USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 743 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 24 TYR OH : rot 0:sc= -0.175! USER MOD Set 1.2: A 60 SER OG : rot -125:sc= 1.17 USER MOD Set 1.3: A 61 GLN : amide:sc= -1.13! K(o=-0.14!,f=3.9) USER MOD Set 2.1: A 35 HIS : no HE2:sc= 0.18 K(o=0.45,f=-3) USER MOD Set 2.2: A 36 ASN : amide:sc= 0.271 K(o=0.45,f=-2.3!) USER MOD Single : A 1 MET CE :methyl -154:sc= -0.159 (180deg=-1.1) USER MOD Single : A 1 MET N :NH3+ -159:sc= -0.0521 (180deg=-0.772) USER MOD Single : A 5 THR OG1 : rot -49:sc= 0.284 USER MOD Single : A 10 LYS NZ :NH3+ 150:sc= -0.32 (180deg=-1.49!) USER MOD Single : A 14 SER OG : rot -46:sc= 0.0054 USER MOD Single : A 18 LYS NZ :NH3+ -154:sc= -0.201 (180deg=-1.34!) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 137:sc=-0.00107 (180deg=-0.729) USER MOD Single : A 32 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.63) USER MOD Single : A 37 SER OG : rot -43:sc= -0.56 USER MOD Single : A 38 ASN : amide:sc= -2.02 K(o=-2,f=-0.86) USER MOD Single : A 44 GLN : amide:sc= -0.143 K(o=-0.14,f=-1.4!) USER MOD Single : A 47 MET CE :methyl 169:sc= -0.282 (180deg=-0.437) USER MOD Single : A 48 HIS : no HD1:sc= -0.998 K(o=-1,f=-2.3!) USER MOD Single : A 51 MET CE :methyl -119:sc= -1.55 (180deg=-2.6) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot -38:sc= 0.102 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -2.38 K(o=-2.4,f=-5.2) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.0337 X(o=-0.034,f=-0.0046) USER MOD Single : A 87 HIS : no HD1:sc= -3.34! C(o=-3.3!,f=-1.3!) USER MOD Single : A 88 HIS : no HE2:sc= -3.93! C(o=-3.9!,f=-12!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 90 HIS : no HD1:sc= -1.24 X(o=-1.2,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.813 -14.136 23.264 1.00 0.00 N ATOM 2 CA MET A 1 -3.360 -15.357 23.990 1.00 0.00 C ATOM 3 C MET A 1 -3.726 -16.591 23.172 1.00 0.00 C ATOM 4 O MET A 1 -2.937 -17.528 23.060 1.00 0.00 O ATOM 5 CB MET A 1 -4.047 -15.412 25.358 1.00 0.00 C ATOM 6 CG MET A 1 -3.706 -14.151 26.161 1.00 0.00 C ATOM 7 SD MET A 1 -1.918 -14.046 26.427 1.00 0.00 S ATOM 8 CE MET A 1 -1.752 -15.490 27.508 1.00 0.00 C ATOM 0 H1 MET A 1 -3.279 -13.311 23.605 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.648 -14.257 22.244 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.828 -13.987 23.436 1.00 0.00 H new ATOM 0 HA MET A 1 -2.280 -15.329 24.132 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.127 -15.492 25.230 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.724 -16.299 25.902 1.00 0.00 H new ATOM 0 HG2 MET A 1 -4.055 -13.266 25.628 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.224 -14.170 27.120 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.879 -15.366 28.149 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.645 -15.587 28.126 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.632 -16.387 26.901 1.00 0.00 H new ATOM 20 N GLY A 2 -4.926 -16.584 22.603 1.00 0.00 N ATOM 21 CA GLY A 2 -5.381 -17.710 21.798 1.00 0.00 C ATOM 22 C GLY A 2 -4.485 -17.908 20.581 1.00 0.00 C ATOM 23 O GLY A 2 -3.568 -18.728 20.602 1.00 0.00 O ATOM 0 H GLY A 2 -5.595 -15.819 22.683 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -5.384 -18.617 22.403 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.408 -17.539 21.474 1.00 0.00 H new ATOM 27 N VAL A 3 -4.753 -17.149 19.525 1.00 0.00 N ATOM 28 CA VAL A 3 -3.960 -17.248 18.305 1.00 0.00 C ATOM 29 C VAL A 3 -2.526 -16.800 18.564 1.00 0.00 C ATOM 30 O VAL A 3 -1.579 -17.374 18.027 1.00 0.00 O ATOM 31 CB VAL A 3 -4.576 -16.382 17.207 1.00 0.00 C ATOM 32 CG1 VAL A 3 -4.612 -14.924 17.664 1.00 0.00 C ATOM 33 CG2 VAL A 3 -3.729 -16.495 15.935 1.00 0.00 C ATOM 0 H VAL A 3 -5.507 -16.463 19.488 1.00 0.00 H new ATOM 0 HA VAL A 3 -3.953 -18.289 17.982 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.591 -16.723 17.003 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -5.052 -14.308 16.880 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.212 -14.841 18.570 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.598 -14.582 17.869 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.167 -15.878 15.150 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -2.715 -16.154 16.142 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -3.702 -17.534 15.607 1.00 0.00 H new ATOM 43 N TRP A 4 -2.376 -15.770 19.391 1.00 0.00 N ATOM 44 CA TRP A 4 -1.056 -15.239 19.720 1.00 0.00 C ATOM 45 C TRP A 4 -0.500 -15.920 20.966 1.00 0.00 C ATOM 46 O TRP A 4 -1.239 -16.248 21.893 1.00 0.00 O ATOM 47 CB TRP A 4 -1.152 -13.731 19.957 1.00 0.00 C ATOM 48 CG TRP A 4 -1.524 -13.053 18.676 1.00 0.00 C ATOM 49 CD1 TRP A 4 -0.819 -13.129 17.523 1.00 0.00 C ATOM 50 CD2 TRP A 4 -2.677 -12.207 18.396 1.00 0.00 C ATOM 51 NE1 TRP A 4 -1.465 -12.381 16.555 1.00 0.00 N ATOM 52 CE2 TRP A 4 -2.615 -11.795 17.044 1.00 0.00 C ATOM 53 CE3 TRP A 4 -3.760 -11.764 19.176 1.00 0.00 C ATOM 54 CZ2 TRP A 4 -3.592 -10.968 16.486 1.00 0.00 C ATOM 55 CZ3 TRP A 4 -4.745 -10.933 18.618 1.00 0.00 C ATOM 56 CH2 TRP A 4 -4.662 -10.538 17.275 1.00 0.00 C ATOM 0 H TRP A 4 -3.151 -15.286 19.845 1.00 0.00 H new ATOM 0 HA TRP A 4 -0.383 -15.435 18.885 1.00 0.00 H new ATOM 0 HB2 TRP A 4 -1.896 -13.518 20.724 1.00 0.00 H new ATOM 0 HB3 TRP A 4 -0.199 -13.347 20.322 1.00 0.00 H new ATOM 0 HD1 TRP A 4 0.097 -13.683 17.382 1.00 0.00 H new ATOM 0 HE1 TRP A 4 -1.132 -12.275 15.597 1.00 0.00 H new ATOM 0 HE3 TRP A 4 -3.835 -12.065 20.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 -3.521 -10.663 15.452 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 -5.571 -10.596 19.227 1.00 0.00 H new ATOM 0 HH2 TRP A 4 -5.425 -9.902 16.851 1.00 0.00 H new ATOM 67 N THR A 5 0.811 -16.122 20.975 1.00 0.00 N ATOM 68 CA THR A 5 1.478 -16.754 22.105 1.00 0.00 C ATOM 69 C THR A 5 2.986 -16.531 22.020 1.00 0.00 C ATOM 70 O THR A 5 3.776 -17.455 22.221 1.00 0.00 O ATOM 71 CB THR A 5 1.178 -18.255 22.123 1.00 0.00 C ATOM 72 OG1 THR A 5 -0.185 -18.465 21.787 1.00 0.00 O ATOM 73 CG2 THR A 5 1.458 -18.819 23.519 1.00 0.00 C ATOM 0 H THR A 5 1.434 -15.857 20.212 1.00 0.00 H new ATOM 0 HA THR A 5 1.104 -16.305 23.025 1.00 0.00 H new ATOM 0 HB THR A 5 1.814 -18.763 21.398 1.00 0.00 H new ATOM 0 HG1 THR A 5 -0.750 -17.875 22.329 1.00 0.00 H new ATOM 0 HG21 THR A 5 1.244 -19.888 23.529 1.00 0.00 H new ATOM 0 HG22 THR A 5 2.505 -18.656 23.774 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.825 -18.315 24.249 1.00 0.00 H new ATOM 81 N PRO A 6 3.393 -15.323 21.728 1.00 0.00 N ATOM 82 CA PRO A 6 4.837 -14.954 21.612 1.00 0.00 C ATOM 83 C PRO A 6 5.569 -15.114 22.943 1.00 0.00 C ATOM 84 O PRO A 6 4.975 -15.505 23.947 1.00 0.00 O ATOM 85 CB PRO A 6 4.794 -13.479 21.168 1.00 0.00 C ATOM 86 CG PRO A 6 3.463 -12.984 21.629 1.00 0.00 C ATOM 87 CD PRO A 6 2.519 -14.166 21.475 1.00 0.00 C ATOM 0 HA PRO A 6 5.380 -15.593 20.915 1.00 0.00 H new ATOM 0 HB2 PRO A 6 5.606 -12.907 21.616 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.898 -13.388 20.087 1.00 0.00 H new ATOM 0 HG2 PRO A 6 3.506 -12.647 22.665 1.00 0.00 H new ATOM 0 HG3 PRO A 6 3.131 -12.135 21.032 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.695 -14.120 22.187 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.078 -14.203 20.479 1.00 0.00 H new ATOM 95 N GLU A 7 6.861 -14.808 22.939 1.00 0.00 N ATOM 96 CA GLU A 7 7.670 -14.918 24.149 1.00 0.00 C ATOM 97 C GLU A 7 6.919 -14.333 25.341 1.00 0.00 C ATOM 98 O GLU A 7 7.254 -14.603 26.491 1.00 0.00 O ATOM 99 CB GLU A 7 9.000 -14.184 23.963 1.00 0.00 C ATOM 100 CG GLU A 7 9.899 -14.449 25.173 1.00 0.00 C ATOM 101 CD GLU A 7 11.282 -13.852 24.940 1.00 0.00 C ATOM 102 OE1 GLU A 7 11.425 -13.092 23.997 1.00 0.00 O ATOM 103 OE2 GLU A 7 12.177 -14.168 25.706 1.00 0.00 O ATOM 0 H GLU A 7 7.370 -14.483 22.117 1.00 0.00 H new ATOM 0 HA GLU A 7 7.869 -15.973 24.339 1.00 0.00 H new ATOM 0 HB2 GLU A 7 9.490 -14.522 23.050 1.00 0.00 H new ATOM 0 HB3 GLU A 7 8.825 -13.114 23.853 1.00 0.00 H new ATOM 0 HG2 GLU A 7 9.454 -14.015 26.068 1.00 0.00 H new ATOM 0 HG3 GLU A 7 9.982 -15.522 25.346 1.00 0.00 H new ATOM 110 N VAL A 8 5.894 -13.536 25.055 1.00 0.00 N ATOM 111 CA VAL A 8 5.100 -12.923 26.111 1.00 0.00 C ATOM 112 C VAL A 8 4.637 -13.989 27.094 1.00 0.00 C ATOM 113 O VAL A 8 4.652 -13.776 28.305 1.00 0.00 O ATOM 114 CB VAL A 8 3.881 -12.221 25.512 1.00 0.00 C ATOM 115 CG1 VAL A 8 3.030 -11.624 26.634 1.00 0.00 C ATOM 116 CG2 VAL A 8 4.346 -11.106 24.575 1.00 0.00 C ATOM 0 H VAL A 8 5.596 -13.302 24.108 1.00 0.00 H new ATOM 0 HA VAL A 8 5.716 -12.190 26.632 1.00 0.00 H new ATOM 0 HB VAL A 8 3.286 -12.942 24.952 1.00 0.00 H new ATOM 0 HG11 VAL A 8 2.162 -11.124 26.205 1.00 0.00 H new ATOM 0 HG12 VAL A 8 2.698 -12.419 27.301 1.00 0.00 H new ATOM 0 HG13 VAL A 8 3.623 -10.903 27.196 1.00 0.00 H new ATOM 0 HG21 VAL A 8 3.478 -10.605 24.147 1.00 0.00 H new ATOM 0 HG22 VAL A 8 4.942 -10.385 25.135 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.950 -11.532 23.774 1.00 0.00 H new ATOM 126 N LEU A 9 4.225 -15.138 26.569 1.00 0.00 N ATOM 127 CA LEU A 9 3.764 -16.220 27.427 1.00 0.00 C ATOM 128 C LEU A 9 4.877 -16.633 28.382 1.00 0.00 C ATOM 129 O LEU A 9 4.658 -16.766 29.587 1.00 0.00 O ATOM 130 CB LEU A 9 3.348 -17.423 26.570 1.00 0.00 C ATOM 131 CG LEU A 9 2.898 -18.586 27.469 1.00 0.00 C ATOM 132 CD1 LEU A 9 1.721 -18.143 28.355 1.00 0.00 C ATOM 133 CD2 LEU A 9 2.474 -19.770 26.591 1.00 0.00 C ATOM 0 H LEU A 9 4.201 -15.341 25.570 1.00 0.00 H new ATOM 0 HA LEU A 9 2.906 -15.875 28.003 1.00 0.00 H new ATOM 0 HB2 LEU A 9 2.538 -17.138 25.899 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.183 -17.739 25.945 1.00 0.00 H new ATOM 0 HG LEU A 9 3.725 -18.887 28.111 1.00 0.00 H new ATOM 0 HD11 LEU A 9 1.409 -18.974 28.988 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.031 -17.306 28.981 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.887 -17.835 27.725 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.154 -20.597 27.225 1.00 0.00 H new ATOM 0 HD22 LEU A 9 1.649 -19.467 25.946 1.00 0.00 H new ATOM 0 HD23 LEU A 9 3.317 -20.088 25.977 1.00 0.00 H new ATOM 145 N LYS A 10 6.070 -16.824 27.839 1.00 0.00 N ATOM 146 CA LYS A 10 7.217 -17.205 28.652 1.00 0.00 C ATOM 147 C LYS A 10 7.613 -16.064 29.577 1.00 0.00 C ATOM 148 O LYS A 10 7.969 -16.280 30.733 1.00 0.00 O ATOM 149 CB LYS A 10 8.396 -17.573 27.755 1.00 0.00 C ATOM 150 CG LYS A 10 8.131 -18.930 27.103 1.00 0.00 C ATOM 151 CD LYS A 10 9.224 -19.245 26.072 1.00 0.00 C ATOM 152 CE LYS A 10 10.488 -19.750 26.772 1.00 0.00 C ATOM 153 NZ LYS A 10 10.148 -20.922 27.625 1.00 0.00 N ATOM 0 H LYS A 10 6.270 -16.722 26.844 1.00 0.00 H new ATOM 0 HA LYS A 10 6.942 -18.070 29.256 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.537 -16.810 26.989 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.315 -17.611 28.340 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.104 -19.709 27.865 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.155 -18.924 26.619 1.00 0.00 H new ATOM 0 HD2 LYS A 10 8.864 -19.997 25.370 1.00 0.00 H new ATOM 0 HD3 LYS A 10 9.454 -18.351 25.492 1.00 0.00 H new ATOM 0 HE2 LYS A 10 11.239 -20.030 26.033 1.00 0.00 H new ATOM 0 HE3 LYS A 10 10.921 -18.957 27.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 10.970 -21.556 27.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 9.891 -20.595 28.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 9.346 -21.435 27.207 1.00 0.00 H new ATOM 167 N ALA A 11 7.553 -14.848 29.053 1.00 0.00 N ATOM 168 CA ALA A 11 7.910 -13.674 29.835 1.00 0.00 C ATOM 169 C ALA A 11 7.005 -13.569 31.054 1.00 0.00 C ATOM 170 O ALA A 11 7.420 -13.116 32.113 1.00 0.00 O ATOM 171 CB ALA A 11 7.779 -12.412 28.980 1.00 0.00 C ATOM 0 H ALA A 11 7.262 -14.650 28.096 1.00 0.00 H new ATOM 0 HA ALA A 11 8.944 -13.771 30.165 1.00 0.00 H new ATOM 0 HB1 ALA A 11 8.049 -11.540 29.575 1.00 0.00 H new ATOM 0 HB2 ALA A 11 8.445 -12.484 28.120 1.00 0.00 H new ATOM 0 HB3 ALA A 11 6.750 -12.312 28.635 1.00 0.00 H new ATOM 177 N ARG A 12 5.758 -13.992 30.894 1.00 0.00 N ATOM 178 CA ARG A 12 4.799 -13.946 31.993 1.00 0.00 C ATOM 179 C ARG A 12 4.940 -15.176 32.880 1.00 0.00 C ATOM 180 O ARG A 12 5.086 -15.065 34.096 1.00 0.00 O ATOM 181 CB ARG A 12 3.380 -13.883 31.426 1.00 0.00 C ATOM 182 CG ARG A 12 3.176 -12.572 30.650 1.00 0.00 C ATOM 183 CD ARG A 12 2.802 -11.439 31.613 1.00 0.00 C ATOM 184 NE ARG A 12 2.671 -10.184 30.882 1.00 0.00 N ATOM 185 CZ ARG A 12 3.717 -9.384 30.694 1.00 0.00 C ATOM 186 NH1 ARG A 12 4.892 -9.728 31.149 1.00 0.00 N ATOM 187 NH2 ARG A 12 3.569 -8.262 30.051 1.00 0.00 N ATOM 0 H ARG A 12 5.387 -14.368 30.021 1.00 0.00 H new ATOM 0 HA ARG A 12 4.997 -13.059 32.595 1.00 0.00 H new ATOM 0 HB2 ARG A 12 3.205 -14.734 30.768 1.00 0.00 H new ATOM 0 HB3 ARG A 12 2.654 -13.952 32.236 1.00 0.00 H new ATOM 0 HG2 ARG A 12 4.088 -12.315 30.111 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.390 -12.700 29.905 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.865 -11.675 32.118 1.00 0.00 H new ATOM 0 HD3 ARG A 12 3.565 -11.341 32.386 1.00 0.00 H new ATOM 0 HE ARG A 12 1.761 -9.915 30.508 1.00 0.00 H new ATOM 0 HH11 ARG A 12 5.007 -10.610 31.648 1.00 0.00 H new ATOM 0 HH12 ARG A 12 5.694 -9.115 31.005 1.00 0.00 H new ATOM 0 HH21 ARG A 12 2.652 -7.997 29.692 1.00 0.00 H new ATOM 0 HH22 ARG A 12 4.370 -7.648 29.906 1.00 0.00 H new ATOM 201 N ALA A 13 4.897 -16.350 32.263 1.00 0.00 N ATOM 202 CA ALA A 13 5.023 -17.592 33.012 1.00 0.00 C ATOM 203 C ALA A 13 6.406 -17.699 33.639 1.00 0.00 C ATOM 204 O ALA A 13 6.547 -18.051 34.810 1.00 0.00 O ATOM 205 CB ALA A 13 4.794 -18.783 32.083 1.00 0.00 C ATOM 0 H ALA A 13 4.777 -16.468 31.257 1.00 0.00 H new ATOM 0 HA ALA A 13 4.274 -17.596 33.804 1.00 0.00 H new ATOM 0 HB1 ALA A 13 4.890 -19.710 32.649 1.00 0.00 H new ATOM 0 HB2 ALA A 13 3.794 -18.722 31.653 1.00 0.00 H new ATOM 0 HB3 ALA A 13 5.535 -18.768 31.283 1.00 0.00 H new ATOM 211 N SER A 14 7.427 -17.381 32.848 1.00 0.00 N ATOM 212 CA SER A 14 8.807 -17.435 33.319 1.00 0.00 C ATOM 213 C SER A 14 9.223 -16.090 33.900 1.00 0.00 C ATOM 214 O SER A 14 10.368 -15.920 34.307 1.00 0.00 O ATOM 215 CB SER A 14 9.744 -17.818 32.167 1.00 0.00 C ATOM 216 OG SER A 14 10.893 -18.462 32.699 1.00 0.00 O ATOM 0 H SER A 14 7.324 -17.083 31.878 1.00 0.00 H new ATOM 0 HA SER A 14 8.877 -18.192 34.101 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.231 -18.480 31.469 1.00 0.00 H new ATOM 0 HB3 SER A 14 10.036 -16.929 31.608 1.00 0.00 H new ATOM 0 HG SER A 14 11.224 -17.956 33.470 1.00 0.00 H new ATOM 222 N VAL A 15 8.282 -15.146 33.925 1.00 0.00 N ATOM 223 CA VAL A 15 8.552 -13.812 34.452 1.00 0.00 C ATOM 224 C VAL A 15 9.572 -13.092 33.577 1.00 0.00 C ATOM 225 O VAL A 15 9.281 -12.036 33.011 1.00 0.00 O ATOM 226 CB VAL A 15 9.076 -13.903 35.887 1.00 0.00 C ATOM 227 CG1 VAL A 15 9.029 -12.520 36.533 1.00 0.00 C ATOM 228 CG2 VAL A 15 8.199 -14.873 36.682 1.00 0.00 C ATOM 0 H VAL A 15 7.329 -15.282 33.587 1.00 0.00 H new ATOM 0 HA VAL A 15 7.620 -13.247 34.449 1.00 0.00 H new ATOM 0 HB VAL A 15 10.105 -14.263 35.882 1.00 0.00 H new ATOM 0 HG11 VAL A 15 9.402 -12.583 37.555 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.651 -11.830 35.962 1.00 0.00 H new ATOM 0 HG13 VAL A 15 8.001 -12.158 36.544 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.568 -14.942 37.705 1.00 0.00 H new ATOM 0 HG22 VAL A 15 7.171 -14.511 36.690 1.00 0.00 H new ATOM 0 HG23 VAL A 15 8.233 -15.858 36.217 1.00 0.00 H new ATOM 238 N ILE A 16 10.769 -13.664 33.469 1.00 0.00 N ATOM 239 CA ILE A 16 11.830 -13.070 32.656 1.00 0.00 C ATOM 240 C ILE A 16 12.126 -13.945 31.447 1.00 0.00 C ATOM 241 O ILE A 16 12.519 -15.105 31.582 1.00 0.00 O ATOM 242 CB ILE A 16 13.097 -12.902 33.505 1.00 0.00 C ATOM 243 CG1 ILE A 16 12.791 -12.027 34.742 1.00 0.00 C ATOM 244 CG2 ILE A 16 14.201 -12.253 32.659 1.00 0.00 C ATOM 245 CD1 ILE A 16 12.864 -10.531 34.386 1.00 0.00 C ATOM 0 H ILE A 16 11.029 -14.535 33.932 1.00 0.00 H new ATOM 0 HA ILE A 16 11.499 -12.093 32.303 1.00 0.00 H new ATOM 0 HB ILE A 16 13.436 -13.881 33.844 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.799 -12.266 35.126 1.00 0.00 H new ATOM 0 HG13 ILE A 16 13.503 -12.251 35.537 1.00 0.00 H new ATOM 0 HG21 ILE A 16 15.100 -12.134 33.263 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.422 -12.887 31.801 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.866 -11.276 32.311 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.645 -9.935 35.272 1.00 0.00 H new ATOM 0 HD12 ILE A 16 13.864 -10.291 34.025 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.134 -10.306 33.608 1.00 0.00 H new ATOM 257 N GLY A 17 11.935 -13.375 30.263 1.00 0.00 N ATOM 258 CA GLY A 17 12.181 -14.104 29.027 1.00 0.00 C ATOM 259 C GLY A 17 13.657 -14.465 28.902 1.00 0.00 C ATOM 260 O GLY A 17 14.531 -13.679 29.270 1.00 0.00 O ATOM 0 H GLY A 17 11.612 -12.416 30.134 1.00 0.00 H new ATOM 0 HA2 GLY A 17 11.576 -15.011 29.007 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.876 -13.498 28.174 1.00 0.00 H new ATOM 264 N LYS A 18 13.924 -15.657 28.384 1.00 0.00 N ATOM 265 CA LYS A 18 15.296 -16.119 28.215 1.00 0.00 C ATOM 266 C LYS A 18 15.321 -17.460 27.491 1.00 0.00 C ATOM 267 O LYS A 18 15.972 -18.406 27.935 1.00 0.00 O ATOM 268 CB LYS A 18 15.971 -16.262 29.577 1.00 0.00 C ATOM 269 CG LYS A 18 15.115 -17.156 30.487 1.00 0.00 C ATOM 270 CD LYS A 18 15.652 -17.119 31.927 1.00 0.00 C ATOM 271 CE LYS A 18 16.847 -18.067 32.062 1.00 0.00 C ATOM 272 NZ LYS A 18 16.415 -19.453 31.728 1.00 0.00 N ATOM 0 H LYS A 18 13.212 -16.319 28.075 1.00 0.00 H new ATOM 0 HA LYS A 18 15.836 -15.384 27.618 1.00 0.00 H new ATOM 0 HB2 LYS A 18 16.965 -16.693 29.458 1.00 0.00 H new ATOM 0 HB3 LYS A 18 16.102 -15.281 30.034 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.079 -16.819 30.469 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.123 -18.180 30.114 1.00 0.00 H new ATOM 0 HD2 LYS A 18 15.951 -16.104 32.187 1.00 0.00 H new ATOM 0 HD3 LYS A 18 14.866 -17.408 32.625 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.651 -17.754 31.396 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.241 -18.031 33.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.031 -20.135 32.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 15.432 -19.594 32.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 16.480 -19.599 30.700 1.00 0.00 H new ATOM 286 N PRO A 19 14.625 -17.553 26.390 1.00 0.00 N ATOM 287 CA PRO A 19 14.557 -18.805 25.580 1.00 0.00 C ATOM 288 C PRO A 19 15.929 -19.215 25.050 1.00 0.00 C ATOM 289 O PRO A 19 16.714 -18.376 24.612 1.00 0.00 O ATOM 290 CB PRO A 19 13.593 -18.448 24.431 1.00 0.00 C ATOM 291 CG PRO A 19 13.609 -16.955 24.363 1.00 0.00 C ATOM 292 CD PRO A 19 13.829 -16.474 25.793 1.00 0.00 C ATOM 0 HA PRO A 19 14.217 -19.659 26.166 1.00 0.00 H new ATOM 0 HB2 PRO A 19 13.920 -18.890 23.490 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.589 -18.824 24.627 1.00 0.00 H new ATOM 0 HG2 PRO A 19 14.404 -16.602 23.706 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.670 -16.572 23.962 1.00 0.00 H new ATOM 0 HD2 PRO A 19 14.357 -15.521 25.821 1.00 0.00 H new ATOM 0 HD3 PRO A 19 12.885 -16.331 26.320 1.00 0.00 H new ATOM 300 N ILE A 20 16.204 -20.514 25.086 1.00 0.00 N ATOM 301 CA ILE A 20 17.478 -21.035 24.599 1.00 0.00 C ATOM 302 C ILE A 20 17.398 -21.328 23.104 1.00 0.00 C ATOM 303 O ILE A 20 16.427 -21.913 22.629 1.00 0.00 O ATOM 304 CB ILE A 20 17.846 -22.313 25.357 1.00 0.00 C ATOM 305 CG1 ILE A 20 16.608 -23.229 25.456 1.00 0.00 C ATOM 306 CG2 ILE A 20 18.341 -21.948 26.763 1.00 0.00 C ATOM 307 CD1 ILE A 20 17.045 -24.698 25.479 1.00 0.00 C ATOM 0 H ILE A 20 15.566 -21.224 25.445 1.00 0.00 H new ATOM 0 HA ILE A 20 18.247 -20.282 24.769 1.00 0.00 H new ATOM 0 HB ILE A 20 18.637 -22.840 24.824 1.00 0.00 H new ATOM 0 HG12 ILE A 20 16.043 -22.995 26.358 1.00 0.00 H new ATOM 0 HG13 ILE A 20 15.945 -23.051 24.609 1.00 0.00 H new ATOM 0 HG21 ILE A 20 18.603 -22.857 27.304 1.00 0.00 H new ATOM 0 HG22 ILE A 20 19.219 -21.306 26.685 1.00 0.00 H new ATOM 0 HG23 ILE A 20 17.553 -21.421 27.301 1.00 0.00 H new ATOM 0 HD11 ILE A 20 16.166 -25.338 25.549 1.00 0.00 H new ATOM 0 HD12 ILE A 20 17.591 -24.930 24.564 1.00 0.00 H new ATOM 0 HD13 ILE A 20 17.690 -24.872 26.340 1.00 0.00 H new ATOM 319 N GLY A 21 18.425 -20.920 22.368 1.00 0.00 N ATOM 320 CA GLY A 21 18.449 -21.151 20.929 1.00 0.00 C ATOM 321 C GLY A 21 18.672 -22.624 20.624 1.00 0.00 C ATOM 322 O GLY A 21 19.766 -23.151 20.826 1.00 0.00 O ATOM 0 H GLY A 21 19.242 -20.434 22.738 1.00 0.00 H new ATOM 0 HA2 GLY A 21 17.509 -20.821 20.487 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.241 -20.556 20.473 1.00 0.00 H new ATOM 326 N GLU A 22 17.630 -23.285 20.124 1.00 0.00 N ATOM 327 CA GLU A 22 17.731 -24.701 19.787 1.00 0.00 C ATOM 328 C GLU A 22 16.435 -25.178 19.125 1.00 0.00 C ATOM 329 O GLU A 22 15.788 -24.432 18.390 1.00 0.00 O ATOM 330 CB GLU A 22 18.007 -25.534 21.055 1.00 0.00 C ATOM 331 CG GLU A 22 18.798 -26.796 20.692 1.00 0.00 C ATOM 332 CD GLU A 22 19.018 -27.647 21.935 1.00 0.00 C ATOM 333 OE1 GLU A 22 18.492 -27.287 22.977 1.00 0.00 O ATOM 334 OE2 GLU A 22 19.712 -28.644 21.831 1.00 0.00 O ATOM 0 H GLU A 22 16.717 -22.868 19.945 1.00 0.00 H new ATOM 0 HA GLU A 22 18.558 -24.834 19.090 1.00 0.00 H new ATOM 0 HB2 GLU A 22 18.567 -24.939 21.776 1.00 0.00 H new ATOM 0 HB3 GLU A 22 17.066 -25.809 21.531 1.00 0.00 H new ATOM 0 HG2 GLU A 22 18.258 -27.370 19.939 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.758 -26.521 20.255 1.00 0.00 H new ATOM 341 N SER A 23 16.063 -26.427 19.401 1.00 0.00 N ATOM 342 CA SER A 23 14.845 -26.996 18.839 1.00 0.00 C ATOM 343 C SER A 23 13.618 -26.443 19.555 1.00 0.00 C ATOM 344 O SER A 23 12.574 -26.234 18.945 1.00 0.00 O ATOM 345 CB SER A 23 14.871 -28.520 18.964 1.00 0.00 C ATOM 346 OG SER A 23 14.991 -28.878 20.336 1.00 0.00 O ATOM 0 H SER A 23 16.586 -27.059 20.007 1.00 0.00 H new ATOM 0 HA SER A 23 14.791 -26.722 17.785 1.00 0.00 H new ATOM 0 HB2 SER A 23 13.960 -28.946 18.544 1.00 0.00 H new ATOM 0 HB3 SER A 23 15.706 -28.929 18.395 1.00 0.00 H new ATOM 0 HG SER A 23 15.006 -29.854 20.419 1.00 0.00 H new ATOM 352 N TYR A 24 13.753 -26.207 20.856 1.00 0.00 N ATOM 353 CA TYR A 24 12.645 -25.677 21.642 1.00 0.00 C ATOM 354 C TYR A 24 12.269 -24.282 21.156 1.00 0.00 C ATOM 355 O TYR A 24 11.120 -23.861 21.275 1.00 0.00 O ATOM 356 CB TYR A 24 13.022 -25.626 23.123 1.00 0.00 C ATOM 357 CG TYR A 24 13.198 -27.032 23.646 1.00 0.00 C ATOM 358 CD1 TYR A 24 14.442 -27.666 23.548 1.00 0.00 C ATOM 359 CD2 TYR A 24 12.115 -27.703 24.230 1.00 0.00 C ATOM 360 CE1 TYR A 24 14.605 -28.969 24.032 1.00 0.00 C ATOM 361 CE2 TYR A 24 12.278 -29.007 24.714 1.00 0.00 C ATOM 362 CZ TYR A 24 13.523 -29.639 24.616 1.00 0.00 C ATOM 363 OH TYR A 24 13.684 -30.924 25.093 1.00 0.00 O ATOM 0 H TYR A 24 14.610 -26.372 21.384 1.00 0.00 H new ATOM 0 HA TYR A 24 11.787 -26.338 21.517 1.00 0.00 H new ATOM 0 HB2 TYR A 24 13.944 -25.059 23.255 1.00 0.00 H new ATOM 0 HB3 TYR A 24 12.246 -25.110 23.689 1.00 0.00 H new ATOM 0 HD1 TYR A 24 15.277 -27.149 23.098 1.00 0.00 H new ATOM 0 HD2 TYR A 24 11.155 -27.215 24.307 1.00 0.00 H new ATOM 0 HE1 TYR A 24 15.565 -29.458 23.955 1.00 0.00 H new ATOM 0 HE2 TYR A 24 11.443 -29.525 25.163 1.00 0.00 H new ATOM 0 HH TYR A 24 14.608 -31.215 24.945 1.00 0.00 H new ATOM 373 N LYS A 25 13.249 -23.568 20.614 1.00 0.00 N ATOM 374 CA LYS A 25 13.009 -22.222 20.112 1.00 0.00 C ATOM 375 C LYS A 25 12.341 -22.278 18.742 1.00 0.00 C ATOM 376 O LYS A 25 11.890 -21.264 18.209 1.00 0.00 O ATOM 377 CB LYS A 25 14.339 -21.463 20.018 1.00 0.00 C ATOM 378 CG LYS A 25 14.071 -19.991 19.708 1.00 0.00 C ATOM 379 CD LYS A 25 15.378 -19.200 19.783 1.00 0.00 C ATOM 380 CE LYS A 25 15.103 -17.724 19.489 1.00 0.00 C ATOM 381 NZ LYS A 25 16.374 -16.951 19.597 1.00 0.00 N ATOM 0 H LYS A 25 14.209 -23.896 20.512 1.00 0.00 H new ATOM 0 HA LYS A 25 12.344 -21.700 20.800 1.00 0.00 H new ATOM 0 HB2 LYS A 25 14.887 -21.553 20.956 1.00 0.00 H new ATOM 0 HB3 LYS A 25 14.964 -21.901 19.240 1.00 0.00 H new ATOM 0 HG2 LYS A 25 13.632 -19.893 18.715 1.00 0.00 H new ATOM 0 HG3 LYS A 25 13.349 -19.586 20.417 1.00 0.00 H new ATOM 0 HD2 LYS A 25 15.823 -19.307 20.772 1.00 0.00 H new ATOM 0 HD3 LYS A 25 16.096 -19.596 19.065 1.00 0.00 H new ATOM 0 HE2 LYS A 25 14.681 -17.613 18.490 1.00 0.00 H new ATOM 0 HE3 LYS A 25 14.366 -17.333 20.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 16.188 -15.947 19.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 16.758 -17.047 20.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 17.063 -17.319 18.910 1.00 0.00 H new ATOM 395 N ARG A 26 12.273 -23.473 18.172 1.00 0.00 N ATOM 396 CA ARG A 26 11.664 -23.637 16.865 1.00 0.00 C ATOM 397 C ARG A 26 10.201 -23.245 16.908 1.00 0.00 C ATOM 398 O ARG A 26 9.714 -22.551 16.021 1.00 0.00 O ATOM 399 CB ARG A 26 11.794 -25.091 16.415 1.00 0.00 C ATOM 400 CG ARG A 26 11.215 -25.265 15.002 1.00 0.00 C ATOM 401 CD ARG A 26 11.988 -24.395 14.001 1.00 0.00 C ATOM 402 NE ARG A 26 11.952 -24.996 12.680 1.00 0.00 N ATOM 403 CZ ARG A 26 12.329 -24.309 11.612 1.00 0.00 C ATOM 404 NH1 ARG A 26 12.742 -23.077 11.739 1.00 0.00 N ATOM 405 NH2 ARG A 26 12.291 -24.866 10.436 1.00 0.00 N ATOM 0 H ARG A 26 12.628 -24.333 18.590 1.00 0.00 H new ATOM 0 HA ARG A 26 12.179 -22.989 16.156 1.00 0.00 H new ATOM 0 HB2 ARG A 26 12.842 -25.390 16.425 1.00 0.00 H new ATOM 0 HB3 ARG A 26 11.270 -25.743 17.113 1.00 0.00 H new ATOM 0 HG2 ARG A 26 11.272 -26.312 14.704 1.00 0.00 H new ATOM 0 HG3 ARG A 26 10.161 -24.989 14.997 1.00 0.00 H new ATOM 0 HD2 ARG A 26 11.554 -23.396 13.966 1.00 0.00 H new ATOM 0 HD3 ARG A 26 13.021 -24.282 14.329 1.00 0.00 H new ATOM 0 HE ARG A 26 11.633 -25.959 12.573 1.00 0.00 H new ATOM 0 HH11 ARG A 26 12.775 -22.643 12.661 1.00 0.00 H new ATOM 0 HH12 ARG A 26 13.032 -22.549 10.916 1.00 0.00 H new ATOM 0 HH21 ARG A 26 11.971 -25.830 10.338 1.00 0.00 H new ATOM 0 HH22 ARG A 26 12.581 -24.339 9.612 1.00 0.00 H new ATOM 419 N ILE A 27 9.505 -23.688 17.945 1.00 0.00 N ATOM 420 CA ILE A 27 8.096 -23.375 18.081 1.00 0.00 C ATOM 421 C ILE A 27 7.905 -21.872 18.257 1.00 0.00 C ATOM 422 O ILE A 27 7.004 -21.274 17.668 1.00 0.00 O ATOM 423 CB ILE A 27 7.505 -24.133 19.282 1.00 0.00 C ATOM 424 CG1 ILE A 27 8.532 -24.152 20.421 1.00 0.00 C ATOM 425 CG2 ILE A 27 7.170 -25.574 18.878 1.00 0.00 C ATOM 426 CD1 ILE A 27 7.842 -24.531 21.730 1.00 0.00 C ATOM 0 H ILE A 27 9.891 -24.260 18.696 1.00 0.00 H new ATOM 0 HA ILE A 27 7.574 -23.687 17.176 1.00 0.00 H new ATOM 0 HB ILE A 27 6.594 -23.632 19.611 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.325 -24.866 20.197 1.00 0.00 H new ATOM 0 HG13 ILE A 27 9.002 -23.173 20.516 1.00 0.00 H new ATOM 0 HG21 ILE A 27 6.752 -26.104 19.734 1.00 0.00 H new ATOM 0 HG22 ILE A 27 6.442 -25.565 18.066 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.077 -26.079 18.546 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.575 -24.544 22.537 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.065 -23.801 21.956 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.393 -25.520 21.632 1.00 0.00 H new ATOM 438 N LEU A 28 8.759 -21.275 19.072 1.00 0.00 N ATOM 439 CA LEU A 28 8.688 -19.845 19.326 1.00 0.00 C ATOM 440 C LEU A 28 8.949 -19.064 18.047 1.00 0.00 C ATOM 441 O LEU A 28 8.252 -18.096 17.743 1.00 0.00 O ATOM 442 CB LEU A 28 9.723 -19.458 20.387 1.00 0.00 C ATOM 443 CG LEU A 28 9.309 -20.037 21.752 1.00 0.00 C ATOM 444 CD1 LEU A 28 10.450 -19.837 22.761 1.00 0.00 C ATOM 445 CD2 LEU A 28 8.023 -19.345 22.265 1.00 0.00 C ATOM 0 H LEU A 28 9.508 -21.757 19.568 1.00 0.00 H new ATOM 0 HA LEU A 28 7.688 -19.602 19.686 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.706 -19.835 20.104 1.00 0.00 H new ATOM 0 HB3 LEU A 28 9.804 -18.373 20.451 1.00 0.00 H new ATOM 0 HG LEU A 28 9.107 -21.102 21.639 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.157 -20.247 23.728 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.344 -20.349 22.406 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.660 -18.773 22.867 1.00 0.00 H new ATOM 0 HD21 LEU A 28 7.744 -19.766 23.231 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.204 -18.276 22.374 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.214 -19.505 21.552 1.00 0.00 H new ATOM 457 N ALA A 29 9.955 -19.497 17.296 1.00 0.00 N ATOM 458 CA ALA A 29 10.299 -18.835 16.046 1.00 0.00 C ATOM 459 C ALA A 29 9.206 -19.055 15.011 1.00 0.00 C ATOM 460 O ALA A 29 8.895 -18.166 14.221 1.00 0.00 O ATOM 461 CB ALA A 29 11.629 -19.371 15.517 1.00 0.00 C ATOM 0 H ALA A 29 10.542 -20.298 17.529 1.00 0.00 H new ATOM 0 HA ALA A 29 10.394 -17.766 16.235 1.00 0.00 H new ATOM 0 HB1 ALA A 29 11.877 -18.869 14.582 1.00 0.00 H new ATOM 0 HB2 ALA A 29 12.414 -19.183 16.249 1.00 0.00 H new ATOM 0 HB3 ALA A 29 11.545 -20.444 15.342 1.00 0.00 H new ATOM 467 N LYS A 30 8.629 -20.248 15.021 1.00 0.00 N ATOM 468 CA LYS A 30 7.574 -20.582 14.076 1.00 0.00 C ATOM 469 C LYS A 30 6.359 -19.694 14.298 1.00 0.00 C ATOM 470 O LYS A 30 5.627 -19.372 13.363 1.00 0.00 O ATOM 471 CB LYS A 30 7.165 -22.052 14.228 1.00 0.00 C ATOM 472 CG LYS A 30 6.473 -22.538 12.935 1.00 0.00 C ATOM 473 CD LYS A 30 7.510 -23.182 11.994 1.00 0.00 C ATOM 474 CE LYS A 30 7.722 -24.649 12.376 1.00 0.00 C ATOM 475 NZ LYS A 30 8.996 -25.138 11.784 1.00 0.00 N ATOM 0 H LYS A 30 8.872 -20.997 15.669 1.00 0.00 H new ATOM 0 HA LYS A 30 7.957 -20.418 13.069 1.00 0.00 H new ATOM 0 HB2 LYS A 30 8.043 -22.664 14.434 1.00 0.00 H new ATOM 0 HB3 LYS A 30 6.491 -22.166 15.077 1.00 0.00 H new ATOM 0 HG2 LYS A 30 5.693 -23.259 13.179 1.00 0.00 H new ATOM 0 HG3 LYS A 30 5.987 -21.700 12.435 1.00 0.00 H new ATOM 0 HD2 LYS A 30 7.169 -23.112 10.961 1.00 0.00 H new ATOM 0 HD3 LYS A 30 8.454 -22.641 12.055 1.00 0.00 H new ATOM 0 HE2 LYS A 30 7.750 -24.753 13.461 1.00 0.00 H new ATOM 0 HE3 LYS A 30 6.888 -25.253 12.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 9.510 -25.707 12.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 8.789 -25.723 10.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 9.581 -24.326 11.501 1.00 0.00 H new ATOM 489 N LEU A 31 6.147 -19.314 15.548 1.00 0.00 N ATOM 490 CA LEU A 31 5.013 -18.477 15.899 1.00 0.00 C ATOM 491 C LEU A 31 5.082 -17.156 15.141 1.00 0.00 C ATOM 492 O LEU A 31 4.058 -16.599 14.747 1.00 0.00 O ATOM 493 CB LEU A 31 5.014 -18.203 17.406 1.00 0.00 C ATOM 494 CG LEU A 31 3.598 -17.791 17.867 1.00 0.00 C ATOM 495 CD1 LEU A 31 2.778 -19.040 18.231 1.00 0.00 C ATOM 496 CD2 LEU A 31 3.695 -16.873 19.089 1.00 0.00 C ATOM 0 H LEU A 31 6.744 -19.571 16.334 1.00 0.00 H new ATOM 0 HA LEU A 31 4.095 -18.998 15.627 1.00 0.00 H new ATOM 0 HB2 LEU A 31 5.337 -19.093 17.946 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.727 -17.412 17.640 1.00 0.00 H new ATOM 0 HG LEU A 31 3.104 -17.261 17.053 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.782 -18.739 18.555 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.696 -19.688 17.359 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.275 -19.579 19.038 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.693 -16.586 19.409 1.00 0.00 H new ATOM 0 HD22 LEU A 31 4.198 -17.399 19.900 1.00 0.00 H new ATOM 0 HD23 LEU A 31 4.263 -15.980 18.829 1.00 0.00 H new ATOM 508 N GLN A 32 6.299 -16.657 14.948 1.00 0.00 N ATOM 509 CA GLN A 32 6.492 -15.394 14.247 1.00 0.00 C ATOM 510 C GLN A 32 5.746 -15.407 12.917 1.00 0.00 C ATOM 511 O GLN A 32 5.076 -14.438 12.561 1.00 0.00 O ATOM 512 CB GLN A 32 7.982 -15.175 13.983 1.00 0.00 C ATOM 513 CG GLN A 32 8.718 -15.023 15.314 1.00 0.00 C ATOM 514 CD GLN A 32 8.316 -13.717 15.989 1.00 0.00 C ATOM 515 OE1 GLN A 32 8.277 -12.671 15.343 1.00 0.00 O ATOM 516 NE2 GLN A 32 8.017 -13.714 17.259 1.00 0.00 N ATOM 0 H GLN A 32 7.159 -17.104 15.265 1.00 0.00 H new ATOM 0 HA GLN A 32 6.103 -14.587 14.868 1.00 0.00 H new ATOM 0 HB2 GLN A 32 8.391 -16.016 13.423 1.00 0.00 H new ATOM 0 HB3 GLN A 32 8.127 -14.285 13.371 1.00 0.00 H new ATOM 0 HG2 GLN A 32 8.485 -15.865 15.966 1.00 0.00 H new ATOM 0 HG3 GLN A 32 9.795 -15.038 15.147 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.050 -14.583 17.793 1.00 0.00 H new ATOM 0 HE22 GLN A 32 7.750 -12.843 17.718 1.00 0.00 H new ATOM 525 N ARG A 33 5.855 -16.515 12.191 1.00 0.00 N ATOM 526 CA ARG A 33 5.178 -16.640 10.905 1.00 0.00 C ATOM 527 C ARG A 33 3.669 -16.593 11.092 1.00 0.00 C ATOM 528 O ARG A 33 2.953 -15.997 10.292 1.00 0.00 O ATOM 529 CB ARG A 33 5.559 -17.954 10.224 1.00 0.00 C ATOM 530 CG ARG A 33 7.006 -17.880 9.745 1.00 0.00 C ATOM 531 CD ARG A 33 7.353 -19.161 8.986 1.00 0.00 C ATOM 532 NE ARG A 33 8.729 -19.096 8.497 1.00 0.00 N ATOM 533 CZ ARG A 33 9.158 -19.904 7.533 1.00 0.00 C ATOM 534 NH1 ARG A 33 8.348 -20.785 7.016 1.00 0.00 N ATOM 535 NH2 ARG A 33 10.389 -19.816 7.105 1.00 0.00 N ATOM 0 H ARG A 33 6.400 -17.332 12.467 1.00 0.00 H new ATOM 0 HA ARG A 33 5.491 -15.805 10.277 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.437 -18.785 10.919 1.00 0.00 H new ATOM 0 HB3 ARG A 33 4.895 -18.144 9.381 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.144 -17.013 9.099 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.677 -17.754 10.595 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.231 -20.025 9.639 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.667 -19.295 8.149 1.00 0.00 H new ATOM 0 HE ARG A 33 9.373 -18.417 8.904 1.00 0.00 H new ATOM 0 HH11 ARG A 33 7.387 -20.853 7.351 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.675 -21.406 6.276 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.022 -19.127 7.511 1.00 0.00 H new ATOM 0 HH22 ARG A 33 10.717 -20.437 6.365 1.00 0.00 H new ATOM 549 N ILE A 34 3.192 -17.227 12.154 1.00 0.00 N ATOM 550 CA ILE A 34 1.765 -17.256 12.435 1.00 0.00 C ATOM 551 C ILE A 34 1.251 -15.840 12.669 1.00 0.00 C ATOM 552 O ILE A 34 0.170 -15.476 12.212 1.00 0.00 O ATOM 553 CB ILE A 34 1.490 -18.115 13.671 1.00 0.00 C ATOM 554 CG1 ILE A 34 2.161 -19.480 13.494 1.00 0.00 C ATOM 555 CG2 ILE A 34 -0.025 -18.315 13.839 1.00 0.00 C ATOM 556 CD1 ILE A 34 1.741 -20.417 14.628 1.00 0.00 C ATOM 0 H ILE A 34 3.769 -17.725 12.831 1.00 0.00 H new ATOM 0 HA ILE A 34 1.248 -17.688 11.578 1.00 0.00 H new ATOM 0 HB ILE A 34 1.889 -17.616 14.554 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.882 -19.910 12.532 1.00 0.00 H new ATOM 0 HG13 ILE A 34 3.245 -19.364 13.489 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -0.216 -18.927 14.720 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.509 -17.346 13.959 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.426 -18.814 12.957 1.00 0.00 H new ATOM 0 HD11 ILE A 34 2.222 -21.386 14.496 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.043 -19.989 15.584 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.659 -20.544 14.613 1.00 0.00 H new ATOM 568 N HIS A 35 2.025 -15.048 13.403 1.00 0.00 N ATOM 569 CA HIS A 35 1.621 -13.681 13.700 1.00 0.00 C ATOM 570 C HIS A 35 1.342 -12.903 12.416 1.00 0.00 C ATOM 571 O HIS A 35 0.249 -12.371 12.228 1.00 0.00 O ATOM 572 CB HIS A 35 2.732 -12.981 14.486 1.00 0.00 C ATOM 573 CG HIS A 35 2.290 -11.592 14.856 1.00 0.00 C ATOM 574 ND1 HIS A 35 2.473 -10.507 14.014 1.00 0.00 N ATOM 575 CD2 HIS A 35 1.676 -11.096 15.978 1.00 0.00 C ATOM 576 CE1 HIS A 35 1.976 -9.422 14.636 1.00 0.00 C ATOM 577 NE2 HIS A 35 1.477 -9.726 15.837 1.00 0.00 N ATOM 0 H HIS A 35 2.924 -15.325 13.798 1.00 0.00 H new ATOM 0 HA HIS A 35 0.706 -13.712 14.292 1.00 0.00 H new ATOM 0 HB2 HIS A 35 2.969 -13.550 15.385 1.00 0.00 H new ATOM 0 HB3 HIS A 35 3.642 -12.937 13.888 1.00 0.00 H new ATOM 0 HD1 HIS A 35 2.906 -10.527 13.091 1.00 0.00 H new ATOM 0 HD2 HIS A 35 1.390 -11.680 16.840 1.00 0.00 H new ATOM 0 HE1 HIS A 35 1.980 -8.427 14.215 1.00 0.00 H new ATOM 585 N ASN A 36 2.336 -12.838 11.536 1.00 0.00 N ATOM 586 CA ASN A 36 2.183 -12.120 10.274 1.00 0.00 C ATOM 587 C ASN A 36 1.395 -12.951 9.261 1.00 0.00 C ATOM 588 O ASN A 36 0.479 -12.452 8.608 1.00 0.00 O ATOM 589 CB ASN A 36 3.562 -11.784 9.700 1.00 0.00 C ATOM 590 CG ASN A 36 4.183 -10.629 10.478 1.00 0.00 C ATOM 591 OD1 ASN A 36 3.480 -9.906 11.183 1.00 0.00 O ATOM 592 ND2 ASN A 36 5.466 -10.414 10.393 1.00 0.00 N ATOM 0 H ASN A 36 3.250 -13.270 11.671 1.00 0.00 H new ATOM 0 HA ASN A 36 1.631 -11.201 10.469 1.00 0.00 H new ATOM 0 HB2 ASN A 36 4.210 -12.659 9.753 1.00 0.00 H new ATOM 0 HB3 ASN A 36 3.472 -11.517 8.647 1.00 0.00 H new ATOM 0 HD21 ASN A 36 5.890 -9.645 10.912 1.00 0.00 H new ATOM 0 HD22 ASN A 36 6.046 -11.015 9.808 1.00 0.00 H new ATOM 599 N SER A 37 1.770 -14.219 9.137 1.00 0.00 N ATOM 600 CA SER A 37 1.113 -15.126 8.200 1.00 0.00 C ATOM 601 C SER A 37 -0.184 -15.662 8.792 1.00 0.00 C ATOM 602 O SER A 37 -0.704 -16.682 8.342 1.00 0.00 O ATOM 603 CB SER A 37 2.042 -16.294 7.849 1.00 0.00 C ATOM 604 OG SER A 37 1.834 -17.360 8.767 1.00 0.00 O ATOM 0 H SER A 37 2.526 -14.644 9.674 1.00 0.00 H new ATOM 0 HA SER A 37 0.882 -14.568 7.293 1.00 0.00 H new ATOM 0 HB2 SER A 37 1.848 -16.633 6.832 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.082 -15.968 7.883 1.00 0.00 H new ATOM 0 HG SER A 37 1.760 -17.000 9.675 1.00 0.00 H new ATOM 610 N ASN A 38 -0.698 -14.978 9.809 1.00 0.00 N ATOM 611 CA ASN A 38 -1.929 -15.411 10.458 1.00 0.00 C ATOM 612 C ASN A 38 -2.969 -15.817 9.420 1.00 0.00 C ATOM 613 O ASN A 38 -3.371 -15.017 8.575 1.00 0.00 O ATOM 614 CB ASN A 38 -2.490 -14.271 11.312 1.00 0.00 C ATOM 615 CG ASN A 38 -3.724 -14.744 12.070 1.00 0.00 C ATOM 616 OD1 ASN A 38 -4.780 -14.113 11.996 1.00 0.00 O ATOM 617 ND2 ASN A 38 -3.656 -15.824 12.797 1.00 0.00 N ATOM 0 H ASN A 38 -0.286 -14.130 10.198 1.00 0.00 H new ATOM 0 HA ASN A 38 -1.703 -16.271 11.088 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -1.732 -13.926 12.015 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -2.746 -13.423 10.677 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -4.478 -16.149 13.306 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -2.781 -16.344 12.857 1.00 0.00 H new ATOM 624 N ILE A 39 -3.395 -17.072 9.499 1.00 0.00 N ATOM 625 CA ILE A 39 -4.387 -17.597 8.574 1.00 0.00 C ATOM 626 C ILE A 39 -3.975 -17.312 7.138 1.00 0.00 C ATOM 627 O ILE A 39 -4.604 -16.500 6.457 1.00 0.00 O ATOM 628 CB ILE A 39 -5.750 -16.965 8.844 1.00 0.00 C ATOM 629 CG1 ILE A 39 -6.042 -17.015 10.340 1.00 0.00 C ATOM 630 CG2 ILE A 39 -6.826 -17.746 8.088 1.00 0.00 C ATOM 631 CD1 ILE A 39 -7.375 -16.327 10.625 1.00 0.00 C ATOM 0 H ILE A 39 -3.068 -17.743 10.194 1.00 0.00 H new ATOM 0 HA ILE A 39 -4.454 -18.675 8.721 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.748 -15.928 8.508 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.076 -18.050 10.680 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -5.242 -16.524 10.894 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -7.802 -17.298 8.278 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.614 -17.715 7.019 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.830 -18.782 8.428 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -7.582 -16.364 11.695 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -7.325 -15.288 10.301 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -8.171 -16.838 10.084 1.00 0.00 H new ATOM 643 N LEU A 40 -2.915 -17.979 6.681 1.00 0.00 N ATOM 644 CA LEU A 40 -2.420 -17.788 5.313 1.00 0.00 C ATOM 645 C LEU A 40 -2.487 -19.093 4.535 1.00 0.00 C ATOM 646 O LEU A 40 -2.343 -20.170 5.098 1.00 0.00 O ATOM 647 CB LEU A 40 -0.972 -17.276 5.335 1.00 0.00 C ATOM 648 CG LEU A 40 -0.510 -16.942 3.908 1.00 0.00 C ATOM 649 CD1 LEU A 40 -1.357 -15.794 3.322 1.00 0.00 C ATOM 650 CD2 LEU A 40 0.969 -16.537 3.942 1.00 0.00 C ATOM 0 H LEU A 40 -2.384 -18.653 7.232 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.053 -17.049 4.822 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.901 -16.390 5.966 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.317 -18.031 5.771 1.00 0.00 H new ATOM 0 HG LEU A 40 -0.637 -17.820 3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.017 -15.570 2.311 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -2.405 -16.093 3.294 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.249 -14.907 3.946 1.00 0.00 H new ATOM 0 HD21 LEU A 40 1.304 -16.298 2.933 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.092 -15.663 4.581 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.563 -17.362 4.336 1.00 0.00 H new ATOM 662 N ASP A 41 -2.709 -18.990 3.234 1.00 0.00 N ATOM 663 CA ASP A 41 -2.801 -20.178 2.395 1.00 0.00 C ATOM 664 C ASP A 41 -1.621 -21.106 2.637 1.00 0.00 C ATOM 665 O ASP A 41 -1.792 -22.315 2.784 1.00 0.00 O ATOM 666 CB ASP A 41 -2.840 -19.772 0.920 1.00 0.00 C ATOM 667 CG ASP A 41 -4.171 -19.102 0.593 1.00 0.00 C ATOM 668 OD1 ASP A 41 -5.086 -19.219 1.392 1.00 0.00 O ATOM 669 OD2 ASP A 41 -4.254 -18.478 -0.453 1.00 0.00 O ATOM 0 H ASP A 41 -2.828 -18.106 2.739 1.00 0.00 H new ATOM 0 HA ASP A 41 -3.718 -20.708 2.653 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -2.018 -19.090 0.701 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -2.702 -20.651 0.290 1.00 0.00 H new ATOM 674 N GLU A 42 -0.427 -20.541 2.678 1.00 0.00 N ATOM 675 CA GLU A 42 0.770 -21.338 2.906 1.00 0.00 C ATOM 676 C GLU A 42 0.863 -21.785 4.362 1.00 0.00 C ATOM 677 O GLU A 42 1.101 -22.957 4.649 1.00 0.00 O ATOM 678 CB GLU A 42 1.997 -20.510 2.556 1.00 0.00 C ATOM 679 CG GLU A 42 2.034 -20.247 1.049 1.00 0.00 C ATOM 680 CD GLU A 42 2.255 -21.551 0.292 1.00 0.00 C ATOM 681 OE1 GLU A 42 2.761 -22.484 0.895 1.00 0.00 O ATOM 682 OE2 GLU A 42 1.919 -21.599 -0.880 1.00 0.00 O ATOM 0 H GLU A 42 -0.259 -19.542 2.558 1.00 0.00 H new ATOM 0 HA GLU A 42 0.719 -22.226 2.275 1.00 0.00 H new ATOM 0 HB2 GLU A 42 1.976 -19.565 3.099 1.00 0.00 H new ATOM 0 HB3 GLU A 42 2.901 -21.035 2.865 1.00 0.00 H new ATOM 0 HG2 GLU A 42 1.099 -19.787 0.730 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.832 -19.542 0.815 1.00 0.00 H new ATOM 689 N ARG A 43 0.677 -20.842 5.277 1.00 0.00 N ATOM 690 CA ARG A 43 0.748 -21.152 6.701 1.00 0.00 C ATOM 691 C ARG A 43 -0.343 -22.147 7.092 1.00 0.00 C ATOM 692 O ARG A 43 -0.101 -23.085 7.847 1.00 0.00 O ATOM 693 CB ARG A 43 0.591 -19.874 7.525 1.00 0.00 C ATOM 694 CG ARG A 43 0.983 -20.140 8.999 1.00 0.00 C ATOM 695 CD ARG A 43 -0.055 -19.520 9.937 1.00 0.00 C ATOM 696 NE ARG A 43 -1.361 -20.126 9.704 1.00 0.00 N ATOM 697 CZ ARG A 43 -2.413 -19.786 10.436 1.00 0.00 C ATOM 698 NH1 ARG A 43 -2.286 -18.901 11.385 1.00 0.00 N ATOM 699 NH2 ARG A 43 -3.574 -20.337 10.206 1.00 0.00 N ATOM 0 H ARG A 43 0.478 -19.865 5.063 1.00 0.00 H new ATOM 0 HA ARG A 43 1.721 -21.598 6.904 1.00 0.00 H new ATOM 0 HB2 ARG A 43 1.219 -19.085 7.110 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -0.439 -19.522 7.472 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.052 -21.213 9.178 1.00 0.00 H new ATOM 0 HG3 ARG A 43 1.967 -19.719 9.204 1.00 0.00 H new ATOM 0 HD2 ARG A 43 0.245 -19.669 10.974 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -0.109 -18.444 9.773 1.00 0.00 H new ATOM 0 HE ARG A 43 -1.467 -20.822 8.966 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -1.378 -18.471 11.563 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.094 -18.638 11.949 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -3.672 -21.029 9.463 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -4.383 -20.075 10.769 1.00 0.00 H new ATOM 713 N GLN A 44 -1.548 -21.943 6.574 1.00 0.00 N ATOM 714 CA GLN A 44 -2.663 -22.836 6.881 1.00 0.00 C ATOM 715 C GLN A 44 -2.205 -24.294 6.848 1.00 0.00 C ATOM 716 O GLN A 44 -2.614 -25.102 7.681 1.00 0.00 O ATOM 717 CB GLN A 44 -3.796 -22.619 5.862 1.00 0.00 C ATOM 718 CG GLN A 44 -4.712 -21.481 6.319 1.00 0.00 C ATOM 719 CD GLN A 44 -5.736 -21.165 5.234 1.00 0.00 C ATOM 720 OE1 GLN A 44 -5.781 -21.839 4.204 1.00 0.00 O ATOM 721 NE2 GLN A 44 -6.565 -20.174 5.406 1.00 0.00 N ATOM 0 H GLN A 44 -1.779 -21.174 5.944 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.029 -22.610 7.883 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -3.375 -22.385 4.884 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.373 -23.537 5.749 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -5.222 -21.762 7.241 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -4.119 -20.593 6.540 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -6.525 -19.618 6.260 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -7.254 -19.955 4.686 1.00 0.00 H new ATOM 730 N GLY A 45 -1.350 -24.617 5.889 1.00 0.00 N ATOM 731 CA GLY A 45 -0.837 -25.972 5.767 1.00 0.00 C ATOM 732 C GLY A 45 0.141 -26.273 6.889 1.00 0.00 C ATOM 733 O GLY A 45 0.235 -27.404 7.354 1.00 0.00 O ATOM 0 H GLY A 45 -0.999 -23.964 5.189 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.662 -26.684 5.795 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.343 -26.095 4.803 1.00 0.00 H new ATOM 737 N LEU A 46 0.870 -25.249 7.318 1.00 0.00 N ATOM 738 CA LEU A 46 1.845 -25.416 8.389 1.00 0.00 C ATOM 739 C LEU A 46 1.156 -25.802 9.693 1.00 0.00 C ATOM 740 O LEU A 46 1.725 -26.502 10.522 1.00 0.00 O ATOM 741 CB LEU A 46 2.656 -24.123 8.580 1.00 0.00 C ATOM 742 CG LEU A 46 3.593 -24.264 9.786 1.00 0.00 C ATOM 743 CD1 LEU A 46 4.502 -25.498 9.625 1.00 0.00 C ATOM 744 CD2 LEU A 46 4.453 -23.004 9.912 1.00 0.00 C ATOM 0 H LEU A 46 0.806 -24.302 6.944 1.00 0.00 H new ATOM 0 HA LEU A 46 2.525 -26.220 8.108 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.236 -23.912 7.681 1.00 0.00 H new ATOM 0 HB3 LEU A 46 1.982 -23.280 8.730 1.00 0.00 H new ATOM 0 HG LEU A 46 2.991 -24.391 10.686 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.159 -25.581 10.490 1.00 0.00 H new ATOM 0 HD12 LEU A 46 3.888 -26.395 9.549 1.00 0.00 H new ATOM 0 HD13 LEU A 46 5.103 -25.392 8.722 1.00 0.00 H new ATOM 0 HD21 LEU A 46 5.120 -23.103 10.769 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.044 -22.875 9.005 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.809 -22.136 10.052 1.00 0.00 H new ATOM 756 N MET A 47 -0.065 -25.328 9.874 1.00 0.00 N ATOM 757 CA MET A 47 -0.804 -25.612 11.097 1.00 0.00 C ATOM 758 C MET A 47 -0.960 -27.117 11.295 1.00 0.00 C ATOM 759 O MET A 47 -0.851 -27.618 12.414 1.00 0.00 O ATOM 760 CB MET A 47 -2.190 -24.954 11.029 1.00 0.00 C ATOM 761 CG MET A 47 -2.088 -23.464 11.370 1.00 0.00 C ATOM 762 SD MET A 47 -0.709 -22.731 10.458 1.00 0.00 S ATOM 763 CE MET A 47 0.297 -22.233 11.877 1.00 0.00 C ATOM 0 H MET A 47 -0.564 -24.750 9.198 1.00 0.00 H new ATOM 0 HA MET A 47 -0.247 -25.206 11.941 1.00 0.00 H new ATOM 0 HB2 MET A 47 -2.610 -25.078 10.031 1.00 0.00 H new ATOM 0 HB3 MET A 47 -2.869 -25.448 11.724 1.00 0.00 H new ATOM 0 HG2 MET A 47 -3.018 -22.957 11.114 1.00 0.00 H new ATOM 0 HG3 MET A 47 -1.939 -23.335 12.442 1.00 0.00 H new ATOM 0 HE1 MET A 47 1.287 -21.933 11.534 1.00 0.00 H new ATOM 0 HE2 MET A 47 -0.180 -21.395 12.385 1.00 0.00 H new ATOM 0 HE3 MET A 47 0.391 -23.070 12.568 1.00 0.00 H new ATOM 773 N HIS A 48 -1.220 -27.833 10.212 1.00 0.00 N ATOM 774 CA HIS A 48 -1.390 -29.276 10.298 1.00 0.00 C ATOM 775 C HIS A 48 -0.112 -29.954 10.785 1.00 0.00 C ATOM 776 O HIS A 48 -0.139 -30.750 11.723 1.00 0.00 O ATOM 777 CB HIS A 48 -1.768 -29.830 8.926 1.00 0.00 C ATOM 778 CG HIS A 48 -1.947 -31.318 9.021 1.00 0.00 C ATOM 779 ND1 HIS A 48 -0.870 -32.187 9.107 1.00 0.00 N ATOM 780 CD2 HIS A 48 -3.069 -32.109 9.043 1.00 0.00 C ATOM 781 CE1 HIS A 48 -1.361 -33.437 9.176 1.00 0.00 C ATOM 782 NE2 HIS A 48 -2.696 -33.446 9.141 1.00 0.00 N ATOM 0 H HIS A 48 -1.317 -27.445 9.274 1.00 0.00 H new ATOM 0 HA HIS A 48 -2.184 -29.483 11.015 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -2.688 -29.364 8.574 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -0.992 -29.592 8.199 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.086 -31.749 8.992 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -0.751 -34.325 9.251 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -3.311 -34.259 9.178 1.00 0.00 H new ATOM 790 N GLU A 49 1.004 -29.632 10.145 1.00 0.00 N ATOM 791 CA GLU A 49 2.288 -30.215 10.521 1.00 0.00 C ATOM 792 C GLU A 49 2.760 -29.659 11.858 1.00 0.00 C ATOM 793 O GLU A 49 3.340 -30.377 12.672 1.00 0.00 O ATOM 794 CB GLU A 49 3.336 -29.927 9.436 1.00 0.00 C ATOM 795 CG GLU A 49 3.127 -30.850 8.226 1.00 0.00 C ATOM 796 CD GLU A 49 1.961 -30.357 7.379 1.00 0.00 C ATOM 797 OE1 GLU A 49 1.320 -29.409 7.789 1.00 0.00 O ATOM 798 OE2 GLU A 49 1.729 -30.936 6.331 1.00 0.00 O ATOM 0 H GLU A 49 1.048 -28.974 9.367 1.00 0.00 H new ATOM 0 HA GLU A 49 2.161 -31.293 10.619 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.266 -28.885 9.122 1.00 0.00 H new ATOM 0 HB3 GLU A 49 4.337 -30.071 9.842 1.00 0.00 H new ATOM 0 HG2 GLU A 49 4.035 -30.882 7.624 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.934 -31.868 8.566 1.00 0.00 H new ATOM 805 N LEU A 50 2.517 -28.377 12.069 1.00 0.00 N ATOM 806 CA LEU A 50 2.939 -27.731 13.300 1.00 0.00 C ATOM 807 C LEU A 50 2.242 -28.366 14.494 1.00 0.00 C ATOM 808 O LEU A 50 2.839 -28.539 15.556 1.00 0.00 O ATOM 809 CB LEU A 50 2.621 -26.239 13.251 1.00 0.00 C ATOM 810 CG LEU A 50 3.245 -25.521 14.458 1.00 0.00 C ATOM 811 CD1 LEU A 50 4.782 -25.649 14.428 1.00 0.00 C ATOM 812 CD2 LEU A 50 2.846 -24.042 14.426 1.00 0.00 C ATOM 0 H LEU A 50 2.034 -27.767 11.410 1.00 0.00 H new ATOM 0 HA LEU A 50 4.016 -27.861 13.406 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.004 -25.809 12.326 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.541 -26.090 13.249 1.00 0.00 H new ATOM 0 HG LEU A 50 2.879 -25.982 15.375 1.00 0.00 H new ATOM 0 HD11 LEU A 50 5.207 -25.135 15.290 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.060 -26.702 14.461 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.167 -25.200 13.512 1.00 0.00 H new ATOM 0 HD21 LEU A 50 3.286 -23.528 15.280 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.207 -23.588 13.503 1.00 0.00 H new ATOM 0 HD23 LEU A 50 1.760 -23.957 14.471 1.00 0.00 H new ATOM 824 N MET A 51 0.971 -28.703 14.313 1.00 0.00 N ATOM 825 CA MET A 51 0.197 -29.309 15.384 1.00 0.00 C ATOM 826 C MET A 51 0.921 -30.529 15.938 1.00 0.00 C ATOM 827 O MET A 51 1.010 -30.707 17.153 1.00 0.00 O ATOM 828 CB MET A 51 -1.181 -29.725 14.857 1.00 0.00 C ATOM 829 CG MET A 51 -1.977 -30.422 15.967 1.00 0.00 C ATOM 830 SD MET A 51 -1.524 -32.176 16.019 1.00 0.00 S ATOM 831 CE MET A 51 -3.163 -32.827 16.421 1.00 0.00 C ATOM 0 H MET A 51 0.459 -28.568 13.441 1.00 0.00 H new ATOM 0 HA MET A 51 0.076 -28.578 16.183 1.00 0.00 H new ATOM 0 HB2 MET A 51 -1.724 -28.849 14.504 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.067 -30.394 14.004 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.770 -29.952 16.929 1.00 0.00 H new ATOM 0 HG3 MET A 51 -3.046 -30.316 15.785 1.00 0.00 H new ATOM 0 HE1 MET A 51 -3.123 -33.347 17.378 1.00 0.00 H new ATOM 0 HE2 MET A 51 -3.876 -32.005 16.484 1.00 0.00 H new ATOM 0 HE3 MET A 51 -3.479 -33.522 15.643 1.00 0.00 H new ATOM 841 N GLU A 52 1.437 -31.365 15.045 1.00 0.00 N ATOM 842 CA GLU A 52 2.154 -32.561 15.468 1.00 0.00 C ATOM 843 C GLU A 52 3.484 -32.186 16.109 1.00 0.00 C ATOM 844 O GLU A 52 3.870 -32.738 17.130 1.00 0.00 O ATOM 845 CB GLU A 52 2.418 -33.467 14.266 1.00 0.00 C ATOM 846 CG GLU A 52 2.876 -34.842 14.745 1.00 0.00 C ATOM 847 CD GLU A 52 1.705 -35.594 15.367 1.00 0.00 C ATOM 848 OE1 GLU A 52 0.598 -35.088 15.298 1.00 0.00 O ATOM 849 OE2 GLU A 52 1.933 -36.668 15.899 1.00 0.00 O ATOM 0 H GLU A 52 1.374 -31.239 14.035 1.00 0.00 H new ATOM 0 HA GLU A 52 1.538 -33.088 16.197 1.00 0.00 H new ATOM 0 HB2 GLU A 52 1.513 -33.564 13.666 1.00 0.00 H new ATOM 0 HB3 GLU A 52 3.179 -33.023 13.625 1.00 0.00 H new ATOM 0 HG2 GLU A 52 3.281 -35.411 13.908 1.00 0.00 H new ATOM 0 HG3 GLU A 52 3.678 -34.733 15.475 1.00 0.00 H new ATOM 856 N LEU A 53 4.182 -31.238 15.501 1.00 0.00 N ATOM 857 CA LEU A 53 5.474 -30.808 16.018 1.00 0.00 C ATOM 858 C LEU A 53 5.322 -30.237 17.418 1.00 0.00 C ATOM 859 O LEU A 53 6.170 -30.452 18.280 1.00 0.00 O ATOM 860 CB LEU A 53 6.079 -29.750 15.094 1.00 0.00 C ATOM 861 CG LEU A 53 6.416 -30.386 13.735 1.00 0.00 C ATOM 862 CD1 LEU A 53 6.815 -29.288 12.741 1.00 0.00 C ATOM 863 CD2 LEU A 53 7.569 -31.405 13.878 1.00 0.00 C ATOM 0 H LEU A 53 3.879 -30.755 14.655 1.00 0.00 H new ATOM 0 HA LEU A 53 6.136 -31.673 16.060 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.377 -28.927 14.958 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.979 -29.331 15.544 1.00 0.00 H new ATOM 0 HG LEU A 53 5.535 -30.912 13.368 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.054 -29.739 11.778 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.987 -28.589 12.619 1.00 0.00 H new ATOM 0 HD13 LEU A 53 7.688 -28.755 13.119 1.00 0.00 H new ATOM 0 HD21 LEU A 53 7.791 -31.843 12.905 1.00 0.00 H new ATOM 0 HD22 LEU A 53 8.456 -30.899 14.259 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.274 -32.193 14.571 1.00 0.00 H new ATOM 875 N ILE A 54 4.243 -29.503 17.641 1.00 0.00 N ATOM 876 CA ILE A 54 4.015 -28.908 18.947 1.00 0.00 C ATOM 877 C ILE A 54 3.853 -29.984 20.020 1.00 0.00 C ATOM 878 O ILE A 54 4.419 -29.876 21.101 1.00 0.00 O ATOM 879 CB ILE A 54 2.756 -28.041 18.908 1.00 0.00 C ATOM 880 CG1 ILE A 54 3.004 -26.800 18.033 1.00 0.00 C ATOM 881 CG2 ILE A 54 2.372 -27.614 20.333 1.00 0.00 C ATOM 882 CD1 ILE A 54 3.632 -25.658 18.851 1.00 0.00 C ATOM 0 H ILE A 54 3.522 -29.307 16.946 1.00 0.00 H new ATOM 0 HA ILE A 54 4.881 -28.295 19.196 1.00 0.00 H new ATOM 0 HB ILE A 54 1.937 -28.618 18.479 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.662 -27.062 17.204 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.062 -26.464 17.598 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.474 -26.997 20.298 1.00 0.00 H new ATOM 0 HG22 ILE A 54 2.180 -28.500 20.939 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.189 -27.042 20.774 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.795 -24.795 18.205 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.961 -25.381 19.664 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.585 -25.988 19.264 1.00 0.00 H new ATOM 894 N ASP A 55 3.072 -31.013 19.716 1.00 0.00 N ATOM 895 CA ASP A 55 2.834 -32.079 20.672 1.00 0.00 C ATOM 896 C ASP A 55 4.133 -32.788 21.015 1.00 0.00 C ATOM 897 O ASP A 55 4.448 -32.998 22.184 1.00 0.00 O ATOM 898 CB ASP A 55 1.833 -33.078 20.088 1.00 0.00 C ATOM 899 CG ASP A 55 1.558 -34.187 21.094 1.00 0.00 C ATOM 900 OD1 ASP A 55 2.188 -34.183 22.138 1.00 0.00 O ATOM 901 OD2 ASP A 55 0.721 -35.028 20.805 1.00 0.00 O ATOM 0 H ASP A 55 2.597 -31.129 18.821 1.00 0.00 H new ATOM 0 HA ASP A 55 2.425 -31.647 21.585 1.00 0.00 H new ATOM 0 HB2 ASP A 55 0.904 -32.568 19.833 1.00 0.00 H new ATOM 0 HB3 ASP A 55 2.227 -33.503 19.165 1.00 0.00 H new ATOM 906 N LEU A 56 4.881 -33.155 19.986 1.00 0.00 N ATOM 907 CA LEU A 56 6.141 -33.847 20.188 1.00 0.00 C ATOM 908 C LEU A 56 7.128 -32.969 20.944 1.00 0.00 C ATOM 909 O LEU A 56 7.823 -33.432 21.847 1.00 0.00 O ATOM 910 CB LEU A 56 6.722 -34.268 18.827 1.00 0.00 C ATOM 911 CG LEU A 56 6.124 -35.618 18.375 1.00 0.00 C ATOM 912 CD1 LEU A 56 6.734 -36.779 19.195 1.00 0.00 C ATOM 913 CD2 LEU A 56 4.594 -35.611 18.552 1.00 0.00 C ATOM 0 H LEU A 56 4.638 -32.986 19.010 1.00 0.00 H new ATOM 0 HA LEU A 56 5.960 -34.738 20.790 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.509 -33.502 18.082 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.807 -34.350 18.898 1.00 0.00 H new ATOM 0 HG LEU A 56 6.362 -35.762 17.321 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.302 -37.724 18.865 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.814 -36.802 19.046 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.516 -36.631 20.253 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.186 -36.569 18.229 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.350 -35.448 19.602 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.162 -34.811 17.950 1.00 0.00 H new ATOM 925 N TYR A 57 7.186 -31.708 20.570 1.00 0.00 N ATOM 926 CA TYR A 57 8.093 -30.777 21.215 1.00 0.00 C ATOM 927 C TYR A 57 7.624 -30.479 22.634 1.00 0.00 C ATOM 928 O TYR A 57 8.426 -30.404 23.562 1.00 0.00 O ATOM 929 CB TYR A 57 8.175 -29.485 20.395 1.00 0.00 C ATOM 930 CG TYR A 57 9.141 -29.663 19.239 1.00 0.00 C ATOM 931 CD1 TYR A 57 9.027 -30.768 18.378 1.00 0.00 C ATOM 932 CD2 TYR A 57 10.160 -28.724 19.030 1.00 0.00 C ATOM 933 CE1 TYR A 57 9.926 -30.928 17.321 1.00 0.00 C ATOM 934 CE2 TYR A 57 11.058 -28.889 17.971 1.00 0.00 C ATOM 935 CZ TYR A 57 10.940 -29.989 17.117 1.00 0.00 C ATOM 936 OH TYR A 57 11.825 -30.153 16.074 1.00 0.00 O ATOM 0 H TYR A 57 6.619 -31.303 19.825 1.00 0.00 H new ATOM 0 HA TYR A 57 9.085 -31.225 21.270 1.00 0.00 H new ATOM 0 HB2 TYR A 57 7.187 -29.222 20.017 1.00 0.00 H new ATOM 0 HB3 TYR A 57 8.503 -28.662 21.030 1.00 0.00 H new ATOM 0 HD1 TYR A 57 8.243 -31.494 18.534 1.00 0.00 H new ATOM 0 HD2 TYR A 57 10.252 -27.872 19.687 1.00 0.00 H new ATOM 0 HE1 TYR A 57 9.837 -31.778 16.661 1.00 0.00 H new ATOM 0 HE2 TYR A 57 11.844 -28.165 17.813 1.00 0.00 H new ATOM 0 HH TYR A 57 12.467 -29.413 16.071 1.00 0.00 H new ATOM 946 N GLU A 58 6.318 -30.307 22.787 1.00 0.00 N ATOM 947 CA GLU A 58 5.746 -30.016 24.093 1.00 0.00 C ATOM 948 C GLU A 58 5.805 -31.245 24.989 1.00 0.00 C ATOM 949 O GLU A 58 5.754 -31.142 26.206 1.00 0.00 O ATOM 950 CB GLU A 58 4.299 -29.550 23.951 1.00 0.00 C ATOM 951 CG GLU A 58 4.270 -28.130 23.375 1.00 0.00 C ATOM 952 CD GLU A 58 4.784 -27.137 24.409 1.00 0.00 C ATOM 953 OE1 GLU A 58 4.300 -27.174 25.528 1.00 0.00 O ATOM 954 OE2 GLU A 58 5.650 -26.348 24.067 1.00 0.00 O ATOM 0 H GLU A 58 5.639 -30.364 22.028 1.00 0.00 H new ATOM 0 HA GLU A 58 6.332 -29.218 24.549 1.00 0.00 H new ATOM 0 HB2 GLU A 58 3.750 -30.229 23.299 1.00 0.00 H new ATOM 0 HB3 GLU A 58 3.803 -29.570 24.921 1.00 0.00 H new ATOM 0 HG2 GLU A 58 4.884 -28.081 22.476 1.00 0.00 H new ATOM 0 HG3 GLU A 58 3.253 -27.868 23.082 1.00 0.00 H new ATOM 961 N GLU A 59 5.886 -32.415 24.377 1.00 0.00 N ATOM 962 CA GLU A 59 5.951 -33.660 25.135 1.00 0.00 C ATOM 963 C GLU A 59 7.399 -34.008 25.475 1.00 0.00 C ATOM 964 O GLU A 59 7.663 -34.879 26.303 1.00 0.00 O ATOM 965 CB GLU A 59 5.320 -34.795 24.331 1.00 0.00 C ATOM 966 CG GLU A 59 5.243 -36.058 25.197 1.00 0.00 C ATOM 967 CD GLU A 59 4.398 -37.116 24.502 1.00 0.00 C ATOM 968 OE1 GLU A 59 4.618 -37.341 23.323 1.00 0.00 O ATOM 969 OE2 GLU A 59 3.541 -37.685 25.157 1.00 0.00 O ATOM 0 H GLU A 59 5.908 -32.532 23.364 1.00 0.00 H new ATOM 0 HA GLU A 59 5.398 -33.527 26.065 1.00 0.00 H new ATOM 0 HB2 GLU A 59 4.322 -34.508 23.999 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.910 -34.991 23.435 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.246 -36.445 25.381 1.00 0.00 H new ATOM 0 HG3 GLU A 59 4.812 -35.817 26.168 1.00 0.00 H new ATOM 976 N SER A 60 8.343 -33.347 24.808 1.00 0.00 N ATOM 977 CA SER A 60 9.753 -33.646 25.034 1.00 0.00 C ATOM 978 C SER A 60 10.139 -33.490 26.501 1.00 0.00 C ATOM 979 O SER A 60 10.582 -34.449 27.136 1.00 0.00 O ATOM 980 CB SER A 60 10.612 -32.690 24.204 1.00 0.00 C ATOM 981 OG SER A 60 11.954 -32.743 24.669 1.00 0.00 O ATOM 0 H SER A 60 8.162 -32.616 24.120 1.00 0.00 H new ATOM 0 HA SER A 60 9.922 -34.682 24.740 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.569 -32.965 23.150 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.227 -31.673 24.284 1.00 0.00 H new ATOM 0 HG SER A 60 12.253 -31.841 24.908 1.00 0.00 H new ATOM 987 N GLN A 61 9.963 -32.279 27.039 1.00 0.00 N ATOM 988 CA GLN A 61 10.295 -31.997 28.446 1.00 0.00 C ATOM 989 C GLN A 61 9.039 -31.741 29.275 1.00 0.00 C ATOM 990 O GLN A 61 8.917 -32.233 30.394 1.00 0.00 O ATOM 991 CB GLN A 61 11.250 -30.785 28.533 1.00 0.00 C ATOM 992 CG GLN A 61 12.498 -31.147 29.336 1.00 0.00 C ATOM 993 CD GLN A 61 13.330 -32.156 28.556 1.00 0.00 C ATOM 994 OE1 GLN A 61 13.654 -33.224 29.071 1.00 0.00 O ATOM 995 NE2 GLN A 61 13.689 -31.882 27.330 1.00 0.00 N ATOM 0 H GLN A 61 9.594 -31.478 26.526 1.00 0.00 H new ATOM 0 HA GLN A 61 10.792 -32.876 28.857 1.00 0.00 H new ATOM 0 HB2 GLN A 61 11.535 -30.466 27.530 1.00 0.00 H new ATOM 0 HB3 GLN A 61 10.739 -29.944 29.002 1.00 0.00 H new ATOM 0 HG2 GLN A 61 13.087 -30.252 29.536 1.00 0.00 H new ATOM 0 HG3 GLN A 61 12.213 -31.564 30.302 1.00 0.00 H new ATOM 0 HE21 GLN A 61 13.418 -30.995 26.906 1.00 0.00 H new ATOM 0 HE22 GLN A 61 14.240 -32.555 26.797 1.00 0.00 H new ATOM 1004 N PRO A 62 8.122 -30.983 28.748 1.00 0.00 N ATOM 1005 CA PRO A 62 6.866 -30.649 29.459 1.00 0.00 C ATOM 1006 C PRO A 62 5.707 -31.536 29.035 1.00 0.00 C ATOM 1007 O PRO A 62 4.804 -31.118 28.315 1.00 0.00 O ATOM 1008 CB PRO A 62 6.625 -29.191 29.000 1.00 0.00 C ATOM 1009 CG PRO A 62 7.265 -29.080 27.629 1.00 0.00 C ATOM 1010 CD PRO A 62 8.205 -30.295 27.451 1.00 0.00 C ATOM 0 HA PRO A 62 6.938 -30.785 30.538 1.00 0.00 H new ATOM 0 HB2 PRO A 62 5.559 -28.966 28.954 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.070 -28.482 29.698 1.00 0.00 H new ATOM 0 HG2 PRO A 62 6.502 -29.069 26.850 1.00 0.00 H new ATOM 0 HG3 PRO A 62 7.823 -28.148 27.542 1.00 0.00 H new ATOM 0 HD2 PRO A 62 7.880 -30.938 26.633 1.00 0.00 H new ATOM 0 HD3 PRO A 62 9.225 -29.984 27.226 1.00 0.00 H new ATOM 1018 N SER A 63 5.753 -32.771 29.527 1.00 0.00 N ATOM 1019 CA SER A 63 4.714 -33.741 29.235 1.00 0.00 C ATOM 1020 C SER A 63 3.426 -33.389 29.959 1.00 0.00 C ATOM 1021 O SER A 63 2.343 -33.478 29.389 1.00 0.00 O ATOM 1022 CB SER A 63 5.168 -35.135 29.663 1.00 0.00 C ATOM 1023 OG SER A 63 6.413 -35.436 29.047 1.00 0.00 O ATOM 0 H SER A 63 6.500 -33.119 30.129 1.00 0.00 H new ATOM 0 HA SER A 63 4.529 -33.727 28.161 1.00 0.00 H new ATOM 0 HB2 SER A 63 5.266 -35.180 30.748 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.421 -35.876 29.379 1.00 0.00 H new ATOM 0 HG SER A 63 6.417 -35.088 28.131 1.00 0.00 H new ATOM 1029 N SER A 64 3.547 -32.992 31.229 1.00 0.00 N ATOM 1030 CA SER A 64 2.382 -32.625 32.038 1.00 0.00 C ATOM 1031 C SER A 64 2.478 -31.173 32.498 1.00 0.00 C ATOM 1032 O SER A 64 1.656 -30.707 33.287 1.00 0.00 O ATOM 1033 CB SER A 64 2.286 -33.542 33.254 1.00 0.00 C ATOM 1034 OG SER A 64 3.444 -33.377 34.061 1.00 0.00 O ATOM 0 H SER A 64 4.439 -32.917 31.718 1.00 0.00 H new ATOM 0 HA SER A 64 1.488 -32.737 31.424 1.00 0.00 H new ATOM 0 HB2 SER A 64 1.391 -33.308 33.830 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.197 -34.580 32.934 1.00 0.00 H new ATOM 0 HG SER A 64 3.384 -33.964 34.844 1.00 0.00 H new ATOM 1040 N GLU A 65 3.492 -30.466 32.013 1.00 0.00 N ATOM 1041 CA GLU A 65 3.690 -29.068 32.391 1.00 0.00 C ATOM 1042 C GLU A 65 2.921 -28.133 31.463 1.00 0.00 C ATOM 1043 O GLU A 65 1.757 -27.817 31.703 1.00 0.00 O ATOM 1044 CB GLU A 65 5.181 -28.728 32.338 1.00 0.00 C ATOM 1045 CG GLU A 65 5.917 -29.474 33.454 1.00 0.00 C ATOM 1046 CD GLU A 65 7.421 -29.252 33.326 1.00 0.00 C ATOM 1047 OE1 GLU A 65 7.819 -28.516 32.438 1.00 0.00 O ATOM 1048 OE2 GLU A 65 8.154 -29.823 34.119 1.00 0.00 O ATOM 0 H GLU A 65 4.186 -30.832 31.362 1.00 0.00 H new ATOM 0 HA GLU A 65 3.314 -28.932 33.405 1.00 0.00 H new ATOM 0 HB2 GLU A 65 5.593 -29.005 31.368 1.00 0.00 H new ATOM 0 HB3 GLU A 65 5.324 -27.653 32.450 1.00 0.00 H new ATOM 0 HG2 GLU A 65 5.571 -29.124 34.426 1.00 0.00 H new ATOM 0 HG3 GLU A 65 5.692 -30.539 33.400 1.00 0.00 H new ATOM 1055 N ARG A 66 3.589 -27.690 30.407 1.00 0.00 N ATOM 1056 CA ARG A 66 2.980 -26.777 29.446 1.00 0.00 C ATOM 1057 C ARG A 66 1.871 -27.467 28.673 1.00 0.00 C ATOM 1058 O ARG A 66 1.064 -26.816 28.011 1.00 0.00 O ATOM 1059 CB ARG A 66 4.039 -26.262 28.473 1.00 0.00 C ATOM 1060 CG ARG A 66 5.186 -25.597 29.246 1.00 0.00 C ATOM 1061 CD ARG A 66 4.756 -24.221 29.765 1.00 0.00 C ATOM 1062 NE ARG A 66 5.901 -23.532 30.345 1.00 0.00 N ATOM 1063 CZ ARG A 66 6.241 -23.708 31.619 1.00 0.00 C ATOM 1064 NH1 ARG A 66 5.541 -24.507 32.379 1.00 0.00 N ATOM 1065 NH2 ARG A 66 7.274 -23.084 32.107 1.00 0.00 N ATOM 0 H ARG A 66 4.553 -27.947 30.193 1.00 0.00 H new ATOM 0 HA ARG A 66 2.552 -25.939 29.996 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.424 -27.086 27.873 1.00 0.00 H new ATOM 0 HB3 ARG A 66 3.592 -25.547 27.782 1.00 0.00 H new ATOM 0 HG2 ARG A 66 5.485 -26.230 30.081 1.00 0.00 H new ATOM 0 HG3 ARG A 66 6.056 -25.492 28.598 1.00 0.00 H new ATOM 0 HD2 ARG A 66 4.338 -23.629 28.950 1.00 0.00 H new ATOM 0 HD3 ARG A 66 3.971 -24.333 30.513 1.00 0.00 H new ATOM 0 HE ARG A 66 6.453 -22.902 29.763 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.733 -24.997 31.996 1.00 0.00 H new ATOM 0 HH12 ARG A 66 5.803 -24.641 33.356 1.00 0.00 H new ATOM 0 HH21 ARG A 66 7.821 -22.461 31.513 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.536 -23.218 33.084 1.00 0.00 H new ATOM 1079 N LEU A 67 1.831 -28.788 28.754 1.00 0.00 N ATOM 1080 CA LEU A 67 0.812 -29.543 28.044 1.00 0.00 C ATOM 1081 C LEU A 67 -0.565 -28.912 28.257 1.00 0.00 C ATOM 1082 O LEU A 67 -1.446 -29.004 27.405 1.00 0.00 O ATOM 1083 CB LEU A 67 0.787 -30.989 28.545 1.00 0.00 C ATOM 1084 CG LEU A 67 0.110 -31.898 27.491 1.00 0.00 C ATOM 1085 CD1 LEU A 67 1.166 -32.445 26.524 1.00 0.00 C ATOM 1086 CD2 LEU A 67 -0.602 -33.068 28.183 1.00 0.00 C ATOM 0 H LEU A 67 2.484 -29.353 29.297 1.00 0.00 H new ATOM 0 HA LEU A 67 1.052 -29.529 26.981 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.803 -31.334 28.738 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.246 -31.047 29.490 1.00 0.00 H new ATOM 0 HG LEU A 67 -0.622 -31.310 26.937 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.685 -33.084 25.784 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.662 -31.616 26.020 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.903 -33.025 27.080 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.075 -33.701 27.432 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.124 -33.654 28.747 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.362 -32.681 28.862 1.00 0.00 H new ATOM 1098 N ASN A 68 -0.742 -28.278 29.410 1.00 0.00 N ATOM 1099 CA ASN A 68 -2.010 -27.634 29.727 1.00 0.00 C ATOM 1100 C ASN A 68 -2.247 -26.441 28.804 1.00 0.00 C ATOM 1101 O ASN A 68 -3.368 -26.198 28.359 1.00 0.00 O ATOM 1102 CB ASN A 68 -2.011 -27.169 31.181 1.00 0.00 C ATOM 1103 CG ASN A 68 -3.340 -26.498 31.508 1.00 0.00 C ATOM 1104 OD1 ASN A 68 -3.498 -25.293 31.303 1.00 0.00 O ATOM 1105 ND2 ASN A 68 -4.314 -27.211 32.005 1.00 0.00 N ATOM 0 H ASN A 68 -0.030 -28.196 30.135 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.812 -28.357 29.581 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -1.849 -28.019 31.844 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -1.190 -26.472 31.350 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -5.208 -26.771 32.224 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.181 -28.208 32.174 1.00 0.00 H new ATOM 1112 N ALA A 69 -1.178 -25.694 28.529 1.00 0.00 N ATOM 1113 CA ALA A 69 -1.271 -24.523 27.661 1.00 0.00 C ATOM 1114 C ALA A 69 -1.191 -24.934 26.197 1.00 0.00 C ATOM 1115 O ALA A 69 -1.589 -24.182 25.308 1.00 0.00 O ATOM 1116 CB ALA A 69 -0.142 -23.546 27.980 1.00 0.00 C ATOM 0 H ALA A 69 -0.243 -25.878 28.893 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.231 -24.039 27.839 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -0.219 -22.676 27.328 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -0.219 -23.228 29.020 1.00 0.00 H new ATOM 0 HB3 ALA A 69 0.819 -24.035 27.820 1.00 0.00 H new ATOM 1122 N PHE A 70 -0.674 -26.129 25.953 1.00 0.00 N ATOM 1123 CA PHE A 70 -0.551 -26.622 24.590 1.00 0.00 C ATOM 1124 C PHE A 70 -1.920 -26.651 23.918 1.00 0.00 C ATOM 1125 O PHE A 70 -2.069 -26.232 22.771 1.00 0.00 O ATOM 1126 CB PHE A 70 0.057 -28.038 24.598 1.00 0.00 C ATOM 1127 CG PHE A 70 -0.319 -28.783 23.331 1.00 0.00 C ATOM 1128 CD1 PHE A 70 -0.261 -28.129 22.098 1.00 0.00 C ATOM 1129 CD2 PHE A 70 -0.748 -30.114 23.398 1.00 0.00 C ATOM 1130 CE1 PHE A 70 -0.628 -28.801 20.930 1.00 0.00 C ATOM 1131 CE2 PHE A 70 -1.120 -30.787 22.229 1.00 0.00 C ATOM 1132 CZ PHE A 70 -1.057 -30.130 20.994 1.00 0.00 C ATOM 0 H PHE A 70 -0.336 -26.769 26.672 1.00 0.00 H new ATOM 0 HA PHE A 70 0.104 -25.954 24.031 1.00 0.00 H new ATOM 0 HB2 PHE A 70 1.142 -27.974 24.681 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -0.298 -28.588 25.470 1.00 0.00 H new ATOM 0 HD1 PHE A 70 0.068 -27.102 22.048 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -0.792 -30.621 24.351 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -0.580 -28.294 19.978 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -1.455 -31.812 22.279 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.340 -30.650 20.091 1.00 0.00 H new ATOM 1142 N ARG A 71 -2.907 -27.168 24.633 1.00 0.00 N ATOM 1143 CA ARG A 71 -4.244 -27.272 24.083 1.00 0.00 C ATOM 1144 C ARG A 71 -4.755 -25.898 23.692 1.00 0.00 C ATOM 1145 O ARG A 71 -5.458 -25.745 22.692 1.00 0.00 O ATOM 1146 CB ARG A 71 -5.182 -27.892 25.111 1.00 0.00 C ATOM 1147 CG ARG A 71 -4.793 -29.361 25.371 1.00 0.00 C ATOM 1148 CD ARG A 71 -5.483 -30.277 24.355 1.00 0.00 C ATOM 1149 NE ARG A 71 -6.929 -30.145 24.475 1.00 0.00 N ATOM 1150 CZ ARG A 71 -7.745 -30.710 23.594 1.00 0.00 C ATOM 1151 NH1 ARG A 71 -7.253 -31.385 22.591 1.00 0.00 N ATOM 1152 NH2 ARG A 71 -9.038 -30.585 23.727 1.00 0.00 N ATOM 0 H ARG A 71 -2.807 -27.518 25.586 1.00 0.00 H new ATOM 0 HA ARG A 71 -4.211 -27.906 23.197 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -5.138 -27.327 26.042 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -6.211 -27.838 24.754 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.711 -29.477 25.301 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.079 -29.647 26.383 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.167 -30.018 23.344 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.188 -31.312 24.525 1.00 0.00 H new ATOM 0 HE ARG A 71 -7.321 -29.609 25.249 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -6.243 -31.478 22.485 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -7.879 -31.820 21.913 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -9.421 -30.053 24.508 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -9.665 -31.019 23.050 1.00 0.00 H new ATOM 1166 N GLU A 72 -4.390 -24.895 24.480 1.00 0.00 N ATOM 1167 CA GLU A 72 -4.814 -23.535 24.197 1.00 0.00 C ATOM 1168 C GLU A 72 -4.304 -23.118 22.826 1.00 0.00 C ATOM 1169 O GLU A 72 -5.062 -22.628 22.000 1.00 0.00 O ATOM 1170 CB GLU A 72 -4.270 -22.578 25.271 1.00 0.00 C ATOM 1171 CG GLU A 72 -5.197 -21.369 25.403 1.00 0.00 C ATOM 1172 CD GLU A 72 -5.296 -20.640 24.067 1.00 0.00 C ATOM 1173 OE1 GLU A 72 -4.269 -20.466 23.432 1.00 0.00 O ATOM 1174 OE2 GLU A 72 -6.398 -20.272 23.698 1.00 0.00 O ATOM 0 H GLU A 72 -3.807 -24.998 25.311 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.903 -23.491 24.206 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.193 -23.095 26.227 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.265 -22.250 25.004 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.187 -21.693 25.724 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.819 -20.692 26.169 1.00 0.00 H new ATOM 1181 N LEU A 73 -3.017 -23.327 22.593 1.00 0.00 N ATOM 1182 CA LEU A 73 -2.417 -22.983 21.312 1.00 0.00 C ATOM 1183 C LEU A 73 -2.956 -23.899 20.224 1.00 0.00 C ATOM 1184 O LEU A 73 -3.174 -23.477 19.090 1.00 0.00 O ATOM 1185 CB LEU A 73 -0.892 -23.097 21.392 1.00 0.00 C ATOM 1186 CG LEU A 73 -0.262 -22.748 20.032 1.00 0.00 C ATOM 1187 CD1 LEU A 73 -0.653 -21.316 19.616 1.00 0.00 C ATOM 1188 CD2 LEU A 73 1.265 -22.861 20.138 1.00 0.00 C ATOM 0 H LEU A 73 -2.370 -23.731 23.270 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.676 -21.953 21.067 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.510 -22.426 22.161 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -0.610 -24.109 21.683 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.629 -23.443 19.277 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -0.201 -21.081 18.652 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.738 -21.244 19.536 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.297 -20.609 20.366 1.00 0.00 H new ATOM 0 HD21 LEU A 73 1.716 -22.615 19.177 1.00 0.00 H new ATOM 0 HD22 LEU A 73 1.629 -22.169 20.897 1.00 0.00 H new ATOM 0 HD23 LEU A 73 1.536 -23.880 20.415 1.00 0.00 H new ATOM 1200 N ARG A 74 -3.155 -25.164 20.579 1.00 0.00 N ATOM 1201 CA ARG A 74 -3.658 -26.142 19.625 1.00 0.00 C ATOM 1202 C ARG A 74 -4.952 -25.653 19.000 1.00 0.00 C ATOM 1203 O ARG A 74 -5.142 -25.756 17.792 1.00 0.00 O ATOM 1204 CB ARG A 74 -3.921 -27.470 20.333 1.00 0.00 C ATOM 1205 CG ARG A 74 -4.364 -28.520 19.314 1.00 0.00 C ATOM 1206 CD ARG A 74 -4.547 -29.869 20.010 1.00 0.00 C ATOM 1207 NE ARG A 74 -4.785 -30.918 19.023 1.00 0.00 N ATOM 1208 CZ ARG A 74 -5.267 -32.103 19.385 1.00 0.00 C ATOM 1209 NH1 ARG A 74 -5.546 -32.337 20.637 1.00 0.00 N ATOM 1210 NH2 ARG A 74 -5.464 -33.031 18.488 1.00 0.00 N ATOM 0 H ARG A 74 -2.977 -25.533 21.513 1.00 0.00 H new ATOM 0 HA ARG A 74 -2.909 -26.279 18.845 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -3.019 -27.805 20.845 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -4.690 -27.341 21.094 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.298 -28.213 18.844 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -3.621 -28.607 18.521 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -3.660 -30.107 20.597 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -5.385 -29.817 20.705 1.00 0.00 H new ATOM 0 HE ARG A 74 -4.578 -30.739 18.040 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -5.394 -31.611 21.338 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -5.916 -33.246 20.916 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -5.248 -32.847 17.508 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -5.834 -33.940 18.767 1.00 0.00 H new ATOM 1224 N THR A 75 -5.841 -25.114 19.825 1.00 0.00 N ATOM 1225 CA THR A 75 -7.113 -24.609 19.325 1.00 0.00 C ATOM 1226 C THR A 75 -6.896 -23.811 18.041 1.00 0.00 C ATOM 1227 O THR A 75 -7.687 -23.891 17.109 1.00 0.00 O ATOM 1228 CB THR A 75 -7.783 -23.729 20.397 1.00 0.00 C ATOM 1229 OG1 THR A 75 -9.192 -23.785 20.233 1.00 0.00 O ATOM 1230 CG2 THR A 75 -7.318 -22.266 20.289 1.00 0.00 C ATOM 0 H THR A 75 -5.707 -25.016 20.831 1.00 0.00 H new ATOM 0 HA THR A 75 -7.767 -25.452 19.101 1.00 0.00 H new ATOM 0 HB THR A 75 -7.499 -24.108 21.379 1.00 0.00 H new ATOM 0 HG1 THR A 75 -9.623 -23.228 20.914 1.00 0.00 H new ATOM 0 HG21 THR A 75 -7.809 -21.671 21.059 1.00 0.00 H new ATOM 0 HG22 THR A 75 -6.238 -22.217 20.425 1.00 0.00 H new ATOM 0 HG23 THR A 75 -7.578 -21.873 19.306 1.00 0.00 H new ATOM 1238 N GLN A 76 -5.820 -23.032 18.017 1.00 0.00 N ATOM 1239 CA GLN A 76 -5.512 -22.216 16.863 1.00 0.00 C ATOM 1240 C GLN A 76 -5.146 -23.092 15.678 1.00 0.00 C ATOM 1241 O GLN A 76 -5.665 -22.915 14.577 1.00 0.00 O ATOM 1242 CB GLN A 76 -4.351 -21.280 17.196 1.00 0.00 C ATOM 1243 CG GLN A 76 -4.069 -20.357 16.008 1.00 0.00 C ATOM 1244 CD GLN A 76 -5.270 -19.449 15.763 1.00 0.00 C ATOM 1245 OE1 GLN A 76 -5.916 -19.009 16.713 1.00 0.00 O ATOM 1246 NE2 GLN A 76 -5.613 -19.146 14.540 1.00 0.00 N ATOM 0 H GLN A 76 -5.152 -22.953 18.784 1.00 0.00 H new ATOM 0 HA GLN A 76 -6.391 -21.627 16.601 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -4.592 -20.688 18.079 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.461 -21.862 17.435 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.181 -19.756 16.205 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -3.861 -20.949 15.117 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.076 -19.512 13.754 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -6.418 -18.543 14.371 1.00 0.00 H new ATOM 1255 N LEU A 77 -4.242 -24.034 15.913 1.00 0.00 N ATOM 1256 CA LEU A 77 -3.805 -24.930 14.857 1.00 0.00 C ATOM 1257 C LEU A 77 -4.974 -25.773 14.376 1.00 0.00 C ATOM 1258 O LEU A 77 -5.144 -25.988 13.179 1.00 0.00 O ATOM 1259 CB LEU A 77 -2.693 -25.843 15.373 1.00 0.00 C ATOM 1260 CG LEU A 77 -1.608 -25.005 16.062 1.00 0.00 C ATOM 1261 CD1 LEU A 77 -0.531 -25.922 16.632 1.00 0.00 C ATOM 1262 CD2 LEU A 77 -0.980 -24.030 15.064 1.00 0.00 C ATOM 0 H LEU A 77 -3.802 -24.195 16.819 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.424 -24.336 14.026 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -3.103 -26.570 16.074 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.260 -26.406 14.546 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.064 -24.437 16.873 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.237 -25.322 17.120 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.978 -26.600 17.359 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.081 -26.500 15.825 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.212 -23.441 15.565 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -0.531 -24.589 14.243 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.749 -23.365 14.672 1.00 0.00 H new ATOM 1274 N GLU A 78 -5.779 -26.247 15.321 1.00 0.00 N ATOM 1275 CA GLU A 78 -6.934 -27.064 14.984 1.00 0.00 C ATOM 1276 C GLU A 78 -7.997 -26.224 14.284 1.00 0.00 C ATOM 1277 O GLU A 78 -8.574 -26.645 13.282 1.00 0.00 O ATOM 1278 CB GLU A 78 -7.521 -27.678 16.257 1.00 0.00 C ATOM 1279 CG GLU A 78 -8.655 -28.640 15.888 1.00 0.00 C ATOM 1280 CD GLU A 78 -9.222 -29.284 17.148 1.00 0.00 C ATOM 1281 OE1 GLU A 78 -8.573 -29.205 18.177 1.00 0.00 O ATOM 1282 OE2 GLU A 78 -10.300 -29.852 17.064 1.00 0.00 O ATOM 0 H GLU A 78 -5.653 -26.080 16.319 1.00 0.00 H new ATOM 0 HA GLU A 78 -6.614 -27.858 14.309 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -6.745 -28.209 16.808 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -7.896 -26.892 16.912 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -9.442 -28.102 15.359 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -8.284 -29.410 15.211 1.00 0.00 H new ATOM 1289 N LYS A 79 -8.251 -25.031 14.817 1.00 0.00 N ATOM 1290 CA LYS A 79 -9.245 -24.145 14.233 1.00 0.00 C ATOM 1291 C LYS A 79 -8.807 -23.692 12.854 1.00 0.00 C ATOM 1292 O LYS A 79 -9.587 -23.715 11.902 1.00 0.00 O ATOM 1293 CB LYS A 79 -9.440 -22.925 15.135 1.00 0.00 C ATOM 1294 CG LYS A 79 -10.208 -23.335 16.410 1.00 0.00 C ATOM 1295 CD LYS A 79 -11.727 -23.255 16.164 1.00 0.00 C ATOM 1296 CE LYS A 79 -12.226 -21.837 16.454 1.00 0.00 C ATOM 1297 NZ LYS A 79 -13.667 -21.739 16.098 1.00 0.00 N ATOM 0 H LYS A 79 -7.785 -24.661 15.645 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.186 -24.687 14.142 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.472 -22.501 15.403 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -9.991 -22.151 14.601 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -9.932 -24.349 16.700 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -9.931 -22.681 17.237 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -11.952 -23.526 15.132 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -12.246 -23.970 16.802 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -12.083 -21.598 17.508 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -11.648 -21.112 15.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -14.008 -20.776 16.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -13.790 -21.951 15.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -14.211 -22.421 16.663 1.00 0.00 H new ATOM 1311 N ALA A 80 -7.551 -23.286 12.753 1.00 0.00 N ATOM 1312 CA ALA A 80 -7.019 -22.830 11.485 1.00 0.00 C ATOM 1313 C ALA A 80 -7.024 -23.968 10.474 1.00 0.00 C ATOM 1314 O ALA A 80 -7.031 -23.740 9.266 1.00 0.00 O ATOM 1315 CB ALA A 80 -5.598 -22.301 11.665 1.00 0.00 C ATOM 0 H ALA A 80 -6.888 -23.264 13.528 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.651 -22.023 11.114 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.211 -21.962 10.704 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -5.606 -21.467 12.367 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.960 -23.096 12.053 1.00 0.00 H new ATOM 1321 N LEU A 81 -7.018 -25.194 10.983 1.00 0.00 N ATOM 1322 CA LEU A 81 -7.019 -26.365 10.119 1.00 0.00 C ATOM 1323 C LEU A 81 -8.303 -26.408 9.296 1.00 0.00 C ATOM 1324 O LEU A 81 -8.422 -27.184 8.348 1.00 0.00 O ATOM 1325 CB LEU A 81 -6.881 -27.650 10.964 1.00 0.00 C ATOM 1326 CG LEU A 81 -5.904 -28.625 10.294 1.00 0.00 C ATOM 1327 CD1 LEU A 81 -5.734 -29.865 11.174 1.00 0.00 C ATOM 1328 CD2 LEU A 81 -6.454 -29.037 8.922 1.00 0.00 C ATOM 0 H LEU A 81 -7.012 -25.401 11.982 1.00 0.00 H new ATOM 0 HA LEU A 81 -6.169 -26.302 9.439 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.527 -27.400 11.964 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.856 -28.124 11.080 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.937 -28.140 10.165 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.040 -30.557 10.697 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -5.341 -29.570 12.147 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.700 -30.353 11.306 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.761 -29.730 8.445 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.422 -29.522 9.049 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.571 -28.152 8.296 1.00 0.00 H new ATOM 1340 N GLY A 82 -9.262 -25.574 9.670 1.00 0.00 N ATOM 1341 CA GLY A 82 -10.533 -25.538 8.970 1.00 0.00 C ATOM 1342 C GLY A 82 -10.333 -25.106 7.525 1.00 0.00 C ATOM 1343 O GLY A 82 -11.175 -25.373 6.668 1.00 0.00 O ATOM 0 H GLY A 82 -9.184 -24.919 10.448 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.000 -26.523 9.000 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -11.212 -24.848 9.471 1.00 0.00 H new ATOM 1347 N LEU A 83 -9.208 -24.448 7.265 1.00 0.00 N ATOM 1348 CA LEU A 83 -8.891 -23.994 5.918 1.00 0.00 C ATOM 1349 C LEU A 83 -10.006 -23.120 5.370 1.00 0.00 C ATOM 1350 O LEU A 83 -10.432 -23.280 4.226 1.00 0.00 O ATOM 1351 CB LEU A 83 -8.684 -25.204 4.999 1.00 0.00 C ATOM 1352 CG LEU A 83 -7.389 -25.949 5.392 1.00 0.00 C ATOM 1353 CD1 LEU A 83 -7.500 -27.429 5.005 1.00 0.00 C ATOM 1354 CD2 LEU A 83 -6.182 -25.330 4.665 1.00 0.00 C ATOM 0 H LEU A 83 -8.504 -24.219 7.967 1.00 0.00 H new ATOM 0 HA LEU A 83 -7.975 -23.405 5.957 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.538 -25.878 5.073 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -8.625 -24.877 3.961 1.00 0.00 H new ATOM 0 HG LEU A 83 -7.250 -25.860 6.469 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -6.583 -27.948 5.285 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -8.345 -27.879 5.526 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -7.650 -27.513 3.929 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -5.274 -25.862 4.949 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.327 -25.408 3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.089 -24.280 4.943 1.00 0.00 H new ATOM 1366 N GLU A 84 -10.475 -22.192 6.193 1.00 0.00 N ATOM 1367 CA GLU A 84 -11.541 -21.297 5.776 1.00 0.00 C ATOM 1368 C GLU A 84 -11.076 -20.439 4.608 1.00 0.00 C ATOM 1369 O GLU A 84 -10.080 -19.720 4.707 1.00 0.00 O ATOM 1370 CB GLU A 84 -11.948 -20.402 6.946 1.00 0.00 C ATOM 1371 CG GLU A 84 -12.526 -21.261 8.074 1.00 0.00 C ATOM 1372 CD GLU A 84 -13.865 -21.860 7.654 1.00 0.00 C ATOM 1373 OE1 GLU A 84 -14.366 -21.470 6.611 1.00 0.00 O ATOM 1374 OE2 GLU A 84 -14.365 -22.706 8.375 1.00 0.00 O ATOM 0 H GLU A 84 -10.137 -22.041 7.144 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.399 -21.889 5.459 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.084 -19.843 7.307 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -12.686 -19.671 6.618 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.827 -22.058 8.327 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -12.657 -20.655 8.971 1.00 0.00 H new ATOM 1381 N HIS A 85 -11.799 -20.525 3.497 1.00 0.00 N ATOM 1382 CA HIS A 85 -11.452 -19.754 2.311 1.00 0.00 C ATOM 1383 C HIS A 85 -11.886 -18.304 2.474 1.00 0.00 C ATOM 1384 O HIS A 85 -12.999 -18.027 2.923 1.00 0.00 O ATOM 1385 CB HIS A 85 -12.132 -20.355 1.081 1.00 0.00 C ATOM 1386 CG HIS A 85 -11.643 -21.762 0.878 1.00 0.00 C ATOM 1387 ND1 HIS A 85 -10.428 -22.042 0.272 1.00 0.00 N ATOM 1388 CD2 HIS A 85 -12.192 -22.978 1.198 1.00 0.00 C ATOM 1389 CE1 HIS A 85 -10.287 -23.380 0.248 1.00 0.00 C ATOM 1390 NE2 HIS A 85 -11.333 -23.999 0.799 1.00 0.00 N ATOM 0 H HIS A 85 -12.623 -21.117 3.394 1.00 0.00 H new ATOM 0 HA HIS A 85 -10.370 -19.787 2.181 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -13.214 -20.350 1.211 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -11.914 -19.752 0.200 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -13.145 -23.122 1.685 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -9.431 -23.891 -0.167 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -11.473 -25.004 0.905 1.00 0.00 H new ATOM 1398 N HIS A 86 -10.999 -17.380 2.106 1.00 0.00 N ATOM 1399 CA HIS A 86 -11.291 -15.948 2.211 1.00 0.00 C ATOM 1400 C HIS A 86 -11.139 -15.267 0.851 1.00 0.00 C ATOM 1401 O HIS A 86 -11.831 -14.292 0.558 1.00 0.00 O ATOM 1402 CB HIS A 86 -10.343 -15.299 3.223 1.00 0.00 C ATOM 1403 CG HIS A 86 -10.539 -15.941 4.571 1.00 0.00 C ATOM 1404 ND1 HIS A 86 -11.698 -15.764 5.312 1.00 0.00 N ATOM 1405 CD2 HIS A 86 -9.734 -16.759 5.325 1.00 0.00 C ATOM 1406 CE1 HIS A 86 -11.560 -16.462 6.456 1.00 0.00 C ATOM 1407 NE2 HIS A 86 -10.380 -17.087 6.515 1.00 0.00 N ATOM 0 H HIS A 86 -10.074 -17.595 1.733 1.00 0.00 H new ATOM 0 HA HIS A 86 -12.321 -15.827 2.548 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -9.309 -15.417 2.898 1.00 0.00 H new ATOM 0 HB3 HIS A 86 -10.537 -14.228 3.286 1.00 0.00 H new ATOM 0 HD2 HIS A 86 -8.749 -17.097 5.039 1.00 0.00 H new ATOM 0 HE1 HIS A 86 -12.311 -16.511 7.231 1.00 0.00 H new ATOM 0 HE2 HIS A 86 -10.028 -17.677 7.269 1.00 0.00 H new ATOM 1415 N HIS A 87 -10.237 -15.789 0.022 1.00 0.00 N ATOM 1416 CA HIS A 87 -10.015 -15.219 -1.306 1.00 0.00 C ATOM 1417 C HIS A 87 -11.047 -15.752 -2.298 1.00 0.00 C ATOM 1418 O HIS A 87 -12.253 -15.606 -2.088 1.00 0.00 O ATOM 1419 CB HIS A 87 -8.606 -15.560 -1.799 1.00 0.00 C ATOM 1420 CG HIS A 87 -8.309 -14.771 -3.046 1.00 0.00 C ATOM 1421 ND1 HIS A 87 -8.135 -13.396 -3.025 1.00 0.00 N ATOM 1422 CD2 HIS A 87 -8.153 -15.148 -4.357 1.00 0.00 C ATOM 1423 CE1 HIS A 87 -7.886 -12.999 -4.287 1.00 0.00 C ATOM 1424 NE2 HIS A 87 -7.885 -14.026 -5.139 1.00 0.00 N ATOM 0 H HIS A 87 -9.654 -16.596 0.242 1.00 0.00 H new ATOM 0 HA HIS A 87 -10.119 -14.136 -1.235 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -7.873 -15.330 -1.026 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -8.529 -16.628 -2.004 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -8.227 -16.160 -4.726 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -7.709 -11.973 -4.575 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -7.723 -13.996 -6.146 1.00 0.00 H new ATOM 1432 N HIS A 88 -10.570 -16.366 -3.381 1.00 0.00 N ATOM 1433 CA HIS A 88 -11.463 -16.912 -4.398 1.00 0.00 C ATOM 1434 C HIS A 88 -10.797 -18.059 -5.155 1.00 0.00 C ATOM 1435 O HIS A 88 -9.592 -18.280 -5.040 1.00 0.00 O ATOM 1436 CB HIS A 88 -11.868 -15.809 -5.378 1.00 0.00 C ATOM 1437 CG HIS A 88 -12.861 -16.358 -6.362 1.00 0.00 C ATOM 1438 ND1 HIS A 88 -12.470 -17.052 -7.495 1.00 0.00 N ATOM 1439 CD2 HIS A 88 -14.233 -16.328 -6.395 1.00 0.00 C ATOM 1440 CE1 HIS A 88 -13.586 -17.409 -8.157 1.00 0.00 C ATOM 1441 NE2 HIS A 88 -14.688 -16.992 -7.530 1.00 0.00 N ATOM 0 H HIS A 88 -9.577 -16.496 -3.574 1.00 0.00 H new ATOM 0 HA HIS A 88 -12.351 -17.302 -3.900 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -12.302 -14.968 -4.837 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -10.990 -15.432 -5.902 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -11.511 -17.255 -7.776 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -14.863 -15.860 -5.653 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -13.589 -17.965 -9.083 1.00 0.00 H new ATOM 1449 N HIS A 89 -11.602 -18.786 -5.924 1.00 0.00 N ATOM 1450 CA HIS A 89 -11.111 -19.921 -6.700 1.00 0.00 C ATOM 1451 C HIS A 89 -10.458 -19.461 -8.003 1.00 0.00 C ATOM 1452 O HIS A 89 -10.998 -18.610 -8.708 1.00 0.00 O ATOM 1453 CB HIS A 89 -12.282 -20.853 -7.019 1.00 0.00 C ATOM 1454 CG HIS A 89 -11.786 -22.060 -7.764 1.00 0.00 C ATOM 1455 ND1 HIS A 89 -11.832 -22.145 -9.147 1.00 0.00 N ATOM 1456 CD2 HIS A 89 -11.237 -23.242 -7.334 1.00 0.00 C ATOM 1457 CE1 HIS A 89 -11.325 -23.340 -9.497 1.00 0.00 C ATOM 1458 NE2 HIS A 89 -10.947 -24.048 -8.429 1.00 0.00 N ATOM 0 H HIS A 89 -12.601 -18.609 -6.027 1.00 0.00 H new ATOM 0 HA HIS A 89 -10.359 -20.444 -6.110 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -12.775 -21.161 -6.097 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.025 -20.326 -7.617 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -11.058 -23.506 -6.302 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -11.234 -23.685 -10.516 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -10.534 -24.981 -8.419 1.00 0.00 H new ATOM 1466 N HIS A 90 -9.295 -20.035 -8.321 1.00 0.00 N ATOM 1467 CA HIS A 90 -8.589 -19.675 -9.551 1.00 0.00 C ATOM 1468 C HIS A 90 -7.514 -20.706 -9.884 1.00 0.00 C ATOM 1469 O HIS A 90 -7.873 -21.826 -10.211 1.00 0.00 O ATOM 1470 CB HIS A 90 -7.946 -18.294 -9.407 1.00 0.00 C ATOM 1471 CG HIS A 90 -7.189 -17.960 -10.664 1.00 0.00 C ATOM 1472 ND1 HIS A 90 -7.830 -17.602 -11.840 1.00 0.00 N ATOM 1473 CD2 HIS A 90 -5.844 -17.927 -10.945 1.00 0.00 C ATOM 1474 CE1 HIS A 90 -6.880 -17.370 -12.766 1.00 0.00 C ATOM 1475 NE2 HIS A 90 -5.653 -17.554 -12.273 1.00 0.00 N ATOM 1476 OXT HIS A 90 -6.345 -20.360 -9.815 1.00 0.00 O ATOM 0 H HIS A 90 -8.828 -20.741 -7.752 1.00 0.00 H new ATOM 0 HA HIS A 90 -9.316 -19.653 -10.363 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -8.712 -17.542 -9.221 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -7.273 -18.282 -8.550 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -5.056 -18.155 -10.243 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -7.086 -17.072 -13.783 1.00 0.00 H new ATOM 0 HE2 HIS A 90 -4.766 -17.445 -12.764 1.00 0.00 H new TER 1484 HIS A 90