USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1027 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 100 SER OG : rot 87:sc= 0.776 USER MOD Set 1.2: A 102 THR OG1 : rot 76:sc= 0.312 USER MOD Set 1.3: A 111 ASN : amide:sc= 1.73 K(o=0.95,f=-6.9!) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= -1.87 (180deg=-1.87) USER MOD Set 2.1: A 73 THR OG1 : rot -77:sc= 1.31 USER MOD Set 2.2: A 75 THR OG1 : rot 180:sc= 0.0366 USER MOD Set 3.1: A 43 HIS : no HD1:sc= -0.443 X(o=-1.7,f=-2.1) USER MOD Set 3.2: A 85 MET CE :methyl -149:sc= -0.0275 (180deg=-1.56) USER MOD Set 3.3: A 91 MET CE :methyl -143:sc= -1.22 (180deg=-2.23) USER MOD Set 4.1: A 8 GLN : amide:sc= -0.289 K(o=-1.3,f=0.081) USER MOD Set 4.2: A 10 GLN : amide:sc= -1 K(o=-1.3,f=0.12) USER MOD Set 5.1: A 1 MET N :NH3+ 141:sc= 1.13 (180deg=0.644) USER MOD Set 5.2: A 2 ASN : amide:sc= -0.182 K(o=0.95,f=-2.7!) USER MOD Single : A 1 MET CE :methyl 158:sc= -0.176 (180deg=-0.692) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ -161:sc= 1.12 (180deg=0.0572) USER MOD Single : A 7 TYR OH : rot -12:sc= 0.683 USER MOD Single : A 11 SER OG : rot 180:sc=-0.00699 USER MOD Single : A 12 GLN : amide:sc= -2.31! C(o=-2.3!,f=-3.1!) USER MOD Single : A 14 ASN : amide:sc= -3.22! C(o=-3.2!,f=-5.8!) USER MOD Single : A 19 MET CE :methyl 171:sc= -0.937 (180deg=-1.04) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 MET CE :methyl 161:sc= -0.13 (180deg=-0.579) USER MOD Single : A 30 GLN : amide:sc= 0.0994 K(o=0.099,f=-1.4) USER MOD Single : A 31 LYS NZ :NH3+ 172:sc= 1.28 (180deg=1.22) USER MOD Single : A 33 LYS NZ :NH3+ -168:sc= 1.28 (180deg=0.896) USER MOD Single : A 36 LYS NZ :NH3+ -158:sc= -0.0744 (180deg=-0.478) USER MOD Single : A 39 SER OG : rot 22:sc= 1.19 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -151:sc= 1.29 (180deg=1.12) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 76:sc= 0.164 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.564 USER MOD Single : A 54 TYR OH : rot 180:sc= -0.216 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HE2:sc= -0.0785! C(o=-0.079!,f=-4.7!) USER MOD Single : A 61 ASN : amide:sc= -7.88! C(o=-7.9!,f=-5.2!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot 117:sc= 0.265 USER MOD Single : A 74 MET CE :methyl -118:sc= -0.532 (180deg=-3.94!) USER MOD Single : A 78 LYS NZ :NH3+ 138:sc= -0.556 (180deg=-2.2!) USER MOD Single : A 80 LYS NZ :NH3+ -178:sc= 0.928 (180deg=0.924) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -2.4! X(o=-2.4!,f=-2.7) USER MOD Single : A 90 LYS NZ :NH3+ -135:sc= 1.18 (180deg=0.953) USER MOD Single : A 93 THR OG1 : rot 62:sc= -1.8! USER MOD Single : A 94 THR OG1 : rot 43:sc= 0.789 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.606! X(o=-0.61!,f=-0.39) USER MOD Single : A 108 THR OG1 : rot 29:sc= 0.0185 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 154:sc= -4.35! USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot -120:sc= -1.24 USER MOD Single : A 125 LYS NZ :NH3+ -136:sc= -0.113 (180deg=-1.97!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.689 -17.113 4.008 1.00 0.00 N ATOM 2 CA MET A 1 7.773 -15.650 4.223 1.00 0.00 C ATOM 3 C MET A 1 7.337 -14.908 2.967 1.00 0.00 C ATOM 4 O MET A 1 8.151 -14.296 2.278 1.00 0.00 O ATOM 5 CB MET A 1 9.201 -15.234 4.604 1.00 0.00 C ATOM 6 CG MET A 1 9.708 -15.849 5.902 1.00 0.00 C ATOM 7 SD MET A 1 9.941 -17.637 5.797 1.00 0.00 S ATOM 8 CE MET A 1 11.201 -17.747 4.526 1.00 0.00 C ATOM 0 H1 MET A 1 8.500 -17.578 4.464 1.00 0.00 H new ATOM 0 H2 MET A 1 6.806 -17.474 4.421 1.00 0.00 H new ATOM 0 H3 MET A 1 7.703 -17.315 2.988 1.00 0.00 H new ATOM 0 HA MET A 1 7.105 -15.389 5.044 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.876 -15.513 3.795 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.240 -14.148 4.691 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.654 -15.381 6.173 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.002 -15.627 6.702 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.724 -18.699 4.614 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.734 -17.679 3.544 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.912 -16.930 4.647 1.00 0.00 H new ATOM 20 N ASN A 2 6.051 -14.978 2.669 1.00 0.00 N ATOM 21 CA ASN A 2 5.495 -14.318 1.497 1.00 0.00 C ATOM 22 C ASN A 2 4.646 -13.148 1.952 1.00 0.00 C ATOM 23 O ASN A 2 3.627 -13.344 2.610 1.00 0.00 O ATOM 24 CB ASN A 2 4.604 -15.267 0.693 1.00 0.00 C ATOM 25 CG ASN A 2 5.315 -16.507 0.167 1.00 0.00 C ATOM 26 OD1 ASN A 2 6.297 -16.983 0.740 1.00 0.00 O ATOM 27 ND2 ASN A 2 4.802 -17.048 -0.926 1.00 0.00 N ATOM 0 H ASN A 2 5.367 -15.489 3.226 1.00 0.00 H new ATOM 0 HA ASN A 2 6.322 -13.990 0.867 1.00 0.00 H new ATOM 0 HB2 ASN A 2 3.770 -15.581 1.320 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.181 -14.721 -0.150 1.00 0.00 H new ATOM 0 HD21 ASN A 2 5.220 -17.889 -1.323 1.00 0.00 H new ATOM 0 HD22 ASN A 2 3.988 -16.624 -1.371 1.00 0.00 H new ATOM 34 N PHE A 3 5.105 -11.948 1.642 1.00 0.00 N ATOM 35 CA PHE A 3 4.408 -10.699 1.956 1.00 0.00 C ATOM 36 C PHE A 3 4.634 -10.319 3.407 1.00 0.00 C ATOM 37 O PHE A 3 4.650 -9.146 3.753 1.00 0.00 O ATOM 38 CB PHE A 3 2.902 -10.802 1.653 1.00 0.00 C ATOM 39 CG PHE A 3 2.166 -9.488 1.667 1.00 0.00 C ATOM 40 CD1 PHE A 3 2.675 -8.382 1.005 1.00 0.00 C ATOM 41 CD2 PHE A 3 0.949 -9.370 2.311 1.00 0.00 C ATOM 42 CE1 PHE A 3 1.985 -7.185 0.988 1.00 0.00 C ATOM 43 CE2 PHE A 3 0.257 -8.174 2.304 1.00 0.00 C ATOM 44 CZ PHE A 3 0.775 -7.081 1.639 1.00 0.00 C ATOM 0 H PHE A 3 5.990 -11.805 1.155 1.00 0.00 H new ATOM 0 HA PHE A 3 4.821 -9.917 1.319 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.773 -11.265 0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.443 -11.468 2.384 1.00 0.00 H new ATOM 0 HD1 PHE A 3 3.624 -8.457 0.495 1.00 0.00 H new ATOM 0 HD2 PHE A 3 0.534 -10.223 2.826 1.00 0.00 H new ATOM 0 HE1 PHE A 3 2.393 -6.333 0.465 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.689 -8.094 2.819 1.00 0.00 H new ATOM 0 HZ PHE A 3 0.233 -6.147 1.629 1.00 0.00 H new ATOM 54 N SER A 4 4.838 -11.317 4.247 1.00 0.00 N ATOM 55 CA SER A 4 5.007 -11.071 5.664 1.00 0.00 C ATOM 56 C SER A 4 6.442 -10.669 6.009 1.00 0.00 C ATOM 57 O SER A 4 7.399 -11.083 5.351 1.00 0.00 O ATOM 58 CB SER A 4 4.581 -12.295 6.467 1.00 0.00 C ATOM 59 OG SER A 4 5.421 -13.411 6.212 1.00 0.00 O ATOM 0 H SER A 4 4.890 -12.298 3.974 1.00 0.00 H new ATOM 0 HA SER A 4 4.366 -10.231 5.932 1.00 0.00 H new ATOM 0 HB2 SER A 4 4.604 -12.058 7.531 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.551 -12.551 6.220 1.00 0.00 H new ATOM 0 HG SER A 4 5.119 -14.176 6.745 1.00 0.00 H new ATOM 65 N GLY A 5 6.561 -9.864 7.053 1.00 0.00 N ATOM 66 CA GLY A 5 7.831 -9.337 7.485 1.00 0.00 C ATOM 67 C GLY A 5 7.858 -7.841 7.385 1.00 0.00 C ATOM 68 O GLY A 5 6.866 -7.229 7.001 1.00 0.00 O ATOM 0 H GLY A 5 5.771 -9.561 7.623 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.022 -9.639 8.515 1.00 0.00 H new ATOM 0 HA3 GLY A 5 8.630 -9.760 6.875 1.00 0.00 H new ATOM 72 N LYS A 6 8.978 -7.243 7.723 1.00 0.00 N ATOM 73 CA LYS A 6 9.080 -5.797 7.668 1.00 0.00 C ATOM 74 C LYS A 6 9.672 -5.393 6.322 1.00 0.00 C ATOM 75 O LYS A 6 10.800 -5.754 5.997 1.00 0.00 O ATOM 76 CB LYS A 6 9.970 -5.240 8.789 1.00 0.00 C ATOM 77 CG LYS A 6 10.221 -6.189 9.954 1.00 0.00 C ATOM 78 CD LYS A 6 11.430 -7.078 9.714 1.00 0.00 C ATOM 79 CE LYS A 6 12.701 -6.261 9.551 1.00 0.00 C ATOM 80 NZ LYS A 6 13.905 -7.118 9.389 1.00 0.00 N ATOM 0 H LYS A 6 9.821 -7.724 8.035 1.00 0.00 H new ATOM 0 HA LYS A 6 8.079 -5.385 7.796 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.931 -4.956 8.360 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.512 -4.330 9.176 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.371 -5.611 10.866 1.00 0.00 H new ATOM 0 HG3 LYS A 6 9.340 -6.811 10.112 1.00 0.00 H new ATOM 0 HD2 LYS A 6 11.546 -7.769 10.549 1.00 0.00 H new ATOM 0 HD3 LYS A 6 11.267 -7.681 8.821 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.602 -5.609 8.683 1.00 0.00 H new ATOM 0 HE3 LYS A 6 12.830 -5.617 10.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 14.758 -6.562 9.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.847 -7.926 10.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 13.954 -7.466 8.410 1.00 0.00 H new ATOM 94 N TYR A 7 8.898 -4.666 5.546 1.00 0.00 N ATOM 95 CA TYR A 7 9.332 -4.152 4.260 1.00 0.00 C ATOM 96 C TYR A 7 9.189 -2.648 4.287 1.00 0.00 C ATOM 97 O TYR A 7 8.159 -2.136 4.685 1.00 0.00 O ATOM 98 CB TYR A 7 8.469 -4.711 3.114 1.00 0.00 C ATOM 99 CG TYR A 7 8.442 -6.220 3.004 1.00 0.00 C ATOM 100 CD1 TYR A 7 7.833 -6.998 3.977 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.018 -6.867 1.921 1.00 0.00 C ATOM 102 CE1 TYR A 7 7.802 -8.373 3.879 1.00 0.00 C ATOM 103 CE2 TYR A 7 8.989 -8.245 1.815 1.00 0.00 C ATOM 104 CZ TYR A 7 8.383 -8.992 2.799 1.00 0.00 C ATOM 105 OH TYR A 7 8.352 -10.365 2.700 1.00 0.00 O ATOM 0 H TYR A 7 7.941 -4.411 5.790 1.00 0.00 H new ATOM 0 HA TYR A 7 10.365 -4.453 4.087 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.447 -4.354 3.243 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.834 -4.301 2.172 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.374 -6.517 4.828 1.00 0.00 H new ATOM 0 HD2 TYR A 7 9.497 -6.285 1.148 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.323 -8.961 4.648 1.00 0.00 H new ATOM 0 HE2 TYR A 7 9.440 -8.733 0.964 1.00 0.00 H new ATOM 0 HH TYR A 7 8.057 -10.748 3.552 1.00 0.00 H new ATOM 115 N GLN A 8 10.198 -1.935 3.864 1.00 0.00 N ATOM 116 CA GLN A 8 10.168 -0.493 3.979 1.00 0.00 C ATOM 117 C GLN A 8 9.929 0.120 2.610 1.00 0.00 C ATOM 118 O GLN A 8 10.589 -0.255 1.636 1.00 0.00 O ATOM 119 CB GLN A 8 11.488 0.004 4.554 1.00 0.00 C ATOM 120 CG GLN A 8 11.374 1.288 5.345 1.00 0.00 C ATOM 121 CD GLN A 8 12.469 2.279 5.020 1.00 0.00 C ATOM 122 OE1 GLN A 8 13.541 2.251 5.619 1.00 0.00 O ATOM 123 NE2 GLN A 8 12.206 3.167 4.075 1.00 0.00 N ATOM 0 H GLN A 8 11.043 -2.318 3.441 1.00 0.00 H new ATOM 0 HA GLN A 8 9.359 -0.197 4.647 1.00 0.00 H new ATOM 0 HB2 GLN A 8 11.906 -0.770 5.197 1.00 0.00 H new ATOM 0 HB3 GLN A 8 12.194 0.155 3.737 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.405 1.746 5.146 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.405 1.057 6.410 1.00 0.00 H new ATOM 0 HE21 GLN A 8 11.303 3.156 3.602 1.00 0.00 H new ATOM 0 HE22 GLN A 8 12.907 3.863 3.820 1.00 0.00 H new ATOM 132 N VAL A 9 8.976 1.039 2.520 1.00 0.00 N ATOM 133 CA VAL A 9 8.743 1.736 1.260 1.00 0.00 C ATOM 134 C VAL A 9 9.920 2.675 0.958 1.00 0.00 C ATOM 135 O VAL A 9 10.470 3.318 1.858 1.00 0.00 O ATOM 136 CB VAL A 9 7.405 2.515 1.254 1.00 0.00 C ATOM 137 CG1 VAL A 9 7.582 3.904 1.776 1.00 0.00 C ATOM 138 CG2 VAL A 9 6.797 2.532 -0.139 1.00 0.00 C ATOM 0 H VAL A 9 8.363 1.316 3.287 1.00 0.00 H new ATOM 0 HA VAL A 9 8.670 0.983 0.475 1.00 0.00 H new ATOM 0 HB VAL A 9 6.715 1.997 1.921 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.624 4.424 1.759 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.954 3.863 2.800 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.297 4.439 1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.858 3.085 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.487 3.014 -0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.610 1.509 -0.467 1.00 0.00 H new ATOM 148 N GLN A 10 10.320 2.709 -0.306 1.00 0.00 N ATOM 149 CA GLN A 10 11.498 3.458 -0.740 1.00 0.00 C ATOM 150 C GLN A 10 11.115 4.658 -1.595 1.00 0.00 C ATOM 151 O GLN A 10 11.583 5.777 -1.377 1.00 0.00 O ATOM 152 CB GLN A 10 12.422 2.574 -1.569 1.00 0.00 C ATOM 153 CG GLN A 10 13.261 1.584 -0.791 1.00 0.00 C ATOM 154 CD GLN A 10 13.555 2.021 0.633 1.00 0.00 C ATOM 155 OE1 GLN A 10 14.505 2.758 0.884 1.00 0.00 O ATOM 156 NE2 GLN A 10 12.775 1.531 1.581 1.00 0.00 N ATOM 0 H GLN A 10 9.839 2.220 -1.061 1.00 0.00 H new ATOM 0 HA GLN A 10 12.002 3.798 0.164 1.00 0.00 H new ATOM 0 HB2 GLN A 10 11.817 2.022 -2.288 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.091 3.217 -2.142 1.00 0.00 H new ATOM 0 HG2 GLN A 10 12.746 0.624 -0.768 1.00 0.00 H new ATOM 0 HG3 GLN A 10 14.203 1.428 -1.316 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.995 0.922 1.335 1.00 0.00 H new ATOM 0 HE22 GLN A 10 12.953 1.762 2.558 1.00 0.00 H new ATOM 165 N SER A 11 10.270 4.410 -2.584 1.00 0.00 N ATOM 166 CA SER A 11 9.976 5.398 -3.616 1.00 0.00 C ATOM 167 C SER A 11 8.611 5.139 -4.240 1.00 0.00 C ATOM 168 O SER A 11 8.123 4.010 -4.226 1.00 0.00 O ATOM 169 CB SER A 11 11.060 5.349 -4.690 1.00 0.00 C ATOM 170 OG SER A 11 12.306 5.810 -4.188 1.00 0.00 O ATOM 0 H SER A 11 9.772 3.527 -2.696 1.00 0.00 H new ATOM 0 HA SER A 11 9.959 6.388 -3.160 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.168 4.327 -5.054 1.00 0.00 H new ATOM 0 HB3 SER A 11 10.760 5.961 -5.541 1.00 0.00 H new ATOM 0 HG SER A 11 12.981 5.766 -4.897 1.00 0.00 H new ATOM 176 N GLN A 12 7.997 6.185 -4.785 1.00 0.00 N ATOM 177 CA GLN A 12 6.667 6.067 -5.372 1.00 0.00 C ATOM 178 C GLN A 12 6.576 6.814 -6.692 1.00 0.00 C ATOM 179 O GLN A 12 7.354 7.723 -6.970 1.00 0.00 O ATOM 180 CB GLN A 12 5.562 6.597 -4.449 1.00 0.00 C ATOM 181 CG GLN A 12 5.443 5.886 -3.105 1.00 0.00 C ATOM 182 CD GLN A 12 6.536 6.271 -2.119 1.00 0.00 C ATOM 183 OE1 GLN A 12 6.955 5.460 -1.298 1.00 0.00 O ATOM 184 NE2 GLN A 12 7.000 7.511 -2.187 1.00 0.00 N ATOM 0 H GLN A 12 8.398 7.122 -4.832 1.00 0.00 H new ATOM 0 HA GLN A 12 6.514 4.999 -5.529 1.00 0.00 H new ATOM 0 HB2 GLN A 12 5.740 7.657 -4.267 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.607 6.519 -4.969 1.00 0.00 H new ATOM 0 HG2 GLN A 12 4.472 6.114 -2.666 1.00 0.00 H new ATOM 0 HG3 GLN A 12 5.474 4.809 -3.268 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.628 8.157 -2.883 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.729 7.819 -1.544 1.00 0.00 H new ATOM 193 N GLU A 13 5.620 6.393 -7.493 1.00 0.00 N ATOM 194 CA GLU A 13 5.314 7.010 -8.768 1.00 0.00 C ATOM 195 C GLU A 13 3.935 7.642 -8.721 1.00 0.00 C ATOM 196 O GLU A 13 2.984 6.996 -8.302 1.00 0.00 O ATOM 197 CB GLU A 13 5.331 5.932 -9.828 1.00 0.00 C ATOM 198 CG GLU A 13 6.644 5.795 -10.568 1.00 0.00 C ATOM 199 CD GLU A 13 6.827 6.864 -11.623 1.00 0.00 C ATOM 200 OE1 GLU A 13 6.407 6.646 -12.778 1.00 0.00 O ATOM 201 OE2 GLU A 13 7.391 7.928 -11.308 1.00 0.00 O ATOM 0 H GLU A 13 5.022 5.597 -7.272 1.00 0.00 H new ATOM 0 HA GLU A 13 6.049 7.783 -8.993 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.092 4.977 -9.360 1.00 0.00 H new ATOM 0 HB3 GLU A 13 4.542 6.139 -10.551 1.00 0.00 H new ATOM 0 HG2 GLU A 13 7.467 5.848 -9.855 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.692 4.813 -11.038 1.00 0.00 H new ATOM 208 N ASN A 14 3.829 8.892 -9.144 1.00 0.00 N ATOM 209 CA ASN A 14 2.539 9.581 -9.208 1.00 0.00 C ATOM 210 C ASN A 14 1.915 9.745 -7.845 1.00 0.00 C ATOM 211 O ASN A 14 0.703 9.766 -7.723 1.00 0.00 O ATOM 212 CB ASN A 14 1.547 8.842 -10.099 1.00 0.00 C ATOM 213 CG ASN A 14 1.927 8.935 -11.554 1.00 0.00 C ATOM 214 OD1 ASN A 14 1.396 9.729 -12.328 1.00 0.00 O ATOM 215 ND2 ASN A 14 2.894 8.139 -11.897 1.00 0.00 N ATOM 0 H ASN A 14 4.621 9.456 -9.450 1.00 0.00 H new ATOM 0 HA ASN A 14 2.752 10.564 -9.629 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.501 7.794 -9.801 1.00 0.00 H new ATOM 0 HB3 ASN A 14 0.550 9.258 -9.956 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.251 8.152 -12.852 1.00 0.00 H new ATOM 0 HD22 ASN A 14 3.296 7.500 -11.211 1.00 0.00 H new ATOM 222 N PHE A 15 2.736 9.877 -6.833 1.00 0.00 N ATOM 223 CA PHE A 15 2.257 10.158 -5.478 1.00 0.00 C ATOM 224 C PHE A 15 1.680 11.573 -5.386 1.00 0.00 C ATOM 225 O PHE A 15 1.494 12.111 -4.299 1.00 0.00 O ATOM 226 CB PHE A 15 3.378 9.954 -4.451 1.00 0.00 C ATOM 227 CG PHE A 15 4.677 10.626 -4.801 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.613 9.979 -5.589 1.00 0.00 C ATOM 229 CD2 PHE A 15 4.966 11.897 -4.335 1.00 0.00 C ATOM 230 CE1 PHE A 15 6.812 10.585 -5.906 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.163 12.508 -4.650 1.00 0.00 C ATOM 232 CZ PHE A 15 7.087 11.851 -5.435 1.00 0.00 C ATOM 0 H PHE A 15 3.750 9.796 -6.911 1.00 0.00 H new ATOM 0 HA PHE A 15 1.457 9.454 -5.248 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.040 10.327 -3.484 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.557 8.885 -4.335 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.403 8.987 -5.961 1.00 0.00 H new ATOM 0 HD2 PHE A 15 4.247 12.416 -3.718 1.00 0.00 H new ATOM 0 HE1 PHE A 15 7.533 10.068 -6.522 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.376 13.501 -4.282 1.00 0.00 H new ATOM 0 HZ PHE A 15 8.025 12.328 -5.680 1.00 0.00 H new ATOM 242 N GLU A 16 1.401 12.156 -6.545 1.00 0.00 N ATOM 243 CA GLU A 16 0.942 13.541 -6.648 1.00 0.00 C ATOM 244 C GLU A 16 -0.328 13.659 -7.502 1.00 0.00 C ATOM 245 O GLU A 16 -1.295 14.278 -7.083 1.00 0.00 O ATOM 246 CB GLU A 16 2.079 14.383 -7.204 1.00 0.00 C ATOM 247 CG GLU A 16 3.272 14.362 -6.305 1.00 0.00 C ATOM 248 CD GLU A 16 4.494 15.018 -6.915 1.00 0.00 C ATOM 249 OE1 GLU A 16 4.506 16.246 -7.072 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.449 14.297 -7.267 1.00 0.00 O ATOM 0 H GLU A 16 1.486 11.683 -7.444 1.00 0.00 H new ATOM 0 HA GLU A 16 0.670 13.908 -5.659 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.359 14.011 -8.190 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.740 15.411 -7.336 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.024 14.868 -5.372 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.510 13.329 -6.053 1.00 0.00 H new ATOM 257 N PRO A 17 -0.374 13.052 -8.695 1.00 0.00 N ATOM 258 CA PRO A 17 -1.604 12.994 -9.480 1.00 0.00 C ATOM 259 C PRO A 17 -2.609 12.072 -8.816 1.00 0.00 C ATOM 260 O PRO A 17 -3.818 12.221 -8.948 1.00 0.00 O ATOM 261 CB PRO A 17 -1.170 12.407 -10.801 1.00 0.00 C ATOM 262 CG PRO A 17 0.071 11.662 -10.498 1.00 0.00 C ATOM 263 CD PRO A 17 0.731 12.366 -9.360 1.00 0.00 C ATOM 0 HA PRO A 17 -2.080 13.969 -9.582 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.936 11.749 -11.211 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.991 13.188 -11.540 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -0.153 10.628 -10.235 1.00 0.00 H new ATOM 0 HG3 PRO A 17 0.727 11.634 -11.368 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.230 11.666 -8.690 1.00 0.00 H new ATOM 0 HD3 PRO A 17 1.488 13.069 -9.708 1.00 0.00 H new ATOM 271 N PHE A 18 -2.061 11.113 -8.104 1.00 0.00 N ATOM 272 CA PHE A 18 -2.822 10.210 -7.278 1.00 0.00 C ATOM 273 C PHE A 18 -3.503 11.018 -6.187 1.00 0.00 C ATOM 274 O PHE A 18 -4.720 10.966 -6.022 1.00 0.00 O ATOM 275 CB PHE A 18 -1.819 9.193 -6.725 1.00 0.00 C ATOM 276 CG PHE A 18 -2.302 8.203 -5.684 1.00 0.00 C ATOM 277 CD1 PHE A 18 -3.265 8.525 -4.742 1.00 0.00 C ATOM 278 CD2 PHE A 18 -1.764 6.927 -5.661 1.00 0.00 C ATOM 279 CE1 PHE A 18 -3.682 7.601 -3.807 1.00 0.00 C ATOM 280 CE2 PHE A 18 -2.175 5.999 -4.726 1.00 0.00 C ATOM 281 CZ PHE A 18 -3.136 6.335 -3.797 1.00 0.00 C ATOM 0 H PHE A 18 -1.056 10.938 -8.084 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.607 9.681 -7.819 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.423 8.624 -7.567 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -0.985 9.748 -6.295 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -3.696 9.515 -4.740 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -1.011 6.654 -6.386 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -4.437 7.869 -3.082 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.743 5.009 -4.722 1.00 0.00 H new ATOM 0 HZ PHE A 18 -3.460 5.610 -3.065 1.00 0.00 H new ATOM 291 N MET A 19 -2.707 11.804 -5.485 1.00 0.00 N ATOM 292 CA MET A 19 -3.232 12.683 -4.447 1.00 0.00 C ATOM 293 C MET A 19 -4.201 13.698 -5.039 1.00 0.00 C ATOM 294 O MET A 19 -5.220 14.027 -4.425 1.00 0.00 O ATOM 295 CB MET A 19 -2.117 13.437 -3.723 1.00 0.00 C ATOM 296 CG MET A 19 -1.128 12.551 -2.988 1.00 0.00 C ATOM 297 SD MET A 19 -1.917 11.326 -1.921 1.00 0.00 S ATOM 298 CE MET A 19 -2.847 12.376 -0.805 1.00 0.00 C ATOM 0 H MET A 19 -1.696 11.854 -5.612 1.00 0.00 H new ATOM 0 HA MET A 19 -3.750 12.046 -3.730 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.573 14.041 -4.450 1.00 0.00 H new ATOM 0 HB3 MET A 19 -2.567 14.127 -3.009 1.00 0.00 H new ATOM 0 HG2 MET A 19 -0.501 12.037 -3.717 1.00 0.00 H new ATOM 0 HG3 MET A 19 -0.469 13.176 -2.385 1.00 0.00 H new ATOM 0 HE1 MET A 19 -3.508 11.762 -0.194 1.00 0.00 H new ATOM 0 HE2 MET A 19 -2.158 12.921 -0.160 1.00 0.00 H new ATOM 0 HE3 MET A 19 -3.441 13.085 -1.382 1.00 0.00 H new ATOM 308 N LYS A 20 -3.887 14.182 -6.241 1.00 0.00 N ATOM 309 CA LYS A 20 -4.681 15.226 -6.870 1.00 0.00 C ATOM 310 C LYS A 20 -6.062 14.683 -7.218 1.00 0.00 C ATOM 311 O LYS A 20 -7.069 15.378 -7.098 1.00 0.00 O ATOM 312 CB LYS A 20 -3.989 15.786 -8.134 1.00 0.00 C ATOM 313 CG LYS A 20 -4.389 15.116 -9.436 1.00 0.00 C ATOM 314 CD LYS A 20 -3.775 15.837 -10.611 1.00 0.00 C ATOM 315 CE LYS A 20 -3.574 14.889 -11.762 1.00 0.00 C ATOM 316 NZ LYS A 20 -2.924 15.544 -12.925 1.00 0.00 N ATOM 0 H LYS A 20 -3.090 13.866 -6.793 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.782 16.048 -6.161 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.209 16.851 -8.209 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -2.910 15.691 -8.011 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.065 14.075 -9.431 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.475 15.112 -9.531 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -4.420 16.660 -10.918 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -2.819 16.273 -10.319 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -2.964 14.047 -11.434 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -4.538 14.484 -12.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -2.807 14.852 -13.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -3.517 16.331 -13.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -1.992 15.908 -12.642 1.00 0.00 H new ATOM 330 N ALA A 21 -6.082 13.426 -7.639 1.00 0.00 N ATOM 331 CA ALA A 21 -7.313 12.749 -8.007 1.00 0.00 C ATOM 332 C ALA A 21 -8.210 12.530 -6.793 1.00 0.00 C ATOM 333 O ALA A 21 -9.429 12.420 -6.920 1.00 0.00 O ATOM 334 CB ALA A 21 -6.992 11.429 -8.680 1.00 0.00 C ATOM 0 H ALA A 21 -5.246 12.850 -7.734 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.858 13.383 -8.707 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.919 10.925 -8.954 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.400 11.612 -9.577 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.426 10.799 -7.994 1.00 0.00 H new ATOM 340 N MET A 22 -7.598 12.473 -5.615 1.00 0.00 N ATOM 341 CA MET A 22 -8.352 12.341 -4.375 1.00 0.00 C ATOM 342 C MET A 22 -8.907 13.695 -3.985 1.00 0.00 C ATOM 343 O MET A 22 -10.109 13.852 -3.765 1.00 0.00 O ATOM 344 CB MET A 22 -7.472 11.827 -3.238 1.00 0.00 C ATOM 345 CG MET A 22 -6.657 10.612 -3.602 1.00 0.00 C ATOM 346 SD MET A 22 -5.610 10.051 -2.246 1.00 0.00 S ATOM 347 CE MET A 22 -6.842 9.580 -1.032 1.00 0.00 C ATOM 0 H MET A 22 -6.586 12.516 -5.493 1.00 0.00 H new ATOM 0 HA MET A 22 -9.156 11.624 -4.542 1.00 0.00 H new ATOM 0 HB2 MET A 22 -6.798 12.624 -2.923 1.00 0.00 H new ATOM 0 HB3 MET A 22 -8.103 11.587 -2.382 1.00 0.00 H new ATOM 0 HG2 MET A 22 -7.327 9.804 -3.898 1.00 0.00 H new ATOM 0 HG3 MET A 22 -6.034 10.842 -4.466 1.00 0.00 H new ATOM 0 HE1 MET A 22 -6.391 8.916 -0.295 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.221 10.472 -0.533 1.00 0.00 H new ATOM 0 HE3 MET A 22 -7.664 9.065 -1.529 1.00 0.00 H new ATOM 357 N GLY A 23 -8.018 14.671 -3.914 1.00 0.00 N ATOM 358 CA GLY A 23 -8.424 16.011 -3.566 1.00 0.00 C ATOM 359 C GLY A 23 -7.276 16.893 -3.117 1.00 0.00 C ATOM 360 O GLY A 23 -7.413 18.118 -3.080 1.00 0.00 O ATOM 0 H GLY A 23 -7.020 14.557 -4.092 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.909 16.470 -4.427 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.167 15.962 -2.770 1.00 0.00 H new ATOM 364 N LEU A 24 -6.142 16.293 -2.780 1.00 0.00 N ATOM 365 CA LEU A 24 -5.009 17.042 -2.298 1.00 0.00 C ATOM 366 C LEU A 24 -4.238 17.631 -3.473 1.00 0.00 C ATOM 367 O LEU A 24 -3.924 16.929 -4.432 1.00 0.00 O ATOM 368 CB LEU A 24 -4.108 16.122 -1.487 1.00 0.00 C ATOM 369 CG LEU A 24 -2.954 16.809 -0.773 1.00 0.00 C ATOM 370 CD1 LEU A 24 -3.442 17.438 0.514 1.00 0.00 C ATOM 371 CD2 LEU A 24 -1.837 15.826 -0.520 1.00 0.00 C ATOM 0 H LEU A 24 -5.991 15.286 -2.835 1.00 0.00 H new ATOM 0 HA LEU A 24 -5.354 17.859 -1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.717 15.605 -0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.701 15.360 -2.152 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.560 17.603 -1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -2.609 17.928 1.018 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.214 18.174 0.289 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.856 16.666 1.163 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.017 16.330 -0.008 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.205 15.009 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.481 15.427 -1.470 1.00 0.00 H new ATOM 383 N PRO A 25 -3.928 18.928 -3.419 1.00 0.00 N ATOM 384 CA PRO A 25 -3.189 19.606 -4.480 1.00 0.00 C ATOM 385 C PRO A 25 -1.711 19.262 -4.421 1.00 0.00 C ATOM 386 O PRO A 25 -1.162 19.045 -3.342 1.00 0.00 O ATOM 387 CB PRO A 25 -3.410 21.079 -4.161 1.00 0.00 C ATOM 388 CG PRO A 25 -3.506 21.093 -2.687 1.00 0.00 C ATOM 389 CD PRO A 25 -4.240 19.840 -2.309 1.00 0.00 C ATOM 0 HA PRO A 25 -3.519 19.323 -5.480 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -2.585 21.696 -4.517 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -4.318 21.460 -4.628 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.516 21.118 -2.232 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -4.039 21.978 -2.339 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -3.898 19.444 -1.353 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -5.312 20.012 -2.217 1.00 0.00 H new ATOM 397 N GLU A 26 -1.085 19.204 -5.590 1.00 0.00 N ATOM 398 CA GLU A 26 0.327 18.896 -5.716 1.00 0.00 C ATOM 399 C GLU A 26 1.181 19.755 -4.809 1.00 0.00 C ATOM 400 O GLU A 26 2.119 19.241 -4.243 1.00 0.00 O ATOM 401 CB GLU A 26 0.757 19.048 -7.164 1.00 0.00 C ATOM 402 CG GLU A 26 2.102 18.428 -7.480 1.00 0.00 C ATOM 403 CD GLU A 26 2.408 18.437 -8.962 1.00 0.00 C ATOM 404 OE1 GLU A 26 2.793 19.500 -9.490 1.00 0.00 O ATOM 405 OE2 GLU A 26 2.260 17.381 -9.615 1.00 0.00 O ATOM 0 H GLU A 26 -1.550 19.371 -6.482 1.00 0.00 H new ATOM 0 HA GLU A 26 0.475 17.863 -5.402 1.00 0.00 H new ATOM 0 HB2 GLU A 26 0.001 18.595 -7.805 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.791 20.109 -7.412 1.00 0.00 H new ATOM 0 HG2 GLU A 26 2.883 18.970 -6.947 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.121 17.401 -7.114 1.00 0.00 H new ATOM 412 N ASP A 27 0.849 21.030 -4.622 1.00 0.00 N ATOM 413 CA ASP A 27 1.580 21.849 -3.648 1.00 0.00 C ATOM 414 C ASP A 27 1.501 21.214 -2.275 1.00 0.00 C ATOM 415 O ASP A 27 2.517 20.986 -1.657 1.00 0.00 O ATOM 416 CB ASP A 27 1.046 23.272 -3.582 1.00 0.00 C ATOM 417 CG ASP A 27 1.577 24.030 -2.379 1.00 0.00 C ATOM 418 OD1 ASP A 27 2.735 24.500 -2.428 1.00 0.00 O ATOM 419 OD2 ASP A 27 0.839 24.161 -1.382 1.00 0.00 O ATOM 0 H ASP A 27 0.099 21.513 -5.116 1.00 0.00 H new ATOM 0 HA ASP A 27 2.618 21.897 -3.977 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.320 23.803 -4.494 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -0.043 23.248 -3.542 1.00 0.00 H new ATOM 424 N LEU A 28 0.320 20.807 -1.852 1.00 0.00 N ATOM 425 CA LEU A 28 0.173 20.222 -0.519 1.00 0.00 C ATOM 426 C LEU A 28 0.865 18.876 -0.481 1.00 0.00 C ATOM 427 O LEU A 28 1.414 18.469 0.542 1.00 0.00 O ATOM 428 CB LEU A 28 -1.295 20.098 -0.120 1.00 0.00 C ATOM 429 CG LEU A 28 -1.929 21.415 0.322 1.00 0.00 C ATOM 430 CD1 LEU A 28 -3.430 21.288 0.493 1.00 0.00 C ATOM 431 CD2 LEU A 28 -1.312 21.849 1.623 1.00 0.00 C ATOM 0 H LEU A 28 -0.542 20.865 -2.395 1.00 0.00 H new ATOM 0 HA LEU A 28 0.643 20.885 0.207 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -1.858 19.700 -0.964 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.381 19.374 0.691 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.743 22.157 -0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -3.843 22.246 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -3.880 20.993 -0.455 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -3.648 20.533 1.249 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.761 22.789 1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.488 21.086 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.239 21.987 1.489 1.00 0.00 H new ATOM 443 N ILE A 29 0.841 18.196 -1.610 1.00 0.00 N ATOM 444 CA ILE A 29 1.625 16.997 -1.790 1.00 0.00 C ATOM 445 C ILE A 29 3.116 17.306 -1.661 1.00 0.00 C ATOM 446 O ILE A 29 3.818 16.627 -0.956 1.00 0.00 O ATOM 447 CB ILE A 29 1.368 16.394 -3.167 1.00 0.00 C ATOM 448 CG1 ILE A 29 -0.114 16.180 -3.375 1.00 0.00 C ATOM 449 CG2 ILE A 29 2.088 15.080 -3.292 1.00 0.00 C ATOM 450 CD1 ILE A 29 -0.507 16.011 -4.806 1.00 0.00 C ATOM 0 H ILE A 29 0.281 18.459 -2.421 1.00 0.00 H new ATOM 0 HA ILE A 29 1.331 16.287 -1.017 1.00 0.00 H new ATOM 0 HB ILE A 29 1.738 17.084 -3.926 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.425 15.297 -2.816 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.656 17.029 -2.958 1.00 0.00 H new ATOM 0 HG21 ILE A 29 1.900 14.655 -4.278 1.00 0.00 H new ATOM 0 HG22 ILE A 29 3.159 15.238 -3.163 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.728 14.393 -2.526 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.585 15.862 -4.872 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.229 16.903 -5.368 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.005 15.144 -5.224 1.00 0.00 H new ATOM 462 N GLN A 30 3.554 18.387 -2.295 1.00 0.00 N ATOM 463 CA GLN A 30 4.987 18.766 -2.376 1.00 0.00 C ATOM 464 C GLN A 30 5.637 18.805 -1.007 1.00 0.00 C ATOM 465 O GLN A 30 6.766 18.351 -0.830 1.00 0.00 O ATOM 466 CB GLN A 30 5.153 20.166 -2.993 1.00 0.00 C ATOM 467 CG GLN A 30 4.679 20.300 -4.397 1.00 0.00 C ATOM 468 CD GLN A 30 5.130 19.160 -5.288 1.00 0.00 C ATOM 469 OE1 GLN A 30 6.189 19.211 -5.913 1.00 0.00 O ATOM 470 NE2 GLN A 30 4.324 18.121 -5.346 1.00 0.00 N ATOM 0 H GLN A 30 2.933 19.039 -2.775 1.00 0.00 H new ATOM 0 HA GLN A 30 5.465 18.008 -2.997 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.615 20.884 -2.375 1.00 0.00 H new ATOM 0 HB3 GLN A 30 6.207 20.440 -2.955 1.00 0.00 H new ATOM 0 HG2 GLN A 30 3.590 20.349 -4.403 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.043 21.241 -4.809 1.00 0.00 H new ATOM 0 HE21 GLN A 30 3.455 18.119 -4.812 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.568 17.318 -5.925 1.00 0.00 H new ATOM 479 N LYS A 31 4.917 19.349 -0.051 1.00 0.00 N ATOM 480 CA LYS A 31 5.437 19.515 1.293 1.00 0.00 C ATOM 481 C LYS A 31 5.601 18.161 1.961 1.00 0.00 C ATOM 482 O LYS A 31 6.490 17.964 2.789 1.00 0.00 O ATOM 483 CB LYS A 31 4.517 20.390 2.122 1.00 0.00 C ATOM 484 CG LYS A 31 4.532 21.873 1.729 1.00 0.00 C ATOM 485 CD LYS A 31 3.844 22.137 0.394 1.00 0.00 C ATOM 486 CE LYS A 31 4.834 22.394 -0.739 1.00 0.00 C ATOM 487 NZ LYS A 31 4.973 23.840 -1.043 1.00 0.00 N ATOM 0 H LYS A 31 3.963 19.687 -0.178 1.00 0.00 H new ATOM 0 HA LYS A 31 6.410 20.002 1.225 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.498 20.013 2.033 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.799 20.301 3.171 1.00 0.00 H new ATOM 0 HG2 LYS A 31 4.040 22.456 2.508 1.00 0.00 H new ATOM 0 HG3 LYS A 31 5.564 22.220 1.676 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.218 21.282 0.137 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.182 22.997 0.495 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.808 21.986 -0.468 1.00 0.00 H new ATOM 0 HE3 LYS A 31 4.505 21.866 -1.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.750 23.979 -1.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 4.086 24.195 -1.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.180 24.361 -0.167 1.00 0.00 H new ATOM 501 N GLY A 32 4.745 17.228 1.578 1.00 0.00 N ATOM 502 CA GLY A 32 4.723 15.938 2.215 1.00 0.00 C ATOM 503 C GLY A 32 4.774 14.785 1.223 1.00 0.00 C ATOM 504 O GLY A 32 4.199 13.723 1.465 1.00 0.00 O ATOM 0 H GLY A 32 4.061 17.347 0.831 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.570 15.861 2.897 1.00 0.00 H new ATOM 0 HA3 GLY A 32 3.819 15.852 2.818 1.00 0.00 H new ATOM 508 N LYS A 33 5.457 14.998 0.104 1.00 0.00 N ATOM 509 CA LYS A 33 5.326 14.117 -1.061 1.00 0.00 C ATOM 510 C LYS A 33 6.131 12.829 -0.940 1.00 0.00 C ATOM 511 O LYS A 33 5.645 11.745 -1.257 1.00 0.00 O ATOM 512 CB LYS A 33 5.771 14.865 -2.318 1.00 0.00 C ATOM 513 CG LYS A 33 7.206 15.304 -2.278 1.00 0.00 C ATOM 514 CD LYS A 33 7.595 16.086 -3.512 1.00 0.00 C ATOM 515 CE LYS A 33 9.104 16.113 -3.697 1.00 0.00 C ATOM 516 NZ LYS A 33 9.820 16.500 -2.449 1.00 0.00 N ATOM 0 H LYS A 33 6.108 15.772 -0.026 1.00 0.00 H new ATOM 0 HA LYS A 33 4.275 13.834 -1.121 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.620 14.223 -3.186 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.135 15.740 -2.454 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.373 15.918 -1.393 1.00 0.00 H new ATOM 0 HG3 LYS A 33 7.850 14.429 -2.185 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.127 15.641 -4.390 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.218 17.106 -3.433 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.446 15.129 -4.019 1.00 0.00 H new ATOM 0 HE3 LYS A 33 9.358 16.815 -4.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 10.816 16.702 -2.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 9.376 17.348 -2.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.769 15.720 -1.763 1.00 0.00 H new ATOM 530 N ASP A 34 7.354 12.949 -0.463 1.00 0.00 N ATOM 531 CA ASP A 34 8.308 11.854 -0.550 1.00 0.00 C ATOM 532 C ASP A 34 8.663 11.300 0.821 1.00 0.00 C ATOM 533 O ASP A 34 9.831 11.081 1.140 1.00 0.00 O ATOM 534 CB ASP A 34 9.570 12.309 -1.293 1.00 0.00 C ATOM 535 CG ASP A 34 10.285 13.468 -0.620 1.00 0.00 C ATOM 536 OD1 ASP A 34 9.697 14.569 -0.524 1.00 0.00 O ATOM 537 OD2 ASP A 34 11.448 13.292 -0.211 1.00 0.00 O ATOM 0 H ASP A 34 7.713 13.790 -0.012 1.00 0.00 H new ATOM 0 HA ASP A 34 7.836 11.048 -1.111 1.00 0.00 H new ATOM 0 HB2 ASP A 34 10.257 11.467 -1.375 1.00 0.00 H new ATOM 0 HB3 ASP A 34 9.299 12.600 -2.308 1.00 0.00 H new ATOM 542 N ILE A 35 7.644 11.063 1.624 1.00 0.00 N ATOM 543 CA ILE A 35 7.827 10.499 2.946 1.00 0.00 C ATOM 544 C ILE A 35 7.981 8.982 2.881 1.00 0.00 C ATOM 545 O ILE A 35 7.081 8.276 2.430 1.00 0.00 O ATOM 546 CB ILE A 35 6.641 10.850 3.857 1.00 0.00 C ATOM 547 CG1 ILE A 35 6.411 12.353 3.847 1.00 0.00 C ATOM 548 CG2 ILE A 35 6.904 10.380 5.279 1.00 0.00 C ATOM 549 CD1 ILE A 35 7.609 13.100 4.338 1.00 0.00 C ATOM 0 H ILE A 35 6.672 11.255 1.380 1.00 0.00 H new ATOM 0 HA ILE A 35 8.739 10.929 3.360 1.00 0.00 H new ATOM 0 HB ILE A 35 5.751 10.345 3.481 1.00 0.00 H new ATOM 0 HG12 ILE A 35 6.170 12.677 2.835 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.551 12.594 4.472 1.00 0.00 H new ATOM 0 HG21 ILE A 35 6.053 10.637 5.910 1.00 0.00 H new ATOM 0 HG22 ILE A 35 7.047 9.299 5.285 1.00 0.00 H new ATOM 0 HG23 ILE A 35 7.801 10.866 5.663 1.00 0.00 H new ATOM 0 HD11 ILE A 35 7.405 14.170 4.316 1.00 0.00 H new ATOM 0 HD12 ILE A 35 7.834 12.795 5.360 1.00 0.00 H new ATOM 0 HD13 ILE A 35 8.463 12.880 3.697 1.00 0.00 H new ATOM 561 N LYS A 36 9.130 8.492 3.321 1.00 0.00 N ATOM 562 CA LYS A 36 9.378 7.057 3.382 1.00 0.00 C ATOM 563 C LYS A 36 8.832 6.474 4.678 1.00 0.00 C ATOM 564 O LYS A 36 8.867 7.117 5.730 1.00 0.00 O ATOM 565 CB LYS A 36 10.871 6.754 3.276 1.00 0.00 C ATOM 566 CG LYS A 36 11.447 7.005 1.895 1.00 0.00 C ATOM 567 CD LYS A 36 12.876 6.501 1.786 1.00 0.00 C ATOM 568 CE LYS A 36 13.860 7.465 2.428 1.00 0.00 C ATOM 569 NZ LYS A 36 13.918 8.757 1.698 1.00 0.00 N ATOM 0 H LYS A 36 9.908 9.068 3.642 1.00 0.00 H new ATOM 0 HA LYS A 36 8.866 6.597 2.537 1.00 0.00 H new ATOM 0 HB2 LYS A 36 11.409 7.365 4.001 1.00 0.00 H new ATOM 0 HB3 LYS A 36 11.042 5.712 3.547 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.828 6.511 1.146 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.419 8.073 1.677 1.00 0.00 H new ATOM 0 HD2 LYS A 36 12.956 5.526 2.266 1.00 0.00 H new ATOM 0 HD3 LYS A 36 13.134 6.362 0.736 1.00 0.00 H new ATOM 0 HE2 LYS A 36 13.571 7.645 3.463 1.00 0.00 H new ATOM 0 HE3 LYS A 36 14.852 7.013 2.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 14.819 9.233 1.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 13.846 8.581 0.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 13.129 9.363 2.001 1.00 0.00 H new ATOM 583 N GLY A 37 8.353 5.249 4.596 1.00 0.00 N ATOM 584 CA GLY A 37 7.795 4.586 5.748 1.00 0.00 C ATOM 585 C GLY A 37 8.081 3.106 5.721 1.00 0.00 C ATOM 586 O GLY A 37 8.666 2.607 4.761 1.00 0.00 O ATOM 0 H GLY A 37 8.341 4.695 3.740 1.00 0.00 H new ATOM 0 HA2 GLY A 37 8.209 5.022 6.657 1.00 0.00 H new ATOM 0 HA3 GLY A 37 6.718 4.750 5.778 1.00 0.00 H new ATOM 590 N VAL A 38 7.657 2.396 6.750 1.00 0.00 N ATOM 591 CA VAL A 38 7.956 0.978 6.865 1.00 0.00 C ATOM 592 C VAL A 38 6.661 0.194 6.969 1.00 0.00 C ATOM 593 O VAL A 38 5.684 0.690 7.523 1.00 0.00 O ATOM 594 CB VAL A 38 8.828 0.675 8.100 1.00 0.00 C ATOM 595 CG1 VAL A 38 9.449 -0.703 7.985 1.00 0.00 C ATOM 596 CG2 VAL A 38 9.895 1.729 8.285 1.00 0.00 C ATOM 0 H VAL A 38 7.105 2.776 7.519 1.00 0.00 H new ATOM 0 HA VAL A 38 8.512 0.683 5.975 1.00 0.00 H new ATOM 0 HB VAL A 38 8.186 0.693 8.981 1.00 0.00 H new ATOM 0 HG11 VAL A 38 10.061 -0.901 8.865 1.00 0.00 H new ATOM 0 HG12 VAL A 38 8.661 -1.453 7.915 1.00 0.00 H new ATOM 0 HG13 VAL A 38 10.072 -0.748 7.092 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.495 1.490 9.163 1.00 0.00 H new ATOM 0 HG22 VAL A 38 10.536 1.756 7.404 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.425 2.703 8.421 1.00 0.00 H new ATOM 606 N SER A 39 6.639 -1.001 6.409 1.00 0.00 N ATOM 607 CA SER A 39 5.470 -1.856 6.519 1.00 0.00 C ATOM 608 C SER A 39 5.839 -3.266 6.988 1.00 0.00 C ATOM 609 O SER A 39 6.575 -3.977 6.322 1.00 0.00 O ATOM 610 CB SER A 39 4.720 -1.900 5.183 1.00 0.00 C ATOM 611 OG SER A 39 5.602 -2.074 4.086 1.00 0.00 O ATOM 0 H SER A 39 7.412 -1.401 5.876 1.00 0.00 H new ATOM 0 HA SER A 39 4.812 -1.429 7.276 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.996 -2.715 5.200 1.00 0.00 H new ATOM 0 HB3 SER A 39 4.156 -0.976 5.053 1.00 0.00 H new ATOM 0 HG SER A 39 6.440 -2.473 4.400 1.00 0.00 H new ATOM 617 N GLU A 40 5.282 -3.670 8.122 1.00 0.00 N ATOM 618 CA GLU A 40 5.532 -4.980 8.698 1.00 0.00 C ATOM 619 C GLU A 40 4.282 -5.840 8.589 1.00 0.00 C ATOM 620 O GLU A 40 3.227 -5.478 9.088 1.00 0.00 O ATOM 621 CB GLU A 40 5.916 -4.862 10.168 1.00 0.00 C ATOM 622 CG GLU A 40 7.082 -3.966 10.472 1.00 0.00 C ATOM 623 CD GLU A 40 6.686 -2.515 10.651 1.00 0.00 C ATOM 624 OE1 GLU A 40 6.012 -2.208 11.658 1.00 0.00 O ATOM 625 OE2 GLU A 40 7.048 -1.682 9.802 1.00 0.00 O ATOM 0 H GLU A 40 4.642 -3.094 8.669 1.00 0.00 H new ATOM 0 HA GLU A 40 6.354 -5.438 8.148 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.050 -4.499 10.722 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.141 -5.859 10.546 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.575 -4.316 11.379 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.810 -4.041 9.664 1.00 0.00 H new ATOM 632 N ILE A 41 4.412 -6.988 7.977 1.00 0.00 N ATOM 633 CA ILE A 41 3.261 -7.780 7.594 1.00 0.00 C ATOM 634 C ILE A 41 3.301 -9.191 8.181 1.00 0.00 C ATOM 635 O ILE A 41 4.356 -9.793 8.310 1.00 0.00 O ATOM 636 CB ILE A 41 3.157 -7.835 6.069 1.00 0.00 C ATOM 637 CG1 ILE A 41 3.038 -6.413 5.519 1.00 0.00 C ATOM 638 CG2 ILE A 41 1.964 -8.670 5.651 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.220 -6.320 4.025 1.00 0.00 C ATOM 0 H ILE A 41 5.310 -7.403 7.729 1.00 0.00 H new ATOM 0 HA ILE A 41 2.375 -7.295 8.004 1.00 0.00 H new ATOM 0 HB ILE A 41 4.054 -8.302 5.662 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.059 -6.013 5.782 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.781 -5.782 6.006 1.00 0.00 H new ATOM 0 HG21 ILE A 41 1.904 -8.699 4.563 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.077 -9.684 6.036 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.052 -8.229 6.053 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.122 -5.281 3.710 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.210 -6.689 3.755 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.460 -6.923 3.528 1.00 0.00 H new ATOM 651 N VAL A 42 2.152 -9.674 8.608 1.00 0.00 N ATOM 652 CA VAL A 42 2.006 -11.039 9.064 1.00 0.00 C ATOM 653 C VAL A 42 1.174 -11.789 8.043 1.00 0.00 C ATOM 654 O VAL A 42 0.003 -11.459 7.847 1.00 0.00 O ATOM 655 CB VAL A 42 1.325 -11.112 10.446 1.00 0.00 C ATOM 656 CG1 VAL A 42 1.110 -12.556 10.878 1.00 0.00 C ATOM 657 CG2 VAL A 42 2.157 -10.370 11.471 1.00 0.00 C ATOM 0 H VAL A 42 1.291 -9.128 8.648 1.00 0.00 H new ATOM 0 HA VAL A 42 2.995 -11.485 9.167 1.00 0.00 H new ATOM 0 HB VAL A 42 0.346 -10.638 10.372 1.00 0.00 H new ATOM 0 HG11 VAL A 42 0.628 -12.575 11.856 1.00 0.00 H new ATOM 0 HG12 VAL A 42 0.476 -13.063 10.151 1.00 0.00 H new ATOM 0 HG13 VAL A 42 2.072 -13.065 10.937 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.670 -10.426 12.444 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.146 -10.823 11.534 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.255 -9.326 11.174 1.00 0.00 H new ATOM 667 N HIS A 43 1.753 -12.766 7.367 1.00 0.00 N ATOM 668 CA HIS A 43 1.001 -13.471 6.355 1.00 0.00 C ATOM 669 C HIS A 43 0.584 -14.855 6.838 1.00 0.00 C ATOM 670 O HIS A 43 1.408 -15.740 7.068 1.00 0.00 O ATOM 671 CB HIS A 43 1.734 -13.573 4.999 1.00 0.00 C ATOM 672 CG HIS A 43 0.938 -14.380 4.029 1.00 0.00 C ATOM 673 ND1 HIS A 43 1.359 -15.575 3.493 1.00 0.00 N ATOM 674 CD2 HIS A 43 -0.310 -14.174 3.561 1.00 0.00 C ATOM 675 CE1 HIS A 43 0.398 -16.074 2.737 1.00 0.00 C ATOM 676 NE2 HIS A 43 -0.629 -15.242 2.760 1.00 0.00 N ATOM 0 H HIS A 43 2.715 -13.080 7.497 1.00 0.00 H new ATOM 0 HA HIS A 43 0.108 -12.870 6.182 1.00 0.00 H new ATOM 0 HB2 HIS A 43 1.904 -12.575 4.596 1.00 0.00 H new ATOM 0 HB3 HIS A 43 2.713 -14.030 5.143 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -0.942 -13.325 3.777 1.00 0.00 H new ATOM 0 HE1 HIS A 43 0.443 -17.005 2.192 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -1.511 -15.372 2.265 1.00 0.00 H new ATOM 685 N GLU A 44 -0.714 -14.998 6.975 1.00 0.00 N ATOM 686 CA GLU A 44 -1.372 -16.267 7.214 1.00 0.00 C ATOM 687 C GLU A 44 -2.378 -16.426 6.088 1.00 0.00 C ATOM 688 O GLU A 44 -2.877 -15.416 5.602 1.00 0.00 O ATOM 689 CB GLU A 44 -2.068 -16.264 8.577 1.00 0.00 C ATOM 690 CG GLU A 44 -2.099 -17.611 9.277 1.00 0.00 C ATOM 691 CD GLU A 44 -2.829 -18.691 8.498 1.00 0.00 C ATOM 692 OE1 GLU A 44 -2.203 -19.334 7.630 1.00 0.00 O ATOM 693 OE2 GLU A 44 -4.032 -18.915 8.763 1.00 0.00 O ATOM 0 H GLU A 44 -1.363 -14.213 6.922 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.662 -17.094 7.231 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.566 -15.545 9.224 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -3.092 -15.914 8.446 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.076 -17.938 9.461 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.576 -17.493 10.250 1.00 0.00 H new ATOM 700 N GLY A 45 -2.578 -17.650 5.605 1.00 0.00 N ATOM 701 CA GLY A 45 -3.527 -17.899 4.527 1.00 0.00 C ATOM 702 C GLY A 45 -4.765 -17.019 4.622 1.00 0.00 C ATOM 703 O GLY A 45 -5.600 -17.196 5.513 1.00 0.00 O ATOM 0 H GLY A 45 -2.096 -18.483 5.944 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.036 -17.727 3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.828 -18.946 4.548 1.00 0.00 H new ATOM 707 N LYS A 46 -4.836 -16.050 3.705 1.00 0.00 N ATOM 708 CA LYS A 46 -5.904 -15.042 3.624 1.00 0.00 C ATOM 709 C LYS A 46 -5.761 -13.932 4.667 1.00 0.00 C ATOM 710 O LYS A 46 -6.055 -12.774 4.390 1.00 0.00 O ATOM 711 CB LYS A 46 -7.300 -15.643 3.704 1.00 0.00 C ATOM 712 CG LYS A 46 -7.461 -16.920 2.910 1.00 0.00 C ATOM 713 CD LYS A 46 -8.879 -17.438 2.963 1.00 0.00 C ATOM 714 CE LYS A 46 -9.128 -18.086 4.302 1.00 0.00 C ATOM 715 NZ LYS A 46 -8.641 -19.490 4.350 1.00 0.00 N ATOM 0 H LYS A 46 -4.132 -15.940 2.975 1.00 0.00 H new ATOM 0 HA LYS A 46 -5.782 -14.598 2.636 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -7.540 -15.843 4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -8.022 -14.910 3.345 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -7.178 -16.741 1.873 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -6.782 -17.678 3.300 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.582 -16.620 2.806 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -9.044 -18.158 2.162 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -8.634 -17.506 5.081 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -10.196 -18.067 4.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -8.834 -19.893 5.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -9.131 -20.052 3.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.617 -19.509 4.170 1.00 0.00 H new ATOM 729 N LYS A 47 -5.291 -14.275 5.847 1.00 0.00 N ATOM 730 CA LYS A 47 -5.261 -13.339 6.964 1.00 0.00 C ATOM 731 C LYS A 47 -3.946 -12.567 7.001 1.00 0.00 C ATOM 732 O LYS A 47 -2.887 -13.125 7.296 1.00 0.00 O ATOM 733 CB LYS A 47 -5.457 -14.130 8.248 1.00 0.00 C ATOM 734 CG LYS A 47 -6.604 -15.098 8.137 1.00 0.00 C ATOM 735 CD LYS A 47 -6.296 -16.369 8.869 1.00 0.00 C ATOM 736 CE LYS A 47 -7.175 -17.493 8.362 1.00 0.00 C ATOM 737 NZ LYS A 47 -6.709 -18.817 8.850 1.00 0.00 N ATOM 0 H LYS A 47 -4.921 -15.200 6.064 1.00 0.00 H new ATOM 0 HA LYS A 47 -6.058 -12.605 6.850 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -4.543 -14.675 8.483 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -5.640 -13.443 9.074 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -7.508 -14.647 8.546 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -6.803 -15.316 7.088 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.246 -16.630 8.734 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.454 -16.228 9.938 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -8.202 -17.326 8.686 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -7.180 -17.488 7.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -6.965 -19.551 8.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -5.676 -18.799 8.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.159 -19.028 9.763 1.00 0.00 H new ATOM 751 N VAL A 48 -4.019 -11.281 6.685 1.00 0.00 N ATOM 752 CA VAL A 48 -2.838 -10.441 6.621 1.00 0.00 C ATOM 753 C VAL A 48 -2.950 -9.237 7.548 1.00 0.00 C ATOM 754 O VAL A 48 -3.944 -8.508 7.535 1.00 0.00 O ATOM 755 CB VAL A 48 -2.582 -9.942 5.185 1.00 0.00 C ATOM 756 CG1 VAL A 48 -1.447 -8.943 5.148 1.00 0.00 C ATOM 757 CG2 VAL A 48 -2.314 -11.109 4.251 1.00 0.00 C ATOM 0 H VAL A 48 -4.891 -10.798 6.468 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.002 -11.061 6.944 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.481 -9.432 4.840 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.290 -8.609 4.122 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.696 -8.086 5.775 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.537 -9.413 5.520 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -2.136 -10.735 3.243 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.436 -11.656 4.595 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.177 -11.775 4.244 1.00 0.00 H new ATOM 767 N LYS A 49 -1.927 -9.052 8.362 1.00 0.00 N ATOM 768 CA LYS A 49 -1.784 -7.855 9.154 1.00 0.00 C ATOM 769 C LYS A 49 -0.636 -7.042 8.598 1.00 0.00 C ATOM 770 O LYS A 49 0.468 -7.551 8.431 1.00 0.00 O ATOM 771 CB LYS A 49 -1.492 -8.203 10.591 1.00 0.00 C ATOM 772 CG LYS A 49 -2.467 -9.185 11.202 1.00 0.00 C ATOM 773 CD LYS A 49 -1.962 -9.708 12.520 1.00 0.00 C ATOM 774 CE LYS A 49 -1.719 -8.560 13.456 1.00 0.00 C ATOM 775 NZ LYS A 49 -1.010 -8.971 14.695 1.00 0.00 N ATOM 0 H LYS A 49 -1.175 -9.729 8.489 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.713 -7.286 9.114 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.487 -8.619 10.655 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.497 -7.288 11.183 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -3.432 -8.700 11.346 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -2.627 -10.016 10.516 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.689 -10.396 12.953 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.040 -10.270 12.371 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.134 -7.796 12.944 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -2.673 -8.105 13.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.868 -8.141 15.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.578 -9.680 15.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.087 -9.380 14.447 1.00 0.00 H new ATOM 789 N LEU A 50 -0.902 -5.798 8.311 1.00 0.00 N ATOM 790 CA LEU A 50 0.093 -4.911 7.733 1.00 0.00 C ATOM 791 C LEU A 50 0.335 -3.754 8.672 1.00 0.00 C ATOM 792 O LEU A 50 -0.588 -3.029 9.008 1.00 0.00 O ATOM 793 CB LEU A 50 -0.404 -4.405 6.375 1.00 0.00 C ATOM 794 CG LEU A 50 0.666 -4.007 5.363 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.034 -3.507 4.085 1.00 0.00 C ATOM 796 CD2 LEU A 50 1.574 -2.963 5.936 1.00 0.00 C ATOM 0 H LEU A 50 -1.811 -5.362 8.468 1.00 0.00 H new ATOM 0 HA LEU A 50 1.030 -5.448 7.586 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.024 -5.182 5.928 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.048 -3.543 6.547 1.00 0.00 H new ATOM 0 HG LEU A 50 1.258 -4.892 5.132 1.00 0.00 H new ATOM 0 HD11 LEU A 50 0.815 -3.229 3.377 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.584 -4.294 3.652 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.586 -2.637 4.302 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.330 -2.693 5.198 1.00 0.00 H new ATOM 0 HD22 LEU A 50 0.992 -2.080 6.199 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.062 -3.355 6.828 1.00 0.00 H new ATOM 808 N THR A 51 1.572 -3.570 9.087 1.00 0.00 N ATOM 809 CA THR A 51 1.886 -2.470 9.958 1.00 0.00 C ATOM 810 C THR A 51 2.674 -1.443 9.174 1.00 0.00 C ATOM 811 O THR A 51 3.680 -1.764 8.592 1.00 0.00 O ATOM 812 CB THR A 51 2.698 -2.945 11.179 1.00 0.00 C ATOM 813 OG1 THR A 51 2.166 -4.195 11.642 1.00 0.00 O ATOM 814 CG2 THR A 51 2.630 -1.920 12.300 1.00 0.00 C ATOM 0 H THR A 51 2.363 -4.163 8.836 1.00 0.00 H new ATOM 0 HA THR A 51 0.960 -2.029 10.328 1.00 0.00 H new ATOM 0 HB THR A 51 3.740 -3.068 10.883 1.00 0.00 H new ATOM 0 HG1 THR A 51 2.449 -4.914 11.039 1.00 0.00 H new ATOM 0 HG21 THR A 51 3.209 -2.274 13.153 1.00 0.00 H new ATOM 0 HG22 THR A 51 3.040 -0.972 11.951 1.00 0.00 H new ATOM 0 HG23 THR A 51 1.592 -1.778 12.601 1.00 0.00 H new ATOM 822 N ILE A 52 2.216 -0.222 9.156 1.00 0.00 N ATOM 823 CA ILE A 52 2.770 0.775 8.272 1.00 0.00 C ATOM 824 C ILE A 52 3.083 2.042 9.046 1.00 0.00 C ATOM 825 O ILE A 52 2.232 2.610 9.713 1.00 0.00 O ATOM 826 CB ILE A 52 1.753 1.018 7.143 1.00 0.00 C ATOM 827 CG1 ILE A 52 2.113 0.225 5.898 1.00 0.00 C ATOM 828 CG2 ILE A 52 1.605 2.487 6.818 1.00 0.00 C ATOM 829 CD1 ILE A 52 1.183 0.510 4.748 1.00 0.00 C ATOM 0 H ILE A 52 1.455 0.112 9.747 1.00 0.00 H new ATOM 0 HA ILE A 52 3.710 0.436 7.836 1.00 0.00 H new ATOM 0 HB ILE A 52 0.787 0.666 7.506 1.00 0.00 H new ATOM 0 HG12 ILE A 52 3.135 0.462 5.603 1.00 0.00 H new ATOM 0 HG13 ILE A 52 2.086 -0.840 6.128 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.877 2.611 6.016 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.263 3.023 7.704 1.00 0.00 H new ATOM 0 HG23 ILE A 52 2.567 2.888 6.500 1.00 0.00 H new ATOM 0 HD11 ILE A 52 1.483 -0.081 3.883 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.164 0.248 5.031 1.00 0.00 H new ATOM 0 HD13 ILE A 52 1.229 1.570 4.497 1.00 0.00 H new ATOM 841 N THR A 53 4.324 2.446 8.989 1.00 0.00 N ATOM 842 CA THR A 53 4.765 3.642 9.643 1.00 0.00 C ATOM 843 C THR A 53 4.946 4.742 8.606 1.00 0.00 C ATOM 844 O THR A 53 5.589 4.529 7.582 1.00 0.00 O ATOM 845 CB THR A 53 6.101 3.367 10.344 1.00 0.00 C ATOM 846 OG1 THR A 53 6.025 2.141 11.083 1.00 0.00 O ATOM 847 CG2 THR A 53 6.450 4.494 11.264 1.00 0.00 C ATOM 0 H THR A 53 5.059 1.950 8.484 1.00 0.00 H new ATOM 0 HA THR A 53 4.026 3.958 10.380 1.00 0.00 H new ATOM 0 HB THR A 53 6.879 3.280 9.586 1.00 0.00 H new ATOM 0 HG1 THR A 53 6.883 1.972 11.526 1.00 0.00 H new ATOM 0 HG21 THR A 53 7.401 4.283 11.753 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.534 5.418 10.692 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.670 4.603 12.018 1.00 0.00 H new ATOM 855 N TYR A 54 4.371 5.903 8.859 1.00 0.00 N ATOM 856 CA TYR A 54 4.515 7.030 7.961 1.00 0.00 C ATOM 857 C TYR A 54 5.242 8.163 8.665 1.00 0.00 C ATOM 858 O TYR A 54 4.676 8.826 9.536 1.00 0.00 O ATOM 859 CB TYR A 54 3.134 7.498 7.476 1.00 0.00 C ATOM 860 CG TYR A 54 3.144 8.842 6.778 1.00 0.00 C ATOM 861 CD1 TYR A 54 3.426 8.949 5.421 1.00 0.00 C ATOM 862 CD2 TYR A 54 2.874 10.008 7.485 1.00 0.00 C ATOM 863 CE1 TYR A 54 3.436 10.181 4.794 1.00 0.00 C ATOM 864 CE2 TYR A 54 2.884 11.239 6.865 1.00 0.00 C ATOM 865 CZ TYR A 54 3.165 11.322 5.521 1.00 0.00 C ATOM 866 OH TYR A 54 3.174 12.550 4.901 1.00 0.00 O ATOM 0 H TYR A 54 3.798 6.089 9.682 1.00 0.00 H new ATOM 0 HA TYR A 54 5.101 6.723 7.095 1.00 0.00 H new ATOM 0 HB2 TYR A 54 2.728 6.750 6.795 1.00 0.00 H new ATOM 0 HB3 TYR A 54 2.460 7.550 8.331 1.00 0.00 H new ATOM 0 HD1 TYR A 54 3.640 8.058 4.849 1.00 0.00 H new ATOM 0 HD2 TYR A 54 2.652 9.948 8.540 1.00 0.00 H new ATOM 0 HE1 TYR A 54 3.655 10.250 3.739 1.00 0.00 H new ATOM 0 HE2 TYR A 54 2.672 12.134 7.432 1.00 0.00 H new ATOM 0 HH TYR A 54 2.962 13.248 5.555 1.00 0.00 H new ATOM 876 N GLY A 55 6.504 8.353 8.293 1.00 0.00 N ATOM 877 CA GLY A 55 7.295 9.480 8.765 1.00 0.00 C ATOM 878 C GLY A 55 7.566 9.502 10.268 1.00 0.00 C ATOM 879 O GLY A 55 8.484 10.188 10.717 1.00 0.00 O ATOM 0 H GLY A 55 7.004 7.731 7.658 1.00 0.00 H new ATOM 0 HA2 GLY A 55 8.250 9.478 8.240 1.00 0.00 H new ATOM 0 HA3 GLY A 55 6.783 10.402 8.491 1.00 0.00 H new ATOM 883 N SER A 56 6.794 8.740 11.036 1.00 0.00 N ATOM 884 CA SER A 56 6.797 8.834 12.493 1.00 0.00 C ATOM 885 C SER A 56 5.681 7.973 13.062 1.00 0.00 C ATOM 886 O SER A 56 5.868 7.195 13.996 1.00 0.00 O ATOM 887 CB SER A 56 6.542 10.286 12.914 1.00 0.00 C ATOM 888 OG SER A 56 6.728 10.472 14.306 1.00 0.00 O ATOM 0 H SER A 56 6.149 8.041 10.667 1.00 0.00 H new ATOM 0 HA SER A 56 7.763 8.495 12.867 1.00 0.00 H new ATOM 0 HB2 SER A 56 7.214 10.946 12.366 1.00 0.00 H new ATOM 0 HB3 SER A 56 5.525 10.570 12.642 1.00 0.00 H new ATOM 0 HG SER A 56 6.558 11.409 14.536 1.00 0.00 H new ATOM 894 N LYS A 57 4.522 8.110 12.450 1.00 0.00 N ATOM 895 CA LYS A 57 3.290 7.565 12.971 1.00 0.00 C ATOM 896 C LYS A 57 2.957 6.234 12.308 1.00 0.00 C ATOM 897 O LYS A 57 3.024 6.108 11.090 1.00 0.00 O ATOM 898 CB LYS A 57 2.193 8.595 12.720 1.00 0.00 C ATOM 899 CG LYS A 57 0.776 8.084 12.909 1.00 0.00 C ATOM 900 CD LYS A 57 0.378 8.069 14.360 1.00 0.00 C ATOM 901 CE LYS A 57 0.519 9.435 14.986 1.00 0.00 C ATOM 902 NZ LYS A 57 -0.239 9.554 16.258 1.00 0.00 N ATOM 0 H LYS A 57 4.411 8.609 11.567 1.00 0.00 H new ATOM 0 HA LYS A 57 3.384 7.366 14.039 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.350 9.441 13.389 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.295 8.971 11.702 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.085 8.713 12.349 1.00 0.00 H new ATOM 0 HG3 LYS A 57 0.695 7.077 12.499 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -0.654 7.730 14.452 1.00 0.00 H new ATOM 0 HD3 LYS A 57 0.998 7.354 14.901 1.00 0.00 H new ATOM 0 HE2 LYS A 57 1.573 9.639 15.174 1.00 0.00 H new ATOM 0 HE3 LYS A 57 0.168 10.192 14.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -0.112 10.509 16.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -1.249 9.386 16.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 0.112 8.851 16.939 1.00 0.00 H new ATOM 916 N VAL A 58 2.601 5.243 13.112 1.00 0.00 N ATOM 917 CA VAL A 58 2.292 3.922 12.603 1.00 0.00 C ATOM 918 C VAL A 58 0.797 3.726 12.495 1.00 0.00 C ATOM 919 O VAL A 58 0.052 3.890 13.465 1.00 0.00 O ATOM 920 CB VAL A 58 2.888 2.826 13.504 1.00 0.00 C ATOM 921 CG1 VAL A 58 2.731 1.455 12.865 1.00 0.00 C ATOM 922 CG2 VAL A 58 4.352 3.112 13.785 1.00 0.00 C ATOM 0 H VAL A 58 2.520 5.333 14.125 1.00 0.00 H new ATOM 0 HA VAL A 58 2.737 3.842 11.611 1.00 0.00 H new ATOM 0 HB VAL A 58 2.343 2.827 14.448 1.00 0.00 H new ATOM 0 HG11 VAL A 58 3.160 0.697 13.520 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.673 1.245 12.710 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.248 1.439 11.905 1.00 0.00 H new ATOM 0 HG21 VAL A 58 4.760 2.328 14.423 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.904 3.139 12.846 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.445 4.075 14.288 1.00 0.00 H new ATOM 932 N ILE A 59 0.387 3.375 11.298 1.00 0.00 N ATOM 933 CA ILE A 59 -0.970 3.084 10.972 1.00 0.00 C ATOM 934 C ILE A 59 -0.994 1.700 10.310 1.00 0.00 C ATOM 935 O ILE A 59 -0.387 1.474 9.265 1.00 0.00 O ATOM 936 CB ILE A 59 -1.525 4.213 10.071 1.00 0.00 C ATOM 937 CG1 ILE A 59 -2.472 5.113 10.867 1.00 0.00 C ATOM 938 CG2 ILE A 59 -2.189 3.648 8.852 1.00 0.00 C ATOM 939 CD1 ILE A 59 -2.960 6.320 10.098 1.00 0.00 C ATOM 0 H ILE A 59 1.020 3.284 10.504 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.616 3.049 11.850 1.00 0.00 H new ATOM 0 HB ILE A 59 -0.692 4.827 9.728 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -3.333 4.526 11.187 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -1.963 5.451 11.770 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -2.571 4.462 8.235 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -1.465 3.067 8.280 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.015 3.003 9.153 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -3.626 6.908 10.729 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -2.108 6.931 9.801 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -3.498 5.992 9.209 1.00 0.00 H new ATOM 951 N HIS A 60 -1.625 0.758 10.976 1.00 0.00 N ATOM 952 CA HIS A 60 -1.606 -0.637 10.545 1.00 0.00 C ATOM 953 C HIS A 60 -2.992 -1.158 10.167 1.00 0.00 C ATOM 954 O HIS A 60 -4.010 -0.722 10.704 1.00 0.00 O ATOM 955 CB HIS A 60 -0.971 -1.529 11.606 1.00 0.00 C ATOM 956 CG HIS A 60 -1.640 -1.492 12.950 1.00 0.00 C ATOM 957 ND1 HIS A 60 -3.004 -1.396 13.107 1.00 0.00 N ATOM 958 CD2 HIS A 60 -1.123 -1.546 14.197 1.00 0.00 C ATOM 959 CE1 HIS A 60 -3.298 -1.393 14.393 1.00 0.00 C ATOM 960 NE2 HIS A 60 -2.175 -1.485 15.077 1.00 0.00 N ATOM 0 H HIS A 60 -2.164 0.927 11.826 1.00 0.00 H new ATOM 0 HA HIS A 60 -0.995 -0.673 9.643 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -0.974 -2.557 11.244 1.00 0.00 H new ATOM 0 HB3 HIS A 60 0.072 -1.237 11.728 1.00 0.00 H new ATOM 0 HD1 HIS A 60 -3.682 -1.336 12.347 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -0.077 -1.623 14.454 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -4.290 -1.326 14.814 1.00 0.00 H new ATOM 969 N ASN A 61 -3.010 -2.091 9.226 1.00 0.00 N ATOM 970 CA ASN A 61 -4.248 -2.569 8.620 1.00 0.00 C ATOM 971 C ASN A 61 -4.351 -4.080 8.766 1.00 0.00 C ATOM 972 O ASN A 61 -3.469 -4.810 8.311 1.00 0.00 O ATOM 973 CB ASN A 61 -4.291 -2.234 7.118 1.00 0.00 C ATOM 974 CG ASN A 61 -4.147 -0.755 6.777 1.00 0.00 C ATOM 975 OD1 ASN A 61 -4.699 -0.290 5.784 1.00 0.00 O ATOM 976 ND2 ASN A 61 -3.406 -0.009 7.580 1.00 0.00 N ATOM 0 H ASN A 61 -2.169 -2.538 8.860 1.00 0.00 H new ATOM 0 HA ASN A 61 -5.076 -2.077 9.130 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -3.495 -2.785 6.617 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -5.235 -2.594 6.709 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -3.280 0.984 7.382 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -2.961 -0.426 8.397 1.00 0.00 H new ATOM 983 N GLU A 62 -5.407 -4.552 9.410 1.00 0.00 N ATOM 984 CA GLU A 62 -5.685 -5.969 9.459 1.00 0.00 C ATOM 985 C GLU A 62 -6.812 -6.315 8.508 1.00 0.00 C ATOM 986 O GLU A 62 -7.896 -5.727 8.561 1.00 0.00 O ATOM 987 CB GLU A 62 -6.057 -6.389 10.874 1.00 0.00 C ATOM 988 CG GLU A 62 -4.901 -6.321 11.848 1.00 0.00 C ATOM 989 CD GLU A 62 -4.457 -4.908 12.186 1.00 0.00 C ATOM 990 OE1 GLU A 62 -5.332 -4.047 12.427 1.00 0.00 O ATOM 991 OE2 GLU A 62 -3.235 -4.666 12.259 1.00 0.00 O ATOM 0 H GLU A 62 -6.083 -3.970 9.905 1.00 0.00 H new ATOM 0 HA GLU A 62 -4.786 -6.507 9.157 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.863 -5.750 11.234 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.444 -7.408 10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.185 -6.831 12.768 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.055 -6.866 11.430 1.00 0.00 H new ATOM 998 N PHE A 63 -6.552 -7.269 7.638 1.00 0.00 N ATOM 999 CA PHE A 63 -7.529 -7.659 6.630 1.00 0.00 C ATOM 1000 C PHE A 63 -7.386 -9.118 6.221 1.00 0.00 C ATOM 1001 O PHE A 63 -6.308 -9.703 6.312 1.00 0.00 O ATOM 1002 CB PHE A 63 -7.424 -6.753 5.396 1.00 0.00 C ATOM 1003 CG PHE A 63 -6.067 -6.710 4.758 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -5.723 -7.604 3.756 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -5.139 -5.763 5.150 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -4.479 -7.551 3.159 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -3.896 -5.708 4.561 1.00 0.00 C ATOM 1008 CZ PHE A 63 -3.564 -6.601 3.563 1.00 0.00 C ATOM 0 H PHE A 63 -5.676 -7.790 7.604 1.00 0.00 H new ATOM 0 HA PHE A 63 -8.514 -7.540 7.081 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -8.148 -7.089 4.654 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -7.707 -5.740 5.682 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -6.436 -8.350 3.439 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -5.392 -5.058 5.928 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -4.223 -8.251 2.378 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -3.180 -4.965 4.880 1.00 0.00 H new ATOM 0 HZ PHE A 63 -2.590 -6.556 3.099 1.00 0.00 H new ATOM 1018 N THR A 64 -8.494 -9.701 5.795 1.00 0.00 N ATOM 1019 CA THR A 64 -8.496 -11.019 5.202 1.00 0.00 C ATOM 1020 C THR A 64 -8.701 -10.868 3.706 1.00 0.00 C ATOM 1021 O THR A 64 -9.563 -10.102 3.278 1.00 0.00 O ATOM 1022 CB THR A 64 -9.625 -11.889 5.782 1.00 0.00 C ATOM 1023 OG1 THR A 64 -9.768 -11.598 7.182 1.00 0.00 O ATOM 1024 CG2 THR A 64 -9.303 -13.366 5.616 1.00 0.00 C ATOM 0 H THR A 64 -9.416 -9.270 5.853 1.00 0.00 H new ATOM 0 HA THR A 64 -7.546 -11.507 5.419 1.00 0.00 H new ATOM 0 HB THR A 64 -10.549 -11.667 5.249 1.00 0.00 H new ATOM 0 HG1 THR A 64 -10.487 -12.147 7.559 1.00 0.00 H new ATOM 0 HG21 THR A 64 -10.114 -13.964 6.032 1.00 0.00 H new ATOM 0 HG22 THR A 64 -9.189 -13.597 4.557 1.00 0.00 H new ATOM 0 HG23 THR A 64 -8.375 -13.597 6.140 1.00 0.00 H new ATOM 1032 N LEU A 65 -7.887 -11.532 2.909 1.00 0.00 N ATOM 1033 CA LEU A 65 -8.053 -11.458 1.478 1.00 0.00 C ATOM 1034 C LEU A 65 -9.268 -12.234 1.022 1.00 0.00 C ATOM 1035 O LEU A 65 -9.847 -13.027 1.765 1.00 0.00 O ATOM 1036 CB LEU A 65 -6.817 -11.942 0.745 1.00 0.00 C ATOM 1037 CG LEU A 65 -6.326 -13.320 1.115 1.00 0.00 C ATOM 1038 CD1 LEU A 65 -6.850 -14.315 0.116 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -4.823 -13.294 1.141 1.00 0.00 C ATOM 0 H LEU A 65 -7.116 -12.120 3.225 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.204 -10.407 1.232 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -7.024 -11.927 -0.325 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -6.011 -11.230 0.924 1.00 0.00 H new ATOM 0 HG LEU A 65 -6.686 -13.617 2.100 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.499 -15.313 0.378 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.940 -14.300 0.125 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.492 -14.054 -0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -4.447 -14.282 1.407 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -4.447 -13.015 0.157 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -4.484 -12.566 1.878 1.00 0.00 H new ATOM 1051 N GLY A 66 -9.609 -12.013 -0.229 1.00 0.00 N ATOM 1052 CA GLY A 66 -10.884 -12.438 -0.760 1.00 0.00 C ATOM 1053 C GLY A 66 -12.034 -11.732 -0.069 1.00 0.00 C ATOM 1054 O GLY A 66 -13.196 -12.088 -0.256 1.00 0.00 O ATOM 0 H GLY A 66 -9.012 -11.535 -0.904 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -10.920 -12.234 -1.830 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -10.990 -13.516 -0.637 1.00 0.00 H new ATOM 1058 N GLU A 67 -11.701 -10.708 0.708 1.00 0.00 N ATOM 1059 CA GLU A 67 -12.678 -10.007 1.525 1.00 0.00 C ATOM 1060 C GLU A 67 -12.464 -8.514 1.394 1.00 0.00 C ATOM 1061 O GLU A 67 -11.326 -8.057 1.269 1.00 0.00 O ATOM 1062 CB GLU A 67 -12.550 -10.388 3.008 1.00 0.00 C ATOM 1063 CG GLU A 67 -12.594 -11.876 3.293 1.00 0.00 C ATOM 1064 CD GLU A 67 -12.877 -12.180 4.748 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -12.657 -11.301 5.604 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -13.342 -13.302 5.046 1.00 0.00 O ATOM 0 H GLU A 67 -10.752 -10.344 0.788 1.00 0.00 H new ATOM 0 HA GLU A 67 -13.670 -10.290 1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -11.611 -9.988 3.391 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.353 -9.903 3.563 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -13.362 -12.339 2.673 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -11.642 -12.325 3.010 1.00 0.00 H new ATOM 1073 N GLU A 68 -13.543 -7.755 1.394 1.00 0.00 N ATOM 1074 CA GLU A 68 -13.434 -6.315 1.500 1.00 0.00 C ATOM 1075 C GLU A 68 -13.299 -5.940 2.965 1.00 0.00 C ATOM 1076 O GLU A 68 -14.191 -6.196 3.778 1.00 0.00 O ATOM 1077 CB GLU A 68 -14.631 -5.634 0.830 1.00 0.00 C ATOM 1078 CG GLU A 68 -15.001 -4.258 1.363 1.00 0.00 C ATOM 1079 CD GLU A 68 -16.261 -3.727 0.709 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -17.365 -3.986 1.238 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -16.155 -3.034 -0.323 1.00 0.00 O ATOM 0 H GLU A 68 -14.497 -8.109 1.322 1.00 0.00 H new ATOM 0 HA GLU A 68 -12.546 -5.965 0.975 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -14.423 -5.545 -0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -15.498 -6.286 0.932 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -15.145 -4.312 2.442 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -14.178 -3.565 1.186 1.00 0.00 H new ATOM 1088 N CYS A 69 -12.172 -5.354 3.286 1.00 0.00 N ATOM 1089 CA CYS A 69 -11.840 -5.021 4.659 1.00 0.00 C ATOM 1090 C CYS A 69 -11.335 -3.620 4.733 1.00 0.00 C ATOM 1091 O CYS A 69 -10.841 -3.065 3.753 1.00 0.00 O ATOM 1092 CB CYS A 69 -10.806 -5.996 5.222 1.00 0.00 C ATOM 1093 SG CYS A 69 -11.314 -7.734 5.189 1.00 0.00 S ATOM 0 H CYS A 69 -11.456 -5.093 2.608 1.00 0.00 H new ATOM 0 HA CYS A 69 -12.742 -5.104 5.265 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -9.880 -5.891 4.656 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -10.584 -5.715 6.252 1.00 0.00 H new ATOM 0 HG CYS A 69 -10.515 -8.405 4.413 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.447 -3.071 5.910 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.305 -1.673 6.090 1.00 0.00 C ATOM 1101 C GLU A 70 -9.890 -1.313 6.489 1.00 0.00 C ATOM 1102 O GLU A 70 -9.354 -1.741 7.514 1.00 0.00 O ATOM 1103 CB GLU A 70 -12.331 -1.218 7.097 1.00 0.00 C ATOM 1104 CG GLU A 70 -12.196 0.208 7.461 1.00 0.00 C ATOM 1105 CD GLU A 70 -12.993 0.572 8.694 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -14.229 0.698 8.591 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -12.388 0.711 9.779 1.00 0.00 O ATOM 0 H GLU A 70 -11.640 -3.590 6.766 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.485 -1.151 5.150 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.329 -1.390 6.693 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -12.242 -1.826 7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -11.144 0.437 7.632 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.525 0.825 6.625 1.00 0.00 H new ATOM 1114 N LEU A 71 -9.322 -0.518 5.630 1.00 0.00 N ATOM 1115 CA LEU A 71 -7.935 -0.150 5.650 1.00 0.00 C ATOM 1116 C LEU A 71 -7.759 1.251 6.211 1.00 0.00 C ATOM 1117 O LEU A 71 -8.608 2.120 6.016 1.00 0.00 O ATOM 1118 CB LEU A 71 -7.423 -0.198 4.210 1.00 0.00 C ATOM 1119 CG LEU A 71 -7.812 -1.456 3.438 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.400 -1.359 1.981 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.159 -2.635 4.091 1.00 0.00 C ATOM 0 H LEU A 71 -9.836 -0.088 4.861 1.00 0.00 H new ATOM 0 HA LEU A 71 -7.376 -0.837 6.285 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -7.802 0.673 3.675 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -6.336 -0.117 4.222 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.896 -1.570 3.459 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.691 -2.271 1.459 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.893 -0.503 1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.319 -1.233 1.916 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -7.426 -3.544 3.552 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.077 -2.508 4.073 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.498 -2.713 5.124 1.00 0.00 H new ATOM 1133 N GLU A 72 -6.666 1.457 6.912 1.00 0.00 N ATOM 1134 CA GLU A 72 -6.306 2.777 7.382 1.00 0.00 C ATOM 1135 C GLU A 72 -5.106 3.246 6.591 1.00 0.00 C ATOM 1136 O GLU A 72 -4.078 2.571 6.546 1.00 0.00 O ATOM 1137 CB GLU A 72 -5.993 2.751 8.874 1.00 0.00 C ATOM 1138 CG GLU A 72 -5.996 4.117 9.537 1.00 0.00 C ATOM 1139 CD GLU A 72 -6.144 4.019 11.043 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -5.145 3.739 11.736 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -7.277 4.196 11.537 1.00 0.00 O ATOM 0 H GLU A 72 -6.007 0.722 7.171 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.139 3.465 7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.723 2.115 9.375 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -5.016 2.291 9.020 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -5.069 4.638 9.297 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -6.812 4.715 9.131 1.00 0.00 H new ATOM 1148 N THR A 73 -5.240 4.385 5.961 1.00 0.00 N ATOM 1149 CA THR A 73 -4.221 4.844 5.044 1.00 0.00 C ATOM 1150 C THR A 73 -3.195 5.713 5.751 1.00 0.00 C ATOM 1151 O THR A 73 -3.418 6.131 6.886 1.00 0.00 O ATOM 1152 CB THR A 73 -4.832 5.612 3.861 1.00 0.00 C ATOM 1153 OG1 THR A 73 -5.768 6.583 4.341 1.00 0.00 O ATOM 1154 CG2 THR A 73 -5.521 4.656 2.906 1.00 0.00 C ATOM 0 H THR A 73 -6.039 5.011 6.063 1.00 0.00 H new ATOM 0 HA THR A 73 -3.719 3.958 4.656 1.00 0.00 H new ATOM 0 HB THR A 73 -4.031 6.121 3.325 1.00 0.00 H new ATOM 0 HG1 THR A 73 -6.605 6.137 4.588 1.00 0.00 H new ATOM 0 HG21 THR A 73 -5.948 5.217 2.075 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.796 3.937 2.525 1.00 0.00 H new ATOM 0 HG23 THR A 73 -6.315 4.126 3.432 1.00 0.00 H new ATOM 1162 N MET A 74 -2.083 5.991 5.081 1.00 0.00 N ATOM 1163 CA MET A 74 -1.018 6.800 5.662 1.00 0.00 C ATOM 1164 C MET A 74 -1.538 8.192 6.030 1.00 0.00 C ATOM 1165 O MET A 74 -1.041 8.827 6.960 1.00 0.00 O ATOM 1166 CB MET A 74 0.163 6.931 4.687 1.00 0.00 C ATOM 1167 CG MET A 74 0.728 5.604 4.199 1.00 0.00 C ATOM 1168 SD MET A 74 -0.358 4.778 3.014 1.00 0.00 S ATOM 1169 CE MET A 74 0.619 3.333 2.607 1.00 0.00 C ATOM 0 H MET A 74 -1.895 5.667 4.132 1.00 0.00 H new ATOM 0 HA MET A 74 -0.674 6.298 6.566 1.00 0.00 H new ATOM 0 HB2 MET A 74 -0.158 7.514 3.824 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.959 7.494 5.174 1.00 0.00 H new ATOM 0 HG2 MET A 74 1.700 5.776 3.737 1.00 0.00 H new ATOM 0 HG3 MET A 74 0.893 4.948 5.053 1.00 0.00 H new ATOM 0 HE1 MET A 74 0.864 3.347 1.545 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.539 3.339 3.192 1.00 0.00 H new ATOM 0 HE3 MET A 74 0.049 2.432 2.836 1.00 0.00 H new ATOM 1179 N THR A 75 -2.544 8.655 5.293 1.00 0.00 N ATOM 1180 CA THR A 75 -3.141 9.958 5.536 1.00 0.00 C ATOM 1181 C THR A 75 -4.150 9.901 6.681 1.00 0.00 C ATOM 1182 O THR A 75 -4.343 10.882 7.401 1.00 0.00 O ATOM 1183 CB THR A 75 -3.831 10.488 4.265 1.00 0.00 C ATOM 1184 OG1 THR A 75 -4.596 9.438 3.656 1.00 0.00 O ATOM 1185 CG2 THR A 75 -2.806 11.018 3.272 1.00 0.00 C ATOM 0 H THR A 75 -2.963 8.140 4.518 1.00 0.00 H new ATOM 0 HA THR A 75 -2.336 10.638 5.816 1.00 0.00 H new ATOM 0 HB THR A 75 -4.493 11.307 4.548 1.00 0.00 H new ATOM 0 HG1 THR A 75 -5.035 9.779 2.849 1.00 0.00 H new ATOM 0 HG21 THR A 75 -3.318 11.387 2.383 1.00 0.00 H new ATOM 0 HG22 THR A 75 -2.243 11.831 3.730 1.00 0.00 H new ATOM 0 HG23 THR A 75 -2.123 10.216 2.991 1.00 0.00 H new ATOM 1193 N GLY A 76 -4.795 8.750 6.844 1.00 0.00 N ATOM 1194 CA GLY A 76 -5.720 8.574 7.944 1.00 0.00 C ATOM 1195 C GLY A 76 -7.118 8.187 7.501 1.00 0.00 C ATOM 1196 O GLY A 76 -7.975 7.899 8.338 1.00 0.00 O ATOM 0 H GLY A 76 -4.693 7.939 6.234 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.334 7.806 8.614 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.772 9.500 8.517 1.00 0.00 H new ATOM 1200 N GLU A 77 -7.363 8.176 6.197 1.00 0.00 N ATOM 1201 CA GLU A 77 -8.687 7.831 5.685 1.00 0.00 C ATOM 1202 C GLU A 77 -8.898 6.322 5.708 1.00 0.00 C ATOM 1203 O GLU A 77 -7.978 5.552 5.424 1.00 0.00 O ATOM 1204 CB GLU A 77 -8.889 8.372 4.267 1.00 0.00 C ATOM 1205 CG GLU A 77 -10.269 8.072 3.696 1.00 0.00 C ATOM 1206 CD GLU A 77 -10.495 8.666 2.320 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -10.953 9.825 2.237 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -10.247 7.970 1.312 1.00 0.00 O ATOM 0 H GLU A 77 -6.673 8.399 5.480 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.426 8.297 6.337 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -8.733 9.451 4.272 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -8.131 7.943 3.611 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -10.405 6.992 3.644 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -11.027 8.456 4.378 1.00 0.00 H new ATOM 1215 N LYS A 78 -10.107 5.908 6.063 1.00 0.00 N ATOM 1216 CA LYS A 78 -10.451 4.509 6.113 1.00 0.00 C ATOM 1217 C LYS A 78 -11.123 4.083 4.820 1.00 0.00 C ATOM 1218 O LYS A 78 -12.078 4.717 4.363 1.00 0.00 O ATOM 1219 CB LYS A 78 -11.399 4.256 7.271 1.00 0.00 C ATOM 1220 CG LYS A 78 -11.043 4.995 8.538 1.00 0.00 C ATOM 1221 CD LYS A 78 -9.810 4.405 9.191 1.00 0.00 C ATOM 1222 CE LYS A 78 -10.109 3.031 9.775 1.00 0.00 C ATOM 1223 NZ LYS A 78 -8.931 2.430 10.451 1.00 0.00 N ATOM 0 H LYS A 78 -10.868 6.536 6.322 1.00 0.00 H new ATOM 0 HA LYS A 78 -9.537 3.932 6.249 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -12.407 4.541 6.969 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -11.420 3.187 7.481 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -10.869 6.047 8.311 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -11.881 4.953 9.234 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -9.008 4.326 8.457 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.457 5.070 9.979 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -10.929 3.114 10.488 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -10.445 2.367 8.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -9.232 1.980 11.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -8.501 1.716 9.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -8.234 3.173 10.659 1.00 0.00 H new ATOM 1237 N VAL A 79 -10.613 3.022 4.227 1.00 0.00 N ATOM 1238 CA VAL A 79 -11.172 2.496 2.992 1.00 0.00 C ATOM 1239 C VAL A 79 -11.271 0.988 3.051 1.00 0.00 C ATOM 1240 O VAL A 79 -10.362 0.325 3.506 1.00 0.00 O ATOM 1241 CB VAL A 79 -10.358 2.930 1.746 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -9.082 3.657 2.141 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -10.029 1.755 0.848 1.00 0.00 C ATOM 0 H VAL A 79 -9.809 2.503 4.580 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.172 2.917 2.892 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.991 3.618 1.185 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -8.536 3.947 1.243 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.334 4.548 2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -8.460 2.998 2.747 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.458 2.104 -0.013 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.439 1.026 1.404 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.953 1.289 0.506 1.00 0.00 H new ATOM 1253 N LYS A 80 -12.368 0.451 2.583 1.00 0.00 N ATOM 1254 CA LYS A 80 -12.511 -0.994 2.534 1.00 0.00 C ATOM 1255 C LYS A 80 -12.278 -1.480 1.115 1.00 0.00 C ATOM 1256 O LYS A 80 -12.903 -1.003 0.165 1.00 0.00 O ATOM 1257 CB LYS A 80 -13.867 -1.465 3.061 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.041 -0.813 2.380 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.363 -1.377 2.865 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.520 -0.841 2.055 1.00 0.00 C ATOM 1261 NZ LYS A 80 -18.730 -1.693 2.197 1.00 0.00 N ATOM 0 H LYS A 80 -13.169 0.977 2.233 1.00 0.00 H new ATOM 0 HA LYS A 80 -11.759 -1.428 3.193 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -13.940 -2.545 2.936 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.921 -1.263 4.131 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -15.016 0.261 2.563 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -14.960 -0.955 1.302 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.343 -2.465 2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -16.505 -1.125 3.916 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.750 0.175 2.377 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.235 -0.786 1.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.493 -1.314 1.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.508 -2.664 1.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -19.037 -1.698 3.191 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.355 -2.407 0.982 1.00 0.00 N ATOM 1276 CA ALA A 81 -10.952 -2.902 -0.315 1.00 0.00 C ATOM 1277 C ALA A 81 -10.999 -4.417 -0.342 1.00 0.00 C ATOM 1278 O ALA A 81 -10.731 -5.064 0.674 1.00 0.00 O ATOM 1279 CB ALA A 81 -9.548 -2.409 -0.629 1.00 0.00 C ATOM 0 H ALA A 81 -10.865 -2.837 1.766 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.642 -2.528 -1.072 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.242 -2.781 -1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -9.538 -1.319 -0.636 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.856 -2.773 0.131 1.00 0.00 H new ATOM 1285 N VAL A 82 -11.343 -4.988 -1.491 1.00 0.00 N ATOM 1286 CA VAL A 82 -11.289 -6.432 -1.644 1.00 0.00 C ATOM 1287 C VAL A 82 -9.942 -6.805 -2.214 1.00 0.00 C ATOM 1288 O VAL A 82 -9.637 -6.485 -3.363 1.00 0.00 O ATOM 1289 CB VAL A 82 -12.384 -6.976 -2.581 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -12.238 -8.484 -2.766 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -13.745 -6.643 -2.037 1.00 0.00 C ATOM 0 H VAL A 82 -11.657 -4.480 -2.317 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.450 -6.872 -0.660 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.270 -6.501 -3.556 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -13.022 -8.847 -3.431 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.263 -8.705 -3.200 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.325 -8.979 -1.799 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.510 -7.033 -2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.863 -7.093 -1.051 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.850 -5.561 -1.956 1.00 0.00 H new ATOM 1301 N VAL A 83 -9.136 -7.466 -1.410 1.00 0.00 N ATOM 1302 CA VAL A 83 -7.814 -7.891 -1.858 1.00 0.00 C ATOM 1303 C VAL A 83 -7.811 -9.381 -2.156 1.00 0.00 C ATOM 1304 O VAL A 83 -8.300 -10.178 -1.375 1.00 0.00 O ATOM 1305 CB VAL A 83 -6.679 -7.524 -0.841 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -7.247 -6.948 0.443 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -5.766 -8.706 -0.543 1.00 0.00 C ATOM 0 H VAL A 83 -9.364 -7.722 -0.449 1.00 0.00 H new ATOM 0 HA VAL A 83 -7.597 -7.342 -2.774 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.071 -6.756 -1.320 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -6.432 -6.705 1.125 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -7.813 -6.044 0.217 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.905 -7.681 0.911 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -4.996 -8.401 0.166 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.352 -9.520 -0.115 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.295 -9.044 -1.466 1.00 0.00 H new ATOM 1317 N LYS A 84 -7.292 -9.735 -3.310 1.00 0.00 N ATOM 1318 CA LYS A 84 -7.146 -11.110 -3.705 1.00 0.00 C ATOM 1319 C LYS A 84 -5.702 -11.529 -3.572 1.00 0.00 C ATOM 1320 O LYS A 84 -4.801 -10.694 -3.669 1.00 0.00 O ATOM 1321 CB LYS A 84 -7.567 -11.268 -5.151 1.00 0.00 C ATOM 1322 CG LYS A 84 -9.063 -11.204 -5.365 1.00 0.00 C ATOM 1323 CD LYS A 84 -9.769 -12.432 -4.836 1.00 0.00 C ATOM 1324 CE LYS A 84 -11.263 -12.198 -4.804 1.00 0.00 C ATOM 1325 NZ LYS A 84 -12.012 -13.403 -4.353 1.00 0.00 N ATOM 0 H LYS A 84 -6.957 -9.067 -4.004 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.771 -11.732 -3.064 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -7.091 -10.488 -5.745 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -7.197 -12.223 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -9.461 -10.317 -4.872 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -9.272 -11.097 -6.429 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -9.541 -13.292 -5.466 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -9.408 -12.666 -3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -11.484 -11.364 -4.137 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -11.605 -11.911 -5.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -13.031 -13.196 -4.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -11.823 -14.193 -5.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -11.706 -13.663 -3.394 1.00 0.00 H new ATOM 1339 N MET A 85 -5.464 -12.806 -3.345 1.00 0.00 N ATOM 1340 CA MET A 85 -4.102 -13.273 -3.307 1.00 0.00 C ATOM 1341 C MET A 85 -3.896 -14.450 -4.226 1.00 0.00 C ATOM 1342 O MET A 85 -4.686 -15.391 -4.272 1.00 0.00 O ATOM 1343 CB MET A 85 -3.653 -13.633 -1.893 1.00 0.00 C ATOM 1344 CG MET A 85 -2.138 -13.745 -1.747 1.00 0.00 C ATOM 1345 SD MET A 85 -1.630 -14.765 -0.357 1.00 0.00 S ATOM 1346 CE MET A 85 0.141 -14.502 -0.406 1.00 0.00 C ATOM 0 H MET A 85 -6.178 -13.518 -3.189 1.00 0.00 H new ATOM 0 HA MET A 85 -3.486 -12.444 -3.654 1.00 0.00 H new ATOM 0 HB2 MET A 85 -4.022 -12.878 -1.199 1.00 0.00 H new ATOM 0 HB3 MET A 85 -4.109 -14.580 -1.605 1.00 0.00 H new ATOM 0 HG2 MET A 85 -1.721 -14.160 -2.665 1.00 0.00 H new ATOM 0 HG3 MET A 85 -1.717 -12.747 -1.629 1.00 0.00 H new ATOM 0 HE1 MET A 85 0.652 -15.394 -0.044 1.00 0.00 H new ATOM 0 HE2 MET A 85 0.450 -14.298 -1.431 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.400 -13.654 0.227 1.00 0.00 H new ATOM 1356 N GLU A 86 -2.803 -14.357 -4.940 1.00 0.00 N ATOM 1357 CA GLU A 86 -2.377 -15.349 -5.896 1.00 0.00 C ATOM 1358 C GLU A 86 -1.472 -16.373 -5.215 1.00 0.00 C ATOM 1359 O GLU A 86 -0.960 -17.307 -5.827 1.00 0.00 O ATOM 1360 CB GLU A 86 -1.661 -14.597 -6.983 1.00 0.00 C ATOM 1361 CG GLU A 86 -1.067 -15.428 -8.088 1.00 0.00 C ATOM 1362 CD GLU A 86 -2.049 -16.392 -8.729 1.00 0.00 C ATOM 1363 OE1 GLU A 86 -2.177 -17.536 -8.251 1.00 0.00 O ATOM 1364 OE2 GLU A 86 -2.685 -16.011 -9.734 1.00 0.00 O ATOM 0 H GLU A 86 -2.165 -13.564 -4.870 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.214 -15.909 -6.313 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -2.360 -13.888 -7.426 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.862 -14.013 -6.526 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -0.671 -14.764 -8.856 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -0.224 -15.994 -7.691 1.00 0.00 H new ATOM 1371 N GLY A 87 -1.259 -16.167 -3.933 1.00 0.00 N ATOM 1372 CA GLY A 87 -0.535 -17.141 -3.148 1.00 0.00 C ATOM 1373 C GLY A 87 0.962 -16.911 -3.160 1.00 0.00 C ATOM 1374 O GLY A 87 1.559 -16.579 -2.137 1.00 0.00 O ATOM 0 H GLY A 87 -1.573 -15.344 -3.418 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.894 -17.111 -2.119 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -0.747 -18.139 -3.531 1.00 0.00 H new ATOM 1378 N ASP A 88 1.566 -17.070 -4.327 1.00 0.00 N ATOM 1379 CA ASP A 88 3.009 -16.910 -4.482 1.00 0.00 C ATOM 1380 C ASP A 88 3.386 -15.447 -4.556 1.00 0.00 C ATOM 1381 O ASP A 88 4.046 -15.011 -5.493 1.00 0.00 O ATOM 1382 CB ASP A 88 3.496 -17.638 -5.732 1.00 0.00 C ATOM 1383 CG ASP A 88 3.190 -19.120 -5.687 1.00 0.00 C ATOM 1384 OD1 ASP A 88 3.950 -19.868 -5.036 1.00 0.00 O ATOM 1385 OD2 ASP A 88 2.174 -19.538 -6.286 1.00 0.00 O ATOM 0 H ASP A 88 1.077 -17.312 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 88 3.491 -17.347 -3.608 1.00 0.00 H new ATOM 0 HB2 ASP A 88 3.027 -17.199 -6.612 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.571 -17.494 -5.839 1.00 0.00 H new ATOM 1390 N ASN A 89 3.003 -14.716 -3.517 1.00 0.00 N ATOM 1391 CA ASN A 89 3.386 -13.326 -3.322 1.00 0.00 C ATOM 1392 C ASN A 89 2.719 -12.371 -4.304 1.00 0.00 C ATOM 1393 O ASN A 89 3.359 -11.445 -4.803 1.00 0.00 O ATOM 1394 CB ASN A 89 4.888 -13.159 -3.452 1.00 0.00 C ATOM 1395 CG ASN A 89 5.696 -14.154 -2.655 1.00 0.00 C ATOM 1396 OD1 ASN A 89 6.084 -13.895 -1.520 1.00 0.00 O ATOM 1397 ND2 ASN A 89 5.977 -15.294 -3.273 1.00 0.00 N ATOM 0 H ASN A 89 2.407 -15.080 -2.774 1.00 0.00 H new ATOM 0 HA ASN A 89 3.050 -13.072 -2.317 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.162 -13.246 -4.504 1.00 0.00 H new ATOM 0 HB3 ASN A 89 5.158 -12.152 -3.135 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.540 -16.003 -2.803 1.00 0.00 H new ATOM 0 HD22 ASN A 89 5.630 -15.461 -4.218 1.00 0.00 H new ATOM 1404 N LYS A 90 1.451 -12.581 -4.599 1.00 0.00 N ATOM 1405 CA LYS A 90 0.695 -11.591 -5.332 1.00 0.00 C ATOM 1406 C LYS A 90 -0.486 -11.119 -4.493 1.00 0.00 C ATOM 1407 O LYS A 90 -1.319 -11.933 -4.088 1.00 0.00 O ATOM 1408 CB LYS A 90 0.143 -12.154 -6.638 1.00 0.00 C ATOM 1409 CG LYS A 90 1.136 -12.588 -7.692 1.00 0.00 C ATOM 1410 CD LYS A 90 2.053 -13.698 -7.270 1.00 0.00 C ATOM 1411 CE LYS A 90 3.418 -13.411 -7.825 1.00 0.00 C ATOM 1412 NZ LYS A 90 3.484 -13.621 -9.294 1.00 0.00 N ATOM 0 H LYS A 90 0.929 -13.420 -4.345 1.00 0.00 H new ATOM 0 HA LYS A 90 1.374 -10.768 -5.555 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.484 -13.012 -6.395 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.507 -11.399 -7.080 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.588 -12.905 -8.579 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.739 -11.727 -7.980 1.00 0.00 H new ATOM 0 HD2 LYS A 90 2.091 -13.768 -6.183 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.686 -14.656 -7.638 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.693 -12.382 -7.595 1.00 0.00 H new ATOM 0 HE3 LYS A 90 4.150 -14.053 -7.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 4.349 -14.148 -9.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.652 -14.162 -9.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 3.497 -12.700 -9.776 1.00 0.00 H new ATOM 1426 N MET A 91 -0.564 -9.821 -4.244 1.00 0.00 N ATOM 1427 CA MET A 91 -1.742 -9.234 -3.606 1.00 0.00 C ATOM 1428 C MET A 91 -2.377 -8.211 -4.533 1.00 0.00 C ATOM 1429 O MET A 91 -1.780 -7.183 -4.830 1.00 0.00 O ATOM 1430 CB MET A 91 -1.380 -8.541 -2.291 1.00 0.00 C ATOM 1431 CG MET A 91 -1.731 -9.326 -1.038 1.00 0.00 C ATOM 1432 SD MET A 91 -0.795 -10.852 -0.846 1.00 0.00 S ATOM 1433 CE MET A 91 -1.395 -11.383 0.756 1.00 0.00 C ATOM 0 H MET A 91 0.171 -9.151 -4.472 1.00 0.00 H new ATOM 0 HA MET A 91 -2.440 -10.045 -3.397 1.00 0.00 H new ATOM 0 HB2 MET A 91 -0.309 -8.337 -2.287 1.00 0.00 H new ATOM 0 HB3 MET A 91 -1.888 -7.577 -2.253 1.00 0.00 H new ATOM 0 HG2 MET A 91 -1.560 -8.695 -0.166 1.00 0.00 H new ATOM 0 HG3 MET A 91 -2.795 -9.564 -1.056 1.00 0.00 H new ATOM 0 HE1 MET A 91 -0.580 -11.840 1.317 1.00 0.00 H new ATOM 0 HE2 MET A 91 -1.776 -10.522 1.306 1.00 0.00 H new ATOM 0 HE3 MET A 91 -2.195 -12.111 0.622 1.00 0.00 H new ATOM 1443 N VAL A 92 -3.590 -8.473 -4.980 1.00 0.00 N ATOM 1444 CA VAL A 92 -4.265 -7.552 -5.883 1.00 0.00 C ATOM 1445 C VAL A 92 -5.619 -7.166 -5.307 1.00 0.00 C ATOM 1446 O VAL A 92 -6.472 -8.025 -5.103 1.00 0.00 O ATOM 1447 CB VAL A 92 -4.473 -8.166 -7.288 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -4.615 -7.073 -8.328 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -3.339 -9.117 -7.656 1.00 0.00 C ATOM 0 H VAL A 92 -4.126 -9.306 -4.738 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.629 -6.673 -5.986 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.395 -8.747 -7.265 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.761 -7.522 -9.310 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.474 -6.448 -8.084 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.713 -6.462 -8.339 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.518 -9.530 -8.649 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.394 -8.574 -7.654 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -3.294 -9.928 -6.929 1.00 0.00 H new ATOM 1459 N THR A 93 -5.824 -5.888 -5.041 1.00 0.00 N ATOM 1460 CA THR A 93 -7.078 -5.439 -4.459 1.00 0.00 C ATOM 1461 C THR A 93 -7.678 -4.272 -5.217 1.00 0.00 C ATOM 1462 O THR A 93 -6.973 -3.400 -5.732 1.00 0.00 O ATOM 1463 CB THR A 93 -6.957 -5.079 -2.955 1.00 0.00 C ATOM 1464 OG1 THR A 93 -7.907 -4.071 -2.602 1.00 0.00 O ATOM 1465 CG2 THR A 93 -5.558 -4.623 -2.576 1.00 0.00 C ATOM 0 H THR A 93 -5.145 -5.147 -5.217 1.00 0.00 H new ATOM 0 HA THR A 93 -7.749 -6.293 -4.544 1.00 0.00 H new ATOM 0 HB THR A 93 -7.167 -5.991 -2.397 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.814 -4.411 -2.748 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.529 -4.384 -1.513 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.846 -5.420 -2.788 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.295 -3.738 -3.155 1.00 0.00 H new ATOM 1473 N THR A 94 -8.995 -4.284 -5.289 1.00 0.00 N ATOM 1474 CA THR A 94 -9.737 -3.205 -5.905 1.00 0.00 C ATOM 1475 C THR A 94 -10.812 -2.674 -4.956 1.00 0.00 C ATOM 1476 O THR A 94 -11.478 -3.445 -4.259 1.00 0.00 O ATOM 1477 CB THR A 94 -10.367 -3.634 -7.244 1.00 0.00 C ATOM 1478 OG1 THR A 94 -11.136 -2.562 -7.803 1.00 0.00 O ATOM 1479 CG2 THR A 94 -11.235 -4.852 -7.041 1.00 0.00 C ATOM 0 H THR A 94 -9.577 -5.038 -4.924 1.00 0.00 H new ATOM 0 HA THR A 94 -9.028 -2.404 -6.115 1.00 0.00 H new ATOM 0 HB THR A 94 -9.568 -3.884 -7.942 1.00 0.00 H new ATOM 0 HG1 THR A 94 -10.643 -1.721 -7.706 1.00 0.00 H new ATOM 0 HG21 THR A 94 -11.676 -5.147 -7.993 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.629 -5.670 -6.652 1.00 0.00 H new ATOM 0 HG23 THR A 94 -12.028 -4.619 -6.331 1.00 0.00 H new ATOM 1487 N PHE A 95 -10.939 -1.355 -4.893 1.00 0.00 N ATOM 1488 CA PHE A 95 -11.969 -0.721 -4.083 1.00 0.00 C ATOM 1489 C PHE A 95 -12.552 0.466 -4.835 1.00 0.00 C ATOM 1490 O PHE A 95 -11.805 1.272 -5.383 1.00 0.00 O ATOM 1491 CB PHE A 95 -11.394 -0.264 -2.735 1.00 0.00 C ATOM 1492 CG PHE A 95 -10.582 1.006 -2.803 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -9.322 1.021 -3.384 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -11.095 2.191 -2.296 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -8.594 2.194 -3.454 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -10.369 3.365 -2.367 1.00 0.00 C ATOM 1497 CZ PHE A 95 -9.118 3.366 -2.947 1.00 0.00 C ATOM 0 H PHE A 95 -10.338 -0.702 -5.396 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.759 -1.447 -3.888 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -12.216 -0.119 -2.034 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -10.768 -1.060 -2.332 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -8.906 0.108 -3.785 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -12.074 2.196 -1.840 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -7.613 2.193 -3.906 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -10.781 4.280 -1.969 1.00 0.00 H new ATOM 0 HZ PHE A 95 -8.549 4.282 -3.004 1.00 0.00 H new ATOM 1507 N LYS A 96 -13.874 0.557 -4.893 1.00 0.00 N ATOM 1508 CA LYS A 96 -14.543 1.694 -5.525 1.00 0.00 C ATOM 1509 C LYS A 96 -14.085 1.893 -6.974 1.00 0.00 C ATOM 1510 O LYS A 96 -14.112 3.006 -7.495 1.00 0.00 O ATOM 1511 CB LYS A 96 -14.305 2.976 -4.709 1.00 0.00 C ATOM 1512 CG LYS A 96 -15.117 3.036 -3.422 1.00 0.00 C ATOM 1513 CD LYS A 96 -14.981 4.379 -2.730 1.00 0.00 C ATOM 1514 CE LYS A 96 -13.731 4.426 -1.874 1.00 0.00 C ATOM 1515 NZ LYS A 96 -13.421 5.803 -1.405 1.00 0.00 N ATOM 0 H LYS A 96 -14.509 -0.143 -4.510 1.00 0.00 H new ATOM 0 HA LYS A 96 -15.611 1.476 -5.545 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -13.245 3.050 -4.465 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -14.551 3.841 -5.325 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -16.167 2.848 -3.646 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.788 2.245 -2.748 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.946 5.174 -3.475 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.858 4.563 -2.109 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.858 3.771 -1.012 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -12.887 4.040 -2.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.559 5.786 -0.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -13.273 6.424 -2.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -14.214 6.163 -0.837 1.00 0.00 H new ATOM 1529 N GLY A 97 -13.683 0.807 -7.626 1.00 0.00 N ATOM 1530 CA GLY A 97 -13.224 0.887 -8.996 1.00 0.00 C ATOM 1531 C GLY A 97 -11.756 1.261 -9.115 1.00 0.00 C ATOM 1532 O GLY A 97 -11.240 1.414 -10.222 1.00 0.00 O ATOM 0 H GLY A 97 -13.668 -0.131 -7.225 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -13.388 -0.074 -9.484 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -13.824 1.623 -9.531 1.00 0.00 H new ATOM 1536 N ILE A 98 -11.082 1.404 -7.982 1.00 0.00 N ATOM 1537 CA ILE A 98 -9.668 1.733 -7.967 1.00 0.00 C ATOM 1538 C ILE A 98 -8.871 0.446 -7.977 1.00 0.00 C ATOM 1539 O ILE A 98 -9.226 -0.508 -7.282 1.00 0.00 O ATOM 1540 CB ILE A 98 -9.267 2.564 -6.739 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -10.163 3.793 -6.597 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -7.804 2.982 -6.832 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -10.646 4.379 -7.907 1.00 0.00 C ATOM 0 H ILE A 98 -11.497 1.296 -7.057 1.00 0.00 H new ATOM 0 HA ILE A 98 -9.458 2.337 -8.850 1.00 0.00 H new ATOM 0 HB ILE A 98 -9.396 1.943 -5.853 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -11.030 3.526 -5.993 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.618 4.562 -6.050 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -7.537 3.570 -5.954 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.174 2.094 -6.879 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -7.653 3.582 -7.730 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -11.275 5.247 -7.708 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -9.789 4.682 -8.508 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -11.223 3.630 -8.450 1.00 0.00 H new ATOM 1555 N LYS A 99 -7.813 0.399 -8.758 1.00 0.00 N ATOM 1556 CA LYS A 99 -7.097 -0.843 -8.949 1.00 0.00 C ATOM 1557 C LYS A 99 -5.709 -0.793 -8.325 1.00 0.00 C ATOM 1558 O LYS A 99 -4.898 0.060 -8.680 1.00 0.00 O ATOM 1559 CB LYS A 99 -6.993 -1.137 -10.428 1.00 0.00 C ATOM 1560 CG LYS A 99 -7.083 -2.611 -10.748 1.00 0.00 C ATOM 1561 CD LYS A 99 -6.834 -2.868 -12.223 1.00 0.00 C ATOM 1562 CE LYS A 99 -6.924 -4.344 -12.558 1.00 0.00 C ATOM 1563 NZ LYS A 99 -6.525 -4.611 -13.962 1.00 0.00 N ATOM 0 H LYS A 99 -7.433 1.198 -9.266 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.651 -1.639 -8.451 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -7.788 -0.608 -10.954 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.047 -0.747 -10.804 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.354 -3.160 -10.152 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -8.068 -2.986 -10.472 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.562 -2.315 -12.817 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.848 -2.492 -12.497 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -6.283 -4.911 -11.883 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.944 -4.693 -12.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -6.599 -5.630 -14.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.153 -4.090 -14.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -5.543 -4.301 -14.109 1.00 0.00 H new ATOM 1577 N SER A 100 -5.448 -1.697 -7.390 1.00 0.00 N ATOM 1578 CA SER A 100 -4.135 -1.814 -6.780 1.00 0.00 C ATOM 1579 C SER A 100 -3.578 -3.218 -6.997 1.00 0.00 C ATOM 1580 O SER A 100 -4.178 -4.209 -6.582 1.00 0.00 O ATOM 1581 CB SER A 100 -4.209 -1.500 -5.283 1.00 0.00 C ATOM 1582 OG SER A 100 -2.915 -1.464 -4.701 1.00 0.00 O ATOM 0 H SER A 100 -6.135 -2.363 -7.037 1.00 0.00 H new ATOM 0 HA SER A 100 -3.468 -1.093 -7.252 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.704 -0.540 -5.134 1.00 0.00 H new ATOM 0 HB3 SER A 100 -4.816 -2.253 -4.780 1.00 0.00 H new ATOM 0 HG SER A 100 -2.538 -0.565 -4.797 1.00 0.00 H new ATOM 1588 N VAL A 101 -2.432 -3.290 -7.647 1.00 0.00 N ATOM 1589 CA VAL A 101 -1.789 -4.552 -7.958 1.00 0.00 C ATOM 1590 C VAL A 101 -0.450 -4.639 -7.240 1.00 0.00 C ATOM 1591 O VAL A 101 0.412 -3.785 -7.428 1.00 0.00 O ATOM 1592 CB VAL A 101 -1.542 -4.679 -9.471 1.00 0.00 C ATOM 1593 CG1 VAL A 101 -0.782 -5.951 -9.782 1.00 0.00 C ATOM 1594 CG2 VAL A 101 -2.856 -4.627 -10.228 1.00 0.00 C ATOM 0 H VAL A 101 -1.919 -2.472 -7.975 1.00 0.00 H new ATOM 0 HA VAL A 101 -2.447 -5.357 -7.630 1.00 0.00 H new ATOM 0 HB VAL A 101 -0.931 -3.837 -9.796 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.617 -6.023 -10.857 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.179 -5.936 -9.268 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -1.360 -6.812 -9.445 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.664 -4.718 -11.297 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -3.496 -5.447 -9.903 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.354 -3.678 -10.028 1.00 0.00 H new ATOM 1604 N THR A 102 -0.276 -5.643 -6.407 1.00 0.00 N ATOM 1605 CA THR A 102 0.981 -5.827 -5.721 1.00 0.00 C ATOM 1606 C THR A 102 1.638 -7.149 -6.121 1.00 0.00 C ATOM 1607 O THR A 102 1.062 -8.220 -5.928 1.00 0.00 O ATOM 1608 CB THR A 102 0.778 -5.782 -4.195 1.00 0.00 C ATOM 1609 OG1 THR A 102 -0.299 -4.892 -3.879 1.00 0.00 O ATOM 1610 CG2 THR A 102 2.034 -5.299 -3.496 1.00 0.00 C ATOM 0 H THR A 102 -0.988 -6.341 -6.190 1.00 0.00 H new ATOM 0 HA THR A 102 1.642 -5.011 -6.014 1.00 0.00 H new ATOM 0 HB THR A 102 0.547 -6.791 -3.852 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.153 -5.328 -4.080 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.865 -5.276 -2.419 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.858 -5.976 -3.720 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.283 -4.297 -3.846 1.00 0.00 H new ATOM 1618 N GLU A 103 2.847 -7.069 -6.658 1.00 0.00 N ATOM 1619 CA GLU A 103 3.614 -8.258 -7.003 1.00 0.00 C ATOM 1620 C GLU A 103 4.923 -8.206 -6.232 1.00 0.00 C ATOM 1621 O GLU A 103 5.726 -7.294 -6.437 1.00 0.00 O ATOM 1622 CB GLU A 103 3.943 -8.261 -8.496 1.00 0.00 C ATOM 1623 CG GLU A 103 4.117 -9.628 -9.095 1.00 0.00 C ATOM 1624 CD GLU A 103 2.802 -10.247 -9.515 1.00 0.00 C ATOM 1625 OE1 GLU A 103 1.741 -9.691 -9.169 1.00 0.00 O ATOM 1626 OE2 GLU A 103 2.824 -11.281 -10.215 1.00 0.00 O ATOM 0 H GLU A 103 3.320 -6.189 -6.865 1.00 0.00 H new ATOM 0 HA GLU A 103 3.036 -9.150 -6.759 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.147 -7.743 -9.031 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.858 -7.690 -8.654 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.776 -9.561 -9.960 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.607 -10.279 -8.371 1.00 0.00 H new ATOM 1633 N PHE A 104 5.143 -9.146 -5.338 1.00 0.00 N ATOM 1634 CA PHE A 104 6.374 -9.175 -4.580 1.00 0.00 C ATOM 1635 C PHE A 104 7.142 -10.447 -4.866 1.00 0.00 C ATOM 1636 O PHE A 104 6.636 -11.535 -4.667 1.00 0.00 O ATOM 1637 CB PHE A 104 6.103 -9.022 -3.077 1.00 0.00 C ATOM 1638 CG PHE A 104 4.688 -9.259 -2.654 1.00 0.00 C ATOM 1639 CD1 PHE A 104 3.734 -8.329 -2.950 1.00 0.00 C ATOM 1640 CD2 PHE A 104 4.325 -10.389 -1.954 1.00 0.00 C ATOM 1641 CE1 PHE A 104 2.423 -8.506 -2.569 1.00 0.00 C ATOM 1642 CE2 PHE A 104 3.015 -10.583 -1.567 1.00 0.00 C ATOM 1643 CZ PHE A 104 2.061 -9.638 -1.877 1.00 0.00 C ATOM 0 H PHE A 104 4.488 -9.897 -5.119 1.00 0.00 H new ATOM 0 HA PHE A 104 6.985 -8.328 -4.892 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.747 -9.715 -2.536 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.392 -8.016 -2.773 1.00 0.00 H new ATOM 0 HD1 PHE A 104 4.013 -7.438 -3.493 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.072 -11.129 -1.706 1.00 0.00 H new ATOM 0 HE1 PHE A 104 1.682 -7.759 -2.813 1.00 0.00 H new ATOM 0 HE2 PHE A 104 2.738 -11.473 -1.022 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.034 -9.786 -1.578 1.00 0.00 H new ATOM 1653 N ASN A 105 8.342 -10.337 -5.382 1.00 0.00 N ATOM 1654 CA ASN A 105 9.153 -11.522 -5.559 1.00 0.00 C ATOM 1655 C ASN A 105 10.529 -11.351 -4.945 1.00 0.00 C ATOM 1656 O ASN A 105 11.305 -10.498 -5.374 1.00 0.00 O ATOM 1657 CB ASN A 105 9.244 -11.917 -7.028 1.00 0.00 C ATOM 1658 CG ASN A 105 8.622 -13.284 -7.267 1.00 0.00 C ATOM 1659 OD1 ASN A 105 9.080 -14.050 -8.115 1.00 0.00 O ATOM 1660 ND2 ASN A 105 7.564 -13.594 -6.520 1.00 0.00 N ATOM 0 H ASN A 105 8.773 -9.462 -5.681 1.00 0.00 H new ATOM 0 HA ASN A 105 8.660 -12.337 -5.030 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.737 -11.171 -7.640 1.00 0.00 H new ATOM 0 HB3 ASN A 105 10.288 -11.930 -7.340 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.102 -14.495 -6.640 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.216 -12.930 -5.828 1.00 0.00 H new ATOM 1667 N GLY A 106 10.807 -12.140 -3.918 1.00 0.00 N ATOM 1668 CA GLY A 106 12.121 -12.135 -3.315 1.00 0.00 C ATOM 1669 C GLY A 106 12.258 -11.091 -2.232 1.00 0.00 C ATOM 1670 O GLY A 106 13.239 -10.344 -2.216 1.00 0.00 O ATOM 0 H GLY A 106 10.143 -12.785 -3.491 1.00 0.00 H new ATOM 0 HA2 GLY A 106 12.328 -13.119 -2.894 1.00 0.00 H new ATOM 0 HA3 GLY A 106 12.870 -11.954 -4.086 1.00 0.00 H new ATOM 1674 N ASP A 107 11.265 -11.022 -1.338 1.00 0.00 N ATOM 1675 CA ASP A 107 11.295 -10.074 -0.218 1.00 0.00 C ATOM 1676 C ASP A 107 11.283 -8.624 -0.711 1.00 0.00 C ATOM 1677 O ASP A 107 11.527 -7.691 0.053 1.00 0.00 O ATOM 1678 CB ASP A 107 12.523 -10.316 0.677 1.00 0.00 C ATOM 1679 CG ASP A 107 12.519 -11.685 1.330 1.00 0.00 C ATOM 1680 OD1 ASP A 107 12.981 -12.659 0.693 1.00 0.00 O ATOM 1681 OD2 ASP A 107 12.060 -11.799 2.485 1.00 0.00 O ATOM 0 H ASP A 107 10.432 -11.610 -1.368 1.00 0.00 H new ATOM 0 HA ASP A 107 10.394 -10.242 0.371 1.00 0.00 H new ATOM 0 HB2 ASP A 107 13.428 -10.207 0.080 1.00 0.00 H new ATOM 0 HB3 ASP A 107 12.558 -9.550 1.452 1.00 0.00 H new ATOM 1686 N THR A 108 11.016 -8.429 -1.993 1.00 0.00 N ATOM 1687 CA THR A 108 10.849 -7.090 -2.532 1.00 0.00 C ATOM 1688 C THR A 108 9.475 -6.937 -3.149 1.00 0.00 C ATOM 1689 O THR A 108 9.053 -7.756 -3.964 1.00 0.00 O ATOM 1690 CB THR A 108 11.939 -6.727 -3.559 1.00 0.00 C ATOM 1691 OG1 THR A 108 12.137 -7.811 -4.478 1.00 0.00 O ATOM 1692 CG2 THR A 108 13.248 -6.401 -2.861 1.00 0.00 C ATOM 0 H THR A 108 10.911 -9.178 -2.677 1.00 0.00 H new ATOM 0 HA THR A 108 10.950 -6.396 -1.698 1.00 0.00 H new ATOM 0 HB THR A 108 11.607 -5.847 -4.110 1.00 0.00 H new ATOM 0 HG1 THR A 108 11.302 -8.315 -4.574 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.004 -6.148 -3.605 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.101 -5.555 -2.190 1.00 0.00 H new ATOM 0 HG23 THR A 108 13.580 -7.266 -2.287 1.00 0.00 H new ATOM 1700 N ILE A 109 8.790 -5.884 -2.750 1.00 0.00 N ATOM 1701 CA ILE A 109 7.402 -5.696 -3.089 1.00 0.00 C ATOM 1702 C ILE A 109 7.214 -4.560 -4.083 1.00 0.00 C ATOM 1703 O ILE A 109 7.743 -3.462 -3.895 1.00 0.00 O ATOM 1704 CB ILE A 109 6.590 -5.380 -1.819 1.00 0.00 C ATOM 1705 CG1 ILE A 109 6.732 -6.517 -0.807 1.00 0.00 C ATOM 1706 CG2 ILE A 109 5.135 -5.158 -2.156 1.00 0.00 C ATOM 1707 CD1 ILE A 109 5.567 -6.625 0.157 1.00 0.00 C ATOM 0 H ILE A 109 9.185 -5.136 -2.181 1.00 0.00 H new ATOM 0 HA ILE A 109 7.050 -6.621 -3.546 1.00 0.00 H new ATOM 0 HB ILE A 109 6.983 -4.464 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.835 -7.459 -1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.650 -6.372 -0.238 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.580 -4.936 -1.244 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.045 -4.321 -2.848 1.00 0.00 H new ATOM 0 HG23 ILE A 109 4.728 -6.057 -2.619 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.739 -7.454 0.844 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.476 -5.698 0.722 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.648 -6.802 -0.402 1.00 0.00 H new ATOM 1719 N THR A 110 6.474 -4.825 -5.146 1.00 0.00 N ATOM 1720 CA THR A 110 6.103 -3.780 -6.077 1.00 0.00 C ATOM 1721 C THR A 110 4.589 -3.611 -6.088 1.00 0.00 C ATOM 1722 O THR A 110 3.857 -4.545 -6.406 1.00 0.00 O ATOM 1723 CB THR A 110 6.588 -4.089 -7.502 1.00 0.00 C ATOM 1724 OG1 THR A 110 7.961 -4.502 -7.475 1.00 0.00 O ATOM 1725 CG2 THR A 110 6.444 -2.859 -8.386 1.00 0.00 C ATOM 0 H THR A 110 6.121 -5.752 -5.383 1.00 0.00 H new ATOM 0 HA THR A 110 6.582 -2.858 -5.746 1.00 0.00 H new ATOM 0 HB THR A 110 5.977 -4.894 -7.910 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.261 -4.699 -8.387 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.791 -3.092 -9.393 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.397 -2.559 -8.424 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.041 -2.044 -7.976 1.00 0.00 H new ATOM 1733 N ASN A 111 4.127 -2.428 -5.733 1.00 0.00 N ATOM 1734 CA ASN A 111 2.694 -2.141 -5.739 1.00 0.00 C ATOM 1735 C ASN A 111 2.370 -1.070 -6.767 1.00 0.00 C ATOM 1736 O ASN A 111 2.940 0.019 -6.744 1.00 0.00 O ATOM 1737 CB ASN A 111 2.243 -1.707 -4.342 1.00 0.00 C ATOM 1738 CG ASN A 111 0.774 -1.314 -4.259 1.00 0.00 C ATOM 1739 OD1 ASN A 111 0.415 -0.430 -3.483 1.00 0.00 O ATOM 1740 ND2 ASN A 111 -0.084 -1.982 -5.017 1.00 0.00 N ATOM 0 H ASN A 111 4.715 -1.649 -5.437 1.00 0.00 H new ATOM 0 HA ASN A 111 2.153 -3.047 -6.014 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.431 -2.521 -3.642 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.853 -0.863 -4.021 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.080 -1.769 -4.969 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.252 -2.709 -5.649 1.00 0.00 H new ATOM 1747 N THR A 112 1.476 -1.403 -7.684 1.00 0.00 N ATOM 1748 CA THR A 112 1.065 -0.478 -8.715 1.00 0.00 C ATOM 1749 C THR A 112 -0.436 -0.216 -8.630 1.00 0.00 C ATOM 1750 O THR A 112 -1.232 -1.149 -8.640 1.00 0.00 O ATOM 1751 CB THR A 112 1.406 -1.037 -10.104 1.00 0.00 C ATOM 1752 OG1 THR A 112 2.697 -1.663 -10.072 1.00 0.00 O ATOM 1753 CG2 THR A 112 1.397 0.060 -11.131 1.00 0.00 C ATOM 0 H THR A 112 1.021 -2.315 -7.731 1.00 0.00 H new ATOM 0 HA THR A 112 1.602 0.458 -8.563 1.00 0.00 H new ATOM 0 HB THR A 112 0.652 -1.775 -10.377 1.00 0.00 H new ATOM 0 HG1 THR A 112 2.910 -2.020 -10.960 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.641 -0.355 -12.109 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.408 0.517 -11.167 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.136 0.815 -10.863 1.00 0.00 H new ATOM 1761 N MET A 113 -0.820 1.044 -8.534 1.00 0.00 N ATOM 1762 CA MET A 113 -2.211 1.409 -8.473 1.00 0.00 C ATOM 1763 C MET A 113 -2.545 2.326 -9.640 1.00 0.00 C ATOM 1764 O MET A 113 -1.686 3.053 -10.129 1.00 0.00 O ATOM 1765 CB MET A 113 -2.518 2.085 -7.136 1.00 0.00 C ATOM 1766 CG MET A 113 -3.832 2.827 -7.132 1.00 0.00 C ATOM 1767 SD MET A 113 -4.249 3.535 -5.528 1.00 0.00 S ATOM 1768 CE MET A 113 -4.323 2.065 -4.508 1.00 0.00 C ATOM 0 H MET A 113 -0.176 1.834 -8.497 1.00 0.00 H new ATOM 0 HA MET A 113 -2.829 0.514 -8.546 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.532 1.330 -6.350 1.00 0.00 H new ATOM 0 HB3 MET A 113 -1.714 2.781 -6.895 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.793 3.625 -7.874 1.00 0.00 H new ATOM 0 HG3 MET A 113 -4.626 2.146 -7.438 1.00 0.00 H new ATOM 0 HE1 MET A 113 -4.572 2.345 -3.484 1.00 0.00 H new ATOM 0 HE2 MET A 113 -5.087 1.391 -4.896 1.00 0.00 H new ATOM 0 HE3 MET A 113 -3.355 1.563 -4.522 1.00 0.00 H new ATOM 1778 N THR A 114 -3.774 2.273 -10.102 1.00 0.00 N ATOM 1779 CA THR A 114 -4.202 3.098 -11.202 1.00 0.00 C ATOM 1780 C THR A 114 -5.377 3.952 -10.761 1.00 0.00 C ATOM 1781 O THR A 114 -6.399 3.422 -10.318 1.00 0.00 O ATOM 1782 CB THR A 114 -4.611 2.233 -12.411 1.00 0.00 C ATOM 1783 OG1 THR A 114 -3.540 1.341 -12.747 1.00 0.00 O ATOM 1784 CG2 THR A 114 -4.955 3.099 -13.615 1.00 0.00 C ATOM 0 H THR A 114 -4.498 1.660 -9.727 1.00 0.00 H new ATOM 0 HA THR A 114 -3.372 3.737 -11.504 1.00 0.00 H new ATOM 0 HB THR A 114 -5.498 1.660 -12.139 1.00 0.00 H new ATOM 0 HG1 THR A 114 -3.801 0.790 -13.514 1.00 0.00 H new ATOM 0 HG21 THR A 114 -5.240 2.462 -14.452 1.00 0.00 H new ATOM 0 HG22 THR A 114 -5.785 3.759 -13.363 1.00 0.00 H new ATOM 0 HG23 THR A 114 -4.087 3.697 -13.893 1.00 0.00 H new ATOM 1792 N LEU A 115 -5.231 5.263 -10.854 1.00 0.00 N ATOM 1793 CA LEU A 115 -6.302 6.157 -10.468 1.00 0.00 C ATOM 1794 C LEU A 115 -6.657 7.043 -11.648 1.00 0.00 C ATOM 1795 O LEU A 115 -5.884 7.915 -12.012 1.00 0.00 O ATOM 1796 CB LEU A 115 -5.857 7.014 -9.278 1.00 0.00 C ATOM 1797 CG LEU A 115 -6.934 7.293 -8.242 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -6.379 8.138 -7.121 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -8.076 8.013 -8.903 1.00 0.00 C ATOM 0 H LEU A 115 -4.387 5.726 -11.191 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.178 5.579 -10.174 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -5.022 6.517 -8.785 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -5.484 7.966 -9.656 1.00 0.00 H new ATOM 0 HG LEU A 115 -7.283 6.349 -7.824 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.162 8.329 -6.387 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.554 7.611 -6.642 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.020 9.085 -7.523 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -8.853 8.217 -8.166 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.719 8.953 -9.323 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -8.485 7.392 -9.700 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.840 6.852 -12.211 1.00 0.00 N ATOM 1812 CA GLY A 116 -8.227 7.602 -13.394 1.00 0.00 C ATOM 1813 C GLY A 116 -7.204 7.497 -14.512 1.00 0.00 C ATOM 1814 O GLY A 116 -7.139 6.491 -15.225 1.00 0.00 O ATOM 0 H GLY A 116 -8.541 6.192 -11.873 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -9.190 7.238 -13.752 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.362 8.650 -13.127 1.00 0.00 H new ATOM 1818 N ASP A 117 -6.405 8.545 -14.651 1.00 0.00 N ATOM 1819 CA ASP A 117 -5.357 8.611 -15.662 1.00 0.00 C ATOM 1820 C ASP A 117 -3.989 8.309 -15.045 1.00 0.00 C ATOM 1821 O ASP A 117 -3.012 8.056 -15.753 1.00 0.00 O ATOM 1822 CB ASP A 117 -5.359 10.013 -16.292 1.00 0.00 C ATOM 1823 CG ASP A 117 -4.295 10.205 -17.356 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -4.551 9.859 -18.530 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -3.211 10.734 -17.033 1.00 0.00 O ATOM 0 H ASP A 117 -6.465 9.377 -14.064 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.551 7.862 -16.430 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -6.338 10.203 -16.732 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -5.213 10.755 -15.507 1.00 0.00 H new ATOM 1830 N ILE A 118 -3.937 8.290 -13.719 1.00 0.00 N ATOM 1831 CA ILE A 118 -2.672 8.220 -13.002 1.00 0.00 C ATOM 1832 C ILE A 118 -2.214 6.768 -12.790 1.00 0.00 C ATOM 1833 O ILE A 118 -3.016 5.891 -12.456 1.00 0.00 O ATOM 1834 CB ILE A 118 -2.765 8.969 -11.641 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -3.115 8.051 -10.471 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -3.802 10.063 -11.710 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -1.891 7.608 -9.708 1.00 0.00 C ATOM 0 H ILE A 118 -4.760 8.322 -13.117 1.00 0.00 H new ATOM 0 HA ILE A 118 -1.922 8.714 -13.620 1.00 0.00 H new ATOM 0 HB ILE A 118 -1.773 9.383 -11.462 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -3.794 8.570 -9.795 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -3.645 7.175 -10.845 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -3.854 10.576 -10.750 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.528 10.775 -12.488 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.774 9.629 -11.942 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -2.190 6.957 -8.886 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -1.223 7.065 -10.376 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -1.375 8.481 -9.310 1.00 0.00 H new ATOM 1849 N VAL A 119 -0.928 6.515 -13.030 1.00 0.00 N ATOM 1850 CA VAL A 119 -0.339 5.208 -12.767 1.00 0.00 C ATOM 1851 C VAL A 119 0.675 5.277 -11.621 1.00 0.00 C ATOM 1852 O VAL A 119 1.723 5.884 -11.740 1.00 0.00 O ATOM 1853 CB VAL A 119 0.326 4.648 -14.034 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.285 5.662 -14.614 1.00 0.00 C ATOM 1855 CG2 VAL A 119 1.022 3.323 -13.753 1.00 0.00 C ATOM 0 H VAL A 119 -0.275 7.202 -13.407 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.143 4.536 -12.468 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.452 4.453 -14.772 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.749 5.252 -15.511 1.00 0.00 H new ATOM 0 HG12 VAL A 119 0.742 6.572 -14.870 1.00 0.00 H new ATOM 0 HG13 VAL A 119 2.057 5.894 -13.880 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.483 2.953 -14.669 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.790 3.469 -12.994 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.292 2.597 -13.395 1.00 0.00 H new ATOM 1865 N TYR A 120 0.389 4.610 -10.529 1.00 0.00 N ATOM 1866 CA TYR A 120 1.220 4.719 -9.339 1.00 0.00 C ATOM 1867 C TYR A 120 1.985 3.440 -9.090 1.00 0.00 C ATOM 1868 O TYR A 120 1.404 2.382 -8.912 1.00 0.00 O ATOM 1869 CB TYR A 120 0.331 5.099 -8.153 1.00 0.00 C ATOM 1870 CG TYR A 120 0.866 4.789 -6.758 1.00 0.00 C ATOM 1871 CD1 TYR A 120 1.790 5.615 -6.126 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.395 3.688 -6.053 1.00 0.00 C ATOM 1873 CE1 TYR A 120 2.224 5.348 -4.838 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.832 3.414 -4.772 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.740 4.253 -4.171 1.00 0.00 C ATOM 1876 OH TYR A 120 2.160 4.006 -2.886 1.00 0.00 O ATOM 0 H TYR A 120 -0.411 3.984 -10.433 1.00 0.00 H new ATOM 0 HA TYR A 120 1.968 5.499 -9.481 1.00 0.00 H new ATOM 0 HB2 TYR A 120 0.131 6.169 -8.209 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.625 4.589 -8.270 1.00 0.00 H new ATOM 0 HD1 TYR A 120 2.175 6.478 -6.648 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.328 3.033 -6.517 1.00 0.00 H new ATOM 0 HE1 TYR A 120 2.941 6.000 -4.361 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.463 2.546 -4.246 1.00 0.00 H new ATOM 0 HH TYR A 120 1.473 3.493 -2.410 1.00 0.00 H new ATOM 1886 N LYS A 121 3.296 3.549 -9.088 1.00 0.00 N ATOM 1887 CA LYS A 121 4.153 2.411 -8.828 1.00 0.00 C ATOM 1888 C LYS A 121 5.074 2.719 -7.667 1.00 0.00 C ATOM 1889 O LYS A 121 5.795 3.710 -7.690 1.00 0.00 O ATOM 1890 CB LYS A 121 4.991 2.064 -10.055 1.00 0.00 C ATOM 1891 CG LYS A 121 4.845 0.622 -10.489 1.00 0.00 C ATOM 1892 CD LYS A 121 6.067 0.130 -11.222 1.00 0.00 C ATOM 1893 CE LYS A 121 6.317 0.899 -12.507 1.00 0.00 C ATOM 1894 NZ LYS A 121 7.592 0.490 -13.153 1.00 0.00 N ATOM 0 H LYS A 121 3.795 4.421 -9.265 1.00 0.00 H new ATOM 0 HA LYS A 121 3.519 1.558 -8.585 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.703 2.716 -10.880 1.00 0.00 H new ATOM 0 HB3 LYS A 121 6.040 2.267 -9.840 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.669 -0.004 -9.614 1.00 0.00 H new ATOM 0 HG3 LYS A 121 3.971 0.523 -11.133 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.938 0.219 -10.573 1.00 0.00 H new ATOM 0 HD3 LYS A 121 5.948 -0.929 -11.452 1.00 0.00 H new ATOM 0 HE2 LYS A 121 5.490 0.733 -13.197 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.344 1.967 -12.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 7.729 1.036 -14.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.384 0.671 -12.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 7.556 -0.524 -13.380 1.00 0.00 H new ATOM 1908 N ARG A 122 5.058 1.890 -6.652 1.00 0.00 N ATOM 1909 CA ARG A 122 5.920 2.125 -5.510 1.00 0.00 C ATOM 1910 C ARG A 122 6.887 0.976 -5.302 1.00 0.00 C ATOM 1911 O ARG A 122 6.550 -0.190 -5.521 1.00 0.00 O ATOM 1912 CB ARG A 122 5.110 2.374 -4.236 1.00 0.00 C ATOM 1913 CG ARG A 122 4.222 1.224 -3.816 1.00 0.00 C ATOM 1914 CD ARG A 122 3.574 1.518 -2.477 1.00 0.00 C ATOM 1915 NE ARG A 122 2.665 0.454 -2.048 1.00 0.00 N ATOM 1916 CZ ARG A 122 2.827 -0.280 -0.948 1.00 0.00 C ATOM 1917 NH1 ARG A 122 3.883 -0.091 -0.166 1.00 0.00 N ATOM 1918 NH2 ARG A 122 1.927 -1.204 -0.630 1.00 0.00 N ATOM 0 H ARG A 122 4.470 1.059 -6.588 1.00 0.00 H new ATOM 0 HA ARG A 122 6.497 3.024 -5.726 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.799 2.599 -3.422 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.490 3.259 -4.383 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.453 1.056 -4.570 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.809 0.308 -3.750 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.350 1.654 -1.724 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.024 2.457 -2.542 1.00 0.00 H new ATOM 0 HE ARG A 122 1.851 0.261 -2.632 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.575 0.619 -0.406 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.002 -0.656 0.675 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.114 -1.351 -1.228 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.049 -1.767 0.212 1.00 0.00 H new ATOM 1932 N VAL A 123 8.088 1.321 -4.874 1.00 0.00 N ATOM 1933 CA VAL A 123 9.101 0.339 -4.566 1.00 0.00 C ATOM 1934 C VAL A 123 9.172 0.139 -3.062 1.00 0.00 C ATOM 1935 O VAL A 123 9.399 1.074 -2.291 1.00 0.00 O ATOM 1936 CB VAL A 123 10.488 0.734 -5.122 1.00 0.00 C ATOM 1937 CG1 VAL A 123 10.960 2.059 -4.586 1.00 0.00 C ATOM 1938 CG2 VAL A 123 11.489 -0.359 -4.820 1.00 0.00 C ATOM 0 H VAL A 123 8.384 2.287 -4.732 1.00 0.00 H new ATOM 0 HA VAL A 123 8.819 -0.596 -5.051 1.00 0.00 H new ATOM 0 HB VAL A 123 10.396 0.849 -6.202 1.00 0.00 H new ATOM 0 HG11 VAL A 123 11.938 2.293 -5.005 1.00 0.00 H new ATOM 0 HG12 VAL A 123 10.250 2.838 -4.864 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.034 2.007 -3.500 1.00 0.00 H new ATOM 0 HG21 VAL A 123 12.466 -0.077 -5.214 1.00 0.00 H new ATOM 0 HG22 VAL A 123 11.559 -0.500 -3.741 1.00 0.00 H new ATOM 0 HG23 VAL A 123 11.164 -1.289 -5.287 1.00 0.00 H new ATOM 1948 N SER A 124 8.902 -1.080 -2.653 1.00 0.00 N ATOM 1949 CA SER A 124 8.976 -1.461 -1.264 1.00 0.00 C ATOM 1950 C SER A 124 9.936 -2.641 -1.111 1.00 0.00 C ATOM 1951 O SER A 124 9.844 -3.617 -1.847 1.00 0.00 O ATOM 1952 CB SER A 124 7.571 -1.816 -0.774 1.00 0.00 C ATOM 1953 OG SER A 124 6.749 -0.661 -0.747 1.00 0.00 O ATOM 0 H SER A 124 8.624 -1.837 -3.278 1.00 0.00 H new ATOM 0 HA SER A 124 9.357 -0.637 -0.660 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.130 -2.568 -1.428 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.627 -2.254 0.223 1.00 0.00 H new ATOM 0 HG SER A 124 6.432 -0.507 0.167 1.00 0.00 H new ATOM 1959 N LYS A 125 10.870 -2.546 -0.179 1.00 0.00 N ATOM 1960 CA LYS A 125 11.900 -3.568 -0.040 1.00 0.00 C ATOM 1961 C LYS A 125 12.079 -3.962 1.419 1.00 0.00 C ATOM 1962 O LYS A 125 12.051 -3.117 2.312 1.00 0.00 O ATOM 1963 CB LYS A 125 13.215 -3.074 -0.659 1.00 0.00 C ATOM 1964 CG LYS A 125 13.568 -1.657 -0.319 1.00 0.00 C ATOM 1965 CD LYS A 125 14.457 -1.542 0.905 1.00 0.00 C ATOM 1966 CE LYS A 125 15.813 -2.178 0.665 1.00 0.00 C ATOM 1967 NZ LYS A 125 15.912 -3.559 1.212 1.00 0.00 N ATOM 0 H LYS A 125 10.938 -1.778 0.489 1.00 0.00 H new ATOM 0 HA LYS A 125 11.587 -4.462 -0.579 1.00 0.00 H new ATOM 0 HB2 LYS A 125 14.024 -3.726 -0.330 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.150 -3.169 -1.743 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.072 -1.200 -1.171 1.00 0.00 H new ATOM 0 HG3 LYS A 125 12.652 -1.091 -0.150 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.587 -0.491 1.165 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.973 -2.023 1.755 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.012 -2.202 -0.406 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.585 -1.557 1.119 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 16.822 -3.674 1.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.135 -3.723 1.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.848 -4.246 0.434 1.00 0.00 H new ATOM 1981 N ARG A 126 12.245 -5.255 1.650 1.00 0.00 N ATOM 1982 CA ARG A 126 12.339 -5.794 2.997 1.00 0.00 C ATOM 1983 C ARG A 126 13.656 -5.436 3.664 1.00 0.00 C ATOM 1984 O ARG A 126 14.692 -5.290 3.014 1.00 0.00 O ATOM 1985 CB ARG A 126 12.185 -7.308 2.998 1.00 0.00 C ATOM 1986 CG ARG A 126 12.200 -7.908 4.395 1.00 0.00 C ATOM 1987 CD ARG A 126 12.777 -9.310 4.375 1.00 0.00 C ATOM 1988 NE ARG A 126 13.622 -9.576 5.535 1.00 0.00 N ATOM 1989 CZ ARG A 126 13.905 -10.802 5.968 1.00 0.00 C ATOM 1990 NH1 ARG A 126 13.316 -11.856 5.411 1.00 0.00 N ATOM 1991 NH2 ARG A 126 14.761 -10.974 6.966 1.00 0.00 N ATOM 0 H ARG A 126 12.318 -5.957 0.913 1.00 0.00 H new ATOM 0 HA ARG A 126 11.524 -5.342 3.563 1.00 0.00 H new ATOM 0 HB2 ARG A 126 11.249 -7.572 2.506 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.990 -7.750 2.411 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.790 -7.277 5.060 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.187 -7.933 4.795 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.964 -10.035 4.346 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.360 -9.448 3.464 1.00 0.00 H new ATOM 0 HE ARG A 126 14.016 -8.782 6.039 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.647 -11.725 4.652 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.533 -12.796 5.743 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.204 -10.166 7.403 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.977 -11.915 7.297 1.00 0.00 H new ATOM 2005 N ILE A 127 13.585 -5.307 4.969 1.00 0.00 N ATOM 2006 CA ILE A 127 14.729 -5.049 5.804 1.00 0.00 C ATOM 2007 C ILE A 127 15.272 -6.360 6.349 1.00 0.00 C ATOM 2008 O ILE A 127 16.488 -6.597 6.250 1.00 0.00 O ATOM 2009 CB ILE A 127 14.357 -4.149 6.971 1.00 0.00 C ATOM 2010 CG1 ILE A 127 12.867 -3.880 6.957 1.00 0.00 C ATOM 2011 CG2 ILE A 127 15.108 -2.845 6.874 1.00 0.00 C ATOM 2012 CD1 ILE A 127 12.441 -3.084 8.139 1.00 0.00 C ATOM 2013 OXT ILE A 127 14.460 -7.177 6.835 1.00 0.00 O ATOM 0 H ILE A 127 12.710 -5.381 5.488 1.00 0.00 H new ATOM 0 HA ILE A 127 15.486 -4.550 5.198 1.00 0.00 H new ATOM 0 HB ILE A 127 14.624 -4.648 7.903 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.602 -3.346 6.044 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.326 -4.826 6.941 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.836 -2.205 7.714 1.00 0.00 H new ATOM 0 HG22 ILE A 127 16.180 -3.040 6.898 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.851 -2.346 5.940 1.00 0.00 H new ATOM 0 HD11 ILE A 127 11.366 -2.912 8.093 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.682 -3.630 9.051 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.962 -2.127 8.140 1.00 0.00 H new TER 2025 ILE A 127