A 42 16.918 8.253 -9.122 1.00 0.00 N ATOM 677 CA LYS A 42 16.025 7.374 -9.811 1.00 0.00 C ATOM 678 C LYS A 42 16.622 6.839 -11.114 1.00 0.00 C ATOM 679 O LYS A 42 16.575 5.637 -11.385 1.00 0.00 O ATOM 680 CB LYS A 42 14.745 8.097 -10.097 1.00 0.00 C ATOM 681 CG LYS A 42 14.036 8.576 -8.850 1.00 0.00 C ATOM 682 CD LYS A 42 13.664 7.431 -7.923 1.00 0.00 C ATOM 683 CE LYS A 42 12.959 7.952 -6.679 1.00 0.00 C ATOM 684 NZ LYS A 42 12.561 6.855 -5.760 1.00 0.00 N ATOM 0 H LYS A 42 16.677 9.241 -9.198 1.00 0.00 H new ATOM 0 HA LYS A 42 15.841 6.515 -9.166 1.00 0.00 H new ATOM 0 HB2 LYS A 42 14.955 8.953 -10.738 1.00 0.00 H new ATOM 0 HB3 LYS A 42 14.080 7.437 -10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 42 14.677 9.278 -8.317 1.00 0.00 H new ATOM 0 HG3 LYS A 42 13.134 9.119 -9.133 1.00 0.00 H new ATOM 0 HD2 LYS A 42 13.016 6.729 -8.447 1.00 0.00 H new ATOM 0 HD3 LYS A 42 14.561 6.883 -7.636 1.00 0.00 H new ATOM 0 HE2 LYS A 42 13.617 8.644 -6.153 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.074 8.516 -6.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.085 7.256 -4.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.912 6.208 -6.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 13.407 6.332 -5.457 1.00 0.00 H new ATOM 698 N TYR A 43 17.212 7.739 -11.891 1.00 0.00 N ATOM 699 CA TYR A 43 17.729 7.417 -13.223 1.00 0.00 C ATOM 700 C TYR A 43 19.237 7.191 -13.238 1.00 0.00 C ATOM 701 O TYR A 43 19.888 7.511 -14.227 1.00 0.00 O ATOM 702 CB TYR A 43 17.376 8.523 -14.242 1.00 0.00 C ATOM 703 CG TYR A 43 15.894 8.787 -14.398 1.00 0.00 C ATOM 704 CD1 TYR A 43 15.047 7.807 -14.885 1.00 0.00 C ATOM 705 CD2 TYR A 43 15.351 10.023 -14.073 1.00 0.00 C ATOM 706 CE1 TYR A 43 13.699 8.045 -15.043 1.00 0.00 C ATOM 707 CE2 TYR A 43 14.000 10.270 -14.230 1.00 0.00 C ATOM 708 CZ TYR A 43 13.180 9.278 -14.717 1.00 0.00 C ATOM 709 OH TYR A 43 11.836 9.523 -14.897 1.00 0.00 O ATOM 0 H TYR A 43 17.347 8.713 -11.619 1.00 0.00 H new ATOM 0 HA TYR A 43 17.246 6.482 -13.508 1.00 0.00 H new ATOM 0 HB2 TYR A 43 17.866 9.448 -13.939 1.00 0.00 H new ATOM 0 HB3 TYR A 43 17.787 8.248 -15.213 1.00 0.00 H new ATOM 0 HD1 TYR A 43 15.449 6.839 -15.146 1.00 0.00 H new ATOM 0 HD2 TYR A 43 15.994 10.803 -13.692 1.00 0.00 H new ATOM 0 HE1 TYR A 43 13.052 7.267 -15.421 1.00 0.00 H new ATOM 0 HE2 TYR A 43 13.591 11.236 -13.972 1.00 0.00 H new ATOM 0 HH TYR A 43 11.630 10.440 -14.618 1.00 0.00 H new ATOM 719 N HIS A 44 19.793 6.662 -12.145 1.00 0.00 N ATOM 720 CA HIS A 44 21.211 6.313 -12.111 1.00 0.00 C ATOM 721 C HIS A 44 21.554 5.458 -13.330 1.00 0.00 C ATOM 722 O HIS A 44 20.989 4.384 -13.504 1.00 0.00 O ATOM 723 CB HIS A 44 21.545 5.544 -10.837 1.00 0.00 C ATOM 724 CG HIS A 44 21.965 6.402 -9.688 1.00 0.00 C ATOM 725 ND1 HIS A 44 23.064 7.233 -9.732 1.00 0.00 N ATOM 726 CD2 HIS A 44 21.434 6.554 -8.452 1.00 0.00 C ATOM 727 CE1 HIS A 44 23.187 7.854 -8.577 1.00 0.00 C ATOM 728 NE2 HIS A 44 22.213 7.462 -7.783 1.00 0.00 N ATOM 0 H HIS A 44 19.287 6.468 -11.281 1.00 0.00 H new ATOM 0 HA HIS A 44 21.798 7.231 -12.127 1.00 0.00 H new ATOM 0 HB2 HIS A 44 20.673 4.962 -10.540 1.00 0.00 H new ATOM 0 HB3 HIS A 44 22.343 4.834 -11.055 1.00 0.00 H new ATOM 0 HD2 HIS A 44 20.559 6.053 -8.065 1.00 0.00 H new ATOM 0 HE1 HIS A 44 23.958 8.566 -8.324 1.00 0.00 H new ATOM 0 HE2 HIS A 44 22.063 7.782 -6.826 1.00 0.00 H new ATOM 736 N PRO A 45 22.485 5.913 -14.185 1.00 0.00 N ATOM 737 CA PRO A 45 22.822 5.204 -15.424 1.00 0.00 C ATOM 738 C PRO A 45 23.391 3.809 -15.173 1.00 0.00 C ATOM 739 O PRO A 45 23.284 2.924 -16.021 1.00 0.00 O ATOM 740 CB PRO A 45 23.851 6.093 -16.112 1.00 0.00 C ATOM 741 CG PRO A 45 23.849 7.392 -15.364 1.00 0.00 C ATOM 742 CD PRO A 45 23.289 7.124 -14.000 1.00 0.00 C ATOM 0 HA PRO A 45 21.932 5.037 -16.031 1.00 0.00 H new ATOM 0 HB2 PRO A 45 24.839 5.633 -16.091 1.00 0.00 H new ATOM 0 HB3 PRO A 45 23.594 6.247 -17.160 1.00 0.00 H new ATOM 0 HG2 PRO A 45 24.859 7.795 -15.292 1.00 0.00 H new ATOM 0 HG3 PRO A 45 23.247 8.135 -15.887 1.00 0.00 H new ATOM 0 HD2 PRO A 45 24.080 6.971 -13.266 1.00 0.00 H new ATOM 0 HD3 PRO A 45 22.682 7.957 -13.646 1.00 0.00 H new ATOM 750 N ASP A 46 23.988 3.617 -14.003 1.00 0.00 N ATOM 751 CA ASP A 46 24.530 2.314 -13.620 1.00 0.00 C ATOM 752 C ASP A 46 23.419 1.378 -13.167 1.00 0.00 C ATOM 753 O ASP A 46 23.576 0.153 -13.182 1.00 0.00 O ATOM 754 CB ASP A 46 25.555 2.464 -12.503 1.00 0.00 C ATOM 755 CG ASP A 46 24.941 2.897 -11.185 1.00 0.00 C ATOM 756 OD1 ASP A 46 24.602 4.087 -11.047 1.00 0.00 O ATOM 757 OD2 ASP A 46 24.820 2.051 -10.268 1.00 0.00 O ATOM 0 H ASP A 46 24.110 4.346 -13.301 1.00 0.00 H new ATOM 0 HA ASP A 46 25.018 1.887 -14.496 1.00 0.00 H new ATOM 0 HB2 ASP A 46 26.071 1.514 -12.362 1.00 0.00 H new ATOM 0 HB3 ASP A 46 26.307 3.194 -12.804 1.00 0.00 H new ATOM 762 N LYS A 47 22.302 1.954 -12.769 1.00 0.00 N ATOM 763 CA LYS A 47 21.176 1.170 -12.286 1.00 0.00 C ATOM 764 C LYS A 47 20.140 1.018 -13.388 1.00 0.00 C ATOM 765 O LYS A 47 19.419 0.029 -13.439 1.00 0.00 O ATOM 766 CB LYS A 47 20.555 1.839 -11.059 1.00 0.00 C ATOM 767 CG LYS A 47 19.556 0.970 -10.311 1.00 0.00 C ATOM 768 CD LYS A 47 19.055 1.666 -9.054 1.00 0.00 C ATOM 769 CE LYS A 47 18.079 0.786 -8.285 1.00 0.00 C ATOM 770 NZ LYS A 47 17.603 1.434 -7.030 1.00 0.00 N ATOM 0 H LYS A 47 22.147 2.962 -12.769 1.00 0.00 H new ATOM 0 HA LYS A 47 21.530 0.180 -11.998 1.00 0.00 H new ATOM 0 HB2 LYS A 47 21.353 2.127 -10.374 1.00 0.00 H new ATOM 0 HB3 LYS A 47 20.057 2.757 -11.373 1.00 0.00 H new ATOM 0 HG2 LYS A 47 18.713 0.738 -10.962 1.00 0.00 H new ATOM 0 HG3 LYS A 47 20.023 0.022 -10.044 1.00 0.00 H new ATOM 0 HD2 LYS A 47 19.901 1.919 -8.415 1.00 0.00 H new ATOM 0 HD3 LYS A 47 18.568 2.603 -9.324 1.00 0.00 H new ATOM 0 HE2 LYS A 47 17.223 0.555 -8.920 1.00 0.00 H new ATOM 0 HE3 LYS A 47 18.561 -0.161 -8.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 16.941 0.798 -6.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 18.415 1.631 -6.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 17.120 2.325 -7.261 1.00 0.00 H new ATOM 784 N ASN A 48 20.081 2.000 -14.275 1.00 0.00 N ATOM 785 CA ASN A 48 19.191 1.953 -15.421 1.00 0.00 C ATOM 786 C ASN A 48 19.890 2.533 -16.633 1.00 0.00 C ATOM 787 O ASN A 48 19.755 3.721 -16.935 1.00 0.00 O ATOM 788 CB ASN A 48 17.890 2.721 -15.184 1.00 0.00 C ATOM 789 CG ASN A 48 17.142 2.308 -13.926 1.00 0.00 C ATOM 790 OD1 ASN A 48 16.336 1.377 -13.944 1.00 0.00 O ATOM 791 ND2 ASN A 48 17.376 3.013 -12.838 1.00 0.00 N ATOM 0 H ASN A 48 20.646 2.847 -14.220 1.00 0.00 H new ATOM 0 HA ASN A 48 18.936 0.906 -15.585 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.115 3.786 -15.126 1.00 0.00 H new ATOM 0 HB3 ASN A 48 17.236 2.580 -16.045 1.00 0.00 H new ATOM 0 HD21 ASN A 48 16.882 2.794 -11.973 1.00 0.00 H new ATOM 0 HD22 ASN A 48 18.051 3.777 -12.861 1.00 0.00 H new ATOM 798 N PRO A 49 20.659 1.704 -17.323 1.00 0.00 N ATOM 799 CA PRO A 49 21.406 2.100 -18.495 1.00 0.00 C ATOM 800 C PRO A 49 20.496 2.588 -19.619 1.00 0.00 C ATOM 801 O PRO A 49 20.889 3.425 -20.436 1.00 0.00 O ATOM 802 CB PRO A 49 22.131 0.822 -18.900 1.00 0.00 C ATOM 803 CG PRO A 49 21.384 -0.253 -18.254 1.00 0.00 C ATOM 804 CD PRO A 49 20.858 0.315 -17.005 1.00 0.00 C ATOM 0 HA PRO A 49 22.077 2.935 -18.294 1.00 0.00 H new ATOM 0 HB2 PRO A 49 22.142 0.700 -19.983 1.00 0.00 H new ATOM 0 HB3 PRO A 49 23.170 0.835 -18.570 1.00 0.00 H new ATOM 0 HG2 PRO A 49 20.575 -0.605 -18.894 1.00 0.00 H new ATOM 0 HG3 PRO A 49 22.027 -1.109 -18.053 1.00 0.00 H new ATOM 0 HD2 PRO A 49 19.926 -0.166 -16.707 1.00 0.00 H new ATOM 0 HD3 PRO A 49 21.560 0.189 -16.180 1.00 0.00 H new ATOM 812 N ASN A 50 19.275 2.076 -19.632 1.00 0.00 N ATOM 813 CA ASN A 50 18.283 2.456 -20.630 1.00 0.00 C ATOM 814 C ASN A 50 17.886 3.933 -20.476 1.00 0.00 C ATOM 815 O ASN A 50 17.621 4.620 -21.462 1.00 0.00 O ATOM 816 CB ASN A 50 17.052 1.527 -20.555 1.00 0.00 C ATOM 817 CG ASN A 50 15.960 1.908 -21.540 1.00 0.00 C ATOM 818 OD1 ASN A 50 15.040 2.646 -21.207 1.00 0.00 O ATOM 819 ND2 ASN A 50 16.050 1.400 -22.754 1.00 0.00 N ATOM 0 H ASN A 50 18.943 1.389 -18.955 1.00 0.00 H new ATOM 0 HA ASN A 50 18.728 2.339 -21.618 1.00 0.00 H new ATOM 0 HB2 ASN A 50 17.366 0.501 -20.748 1.00 0.00 H new ATOM 0 HB3 ASN A 50 16.646 1.552 -19.544 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.339 1.618 -23.452 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.831 0.789 -22.995 1.00 0.00 H new ATOM 826 N GLU A 51 17.881 4.420 -19.236 1.00 0.00 N ATOM 827 CA GLU A 51 17.501 5.803 -18.962 1.00 0.00 C ATOM 828 C GLU A 51 18.712 6.740 -18.987 1.00 0.00 C ATOM 829 O GLU A 51 18.570 7.945 -18.828 1.00 0.00 O ATOM 830 CB GLU A 51 16.773 5.916 -17.617 1.00 0.00 C ATOM 831 CG GLU A 51 15.386 5.294 -17.613 1.00 0.00 C ATOM 832 CD GLU A 51 14.385 6.088 -18.425 1.00 0.00 C ATOM 833 OE1 GLU A 51 13.805 7.053 -17.888 1.00 0.00 O ATOM 834 OE2 GLU A 51 14.151 5.739 -19.588 1.00 0.00 O ATOM 0 H GLU A 51 18.135 3.879 -18.409 1.00 0.00 H new ATOM 0 HA GLU A 51 16.821 6.112 -19.756 1.00 0.00 H new ATOM 0 HB2 GLU A 51 17.377 5.437 -16.847 1.00 0.00 H new ATOM 0 HB3 GLU A 51 16.689 6.969 -17.348 1.00 0.00 H new ATOM 0 HG2 GLU A 51 15.446 4.280 -18.009 1.00 0.00 H new ATOM 0 HG3 GLU A 51 15.032 5.214 -16.585 1.00 0.00 H new ATOM 841 N GLY A 52 19.904 6.181 -19.201 1.00 0.00 N ATOM 842 CA GLY A 52 21.112 6.993 -19.244 1.00 0.00 C ATOM 843 C GLY A 52 21.126 7.956 -20.427 1.00 0.00 C ATOM 844 O GLY A 52 21.659 9.063 -20.329 1.00 0.00 O ATOM 0 H GLY A 52 20.054 5.182 -19.345 1.00 0.00 H new ATOM 0 HA2 GLY A 52 21.198 7.560 -18.317 1.00 0.00 H new ATOM 0 HA3 GLY A 52 21.983 6.340 -19.301 1.00 0.00 H new ATOM 848 N GLU A 53 20.539 7.534 -21.545 1.00 0.00 N ATOM 849 CA GLU A 53 20.440 8.386 -22.736 1.00 0.00 C ATOM 850 C GLU A 53 19.598 9.618 -22.412 1.00 0.00 C ATOM 851 O GLU A 53 19.908 10.741 -22.820 1.00 0.00 O ATOM 852 CB GLU A 53 19.807 7.597 -23.881 1.00 0.00 C ATOM 853 CG GLU A 53 19.716 8.360 -25.184 1.00 0.00 C ATOM 854 CD GLU A 53 19.109 7.533 -26.288 1.00 0.00 C ATOM 855 OE1 GLU A 53 19.677 6.463 -26.617 1.00 0.00 O ATOM 856 OE2 GLU A 53 18.064 7.939 -26.830 1.00 0.00 O ATOM 0 H GLU A 53 20.124 6.609 -21.655 1.00 0.00 H new ATOM 0 HA GLU A 53 21.436 8.708 -23.040 1.00 0.00 H new ATOM 0 HB2 GLU A 53 20.386 6.688 -24.045 1.00 0.00 H new ATOM 0 HB3 GLU A 53 18.805 7.287 -23.584 1.00 0.00 H new ATOM 0 HG2 GLU A 53 19.118 9.259 -25.035 1.00 0.00 H new ATOM 0 HG3 GLU A 53 20.712 8.686 -25.482 1.00 0.00 H new ATOM 863 N LYS A 54 18.538 9.379 -21.677 1.00 0.00 N ATOM 864 CA LYS A 54 17.667 10.393 -21.168 1.00 0.00 C ATOM 865 C LYS A 54 18.415 11.263 -20.139 1.00 0.00 C ATOM 866 O LYS A 54 18.224 12.484 -20.061 1.00 0.00 O ATOM 867 CB LYS A 54 16.504 9.675 -20.543 1.00 0.00 C ATOM 868 CG LYS A 54 15.545 10.527 -19.804 1.00 0.00 C ATOM 869 CD LYS A 54 14.425 9.660 -19.321 1.00 0.00 C ATOM 870 CE LYS A 54 13.418 10.402 -18.473 1.00 0.00 C ATOM 871 NZ LYS A 54 12.351 9.482 -17.998 1.00 0.00 N ATOM 0 H LYS A 54 18.254 8.436 -21.411 1.00 0.00 H new ATOM 0 HA LYS A 54 17.321 11.065 -21.954 1.00 0.00 H new ATOM 0 HB2 LYS A 54 15.962 9.147 -21.328 1.00 0.00 H new ATOM 0 HB3 LYS A 54 16.892 8.920 -19.860 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.039 11.014 -18.963 1.00 0.00 H new ATOM 0 HG3 LYS A 54 15.163 11.317 -20.450 1.00 0.00 H new ATOM 0 HD2 LYS A 54 13.915 9.224 -20.180 1.00 0.00 H new ATOM 0 HD3 LYS A 54 14.838 8.833 -18.743 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.919 10.857 -17.619 1.00 0.00 H new ATOM 0 HE3 LYS A 54 12.975 11.213 -19.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 12.146 9.676 -16.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 11.490 9.628 -18.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 12.670 8.498 -18.102 1.00 0.00 H new ATOM 885 N PHE A 55 19.275 10.615 -19.369 1.00 0.00 N ATOM 886 CA PHE A 55 20.061 11.274 -18.337 1.00 0.00 C ATOM 887 C PHE A 55 21.046 12.275 -18.945 1.00 0.00 C ATOM 888 O PHE A 55 21.509 13.193 -18.262 1.00 0.00 O ATOM 889 CB PHE A 55 20.805 10.232 -17.490 1.00 0.00 C ATOM 890 CG PHE A 55 21.476 10.793 -16.269 1.00 0.00 C ATOM 891 CD1 PHE A 55 20.729 11.175 -15.168 1.00 0.00 C ATOM 892 CD2 PHE A 55 22.855 10.935 -16.223 1.00 0.00 C ATOM 893 CE1 PHE A 55 21.340 11.689 -14.045 1.00 0.00 C ATOM 894 CE2 PHE A 55 23.470 11.449 -15.103 1.00 0.00 C ATOM 895 CZ PHE A 55 22.712 11.826 -14.013 1.00 0.00 C ATOM 0 H PHE A 55 19.448 9.613 -19.442 1.00 0.00 H new ATOM 0 HA PHE A 55 19.378 11.828 -17.693 1.00 0.00 H new ATOM 0 HB2 PHE A 55 20.099 9.461 -17.181 1.00 0.00 H new ATOM 0 HB3 PHE A 55 21.556 9.745 -18.112 1.00 0.00 H new ATOM 0 HD1 PHE A 55 19.654 11.069 -15.189 1.00 0.00 H new ATOM 0 HD2 PHE A 55 23.452 10.640 -17.073 1.00 0.00 H new ATOM 0 HE1 PHE A 55 20.746 11.984 -13.192 1.00 0.00 H new ATOM 0 HE2 PHE A 55 24.544 11.557 -15.078 1.00 0.00 H new ATOM 0 HZ PHE A 55 23.194 12.229 -13.134 1.00 0.00 H new ATOM 905 N LYS A 56 21.368 12.088 -20.219 1.00 0.00 N ATOM 906 CA LYS A 56 22.257 13.015 -20.911 1.00 0.00 C ATOM 907 C LYS A 56 21.630 14.406 -20.883 1.00 0.00 C ATOM 908 O LYS A 56 22.300 15.406 -20.616 1.00 0.00 O ATOM 909 CB LYS A 56 22.464 12.582 -22.365 1.00 0.00 C ATOM 910 CG LYS A 56 23.164 11.245 -22.539 1.00 0.00 C ATOM 911 CD LYS A 56 23.312 10.903 -24.010 1.00 0.00 C ATOM 912 CE LYS A 56 23.994 9.560 -24.222 1.00 0.00 C ATOM 913 NZ LYS A 56 24.138 9.239 -25.668 1.00 0.00 N ATOM 0 H LYS A 56 21.032 11.312 -20.789 1.00 0.00 H new ATOM 0 HA LYS A 56 23.226 13.022 -20.411 1.00 0.00 H new ATOM 0 HB2 LYS A 56 21.492 12.534 -22.857 1.00 0.00 H new ATOM 0 HB3 LYS A 56 23.044 13.349 -22.879 1.00 0.00 H new ATOM 0 HG2 LYS A 56 24.146 11.280 -22.068 1.00 0.00 H new ATOM 0 HG3 LYS A 56 22.596 10.463 -22.034 1.00 0.00 H new ATOM 0 HD2 LYS A 56 22.328 10.887 -24.478 1.00 0.00 H new ATOM 0 HD3 LYS A 56 23.888 11.684 -24.507 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.977 9.573 -23.752 1.00 0.00 H new ATOM 0 HE3 LYS A 56 23.416 8.777 -23.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 24.607 8.317 -25.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.198 9.202 -26.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.710 9.973 -26.131 1.00 0.00 H new ATOM 927 N GLN A 57 20.324 14.446 -21.128 1.00 0.00 N ATOM 928 CA GLN A 57 19.560 15.657 -21.080 1.00 0.00 C ATOM 929 C GLN A 57 19.578 16.232 -19.686 1.00 0.00 C ATOM 930 O GLN A 57 19.816 17.431 -19.492 1.00 0.00 O ATOM 931 CB GLN A 57 18.127 15.336 -21.451 1.00 0.00 C ATOM 932 CG GLN A 57 17.944 14.919 -22.886 1.00 0.00 C ATOM 933 CD GLN A 57 16.507 14.574 -23.233 1.00 0.00 C ATOM 934 OE1 GLN A 57 15.573 15.052 -22.603 1.00 0.00 O ATOM 935 NE2 GLN A 57 16.323 13.745 -24.248 1.00 0.00 N ATOM 0 H GLN A 57 19.774 13.621 -21.367 1.00 0.00 H new ATOM 0 HA GLN A 57 19.990 16.381 -21.772 1.00 0.00 H new ATOM 0 HB2 GLN A 57 17.765 14.538 -20.803 1.00 0.00 H new ATOM 0 HB3 GLN A 57 17.507 16.211 -21.256 1.00 0.00 H new ATOM 0 HG2 GLN A 57 18.284 15.724 -23.537 1.00 0.00 H new ATOM 0 HG3 GLN A 57 18.577 14.055 -23.090 1.00 0.00 H new ATOM 0 HE21 GLN A 57 17.127 13.367 -24.750 1.00 0.00 H new ATOM 0 HE22 GLN A 57 15.378 13.484 -24.529 1.00 0.00 H new ATOM 944 N ILE A 58 19.359 15.361 -18.715 1.00 0.00 N ATOM 945 CA ILE A 58 19.287 15.768 -17.327 1.00 0.00 C ATOM 946 C ILE A 58 20.609 16.373 -16.850 1.00 0.00 C ATOM 947 O ILE A 58 20.626 17.428 -16.207 1.00 0.00 O ATOM 948 CB ILE A 58 18.918 14.560 -16.431 1.00 0.00 C ATOM 949 CG1 ILE A 58 17.504 14.084 -16.733 1.00 0.00 C ATOM 950 CG2 ILE A 58 19.042 14.907 -14.972 1.00 0.00 C ATOM 951 CD1 ILE A 58 17.134 12.779 -16.057 1.00 0.00 C ATOM 0 H ILE A 58 19.228 14.361 -18.867 1.00 0.00 H new ATOM 0 HA ILE A 58 18.513 16.531 -17.249 1.00 0.00 H new ATOM 0 HB ILE A 58 19.619 13.755 -16.653 1.00 0.00 H new ATOM 0 HG12 ILE A 58 16.798 14.855 -16.423 1.00 0.00 H new ATOM 0 HG13 ILE A 58 17.394 13.967 -17.811 1.00 0.00 H new ATOM 0 HG21 ILE A 58 18.777 14.039 -14.368 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.069 15.201 -14.754 1.00 0.00 H new ATOM 0 HG23 ILE A 58 18.371 15.733 -14.736 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.112 12.509 -16.322 1.00 0.00 H new ATOM 0 HD12 ILE A 58 17.814 11.993 -16.386 1.00 0.00 H new ATOM 0 HD13 ILE A 58 17.209 12.895 -14.976 1.00 0.00 H new ATOM 963 N SER A 59 21.702 15.714 -17.180 1.00 0.00 N ATOM 964 CA SER A 59 23.010 16.159 -16.755 1.00 0.00 C ATOM 965 C SER A 59 23.357 17.546 -17.330 1.00 0.00 C ATOM 966 O SER A 59 23.851 18.419 -16.609 1.00 0.00 O ATOM 967 CB SER A 59 24.081 15.123 -17.135 1.00 0.00 C ATOM 968 OG SER A 59 25.362 15.491 -16.639 1.00 0.00 O ATOM 0 H SER A 59 21.707 14.864 -17.744 1.00 0.00 H new ATOM 0 HA SER A 59 22.990 16.256 -15.669 1.00 0.00 H new ATOM 0 HB2 SER A 59 23.802 14.147 -16.737 1.00 0.00 H new ATOM 0 HB3 SER A 59 24.124 15.024 -18.220 1.00 0.00 H new ATOM 0 HG SER A 59 26.020 14.812 -16.896 1.00 0.00 H new ATOM 974 N GLN A 60 23.085 17.752 -18.627 1.00 0.00 N ATOM 975 CA GLN A 60 23.387 19.009 -19.275 1.00 0.00 C ATOM 976 C GLN A 60 22.543 20.133 -18.738 1.00 0.00 C ATOM 977 O GLN A 60 23.056 21.210 -18.424 1.00 0.00 O ATOM 978 CB GLN A 60 23.174 18.896 -20.756 1.00 0.00 C ATOM 979 CG GLN A 60 24.090 17.919 -21.440 1.00 0.00 C ATOM 980 CD GLN A 60 23.982 17.990 -22.945 1.00 0.00 C ATOM 981 OE1 GLN A 60 23.134 17.338 -23.557 1.00 0.00 O ATOM 982 NE2 GLN A 60 24.842 18.786 -23.555 1.00 0.00 N ATOM 0 H GLN A 60 22.656 17.056 -19.237 1.00 0.00 H new ATOM 0 HA GLN A 60 24.433 19.236 -19.066 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.142 18.599 -20.941 1.00 0.00 H new ATOM 0 HB3 GLN A 60 23.309 19.879 -21.207 1.00 0.00 H new ATOM 0 HG2 GLN A 60 25.119 18.119 -21.142 1.00 0.00 H new ATOM 0 HG3 GLN A 60 23.853 16.908 -21.108 1.00 0.00 H new ATOM 0 HE21 GLN A 60 25.528 19.308 -23.010 1.00 0.00 H new ATOM 0 HE22 GLN A 60 24.820 18.878 -24.571 1.00 0.00 H new ATOM 991 N ALA A 61 21.252 19.884 -18.621 1.00 0.00 N ATOM 992 CA ALA A 61 20.327 20.887 -18.103 1.00 0.00 C ATOM 993 C ALA A 61 20.738 21.300 -16.707 1.00 0.00 C ATOM 994 O ALA A 61 20.681 22.472 -16.356 1.00 0.00 O ATOM 995 CB ALA A 61 18.907 20.359 -18.113 1.00 0.00 C ATOM 0 H ALA A 61 20.816 18.998 -18.876 1.00 0.00 H new ATOM 0 HA ALA A 61 20.364 21.764 -18.749 1.00 0.00 H new ATOM 0 HB1 ALA A 61 18.233 21.121 -17.723 1.00 0.00 H new ATOM 0 HB2 ALA A 61 18.619 20.108 -19.134 1.00 0.00 H new ATOM 0 HB3 ALA A 61 18.846 19.467 -17.489 1.00 0.00 H new ATOM 1001 N TYR A 62 21.178 20.324 -15.924 1.00 0.00 N ATOM 1002 CA TYR A 62 21.675 20.577 -14.598 1.00 0.00 C ATOM 1003 C TYR A 62 22.871 21.534 -14.623 1.00 0.00 C ATOM 1004 O TYR A 62 22.967 22.451 -13.799 1.00 0.00 O ATOM 1005 CB TYR A 62 22.071 19.268 -13.917 1.00 0.00 C ATOM 1006 CG TYR A 62 22.865 19.457 -12.643 1.00 0.00 C ATOM 1007 CD1 TYR A 62 22.299 20.031 -11.513 1.00 0.00 C ATOM 1008 CD2 TYR A 62 24.189 19.051 -12.577 1.00 0.00 C ATOM 1009 CE1 TYR A 62 23.037 20.202 -10.354 1.00 0.00 C ATOM 1010 CE2 TYR A 62 24.930 19.210 -11.423 1.00 0.00 C ATOM 1011 CZ TYR A 62 24.354 19.786 -10.317 1.00 0.00 C ATOM 1012 OH TYR A 62 25.096 19.950 -9.173 1.00 0.00 O ATOM 0 H TYR A 62 21.196 19.342 -16.198 1.00 0.00 H new ATOM 0 HA TYR A 62 20.873 21.048 -14.029 1.00 0.00 H new ATOM 0 HB2 TYR A 62 21.169 18.700 -13.691 1.00 0.00 H new ATOM 0 HB3 TYR A 62 22.658 18.670 -14.614 1.00 0.00 H new ATOM 0 HD1 TYR A 62 21.267 20.349 -11.538 1.00 0.00 H new ATOM 0 HD2 TYR A 62 24.649 18.602 -13.445 1.00 0.00 H new ATOM 0 HE1 TYR A 62 22.586 20.658 -9.485 1.00 0.00 H new ATOM 0 HE2 TYR A 62 25.959 18.883 -11.390 1.00 0.00 H new ATOM 0 HH TYR A 62 26.001 19.603 -9.317 1.00 0.00 H new ATOM 1022 N GLU A 63 23.779 21.317 -15.574 1.00 0.00 N ATOM 1023 CA GLU A 63 24.996 22.117 -15.666 1.00 0.00 C ATOM 1024 C GLU A 63 24.697 23.596 -15.834 1.00 0.00 C ATOM 1025 O GLU A 63 25.317 24.437 -15.198 1.00 0.00 O ATOM 1026 CB GLU A 63 25.893 21.613 -16.792 1.00 0.00 C ATOM 1027 CG GLU A 63 26.449 20.227 -16.536 1.00 0.00 C ATOM 1028 CD GLU A 63 27.325 19.719 -17.659 1.00 0.00 C ATOM 1029 OE1 GLU A 63 27.444 20.412 -18.692 1.00 0.00 O ATOM 1030 OE2 GLU A 63 27.919 18.627 -17.497 1.00 0.00 O ATOM 0 H GLU A 63 23.694 20.595 -16.289 1.00 0.00 H new ATOM 0 HA GLU A 63 25.528 22.002 -14.722 1.00 0.00 H new ATOM 0 HB2 GLU A 63 25.326 21.604 -17.723 1.00 0.00 H new ATOM 0 HB3 GLU A 63 26.720 22.310 -16.929 1.00 0.00 H new ATOM 0 HG2 GLU A 63 27.026 20.239 -15.611 1.00 0.00 H new ATOM 0 HG3 GLU A 63 25.622 19.533 -16.387 1.00 0.00 H new ATOM 1037 N VAL A 64 23.768 23.909 -16.687 1.00 0.00 N ATOM 1038 CA VAL A 64 23.365 25.281 -16.891 1.00 0.00 C ATOM 1039 C VAL A 64 22.422 25.776 -15.779 1.00 0.00 C ATOM 1040 O VAL A 64 22.537 26.897 -15.340 1.00 0.00 O ATOM 1041 CB VAL A 64 22.762 25.476 -18.305 1.00 0.00 C ATOM 1042 CG1 VAL A 64 22.435 24.139 -18.932 1.00 0.00 C ATOM 1043 CG2 VAL A 64 21.542 26.355 -18.266 1.00 0.00 C ATOM 0 H VAL A 64 23.267 23.231 -17.261 1.00 0.00 H new ATOM 0 HA VAL A 64 24.258 25.902 -16.830 1.00 0.00 H new ATOM 0 HB VAL A 64 23.511 25.975 -18.920 1.00 0.00 H new ATOM 0 HG11 VAL A 64 22.013 24.296 -19.924 1.00 0.00 H new ATOM 0 HG12 VAL A 64 23.344 23.544 -19.015 1.00 0.00 H new ATOM 0 HG13 VAL A 64 21.712 23.612 -18.309 1.00 0.00 H new ATOM 0 HG21 VAL A 64 21.145 26.471 -19.274 1.00 0.00 H new ATOM 0 HG22 VAL A 64 20.785 25.899 -17.628 1.00 0.00 H new ATOM 0 HG23 VAL A 64 21.811 27.333 -17.868 1.00 0.00 H new ATOM 1053 N LEU A 65 21.509 24.927 -15.327 1.00 0.00 N ATOM 1054 CA LEU A 65 20.561 25.307 -14.270 1.00 0.00 C ATOM 1055 C LEU A 65 21.247 25.621 -12.943 1.00 0.00 C ATOM 1056 O LEU A 65 20.880 26.573 -12.264 1.00 0.00 O ATOM 1057 CB LEU A 65 19.439 24.265 -14.113 1.00 0.00 C ATOM 1058 CG LEU A 65 18.169 24.506 -14.979 1.00 0.00 C ATOM 1059 CD1 LEU A 65 18.510 24.867 -16.419 1.00 0.00 C ATOM 1060 CD2 LEU A 65 17.266 23.292 -14.954 1.00 0.00 C ATOM 0 H LEU A 65 21.399 23.973 -15.669 1.00 0.00 H new ATOM 0 HA LEU A 65 20.095 26.238 -14.592 1.00 0.00 H new ATOM 0 HB2 LEU A 65 19.843 23.283 -14.359 1.00 0.00 H new ATOM 0 HB3 LEU A 65 19.141 24.234 -13.065 1.00 0.00 H new ATOM 0 HG LEU A 65 17.646 25.356 -14.540 1.00 0.00 H new ATOM 0 HD11 LEU A 65 17.590 25.025 -16.982 1.00 0.00 H new ATOM 0 HD12 LEU A 65 19.106 25.779 -16.434 1.00 0.00 H new ATOM 0 HD13 LEU A 65 19.078 24.055 -16.873 1.00 0.00 H new ATOM 0 HD21 LEU A 65 16.384 23.482 -15.566 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.804 22.430 -15.350 1.00 0.00 H new ATOM 0 HD23 LEU A 65 16.959 23.088 -13.928 1.00 0.00 H new ATOM 1072 N SER A 66 22.248 24.834 -12.577 1.00 0.00 N ATOM 1073 CA SER A 66 22.963 25.061 -11.324 1.00 0.00 C ATOM 1074 C SER A 66 23.877 26.301 -11.408 1.00 0.00 C ATOM 1075 O SER A 66 24.367 26.802 -10.384 1.00 0.00 O ATOM 1076 CB SER A 66 23.754 23.812 -10.916 1.00 0.00 C ATOM 1077 OG SER A 66 24.664 23.411 -11.928 1.00 0.00 O ATOM 0 H SER A 66 22.583 24.039 -13.122 1.00 0.00 H new ATOM 0 HA SER A 66 22.222 25.260 -10.550 1.00 0.00 H new ATOM 0 HB2 SER A 66 24.300 24.013 -9.995 1.00 0.00 H new ATOM 0 HB3 SER A 66 23.062 22.996 -10.705 1.00 0.00 H new ATOM 0 HG SER A 66 24.168 23.019 -12.677 1.00 0.00 H new ATOM 1083 N ASP A 67 24.111 26.785 -12.620 1.00 0.00 N ATOM 1084 CA ASP A 67 24.906 27.989 -12.832 1.00 0.00 C ATOM 1085 C ASP A 67 23.983 29.124 -13.228 1.00 0.00 C ATOM 1086 O ASP A 67 23.441 29.133 -14.328 1.00 0.00 O ATOM 1087 CB ASP A 67 25.958 27.763 -13.919 1.00 0.00 C ATOM 1088 CG ASP A 67 26.884 28.951 -14.108 1.00 0.00 C ATOM 1089 OD1 ASP A 67 26.547 29.858 -14.896 1.00 0.00 O ATOM 1090 OD2 ASP A 67 27.962 28.971 -13.484 1.00 0.00 O ATOM 0 H ASP A 67 23.759 26.359 -13.478 1.00 0.00 H new ATOM 0 HA ASP A 67 25.427 28.240 -11.908 1.00 0.00 H new ATOM 0 HB2 ASP A 67 26.551 26.884 -13.665 1.00 0.00 H new ATOM 0 HB3 ASP A 67 25.456 27.547 -14.862 1.00 0.00 H new ATOM 1095 N ALA A 68 23.814 30.079 -12.336 1.00 0.00 N ATOM 1096 CA ALA A 68 22.888 31.186 -12.553 1.00 0.00 C ATOM 1097 C ALA A 68 23.122 31.894 -13.885 1.00 0.00 C ATOM 1098 O ALA A 68 22.169 32.316 -14.544 1.00 0.00 O ATOM 1099 CB ALA A 68 22.975 32.175 -11.404 1.00 0.00 C ATOM 0 H ALA A 68 24.308 30.115 -11.444 1.00 0.00 H new ATOM 0 HA ALA A 68 21.884 30.763 -12.592 1.00 0.00 H new ATOM 0 HB1 ALA A 68 22.280 32.996 -11.577 1.00 0.00 H new ATOM 0 HB2 ALA A 68 22.718 31.673 -10.471 1.00 0.00 H new ATOM 0 HB3 ALA A 68 23.990 32.567 -11.337 1.00 0.00 H new ATOM 1105 N LYS A 69 24.379 32.014 -14.294 1.00 0.00 N ATOM 1106 CA LYS A 69 24.688 32.696 -15.538 1.00 0.00 C ATOM 1107 C LYS A 69 24.198 31.889 -16.742 1.00 0.00 C ATOM 1108 O LYS A 69 23.490 32.411 -17.604 1.00 0.00 O ATOM 1109 CB LYS A 69 26.185 32.965 -15.666 1.00 0.00 C ATOM 1110 CG LYS A 69 26.555 33.679 -16.957 1.00 0.00 C ATOM 1111 CD LYS A 69 28.045 33.902 -17.058 1.00 0.00 C ATOM 1112 CE LYS A 69 28.410 34.622 -18.342 1.00 0.00 C ATOM 1113 NZ LYS A 69 29.871 34.834 -18.460 1.00 0.00 N ATOM 0 H LYS A 69 25.188 31.653 -13.789 1.00 0.00 H new ATOM 0 HA LYS A 69 24.166 33.653 -15.522 1.00 0.00 H new ATOM 0 HB2 LYS A 69 26.514 33.566 -14.818 1.00 0.00 H new ATOM 0 HB3 LYS A 69 26.724 32.019 -15.614 1.00 0.00 H new ATOM 0 HG2 LYS A 69 26.215 33.091 -17.810 1.00 0.00 H new ATOM 0 HG3 LYS A 69 26.038 34.638 -17.005 1.00 0.00 H new ATOM 0 HD2 LYS A 69 28.386 34.485 -16.202 1.00 0.00 H new ATOM 0 HD3 LYS A 69 28.562 32.943 -17.017 1.00 0.00 H new ATOM 0 HE2 LYS A 69 28.057 34.043 -19.196 1.00 0.00 H new ATOM 0 HE3 LYS A 69 27.900 35.584 -18.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 30.079 35.329 -19.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 30.204 35.408 -17.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 30.357 33.915 -18.453 1.00 0.00 H new ATOM 1127 N LYS A 70 24.558 30.613 -16.773 1.00 0.00 N ATOM 1128 CA LYS A 70 24.199 29.737 -17.864 1.00 0.00 C ATOM 1129 C LYS A 70 22.693 29.592 -17.931 1.00 0.00 C ATOM 1130 O LYS A 70 22.105 29.561 -19.009 1.00 0.00 O ATOM 1131 CB LYS A 70 24.872 28.386 -17.679 1.00 0.00 C ATOM 1132 CG LYS A 70 26.391 28.473 -17.742 1.00 0.00 C ATOM 1133 CD LYS A 70 27.066 27.181 -17.312 1.00 0.00 C ATOM 1134 CE LYS A 70 26.815 26.048 -18.276 1.00 0.00 C ATOM 1135 NZ LYS A 70 27.510 24.812 -17.845 1.00 0.00 N ATOM 0 H LYS A 70 25.106 30.163 -16.040 1.00 0.00 H new ATOM 0 HA LYS A 70 24.542 30.164 -18.806 1.00 0.00 H new ATOM 0 HB2 LYS A 70 24.576 27.966 -16.718 1.00 0.00 H new ATOM 0 HB3 LYS A 70 24.519 27.700 -18.449 1.00 0.00 H new ATOM 0 HG2 LYS A 70 26.696 28.717 -18.760 1.00 0.00 H new ATOM 0 HG3 LYS A 70 26.732 29.288 -17.103 1.00 0.00 H new ATOM 0 HD2 LYS A 70 28.140 27.348 -17.224 1.00 0.00 H new ATOM 0 HD3 LYS A 70 26.705 26.899 -16.323 1.00 0.00 H new ATOM 0 HE2 LYS A 70 25.744 25.859 -18.348 1.00 0.00 H new ATOM 0 HE3 LYS A 70 27.157 26.332 -19.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 27.319 24.050 -18.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 28.534 24.987 -17.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 27.165 24.530 -16.905 1.00 0.00 H new ATOM 1149 N ARG A 71 22.078 29.524 -16.761 1.00 0.00 N ATOM 1150 CA ARG A 71 20.639 29.424 -16.638 1.00 0.00 C ATOM 1151 C ARG A 71 19.959 30.594 -17.319 1.00 0.00 C ATOM 1152 O ARG A 71 18.982 30.420 -18.038 1.00 0.00 O ATOM 1153 CB ARG A 71 20.236 29.391 -15.167 1.00 0.00 C ATOM 1154 CG ARG A 71 18.744 29.255 -14.944 1.00 0.00 C ATOM 1155 CD ARG A 71 18.410 29.245 -13.467 1.00 0.00 C ATOM 1156 NE ARG A 71 16.967 29.186 -13.235 1.00 0.00 N ATOM 1157 CZ ARG A 71 16.393 29.397 -12.049 1.00 0.00 C ATOM 1158 NH1 ARG A 71 17.136 29.700 -10.996 1.00 0.00 N ATOM 1159 NH2 ARG A 71 15.074 29.328 -11.923 1.00 0.00 N ATOM 0 H ARG A 71 22.569 29.537 -15.867 1.00 0.00 H new ATOM 0 HA ARG A 71 20.322 28.500 -17.122 1.00 0.00 H new ATOM 0 HB2 ARG A 71 20.744 28.559 -14.680 1.00 0.00 H new ATOM 0 HB3 ARG A 71 20.584 30.304 -14.684 1.00 0.00 H new ATOM 0 HG2 ARG A 71 18.224 30.080 -15.432 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.387 28.335 -15.407 1.00 0.00 H new ATOM 0 HD2 ARG A 71 18.889 28.389 -12.992 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.817 30.140 -12.997 1.00 0.00 H new ATOM 0 HE ARG A 71 16.363 28.970 -14.028 1.00 0.00 H new ATOM 0 HH11 ARG A 71 18.149 29.773 -11.090 1.00 0.00 H new ATOM 0 HH12 ARG A 71 16.695 29.861 -10.090 1.00 0.00 H new ATOM 0 HH21 ARG A 71 14.495 29.113 -12.735 1.00 0.00 H new ATOM 0 HH22 ARG A 71 14.639 29.490 -11.015 1.00 0.00 H new ATOM 1173 N GLU A 72 20.501 31.773 -17.117 1.00 0.00 N ATOM 1174 CA GLU A 72 19.922 32.968 -17.635 1.00 0.00 C ATOM 1175 C GLU A 72 20.054 33.007 -19.147 1.00 0.00 C ATOM 1176 O GLU A 72 19.106 33.355 -19.860 1.00 0.00 O ATOM 1177 CB GLU A 72 20.606 34.178 -17.015 1.00 0.00 C ATOM 1178 CG GLU A 72 19.946 35.475 -17.369 1.00 0.00 C ATOM 1179 CD GLU A 72 20.643 36.673 -16.766 1.00 0.00 C ATOM 1180 OE1 GLU A 72 20.343 37.022 -15.607 1.00 0.00 O ATOM 1181 OE2 GLU A 72 21.512 37.264 -17.439 1.00 0.00 O ATOM 0 H GLU A 72 21.359 31.919 -16.585 1.00 0.00 H new ATOM 0 HA GLU A 72 18.862 32.988 -17.382 1.00 0.00 H new ATOM 0 HB2 GLU A 72 20.615 34.066 -15.931 1.00 0.00 H new ATOM 0 HB3 GLU A 72 21.646 34.206 -17.341 1.00 0.00 H new ATOM 0 HG2 GLU A 72 19.924 35.582 -18.454 1.00 0.00 H new ATOM 0 HG3 GLU A 72 18.910 35.455 -17.030 1.00 0.00 H new ATOM 1188 N LEU A 73 21.224 32.621 -19.631 1.00 0.00 N ATOM 1189 CA LEU A 73 21.509 32.651 -21.041 1.00 0.00 C ATOM 1190 C LEU A 73 20.624 31.655 -21.781 1.00 0.00 C ATOM 1191 O LEU A 73 20.033 31.969 -22.815 1.00 0.00 O ATOM 1192 CB LEU A 73 22.973 32.287 -21.264 1.00 0.00 C ATOM 1193 CG LEU A 73 23.986 33.033 -20.386 1.00 0.00 C ATOM 1194 CD1 LEU A 73 25.405 32.693 -20.788 1.00 0.00 C ATOM 1195 CD2 LEU A 73 23.747 34.535 -20.413 1.00 0.00 C ATOM 0 H LEU A 73 21.993 32.281 -19.054 1.00 0.00 H new ATOM 0 HA LEU A 73 21.310 33.652 -21.423 1.00 0.00 H new ATOM 0 HB2 LEU A 73 23.092 31.217 -21.094 1.00 0.00 H new ATOM 0 HB3 LEU A 73 23.219 32.473 -22.309 1.00 0.00 H new ATOM 0 HG LEU A 73 23.842 32.701 -19.358 1.00 0.00 H new ATOM 0 HD11 LEU A 73 26.104 33.235 -20.150 1.00 0.00 H new ATOM 0 HD12 LEU A 73 25.568 31.621 -20.676 1.00 0.00 H new ATOM 0 HD13 LEU A 73 25.567 32.978 -21.828 1.00 0.00 H new ATOM 0 HD21 LEU A 73 24.482 35.032 -19.780 1.00 0.00 H new ATOM 0 HD22 LEU A 73 23.842 34.900 -21.436 1.00 0.00 H new ATOM 0 HD23 LEU A 73 22.745 34.751 -20.042 1.00 0.00 H new ATOM 1207 N TYR A 74 20.534 30.453 -21.230 1.00 0.00 N ATOM 1208 CA TYR A 74 19.737 29.393 -21.795 1.00 0.00 C ATOM 1209 C TYR A 74 18.248 29.666 -21.707 1.00 0.00 C ATOM 1210 O TYR A 74 17.494 29.303 -22.605 1.00 0.00 O ATOM 1211 CB TYR A 74 20.104 28.072 -21.160 1.00 0.00 C ATOM 1212 CG TYR A 74 21.328 27.431 -21.786 1.00 0.00 C ATOM 1213 CD1 TYR A 74 22.572 28.046 -21.714 1.00 0.00 C ATOM 1214 CD2 TYR A 74 21.238 26.212 -22.449 1.00 0.00 C ATOM 1215 CE1 TYR A 74 23.689 27.471 -22.289 1.00 0.00 C ATOM 1216 CE2 TYR A 74 22.352 25.628 -23.026 1.00 0.00 C ATOM 1217 CZ TYR A 74 23.573 26.261 -22.942 1.00 0.00 C ATOM 1218 OH TYR A 74 24.686 25.683 -23.514 1.00 0.00 O ATOM 0 H TYR A 74 21.019 30.192 -20.371 1.00 0.00 H new ATOM 0 HA TYR A 74 19.965 29.343 -22.860 1.00 0.00 H new ATOM 0 HB2 TYR A 74 20.285 28.225 -20.096 1.00 0.00 H new ATOM 0 HB3 TYR A 74 19.260 27.388 -21.244 1.00 0.00 H new ATOM 0 HD1 TYR A 74 22.667 28.991 -21.199 1.00 0.00 H new ATOM 0 HD2 TYR A 74 20.283 25.713 -22.515 1.00 0.00 H new ATOM 0 HE1 TYR A 74 24.647 27.966 -22.228 1.00 0.00 H new ATOM 0 HE2 TYR A 74 22.265 24.682 -23.539 1.00 0.00 H new ATOM 0 HH TYR A 74 24.435 24.834 -23.933 1.00 0.00 H new ATOM 1228 N ASP A 75 17.825 30.297 -20.621 1.00 0.00 N ATOM 1229 CA ASP A 75 16.412 30.637 -20.424 1.00 0.00 C ATOM 1230 C ASP A 75 15.942 31.603 -21.502 1.00 0.00 C ATOM 1231 O ASP A 75 14.795 31.540 -21.959 1.00 0.00 O ATOM 1232 CB ASP A 75 16.197 31.253 -19.036 1.00 0.00 C ATOM 1233 CG ASP A 75 14.743 31.599 -18.761 1.00 0.00 C ATOM 1234 OD1 ASP A 75 13.969 30.688 -18.400 1.00 0.00 O ATOM 1235 OD2 ASP A 75 14.366 32.782 -18.900 1.00 0.00 O ATOM 0 H ASP A 75 18.437 30.587 -19.858 1.00 0.00 H new ATOM 0 HA ASP A 75 15.826 29.721 -20.495 1.00 0.00 H new ATOM 0 HB2 ASP A 75 16.549 30.555 -18.276 1.00 0.00 H new ATOM 0 HB3 ASP A 75 16.803 32.155 -18.946 1.00 0.00 H new ATOM 1240 N LYS A 76 16.834 32.499 -21.905 1.00 0.00 N ATOM 1241 CA LYS A 76 16.524 33.474 -22.945 1.00 0.00 C ATOM 1242 C LYS A 76 16.640 32.849 -24.328 1.00 0.00 C ATOM 1243 O LYS A 76 16.031 33.324 -25.293 1.00 0.00 O ATOM 1244 CB LYS A 76 17.482 34.658 -22.869 1.00 0.00 C ATOM 1245 CG LYS A 76 17.331 35.508 -21.633 1.00 0.00 C ATOM 1246 CD LYS A 76 18.360 36.615 -21.632 1.00 0.00 C ATOM 1247 CE LYS A 76 18.258 37.468 -20.382 1.00 0.00 C ATOM 1248 NZ LYS A 76 16.940 38.145 -20.276 1.00 0.00 N ATOM 0 H LYS A 76 17.779 32.571 -21.528 1.00 0.00 H new ATOM 0 HA LYS A 76 15.500 33.812 -22.782 1.00 0.00 H new ATOM 0 HB2 LYS A 76 18.505 34.285 -22.915 1.00 0.00 H new ATOM 0 HB3 LYS A 76 17.333 35.287 -23.747 1.00 0.00 H new ATOM 0 HG2 LYS A 76 16.328 35.934 -21.596 1.00 0.00 H new ATOM 0 HG3 LYS A 76 17.449 34.891 -20.742 1.00 0.00 H new ATOM 0 HD2 LYS A 76 19.359 36.184 -21.699 1.00 0.00 H new ATOM 0 HD3 LYS A 76 18.223 37.241 -22.513 1.00 0.00 H new ATOM 0 HE2 LYS A 76 18.416 36.843 -19.503 1.00 0.00 H new ATOM 0 HE3 LYS A 76 19.050 38.216 -20.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 16.980 38.868 -19.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 16.708 38.597 -21.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.208 37.445 -20.041 1.00 0.00 H new ATOM 1262 N GLY A 77 17.411 31.788 -24.422 1.00 0.00 N ATOM 1263 CA GLY A 77 17.643 31.153 -25.692 1.00 0.00 C ATOM 1264 C GLY A 77 16.506 30.230 -26.102 1.00 0.00 C ATOM 1265 O GLY A 77 15.856 29.658 -25.214 1.00 0.00 O ATOM 1266 OXT GLY A 77 16.247 30.096 -27.312 1.00 0.00 O ATOM 0 H GLY A 77 17.886 31.350 -23.632 1.00 0.00 H new ATOM 0 HA2 GLY A 77 17.779 31.918 -26.457 1.00 0.00 H new ATOM 0 HA3 GLY A 77 18.570 30.582 -25.644 1.00 0.00 H new TER 1270 GLY A 77