USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 923 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 76 GLN : amide:sc= -0.155 X(o=-0.5,f=-0.91) USER MOD Set 1.2: A 79 THR OG1 : rot -12:sc= -0.35 USER MOD Set 2.1: A 27 THR OG1 : rot 1:sc= -0.482! USER MOD Set 2.2: A 28 SER OG : rot 180:sc= 0.00886 USER MOD Single : A 1 MET CE :methyl -155:sc= -0.12 (180deg=-1.18) USER MOD Single : A 1 MET N :NH3+ 130:sc= -0.0502 (180deg=-0.792) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -2.2! C(o=-2.2!,f=-7.7!) USER MOD Single : A 29 ASN : amide:sc= -0.0168 K(o=-0.017,f=-1.6!) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.172 X(o=-0.17,f=-0.29) USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN :FLIP amide:sc= -0.0763 F(o=-0.67,f=-0.076) USER MOD Single : A 52 LYS NZ :NH3+ -161:sc= -0.0268 (180deg=-0.415) USER MOD Single : A 58 GLN : amide:sc= -1.4! X(o=-1.4!,f=-1.5) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot -68:sc= 0.855 USER MOD Single : A 71 GLN : amide:sc= -0.0129 K(o=-0.013,f=-1.9!) USER MOD Single : A 75 SER OG : rot 65:sc= 0.13 USER MOD Single : A 80 SER OG : rot -53:sc= 0.756 USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= -0.0593 (180deg=-0.467) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 160:sc= -0.0321 (180deg=-0.397) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 146:sc= -0.391 (180deg=-1.52!) USER MOD Single : A 92 ASN : amide:sc=-0.00844 K(o=-0.0084,f=-10!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 MET CE :methyl -152:sc= -0.234 (180deg=-1.33!) USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 103 CYS SG : rot -41:sc= -2.39! USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.378 22.300 18.345 1.00 0.00 N ATOM 2 CA MET A 1 27.011 22.855 18.132 1.00 0.00 C ATOM 3 C MET A 1 26.471 23.392 19.454 1.00 0.00 C ATOM 4 O MET A 1 27.200 23.486 20.441 1.00 0.00 O ATOM 5 CB MET A 1 26.093 21.754 17.599 1.00 0.00 C ATOM 6 CG MET A 1 25.948 20.653 18.653 1.00 0.00 C ATOM 7 SD MET A 1 25.073 19.243 17.933 1.00 0.00 S ATOM 8 CE MET A 1 23.494 20.079 17.641 1.00 0.00 C ATOM 0 H1 MET A 1 28.433 21.345 17.936 1.00 0.00 H new ATOM 0 H2 MET A 1 29.078 22.915 17.883 1.00 0.00 H new ATOM 0 H3 MET A 1 28.578 22.252 19.364 1.00 0.00 H new ATOM 0 HA MET A 1 27.052 23.668 17.407 1.00 0.00 H new ATOM 0 HB2 MET A 1 25.115 22.168 17.354 1.00 0.00 H new ATOM 0 HB3 MET A 1 26.503 21.339 16.678 1.00 0.00 H new ATOM 0 HG2 MET A 1 26.931 20.342 19.008 1.00 0.00 H new ATOM 0 HG3 MET A 1 25.402 21.031 19.517 1.00 0.00 H new ATOM 0 HE1 MET A 1 22.690 19.343 17.623 1.00 0.00 H new ATOM 0 HE2 MET A 1 23.310 20.798 18.439 1.00 0.00 H new ATOM 0 HE3 MET A 1 23.530 20.600 16.684 1.00 0.00 H new ATOM 18 N SER A 2 25.189 23.738 19.464 1.00 0.00 N ATOM 19 CA SER A 2 24.559 24.263 20.671 1.00 0.00 C ATOM 20 C SER A 2 25.438 25.335 21.308 1.00 0.00 C ATOM 21 O SER A 2 25.578 26.436 20.776 1.00 0.00 O ATOM 22 CB SER A 2 24.323 23.130 21.670 1.00 0.00 C ATOM 23 OG SER A 2 23.230 22.336 21.231 1.00 0.00 O ATOM 0 H SER A 2 24.569 23.666 18.657 1.00 0.00 H new ATOM 0 HA SER A 2 23.603 24.709 20.398 1.00 0.00 H new ATOM 0 HB2 SER A 2 25.220 22.517 21.760 1.00 0.00 H new ATOM 0 HB3 SER A 2 24.116 23.539 22.659 1.00 0.00 H new ATOM 0 HG SER A 2 23.078 21.608 21.869 1.00 0.00 H new ATOM 29 N ALA A 3 26.029 25.006 22.454 1.00 0.00 N ATOM 30 CA ALA A 3 26.892 25.948 23.155 1.00 0.00 C ATOM 31 C ALA A 3 28.176 26.185 22.368 1.00 0.00 C ATOM 32 O ALA A 3 28.783 25.247 21.854 1.00 0.00 O ATOM 33 CB ALA A 3 27.234 25.407 24.544 1.00 0.00 C ATOM 0 H ALA A 3 25.926 24.101 22.913 1.00 0.00 H new ATOM 0 HA ALA A 3 26.361 26.895 23.255 1.00 0.00 H new ATOM 0 HB1 ALA A 3 27.879 26.116 25.062 1.00 0.00 H new ATOM 0 HB2 ALA A 3 26.317 25.266 25.116 1.00 0.00 H new ATOM 0 HB3 ALA A 3 27.750 24.452 24.446 1.00 0.00 H new ATOM 39 N THR A 4 28.584 27.445 22.282 1.00 0.00 N ATOM 40 CA THR A 4 29.800 27.798 21.557 1.00 0.00 C ATOM 41 C THR A 4 31.029 27.262 22.284 1.00 0.00 C ATOM 42 O THR A 4 31.954 26.742 21.659 1.00 0.00 O ATOM 43 CB THR A 4 29.907 29.322 21.422 1.00 0.00 C ATOM 44 OG1 THR A 4 31.275 29.692 21.329 1.00 0.00 O ATOM 45 CG2 THR A 4 29.278 29.991 22.646 1.00 0.00 C ATOM 0 H THR A 4 28.095 28.236 22.702 1.00 0.00 H new ATOM 0 HA THR A 4 29.753 27.349 20.565 1.00 0.00 H new ATOM 0 HB THR A 4 29.380 29.645 20.524 1.00 0.00 H new ATOM 0 HG1 THR A 4 31.345 30.666 21.241 1.00 0.00 H new ATOM 0 HG21 THR A 4 29.355 31.074 22.548 1.00 0.00 H new ATOM 0 HG22 THR A 4 28.228 29.707 22.717 1.00 0.00 H new ATOM 0 HG23 THR A 4 29.802 29.670 23.546 1.00 0.00 H new ATOM 53 N ALA A 5 31.034 27.397 23.607 1.00 0.00 N ATOM 54 CA ALA A 5 32.157 26.923 24.408 1.00 0.00 C ATOM 55 C ALA A 5 31.810 26.966 25.893 1.00 0.00 C ATOM 56 O ALA A 5 32.578 26.499 26.735 1.00 0.00 O ATOM 57 CB ALA A 5 33.390 27.792 24.147 1.00 0.00 C ATOM 0 H ALA A 5 30.280 27.827 24.143 1.00 0.00 H new ATOM 0 HA ALA A 5 32.372 25.893 24.124 1.00 0.00 H new ATOM 0 HB1 ALA A 5 34.224 27.431 24.749 1.00 0.00 H new ATOM 0 HB2 ALA A 5 33.655 27.739 23.091 1.00 0.00 H new ATOM 0 HB3 ALA A 5 33.170 28.825 24.415 1.00 0.00 H new ATOM 63 N ALA A 6 30.646 27.527 26.208 1.00 0.00 N ATOM 64 CA ALA A 6 30.206 27.625 27.595 1.00 0.00 C ATOM 65 C ALA A 6 31.249 28.354 28.439 1.00 0.00 C ATOM 66 O ALA A 6 32.126 27.728 29.033 1.00 0.00 O ATOM 67 CB ALA A 6 29.971 26.227 28.167 1.00 0.00 C ATOM 0 H ALA A 6 29.995 27.918 25.527 1.00 0.00 H new ATOM 0 HA ALA A 6 29.274 28.190 27.622 1.00 0.00 H new ATOM 0 HB1 ALA A 6 29.643 26.308 29.203 1.00 0.00 H new ATOM 0 HB2 ALA A 6 29.204 25.719 27.582 1.00 0.00 H new ATOM 0 HB3 ALA A 6 30.898 25.656 28.124 1.00 0.00 H new ATOM 73 N THR A 7 31.146 29.677 28.486 1.00 0.00 N ATOM 74 CA THR A 7 32.082 30.483 29.258 1.00 0.00 C ATOM 75 C THR A 7 31.958 30.167 30.737 1.00 0.00 C ATOM 76 O THR A 7 32.963 29.997 31.431 1.00 0.00 O ATOM 77 CB THR A 7 31.810 31.970 29.028 1.00 0.00 C ATOM 78 OG1 THR A 7 31.721 32.221 27.632 1.00 0.00 O ATOM 79 CG2 THR A 7 32.949 32.796 29.625 1.00 0.00 C ATOM 0 H THR A 7 30.426 30.212 28.000 1.00 0.00 H new ATOM 0 HA THR A 7 33.094 30.247 28.928 1.00 0.00 H new ATOM 0 HB THR A 7 30.872 32.248 29.509 1.00 0.00 H new ATOM 0 HG1 THR A 7 31.545 33.173 27.481 1.00 0.00 H new ATOM 0 HG21 THR A 7 32.755 33.856 29.461 1.00 0.00 H new ATOM 0 HG22 THR A 7 33.018 32.601 30.695 1.00 0.00 H new ATOM 0 HG23 THR A 7 33.888 32.521 29.145 1.00 0.00 H new ATOM 87 N VAL A 8 30.716 30.091 31.222 1.00 0.00 N ATOM 88 CA VAL A 8 30.473 29.795 32.628 1.00 0.00 C ATOM 89 C VAL A 8 29.426 28.688 32.774 1.00 0.00 C ATOM 90 O VAL A 8 28.551 28.537 31.922 1.00 0.00 O ATOM 91 CB VAL A 8 29.992 31.058 33.357 1.00 0.00 C ATOM 92 CG1 VAL A 8 31.198 31.914 33.748 1.00 0.00 C ATOM 93 CG2 VAL A 8 29.079 31.857 32.427 1.00 0.00 C ATOM 0 H VAL A 8 29.873 30.230 30.665 1.00 0.00 H new ATOM 0 HA VAL A 8 31.408 29.454 33.072 1.00 0.00 H new ATOM 0 HB VAL A 8 29.444 30.776 34.256 1.00 0.00 H new ATOM 0 HG11 VAL A 8 30.856 32.810 34.265 1.00 0.00 H new ATOM 0 HG12 VAL A 8 31.852 31.342 34.407 1.00 0.00 H new ATOM 0 HG13 VAL A 8 31.747 32.200 32.851 1.00 0.00 H new ATOM 0 HG21 VAL A 8 28.734 32.755 32.939 1.00 0.00 H new ATOM 0 HG22 VAL A 8 29.631 32.140 31.530 1.00 0.00 H new ATOM 0 HG23 VAL A 8 28.220 31.247 32.147 1.00 0.00 H new ATOM 103 N PRO A 9 29.506 27.928 33.835 1.00 0.00 N ATOM 104 CA PRO A 9 28.555 26.823 34.100 1.00 0.00 C ATOM 105 C PRO A 9 27.125 27.170 33.671 1.00 0.00 C ATOM 106 O PRO A 9 26.752 28.342 33.620 1.00 0.00 O ATOM 107 CB PRO A 9 28.640 26.627 35.619 1.00 0.00 C ATOM 108 CG PRO A 9 30.016 27.091 36.007 1.00 0.00 C ATOM 109 CD PRO A 9 30.513 28.032 34.901 1.00 0.00 C ATOM 0 HA PRO A 9 28.806 25.925 33.535 1.00 0.00 H new ATOM 0 HB2 PRO A 9 27.872 27.205 36.133 1.00 0.00 H new ATOM 0 HB3 PRO A 9 28.487 25.582 35.889 1.00 0.00 H new ATOM 0 HG2 PRO A 9 29.990 27.607 36.967 1.00 0.00 H new ATOM 0 HG3 PRO A 9 30.690 26.242 36.120 1.00 0.00 H new ATOM 0 HD2 PRO A 9 30.600 29.056 35.263 1.00 0.00 H new ATOM 0 HD3 PRO A 9 31.499 27.735 34.543 1.00 0.00 H new ATOM 117 N PRO A 10 26.328 26.174 33.385 1.00 0.00 N ATOM 118 CA PRO A 10 24.910 26.374 32.967 1.00 0.00 C ATOM 119 C PRO A 10 24.052 26.922 34.101 1.00 0.00 C ATOM 120 O PRO A 10 24.321 26.676 35.275 1.00 0.00 O ATOM 121 CB PRO A 10 24.452 24.967 32.551 1.00 0.00 C ATOM 122 CG PRO A 10 25.352 24.028 33.293 1.00 0.00 C ATOM 123 CD PRO A 10 26.687 24.747 33.431 1.00 0.00 C ATOM 0 HA PRO A 10 24.815 27.107 32.166 1.00 0.00 H new ATOM 0 HB2 PRO A 10 23.407 24.800 32.811 1.00 0.00 H new ATOM 0 HB3 PRO A 10 24.538 24.827 31.473 1.00 0.00 H new ATOM 0 HG2 PRO A 10 24.938 23.782 34.271 1.00 0.00 H new ATOM 0 HG3 PRO A 10 25.469 23.089 32.751 1.00 0.00 H new ATOM 0 HD2 PRO A 10 27.184 24.490 34.366 1.00 0.00 H new ATOM 0 HD3 PRO A 10 27.369 24.481 32.624 1.00 0.00 H new ATOM 131 N ALA A 11 23.004 27.658 33.739 1.00 0.00 N ATOM 132 CA ALA A 11 22.099 28.232 34.733 1.00 0.00 C ATOM 133 C ALA A 11 20.651 28.120 34.266 1.00 0.00 C ATOM 134 O ALA A 11 19.750 28.702 34.870 1.00 0.00 O ATOM 135 CB ALA A 11 22.451 29.701 34.965 1.00 0.00 C ATOM 0 H ALA A 11 22.761 27.870 32.771 1.00 0.00 H new ATOM 0 HA ALA A 11 22.210 27.679 35.665 1.00 0.00 H new ATOM 0 HB1 ALA A 11 21.774 30.125 35.707 1.00 0.00 H new ATOM 0 HB2 ALA A 11 23.477 29.777 35.325 1.00 0.00 H new ATOM 0 HB3 ALA A 11 22.354 30.251 34.029 1.00 0.00 H new ATOM 141 N ALA A 12 20.434 27.368 33.193 1.00 0.00 N ATOM 142 CA ALA A 12 19.089 27.190 32.658 1.00 0.00 C ATOM 143 C ALA A 12 19.053 26.018 31.683 1.00 0.00 C ATOM 144 O ALA A 12 18.955 26.203 30.472 1.00 0.00 O ATOM 145 CB ALA A 12 18.637 28.463 31.942 1.00 0.00 C ATOM 0 H ALA A 12 21.165 26.875 32.680 1.00 0.00 H new ATOM 0 HA ALA A 12 18.414 26.982 33.488 1.00 0.00 H new ATOM 0 HB1 ALA A 12 17.632 28.320 31.546 1.00 0.00 H new ATOM 0 HB2 ALA A 12 18.635 29.295 32.646 1.00 0.00 H new ATOM 0 HB3 ALA A 12 19.322 28.682 31.123 1.00 0.00 H new ATOM 151 N PRO A 13 19.132 24.821 32.195 1.00 0.00 N ATOM 152 CA PRO A 13 19.110 23.582 31.361 1.00 0.00 C ATOM 153 C PRO A 13 17.833 23.472 30.530 1.00 0.00 C ATOM 154 O PRO A 13 16.752 23.848 30.983 1.00 0.00 O ATOM 155 CB PRO A 13 19.197 22.440 32.393 1.00 0.00 C ATOM 156 CG PRO A 13 19.753 23.072 33.632 1.00 0.00 C ATOM 157 CD PRO A 13 19.257 24.513 33.626 1.00 0.00 C ATOM 0 HA PRO A 13 19.923 23.564 30.635 1.00 0.00 H new ATOM 0 HB2 PRO A 13 18.216 22.003 32.580 1.00 0.00 H new ATOM 0 HB3 PRO A 13 19.842 21.636 32.038 1.00 0.00 H new ATOM 0 HG2 PRO A 13 19.414 22.546 34.524 1.00 0.00 H new ATOM 0 HG3 PRO A 13 20.842 23.034 33.634 1.00 0.00 H new ATOM 0 HD2 PRO A 13 18.303 24.612 34.144 1.00 0.00 H new ATOM 0 HD3 PRO A 13 19.960 25.183 34.122 1.00 0.00 H new ATOM 165 N ALA A 14 17.967 22.947 29.318 1.00 0.00 N ATOM 166 CA ALA A 14 16.820 22.786 28.435 1.00 0.00 C ATOM 167 C ALA A 14 15.820 21.801 29.028 1.00 0.00 C ATOM 168 O ALA A 14 14.633 21.838 28.706 1.00 0.00 O ATOM 169 CB ALA A 14 17.279 22.290 27.065 1.00 0.00 C ATOM 0 H ALA A 14 18.853 22.627 28.927 1.00 0.00 H new ATOM 0 HA ALA A 14 16.334 23.755 28.324 1.00 0.00 H new ATOM 0 HB1 ALA A 14 16.414 22.173 26.412 1.00 0.00 H new ATOM 0 HB2 ALA A 14 17.968 23.013 26.628 1.00 0.00 H new ATOM 0 HB3 ALA A 14 17.783 21.330 27.176 1.00 0.00 H new ATOM 175 N GLY A 15 16.308 20.917 29.895 1.00 0.00 N ATOM 176 CA GLY A 15 15.446 19.921 30.527 1.00 0.00 C ATOM 177 C GLY A 15 15.447 18.619 29.732 1.00 0.00 C ATOM 178 O GLY A 15 14.664 17.712 30.011 1.00 0.00 O ATOM 0 H GLY A 15 17.288 20.870 30.174 1.00 0.00 H new ATOM 0 HA2 GLY A 15 15.788 19.731 31.544 1.00 0.00 H new ATOM 0 HA3 GLY A 15 14.429 20.307 30.599 1.00 0.00 H new ATOM 182 N GLU A 16 16.330 18.535 28.742 1.00 0.00 N ATOM 183 CA GLU A 16 16.420 17.337 27.916 1.00 0.00 C ATOM 184 C GLU A 16 15.055 16.980 27.340 1.00 0.00 C ATOM 185 O GLU A 16 14.720 17.370 26.223 1.00 0.00 O ATOM 186 CB GLU A 16 16.953 16.167 28.748 1.00 0.00 C ATOM 187 CG GLU A 16 17.100 14.930 27.857 1.00 0.00 C ATOM 188 CD GLU A 16 17.723 13.787 28.649 1.00 0.00 C ATOM 189 OE1 GLU A 16 18.262 14.053 29.711 1.00 0.00 O ATOM 190 OE2 GLU A 16 17.647 12.662 28.186 1.00 0.00 O ATOM 0 H GLU A 16 16.987 19.275 28.494 1.00 0.00 H new ATOM 0 HA GLU A 16 17.106 17.536 27.092 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.916 16.428 29.187 1.00 0.00 H new ATOM 0 HB3 GLU A 16 16.273 15.955 29.573 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.124 14.629 27.475 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.722 15.166 26.993 1.00 0.00 H new ATOM 197 N GLY A 17 14.270 16.229 28.109 1.00 0.00 N ATOM 198 CA GLY A 17 12.946 15.822 27.663 1.00 0.00 C ATOM 199 C GLY A 17 12.053 17.034 27.430 1.00 0.00 C ATOM 200 O GLY A 17 11.781 17.408 26.290 1.00 0.00 O ATOM 0 H GLY A 17 14.528 15.893 29.037 1.00 0.00 H new ATOM 0 HA2 GLY A 17 13.030 15.245 26.742 1.00 0.00 H new ATOM 0 HA3 GLY A 17 12.492 15.169 28.408 1.00 0.00 H new ATOM 204 N GLY A 18 11.606 17.651 28.519 1.00 0.00 N ATOM 205 CA GLY A 18 10.746 18.825 28.420 1.00 0.00 C ATOM 206 C GLY A 18 9.535 18.540 27.545 1.00 0.00 C ATOM 207 O GLY A 18 9.482 17.518 26.861 1.00 0.00 O ATOM 0 H GLY A 18 11.823 17.361 29.473 1.00 0.00 H new ATOM 0 HA2 GLY A 18 10.418 19.125 29.415 1.00 0.00 H new ATOM 0 HA3 GLY A 18 11.311 19.660 28.005 1.00 0.00 H new ATOM 211 N PRO A 19 8.567 19.424 27.561 1.00 0.00 N ATOM 212 CA PRO A 19 7.324 19.275 26.762 1.00 0.00 C ATOM 213 C PRO A 19 7.598 19.377 25.252 1.00 0.00 C ATOM 214 O PRO A 19 7.986 20.441 24.761 1.00 0.00 O ATOM 215 CB PRO A 19 6.420 20.413 27.237 1.00 0.00 C ATOM 216 CG PRO A 19 7.346 21.430 27.813 1.00 0.00 C ATOM 217 CD PRO A 19 8.561 20.662 28.345 1.00 0.00 C ATOM 0 HA PRO A 19 6.868 18.295 26.905 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.842 20.829 26.411 1.00 0.00 H new ATOM 0 HB3 PRO A 19 5.705 20.064 27.982 1.00 0.00 H new ATOM 0 HG2 PRO A 19 7.646 22.154 27.056 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.860 21.988 28.613 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.483 21.227 28.206 1.00 0.00 H new ATOM 0 HD3 PRO A 19 8.469 20.459 29.412 1.00 0.00 H new ATOM 225 N PRO A 20 7.396 18.313 24.517 1.00 0.00 N ATOM 226 CA PRO A 20 7.621 18.301 23.044 1.00 0.00 C ATOM 227 C PRO A 20 6.921 19.469 22.347 1.00 0.00 C ATOM 228 O PRO A 20 7.466 20.063 21.417 1.00 0.00 O ATOM 229 CB PRO A 20 7.014 16.959 22.600 1.00 0.00 C ATOM 230 CG PRO A 20 7.064 16.082 23.810 1.00 0.00 C ATOM 231 CD PRO A 20 6.944 17.001 25.011 1.00 0.00 C ATOM 0 HA PRO A 20 8.675 18.407 22.787 1.00 0.00 H new ATOM 0 HB2 PRO A 20 5.990 17.088 22.250 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.580 16.525 21.776 1.00 0.00 H new ATOM 0 HG2 PRO A 20 6.253 15.354 23.796 1.00 0.00 H new ATOM 0 HG3 PRO A 20 7.997 15.519 23.843 1.00 0.00 H new ATOM 0 HD2 PRO A 20 5.918 17.046 25.376 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.562 16.654 25.840 1.00 0.00 H new ATOM 239 N ALA A 21 5.714 19.789 22.806 1.00 0.00 N ATOM 240 CA ALA A 21 4.956 20.881 22.219 1.00 0.00 C ATOM 241 C ALA A 21 3.596 21.021 22.903 1.00 0.00 C ATOM 242 O ALA A 21 3.098 20.077 23.518 1.00 0.00 O ATOM 243 CB ALA A 21 4.759 20.634 20.707 1.00 0.00 C ATOM 0 H ALA A 21 5.246 19.310 23.576 1.00 0.00 H new ATOM 0 HA ALA A 21 5.515 21.806 22.363 1.00 0.00 H new ATOM 0 HB1 ALA A 21 4.190 21.457 20.275 1.00 0.00 H new ATOM 0 HB2 ALA A 21 5.732 20.570 20.219 1.00 0.00 H new ATOM 0 HB3 ALA A 21 4.216 19.700 20.559 1.00 0.00 H new ATOM 249 N PRO A 22 2.995 22.174 22.789 1.00 0.00 N ATOM 250 CA PRO A 22 1.666 22.447 23.396 1.00 0.00 C ATOM 251 C PRO A 22 0.560 21.585 22.782 1.00 0.00 C ATOM 252 O PRO A 22 0.738 21.005 21.711 1.00 0.00 O ATOM 253 CB PRO A 22 1.422 23.943 23.109 1.00 0.00 C ATOM 254 CG PRO A 22 2.307 24.266 21.950 1.00 0.00 C ATOM 255 CD PRO A 22 3.517 23.346 22.069 1.00 0.00 C ATOM 0 HA PRO A 22 1.652 22.209 24.460 1.00 0.00 H new ATOM 0 HB2 PRO A 22 0.375 24.133 22.871 1.00 0.00 H new ATOM 0 HB3 PRO A 22 1.668 24.556 23.976 1.00 0.00 H new ATOM 0 HG2 PRO A 22 1.787 24.104 21.006 1.00 0.00 H new ATOM 0 HG3 PRO A 22 2.610 25.313 21.972 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.910 23.072 21.090 1.00 0.00 H new ATOM 0 HD3 PRO A 22 4.330 23.823 22.616 1.00 0.00 H new ATOM 263 N PRO A 23 -0.566 21.508 23.440 1.00 0.00 N ATOM 264 CA PRO A 23 -1.725 20.724 22.952 1.00 0.00 C ATOM 265 C PRO A 23 -1.989 20.946 21.460 1.00 0.00 C ATOM 266 O PRO A 23 -1.283 21.698 20.793 1.00 0.00 O ATOM 267 CB PRO A 23 -2.902 21.231 23.800 1.00 0.00 C ATOM 268 CG PRO A 23 -2.293 21.754 25.061 1.00 0.00 C ATOM 269 CD PRO A 23 -0.855 22.161 24.729 1.00 0.00 C ATOM 0 HA PRO A 23 -1.558 19.651 23.052 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -3.454 22.013 23.278 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -3.609 20.428 24.010 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -2.858 22.607 25.437 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -2.308 20.993 25.841 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -0.758 23.244 24.654 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -0.162 21.832 25.503 1.00 0.00 H new ATOM 277 N PRO A 24 -3.005 20.315 20.935 1.00 0.00 N ATOM 278 CA PRO A 24 -3.374 20.444 19.495 1.00 0.00 C ATOM 279 C PRO A 24 -3.745 21.878 19.122 1.00 0.00 C ATOM 280 O PRO A 24 -4.313 22.612 19.927 1.00 0.00 O ATOM 281 CB PRO A 24 -4.584 19.500 19.339 1.00 0.00 C ATOM 282 CG PRO A 24 -4.533 18.592 20.525 1.00 0.00 C ATOM 283 CD PRO A 24 -3.920 19.408 21.644 1.00 0.00 C ATOM 0 HA PRO A 24 -2.544 20.188 18.836 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -5.519 20.060 19.313 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.525 18.935 18.409 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -5.530 18.245 20.795 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -3.934 17.706 20.314 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.677 19.957 22.204 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.390 18.778 22.358 1.00 0.00 H new ATOM 291 N ASN A 25 -3.428 22.261 17.890 1.00 0.00 N ATOM 292 CA ASN A 25 -3.739 23.605 17.415 1.00 0.00 C ATOM 293 C ASN A 25 -5.186 23.685 16.939 1.00 0.00 C ATOM 294 O ASN A 25 -5.471 23.517 15.754 1.00 0.00 O ATOM 295 CB ASN A 25 -2.801 23.981 16.266 1.00 0.00 C ATOM 296 CG ASN A 25 -2.983 23.011 15.104 1.00 0.00 C ATOM 297 OD1 ASN A 25 -3.709 22.023 15.224 1.00 0.00 O ATOM 298 ND2 ASN A 25 -2.365 23.236 13.976 1.00 0.00 N ATOM 0 H ASN A 25 -2.960 21.666 17.207 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.602 24.303 18.241 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -3.007 24.999 15.936 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -1.767 23.960 16.609 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -2.483 22.593 13.193 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -1.764 24.054 13.878 1.00 0.00 H new ATOM 305 N LEU A 26 -6.096 23.945 17.872 1.00 0.00 N ATOM 306 CA LEU A 26 -7.510 24.048 17.537 1.00 0.00 C ATOM 307 C LEU A 26 -7.753 25.209 16.584 1.00 0.00 C ATOM 308 O LEU A 26 -8.527 25.089 15.632 1.00 0.00 O ATOM 309 CB LEU A 26 -8.333 24.250 18.811 1.00 0.00 C ATOM 310 CG LEU A 26 -8.272 22.980 19.670 1.00 0.00 C ATOM 311 CD1 LEU A 26 -8.843 23.276 21.059 1.00 0.00 C ATOM 312 CD2 LEU A 26 -9.086 21.855 19.007 1.00 0.00 C ATOM 0 H LEU A 26 -5.881 24.087 18.859 1.00 0.00 H new ATOM 0 HA LEU A 26 -7.816 23.123 17.048 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -7.948 25.101 19.374 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -9.368 24.479 18.555 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.234 22.660 19.762 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.800 22.374 21.670 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -8.257 24.064 21.533 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -9.879 23.601 20.965 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.037 20.958 19.624 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.125 22.169 18.906 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -8.674 21.640 18.021 1.00 0.00 H new ATOM 324 N THR A 27 -7.093 26.329 16.847 1.00 0.00 N ATOM 325 CA THR A 27 -7.244 27.509 16.002 1.00 0.00 C ATOM 326 C THR A 27 -8.719 27.850 15.815 1.00 0.00 C ATOM 327 O THR A 27 -9.453 28.028 16.788 1.00 0.00 O ATOM 328 CB THR A 27 -6.595 27.262 14.638 1.00 0.00 C ATOM 329 OG1 THR A 27 -7.287 26.218 13.967 1.00 0.00 O ATOM 330 CG2 THR A 27 -5.133 26.866 14.830 1.00 0.00 C ATOM 0 H THR A 27 -6.452 26.447 17.632 1.00 0.00 H new ATOM 0 HA THR A 27 -6.750 28.349 16.491 1.00 0.00 H new ATOM 0 HB THR A 27 -6.646 28.173 14.042 1.00 0.00 H new ATOM 0 HG1 THR A 27 -8.033 25.911 14.523 1.00 0.00 H new ATOM 0 HG21 THR A 27 -4.673 26.691 13.858 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.603 27.669 15.343 1.00 0.00 H new ATOM 0 HG23 THR A 27 -5.078 25.956 15.427 1.00 0.00 H new ATOM 338 N SER A 28 -9.147 27.936 14.559 1.00 0.00 N ATOM 339 CA SER A 28 -10.536 28.255 14.256 1.00 0.00 C ATOM 340 C SER A 28 -11.430 27.054 14.532 1.00 0.00 C ATOM 341 O SER A 28 -10.969 25.913 14.541 1.00 0.00 O ATOM 342 CB SER A 28 -10.670 28.665 12.790 1.00 0.00 C ATOM 343 OG SER A 28 -10.046 27.686 11.969 1.00 0.00 O ATOM 0 H SER A 28 -8.556 27.790 13.741 1.00 0.00 H new ATOM 0 HA SER A 28 -10.847 29.082 14.894 1.00 0.00 H new ATOM 0 HB2 SER A 28 -11.722 28.763 12.523 1.00 0.00 H new ATOM 0 HB3 SER A 28 -10.208 29.639 12.629 1.00 0.00 H new ATOM 0 HG SER A 28 -10.132 27.945 11.028 1.00 0.00 H new ATOM 349 N ASN A 29 -12.715 27.315 14.756 1.00 0.00 N ATOM 350 CA ASN A 29 -13.671 26.244 15.034 1.00 0.00 C ATOM 351 C ASN A 29 -14.505 25.943 13.797 1.00 0.00 C ATOM 352 O ASN A 29 -15.016 26.852 13.143 1.00 0.00 O ATOM 353 CB ASN A 29 -14.593 26.653 16.183 1.00 0.00 C ATOM 354 CG ASN A 29 -13.797 26.738 17.481 1.00 0.00 C ATOM 355 OD1 ASN A 29 -12.773 26.072 17.628 1.00 0.00 O ATOM 356 ND2 ASN A 29 -14.208 27.527 18.437 1.00 0.00 N ATOM 0 H ASN A 29 -13.118 28.252 14.751 1.00 0.00 H new ATOM 0 HA ASN A 29 -13.116 25.349 15.315 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -15.055 27.616 15.965 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -15.401 25.929 16.288 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -13.680 27.592 19.307 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -15.057 28.078 18.313 1.00 0.00 H new ATOM 363 N ARG A 30 -14.639 24.658 13.476 1.00 0.00 N ATOM 364 CA ARG A 30 -15.419 24.243 12.309 1.00 0.00 C ATOM 365 C ARG A 30 -16.294 23.042 12.648 1.00 0.00 C ATOM 366 O ARG A 30 -15.897 22.172 13.417 1.00 0.00 O ATOM 367 CB ARG A 30 -14.476 23.883 11.157 1.00 0.00 C ATOM 368 CG ARG A 30 -13.724 25.135 10.703 1.00 0.00 C ATOM 369 CD ARG A 30 -12.730 24.764 9.601 1.00 0.00 C ATOM 370 NE ARG A 30 -13.442 24.330 8.404 1.00 0.00 N ATOM 371 CZ ARG A 30 -12.784 23.896 7.334 1.00 0.00 C ATOM 372 NH1 ARG A 30 -11.481 23.852 7.341 1.00 0.00 N ATOM 373 NH2 ARG A 30 -13.444 23.516 6.274 1.00 0.00 N ATOM 0 H ARG A 30 -14.222 23.890 14.002 1.00 0.00 H new ATOM 0 HA ARG A 30 -16.062 25.071 12.010 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -13.769 23.117 11.477 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -15.043 23.465 10.325 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -14.428 25.881 10.336 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -13.198 25.581 11.547 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -12.099 25.622 9.367 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -12.071 23.969 9.949 1.00 0.00 H new ATOM 0 HE ARG A 30 -14.461 24.360 8.388 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -10.965 24.151 8.169 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -10.978 23.519 6.519 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -14.463 23.552 6.268 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -12.940 23.183 5.452 1.00 0.00 H new ATOM 387 N ARG A 31 -17.486 23.003 12.065 1.00 0.00 N ATOM 388 CA ARG A 31 -18.409 21.904 12.309 1.00 0.00 C ATOM 389 C ARG A 31 -17.838 20.594 11.772 1.00 0.00 C ATOM 390 O ARG A 31 -18.009 19.536 12.377 1.00 0.00 O ATOM 391 CB ARG A 31 -19.754 22.187 11.638 1.00 0.00 C ATOM 392 CG ARG A 31 -20.466 23.320 12.378 1.00 0.00 C ATOM 393 CD ARG A 31 -21.806 23.612 11.701 1.00 0.00 C ATOM 394 NE ARG A 31 -22.476 24.724 12.365 1.00 0.00 N ATOM 395 CZ ARG A 31 -23.001 24.585 13.578 1.00 0.00 C ATOM 396 NH1 ARG A 31 -22.920 23.440 14.196 1.00 0.00 N ATOM 397 NH2 ARG A 31 -23.599 25.594 14.149 1.00 0.00 N ATOM 0 H ARG A 31 -17.834 23.716 11.424 1.00 0.00 H new ATOM 0 HA ARG A 31 -18.554 21.812 13.385 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -19.601 22.460 10.594 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -20.372 21.289 11.645 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -20.626 23.043 13.420 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -19.844 24.215 12.378 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -21.646 23.850 10.650 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -22.439 22.725 11.734 1.00 0.00 H new ATOM 0 HE ARG A 31 -22.543 25.624 11.890 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -22.454 22.651 13.749 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -23.323 23.333 15.127 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -23.664 26.489 13.665 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -24.002 25.488 15.080 1.00 0.00 H new ATOM 411 N LEU A 32 -17.165 20.671 10.628 1.00 0.00 N ATOM 412 CA LEU A 32 -16.579 19.489 10.014 1.00 0.00 C ATOM 413 C LEU A 32 -15.327 19.055 10.768 1.00 0.00 C ATOM 414 O LEU A 32 -14.428 18.443 10.192 1.00 0.00 O ATOM 415 CB LEU A 32 -16.222 19.779 8.554 1.00 0.00 C ATOM 416 CG LEU A 32 -17.445 20.353 7.833 1.00 0.00 C ATOM 417 CD1 LEU A 32 -17.073 20.688 6.386 1.00 0.00 C ATOM 418 CD2 LEU A 32 -18.585 19.325 7.845 1.00 0.00 C ATOM 0 H LEU A 32 -17.013 21.537 10.111 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.312 18.683 10.056 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -15.393 20.485 8.505 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -15.892 18.865 8.061 1.00 0.00 H new ATOM 0 HG LEU A 32 -17.773 21.258 8.344 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.943 21.097 5.872 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -16.268 21.423 6.378 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.742 19.783 5.876 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -19.453 19.738 7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -18.261 18.416 7.337 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -18.852 19.090 8.875 1.00 0.00 H new ATOM 430 N GLN A 33 -15.278 19.375 12.054 1.00 0.00 N ATOM 431 CA GLN A 33 -14.130 19.015 12.876 1.00 0.00 C ATOM 432 C GLN A 33 -13.869 17.514 12.803 1.00 0.00 C ATOM 433 O GLN A 33 -12.722 17.077 12.737 1.00 0.00 O ATOM 434 CB GLN A 33 -14.379 19.422 14.332 1.00 0.00 C ATOM 435 CG GLN A 33 -13.120 19.160 15.161 1.00 0.00 C ATOM 436 CD GLN A 33 -13.357 19.567 16.610 1.00 0.00 C ATOM 437 OE1 GLN A 33 -14.402 19.255 17.182 1.00 0.00 O ATOM 438 NE2 GLN A 33 -12.442 20.250 17.243 1.00 0.00 N ATOM 0 H GLN A 33 -16.014 19.880 12.548 1.00 0.00 H new ATOM 0 HA GLN A 33 -13.256 19.544 12.496 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -14.648 20.477 14.384 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -15.218 18.858 14.739 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -12.854 18.104 15.110 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -12.280 19.720 14.750 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -11.577 20.507 16.767 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -12.592 20.526 18.213 1.00 0.00 H new ATOM 447 N GLN A 34 -14.942 16.730 12.821 1.00 0.00 N ATOM 448 CA GLN A 34 -14.819 15.280 12.760 1.00 0.00 C ATOM 449 C GLN A 34 -14.145 14.851 11.460 1.00 0.00 C ATOM 450 O GLN A 34 -13.302 13.957 11.454 1.00 0.00 O ATOM 451 CB GLN A 34 -16.203 14.634 12.855 1.00 0.00 C ATOM 452 CG GLN A 34 -16.769 14.844 14.259 1.00 0.00 C ATOM 453 CD GLN A 34 -18.182 14.274 14.342 1.00 0.00 C ATOM 454 OE1 GLN A 34 -18.645 13.623 13.407 1.00 0.00 O ATOM 455 NE2 GLN A 34 -18.902 14.493 15.408 1.00 0.00 N ATOM 0 H GLN A 34 -15.901 17.073 12.877 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.205 14.952 13.599 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -16.871 15.071 12.113 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.135 13.569 12.635 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -16.128 14.358 14.995 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -16.782 15.907 14.500 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -18.516 15.033 16.182 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -19.851 14.124 15.467 1.00 0.00 H new ATOM 464 N THR A 35 -14.523 15.497 10.361 1.00 0.00 N ATOM 465 CA THR A 35 -13.947 15.174 9.060 1.00 0.00 C ATOM 466 C THR A 35 -12.447 15.462 9.047 1.00 0.00 C ATOM 467 O THR A 35 -11.658 14.663 8.541 1.00 0.00 O ATOM 468 CB THR A 35 -14.634 15.993 7.966 1.00 0.00 C ATOM 469 OG1 THR A 35 -16.043 15.898 8.122 1.00 0.00 O ATOM 470 CG2 THR A 35 -14.233 15.453 6.593 1.00 0.00 C ATOM 0 H THR A 35 -15.220 16.241 10.345 1.00 0.00 H new ATOM 0 HA THR A 35 -14.102 14.112 8.871 1.00 0.00 H new ATOM 0 HB THR A 35 -14.328 17.036 8.046 1.00 0.00 H new ATOM 0 HG1 THR A 35 -16.486 16.423 7.423 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.723 16.038 5.815 1.00 0.00 H new ATOM 0 HG22 THR A 35 -13.152 15.526 6.475 1.00 0.00 H new ATOM 0 HG23 THR A 35 -14.537 14.410 6.509 1.00 0.00 H new ATOM 478 N GLN A 36 -12.065 16.609 9.594 1.00 0.00 N ATOM 479 CA GLN A 36 -10.658 16.995 9.630 1.00 0.00 C ATOM 480 C GLN A 36 -9.827 15.932 10.340 1.00 0.00 C ATOM 481 O GLN A 36 -8.597 15.966 10.302 1.00 0.00 O ATOM 482 CB GLN A 36 -10.502 18.336 10.351 1.00 0.00 C ATOM 483 CG GLN A 36 -11.248 19.424 9.577 1.00 0.00 C ATOM 484 CD GLN A 36 -10.589 19.647 8.219 1.00 0.00 C ATOM 485 OE1 GLN A 36 -9.377 19.851 8.143 1.00 0.00 O ATOM 486 NE2 GLN A 36 -11.316 19.617 7.138 1.00 0.00 N ATOM 0 H GLN A 36 -12.703 17.284 10.016 1.00 0.00 H new ATOM 0 HA GLN A 36 -10.301 17.091 8.604 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -10.895 18.263 11.365 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -9.446 18.594 10.436 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.290 19.135 9.441 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -11.247 20.353 10.147 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -12.320 19.448 7.203 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -10.881 19.763 6.227 1.00 0.00 H new ATOM 495 N ALA A 37 -10.505 14.991 10.987 1.00 0.00 N ATOM 496 CA ALA A 37 -9.818 13.926 11.705 1.00 0.00 C ATOM 497 C ALA A 37 -8.902 13.151 10.764 1.00 0.00 C ATOM 498 O ALA A 37 -7.777 12.806 11.123 1.00 0.00 O ATOM 499 CB ALA A 37 -10.840 12.970 12.323 1.00 0.00 C ATOM 0 H ALA A 37 -11.523 14.944 11.029 1.00 0.00 H new ATOM 0 HA ALA A 37 -9.215 14.375 12.494 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -10.319 12.176 12.858 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -11.477 13.518 13.017 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -11.453 12.534 11.535 1.00 0.00 H new ATOM 505 N GLN A 38 -9.389 12.885 9.557 1.00 0.00 N ATOM 506 CA GLN A 38 -8.602 12.152 8.571 1.00 0.00 C ATOM 507 C GLN A 38 -7.380 12.963 8.152 1.00 0.00 C ATOM 508 O GLN A 38 -6.297 12.414 7.949 1.00 0.00 O ATOM 509 CB GLN A 38 -9.459 11.846 7.342 1.00 0.00 C ATOM 510 CG GLN A 38 -10.574 10.871 7.726 1.00 0.00 C ATOM 511 CD GLN A 38 -11.476 10.611 6.524 1.00 0.00 C ATOM 512 OE1 GLN A 38 -11.205 11.101 5.427 1.00 0.00 O ATOM 513 NE2 GLN A 38 -12.537 9.865 6.664 1.00 0.00 N ATOM 0 H GLN A 38 -10.317 13.163 9.239 1.00 0.00 H new ATOM 0 HA GLN A 38 -8.267 11.218 9.022 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -9.887 12.767 6.946 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -8.842 11.416 6.553 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -10.143 9.933 8.078 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -11.160 11.281 8.549 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -12.759 9.460 7.573 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -13.144 9.686 5.864 1.00 0.00 H new ATOM 522 N VAL A 39 -7.563 14.273 8.020 1.00 0.00 N ATOM 523 CA VAL A 39 -6.471 15.152 7.623 1.00 0.00 C ATOM 524 C VAL A 39 -5.394 15.191 8.700 1.00 0.00 C ATOM 525 O VAL A 39 -4.243 15.517 8.423 1.00 0.00 O ATOM 526 CB VAL A 39 -6.999 16.566 7.374 1.00 0.00 C ATOM 527 CG1 VAL A 39 -5.835 17.491 7.008 1.00 0.00 C ATOM 528 CG2 VAL A 39 -8.010 16.539 6.225 1.00 0.00 C ATOM 0 H VAL A 39 -8.452 14.746 8.181 1.00 0.00 H new ATOM 0 HA VAL A 39 -6.034 14.762 6.704 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.485 16.935 8.277 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.212 18.498 6.831 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.116 17.512 7.827 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.347 17.122 6.106 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.386 17.547 6.048 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.525 16.169 5.322 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.840 15.883 6.486 1.00 0.00 H new ATOM 538 N ASP A 40 -5.781 14.857 9.926 1.00 0.00 N ATOM 539 CA ASP A 40 -4.843 14.856 11.045 1.00 0.00 C ATOM 540 C ASP A 40 -3.734 13.837 10.811 1.00 0.00 C ATOM 541 O ASP A 40 -2.599 14.025 11.247 1.00 0.00 O ATOM 542 CB ASP A 40 -5.579 14.530 12.345 1.00 0.00 C ATOM 543 CG ASP A 40 -4.675 14.812 13.539 1.00 0.00 C ATOM 544 OD1 ASP A 40 -3.701 15.527 13.365 1.00 0.00 O ATOM 545 OD2 ASP A 40 -4.969 14.310 14.612 1.00 0.00 O ATOM 0 H ASP A 40 -6.733 14.584 10.171 1.00 0.00 H new ATOM 0 HA ASP A 40 -4.397 15.848 11.123 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.488 15.127 12.418 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -5.884 13.483 12.348 1.00 0.00 H new ATOM 550 N GLU A 41 -4.073 12.748 10.129 1.00 0.00 N ATOM 551 CA GLU A 41 -3.097 11.705 9.840 1.00 0.00 C ATOM 552 C GLU A 41 -2.201 12.113 8.675 1.00 0.00 C ATOM 553 O GLU A 41 -1.023 11.765 8.635 1.00 0.00 O ATOM 554 CB GLU A 41 -3.815 10.397 9.503 1.00 0.00 C ATOM 555 CG GLU A 41 -4.514 9.861 10.755 1.00 0.00 C ATOM 556 CD GLU A 41 -5.312 8.608 10.410 1.00 0.00 C ATOM 557 OE1 GLU A 41 -5.245 8.182 9.270 1.00 0.00 O ATOM 558 OE2 GLU A 41 -5.979 8.095 11.294 1.00 0.00 O ATOM 0 H GLU A 41 -5.010 12.566 9.768 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.476 11.561 10.724 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.544 10.564 8.710 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -3.100 9.663 9.130 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -3.776 9.632 11.524 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.177 10.623 11.166 1.00 0.00 H new ATOM 565 N VAL A 42 -2.773 12.838 7.719 1.00 0.00 N ATOM 566 CA VAL A 42 -2.017 13.271 6.550 1.00 0.00 C ATOM 567 C VAL A 42 -0.862 14.178 6.956 1.00 0.00 C ATOM 568 O VAL A 42 0.267 14.001 6.502 1.00 0.00 O ATOM 569 CB VAL A 42 -2.941 14.017 5.581 1.00 0.00 C ATOM 570 CG1 VAL A 42 -2.121 14.568 4.412 1.00 0.00 C ATOM 571 CG2 VAL A 42 -4.006 13.056 5.047 1.00 0.00 C ATOM 0 H VAL A 42 -3.749 13.136 7.730 1.00 0.00 H new ATOM 0 HA VAL A 42 -1.608 12.388 6.059 1.00 0.00 H new ATOM 0 HB VAL A 42 -3.425 14.841 6.106 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.779 15.098 3.724 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -1.363 15.254 4.791 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -1.636 13.745 3.888 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.663 13.587 4.358 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -3.522 12.231 4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -4.592 12.665 5.878 1.00 0.00 H new ATOM 581 N VAL A 43 -1.153 15.145 7.815 1.00 0.00 N ATOM 582 CA VAL A 43 -0.132 16.076 8.276 1.00 0.00 C ATOM 583 C VAL A 43 0.997 15.326 8.974 1.00 0.00 C ATOM 584 O VAL A 43 2.172 15.633 8.783 1.00 0.00 O ATOM 585 CB VAL A 43 -0.747 17.092 9.240 1.00 0.00 C ATOM 586 CG1 VAL A 43 -1.625 18.073 8.457 1.00 0.00 C ATOM 587 CG2 VAL A 43 -1.604 16.364 10.278 1.00 0.00 C ATOM 0 H VAL A 43 -2.082 15.305 8.205 1.00 0.00 H new ATOM 0 HA VAL A 43 0.274 16.600 7.411 1.00 0.00 H new ATOM 0 HB VAL A 43 0.051 17.637 9.745 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.063 18.797 9.144 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.017 18.595 7.718 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.420 17.526 7.951 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -2.041 17.090 10.963 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.400 15.817 9.773 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -0.982 15.665 10.838 1.00 0.00 H new ATOM 597 N ASP A 44 0.631 14.342 9.785 1.00 0.00 N ATOM 598 CA ASP A 44 1.621 13.550 10.509 1.00 0.00 C ATOM 599 C ASP A 44 2.525 12.807 9.531 1.00 0.00 C ATOM 600 O ASP A 44 3.741 12.748 9.718 1.00 0.00 O ATOM 601 CB ASP A 44 0.920 12.542 11.422 1.00 0.00 C ATOM 602 CG ASP A 44 0.294 13.263 12.610 1.00 0.00 C ATOM 603 OD1 ASP A 44 0.544 14.448 12.758 1.00 0.00 O ATOM 604 OD2 ASP A 44 -0.430 12.622 13.354 1.00 0.00 O ATOM 0 H ASP A 44 -0.337 14.073 9.959 1.00 0.00 H new ATOM 0 HA ASP A 44 2.228 14.224 11.113 1.00 0.00 H new ATOM 0 HB2 ASP A 44 0.151 12.007 10.864 1.00 0.00 H new ATOM 0 HB3 ASP A 44 1.635 11.798 11.773 1.00 0.00 H new ATOM 609 N ILE A 45 1.925 12.241 8.486 1.00 0.00 N ATOM 610 CA ILE A 45 2.692 11.507 7.488 1.00 0.00 C ATOM 611 C ILE A 45 3.660 12.437 6.762 1.00 0.00 C ATOM 612 O ILE A 45 4.816 12.086 6.527 1.00 0.00 O ATOM 613 CB ILE A 45 1.742 10.859 6.475 1.00 0.00 C ATOM 614 CG1 ILE A 45 0.939 9.755 7.168 1.00 0.00 C ATOM 615 CG2 ILE A 45 2.551 10.252 5.325 1.00 0.00 C ATOM 616 CD1 ILE A 45 -0.221 9.328 6.268 1.00 0.00 C ATOM 0 H ILE A 45 0.921 12.277 8.311 1.00 0.00 H new ATOM 0 HA ILE A 45 3.267 10.732 7.995 1.00 0.00 H new ATOM 0 HB ILE A 45 1.063 11.615 6.080 1.00 0.00 H new ATOM 0 HG12 ILE A 45 1.582 8.901 7.380 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.559 10.113 8.125 1.00 0.00 H new ATOM 0 HG21 ILE A 45 1.873 9.792 4.606 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.126 11.036 4.831 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.231 9.496 5.718 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.793 8.542 6.761 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.869 10.184 6.078 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.171 8.953 5.322 1.00 0.00 H new ATOM 628 N MET A 46 3.176 13.622 6.405 1.00 0.00 N ATOM 629 CA MET A 46 4.002 14.592 5.699 1.00 0.00 C ATOM 630 C MET A 46 5.162 15.042 6.578 1.00 0.00 C ATOM 631 O MET A 46 6.281 15.227 6.101 1.00 0.00 O ATOM 632 CB MET A 46 3.161 15.804 5.297 1.00 0.00 C ATOM 633 CG MET A 46 4.023 16.784 4.499 1.00 0.00 C ATOM 634 SD MET A 46 2.988 18.131 3.874 1.00 0.00 S ATOM 635 CE MET A 46 3.110 19.205 5.324 1.00 0.00 C ATOM 0 H MET A 46 2.222 13.932 6.592 1.00 0.00 H new ATOM 0 HA MET A 46 4.401 14.118 4.802 1.00 0.00 H new ATOM 0 HB2 MET A 46 2.307 15.485 4.699 1.00 0.00 H new ATOM 0 HB3 MET A 46 2.763 16.294 6.185 1.00 0.00 H new ATOM 0 HG2 MET A 46 4.816 17.184 5.130 1.00 0.00 H new ATOM 0 HG3 MET A 46 4.506 16.268 3.669 1.00 0.00 H new ATOM 0 HE1 MET A 46 2.533 20.114 5.153 1.00 0.00 H new ATOM 0 HE2 MET A 46 2.716 18.684 6.197 1.00 0.00 H new ATOM 0 HE3 MET A 46 4.154 19.465 5.497 1.00 0.00 H new ATOM 645 N ARG A 47 4.886 15.222 7.864 1.00 0.00 N ATOM 646 CA ARG A 47 5.912 15.660 8.797 1.00 0.00 C ATOM 647 C ARG A 47 7.083 14.681 8.806 1.00 0.00 C ATOM 648 O ARG A 47 8.244 15.089 8.797 1.00 0.00 O ATOM 649 CB ARG A 47 5.324 15.765 10.207 1.00 0.00 C ATOM 650 CG ARG A 47 6.311 16.510 11.128 1.00 0.00 C ATOM 651 CD ARG A 47 6.029 18.015 11.070 1.00 0.00 C ATOM 652 NE ARG A 47 4.721 18.300 11.646 1.00 0.00 N ATOM 653 CZ ARG A 47 4.100 19.450 11.402 1.00 0.00 C ATOM 654 NH1 ARG A 47 4.663 20.344 10.637 1.00 0.00 N ATOM 655 NH2 ARG A 47 2.931 19.684 11.929 1.00 0.00 N ATOM 0 H ARG A 47 3.967 15.072 8.280 1.00 0.00 H new ATOM 0 HA ARG A 47 6.273 16.638 8.478 1.00 0.00 H new ATOM 0 HB2 ARG A 47 4.371 16.294 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 47 5.123 14.769 10.603 1.00 0.00 H new ATOM 0 HG2 ARG A 47 6.212 16.150 12.152 1.00 0.00 H new ATOM 0 HG3 ARG A 47 7.336 16.309 10.818 1.00 0.00 H new ATOM 0 HD2 ARG A 47 6.801 18.559 11.614 1.00 0.00 H new ATOM 0 HD3 ARG A 47 6.063 18.360 10.037 1.00 0.00 H new ATOM 0 HE ARG A 47 4.275 17.606 12.246 1.00 0.00 H new ATOM 0 HH11 ARG A 47 5.579 20.160 10.227 1.00 0.00 H new ATOM 0 HH12 ARG A 47 4.188 21.227 10.449 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.493 18.985 12.529 1.00 0.00 H new ATOM 0 HH22 ARG A 47 2.455 20.566 11.742 1.00 0.00 H new ATOM 669 N VAL A 48 6.771 13.393 8.826 1.00 0.00 N ATOM 670 CA VAL A 48 7.803 12.367 8.837 1.00 0.00 C ATOM 671 C VAL A 48 8.655 12.451 7.574 1.00 0.00 C ATOM 672 O VAL A 48 9.880 12.358 7.633 1.00 0.00 O ATOM 673 CB VAL A 48 7.162 10.981 8.935 1.00 0.00 C ATOM 674 CG1 VAL A 48 8.243 9.904 8.809 1.00 0.00 C ATOM 675 CG2 VAL A 48 6.457 10.837 10.285 1.00 0.00 C ATOM 0 H VAL A 48 5.816 13.035 8.835 1.00 0.00 H new ATOM 0 HA VAL A 48 8.443 12.531 9.704 1.00 0.00 H new ATOM 0 HB VAL A 48 6.436 10.863 8.130 1.00 0.00 H new ATOM 0 HG11 VAL A 48 7.784 8.918 8.879 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.745 10.003 7.846 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.971 10.023 9.612 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.001 9.849 10.354 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.183 10.958 11.089 1.00 0.00 H new ATOM 0 HG23 VAL A 48 5.684 11.601 10.375 1.00 0.00 H new ATOM 685 N ASN A 49 7.996 12.625 6.433 1.00 0.00 N ATOM 686 CA ASN A 49 8.706 12.713 5.160 1.00 0.00 C ATOM 687 C ASN A 49 9.670 13.896 5.176 1.00 0.00 C ATOM 688 O ASN A 49 10.795 13.797 4.688 1.00 0.00 O ATOM 689 CB ASN A 49 7.701 12.880 4.016 1.00 0.00 C ATOM 690 CG ASN A 49 7.049 11.539 3.693 1.00 0.00 C ATOM 691 OD1 ASN A 49 7.793 10.471 3.591 1.00 0.00 O flip ATOM 692 ND2 ASN A 49 5.832 11.464 3.529 1.00 0.00 N flip ATOM 0 H ASN A 49 6.982 12.707 6.362 1.00 0.00 H new ATOM 0 HA ASN A 49 9.275 11.795 5.009 1.00 0.00 H new ATOM 0 HB2 ASN A 49 6.938 13.607 4.295 1.00 0.00 H new ATOM 0 HB3 ASN A 49 8.205 13.271 3.132 1.00 0.00 H new ATOM 0 HD21 ASN A 49 5.254 12.301 3.610 1.00 0.00 H new ATOM 0 HD22 ASN A 49 5.401 10.565 3.313 1.00 0.00 H new ATOM 699 N VAL A 50 9.225 15.010 5.743 1.00 0.00 N ATOM 700 CA VAL A 50 10.060 16.199 5.832 1.00 0.00 C ATOM 701 C VAL A 50 11.239 15.959 6.765 1.00 0.00 C ATOM 702 O VAL A 50 12.365 16.368 6.486 1.00 0.00 O ATOM 703 CB VAL A 50 9.237 17.388 6.324 1.00 0.00 C ATOM 704 CG1 VAL A 50 10.149 18.602 6.516 1.00 0.00 C ATOM 705 CG2 VAL A 50 8.156 17.725 5.293 1.00 0.00 C ATOM 0 H VAL A 50 8.294 15.114 6.147 1.00 0.00 H new ATOM 0 HA VAL A 50 10.445 16.422 4.837 1.00 0.00 H new ATOM 0 HB VAL A 50 8.769 17.131 7.274 1.00 0.00 H new ATOM 0 HG11 VAL A 50 9.559 19.449 6.867 1.00 0.00 H new ATOM 0 HG12 VAL A 50 10.918 18.366 7.251 1.00 0.00 H new ATOM 0 HG13 VAL A 50 10.620 18.857 5.567 1.00 0.00 H new ATOM 0 HG21 VAL A 50 7.569 18.574 5.645 1.00 0.00 H new ATOM 0 HG22 VAL A 50 8.626 17.978 4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 50 7.502 16.864 5.156 1.00 0.00 H new ATOM 715 N ASP A 51 10.964 15.309 7.882 1.00 0.00 N ATOM 716 CA ASP A 51 12.007 15.028 8.869 1.00 0.00 C ATOM 717 C ASP A 51 13.004 14.014 8.318 1.00 0.00 C ATOM 718 O ASP A 51 14.134 13.917 8.796 1.00 0.00 O ATOM 719 CB ASP A 51 11.380 14.479 10.155 1.00 0.00 C ATOM 720 CG ASP A 51 10.614 15.585 10.875 1.00 0.00 C ATOM 721 OD1 ASP A 51 10.754 16.730 10.478 1.00 0.00 O ATOM 722 OD2 ASP A 51 9.900 15.270 11.812 1.00 0.00 O ATOM 0 H ASP A 51 10.037 14.966 8.133 1.00 0.00 H new ATOM 0 HA ASP A 51 12.531 15.958 9.089 1.00 0.00 H new ATOM 0 HB2 ASP A 51 10.708 13.654 9.918 1.00 0.00 H new ATOM 0 HB3 ASP A 51 12.157 14.080 10.807 1.00 0.00 H new ATOM 727 N LYS A 52 12.579 13.255 7.311 1.00 0.00 N ATOM 728 CA LYS A 52 13.442 12.252 6.704 1.00 0.00 C ATOM 729 C LYS A 52 14.604 12.913 5.976 1.00 0.00 C ATOM 730 O LYS A 52 15.762 12.531 6.156 1.00 0.00 O ATOM 731 CB LYS A 52 12.637 11.400 5.721 1.00 0.00 C ATOM 732 CG LYS A 52 13.516 10.267 5.190 1.00 0.00 C ATOM 733 CD LYS A 52 12.689 9.373 4.263 1.00 0.00 C ATOM 734 CE LYS A 52 13.560 8.221 3.755 1.00 0.00 C ATOM 735 NZ LYS A 52 14.655 8.764 2.903 1.00 0.00 N ATOM 0 H LYS A 52 11.647 13.317 6.902 1.00 0.00 H new ATOM 0 HA LYS A 52 13.841 11.616 7.494 1.00 0.00 H new ATOM 0 HB2 LYS A 52 11.756 10.990 6.215 1.00 0.00 H new ATOM 0 HB3 LYS A 52 12.282 12.016 4.895 1.00 0.00 H new ATOM 0 HG2 LYS A 52 14.370 10.677 4.651 1.00 0.00 H new ATOM 0 HG3 LYS A 52 13.913 9.681 6.019 1.00 0.00 H new ATOM 0 HD2 LYS A 52 11.823 8.981 4.796 1.00 0.00 H new ATOM 0 HD3 LYS A 52 12.310 9.954 3.423 1.00 0.00 H new ATOM 0 HE2 LYS A 52 13.979 7.669 4.597 1.00 0.00 H new ATOM 0 HE3 LYS A 52 12.954 7.518 3.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 15.042 8.004 2.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 14.280 9.521 2.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 15.409 9.147 3.509 1.00 0.00 H new ATOM 749 N VAL A 53 14.289 13.906 5.153 1.00 0.00 N ATOM 750 CA VAL A 53 15.312 14.620 4.403 1.00 0.00 C ATOM 751 C VAL A 53 16.083 15.569 5.311 1.00 0.00 C ATOM 752 O VAL A 53 17.253 15.872 5.066 1.00 0.00 O ATOM 753 CB VAL A 53 14.678 15.395 3.249 1.00 0.00 C ATOM 754 CG1 VAL A 53 13.616 16.348 3.800 1.00 0.00 C ATOM 755 CG2 VAL A 53 15.756 16.201 2.518 1.00 0.00 C ATOM 0 H VAL A 53 13.337 14.233 4.989 1.00 0.00 H new ATOM 0 HA VAL A 53 16.011 13.889 3.996 1.00 0.00 H new ATOM 0 HB VAL A 53 14.215 14.695 2.553 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.163 16.902 2.978 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.848 15.775 4.319 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.080 17.047 4.496 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.302 16.753 1.695 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.220 16.901 3.212 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.514 15.523 2.126 1.00 0.00 H new ATOM 765 N LEU A 54 15.411 16.054 6.345 1.00 0.00 N ATOM 766 CA LEU A 54 16.037 16.983 7.265 1.00 0.00 C ATOM 767 C LEU A 54 17.223 16.330 7.966 1.00 0.00 C ATOM 768 O LEU A 54 18.283 16.936 8.120 1.00 0.00 O ATOM 769 CB LEU A 54 15.003 17.458 8.312 1.00 0.00 C ATOM 770 CG LEU A 54 15.321 18.902 8.737 1.00 0.00 C ATOM 771 CD1 LEU A 54 16.778 18.992 9.220 1.00 0.00 C ATOM 772 CD2 LEU A 54 15.109 19.854 7.534 1.00 0.00 C ATOM 0 H LEU A 54 14.442 15.821 6.564 1.00 0.00 H new ATOM 0 HA LEU A 54 16.400 17.841 6.699 1.00 0.00 H new ATOM 0 HB2 LEU A 54 13.998 17.405 7.894 1.00 0.00 H new ATOM 0 HB3 LEU A 54 15.023 16.800 9.181 1.00 0.00 H new ATOM 0 HG LEU A 54 14.656 19.194 9.550 1.00 0.00 H new ATOM 0 HD11 LEU A 54 16.999 20.016 9.520 1.00 0.00 H new ATOM 0 HD12 LEU A 54 16.921 18.326 10.071 1.00 0.00 H new ATOM 0 HD13 LEU A 54 17.448 18.698 8.412 1.00 0.00 H new ATOM 0 HD21 LEU A 54 15.334 20.877 7.835 1.00 0.00 H new ATOM 0 HD22 LEU A 54 15.770 19.562 6.718 1.00 0.00 H new ATOM 0 HD23 LEU A 54 14.073 19.794 7.201 1.00 0.00 H new ATOM 784 N GLU A 55 17.029 15.102 8.399 1.00 0.00 N ATOM 785 CA GLU A 55 18.086 14.376 9.094 1.00 0.00 C ATOM 786 C GLU A 55 19.230 14.064 8.135 1.00 0.00 C ATOM 787 O GLU A 55 20.399 14.276 8.459 1.00 0.00 O ATOM 788 CB GLU A 55 17.533 13.071 9.673 1.00 0.00 C ATOM 789 CG GLU A 55 18.619 12.377 10.500 1.00 0.00 C ATOM 790 CD GLU A 55 18.071 11.091 11.105 1.00 0.00 C ATOM 791 OE1 GLU A 55 17.021 10.653 10.666 1.00 0.00 O ATOM 792 OE2 GLU A 55 18.707 10.565 12.004 1.00 0.00 O ATOM 0 H GLU A 55 16.158 14.583 8.286 1.00 0.00 H new ATOM 0 HA GLU A 55 18.461 15.000 9.905 1.00 0.00 H new ATOM 0 HB2 GLU A 55 16.663 13.277 10.296 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.200 12.416 8.868 1.00 0.00 H new ATOM 0 HG2 GLU A 55 19.480 12.154 9.870 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.966 13.042 11.291 1.00 0.00 H new ATOM 799 N ARG A 56 18.885 13.563 6.955 1.00 0.00 N ATOM 800 CA ARG A 56 19.893 13.224 5.956 1.00 0.00 C ATOM 801 C ARG A 56 20.373 14.478 5.232 1.00 0.00 C ATOM 802 O ARG A 56 19.585 15.381 4.947 1.00 0.00 O ATOM 803 CB ARG A 56 19.311 12.239 4.940 1.00 0.00 C ATOM 804 CG ARG A 56 19.025 10.903 5.628 1.00 0.00 C ATOM 805 CD ARG A 56 18.415 9.929 4.620 1.00 0.00 C ATOM 806 NE ARG A 56 18.134 8.649 5.262 1.00 0.00 N ATOM 807 CZ ARG A 56 17.929 7.551 4.543 1.00 0.00 C ATOM 808 NH1 ARG A 56 17.980 7.606 3.239 1.00 0.00 N ATOM 809 NH2 ARG A 56 17.679 6.417 5.139 1.00 0.00 N ATOM 0 H ARG A 56 17.923 13.383 6.667 1.00 0.00 H new ATOM 0 HA ARG A 56 20.740 12.764 6.464 1.00 0.00 H new ATOM 0 HB2 ARG A 56 18.394 12.643 4.511 1.00 0.00 H new ATOM 0 HB3 ARG A 56 20.011 12.094 4.117 1.00 0.00 H new ATOM 0 HG2 ARG A 56 19.946 10.489 6.038 1.00 0.00 H new ATOM 0 HG3 ARG A 56 18.342 11.052 6.465 1.00 0.00 H new ATOM 0 HD2 ARG A 56 17.496 10.347 4.209 1.00 0.00 H new ATOM 0 HD3 ARG A 56 19.100 9.783 3.785 1.00 0.00 H new ATOM 0 HE ARG A 56 18.094 8.597 6.280 1.00 0.00 H new ATOM 0 HH11 ARG A 56 18.177 8.492 2.773 1.00 0.00 H new ATOM 0 HH12 ARG A 56 17.823 6.763 2.686 1.00 0.00 H new ATOM 0 HH21 ARG A 56 17.641 6.374 6.157 1.00 0.00 H new ATOM 0 HH22 ARG A 56 17.522 5.574 4.586 1.00 0.00 H new ATOM 823 N ASP A 57 21.667 14.527 4.936 1.00 0.00 N ATOM 824 CA ASP A 57 22.239 15.677 4.243 1.00 0.00 C ATOM 825 C ASP A 57 21.783 15.707 2.788 1.00 0.00 C ATOM 826 O ASP A 57 21.577 14.662 2.171 1.00 0.00 O ATOM 827 CB ASP A 57 23.766 15.613 4.301 1.00 0.00 C ATOM 828 CG ASP A 57 24.261 14.346 3.613 1.00 0.00 C ATOM 829 OD1 ASP A 57 23.429 13.548 3.213 1.00 0.00 O ATOM 830 OD2 ASP A 57 25.466 14.188 3.500 1.00 0.00 O ATOM 0 H ASP A 57 22.336 13.791 5.162 1.00 0.00 H new ATOM 0 HA ASP A 57 21.894 16.585 4.738 1.00 0.00 H new ATOM 0 HB2 ASP A 57 24.194 16.491 3.816 1.00 0.00 H new ATOM 0 HB3 ASP A 57 24.100 15.627 5.339 1.00 0.00 H new ATOM 835 N GLN A 58 21.622 16.911 2.247 1.00 0.00 N ATOM 836 CA GLN A 58 21.184 17.065 0.866 1.00 0.00 C ATOM 837 C GLN A 58 22.186 16.421 -0.087 1.00 0.00 C ATOM 838 O GLN A 58 23.321 16.881 -0.214 1.00 0.00 O ATOM 839 CB GLN A 58 21.035 18.550 0.528 1.00 0.00 C ATOM 840 CG GLN A 58 20.413 18.698 -0.861 1.00 0.00 C ATOM 841 CD GLN A 58 20.180 20.172 -1.175 1.00 0.00 C ATOM 842 OE1 GLN A 58 20.115 20.999 -0.264 1.00 0.00 O ATOM 843 NE2 GLN A 58 20.053 20.554 -2.416 1.00 0.00 N ATOM 0 H GLN A 58 21.787 17.788 2.741 1.00 0.00 H new ATOM 0 HA GLN A 58 20.220 16.569 0.751 1.00 0.00 H new ATOM 0 HB2 GLN A 58 20.409 19.042 1.272 1.00 0.00 H new ATOM 0 HB3 GLN A 58 22.008 19.040 0.556 1.00 0.00 H new ATOM 0 HG2 GLN A 58 21.070 18.258 -1.611 1.00 0.00 H new ATOM 0 HG3 GLN A 58 19.469 18.155 -0.905 1.00 0.00 H new ATOM 0 HE21 GLN A 58 20.107 19.868 -3.169 1.00 0.00 H new ATOM 0 HE22 GLN A 58 19.900 21.539 -2.633 1.00 0.00 H new ATOM 852 N LYS A 59 21.758 15.353 -0.754 1.00 0.00 N ATOM 853 CA LYS A 59 22.628 14.650 -1.691 1.00 0.00 C ATOM 854 C LYS A 59 23.032 15.566 -2.841 1.00 0.00 C ATOM 855 O LYS A 59 24.190 15.578 -3.260 1.00 0.00 O ATOM 856 CB LYS A 59 21.908 13.418 -2.247 1.00 0.00 C ATOM 857 CG LYS A 59 21.713 12.393 -1.127 1.00 0.00 C ATOM 858 CD LYS A 59 20.995 11.160 -1.682 1.00 0.00 C ATOM 859 CE LYS A 59 20.811 10.132 -0.566 1.00 0.00 C ATOM 860 NZ LYS A 59 20.122 8.927 -1.109 1.00 0.00 N ATOM 0 H LYS A 59 20.822 14.958 -0.664 1.00 0.00 H new ATOM 0 HA LYS A 59 23.526 14.338 -1.158 1.00 0.00 H new ATOM 0 HB2 LYS A 59 20.943 13.705 -2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 59 22.488 12.980 -3.059 1.00 0.00 H new ATOM 0 HG2 LYS A 59 22.678 12.107 -0.709 1.00 0.00 H new ATOM 0 HG3 LYS A 59 21.131 12.831 -0.316 1.00 0.00 H new ATOM 0 HD2 LYS A 59 20.026 11.444 -2.092 1.00 0.00 H new ATOM 0 HD3 LYS A 59 21.572 10.727 -2.499 1.00 0.00 H new ATOM 0 HE2 LYS A 59 21.779 9.854 -0.150 1.00 0.00 H new ATOM 0 HE3 LYS A 59 20.227 10.563 0.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 19.997 8.227 -0.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 19.192 9.199 -1.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 20.696 8.512 -1.871 1.00 0.00 H new ATOM 874 N LEU A 60 22.074 16.334 -3.346 1.00 0.00 N ATOM 875 CA LEU A 60 22.341 17.250 -4.446 1.00 0.00 C ATOM 876 C LEU A 60 23.304 18.346 -4.005 1.00 0.00 C ATOM 877 O LEU A 60 23.844 18.302 -2.900 1.00 0.00 O ATOM 878 CB LEU A 60 21.033 17.883 -4.928 1.00 0.00 C ATOM 879 CG LEU A 60 20.021 16.780 -5.255 1.00 0.00 C ATOM 880 CD1 LEU A 60 18.701 17.417 -5.694 1.00 0.00 C ATOM 881 CD2 LEU A 60 20.565 15.895 -6.385 1.00 0.00 C ATOM 0 H LEU A 60 21.110 16.340 -3.013 1.00 0.00 H new ATOM 0 HA LEU A 60 22.795 16.687 -5.262 1.00 0.00 H new ATOM 0 HB2 LEU A 60 20.631 18.543 -4.159 1.00 0.00 H new ATOM 0 HB3 LEU A 60 21.217 18.496 -5.811 1.00 0.00 H new ATOM 0 HG LEU A 60 19.854 16.168 -4.369 1.00 0.00 H new ATOM 0 HD11 LEU A 60 17.979 16.634 -5.927 1.00 0.00 H new ATOM 0 HD12 LEU A 60 18.312 18.041 -4.889 1.00 0.00 H new ATOM 0 HD13 LEU A 60 18.870 18.030 -6.579 1.00 0.00 H new ATOM 0 HD21 LEU A 60 19.842 15.112 -6.614 1.00 0.00 H new ATOM 0 HD22 LEU A 60 20.735 16.503 -7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 60 21.505 15.441 -6.071 1.00 0.00 H new ATOM 893 N SER A 61 23.520 19.324 -4.880 1.00 0.00 N ATOM 894 CA SER A 61 24.423 20.427 -4.573 1.00 0.00 C ATOM 895 C SER A 61 25.801 19.896 -4.186 1.00 0.00 C ATOM 896 O SER A 61 26.125 19.788 -3.003 1.00 0.00 O ATOM 897 CB SER A 61 23.856 21.263 -3.424 1.00 0.00 C ATOM 898 OG SER A 61 24.905 22.010 -2.825 1.00 0.00 O ATOM 0 H SER A 61 23.085 19.375 -5.801 1.00 0.00 H new ATOM 0 HA SER A 61 24.521 21.051 -5.461 1.00 0.00 H new ATOM 0 HB2 SER A 61 23.082 21.935 -3.795 1.00 0.00 H new ATOM 0 HB3 SER A 61 23.387 20.614 -2.684 1.00 0.00 H new ATOM 0 HG SER A 61 25.523 21.400 -2.370 1.00 0.00 H new ATOM 904 N GLU A 62 26.607 19.570 -5.189 1.00 0.00 N ATOM 905 CA GLU A 62 27.946 19.049 -4.944 1.00 0.00 C ATOM 906 C GLU A 62 28.718 18.893 -6.254 1.00 0.00 C ATOM 907 O GLU A 62 29.941 18.992 -6.279 1.00 0.00 O ATOM 908 CB GLU A 62 27.858 17.696 -4.236 1.00 0.00 C ATOM 909 CG GLU A 62 27.037 16.725 -5.089 1.00 0.00 C ATOM 910 CD GLU A 62 26.934 15.375 -4.388 1.00 0.00 C ATOM 911 OE1 GLU A 62 27.603 15.198 -3.384 1.00 0.00 O ATOM 912 OE2 GLU A 62 26.186 14.538 -4.865 1.00 0.00 O ATOM 0 H GLU A 62 26.359 19.656 -6.175 1.00 0.00 H new ATOM 0 HA GLU A 62 28.477 19.759 -4.310 1.00 0.00 H new ATOM 0 HB2 GLU A 62 28.858 17.295 -4.070 1.00 0.00 H new ATOM 0 HB3 GLU A 62 27.396 17.816 -3.256 1.00 0.00 H new ATOM 0 HG2 GLU A 62 26.041 17.132 -5.261 1.00 0.00 H new ATOM 0 HG3 GLU A 62 27.504 16.602 -6.066 1.00 0.00 H new ATOM 919 N LEU A 63 27.993 18.647 -7.338 1.00 0.00 N ATOM 920 CA LEU A 63 28.616 18.479 -8.643 1.00 0.00 C ATOM 921 C LEU A 63 29.301 19.776 -9.073 1.00 0.00 C ATOM 922 O LEU A 63 30.389 19.753 -9.641 1.00 0.00 O ATOM 923 CB LEU A 63 27.561 18.084 -9.687 1.00 0.00 C ATOM 924 CG LEU A 63 26.209 18.740 -9.327 1.00 0.00 C ATOM 925 CD1 LEU A 63 25.439 19.062 -10.609 1.00 0.00 C ATOM 926 CD2 LEU A 63 25.383 17.776 -8.459 1.00 0.00 C ATOM 0 H LEU A 63 26.977 18.560 -7.339 1.00 0.00 H new ATOM 0 HA LEU A 63 29.362 17.688 -8.571 1.00 0.00 H new ATOM 0 HB2 LEU A 63 27.879 18.403 -10.680 1.00 0.00 H new ATOM 0 HB3 LEU A 63 27.454 17.000 -9.719 1.00 0.00 H new ATOM 0 HG LEU A 63 26.390 19.661 -8.772 1.00 0.00 H new ATOM 0 HD11 LEU A 63 24.485 19.525 -10.354 1.00 0.00 H new ATOM 0 HD12 LEU A 63 26.023 19.749 -11.222 1.00 0.00 H new ATOM 0 HD13 LEU A 63 25.259 18.142 -11.166 1.00 0.00 H new ATOM 0 HD21 LEU A 63 24.430 18.240 -8.206 1.00 0.00 H new ATOM 0 HD22 LEU A 63 25.202 16.854 -9.011 1.00 0.00 H new ATOM 0 HD23 LEU A 63 25.931 17.550 -7.544 1.00 0.00 H new ATOM 938 N ASP A 64 28.642 20.901 -8.808 1.00 0.00 N ATOM 939 CA ASP A 64 29.192 22.199 -9.180 1.00 0.00 C ATOM 940 C ASP A 64 30.470 22.478 -8.399 1.00 0.00 C ATOM 941 O ASP A 64 31.389 23.123 -8.902 1.00 0.00 O ATOM 942 CB ASP A 64 28.169 23.302 -8.905 1.00 0.00 C ATOM 943 CG ASP A 64 26.870 23.006 -9.646 1.00 0.00 C ATOM 944 OD1 ASP A 64 26.947 22.560 -10.781 1.00 0.00 O ATOM 945 OD2 ASP A 64 25.818 23.232 -9.074 1.00 0.00 O ATOM 0 H ASP A 64 27.736 20.940 -8.342 1.00 0.00 H new ATOM 0 HA ASP A 64 29.425 22.183 -10.245 1.00 0.00 H new ATOM 0 HB2 ASP A 64 27.978 23.373 -7.834 1.00 0.00 H new ATOM 0 HB3 ASP A 64 28.567 24.266 -9.223 1.00 0.00 H new ATOM 950 N ASP A 65 30.518 21.990 -7.163 1.00 0.00 N ATOM 951 CA ASP A 65 31.688 22.191 -6.317 1.00 0.00 C ATOM 952 C ASP A 65 31.904 23.679 -6.046 1.00 0.00 C ATOM 953 O ASP A 65 31.038 24.503 -6.337 1.00 0.00 O ATOM 954 CB ASP A 65 32.931 21.606 -6.994 1.00 0.00 C ATOM 955 CG ASP A 65 34.047 21.417 -5.970 1.00 0.00 C ATOM 956 OD1 ASP A 65 33.735 21.141 -4.824 1.00 0.00 O ATOM 957 OD2 ASP A 65 35.199 21.554 -6.348 1.00 0.00 O ATOM 0 H ASP A 65 29.766 21.456 -6.728 1.00 0.00 H new ATOM 0 HA ASP A 65 31.519 21.681 -5.368 1.00 0.00 H new ATOM 0 HB2 ASP A 65 32.686 20.650 -7.457 1.00 0.00 H new ATOM 0 HB3 ASP A 65 33.267 22.270 -7.791 1.00 0.00 H new ATOM 962 N ARG A 66 33.064 24.010 -5.488 1.00 0.00 N ATOM 963 CA ARG A 66 33.383 25.400 -5.182 1.00 0.00 C ATOM 964 C ARG A 66 33.517 26.215 -6.464 1.00 0.00 C ATOM 965 O ARG A 66 33.423 27.441 -6.444 1.00 0.00 O ATOM 966 CB ARG A 66 34.689 25.473 -4.389 1.00 0.00 C ATOM 967 CG ARG A 66 34.841 26.870 -3.785 1.00 0.00 C ATOM 968 CD ARG A 66 36.109 26.920 -2.929 1.00 0.00 C ATOM 969 NE ARG A 66 37.291 26.748 -3.764 1.00 0.00 N ATOM 970 CZ ARG A 66 38.502 26.644 -3.229 1.00 0.00 C ATOM 971 NH1 ARG A 66 38.650 26.696 -1.933 1.00 0.00 N ATOM 972 NH2 ARG A 66 39.546 26.490 -3.999 1.00 0.00 N ATOM 0 H ARG A 66 33.793 23.341 -5.240 1.00 0.00 H new ATOM 0 HA ARG A 66 32.572 25.816 -4.585 1.00 0.00 H new ATOM 0 HB2 ARG A 66 34.690 24.722 -3.599 1.00 0.00 H new ATOM 0 HB3 ARG A 66 35.535 25.252 -5.040 1.00 0.00 H new ATOM 0 HG2 ARG A 66 34.894 27.617 -4.577 1.00 0.00 H new ATOM 0 HG3 ARG A 66 33.969 27.112 -3.177 1.00 0.00 H new ATOM 0 HD2 ARG A 66 36.163 27.873 -2.403 1.00 0.00 H new ATOM 0 HD3 ARG A 66 36.075 26.138 -2.170 1.00 0.00 H new ATOM 0 HE ARG A 66 37.186 26.707 -4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 66 37.835 26.817 -1.331 1.00 0.00 H new ATOM 0 HH12 ARG A 66 39.580 26.616 -1.522 1.00 0.00 H new ATOM 0 HH21 ARG A 66 39.431 26.450 -5.012 1.00 0.00 H new ATOM 0 HH22 ARG A 66 40.476 26.410 -3.587 1.00 0.00 H new ATOM 986 N ALA A 67 33.733 25.524 -7.579 1.00 0.00 N ATOM 987 CA ALA A 67 33.876 26.193 -8.865 1.00 0.00 C ATOM 988 C ALA A 67 32.605 26.958 -9.210 1.00 0.00 C ATOM 989 O ALA A 67 32.657 28.003 -9.850 1.00 0.00 O ATOM 990 CB ALA A 67 34.174 25.168 -9.960 1.00 0.00 C ATOM 0 H ALA A 67 33.812 24.508 -7.617 1.00 0.00 H new ATOM 0 HA ALA A 67 34.705 26.898 -8.798 1.00 0.00 H new ATOM 0 HB1 ALA A 67 34.279 25.678 -10.917 1.00 0.00 H new ATOM 0 HB2 ALA A 67 35.100 24.643 -9.725 1.00 0.00 H new ATOM 0 HB3 ALA A 67 33.356 24.451 -10.019 1.00 0.00 H new ATOM 996 N ASP A 68 31.464 26.428 -8.789 1.00 0.00 N ATOM 997 CA ASP A 68 30.184 27.069 -9.063 1.00 0.00 C ATOM 998 C ASP A 68 30.004 27.288 -10.563 1.00 0.00 C ATOM 999 O ASP A 68 29.023 27.894 -10.997 1.00 0.00 O ATOM 1000 CB ASP A 68 30.101 28.413 -8.335 1.00 0.00 C ATOM 1001 CG ASP A 68 29.958 28.184 -6.835 1.00 0.00 C ATOM 1002 OD1 ASP A 68 29.715 27.052 -6.448 1.00 0.00 O ATOM 1003 OD2 ASP A 68 30.098 29.142 -6.094 1.00 0.00 O ATOM 0 H ASP A 68 31.398 25.559 -8.258 1.00 0.00 H new ATOM 0 HA ASP A 68 29.390 26.415 -8.704 1.00 0.00 H new ATOM 0 HB2 ASP A 68 30.996 29.002 -8.538 1.00 0.00 H new ATOM 0 HB3 ASP A 68 29.251 28.986 -8.707 1.00 0.00 H new ATOM 1008 N ALA A 69 30.949 26.784 -11.349 1.00 0.00 N ATOM 1009 CA ALA A 69 30.881 26.923 -12.796 1.00 0.00 C ATOM 1010 C ALA A 69 30.671 28.379 -13.191 1.00 0.00 C ATOM 1011 O ALA A 69 29.537 28.839 -13.324 1.00 0.00 O ATOM 1012 CB ALA A 69 29.733 26.073 -13.345 1.00 0.00 C ATOM 0 H ALA A 69 31.767 26.278 -11.009 1.00 0.00 H new ATOM 0 HA ALA A 69 31.826 26.581 -13.218 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.686 26.181 -14.429 1.00 0.00 H new ATOM 0 HB2 ALA A 69 29.902 25.026 -13.091 1.00 0.00 H new ATOM 0 HB3 ALA A 69 28.792 26.406 -12.907 1.00 0.00 H new ATOM 1018 N LEU A 70 31.769 29.097 -13.379 1.00 0.00 N ATOM 1019 CA LEU A 70 31.694 30.502 -13.762 1.00 0.00 C ATOM 1020 C LEU A 70 31.375 30.640 -15.243 1.00 0.00 C ATOM 1021 O LEU A 70 31.844 29.856 -16.063 1.00 0.00 O ATOM 1022 CB LEU A 70 33.028 31.194 -13.449 1.00 0.00 C ATOM 1023 CG LEU A 70 33.098 31.528 -11.954 1.00 0.00 C ATOM 1024 CD1 LEU A 70 32.070 32.626 -11.606 1.00 0.00 C ATOM 1025 CD2 LEU A 70 32.798 30.263 -11.141 1.00 0.00 C ATOM 0 H LEU A 70 32.717 28.734 -13.274 1.00 0.00 H new ATOM 0 HA LEU A 70 30.895 30.976 -13.192 1.00 0.00 H new ATOM 0 HB2 LEU A 70 33.859 30.545 -13.726 1.00 0.00 H new ATOM 0 HB3 LEU A 70 33.124 32.105 -14.040 1.00 0.00 H new ATOM 0 HG LEU A 70 34.096 31.893 -11.713 1.00 0.00 H new ATOM 0 HD11 LEU A 70 32.129 32.855 -10.542 1.00 0.00 H new ATOM 0 HD12 LEU A 70 32.288 33.525 -12.183 1.00 0.00 H new ATOM 0 HD13 LEU A 70 31.067 32.275 -11.847 1.00 0.00 H new ATOM 0 HD21 LEU A 70 32.846 30.494 -10.077 1.00 0.00 H new ATOM 0 HD22 LEU A 70 31.801 29.900 -11.388 1.00 0.00 H new ATOM 0 HD23 LEU A 70 33.534 29.495 -11.379 1.00 0.00 H new ATOM 1037 N GLN A 71 30.575 31.649 -15.575 1.00 0.00 N ATOM 1038 CA GLN A 71 30.201 31.883 -16.963 1.00 0.00 C ATOM 1039 C GLN A 71 29.569 30.628 -17.561 1.00 0.00 C ATOM 1040 O GLN A 71 28.349 30.470 -17.541 1.00 0.00 O ATOM 1041 CB GLN A 71 31.434 32.279 -17.779 1.00 0.00 C ATOM 1042 CG GLN A 71 31.023 32.534 -19.232 1.00 0.00 C ATOM 1043 CD GLN A 71 32.193 33.124 -20.008 1.00 0.00 C ATOM 1044 OE1 GLN A 71 33.158 33.601 -19.411 1.00 0.00 O ATOM 1045 NE2 GLN A 71 32.167 33.124 -21.313 1.00 0.00 N ATOM 0 H GLN A 71 30.177 32.311 -14.908 1.00 0.00 H new ATOM 0 HA GLN A 71 29.474 32.694 -16.995 1.00 0.00 H new ATOM 0 HB2 GLN A 71 31.891 33.174 -17.357 1.00 0.00 H new ATOM 0 HB3 GLN A 71 32.182 31.488 -17.735 1.00 0.00 H new ATOM 0 HG2 GLN A 71 30.701 31.602 -19.696 1.00 0.00 H new ATOM 0 HG3 GLN A 71 30.174 33.216 -19.264 1.00 0.00 H new ATOM 0 HE21 GLN A 71 31.367 32.729 -21.807 1.00 0.00 H new ATOM 0 HE22 GLN A 71 32.947 33.519 -21.839 1.00 0.00 H new ATOM 1054 N ALA A 72 30.408 29.743 -18.091 1.00 0.00 N ATOM 1055 CA ALA A 72 29.920 28.507 -18.692 1.00 0.00 C ATOM 1056 C ALA A 72 28.716 28.785 -19.585 1.00 0.00 C ATOM 1057 O ALA A 72 27.729 28.050 -19.559 1.00 0.00 O ATOM 1058 CB ALA A 72 29.528 27.516 -17.595 1.00 0.00 C ATOM 0 H ALA A 72 31.421 29.857 -18.117 1.00 0.00 H new ATOM 0 HA ALA A 72 30.717 28.079 -19.301 1.00 0.00 H new ATOM 0 HB1 ALA A 72 29.164 26.595 -18.050 1.00 0.00 H new ATOM 0 HB2 ALA A 72 30.398 27.296 -16.976 1.00 0.00 H new ATOM 0 HB3 ALA A 72 28.742 27.950 -16.976 1.00 0.00 H new ATOM 1064 N GLY A 73 28.802 29.850 -20.374 1.00 0.00 N ATOM 1065 CA GLY A 73 27.711 30.217 -21.269 1.00 0.00 C ATOM 1066 C GLY A 73 27.611 29.239 -22.432 1.00 0.00 C ATOM 1067 O GLY A 73 26.921 28.224 -22.343 1.00 0.00 O ATOM 0 H GLY A 73 29.610 30.471 -20.412 1.00 0.00 H new ATOM 0 HA2 GLY A 73 26.771 30.230 -20.717 1.00 0.00 H new ATOM 0 HA3 GLY A 73 27.871 31.226 -21.649 1.00 0.00 H new ATOM 1071 N ALA A 74 28.302 29.550 -23.524 1.00 0.00 N ATOM 1072 CA ALA A 74 28.281 28.688 -24.702 1.00 0.00 C ATOM 1073 C ALA A 74 29.305 27.564 -24.560 1.00 0.00 C ATOM 1074 O ALA A 74 30.450 27.697 -24.987 1.00 0.00 O ATOM 1075 CB ALA A 74 28.595 29.511 -25.953 1.00 0.00 C ATOM 0 H ALA A 74 28.879 30.386 -23.619 1.00 0.00 H new ATOM 0 HA ALA A 74 27.287 28.250 -24.794 1.00 0.00 H new ATOM 0 HB1 ALA A 74 28.578 28.862 -26.829 1.00 0.00 H new ATOM 0 HB2 ALA A 74 27.848 30.297 -26.069 1.00 0.00 H new ATOM 0 HB3 ALA A 74 29.583 29.961 -25.854 1.00 0.00 H new ATOM 1081 N SER A 75 28.881 26.457 -23.958 1.00 0.00 N ATOM 1082 CA SER A 75 29.765 25.318 -23.763 1.00 0.00 C ATOM 1083 C SER A 75 28.966 24.069 -23.406 1.00 0.00 C ATOM 1084 O SER A 75 29.270 23.387 -22.430 1.00 0.00 O ATOM 1085 CB SER A 75 30.769 25.619 -22.651 1.00 0.00 C ATOM 1086 OG SER A 75 30.065 25.870 -21.442 1.00 0.00 O ATOM 0 H SER A 75 27.935 26.327 -23.599 1.00 0.00 H new ATOM 0 HA SER A 75 30.300 25.137 -24.695 1.00 0.00 H new ATOM 0 HB2 SER A 75 31.450 24.778 -22.522 1.00 0.00 H new ATOM 0 HB3 SER A 75 31.377 26.483 -22.918 1.00 0.00 H new ATOM 0 HG SER A 75 29.595 25.057 -21.162 1.00 0.00 H new ATOM 1092 N GLN A 76 27.940 23.780 -24.198 1.00 0.00 N ATOM 1093 CA GLN A 76 27.100 22.611 -23.953 1.00 0.00 C ATOM 1094 C GLN A 76 27.739 21.359 -24.541 1.00 0.00 C ATOM 1095 O GLN A 76 27.228 20.253 -24.374 1.00 0.00 O ATOM 1096 CB GLN A 76 25.718 22.823 -24.576 1.00 0.00 C ATOM 1097 CG GLN A 76 25.021 24.002 -23.894 1.00 0.00 C ATOM 1098 CD GLN A 76 24.732 23.667 -22.434 1.00 0.00 C ATOM 1099 OE1 GLN A 76 24.155 22.620 -22.139 1.00 0.00 O ATOM 1100 NE2 GLN A 76 25.102 24.496 -21.497 1.00 0.00 N ATOM 0 H GLN A 76 27.670 24.334 -25.011 1.00 0.00 H new ATOM 0 HA GLN A 76 26.997 22.479 -22.876 1.00 0.00 H new ATOM 0 HB2 GLN A 76 25.816 23.014 -25.645 1.00 0.00 H new ATOM 0 HB3 GLN A 76 25.117 21.920 -24.467 1.00 0.00 H new ATOM 0 HG2 GLN A 76 25.650 24.890 -23.954 1.00 0.00 H new ATOM 0 HG3 GLN A 76 24.091 24.234 -24.413 1.00 0.00 H new ATOM 0 HE21 GLN A 76 25.580 25.363 -21.743 1.00 0.00 H new ATOM 0 HE22 GLN A 76 24.913 24.277 -20.519 1.00 0.00 H new ATOM 1109 N PHE A 77 28.859 21.542 -25.234 1.00 0.00 N ATOM 1110 CA PHE A 77 29.557 20.418 -25.846 1.00 0.00 C ATOM 1111 C PHE A 77 29.983 19.407 -24.785 1.00 0.00 C ATOM 1112 O PHE A 77 29.797 18.204 -24.950 1.00 0.00 O ATOM 1113 CB PHE A 77 30.790 20.918 -26.599 1.00 0.00 C ATOM 1114 CG PHE A 77 31.497 19.748 -27.244 1.00 0.00 C ATOM 1115 CD1 PHE A 77 30.966 19.161 -28.399 1.00 0.00 C ATOM 1116 CD2 PHE A 77 32.681 19.252 -26.689 1.00 0.00 C ATOM 1117 CE1 PHE A 77 31.618 18.077 -28.997 1.00 0.00 C ATOM 1118 CE2 PHE A 77 33.335 18.166 -27.286 1.00 0.00 C ATOM 1119 CZ PHE A 77 32.803 17.579 -28.441 1.00 0.00 C ATOM 0 H PHE A 77 29.299 22.450 -25.385 1.00 0.00 H new ATOM 0 HA PHE A 77 28.877 19.930 -26.544 1.00 0.00 H new ATOM 0 HB2 PHE A 77 30.496 21.642 -27.359 1.00 0.00 H new ATOM 0 HB3 PHE A 77 31.465 21.431 -25.913 1.00 0.00 H new ATOM 0 HD1 PHE A 77 30.053 19.545 -28.829 1.00 0.00 H new ATOM 0 HD2 PHE A 77 33.092 19.706 -25.799 1.00 0.00 H new ATOM 0 HE1 PHE A 77 31.207 17.624 -29.887 1.00 0.00 H new ATOM 0 HE2 PHE A 77 34.248 17.782 -26.856 1.00 0.00 H new ATOM 0 HZ PHE A 77 33.306 16.743 -28.903 1.00 0.00 H new ATOM 1129 N GLU A 78 30.557 19.906 -23.697 1.00 0.00 N ATOM 1130 CA GLU A 78 31.005 19.038 -22.613 1.00 0.00 C ATOM 1131 C GLU A 78 29.812 18.429 -21.883 1.00 0.00 C ATOM 1132 O GLU A 78 29.869 17.289 -21.423 1.00 0.00 O ATOM 1133 CB GLU A 78 31.863 19.834 -21.629 1.00 0.00 C ATOM 1134 CG GLU A 78 31.025 20.952 -21.005 1.00 0.00 C ATOM 1135 CD GLU A 78 31.903 21.831 -20.122 1.00 0.00 C ATOM 1136 OE1 GLU A 78 33.002 22.148 -20.543 1.00 0.00 O ATOM 1137 OE2 GLU A 78 31.460 22.176 -19.038 1.00 0.00 O ATOM 0 H GLU A 78 30.723 20.900 -23.541 1.00 0.00 H new ATOM 0 HA GLU A 78 31.600 18.231 -23.040 1.00 0.00 H new ATOM 0 HB2 GLU A 78 32.247 19.175 -20.850 1.00 0.00 H new ATOM 0 HB3 GLU A 78 32.726 20.256 -22.143 1.00 0.00 H new ATOM 0 HG2 GLU A 78 30.565 21.554 -21.789 1.00 0.00 H new ATOM 0 HG3 GLU A 78 30.214 20.524 -20.415 1.00 0.00 H new ATOM 1144 N THR A 79 28.737 19.204 -21.769 1.00 0.00 N ATOM 1145 CA THR A 79 27.540 18.733 -21.082 1.00 0.00 C ATOM 1146 C THR A 79 26.904 17.576 -21.841 1.00 0.00 C ATOM 1147 O THR A 79 26.326 16.669 -21.243 1.00 0.00 O ATOM 1148 CB THR A 79 26.530 19.876 -20.950 1.00 0.00 C ATOM 1149 OG1 THR A 79 26.195 20.359 -22.243 1.00 0.00 O ATOM 1150 CG2 THR A 79 27.140 21.008 -20.123 1.00 0.00 C ATOM 0 H THR A 79 28.670 20.152 -22.140 1.00 0.00 H new ATOM 0 HA THR A 79 27.828 18.385 -20.090 1.00 0.00 H new ATOM 0 HB THR A 79 25.631 19.511 -20.452 1.00 0.00 H new ATOM 0 HG1 THR A 79 26.817 19.986 -22.903 1.00 0.00 H new ATOM 0 HG21 THR A 79 26.419 21.820 -20.031 1.00 0.00 H new ATOM 0 HG22 THR A 79 27.397 20.636 -19.131 1.00 0.00 H new ATOM 0 HG23 THR A 79 28.039 21.376 -20.617 1.00 0.00 H new ATOM 1158 N SER A 80 27.012 17.614 -23.166 1.00 0.00 N ATOM 1159 CA SER A 80 26.437 16.563 -24.000 1.00 0.00 C ATOM 1160 C SER A 80 27.048 15.209 -23.653 1.00 0.00 C ATOM 1161 O SER A 80 26.372 14.183 -23.708 1.00 0.00 O ATOM 1162 CB SER A 80 26.687 16.872 -25.475 1.00 0.00 C ATOM 1163 OG SER A 80 28.080 16.802 -25.740 1.00 0.00 O ATOM 0 H SER A 80 27.488 18.354 -23.682 1.00 0.00 H new ATOM 0 HA SER A 80 25.364 16.524 -23.813 1.00 0.00 H new ATOM 0 HB2 SER A 80 26.150 16.162 -26.103 1.00 0.00 H new ATOM 0 HB3 SER A 80 26.308 17.864 -25.720 1.00 0.00 H new ATOM 0 HG SER A 80 28.563 17.372 -25.106 1.00 0.00 H new ATOM 1169 N ALA A 81 28.326 15.215 -23.293 1.00 0.00 N ATOM 1170 CA ALA A 81 29.017 13.981 -22.939 1.00 0.00 C ATOM 1171 C ALA A 81 28.390 13.351 -21.699 1.00 0.00 C ATOM 1172 O ALA A 81 28.308 12.128 -21.586 1.00 0.00 O ATOM 1173 CB ALA A 81 30.496 14.267 -22.676 1.00 0.00 C ATOM 0 H ALA A 81 28.902 16.055 -23.239 1.00 0.00 H new ATOM 0 HA ALA A 81 28.925 13.284 -23.772 1.00 0.00 H new ATOM 0 HB1 ALA A 81 31.005 13.340 -22.412 1.00 0.00 H new ATOM 0 HB2 ALA A 81 30.950 14.688 -23.573 1.00 0.00 H new ATOM 0 HB3 ALA A 81 30.589 14.978 -21.855 1.00 0.00 H new ATOM 1179 N ALA A 82 27.953 14.193 -20.769 1.00 0.00 N ATOM 1180 CA ALA A 82 27.340 13.707 -19.539 1.00 0.00 C ATOM 1181 C ALA A 82 26.088 12.894 -19.849 1.00 0.00 C ATOM 1182 O ALA A 82 25.786 11.915 -19.167 1.00 0.00 O ATOM 1183 CB ALA A 82 26.973 14.886 -18.636 1.00 0.00 C ATOM 0 H ALA A 82 28.011 15.209 -20.842 1.00 0.00 H new ATOM 0 HA ALA A 82 28.058 13.067 -19.027 1.00 0.00 H new ATOM 0 HB1 ALA A 82 26.516 14.514 -17.719 1.00 0.00 H new ATOM 0 HB2 ALA A 82 27.873 15.449 -18.390 1.00 0.00 H new ATOM 0 HB3 ALA A 82 26.269 15.536 -19.155 1.00 0.00 H new ATOM 1189 N LYS A 83 25.355 13.310 -20.878 1.00 0.00 N ATOM 1190 CA LYS A 83 24.134 12.618 -21.262 1.00 0.00 C ATOM 1191 C LYS A 83 24.429 11.162 -21.610 1.00 0.00 C ATOM 1192 O LYS A 83 23.719 10.255 -21.177 1.00 0.00 O ATOM 1193 CB LYS A 83 23.498 13.314 -22.467 1.00 0.00 C ATOM 1194 CG LYS A 83 22.152 12.658 -22.787 1.00 0.00 C ATOM 1195 CD LYS A 83 21.491 13.390 -23.956 1.00 0.00 C ATOM 1196 CE LYS A 83 20.150 12.729 -24.281 1.00 0.00 C ATOM 1197 NZ LYS A 83 19.219 12.903 -23.131 1.00 0.00 N ATOM 0 H LYS A 83 25.585 14.118 -21.456 1.00 0.00 H new ATOM 0 HA LYS A 83 23.443 12.645 -20.420 1.00 0.00 H new ATOM 0 HB2 LYS A 83 23.356 14.374 -22.255 1.00 0.00 H new ATOM 0 HB3 LYS A 83 24.161 13.248 -23.330 1.00 0.00 H new ATOM 0 HG2 LYS A 83 22.298 11.608 -23.038 1.00 0.00 H new ATOM 0 HG3 LYS A 83 21.503 12.689 -21.912 1.00 0.00 H new ATOM 0 HD2 LYS A 83 21.339 14.439 -23.702 1.00 0.00 H new ATOM 0 HD3 LYS A 83 22.142 13.364 -24.830 1.00 0.00 H new ATOM 0 HE2 LYS A 83 19.722 13.173 -25.180 1.00 0.00 H new ATOM 0 HE3 LYS A 83 20.296 11.669 -24.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 18.239 12.771 -23.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 19.439 12.200 -22.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 19.328 13.860 -22.738 1.00 0.00 H new ATOM 1211 N LEU A 84 25.478 10.946 -22.394 1.00 0.00 N ATOM 1212 CA LEU A 84 25.856 9.596 -22.791 1.00 0.00 C ATOM 1213 C LEU A 84 26.246 8.768 -21.570 1.00 0.00 C ATOM 1214 O LEU A 84 25.888 7.597 -21.462 1.00 0.00 O ATOM 1215 CB LEU A 84 27.030 9.651 -23.777 1.00 0.00 C ATOM 1216 CG LEU A 84 26.508 9.959 -25.183 1.00 0.00 C ATOM 1217 CD1 LEU A 84 25.794 11.312 -25.177 1.00 0.00 C ATOM 1218 CD2 LEU A 84 27.683 10.005 -26.160 1.00 0.00 C ATOM 0 H LEU A 84 26.078 11.683 -22.765 1.00 0.00 H new ATOM 0 HA LEU A 84 25.000 9.124 -23.274 1.00 0.00 H new ATOM 0 HB2 LEU A 84 27.742 10.416 -23.467 1.00 0.00 H new ATOM 0 HB3 LEU A 84 27.563 8.700 -23.777 1.00 0.00 H new ATOM 0 HG LEU A 84 25.808 9.182 -25.491 1.00 0.00 H new ATOM 0 HD11 LEU A 84 25.422 11.532 -26.178 1.00 0.00 H new ATOM 0 HD12 LEU A 84 24.958 11.279 -24.478 1.00 0.00 H new ATOM 0 HD13 LEU A 84 26.492 12.091 -24.870 1.00 0.00 H new ATOM 0 HD21 LEU A 84 27.315 10.224 -27.162 1.00 0.00 H new ATOM 0 HD22 LEU A 84 28.382 10.783 -25.852 1.00 0.00 H new ATOM 0 HD23 LEU A 84 28.192 9.041 -26.163 1.00 0.00 H new ATOM 1230 N LYS A 85 26.990 9.385 -20.658 1.00 0.00 N ATOM 1231 CA LYS A 85 27.431 8.695 -19.452 1.00 0.00 C ATOM 1232 C LYS A 85 26.232 8.295 -18.601 1.00 0.00 C ATOM 1233 O LYS A 85 26.197 7.204 -18.031 1.00 0.00 O ATOM 1234 CB LYS A 85 28.357 9.600 -18.640 1.00 0.00 C ATOM 1235 CG LYS A 85 29.659 9.823 -19.414 1.00 0.00 C ATOM 1236 CD LYS A 85 30.574 10.755 -18.618 1.00 0.00 C ATOM 1237 CE LYS A 85 31.881 10.963 -19.384 1.00 0.00 C ATOM 1238 NZ LYS A 85 32.766 11.883 -18.617 1.00 0.00 N ATOM 0 H LYS A 85 27.298 10.355 -20.730 1.00 0.00 H new ATOM 0 HA LYS A 85 27.972 7.796 -19.746 1.00 0.00 H new ATOM 0 HB2 LYS A 85 27.870 10.555 -18.444 1.00 0.00 H new ATOM 0 HB3 LYS A 85 28.570 9.146 -17.672 1.00 0.00 H new ATOM 0 HG2 LYS A 85 30.158 8.870 -19.590 1.00 0.00 H new ATOM 0 HG3 LYS A 85 29.444 10.255 -20.391 1.00 0.00 H new ATOM 0 HD2 LYS A 85 30.080 11.713 -18.453 1.00 0.00 H new ATOM 0 HD3 LYS A 85 30.779 10.329 -17.636 1.00 0.00 H new ATOM 0 HE2 LYS A 85 32.380 10.006 -19.539 1.00 0.00 H new ATOM 0 HE3 LYS A 85 31.675 11.378 -20.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 33.655 12.024 -19.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 32.289 12.799 -18.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 32.973 11.469 -17.685 1.00 0.00 H new ATOM 1252 N ARG A 86 25.252 9.186 -18.515 1.00 0.00 N ATOM 1253 CA ARG A 86 24.060 8.917 -17.727 1.00 0.00 C ATOM 1254 C ARG A 86 23.338 7.677 -18.241 1.00 0.00 C ATOM 1255 O ARG A 86 22.920 6.822 -17.463 1.00 0.00 O ATOM 1256 CB ARG A 86 23.115 10.121 -17.780 1.00 0.00 C ATOM 1257 CG ARG A 86 22.013 9.967 -16.714 1.00 0.00 C ATOM 1258 CD ARG A 86 22.484 10.586 -15.395 1.00 0.00 C ATOM 1259 NE ARG A 86 22.636 12.028 -15.544 1.00 0.00 N ATOM 1260 CZ ARG A 86 23.202 12.761 -14.591 1.00 0.00 C ATOM 1261 NH1 ARG A 86 23.634 12.188 -13.500 1.00 0.00 N ATOM 1262 NH2 ARG A 86 23.326 14.050 -14.744 1.00 0.00 N ATOM 0 H ARG A 86 25.260 10.095 -18.978 1.00 0.00 H new ATOM 0 HA ARG A 86 24.366 8.739 -16.696 1.00 0.00 H new ATOM 0 HB2 ARG A 86 23.674 11.041 -17.608 1.00 0.00 H new ATOM 0 HB3 ARG A 86 22.667 10.200 -18.771 1.00 0.00 H new ATOM 0 HG2 ARG A 86 21.098 10.454 -17.050 1.00 0.00 H new ATOM 0 HG3 ARG A 86 21.778 8.913 -16.569 1.00 0.00 H new ATOM 0 HD2 ARG A 86 21.765 10.368 -14.605 1.00 0.00 H new ATOM 0 HD3 ARG A 86 23.433 10.142 -15.094 1.00 0.00 H new ATOM 0 HE ARG A 86 22.302 12.482 -16.394 1.00 0.00 H new ATOM 0 HH11 ARG A 86 23.537 11.180 -13.381 1.00 0.00 H new ATOM 0 HH12 ARG A 86 24.069 12.749 -12.767 1.00 0.00 H new ATOM 0 HH21 ARG A 86 22.988 14.497 -15.596 1.00 0.00 H new ATOM 0 HH22 ARG A 86 23.761 14.611 -14.011 1.00 0.00 H new ATOM 1276 N LYS A 87 23.195 7.592 -19.549 1.00 0.00 N ATOM 1277 CA LYS A 87 22.522 6.452 -20.164 1.00 0.00 C ATOM 1278 C LYS A 87 23.303 5.170 -19.924 1.00 0.00 C ATOM 1279 O LYS A 87 22.721 4.115 -19.668 1.00 0.00 O ATOM 1280 CB LYS A 87 22.364 6.689 -21.670 1.00 0.00 C ATOM 1281 CG LYS A 87 21.449 7.901 -21.913 1.00 0.00 C ATOM 1282 CD LYS A 87 19.980 7.468 -21.846 1.00 0.00 C ATOM 1283 CE LYS A 87 19.083 8.660 -22.166 1.00 0.00 C ATOM 1284 NZ LYS A 87 19.236 9.022 -23.601 1.00 0.00 N ATOM 0 H LYS A 87 23.532 8.293 -20.209 1.00 0.00 H new ATOM 0 HA LYS A 87 21.537 6.348 -19.708 1.00 0.00 H new ATOM 0 HB2 LYS A 87 23.340 6.861 -22.125 1.00 0.00 H new ATOM 0 HB3 LYS A 87 21.943 5.803 -22.145 1.00 0.00 H new ATOM 0 HG2 LYS A 87 21.645 8.671 -21.166 1.00 0.00 H new ATOM 0 HG3 LYS A 87 21.664 8.340 -22.887 1.00 0.00 H new ATOM 0 HD2 LYS A 87 19.795 6.660 -22.554 1.00 0.00 H new ATOM 0 HD3 LYS A 87 19.749 7.081 -20.853 1.00 0.00 H new ATOM 0 HE2 LYS A 87 18.043 8.415 -21.950 1.00 0.00 H new ATOM 0 HE3 LYS A 87 19.348 9.508 -21.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 18.415 9.581 -23.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 20.103 9.582 -23.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 19.298 8.156 -24.173 1.00 0.00 H new ATOM 1298 N TYR A 88 24.624 5.264 -20.022 1.00 0.00 N ATOM 1299 CA TYR A 88 25.481 4.102 -19.822 1.00 0.00 C ATOM 1300 C TYR A 88 25.300 3.546 -18.415 1.00 0.00 C ATOM 1301 O TYR A 88 25.178 2.336 -18.226 1.00 0.00 O ATOM 1302 CB TYR A 88 26.943 4.487 -20.038 1.00 0.00 C ATOM 1303 CG TYR A 88 27.790 3.239 -20.089 1.00 0.00 C ATOM 1304 CD1 TYR A 88 27.911 2.526 -21.288 1.00 0.00 C ATOM 1305 CD2 TYR A 88 28.456 2.792 -18.941 1.00 0.00 C ATOM 1306 CE1 TYR A 88 28.693 1.368 -21.340 1.00 0.00 C ATOM 1307 CE2 TYR A 88 29.239 1.633 -18.993 1.00 0.00 C ATOM 1308 CZ TYR A 88 29.359 0.922 -20.193 1.00 0.00 C ATOM 1309 OH TYR A 88 30.132 -0.219 -20.243 1.00 0.00 O ATOM 0 H TYR A 88 25.122 6.127 -20.237 1.00 0.00 H new ATOM 0 HA TYR A 88 25.200 3.335 -20.544 1.00 0.00 H new ATOM 0 HB2 TYR A 88 27.049 5.049 -20.966 1.00 0.00 H new ATOM 0 HB3 TYR A 88 27.282 5.137 -19.231 1.00 0.00 H new ATOM 0 HD1 TYR A 88 27.399 2.871 -22.174 1.00 0.00 H new ATOM 0 HD2 TYR A 88 28.365 3.342 -18.016 1.00 0.00 H new ATOM 0 HE1 TYR A 88 28.783 0.818 -22.265 1.00 0.00 H new ATOM 0 HE2 TYR A 88 29.751 1.287 -18.107 1.00 0.00 H new ATOM 0 HH TYR A 88 30.525 -0.387 -19.361 1.00 0.00 H new ATOM 1319 N TRP A 89 25.282 4.437 -17.425 1.00 0.00 N ATOM 1320 CA TRP A 89 25.112 4.020 -16.034 1.00 0.00 C ATOM 1321 C TRP A 89 24.349 5.083 -15.248 1.00 0.00 C ATOM 1322 O TRP A 89 24.807 6.215 -15.120 1.00 0.00 O ATOM 1323 CB TRP A 89 26.485 3.786 -15.391 1.00 0.00 C ATOM 1324 CG TRP A 89 27.162 5.098 -15.147 1.00 0.00 C ATOM 1325 CD1 TRP A 89 27.899 5.775 -16.055 1.00 0.00 C ATOM 1326 CD2 TRP A 89 27.157 5.910 -13.938 1.00 0.00 C ATOM 1327 NE1 TRP A 89 28.353 6.946 -15.480 1.00 0.00 N ATOM 1328 CE2 TRP A 89 27.923 7.075 -14.173 1.00 0.00 C ATOM 1329 CE3 TRP A 89 26.568 5.748 -12.669 1.00 0.00 C ATOM 1330 CZ2 TRP A 89 28.102 8.044 -13.188 1.00 0.00 C ATOM 1331 CZ3 TRP A 89 26.748 6.722 -11.673 1.00 0.00 C ATOM 1332 CH2 TRP A 89 27.512 7.869 -11.932 1.00 0.00 C ATOM 0 H TRP A 89 25.382 5.443 -17.558 1.00 0.00 H new ATOM 0 HA TRP A 89 24.540 3.092 -16.015 1.00 0.00 H new ATOM 0 HB2 TRP A 89 26.369 3.246 -14.451 1.00 0.00 H new ATOM 0 HB3 TRP A 89 27.100 3.165 -16.042 1.00 0.00 H new ATOM 0 HD1 TRP A 89 28.100 5.453 -17.066 1.00 0.00 H new ATOM 0 HE1 TRP A 89 28.935 7.632 -15.961 1.00 0.00 H new ATOM 0 HE3 TRP A 89 25.975 4.870 -12.461 1.00 0.00 H new ATOM 0 HZ2 TRP A 89 28.693 8.925 -13.393 1.00 0.00 H new ATOM 0 HZ3 TRP A 89 26.295 6.587 -10.702 1.00 0.00 H new ATOM 0 HH2 TRP A 89 27.645 8.616 -11.163 1.00 0.00 H new ATOM 1343 N TRP A 90 23.193 4.702 -14.717 1.00 0.00 N ATOM 1344 CA TRP A 90 22.379 5.631 -13.938 1.00 0.00 C ATOM 1345 C TRP A 90 21.146 4.926 -13.386 1.00 0.00 C ATOM 1346 O TRP A 90 21.196 4.305 -12.327 1.00 0.00 O ATOM 1347 CB TRP A 90 21.946 6.809 -14.818 1.00 0.00 C ATOM 1348 CG TRP A 90 21.040 7.708 -14.042 1.00 0.00 C ATOM 1349 CD1 TRP A 90 19.740 7.932 -14.331 1.00 0.00 C ATOM 1350 CD2 TRP A 90 21.342 8.501 -12.860 1.00 0.00 C ATOM 1351 NE1 TRP A 90 19.222 8.815 -13.400 1.00 0.00 N ATOM 1352 CE2 TRP A 90 20.171 9.194 -12.472 1.00 0.00 C ATOM 1353 CE3 TRP A 90 22.506 8.686 -12.090 1.00 0.00 C ATOM 1354 CZ2 TRP A 90 20.155 10.040 -11.364 1.00 0.00 C ATOM 1355 CZ3 TRP A 90 22.492 9.537 -10.974 1.00 0.00 C ATOM 1356 CH2 TRP A 90 21.320 10.213 -10.611 1.00 0.00 C ATOM 0 H TRP A 90 22.800 3.765 -14.809 1.00 0.00 H new ATOM 0 HA TRP A 90 22.976 6.000 -13.105 1.00 0.00 H new ATOM 0 HB2 TRP A 90 22.821 7.363 -15.158 1.00 0.00 H new ATOM 0 HB3 TRP A 90 21.436 6.442 -15.709 1.00 0.00 H new ATOM 0 HD1 TRP A 90 19.194 7.494 -15.154 1.00 0.00 H new ATOM 0 HE1 TRP A 90 18.257 9.145 -13.400 1.00 0.00 H new ATOM 0 HE3 TRP A 90 23.415 8.170 -12.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 19.248 10.558 -11.089 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 23.391 9.672 -10.391 1.00 0.00 H new ATOM 0 HH2 TRP A 90 21.316 10.866 -9.751 1.00 0.00 H new ATOM 1367 N LYS A 91 20.039 5.027 -14.108 1.00 0.00 N ATOM 1368 CA LYS A 91 18.797 4.393 -13.680 1.00 0.00 C ATOM 1369 C LYS A 91 18.955 2.877 -13.646 1.00 0.00 C ATOM 1370 O LYS A 91 18.352 2.199 -12.816 1.00 0.00 O ATOM 1371 CB LYS A 91 17.667 4.772 -14.629 1.00 0.00 C ATOM 1372 CG LYS A 91 16.339 4.245 -14.080 1.00 0.00 C ATOM 1373 CD LYS A 91 15.177 4.779 -14.930 1.00 0.00 C ATOM 1374 CE LYS A 91 15.090 3.995 -16.241 1.00 0.00 C ATOM 1375 NZ LYS A 91 15.021 2.536 -15.941 1.00 0.00 N ATOM 0 H LYS A 91 19.974 5.538 -14.988 1.00 0.00 H new ATOM 0 HA LYS A 91 18.557 4.742 -12.676 1.00 0.00 H new ATOM 0 HB2 LYS A 91 17.621 5.855 -14.742 1.00 0.00 H new ATOM 0 HB3 LYS A 91 17.854 4.355 -15.619 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.338 3.155 -14.089 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.215 4.555 -13.042 1.00 0.00 H new ATOM 0 HD2 LYS A 91 14.241 4.689 -14.379 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.324 5.839 -15.139 1.00 0.00 H new ATOM 0 HE2 LYS A 91 14.210 4.304 -16.805 1.00 0.00 H new ATOM 0 HE3 LYS A 91 15.958 4.209 -16.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 14.422 2.064 -16.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 15.978 2.130 -15.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 14.615 2.395 -14.994 1.00 0.00 H new ATOM 1389 N ASN A 92 19.765 2.351 -14.561 1.00 0.00 N ATOM 1390 CA ASN A 92 19.990 0.912 -14.629 1.00 0.00 C ATOM 1391 C ASN A 92 20.903 0.460 -13.496 1.00 0.00 C ATOM 1392 O ASN A 92 21.487 -0.620 -13.549 1.00 0.00 O ATOM 1393 CB ASN A 92 20.620 0.545 -15.974 1.00 0.00 C ATOM 1394 CG ASN A 92 22.013 1.156 -16.081 1.00 0.00 C ATOM 1395 OD1 ASN A 92 22.431 1.908 -15.200 1.00 0.00 O ATOM 1396 ND2 ASN A 92 22.759 0.881 -17.115 1.00 0.00 N ATOM 0 H ASN A 92 20.272 2.895 -15.259 1.00 0.00 H new ATOM 0 HA ASN A 92 19.029 0.407 -14.529 1.00 0.00 H new ATOM 0 HB2 ASN A 92 20.681 -0.539 -16.073 1.00 0.00 H new ATOM 0 HB3 ASN A 92 19.992 0.905 -16.789 1.00 0.00 H new ATOM 0 HD21 ASN A 92 23.690 1.289 -17.195 1.00 0.00 H new ATOM 0 HD22 ASN A 92 22.411 0.258 -17.844 1.00 0.00 H new ATOM 1403 N LEU A 93 21.021 1.292 -12.471 1.00 0.00 N ATOM 1404 CA LEU A 93 21.862 0.961 -11.333 1.00 0.00 C ATOM 1405 C LEU A 93 21.333 -0.277 -10.614 1.00 0.00 C ATOM 1406 O LEU A 93 22.100 -1.150 -10.217 1.00 0.00 O ATOM 1407 CB LEU A 93 21.912 2.143 -10.353 1.00 0.00 C ATOM 1408 CG LEU A 93 22.724 1.760 -9.108 1.00 0.00 C ATOM 1409 CD1 LEU A 93 24.130 1.308 -9.526 1.00 0.00 C ATOM 1410 CD2 LEU A 93 22.830 2.970 -8.181 1.00 0.00 C ATOM 0 H LEU A 93 20.549 2.194 -12.405 1.00 0.00 H new ATOM 0 HA LEU A 93 22.867 0.752 -11.700 1.00 0.00 H new ATOM 0 HB2 LEU A 93 22.362 3.009 -10.838 1.00 0.00 H new ATOM 0 HB3 LEU A 93 20.901 2.429 -10.064 1.00 0.00 H new ATOM 0 HG LEU A 93 22.225 0.943 -8.587 1.00 0.00 H new ATOM 0 HD11 LEU A 93 24.704 1.037 -8.640 1.00 0.00 H new ATOM 0 HD12 LEU A 93 24.053 0.444 -10.187 1.00 0.00 H new ATOM 0 HD13 LEU A 93 24.633 2.121 -10.049 1.00 0.00 H new ATOM 0 HD21 LEU A 93 23.406 2.701 -7.296 1.00 0.00 H new ATOM 0 HD22 LEU A 93 23.328 3.786 -8.704 1.00 0.00 H new ATOM 0 HD23 LEU A 93 21.831 3.287 -7.881 1.00 0.00 H new ATOM 1422 N LYS A 94 20.022 -0.333 -10.437 1.00 0.00 N ATOM 1423 CA LYS A 94 19.399 -1.458 -9.745 1.00 0.00 C ATOM 1424 C LYS A 94 19.703 -2.758 -10.470 1.00 0.00 C ATOM 1425 O LYS A 94 19.854 -3.806 -9.845 1.00 0.00 O ATOM 1426 CB LYS A 94 17.885 -1.246 -9.678 1.00 0.00 C ATOM 1427 CG LYS A 94 17.570 0.074 -8.956 1.00 0.00 C ATOM 1428 CD LYS A 94 17.718 -0.108 -7.443 1.00 0.00 C ATOM 1429 CE LYS A 94 17.334 1.187 -6.735 1.00 0.00 C ATOM 1430 NZ LYS A 94 17.503 1.012 -5.265 1.00 0.00 N ATOM 0 H LYS A 94 19.369 0.381 -10.760 1.00 0.00 H new ATOM 0 HA LYS A 94 19.803 -1.517 -8.734 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.467 -1.228 -10.685 1.00 0.00 H new ATOM 0 HB3 LYS A 94 17.416 -2.078 -9.153 1.00 0.00 H new ATOM 0 HG2 LYS A 94 18.243 0.858 -9.304 1.00 0.00 H new ATOM 0 HG3 LYS A 94 16.556 0.395 -9.194 1.00 0.00 H new ATOM 0 HD2 LYS A 94 17.082 -0.925 -7.100 1.00 0.00 H new ATOM 0 HD3 LYS A 94 18.745 -0.379 -7.197 1.00 0.00 H new ATOM 0 HE2 LYS A 94 17.958 2.008 -7.089 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.301 1.449 -6.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 17.242 1.893 -4.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 16.890 0.239 -4.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.495 0.781 -5.055 1.00 0.00 H new ATOM 1444 N MET A 95 19.791 -2.683 -11.791 1.00 0.00 N ATOM 1445 CA MET A 95 20.079 -3.862 -12.594 1.00 0.00 C ATOM 1446 C MET A 95 21.450 -4.431 -12.234 1.00 0.00 C ATOM 1447 O MET A 95 21.674 -5.637 -12.312 1.00 0.00 O ATOM 1448 CB MET A 95 20.050 -3.504 -14.080 1.00 0.00 C ATOM 1449 CG MET A 95 18.632 -3.083 -14.478 1.00 0.00 C ATOM 1450 SD MET A 95 17.508 -4.493 -14.316 1.00 0.00 S ATOM 1451 CE MET A 95 18.206 -5.501 -15.648 1.00 0.00 C ATOM 0 H MET A 95 19.668 -1.823 -12.326 1.00 0.00 H new ATOM 0 HA MET A 95 19.317 -4.614 -12.388 1.00 0.00 H new ATOM 0 HB2 MET A 95 20.751 -2.695 -14.283 1.00 0.00 H new ATOM 0 HB3 MET A 95 20.368 -4.359 -14.677 1.00 0.00 H new ATOM 0 HG2 MET A 95 18.295 -2.262 -13.845 1.00 0.00 H new ATOM 0 HG3 MET A 95 18.626 -2.717 -15.505 1.00 0.00 H new ATOM 0 HE1 MET A 95 17.430 -6.145 -16.062 1.00 0.00 H new ATOM 0 HE2 MET A 95 18.593 -4.850 -16.432 1.00 0.00 H new ATOM 0 HE3 MET A 95 19.015 -6.115 -15.253 1.00 0.00 H new ATOM 1461 N MET A 96 22.369 -3.549 -11.861 1.00 0.00 N ATOM 1462 CA MET A 96 23.719 -3.975 -11.510 1.00 0.00 C ATOM 1463 C MET A 96 23.703 -4.827 -10.246 1.00 0.00 C ATOM 1464 O MET A 96 24.418 -5.825 -10.146 1.00 0.00 O ATOM 1465 CB MET A 96 24.612 -2.751 -11.289 1.00 0.00 C ATOM 1466 CG MET A 96 24.711 -1.952 -12.590 1.00 0.00 C ATOM 1467 SD MET A 96 25.848 -0.563 -12.361 1.00 0.00 S ATOM 1468 CE MET A 96 25.806 0.050 -14.063 1.00 0.00 C ATOM 0 H MET A 96 22.208 -2.544 -11.794 1.00 0.00 H new ATOM 0 HA MET A 96 24.115 -4.572 -12.332 1.00 0.00 H new ATOM 0 HB2 MET A 96 24.201 -2.126 -10.496 1.00 0.00 H new ATOM 0 HB3 MET A 96 25.605 -3.065 -10.966 1.00 0.00 H new ATOM 0 HG2 MET A 96 25.063 -2.594 -13.398 1.00 0.00 H new ATOM 0 HG3 MET A 96 23.726 -1.586 -12.880 1.00 0.00 H new ATOM 0 HE1 MET A 96 26.451 0.924 -14.151 1.00 0.00 H new ATOM 0 HE2 MET A 96 26.157 -0.730 -14.739 1.00 0.00 H new ATOM 0 HE3 MET A 96 24.785 0.325 -14.325 1.00 0.00 H new ATOM 1478 N ILE A 97 22.898 -4.417 -9.271 1.00 0.00 N ATOM 1479 CA ILE A 97 22.821 -5.149 -8.013 1.00 0.00 C ATOM 1480 C ILE A 97 22.349 -6.579 -8.248 1.00 0.00 C ATOM 1481 O ILE A 97 22.983 -7.529 -7.793 1.00 0.00 O ATOM 1482 CB ILE A 97 21.849 -4.431 -7.056 1.00 0.00 C ATOM 1483 CG1 ILE A 97 22.550 -3.228 -6.410 1.00 0.00 C ATOM 1484 CG2 ILE A 97 21.384 -5.398 -5.960 1.00 0.00 C ATOM 1485 CD1 ILE A 97 22.854 -2.178 -7.477 1.00 0.00 C ATOM 0 H ILE A 97 22.298 -3.594 -9.326 1.00 0.00 H new ATOM 0 HA ILE A 97 23.816 -5.182 -7.569 1.00 0.00 H new ATOM 0 HB ILE A 97 20.984 -4.086 -7.623 1.00 0.00 H new ATOM 0 HG12 ILE A 97 21.917 -2.799 -5.634 1.00 0.00 H new ATOM 0 HG13 ILE A 97 23.473 -3.548 -5.927 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.698 -4.883 -5.288 1.00 0.00 H new ATOM 0 HG22 ILE A 97 20.876 -6.248 -6.416 1.00 0.00 H new ATOM 0 HG23 ILE A 97 22.247 -5.751 -5.396 1.00 0.00 H new ATOM 0 HD11 ILE A 97 23.352 -1.325 -7.016 1.00 0.00 H new ATOM 0 HD12 ILE A 97 23.504 -2.610 -8.238 1.00 0.00 H new ATOM 0 HD13 ILE A 97 21.923 -1.849 -7.939 1.00 0.00 H new ATOM 1497 N ILE A 98 21.232 -6.719 -8.945 1.00 0.00 N ATOM 1498 CA ILE A 98 20.679 -8.039 -9.227 1.00 0.00 C ATOM 1499 C ILE A 98 21.569 -8.788 -10.206 1.00 0.00 C ATOM 1500 O ILE A 98 21.796 -9.988 -10.062 1.00 0.00 O ATOM 1501 CB ILE A 98 19.269 -7.905 -9.802 1.00 0.00 C ATOM 1502 CG1 ILE A 98 18.731 -9.291 -10.154 1.00 0.00 C ATOM 1503 CG2 ILE A 98 19.314 -7.039 -11.059 1.00 0.00 C ATOM 1504 CD1 ILE A 98 17.233 -9.197 -10.446 1.00 0.00 C ATOM 0 H ILE A 98 20.692 -5.942 -9.325 1.00 0.00 H new ATOM 0 HA ILE A 98 20.632 -8.602 -8.295 1.00 0.00 H new ATOM 0 HB ILE A 98 18.616 -7.439 -9.064 1.00 0.00 H new ATOM 0 HG12 ILE A 98 19.257 -9.688 -11.022 1.00 0.00 H new ATOM 0 HG13 ILE A 98 18.909 -9.982 -9.330 1.00 0.00 H new ATOM 0 HG21 ILE A 98 18.309 -6.942 -11.470 1.00 0.00 H new ATOM 0 HG22 ILE A 98 19.699 -6.051 -10.807 1.00 0.00 H new ATOM 0 HG23 ILE A 98 19.966 -7.505 -11.798 1.00 0.00 H new ATOM 0 HD11 ILE A 98 16.849 -10.186 -10.697 1.00 0.00 H new ATOM 0 HD12 ILE A 98 16.714 -8.819 -9.565 1.00 0.00 H new ATOM 0 HD13 ILE A 98 17.067 -8.520 -11.284 1.00 0.00 H new ATOM 1516 N LEU A 99 22.068 -8.070 -11.205 1.00 0.00 N ATOM 1517 CA LEU A 99 22.928 -8.677 -12.208 1.00 0.00 C ATOM 1518 C LEU A 99 24.207 -9.203 -11.567 1.00 0.00 C ATOM 1519 O LEU A 99 24.693 -10.278 -11.919 1.00 0.00 O ATOM 1520 CB LEU A 99 23.277 -7.654 -13.295 1.00 0.00 C ATOM 1521 CG LEU A 99 24.200 -8.295 -14.341 1.00 0.00 C ATOM 1522 CD1 LEU A 99 23.506 -9.512 -14.972 1.00 0.00 C ATOM 1523 CD2 LEU A 99 24.529 -7.270 -15.425 1.00 0.00 C ATOM 0 H LEU A 99 21.893 -7.074 -11.340 1.00 0.00 H new ATOM 0 HA LEU A 99 22.392 -9.511 -12.661 1.00 0.00 H new ATOM 0 HB2 LEU A 99 22.366 -7.294 -13.773 1.00 0.00 H new ATOM 0 HB3 LEU A 99 23.766 -6.788 -12.848 1.00 0.00 H new ATOM 0 HG LEU A 99 25.121 -8.621 -13.858 1.00 0.00 H new ATOM 0 HD11 LEU A 99 24.165 -9.963 -15.714 1.00 0.00 H new ATOM 0 HD12 LEU A 99 23.278 -10.243 -14.197 1.00 0.00 H new ATOM 0 HD13 LEU A 99 22.582 -9.194 -15.454 1.00 0.00 H new ATOM 0 HD21 LEU A 99 25.184 -7.724 -16.168 1.00 0.00 H new ATOM 0 HD22 LEU A 99 23.608 -6.941 -15.906 1.00 0.00 H new ATOM 0 HD23 LEU A 99 25.030 -6.413 -14.975 1.00 0.00 H new ATOM 1535 N GLY A 100 24.762 -8.423 -10.648 1.00 0.00 N ATOM 1536 CA GLY A 100 25.995 -8.811 -9.979 1.00 0.00 C ATOM 1537 C GLY A 100 25.817 -10.125 -9.227 1.00 0.00 C ATOM 1538 O GLY A 100 26.705 -10.977 -9.226 1.00 0.00 O ATOM 0 H GLY A 100 24.381 -7.525 -10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 100 26.795 -8.913 -10.713 1.00 0.00 H new ATOM 0 HA3 GLY A 100 26.298 -8.028 -9.284 1.00 0.00 H new ATOM 1542 N VAL A 101 24.664 -10.279 -8.584 1.00 0.00 N ATOM 1543 CA VAL A 101 24.385 -11.493 -7.827 1.00 0.00 C ATOM 1544 C VAL A 101 24.365 -12.709 -8.748 1.00 0.00 C ATOM 1545 O VAL A 101 24.968 -13.738 -8.446 1.00 0.00 O ATOM 1546 CB VAL A 101 23.034 -11.363 -7.117 1.00 0.00 C ATOM 1547 CG1 VAL A 101 22.680 -12.690 -6.441 1.00 0.00 C ATOM 1548 CG2 VAL A 101 23.117 -10.260 -6.062 1.00 0.00 C ATOM 0 H VAL A 101 23.915 -9.586 -8.572 1.00 0.00 H new ATOM 0 HA VAL A 101 25.174 -11.628 -7.087 1.00 0.00 H new ATOM 0 HB VAL A 101 22.264 -11.112 -7.847 1.00 0.00 H new ATOM 0 HG11 VAL A 101 21.719 -12.596 -5.936 1.00 0.00 H new ATOM 0 HG12 VAL A 101 22.620 -13.477 -7.193 1.00 0.00 H new ATOM 0 HG13 VAL A 101 23.449 -12.943 -5.712 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.156 -10.167 -5.556 1.00 0.00 H new ATOM 0 HG22 VAL A 101 23.888 -10.511 -5.333 1.00 0.00 H new ATOM 0 HG23 VAL A 101 23.367 -9.314 -6.543 1.00 0.00 H new ATOM 1558 N ILE A 102 23.659 -12.585 -9.870 1.00 0.00 N ATOM 1559 CA ILE A 102 23.562 -13.686 -10.822 1.00 0.00 C ATOM 1560 C ILE A 102 24.933 -14.038 -11.382 1.00 0.00 C ATOM 1561 O ILE A 102 25.331 -15.201 -11.405 1.00 0.00 O ATOM 1562 CB ILE A 102 22.628 -13.297 -11.967 1.00 0.00 C ATOM 1563 CG1 ILE A 102 21.259 -12.909 -11.401 1.00 0.00 C ATOM 1564 CG2 ILE A 102 22.465 -14.488 -12.916 1.00 0.00 C ATOM 1565 CD1 ILE A 102 20.454 -12.180 -12.476 1.00 0.00 C ATOM 0 H ILE A 102 23.151 -11.742 -10.139 1.00 0.00 H new ATOM 0 HA ILE A 102 23.164 -14.557 -10.302 1.00 0.00 H new ATOM 0 HB ILE A 102 23.051 -12.451 -12.509 1.00 0.00 H new ATOM 0 HG12 ILE A 102 20.724 -13.799 -11.071 1.00 0.00 H new ATOM 0 HG13 ILE A 102 21.382 -12.269 -10.527 1.00 0.00 H new ATOM 0 HG21 ILE A 102 21.799 -14.213 -13.734 1.00 0.00 H new ATOM 0 HG22 ILE A 102 23.438 -14.768 -13.319 1.00 0.00 H new ATOM 0 HG23 ILE A 102 22.042 -15.332 -12.371 1.00 0.00 H new ATOM 0 HD11 ILE A 102 19.479 -11.903 -12.075 1.00 0.00 H new ATOM 0 HD12 ILE A 102 20.988 -11.281 -12.784 1.00 0.00 H new ATOM 0 HD13 ILE A 102 20.320 -12.835 -13.337 1.00 0.00 H new ATOM 1577 N CYS A 103 25.652 -13.024 -11.828 1.00 0.00 N ATOM 1578 CA CYS A 103 26.986 -13.235 -12.388 1.00 0.00 C ATOM 1579 C CYS A 103 27.913 -13.862 -11.351 1.00 0.00 C ATOM 1580 O CYS A 103 28.688 -14.765 -11.662 1.00 0.00 O ATOM 1581 CB CYS A 103 27.575 -11.902 -12.870 1.00 0.00 C ATOM 1582 SG CYS A 103 28.277 -10.989 -11.471 1.00 0.00 S ATOM 0 H CYS A 103 25.343 -12.052 -11.816 1.00 0.00 H new ATOM 0 HA CYS A 103 26.897 -13.916 -13.235 1.00 0.00 H new ATOM 0 HB2 CYS A 103 28.346 -12.086 -13.618 1.00 0.00 H new ATOM 0 HB3 CYS A 103 26.800 -11.306 -13.351 1.00 0.00 H new ATOM 0 HG CYS A 103 27.488 -11.096 -10.443 1.00 0.00 H new ATOM 1588 N ALA A 104 27.833 -13.366 -10.121 1.00 0.00 N ATOM 1589 CA ALA A 104 28.680 -13.870 -9.048 1.00 0.00 C ATOM 1590 C ALA A 104 28.558 -15.384 -8.938 1.00 0.00 C ATOM 1591 O ALA A 104 29.540 -16.077 -8.672 1.00 0.00 O ATOM 1592 CB ALA A 104 28.277 -13.226 -7.719 1.00 0.00 C ATOM 0 H ALA A 104 27.194 -12.620 -9.844 1.00 0.00 H new ATOM 0 HA ALA A 104 29.715 -13.615 -9.276 1.00 0.00 H new ATOM 0 HB1 ALA A 104 28.915 -13.608 -6.922 1.00 0.00 H new ATOM 0 HB2 ALA A 104 28.392 -12.144 -7.789 1.00 0.00 H new ATOM 0 HB3 ALA A 104 27.237 -13.467 -7.499 1.00 0.00 H new ATOM 1598 N ILE A 105 27.350 -15.891 -9.148 1.00 0.00 N ATOM 1599 CA ILE A 105 27.109 -17.327 -9.069 1.00 0.00 C ATOM 1600 C ILE A 105 27.906 -18.060 -10.142 1.00 0.00 C ATOM 1601 O ILE A 105 28.490 -19.108 -9.881 1.00 0.00 O ATOM 1602 CB ILE A 105 25.619 -17.620 -9.244 1.00 0.00 C ATOM 1603 CG1 ILE A 105 24.847 -17.062 -8.046 1.00 0.00 C ATOM 1604 CG2 ILE A 105 25.399 -19.133 -9.328 1.00 0.00 C ATOM 1605 CD1 ILE A 105 23.345 -17.104 -8.337 1.00 0.00 C ATOM 0 H ILE A 105 26.526 -15.334 -9.373 1.00 0.00 H new ATOM 0 HA ILE A 105 27.431 -17.678 -8.089 1.00 0.00 H new ATOM 0 HB ILE A 105 25.263 -17.150 -10.161 1.00 0.00 H new ATOM 0 HG12 ILE A 105 25.071 -17.645 -7.153 1.00 0.00 H new ATOM 0 HG13 ILE A 105 25.160 -16.038 -7.844 1.00 0.00 H new ATOM 0 HG21 ILE A 105 24.336 -19.340 -9.453 1.00 0.00 H new ATOM 0 HG22 ILE A 105 25.949 -19.534 -10.179 1.00 0.00 H new ATOM 0 HG23 ILE A 105 25.755 -19.604 -8.412 1.00 0.00 H new ATOM 0 HD11 ILE A 105 22.798 -16.706 -7.482 1.00 0.00 H new ATOM 0 HD12 ILE A 105 23.128 -16.502 -9.219 1.00 0.00 H new ATOM 0 HD13 ILE A 105 23.038 -18.134 -8.517 1.00 0.00 H new ATOM 1617 N ILE A 106 27.917 -17.506 -11.347 1.00 0.00 N ATOM 1618 CA ILE A 106 28.635 -18.124 -12.456 1.00 0.00 C ATOM 1619 C ILE A 106 30.124 -18.220 -12.138 1.00 0.00 C ATOM 1620 O ILE A 106 30.769 -19.223 -12.441 1.00 0.00 O ATOM 1621 CB ILE A 106 28.434 -17.304 -13.734 1.00 0.00 C ATOM 1622 CG1 ILE A 106 26.970 -17.397 -14.173 1.00 0.00 C ATOM 1623 CG2 ILE A 106 29.332 -17.858 -14.845 1.00 0.00 C ATOM 1624 CD1 ILE A 106 26.706 -16.389 -15.294 1.00 0.00 C ATOM 0 H ILE A 106 27.440 -16.635 -11.582 1.00 0.00 H new ATOM 0 HA ILE A 106 28.240 -19.129 -12.607 1.00 0.00 H new ATOM 0 HB ILE A 106 28.694 -16.263 -13.541 1.00 0.00 H new ATOM 0 HG12 ILE A 106 26.746 -18.407 -14.518 1.00 0.00 H new ATOM 0 HG13 ILE A 106 26.313 -17.196 -13.327 1.00 0.00 H new ATOM 0 HG21 ILE A 106 29.188 -17.274 -15.754 1.00 0.00 H new ATOM 0 HG22 ILE A 106 30.375 -17.796 -14.535 1.00 0.00 H new ATOM 0 HG23 ILE A 106 29.072 -18.899 -15.038 1.00 0.00 H new ATOM 0 HD11 ILE A 106 25.664 -16.456 -15.606 1.00 0.00 H new ATOM 0 HD12 ILE A 106 26.913 -15.381 -14.933 1.00 0.00 H new ATOM 0 HD13 ILE A 106 27.353 -16.611 -16.142 1.00 0.00 H new ATOM 1636 N LEU A 107 30.664 -17.167 -11.547 1.00 0.00 N ATOM 1637 CA LEU A 107 32.084 -17.140 -11.213 1.00 0.00 C ATOM 1638 C LEU A 107 32.437 -18.282 -10.273 1.00 0.00 C ATOM 1639 O LEU A 107 33.511 -18.872 -10.385 1.00 0.00 O ATOM 1640 CB LEU A 107 32.443 -15.791 -10.557 1.00 0.00 C ATOM 1641 CG LEU A 107 32.802 -14.760 -11.633 1.00 0.00 C ATOM 1642 CD1 LEU A 107 31.551 -14.375 -12.416 1.00 0.00 C ATOM 1643 CD2 LEU A 107 33.393 -13.521 -10.966 1.00 0.00 C ATOM 0 H LEU A 107 30.149 -16.325 -11.289 1.00 0.00 H new ATOM 0 HA LEU A 107 32.658 -17.259 -12.132 1.00 0.00 H new ATOM 0 HB2 LEU A 107 31.602 -15.431 -9.964 1.00 0.00 H new ATOM 0 HB3 LEU A 107 33.282 -15.922 -9.874 1.00 0.00 H new ATOM 0 HG LEU A 107 33.533 -15.189 -12.318 1.00 0.00 H new ATOM 0 HD11 LEU A 107 31.811 -13.642 -13.180 1.00 0.00 H new ATOM 0 HD12 LEU A 107 31.132 -15.262 -12.892 1.00 0.00 H new ATOM 0 HD13 LEU A 107 30.814 -13.946 -11.737 1.00 0.00 H new ATOM 0 HD21 LEU A 107 33.650 -12.785 -11.728 1.00 0.00 H new ATOM 0 HD22 LEU A 107 32.662 -13.093 -10.280 1.00 0.00 H new ATOM 0 HD23 LEU A 107 34.290 -13.799 -10.413 1.00 0.00 H new ATOM 1655 N ILE A 108 31.539 -18.581 -9.348 1.00 0.00 N ATOM 1656 CA ILE A 108 31.777 -19.651 -8.390 1.00 0.00 C ATOM 1657 C ILE A 108 31.932 -20.984 -9.119 1.00 0.00 C ATOM 1658 O ILE A 108 32.813 -21.777 -8.797 1.00 0.00 O ATOM 1659 CB ILE A 108 30.612 -19.735 -7.401 1.00 0.00 C ATOM 1660 CG1 ILE A 108 30.607 -18.484 -6.517 1.00 0.00 C ATOM 1661 CG2 ILE A 108 30.770 -20.980 -6.524 1.00 0.00 C ATOM 1662 CD1 ILE A 108 29.334 -18.462 -5.668 1.00 0.00 C ATOM 0 H ILE A 108 30.645 -18.103 -9.240 1.00 0.00 H new ATOM 0 HA ILE A 108 32.696 -19.436 -7.844 1.00 0.00 H new ATOM 0 HB ILE A 108 29.673 -19.799 -7.950 1.00 0.00 H new ATOM 0 HG12 ILE A 108 31.486 -18.478 -5.873 1.00 0.00 H new ATOM 0 HG13 ILE A 108 30.659 -17.588 -7.136 1.00 0.00 H new ATOM 0 HG21 ILE A 108 29.939 -21.037 -5.821 1.00 0.00 H new ATOM 0 HG22 ILE A 108 30.775 -21.870 -7.153 1.00 0.00 H new ATOM 0 HG23 ILE A 108 31.708 -20.920 -5.973 1.00 0.00 H new ATOM 0 HD11 ILE A 108 29.331 -17.572 -5.039 1.00 0.00 H new ATOM 0 HD12 ILE A 108 28.461 -18.448 -6.321 1.00 0.00 H new ATOM 0 HD13 ILE A 108 29.301 -19.351 -5.038 1.00 0.00 H new ATOM 1674 N ILE A 109 31.072 -21.223 -10.099 1.00 0.00 N ATOM 1675 CA ILE A 109 31.127 -22.466 -10.861 1.00 0.00 C ATOM 1676 C ILE A 109 32.439 -22.565 -11.623 1.00 0.00 C ATOM 1677 O ILE A 109 33.068 -23.623 -11.655 1.00 0.00 O ATOM 1678 CB ILE A 109 29.955 -22.524 -11.847 1.00 0.00 C ATOM 1679 CG1 ILE A 109 28.642 -22.277 -11.095 1.00 0.00 C ATOM 1680 CG2 ILE A 109 29.908 -23.902 -12.508 1.00 0.00 C ATOM 1681 CD1 ILE A 109 28.510 -23.261 -9.926 1.00 0.00 C ATOM 0 H ILE A 109 30.333 -20.580 -10.385 1.00 0.00 H new ATOM 0 HA ILE A 109 31.059 -23.303 -10.166 1.00 0.00 H new ATOM 0 HB ILE A 109 30.088 -21.759 -12.612 1.00 0.00 H new ATOM 0 HG12 ILE A 109 28.614 -21.253 -10.723 1.00 0.00 H new ATOM 0 HG13 ILE A 109 27.798 -22.392 -11.775 1.00 0.00 H new ATOM 0 HG21 ILE A 109 29.074 -23.941 -13.209 1.00 0.00 H new ATOM 0 HG22 ILE A 109 30.840 -24.081 -13.043 1.00 0.00 H new ATOM 0 HG23 ILE A 109 29.776 -24.668 -11.744 1.00 0.00 H new ATOM 0 HD11 ILE A 109 27.574 -23.076 -9.399 1.00 0.00 H new ATOM 0 HD12 ILE A 109 28.517 -24.282 -10.307 1.00 0.00 H new ATOM 0 HD13 ILE A 109 29.346 -23.125 -9.240 1.00 0.00 H new ATOM 1693 N ILE A 110 32.846 -21.462 -12.237 1.00 0.00 N ATOM 1694 CA ILE A 110 34.087 -21.440 -13.002 1.00 0.00 C ATOM 1695 C ILE A 110 35.278 -21.708 -12.085 1.00 0.00 C ATOM 1696 O ILE A 110 36.183 -22.465 -12.432 1.00 0.00 O ATOM 1697 CB ILE A 110 34.255 -20.079 -13.681 1.00 0.00 C ATOM 1698 CG1 ILE A 110 33.175 -19.910 -14.752 1.00 0.00 C ATOM 1699 CG2 ILE A 110 35.637 -20.002 -14.340 1.00 0.00 C ATOM 1700 CD1 ILE A 110 33.165 -18.461 -15.243 1.00 0.00 C ATOM 0 H ILE A 110 32.340 -20.577 -12.221 1.00 0.00 H new ATOM 0 HA ILE A 110 34.044 -22.220 -13.762 1.00 0.00 H new ATOM 0 HB ILE A 110 34.162 -19.288 -12.937 1.00 0.00 H new ATOM 0 HG12 ILE A 110 33.365 -20.586 -15.585 1.00 0.00 H new ATOM 0 HG13 ILE A 110 32.199 -20.174 -14.344 1.00 0.00 H new ATOM 0 HG21 ILE A 110 35.756 -19.032 -14.823 1.00 0.00 H new ATOM 0 HG22 ILE A 110 36.409 -20.126 -13.581 1.00 0.00 H new ATOM 0 HG23 ILE A 110 35.730 -20.793 -15.085 1.00 0.00 H new ATOM 0 HD11 ILE A 110 32.396 -18.341 -16.006 1.00 0.00 H new ATOM 0 HD12 ILE A 110 32.954 -17.795 -14.406 1.00 0.00 H new ATOM 0 HD13 ILE A 110 34.138 -18.214 -15.667 1.00 0.00 H new ATOM 1712 N ILE A 111 35.272 -21.077 -10.917 1.00 0.00 N ATOM 1713 CA ILE A 111 36.361 -21.256 -9.966 1.00 0.00 C ATOM 1714 C ILE A 111 36.430 -22.701 -9.493 1.00 0.00 C ATOM 1715 O ILE A 111 37.511 -23.282 -9.407 1.00 0.00 O ATOM 1716 CB ILE A 111 36.156 -20.326 -8.763 1.00 0.00 C ATOM 1717 CG1 ILE A 111 36.330 -18.863 -9.203 1.00 0.00 C ATOM 1718 CG2 ILE A 111 37.185 -20.663 -7.669 1.00 0.00 C ATOM 1719 CD1 ILE A 111 37.819 -18.478 -9.188 1.00 0.00 C ATOM 0 H ILE A 111 34.534 -20.444 -10.608 1.00 0.00 H new ATOM 0 HA ILE A 111 37.299 -21.009 -10.462 1.00 0.00 H new ATOM 0 HB ILE A 111 35.150 -20.465 -8.368 1.00 0.00 H new ATOM 0 HG12 ILE A 111 35.921 -18.726 -10.204 1.00 0.00 H new ATOM 0 HG13 ILE A 111 35.770 -18.206 -8.537 1.00 0.00 H new ATOM 0 HG21 ILE A 111 37.038 -20.002 -6.815 1.00 0.00 H new ATOM 0 HG22 ILE A 111 37.054 -21.698 -7.353 1.00 0.00 H new ATOM 0 HG23 ILE A 111 38.192 -20.528 -8.063 1.00 0.00 H new ATOM 0 HD11 ILE A 111 37.930 -17.440 -9.501 1.00 0.00 H new ATOM 0 HD12 ILE A 111 38.215 -18.597 -8.180 1.00 0.00 H new ATOM 0 HD13 ILE A 111 38.369 -19.124 -9.872 1.00 0.00 H new ATOM 1731 N VAL A 112 35.274 -23.271 -9.186 1.00 0.00 N ATOM 1732 CA VAL A 112 35.211 -24.648 -8.721 1.00 0.00 C ATOM 1733 C VAL A 112 35.610 -25.604 -9.840 1.00 0.00 C ATOM 1734 O VAL A 112 36.352 -26.560 -9.618 1.00 0.00 O ATOM 1735 CB VAL A 112 33.798 -24.974 -8.238 1.00 0.00 C ATOM 1736 CG1 VAL A 112 33.703 -26.463 -7.897 1.00 0.00 C ATOM 1737 CG2 VAL A 112 33.482 -24.145 -6.988 1.00 0.00 C ATOM 0 H VAL A 112 34.370 -22.803 -9.250 1.00 0.00 H new ATOM 0 HA VAL A 112 35.908 -24.768 -7.891 1.00 0.00 H new ATOM 0 HB VAL A 112 33.083 -24.736 -9.025 1.00 0.00 H new ATOM 0 HG11 VAL A 112 32.695 -26.694 -7.553 1.00 0.00 H new ATOM 0 HG12 VAL A 112 33.928 -27.055 -8.784 1.00 0.00 H new ATOM 0 HG13 VAL A 112 34.419 -26.703 -7.111 1.00 0.00 H new ATOM 0 HG21 VAL A 112 32.474 -24.377 -6.643 1.00 0.00 H new ATOM 0 HG22 VAL A 112 34.199 -24.384 -6.202 1.00 0.00 H new ATOM 0 HG23 VAL A 112 33.548 -23.084 -7.229 1.00 0.00 H new ATOM 1747 N TYR A 113 35.104 -25.342 -11.039 1.00 0.00 N ATOM 1748 CA TYR A 113 35.404 -26.188 -12.184 1.00 0.00 C ATOM 1749 C TYR A 113 36.901 -26.207 -12.464 1.00 0.00 C ATOM 1750 O TYR A 113 37.480 -27.257 -12.746 1.00 0.00 O ATOM 1751 CB TYR A 113 34.651 -25.690 -13.420 1.00 0.00 C ATOM 1752 CG TYR A 113 35.040 -26.521 -14.621 1.00 0.00 C ATOM 1753 CD1 TYR A 113 34.484 -27.795 -14.799 1.00 0.00 C ATOM 1754 CD2 TYR A 113 35.956 -26.020 -15.552 1.00 0.00 C ATOM 1755 CE1 TYR A 113 34.846 -28.565 -15.910 1.00 0.00 C ATOM 1756 CE2 TYR A 113 36.319 -26.791 -16.662 1.00 0.00 C ATOM 1757 CZ TYR A 113 35.763 -28.063 -16.841 1.00 0.00 C ATOM 1758 OH TYR A 113 36.120 -28.824 -17.936 1.00 0.00 O ATOM 0 H TYR A 113 34.488 -24.555 -11.242 1.00 0.00 H new ATOM 0 HA TYR A 113 35.081 -27.203 -11.952 1.00 0.00 H new ATOM 0 HB2 TYR A 113 33.576 -25.755 -13.254 1.00 0.00 H new ATOM 0 HB3 TYR A 113 34.883 -24.640 -13.601 1.00 0.00 H new ATOM 0 HD1 TYR A 113 33.777 -28.182 -14.080 1.00 0.00 H new ATOM 0 HD2 TYR A 113 36.383 -25.038 -15.414 1.00 0.00 H new ATOM 0 HE1 TYR A 113 34.418 -29.547 -16.049 1.00 0.00 H new ATOM 0 HE2 TYR A 113 37.028 -26.405 -17.380 1.00 0.00 H new ATOM 0 HH TYR A 113 36.765 -28.328 -18.483 1.00 0.00 H new ATOM 1768 N PHE A 114 37.519 -25.040 -12.384 1.00 0.00 N ATOM 1769 CA PHE A 114 38.952 -24.923 -12.630 1.00 0.00 C ATOM 1770 C PHE A 114 39.735 -25.797 -11.659 1.00 0.00 C ATOM 1771 O PHE A 114 40.662 -26.504 -12.050 1.00 0.00 O ATOM 1772 CB PHE A 114 39.394 -23.465 -12.486 1.00 0.00 C ATOM 1773 CG PHE A 114 40.876 -23.360 -12.764 1.00 0.00 C ATOM 1774 CD1 PHE A 114 41.349 -23.456 -14.079 1.00 0.00 C ATOM 1775 CD2 PHE A 114 41.776 -23.167 -11.709 1.00 0.00 C ATOM 1776 CE1 PHE A 114 42.721 -23.358 -14.337 1.00 0.00 C ATOM 1777 CE2 PHE A 114 43.147 -23.070 -11.968 1.00 0.00 C ATOM 1778 CZ PHE A 114 43.620 -23.165 -13.281 1.00 0.00 C ATOM 0 H PHE A 114 37.055 -24.162 -12.152 1.00 0.00 H new ATOM 0 HA PHE A 114 39.155 -25.260 -13.647 1.00 0.00 H new ATOM 0 HB2 PHE A 114 38.837 -22.835 -13.179 1.00 0.00 H new ATOM 0 HB3 PHE A 114 39.175 -23.105 -11.481 1.00 0.00 H new ATOM 0 HD1 PHE A 114 40.655 -23.606 -14.893 1.00 0.00 H new ATOM 0 HD2 PHE A 114 41.412 -23.093 -10.695 1.00 0.00 H new ATOM 0 HE1 PHE A 114 43.086 -23.431 -15.351 1.00 0.00 H new ATOM 0 HE2 PHE A 114 43.841 -22.922 -11.154 1.00 0.00 H new ATOM 0 HZ PHE A 114 44.679 -23.089 -13.480 1.00 0.00 H new ATOM 1788 N SER A 115 39.348 -25.749 -10.394 1.00 0.00 N ATOM 1789 CA SER A 115 40.011 -26.542 -9.366 1.00 0.00 C ATOM 1790 C SER A 115 39.849 -28.032 -9.650 1.00 0.00 C ATOM 1791 O SER A 115 40.793 -28.809 -9.505 1.00 0.00 O ATOM 1792 CB SER A 115 39.435 -26.215 -7.988 1.00 0.00 C ATOM 1793 OG SER A 115 39.841 -27.213 -7.061 1.00 0.00 O ATOM 0 H SER A 115 38.580 -25.171 -10.053 1.00 0.00 H new ATOM 0 HA SER A 115 41.072 -26.294 -9.377 1.00 0.00 H new ATOM 0 HB2 SER A 115 39.781 -25.235 -7.660 1.00 0.00 H new ATOM 0 HB3 SER A 115 38.347 -26.169 -8.037 1.00 0.00 H new ATOM 0 HG SER A 115 39.475 -27.006 -6.176 1.00 0.00 H new ATOM 1799 N THR A 116 38.647 -28.419 -10.055 1.00 0.00 N ATOM 1800 CA THR A 116 38.364 -29.813 -10.357 1.00 0.00 C ATOM 1801 C THR A 116 37.040 -29.949 -11.103 1.00 0.00 C ATOM 1802 O THR A 116 36.918 -30.874 -11.893 1.00 0.00 O ATOM 1803 CB THR A 116 38.305 -30.628 -9.062 1.00 0.00 C ATOM 1804 OG1 THR A 116 38.197 -32.011 -9.376 1.00 0.00 O ATOM 1805 CG2 THR A 116 37.094 -30.194 -8.237 1.00 0.00 C ATOM 1806 OXT THR A 116 36.169 -29.129 -10.874 1.00 0.00 O ATOM 0 H THR A 116 37.855 -27.788 -10.181 1.00 0.00 H new ATOM 0 HA THR A 116 39.165 -30.192 -10.992 1.00 0.00 H new ATOM 0 HB THR A 116 39.214 -30.457 -8.485 1.00 0.00 H new ATOM 0 HG1 THR A 116 38.161 -32.533 -8.547 1.00 0.00 H new ATOM 0 HG21 THR A 116 37.054 -30.775 -7.316 1.00 0.00 H new ATOM 0 HG22 THR A 116 37.180 -29.135 -7.994 1.00 0.00 H new ATOM 0 HG23 THR A 116 36.183 -30.362 -8.812 1.00 0.00 H new TER 1814 THR A 116