USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 839 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 132 ASN : amide:sc= 0.878 K(o=3.1,f=1.4) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.615 K(o=3.1,f=1.3) USER MOD Set 1.3: B 149 C O2' : rot 86:sc= 1.6 USER MOD Set 2.1: A 87 ASN : amide:sc= 0.745 K(o=1.4,f=-0.68) USER MOD Set 2.2: A 138 THR OG1 : rot 160:sc= 0.688 USER MOD Set 3.1: A 65 LYS NZ :NH3+ 148:sc= 0.96 (180deg=-0.0447) USER MOD Set 3.2: B 147 C O5' : rot 36:sc= 0.841 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 82:sc= 0.179 USER MOD Single : A 58 SER OG : rot -77:sc= -0.0627 USER MOD Single : A 62 HIS : no HD1:sc= -2.08 X(o=-2.1,f=-2.3!) USER MOD Single : A 71 THR OG1 : rot 180:sc= -0.0156 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 105:sc= 1.37 USER MOD Single : A 90 MET CE :methyl 179:sc= -0.012 (180deg=-0.0412) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.03 K(o=1,f=-0.0029) USER MOD Single : A 96 GLN : amide:sc= -0.805 K(o=-0.8,f=-7.1!) USER MOD Single : A 101 MET CE :methyl 158:sc= -4.73! (180deg=-5.44!) USER MOD Single : A 102 ASN : amide:sc= -5.85! C(o=-5.8!,f=-4.9!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.589 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 154:sc= -0.299 (180deg=-0.763) USER MOD Single : A 112 ASN : amide:sc= -0.0867 X(o=-0.087,f=0) USER MOD Single : A 113 TYR OH : rot -133:sc= 0.0483 USER MOD Single : A 114 TYR OH : rot -15:sc= 0 USER MOD Single : A 115 THR OG1 : rot 80:sc= 0.742 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= 0.864 K(o=0.86,f=-0.086) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 1.56 K(o=1.6,f=-2.5!) USER MOD Single : A 131 SER OG : rot 70:sc= 1.54 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 153:sc= 1.61 (180deg=0.498) USER MOD Single : A 140 SER OG : rot 47:sc= 0.0862 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 147 C O2' : rot 176:sc= 0 USER MOD Single : B 148 U O2' : rot -28:sc= 1.19 USER MOD Single : B 150 U O2' : rot -59:sc= 0.56 USER MOD Single : B 151 C O2' : rot 19:sc= 0.0231 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 128:sc= 0.0607 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -21.975 3.378 1.774 1.00 0.00 N ATOM 2 CA GLY A 49 -21.626 3.292 0.339 1.00 0.00 C ATOM 3 C GLY A 49 -20.874 2.008 0.031 1.00 0.00 C ATOM 4 O GLY A 49 -21.102 0.978 0.667 1.00 0.00 O ATOM 0 HA2 GLY A 49 -22.534 3.337 -0.262 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -21.015 4.150 0.059 1.00 0.00 H new ATOM 8 N ASP A 50 -19.974 2.045 -0.956 1.00 0.00 N ATOM 9 CA ASP A 50 -19.101 0.926 -1.342 1.00 0.00 C ATOM 10 C ASP A 50 -17.993 0.686 -0.298 1.00 0.00 C ATOM 11 O ASP A 50 -16.939 1.326 -0.334 1.00 0.00 O ATOM 12 CB ASP A 50 -18.509 1.181 -2.741 1.00 0.00 C ATOM 13 CG ASP A 50 -19.595 1.164 -3.829 1.00 0.00 C ATOM 14 OD1 ASP A 50 -20.061 0.060 -4.201 1.00 0.00 O ATOM 15 OD2 ASP A 50 -19.984 2.256 -4.315 1.00 0.00 O ATOM 0 H ASP A 50 -19.826 2.877 -1.527 1.00 0.00 H new ATOM 0 HA ASP A 50 -19.702 0.017 -1.379 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -17.999 2.144 -2.750 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -17.759 0.422 -2.963 1.00 0.00 H new ATOM 20 N SER A 51 -18.234 -0.229 0.647 1.00 0.00 N ATOM 21 CA SER A 51 -17.418 -0.471 1.854 1.00 0.00 C ATOM 22 C SER A 51 -15.940 -0.823 1.614 1.00 0.00 C ATOM 23 O SER A 51 -15.126 -0.703 2.534 1.00 0.00 O ATOM 24 CB SER A 51 -18.055 -1.585 2.694 1.00 0.00 C ATOM 25 OG SER A 51 -19.413 -1.283 2.994 1.00 0.00 O ATOM 0 H SER A 51 -19.039 -0.853 0.594 1.00 0.00 H new ATOM 0 HA SER A 51 -17.410 0.489 2.370 1.00 0.00 H new ATOM 0 HB2 SER A 51 -17.999 -2.530 2.154 1.00 0.00 H new ATOM 0 HB3 SER A 51 -17.494 -1.714 3.620 1.00 0.00 H new ATOM 0 HG SER A 51 -19.799 -2.008 3.529 1.00 0.00 H new ATOM 31 N ARG A 52 -15.560 -1.225 0.392 1.00 0.00 N ATOM 32 CA ARG A 52 -14.163 -1.392 -0.053 1.00 0.00 C ATOM 33 C ARG A 52 -13.370 -0.072 -0.066 1.00 0.00 C ATOM 34 O ARG A 52 -12.150 -0.104 0.086 1.00 0.00 O ATOM 35 CB ARG A 52 -14.171 -2.056 -1.446 1.00 0.00 C ATOM 36 CG ARG A 52 -12.796 -2.303 -2.095 1.00 0.00 C ATOM 37 CD ARG A 52 -11.904 -3.290 -1.326 1.00 0.00 C ATOM 38 NE ARG A 52 -10.591 -3.452 -1.988 1.00 0.00 N ATOM 39 CZ ARG A 52 -10.308 -4.100 -3.104 1.00 0.00 C ATOM 40 NH1 ARG A 52 -11.174 -4.839 -3.735 1.00 0.00 N ATOM 41 NH2 ARG A 52 -9.114 -4.017 -3.608 1.00 0.00 N ATOM 0 H ARG A 52 -16.235 -1.451 -0.338 1.00 0.00 H new ATOM 0 HA ARG A 52 -13.648 -2.029 0.666 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -14.688 -3.012 -1.366 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -14.759 -1.432 -2.119 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -12.947 -2.680 -3.107 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -12.273 -1.351 -2.184 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.759 -2.934 -0.306 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -12.402 -4.257 -1.258 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.801 -3.005 -1.522 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.122 -4.938 -3.371 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -10.905 -5.319 -4.594 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.402 -3.454 -3.143 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -8.888 -4.515 -4.469 1.00 0.00 H new ATOM 55 N SER A 53 -14.026 1.078 -0.227 1.00 0.00 N ATOM 56 CA SER A 53 -13.385 2.399 -0.360 1.00 0.00 C ATOM 57 C SER A 53 -12.694 2.881 0.925 1.00 0.00 C ATOM 58 O SER A 53 -13.039 2.467 2.034 1.00 0.00 O ATOM 59 CB SER A 53 -14.429 3.450 -0.776 1.00 0.00 C ATOM 60 OG SER A 53 -15.076 3.082 -1.985 1.00 0.00 O ATOM 0 H SER A 53 -15.044 1.124 -0.270 1.00 0.00 H new ATOM 0 HA SER A 53 -12.614 2.282 -1.122 1.00 0.00 H new ATOM 0 HB2 SER A 53 -15.170 3.564 0.016 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.944 4.418 -0.900 1.00 0.00 H new ATOM 0 HG SER A 53 -15.793 2.443 -1.791 1.00 0.00 H new ATOM 66 N ALA A 54 -11.740 3.810 0.783 1.00 0.00 N ATOM 67 CA ALA A 54 -11.187 4.611 1.883 1.00 0.00 C ATOM 68 C ALA A 54 -12.180 5.705 2.366 1.00 0.00 C ATOM 69 O ALA A 54 -13.271 5.855 1.809 1.00 0.00 O ATOM 70 CB ALA A 54 -9.828 5.159 1.427 1.00 0.00 C ATOM 0 H ALA A 54 -11.322 4.031 -0.121 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.031 3.992 2.766 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.392 5.760 2.225 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.162 4.329 1.191 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.964 5.778 0.540 1.00 0.00 H new ATOM 76 N GLY A 55 -11.828 6.465 3.415 1.00 0.00 N ATOM 77 CA GLY A 55 -12.741 7.372 4.128 1.00 0.00 C ATOM 78 C GLY A 55 -12.813 8.753 3.478 1.00 0.00 C ATOM 79 O GLY A 55 -13.868 9.155 2.983 1.00 0.00 O ATOM 0 H GLY A 55 -10.883 6.466 3.799 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -13.738 6.933 4.154 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -12.412 7.476 5.162 1.00 0.00 H new ATOM 83 N VAL A 56 -11.673 9.459 3.438 1.00 0.00 N ATOM 84 CA VAL A 56 -11.481 10.703 2.668 1.00 0.00 C ATOM 85 C VAL A 56 -10.137 10.665 1.912 1.00 0.00 C ATOM 86 O VAL A 56 -9.148 11.268 2.340 1.00 0.00 O ATOM 87 CB VAL A 56 -11.621 11.950 3.554 1.00 0.00 C ATOM 88 CG1 VAL A 56 -11.659 13.227 2.702 1.00 0.00 C ATOM 89 CG2 VAL A 56 -12.905 11.962 4.397 1.00 0.00 C ATOM 0 H VAL A 56 -10.838 9.176 3.951 1.00 0.00 H new ATOM 0 HA VAL A 56 -12.275 10.771 1.925 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.752 11.919 4.212 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -11.759 14.096 3.353 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -10.737 13.308 2.127 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -12.509 13.185 2.021 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -12.937 12.871 4.998 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -13.773 11.931 3.738 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -12.917 11.092 5.054 1.00 0.00 H new ATOM 99 N PRO A 57 -10.077 9.891 0.816 1.00 0.00 N ATOM 100 CA PRO A 57 -8.851 9.553 0.089 1.00 0.00 C ATOM 101 C PRO A 57 -8.649 10.422 -1.174 1.00 0.00 C ATOM 102 O PRO A 57 -9.592 11.052 -1.658 1.00 0.00 O ATOM 103 CB PRO A 57 -9.116 8.076 -0.202 1.00 0.00 C ATOM 104 CG PRO A 57 -10.580 8.076 -0.652 1.00 0.00 C ATOM 105 CD PRO A 57 -11.183 9.071 0.328 1.00 0.00 C ATOM 0 HA PRO A 57 -7.922 9.736 0.629 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.454 7.692 -0.978 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.964 7.456 0.682 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.693 8.396 -1.688 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -11.036 7.089 -0.572 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -11.938 9.688 -0.160 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -11.677 8.555 1.151 1.00 0.00 H new ATOM 113 N SER A 58 -7.425 10.450 -1.722 1.00 0.00 N ATOM 114 CA SER A 58 -7.063 11.275 -2.897 1.00 0.00 C ATOM 115 C SER A 58 -6.108 10.568 -3.873 1.00 0.00 C ATOM 116 O SER A 58 -6.572 9.973 -4.847 1.00 0.00 O ATOM 117 CB SER A 58 -6.501 12.642 -2.470 1.00 0.00 C ATOM 118 OG SER A 58 -7.488 13.450 -1.860 1.00 0.00 O ATOM 0 H SER A 58 -6.647 9.897 -1.362 1.00 0.00 H new ATOM 0 HA SER A 58 -7.992 11.436 -3.444 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.673 12.494 -1.776 1.00 0.00 H new ATOM 0 HB3 SER A 58 -6.098 13.157 -3.342 1.00 0.00 H new ATOM 0 HG SER A 58 -8.076 13.825 -2.549 1.00 0.00 H new ATOM 124 N ARG A 59 -4.782 10.647 -3.656 1.00 0.00 N ATOM 125 CA ARG A 59 -3.753 10.267 -4.647 1.00 0.00 C ATOM 126 C ARG A 59 -2.838 9.108 -4.233 1.00 0.00 C ATOM 127 O ARG A 59 -2.249 8.506 -5.125 1.00 0.00 O ATOM 128 CB ARG A 59 -2.941 11.514 -5.062 1.00 0.00 C ATOM 129 CG ARG A 59 -3.680 12.371 -6.112 1.00 0.00 C ATOM 130 CD ARG A 59 -2.927 13.656 -6.483 1.00 0.00 C ATOM 131 NE ARG A 59 -2.682 14.545 -5.328 1.00 0.00 N ATOM 132 CZ ARG A 59 -3.518 15.338 -4.691 1.00 0.00 C ATOM 133 NH1 ARG A 59 -4.769 15.474 -5.027 1.00 0.00 N ATOM 134 NH2 ARG A 59 -3.074 16.030 -3.689 1.00 0.00 N ATOM 0 H ARG A 59 -4.388 10.981 -2.776 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.297 9.873 -5.505 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.735 12.121 -4.180 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.978 11.200 -5.465 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.836 11.776 -7.012 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.666 12.633 -5.728 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -1.972 13.391 -6.937 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.498 14.199 -7.236 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.726 14.544 -4.973 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -5.144 14.952 -5.819 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -5.374 16.103 -4.498 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -2.096 15.953 -3.410 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -3.703 16.651 -3.180 1.00 0.00 H new ATOM 148 N VAL A 60 -2.739 8.728 -2.950 1.00 0.00 N ATOM 149 CA VAL A 60 -2.038 7.487 -2.542 1.00 0.00 C ATOM 150 C VAL A 60 -2.975 6.308 -2.302 1.00 0.00 C ATOM 151 O VAL A 60 -4.034 6.444 -1.693 1.00 0.00 O ATOM 152 CB VAL A 60 -0.931 7.682 -1.495 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.255 8.240 -0.121 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.131 6.399 -1.316 1.00 0.00 C ATOM 0 H VAL A 60 -3.133 9.258 -2.173 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.466 7.189 -3.421 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.377 8.499 -1.958 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.342 8.302 0.471 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.688 9.235 -0.225 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.968 7.585 0.379 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.648 6.557 -0.570 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.794 5.600 -0.984 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.326 6.120 -2.265 1.00 0.00 H new ATOM 164 N ILE A 61 -2.568 5.139 -2.798 1.00 0.00 N ATOM 165 CA ILE A 61 -3.124 3.797 -2.575 1.00 0.00 C ATOM 166 C ILE A 61 -2.086 2.979 -1.796 1.00 0.00 C ATOM 167 O ILE A 61 -0.894 3.265 -1.860 1.00 0.00 O ATOM 168 CB ILE A 61 -3.448 3.173 -3.955 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.615 3.916 -4.637 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.742 1.660 -3.957 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.518 3.805 -6.154 1.00 0.00 C ATOM 0 H ILE A 61 -1.765 5.101 -3.426 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.045 3.822 -1.992 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.522 3.295 -4.517 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.564 3.500 -4.298 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.604 4.966 -4.344 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.955 1.332 -4.974 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.875 1.120 -3.576 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.604 1.456 -3.322 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.352 4.337 -6.612 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.579 4.243 -6.492 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.554 2.755 -6.445 1.00 0.00 H new ATOM 183 N HIS A 62 -2.514 1.940 -1.089 1.00 0.00 N ATOM 184 CA HIS A 62 -1.671 1.019 -0.335 1.00 0.00 C ATOM 185 C HIS A 62 -1.942 -0.427 -0.785 1.00 0.00 C ATOM 186 O HIS A 62 -3.087 -0.871 -0.872 1.00 0.00 O ATOM 187 CB HIS A 62 -1.898 1.281 1.163 1.00 0.00 C ATOM 188 CG HIS A 62 -1.468 0.170 2.097 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.859 -1.155 2.070 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.652 0.321 3.180 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.235 -1.794 3.070 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.494 -0.930 3.784 1.00 0.00 N ATOM 0 H HIS A 62 -3.504 1.705 -1.022 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.611 1.181 -0.529 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.363 2.190 1.439 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.959 1.474 1.322 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.206 1.246 3.513 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.316 -2.852 3.273 1.00 0.00 H new ATOM 0 HE2 HIS A 62 0.072 -1.144 4.605 1.00 0.00 H new ATOM 200 N ILE A 63 -0.861 -1.162 -1.040 1.00 0.00 N ATOM 201 CA ILE A 63 -0.809 -2.532 -1.567 1.00 0.00 C ATOM 202 C ILE A 63 -0.280 -3.460 -0.461 1.00 0.00 C ATOM 203 O ILE A 63 0.757 -3.144 0.134 1.00 0.00 O ATOM 204 CB ILE A 63 0.145 -2.598 -2.791 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.086 -1.369 -3.734 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.122 -3.887 -3.574 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.049 -1.447 -4.925 1.00 0.00 C ATOM 0 H ILE A 63 0.074 -0.791 -0.872 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.806 -2.842 -1.880 1.00 0.00 H new ATOM 0 HB ILE A 63 1.157 -2.590 -2.385 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.932 -1.261 -4.110 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.310 -0.471 -3.158 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.546 -3.936 -4.434 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.054 -4.748 -2.929 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.156 -3.896 -3.918 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.946 -0.550 -5.535 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.073 -1.522 -4.560 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.813 -2.324 -5.527 1.00 0.00 H new ATOM 219 N ARG A 64 -0.929 -4.600 -0.177 1.00 0.00 N ATOM 220 CA ARG A 64 -0.357 -5.626 0.722 1.00 0.00 C ATOM 221 C ARG A 64 0.529 -6.604 -0.066 1.00 0.00 C ATOM 222 O ARG A 64 0.645 -6.507 -1.286 1.00 0.00 O ATOM 223 CB ARG A 64 -1.429 -6.390 1.537 1.00 0.00 C ATOM 224 CG ARG A 64 -2.650 -5.592 2.019 1.00 0.00 C ATOM 225 CD ARG A 64 -3.572 -6.460 2.899 1.00 0.00 C ATOM 226 NE ARG A 64 -4.999 -6.321 2.548 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.972 -7.150 2.892 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.807 -8.085 3.782 1.00 0.00 N ATOM 229 NH2 ARG A 64 -7.152 -7.044 2.356 1.00 0.00 N ATOM 0 H ARG A 64 -1.847 -4.838 -0.553 1.00 0.00 H new ATOM 0 HA ARG A 64 0.257 -5.093 1.448 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.788 -7.220 0.928 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.943 -6.823 2.411 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.318 -4.721 2.584 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.208 -5.221 1.159 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.279 -7.506 2.802 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.432 -6.185 3.944 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.260 -5.510 1.988 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -4.903 -8.198 4.241 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.581 -8.705 4.020 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.334 -6.317 1.664 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.895 -7.688 2.628 1.00 0.00 H new ATOM 243 N LYS A 65 1.126 -7.565 0.651 1.00 0.00 N ATOM 244 CA LYS A 65 1.629 -8.887 0.205 1.00 0.00 C ATOM 245 C LYS A 65 2.183 -8.922 -1.213 1.00 0.00 C ATOM 246 O LYS A 65 1.834 -9.743 -2.063 1.00 0.00 O ATOM 247 CB LYS A 65 0.518 -9.911 0.363 1.00 0.00 C ATOM 248 CG LYS A 65 -0.020 -9.921 1.796 1.00 0.00 C ATOM 249 CD LYS A 65 -1.361 -10.600 1.770 1.00 0.00 C ATOM 250 CE LYS A 65 -1.337 -12.109 1.469 1.00 0.00 C ATOM 251 NZ LYS A 65 -0.595 -12.869 2.511 1.00 0.00 N ATOM 0 H LYS A 65 1.288 -7.433 1.649 1.00 0.00 H new ATOM 0 HA LYS A 65 2.483 -9.122 0.841 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.291 -9.685 -0.331 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.892 -10.902 0.104 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.665 -10.450 2.459 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.112 -8.904 2.178 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -1.844 -10.448 2.735 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.983 -10.108 1.022 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.359 -12.483 1.405 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.874 -12.278 0.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.014 -13.815 2.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.402 -12.961 2.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.654 -12.363 3.418 1.00 0.00 H new ATOM 265 N LEU A 66 3.111 -8.026 -1.436 1.00 0.00 N ATOM 266 CA LEU A 66 3.975 -8.019 -2.605 1.00 0.00 C ATOM 267 C LEU A 66 4.942 -9.220 -2.529 1.00 0.00 C ATOM 268 O LEU A 66 5.270 -9.668 -1.426 1.00 0.00 O ATOM 269 CB LEU A 66 4.711 -6.670 -2.663 1.00 0.00 C ATOM 270 CG LEU A 66 3.889 -5.643 -3.459 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.310 -4.211 -3.195 1.00 0.00 C ATOM 272 CD2 LEU A 66 4.105 -5.821 -4.953 1.00 0.00 C ATOM 0 H LEU A 66 3.297 -7.255 -0.794 1.00 0.00 H new ATOM 0 HA LEU A 66 3.399 -8.125 -3.524 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.886 -6.300 -1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.688 -6.802 -3.128 1.00 0.00 H new ATOM 0 HG LEU A 66 2.859 -5.815 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.692 -3.535 -3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.185 -3.984 -2.136 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.356 -4.082 -3.472 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.514 -5.084 -5.496 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.161 -5.683 -5.187 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.796 -6.824 -5.248 1.00 0.00 H new ATOM 284 N PRO A 67 5.413 -9.750 -3.670 1.00 0.00 N ATOM 285 CA PRO A 67 6.413 -10.811 -3.751 1.00 0.00 C ATOM 286 C PRO A 67 7.692 -10.571 -2.939 1.00 0.00 C ATOM 287 O PRO A 67 8.084 -9.452 -2.613 1.00 0.00 O ATOM 288 CB PRO A 67 6.757 -10.954 -5.239 1.00 0.00 C ATOM 289 CG PRO A 67 5.480 -10.481 -5.923 1.00 0.00 C ATOM 290 CD PRO A 67 4.929 -9.415 -4.988 1.00 0.00 C ATOM 0 HA PRO A 67 5.987 -11.713 -3.311 1.00 0.00 H new ATOM 0 HB2 PRO A 67 7.616 -10.343 -5.517 1.00 0.00 H new ATOM 0 HB3 PRO A 67 7.000 -11.984 -5.502 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.686 -10.075 -6.913 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.772 -11.299 -6.055 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.267 -8.422 -5.287 1.00 0.00 H new ATOM 0 HD3 PRO A 67 3.839 -9.402 -5.011 1.00 0.00 H new ATOM 298 N ILE A 68 8.389 -11.677 -2.703 1.00 0.00 N ATOM 299 CA ILE A 68 9.619 -11.835 -1.905 1.00 0.00 C ATOM 300 C ILE A 68 10.838 -11.108 -2.490 1.00 0.00 C ATOM 301 O ILE A 68 11.785 -10.779 -1.775 1.00 0.00 O ATOM 302 CB ILE A 68 9.927 -13.345 -1.768 1.00 0.00 C ATOM 303 CG1 ILE A 68 10.183 -14.018 -3.144 1.00 0.00 C ATOM 304 CG2 ILE A 68 8.759 -14.018 -1.027 1.00 0.00 C ATOM 305 CD1 ILE A 68 10.494 -15.517 -3.065 1.00 0.00 C ATOM 0 H ILE A 68 8.089 -12.569 -3.096 1.00 0.00 H new ATOM 0 HA ILE A 68 9.434 -11.375 -0.934 1.00 0.00 H new ATOM 0 HB ILE A 68 10.847 -13.467 -1.197 1.00 0.00 H new ATOM 0 HG12 ILE A 68 9.306 -13.874 -3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.015 -13.512 -3.634 1.00 0.00 H new ATOM 0 HG21 ILE A 68 8.961 -15.084 -0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.649 -13.571 -0.039 1.00 0.00 H new ATOM 0 HG23 ILE A 68 7.839 -13.877 -1.594 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.660 -15.908 -4.069 1.00 0.00 H new ATOM 0 HD12 ILE A 68 11.390 -15.672 -2.463 1.00 0.00 H new ATOM 0 HD13 ILE A 68 9.654 -16.039 -2.606 1.00 0.00 H new ATOM 317 N ASP A 69 10.804 -10.875 -3.799 1.00 0.00 N ATOM 318 CA ASP A 69 11.906 -10.366 -4.628 1.00 0.00 C ATOM 319 C ASP A 69 11.414 -9.347 -5.676 1.00 0.00 C ATOM 320 O ASP A 69 12.080 -9.104 -6.686 1.00 0.00 O ATOM 321 CB ASP A 69 12.631 -11.571 -5.258 1.00 0.00 C ATOM 322 CG ASP A 69 13.975 -11.207 -5.921 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.804 -10.515 -5.281 1.00 0.00 O ATOM 324 OD2 ASP A 69 14.237 -11.664 -7.061 1.00 0.00 O ATOM 0 H ASP A 69 9.960 -11.044 -4.347 1.00 0.00 H new ATOM 0 HA ASP A 69 12.613 -9.814 -4.009 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.807 -12.321 -4.487 1.00 0.00 H new ATOM 0 HB3 ASP A 69 11.980 -12.027 -6.004 1.00 0.00 H new ATOM 329 N VAL A 70 10.227 -8.759 -5.465 1.00 0.00 N ATOM 330 CA VAL A 70 9.675 -7.693 -6.316 1.00 0.00 C ATOM 331 C VAL A 70 10.598 -6.462 -6.409 1.00 0.00 C ATOM 332 O VAL A 70 11.509 -6.281 -5.595 1.00 0.00 O ATOM 333 CB VAL A 70 8.257 -7.323 -5.822 1.00 0.00 C ATOM 334 CG1 VAL A 70 8.159 -5.997 -5.062 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.301 -7.277 -7.011 1.00 0.00 C ATOM 0 H VAL A 70 9.616 -9.013 -4.689 1.00 0.00 H new ATOM 0 HA VAL A 70 9.606 -8.074 -7.335 1.00 0.00 H new ATOM 0 HB VAL A 70 7.988 -8.102 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.126 -5.827 -4.758 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.796 -6.036 -4.178 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.485 -5.182 -5.708 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.301 -7.016 -6.664 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.644 -6.528 -7.725 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.274 -8.254 -7.494 1.00 0.00 H new ATOM 345 N THR A 71 10.322 -5.570 -7.365 1.00 0.00 N ATOM 346 CA THR A 71 10.981 -4.262 -7.493 1.00 0.00 C ATOM 347 C THR A 71 9.985 -3.127 -7.699 1.00 0.00 C ATOM 348 O THR A 71 8.855 -3.310 -8.175 1.00 0.00 O ATOM 349 CB THR A 71 12.076 -4.309 -8.578 1.00 0.00 C ATOM 350 OG1 THR A 71 12.730 -3.062 -8.672 1.00 0.00 O ATOM 351 CG2 THR A 71 11.565 -4.655 -9.977 1.00 0.00 C ATOM 0 H THR A 71 9.621 -5.738 -8.087 1.00 0.00 H new ATOM 0 HA THR A 71 11.474 -4.041 -6.546 1.00 0.00 H new ATOM 0 HB THR A 71 12.748 -5.105 -8.256 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.423 -3.107 -9.363 1.00 0.00 H new ATOM 0 HG21 THR A 71 12.400 -4.666 -10.677 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.093 -5.637 -9.959 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.837 -3.908 -10.293 1.00 0.00 H new ATOM 359 N GLU A 72 10.414 -1.916 -7.347 1.00 0.00 N ATOM 360 CA GLU A 72 9.646 -0.699 -7.579 1.00 0.00 C ATOM 361 C GLU A 72 9.301 -0.543 -9.072 1.00 0.00 C ATOM 362 O GLU A 72 8.194 -0.127 -9.401 1.00 0.00 O ATOM 363 CB GLU A 72 10.385 0.514 -6.965 1.00 0.00 C ATOM 364 CG GLU A 72 11.033 1.446 -7.993 1.00 0.00 C ATOM 365 CD GLU A 72 11.882 2.549 -7.326 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.914 2.225 -6.689 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.542 3.751 -7.450 1.00 0.00 O ATOM 0 H GLU A 72 11.311 -1.753 -6.890 1.00 0.00 H new ATOM 0 HA GLU A 72 8.684 -0.761 -7.070 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.679 1.089 -6.366 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.156 0.149 -6.287 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.662 0.862 -8.665 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.256 1.907 -8.604 1.00 0.00 H new ATOM 374 N GLY A 73 10.206 -0.966 -9.965 1.00 0.00 N ATOM 375 CA GLY A 73 10.017 -0.986 -11.416 1.00 0.00 C ATOM 376 C GLY A 73 8.834 -1.849 -11.874 1.00 0.00 C ATOM 377 O GLY A 73 8.174 -1.520 -12.855 1.00 0.00 O ATOM 0 H GLY A 73 11.122 -1.316 -9.683 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.868 0.035 -11.768 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.928 -1.355 -11.887 1.00 0.00 H new ATOM 381 N GLU A 74 8.520 -2.923 -11.145 1.00 0.00 N ATOM 382 CA GLU A 74 7.339 -3.768 -11.366 1.00 0.00 C ATOM 383 C GLU A 74 6.066 -3.090 -10.874 1.00 0.00 C ATOM 384 O GLU A 74 5.064 -3.047 -11.591 1.00 0.00 O ATOM 385 CB GLU A 74 7.554 -5.138 -10.695 1.00 0.00 C ATOM 386 CG GLU A 74 8.364 -6.055 -11.618 1.00 0.00 C ATOM 387 CD GLU A 74 7.496 -6.701 -12.717 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.944 -7.802 -12.488 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.373 -6.120 -13.820 1.00 0.00 O ATOM 0 H GLU A 74 9.094 -3.239 -10.363 1.00 0.00 H new ATOM 0 HA GLU A 74 7.211 -3.922 -12.437 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.077 -5.009 -9.747 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.591 -5.596 -10.468 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.166 -5.481 -12.083 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.836 -6.838 -11.024 1.00 0.00 H new ATOM 396 N VAL A 75 6.113 -2.497 -9.678 1.00 0.00 N ATOM 397 CA VAL A 75 4.952 -1.789 -9.107 1.00 0.00 C ATOM 398 C VAL A 75 4.552 -0.553 -9.946 1.00 0.00 C ATOM 399 O VAL A 75 3.378 -0.382 -10.289 1.00 0.00 O ATOM 400 CB VAL A 75 5.223 -1.462 -7.628 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.055 -0.717 -6.978 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.449 -2.763 -6.841 1.00 0.00 C ATOM 0 H VAL A 75 6.941 -2.490 -9.082 1.00 0.00 H new ATOM 0 HA VAL A 75 4.082 -2.445 -9.146 1.00 0.00 H new ATOM 0 HB VAL A 75 6.107 -0.824 -7.601 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.292 -0.508 -5.935 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.883 0.221 -7.506 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.157 -1.333 -7.030 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.641 -2.526 -5.794 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.562 -3.392 -6.914 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.305 -3.295 -7.255 1.00 0.00 H new ATOM 412 N ILE A 76 5.504 0.282 -10.369 1.00 0.00 N ATOM 413 CA ILE A 76 5.226 1.413 -11.267 1.00 0.00 C ATOM 414 C ILE A 76 4.897 0.985 -12.692 1.00 0.00 C ATOM 415 O ILE A 76 4.094 1.649 -13.339 1.00 0.00 O ATOM 416 CB ILE A 76 6.360 2.450 -11.258 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.707 1.951 -11.811 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.552 2.927 -9.827 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.886 2.292 -13.285 1.00 0.00 C ATOM 0 H ILE A 76 6.485 0.197 -10.102 1.00 0.00 H new ATOM 0 HA ILE A 76 4.330 1.886 -10.865 1.00 0.00 H new ATOM 0 HB ILE A 76 6.052 3.251 -11.931 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.520 2.394 -11.236 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.774 0.871 -11.679 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.353 3.665 -9.794 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.628 3.378 -9.467 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.813 2.080 -9.193 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.851 1.920 -13.630 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.089 1.827 -13.865 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.847 3.373 -13.416 1.00 0.00 H new ATOM 431 N SER A 77 5.428 -0.145 -13.175 1.00 0.00 N ATOM 432 CA SER A 77 4.996 -0.698 -14.476 1.00 0.00 C ATOM 433 C SER A 77 3.521 -1.088 -14.432 1.00 0.00 C ATOM 434 O SER A 77 2.799 -0.962 -15.427 1.00 0.00 O ATOM 435 CB SER A 77 5.870 -1.885 -14.890 1.00 0.00 C ATOM 436 OG SER A 77 5.500 -2.377 -16.168 1.00 0.00 O ATOM 0 H SER A 77 6.146 -0.691 -12.698 1.00 0.00 H new ATOM 0 HA SER A 77 5.118 0.079 -15.231 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.917 -1.581 -14.904 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.779 -2.681 -14.151 1.00 0.00 H new ATOM 0 HG SER A 77 6.076 -3.133 -16.407 1.00 0.00 H new ATOM 442 N LEU A 78 3.043 -1.448 -13.240 1.00 0.00 N ATOM 443 CA LEU A 78 1.642 -1.714 -12.983 1.00 0.00 C ATOM 444 C LEU A 78 0.791 -0.465 -12.715 1.00 0.00 C ATOM 445 O LEU A 78 -0.429 -0.537 -12.861 1.00 0.00 O ATOM 446 CB LEU A 78 1.535 -2.733 -11.838 1.00 0.00 C ATOM 447 CG LEU A 78 1.643 -4.172 -12.356 1.00 0.00 C ATOM 448 CD1 LEU A 78 1.984 -5.115 -11.207 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.320 -4.594 -13.002 1.00 0.00 C ATOM 0 H LEU A 78 3.635 -1.563 -12.417 1.00 0.00 H new ATOM 0 HA LEU A 78 1.219 -2.126 -13.899 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.324 -2.547 -11.109 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.585 -2.602 -11.320 1.00 0.00 H new ATOM 0 HG LEU A 78 2.436 -4.222 -13.103 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.059 -6.135 -11.584 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.936 -4.821 -10.765 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.201 -5.064 -10.450 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.404 -5.617 -13.368 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.480 -4.537 -12.264 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.093 -3.928 -13.835 1.00 0.00 H new ATOM 461 N GLY A 79 1.400 0.684 -12.393 1.00 0.00 N ATOM 462 CA GLY A 79 0.690 1.961 -12.286 1.00 0.00 C ATOM 463 C GLY A 79 0.708 2.825 -13.551 1.00 0.00 C ATOM 464 O GLY A 79 -0.129 3.711 -13.702 1.00 0.00 O ATOM 0 H GLY A 79 2.399 0.752 -12.200 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.347 1.760 -12.017 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.127 2.534 -11.468 1.00 0.00 H new ATOM 468 N LEU A 80 1.639 2.604 -14.481 1.00 0.00 N ATOM 469 CA LEU A 80 1.856 3.528 -15.598 1.00 0.00 C ATOM 470 C LEU A 80 0.749 3.630 -16.663 1.00 0.00 C ATOM 471 O LEU A 80 0.544 4.743 -17.155 1.00 0.00 O ATOM 472 CB LEU A 80 3.245 3.300 -16.213 1.00 0.00 C ATOM 473 CG LEU A 80 4.324 4.134 -15.504 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.704 3.764 -16.048 1.00 0.00 C ATOM 475 CD2 LEU A 80 4.088 5.632 -15.717 1.00 0.00 C ATOM 0 H LEU A 80 2.256 1.792 -14.483 1.00 0.00 H new ATOM 0 HA LEU A 80 1.804 4.516 -15.140 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.502 2.243 -16.150 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.221 3.559 -17.271 1.00 0.00 H new ATOM 0 HG LEU A 80 4.272 3.918 -14.437 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.466 4.358 -15.542 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.893 2.705 -15.871 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.739 3.965 -17.119 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.865 6.199 -15.205 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.117 5.857 -16.783 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.113 5.908 -15.315 1.00 0.00 H new ATOM 487 N PRO A 81 -0.013 2.574 -17.008 1.00 0.00 N ATOM 488 CA PRO A 81 -1.209 2.687 -17.855 1.00 0.00 C ATOM 489 C PRO A 81 -2.332 3.595 -17.358 1.00 0.00 C ATOM 490 O PRO A 81 -3.304 3.795 -18.094 1.00 0.00 O ATOM 491 CB PRO A 81 -1.706 1.252 -18.074 1.00 0.00 C ATOM 492 CG PRO A 81 -0.465 0.393 -17.836 1.00 0.00 C ATOM 493 CD PRO A 81 0.298 1.170 -16.766 1.00 0.00 C ATOM 0 HA PRO A 81 -0.912 3.193 -18.774 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.508 0.997 -17.381 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.100 1.115 -19.081 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.728 -0.609 -17.496 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.124 0.276 -18.746 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.011 0.866 -15.766 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.370 0.987 -16.838 1.00 0.00 H new ATOM 501 N PHE A 82 -2.223 4.152 -16.148 1.00 0.00 N ATOM 502 CA PHE A 82 -3.370 4.725 -15.453 1.00 0.00 C ATOM 503 C PHE A 82 -3.346 6.255 -15.354 1.00 0.00 C ATOM 504 O PHE A 82 -4.388 6.897 -15.504 1.00 0.00 O ATOM 505 CB PHE A 82 -3.502 4.063 -14.074 1.00 0.00 C ATOM 506 CG PHE A 82 -3.717 2.567 -14.175 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.654 1.691 -14.470 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.017 2.066 -14.042 1.00 0.00 C ATOM 509 CE1 PHE A 82 -2.916 0.324 -14.671 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.283 0.712 -14.274 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.231 -0.161 -14.585 1.00 0.00 C ATOM 0 H PHE A 82 -1.346 4.216 -15.631 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.254 4.511 -16.053 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.603 4.260 -13.491 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.336 4.513 -13.536 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.644 2.067 -14.541 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.821 2.729 -13.758 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.105 -0.354 -14.892 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.295 0.341 -14.214 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.432 -1.208 -14.759 1.00 0.00 H new ATOM 521 N GLY A 83 -2.163 6.847 -15.165 1.00 0.00 N ATOM 522 CA GLY A 83 -1.926 8.279 -15.307 1.00 0.00 C ATOM 523 C GLY A 83 -0.438 8.557 -15.479 1.00 0.00 C ATOM 524 O GLY A 83 0.102 8.395 -16.574 1.00 0.00 O ATOM 0 H GLY A 83 -1.326 6.327 -14.903 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.476 8.661 -16.167 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.302 8.805 -14.429 1.00 0.00 H new ATOM 528 N LYS A 84 0.228 8.943 -14.384 1.00 0.00 N ATOM 529 CA LYS A 84 1.656 9.278 -14.357 1.00 0.00 C ATOM 530 C LYS A 84 2.454 8.711 -13.173 1.00 0.00 C ATOM 531 O LYS A 84 3.678 8.769 -13.211 1.00 0.00 O ATOM 532 CB LYS A 84 1.762 10.813 -14.468 1.00 0.00 C ATOM 533 CG LYS A 84 3.134 11.341 -14.910 1.00 0.00 C ATOM 534 CD LYS A 84 3.694 10.676 -16.179 1.00 0.00 C ATOM 535 CE LYS A 84 4.941 11.401 -16.706 1.00 0.00 C ATOM 536 NZ LYS A 84 6.107 11.269 -15.790 1.00 0.00 N ATOM 0 H LYS A 84 -0.221 9.033 -13.473 1.00 0.00 H new ATOM 0 HA LYS A 84 2.135 8.784 -15.202 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.010 11.163 -15.175 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.517 11.250 -13.500 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.058 12.415 -15.081 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.844 11.197 -14.096 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.943 9.637 -15.964 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.926 10.667 -16.952 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.204 10.999 -17.684 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.711 12.457 -16.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.922 11.775 -16.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.868 11.676 -14.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 6.346 10.263 -15.675 1.00 0.00 H new ATOM 550 N VAL A 85 1.768 8.159 -12.160 1.00 0.00 N ATOM 551 CA VAL A 85 2.261 7.641 -10.860 1.00 0.00 C ATOM 552 C VAL A 85 3.540 8.351 -10.362 1.00 0.00 C ATOM 553 O VAL A 85 4.677 7.973 -10.651 1.00 0.00 O ATOM 554 CB VAL A 85 2.373 6.107 -10.788 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.853 5.365 -9.547 1.00 0.00 C ATOM 556 CG2 VAL A 85 2.401 5.395 -12.141 1.00 0.00 C ATOM 0 H VAL A 85 0.756 8.051 -12.231 1.00 0.00 H new ATOM 0 HA VAL A 85 1.471 7.902 -10.155 1.00 0.00 H new ATOM 0 HB VAL A 85 3.406 5.981 -10.462 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.014 4.294 -9.670 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.388 5.713 -8.664 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.788 5.561 -9.426 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.481 4.319 -11.984 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.483 5.615 -12.687 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.258 5.743 -12.718 1.00 0.00 H new ATOM 566 N THR A 86 3.331 9.428 -9.612 1.00 0.00 N ATOM 567 CA THR A 86 4.346 10.367 -9.120 1.00 0.00 C ATOM 568 C THR A 86 5.378 9.677 -8.234 1.00 0.00 C ATOM 569 O THR A 86 6.571 9.966 -8.345 1.00 0.00 O ATOM 570 CB THR A 86 3.716 11.518 -8.307 1.00 0.00 C ATOM 571 OG1 THR A 86 2.312 11.528 -8.410 1.00 0.00 O ATOM 572 CG2 THR A 86 4.218 12.875 -8.791 1.00 0.00 C ATOM 0 H THR A 86 2.392 9.689 -9.310 1.00 0.00 H new ATOM 0 HA THR A 86 4.833 10.766 -10.010 1.00 0.00 H new ATOM 0 HB THR A 86 4.010 11.348 -7.271 1.00 0.00 H new ATOM 0 HG1 THR A 86 1.921 11.179 -7.582 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.757 13.666 -8.199 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.301 12.923 -8.679 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.955 13.007 -9.841 1.00 0.00 H new ATOM 580 N ASN A 87 4.924 8.780 -7.351 1.00 0.00 N ATOM 581 CA ASN A 87 5.798 8.056 -6.440 1.00 0.00 C ATOM 582 C ASN A 87 5.271 6.671 -6.017 1.00 0.00 C ATOM 583 O ASN A 87 4.103 6.333 -6.192 1.00 0.00 O ATOM 584 CB ASN A 87 6.021 8.960 -5.207 1.00 0.00 C ATOM 585 CG ASN A 87 7.371 8.796 -4.529 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.211 7.997 -4.911 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.615 9.583 -3.507 1.00 0.00 N ATOM 0 H ASN A 87 3.937 8.540 -7.253 1.00 0.00 H new ATOM 0 HA ASN A 87 6.731 7.841 -6.962 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.908 10.000 -5.512 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.237 8.755 -4.478 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.512 9.530 -3.025 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.907 10.248 -3.195 1.00 0.00 H new ATOM 594 N LEU A 88 6.127 5.880 -5.379 1.00 0.00 N ATOM 595 CA LEU A 88 5.778 4.740 -4.538 1.00 0.00 C ATOM 596 C LEU A 88 6.727 4.593 -3.337 1.00 0.00 C ATOM 597 O LEU A 88 7.758 5.257 -3.249 1.00 0.00 O ATOM 598 CB LEU A 88 5.730 3.483 -5.412 1.00 0.00 C ATOM 599 CG LEU A 88 7.079 2.850 -5.775 1.00 0.00 C ATOM 600 CD1 LEU A 88 6.722 1.592 -6.545 1.00 0.00 C ATOM 601 CD2 LEU A 88 7.980 3.743 -6.624 1.00 0.00 C ATOM 0 H LEU A 88 7.135 6.024 -5.437 1.00 0.00 H new ATOM 0 HA LEU A 88 4.793 4.901 -4.101 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.128 2.733 -4.898 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.209 3.730 -6.337 1.00 0.00 H new ATOM 0 HG LEU A 88 7.654 2.665 -4.868 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.635 1.077 -6.843 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.125 0.935 -5.912 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.149 1.859 -7.433 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.913 3.221 -6.836 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.477 3.982 -7.561 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.194 4.664 -6.082 1.00 0.00 H new ATOM 613 N LEU A 89 6.368 3.701 -2.417 1.00 0.00 N ATOM 614 CA LEU A 89 7.087 3.416 -1.167 1.00 0.00 C ATOM 615 C LEU A 89 6.996 1.924 -0.861 1.00 0.00 C ATOM 616 O LEU A 89 6.054 1.273 -1.306 1.00 0.00 O ATOM 617 CB LEU A 89 6.550 4.380 -0.091 1.00 0.00 C ATOM 618 CG LEU A 89 6.368 3.912 1.357 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.785 5.109 2.095 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.360 2.810 1.565 1.00 0.00 C ATOM 0 H LEU A 89 5.531 3.128 -2.523 1.00 0.00 H new ATOM 0 HA LEU A 89 8.159 3.605 -1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.219 5.240 -0.068 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.580 4.739 -0.437 1.00 0.00 H new ATOM 0 HG LEU A 89 7.336 3.538 1.691 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.627 4.849 3.142 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.477 5.949 2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.833 5.387 1.642 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.311 2.557 2.624 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.380 3.145 1.227 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.660 1.931 0.995 1.00 0.00 H new ATOM 632 N MET A 90 7.933 1.386 -0.072 1.00 0.00 N ATOM 633 CA MET A 90 7.995 -0.045 0.257 1.00 0.00 C ATOM 634 C MET A 90 8.134 -0.288 1.763 1.00 0.00 C ATOM 635 O MET A 90 9.199 -0.080 2.347 1.00 0.00 O ATOM 636 CB MET A 90 9.097 -0.730 -0.566 1.00 0.00 C ATOM 637 CG MET A 90 8.781 -0.542 -2.052 1.00 0.00 C ATOM 638 SD MET A 90 9.417 -1.787 -3.194 1.00 0.00 S ATOM 639 CE MET A 90 8.099 -1.537 -4.405 1.00 0.00 C ATOM 0 H MET A 90 8.676 1.935 0.360 1.00 0.00 H new ATOM 0 HA MET A 90 7.046 -0.503 -0.020 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.070 -0.300 -0.328 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.149 -1.791 -0.321 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.698 -0.502 -2.165 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.169 0.429 -2.360 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.260 -2.195 -5.259 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.136 -1.766 -3.948 1.00 0.00 H new ATOM 0 HE3 MET A 90 8.104 -0.500 -4.740 1.00 0.00 H new ATOM 649 N LEU A 91 7.050 -0.758 2.387 1.00 0.00 N ATOM 650 CA LEU A 91 7.043 -1.296 3.756 1.00 0.00 C ATOM 651 C LEU A 91 7.627 -2.721 3.748 1.00 0.00 C ATOM 652 O LEU A 91 6.918 -3.715 3.947 1.00 0.00 O ATOM 653 CB LEU A 91 5.628 -1.288 4.380 1.00 0.00 C ATOM 654 CG LEU A 91 4.784 0.003 4.435 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.618 1.224 4.802 1.00 0.00 C ATOM 656 CD2 LEU A 91 3.968 0.230 3.164 1.00 0.00 C ATOM 0 H LEU A 91 6.130 -0.777 1.947 1.00 0.00 H new ATOM 0 HA LEU A 91 7.663 -0.649 4.377 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.039 -2.030 3.841 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.730 -1.645 5.405 1.00 0.00 H new ATOM 0 HG LEU A 91 4.064 -0.143 5.241 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.979 2.107 4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.070 1.075 5.783 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.403 1.366 4.059 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.395 1.152 3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.640 0.308 2.309 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.286 -0.607 3.015 1.00 0.00 H new ATOM 668 N LYS A 92 8.933 -2.821 3.475 1.00 0.00 N ATOM 669 CA LYS A 92 9.620 -4.081 3.143 1.00 0.00 C ATOM 670 C LYS A 92 9.450 -5.170 4.211 1.00 0.00 C ATOM 671 O LYS A 92 9.203 -6.325 3.872 1.00 0.00 O ATOM 672 CB LYS A 92 11.097 -3.776 2.831 1.00 0.00 C ATOM 673 CG LYS A 92 11.827 -4.978 2.210 1.00 0.00 C ATOM 674 CD LYS A 92 13.268 -4.612 1.827 1.00 0.00 C ATOM 675 CE LYS A 92 13.970 -5.815 1.192 1.00 0.00 C ATOM 676 NZ LYS A 92 15.366 -5.487 0.800 1.00 0.00 N ATOM 0 H LYS A 92 9.557 -2.014 3.478 1.00 0.00 H new ATOM 0 HA LYS A 92 9.149 -4.505 2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.153 -2.928 2.148 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.606 -3.480 3.749 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.835 -5.808 2.917 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.288 -5.318 1.326 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.265 -3.774 1.130 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.816 -4.288 2.712 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.975 -6.648 1.895 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.412 -6.142 0.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.812 -6.324 0.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.359 -4.709 0.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.904 -5.199 1.642 1.00 0.00 H new ATOM 690 N GLY A 93 9.487 -4.794 5.494 1.00 0.00 N ATOM 691 CA GLY A 93 9.350 -5.708 6.638 1.00 0.00 C ATOM 692 C GLY A 93 7.990 -6.414 6.771 1.00 0.00 C ATOM 693 O GLY A 93 7.914 -7.462 7.416 1.00 0.00 O ATOM 0 H GLY A 93 9.616 -3.822 5.775 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.128 -6.469 6.567 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.537 -5.146 7.553 1.00 0.00 H new ATOM 697 N LYS A 94 6.920 -5.876 6.159 1.00 0.00 N ATOM 698 CA LYS A 94 5.574 -6.485 6.084 1.00 0.00 C ATOM 699 C LYS A 94 5.221 -6.977 4.667 1.00 0.00 C ATOM 700 O LYS A 94 4.119 -7.485 4.461 1.00 0.00 O ATOM 701 CB LYS A 94 4.508 -5.506 6.640 1.00 0.00 C ATOM 702 CG LYS A 94 4.347 -5.496 8.170 1.00 0.00 C ATOM 703 CD LYS A 94 5.542 -5.058 9.030 1.00 0.00 C ATOM 704 CE LYS A 94 6.066 -3.657 8.683 1.00 0.00 C ATOM 705 NZ LYS A 94 7.065 -3.190 9.682 1.00 0.00 N ATOM 0 H LYS A 94 6.967 -4.974 5.686 1.00 0.00 H new ATOM 0 HA LYS A 94 5.582 -7.376 6.712 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.761 -4.498 6.313 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.545 -5.754 6.193 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.508 -4.843 8.411 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.066 -6.503 8.480 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.250 -5.078 10.080 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.350 -5.780 8.909 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.519 -3.671 7.692 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.233 -2.955 8.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 7.400 -2.241 9.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.624 -3.154 10.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.870 -3.848 9.702 1.00 0.00 H new ATOM 719 N ASN A 95 6.129 -6.840 3.693 1.00 0.00 N ATOM 720 CA ASN A 95 5.899 -7.044 2.254 1.00 0.00 C ATOM 721 C ASN A 95 4.769 -6.161 1.682 1.00 0.00 C ATOM 722 O ASN A 95 3.914 -6.633 0.934 1.00 0.00 O ATOM 723 CB ASN A 95 5.737 -8.552 1.951 1.00 0.00 C ATOM 724 CG ASN A 95 7.076 -9.199 1.670 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.889 -9.458 2.550 1.00 0.00 O ATOM 726 ND2 ASN A 95 7.346 -9.450 0.415 1.00 0.00 N ATOM 0 H ASN A 95 7.092 -6.571 3.895 1.00 0.00 H new ATOM 0 HA ASN A 95 6.784 -6.700 1.719 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.261 -9.047 2.798 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.078 -8.685 1.093 1.00 0.00 H new ATOM 0 HD21 ASN A 95 8.242 -9.866 0.159 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.661 -9.230 -0.308 1.00 0.00 H new ATOM 733 N GLN A 96 4.755 -4.868 2.010 1.00 0.00 N ATOM 734 CA GLN A 96 3.702 -3.939 1.562 1.00 0.00 C ATOM 735 C GLN A 96 4.282 -2.704 0.855 1.00 0.00 C ATOM 736 O GLN A 96 5.498 -2.501 0.828 1.00 0.00 O ATOM 737 CB GLN A 96 2.782 -3.582 2.727 1.00 0.00 C ATOM 738 CG GLN A 96 2.318 -4.837 3.470 1.00 0.00 C ATOM 739 CD GLN A 96 1.195 -4.483 4.401 1.00 0.00 C ATOM 740 OE1 GLN A 96 0.060 -4.882 4.207 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.473 -3.665 5.389 1.00 0.00 N ATOM 0 H GLN A 96 5.469 -4.431 2.592 1.00 0.00 H new ATOM 0 HA GLN A 96 3.096 -4.444 0.810 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.305 -2.920 3.417 1.00 0.00 H new ATOM 0 HB3 GLN A 96 1.916 -3.035 2.355 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.989 -5.593 2.757 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.147 -5.268 4.031 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.431 -3.344 5.532 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.731 -3.350 6.014 1.00 0.00 H new ATOM 750 N ALA A 97 3.425 -1.860 0.281 1.00 0.00 N ATOM 751 CA ALA A 97 3.812 -0.644 -0.434 1.00 0.00 C ATOM 752 C ALA A 97 2.717 0.430 -0.388 1.00 0.00 C ATOM 753 O ALA A 97 1.540 0.128 -0.196 1.00 0.00 O ATOM 754 CB ALA A 97 4.099 -1.046 -1.898 1.00 0.00 C ATOM 0 H ALA A 97 2.416 -2.007 0.301 1.00 0.00 H new ATOM 0 HA ALA A 97 4.691 -0.210 0.042 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.392 -0.164 -2.467 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.906 -1.778 -1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.202 -1.480 -2.339 1.00 0.00 H new ATOM 760 N PHE A 98 3.102 1.679 -0.652 1.00 0.00 N ATOM 761 CA PHE A 98 2.210 2.726 -1.157 1.00 0.00 C ATOM 762 C PHE A 98 2.426 2.834 -2.671 1.00 0.00 C ATOM 763 O PHE A 98 3.542 2.607 -3.135 1.00 0.00 O ATOM 764 CB PHE A 98 2.548 4.103 -0.569 1.00 0.00 C ATOM 765 CG PHE A 98 2.152 4.416 0.865 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.834 3.410 1.800 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.129 5.766 1.273 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.518 3.749 3.121 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.780 6.109 2.580 1.00 0.00 C ATOM 770 CZ PHE A 98 1.484 5.096 3.497 1.00 0.00 C ATOM 0 H PHE A 98 4.061 1.999 -0.519 1.00 0.00 H new ATOM 0 HA PHE A 98 1.189 2.460 -0.884 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.627 4.237 -0.648 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.086 4.855 -1.208 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.834 2.374 1.496 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.384 6.542 0.567 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.302 2.977 3.844 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.739 7.146 2.880 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.225 5.358 4.512 1.00 0.00 H new ATOM 780 N ILE A 99 1.428 3.296 -3.420 1.00 0.00 N ATOM 781 CA ILE A 99 1.562 3.739 -4.808 1.00 0.00 C ATOM 782 C ILE A 99 0.808 5.071 -4.956 1.00 0.00 C ATOM 783 O ILE A 99 -0.417 5.130 -4.840 1.00 0.00 O ATOM 784 CB ILE A 99 1.183 2.587 -5.767 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.520 2.970 -7.216 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.273 2.110 -5.622 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.295 1.846 -8.238 1.00 0.00 C ATOM 0 H ILE A 99 0.474 3.375 -3.068 1.00 0.00 H new ATOM 0 HA ILE A 99 2.589 3.965 -5.096 1.00 0.00 H new ATOM 0 HB ILE A 99 1.788 1.727 -5.480 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.915 3.831 -7.502 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.563 3.284 -7.263 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.463 1.301 -6.327 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.439 1.752 -4.606 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.950 2.939 -5.830 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.557 2.202 -9.234 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.920 0.991 -7.982 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.247 1.546 -8.224 1.00 0.00 H new ATOM 799 N GLU A 100 1.555 6.170 -5.065 1.00 0.00 N ATOM 800 CA GLU A 100 1.056 7.547 -5.059 1.00 0.00 C ATOM 801 C GLU A 100 1.090 8.143 -6.462 1.00 0.00 C ATOM 802 O GLU A 100 2.134 8.193 -7.113 1.00 0.00 O ATOM 803 CB GLU A 100 1.858 8.404 -4.079 1.00 0.00 C ATOM 804 CG GLU A 100 1.327 9.844 -3.995 1.00 0.00 C ATOM 805 CD GLU A 100 2.087 10.828 -4.907 1.00 0.00 C ATOM 806 OE1 GLU A 100 3.252 11.162 -4.595 1.00 0.00 O ATOM 807 OE2 GLU A 100 1.507 11.299 -5.911 1.00 0.00 O ATOM 0 H GLU A 100 2.569 6.124 -5.164 1.00 0.00 H new ATOM 0 HA GLU A 100 0.018 7.534 -4.728 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.825 7.948 -3.089 1.00 0.00 H new ATOM 0 HB3 GLU A 100 2.904 8.422 -4.387 1.00 0.00 H new ATOM 0 HG2 GLU A 100 0.271 9.851 -4.265 1.00 0.00 H new ATOM 0 HG3 GLU A 100 1.395 10.189 -2.963 1.00 0.00 H new ATOM 814 N MET A 101 -0.071 8.575 -6.935 1.00 0.00 N ATOM 815 CA MET A 101 -0.253 8.898 -8.344 1.00 0.00 C ATOM 816 C MET A 101 -0.767 10.296 -8.639 1.00 0.00 C ATOM 817 O MET A 101 -1.515 10.889 -7.876 1.00 0.00 O ATOM 818 CB MET A 101 -1.020 7.733 -8.980 1.00 0.00 C ATOM 819 CG MET A 101 -2.003 8.037 -10.113 1.00 0.00 C ATOM 820 SD MET A 101 -1.327 7.794 -11.753 1.00 0.00 S ATOM 821 CE MET A 101 -1.057 6.011 -11.601 1.00 0.00 C ATOM 0 H MET A 101 -0.904 8.710 -6.362 1.00 0.00 H new ATOM 0 HA MET A 101 0.719 8.981 -8.831 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.287 7.021 -9.360 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.573 7.229 -8.188 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.882 7.403 -9.997 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.340 9.069 -10.020 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.011 5.564 -12.594 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.119 5.828 -11.077 1.00 0.00 H new ATOM 0 HE3 MET A 101 -1.878 5.565 -11.040 1.00 0.00 H new ATOM 831 N ASN A 102 -0.338 10.817 -9.794 1.00 0.00 N ATOM 832 CA ASN A 102 -0.316 12.254 -10.057 1.00 0.00 C ATOM 833 C ASN A 102 -1.685 12.944 -10.076 1.00 0.00 C ATOM 834 O ASN A 102 -1.746 14.169 -9.967 1.00 0.00 O ATOM 835 CB ASN A 102 0.430 12.462 -11.383 1.00 0.00 C ATOM 836 CG ASN A 102 -0.415 12.248 -12.623 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.441 13.069 -13.524 1.00 0.00 O ATOM 838 ND2 ASN A 102 -1.078 11.117 -12.751 1.00 0.00 N ATOM 0 H ASN A 102 0.003 10.251 -10.571 1.00 0.00 H new ATOM 0 HA ASN A 102 0.192 12.733 -9.220 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.832 13.475 -11.404 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.280 11.781 -11.417 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -1.610 10.931 -13.601 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.059 10.427 -12.000 1.00 0.00 H new ATOM 845 N THR A 103 -2.774 12.179 -10.222 1.00 0.00 N ATOM 846 CA THR A 103 -4.136 12.726 -10.295 1.00 0.00 C ATOM 847 C THR A 103 -5.105 11.849 -9.512 1.00 0.00 C ATOM 848 O THR A 103 -4.942 10.627 -9.427 1.00 0.00 O ATOM 849 CB THR A 103 -4.633 12.957 -11.740 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.194 11.800 -12.315 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.557 13.438 -12.718 1.00 0.00 C ATOM 0 H THR A 103 -2.736 11.162 -10.293 1.00 0.00 H new ATOM 0 HA THR A 103 -4.098 13.714 -9.836 1.00 0.00 H new ATOM 0 HB THR A 103 -5.379 13.740 -11.607 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.494 12.000 -13.226 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.997 13.573 -13.706 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.148 14.387 -12.371 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.759 12.697 -12.774 1.00 0.00 H new ATOM 859 N GLU A 104 -6.118 12.483 -8.916 1.00 0.00 N ATOM 860 CA GLU A 104 -7.144 11.771 -8.150 1.00 0.00 C ATOM 861 C GLU A 104 -7.919 10.796 -9.043 1.00 0.00 C ATOM 862 O GLU A 104 -8.279 9.717 -8.587 1.00 0.00 O ATOM 863 CB GLU A 104 -8.110 12.756 -7.476 1.00 0.00 C ATOM 864 CG GLU A 104 -7.413 13.588 -6.389 1.00 0.00 C ATOM 865 CD GLU A 104 -8.400 14.523 -5.669 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.660 15.641 -6.176 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.888 14.160 -4.572 1.00 0.00 O ATOM 0 H GLU A 104 -6.250 13.494 -8.950 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.638 11.198 -7.373 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.533 13.422 -8.228 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.941 12.205 -7.035 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.947 12.922 -5.663 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.614 14.178 -6.838 1.00 0.00 H new ATOM 874 N GLU A 105 -8.146 11.135 -10.320 1.00 0.00 N ATOM 875 CA GLU A 105 -8.868 10.267 -11.255 1.00 0.00 C ATOM 876 C GLU A 105 -8.040 9.102 -11.796 1.00 0.00 C ATOM 877 O GLU A 105 -8.577 8.005 -11.925 1.00 0.00 O ATOM 878 CB GLU A 105 -9.422 11.059 -12.443 1.00 0.00 C ATOM 879 CG GLU A 105 -10.584 11.975 -12.038 1.00 0.00 C ATOM 880 CD GLU A 105 -11.181 12.689 -13.265 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.114 12.139 -13.900 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.732 13.814 -13.598 1.00 0.00 O ATOM 0 H GLU A 105 -7.835 12.015 -10.730 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.680 9.848 -10.661 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.624 11.659 -12.881 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.760 10.366 -13.214 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.358 11.389 -11.543 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.234 12.714 -11.318 1.00 0.00 H new ATOM 889 N ALA A 106 -6.749 9.290 -12.082 1.00 0.00 N ATOM 890 CA ALA A 106 -5.851 8.186 -12.405 1.00 0.00 C ATOM 891 C ALA A 106 -5.805 7.186 -11.259 1.00 0.00 C ATOM 892 O ALA A 106 -5.997 5.998 -11.483 1.00 0.00 O ATOM 893 CB ALA A 106 -4.452 8.697 -12.703 1.00 0.00 C ATOM 0 H ALA A 106 -6.302 10.207 -12.095 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.235 7.688 -13.295 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.801 7.856 -12.941 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.487 9.380 -13.552 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.063 9.222 -11.831 1.00 0.00 H new ATOM 899 N ALA A 107 -5.597 7.635 -10.023 1.00 0.00 N ATOM 900 CA ALA A 107 -5.595 6.716 -8.899 1.00 0.00 C ATOM 901 C ALA A 107 -6.975 6.135 -8.576 1.00 0.00 C ATOM 902 O ALA A 107 -7.068 4.947 -8.278 1.00 0.00 O ATOM 903 CB ALA A 107 -5.002 7.433 -7.717 1.00 0.00 C ATOM 0 H ALA A 107 -5.431 8.612 -9.782 1.00 0.00 H new ATOM 0 HA ALA A 107 -4.991 5.848 -9.163 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -4.988 6.765 -6.856 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.984 7.743 -7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.604 8.311 -7.485 1.00 0.00 H new ATOM 909 N ASN A 108 -8.061 6.900 -8.702 1.00 0.00 N ATOM 910 CA ASN A 108 -9.416 6.358 -8.603 1.00 0.00 C ATOM 911 C ASN A 108 -9.653 5.261 -9.648 1.00 0.00 C ATOM 912 O ASN A 108 -10.115 4.181 -9.296 1.00 0.00 O ATOM 913 CB ASN A 108 -10.448 7.485 -8.712 1.00 0.00 C ATOM 914 CG ASN A 108 -11.863 6.959 -8.542 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.268 6.535 -7.470 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.655 6.954 -9.591 1.00 0.00 N ATOM 0 H ASN A 108 -8.026 7.905 -8.874 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.533 5.892 -7.625 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.245 8.241 -7.953 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.354 7.974 -9.682 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.607 6.596 -9.510 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.318 7.308 -10.486 1.00 0.00 H new ATOM 923 N THR A 109 -9.278 5.470 -10.912 1.00 0.00 N ATOM 924 CA THR A 109 -9.360 4.405 -11.913 1.00 0.00 C ATOM 925 C THR A 109 -8.409 3.255 -11.574 1.00 0.00 C ATOM 926 O THR A 109 -8.777 2.104 -11.787 1.00 0.00 O ATOM 927 CB THR A 109 -9.182 4.935 -13.351 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.129 4.298 -14.181 1.00 0.00 O ATOM 929 CG2 THR A 109 -7.814 4.686 -13.982 1.00 0.00 C ATOM 0 H THR A 109 -8.918 6.357 -11.264 1.00 0.00 H new ATOM 0 HA THR A 109 -10.370 3.998 -11.879 1.00 0.00 H new ATOM 0 HB THR A 109 -9.305 6.015 -13.273 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.031 4.625 -15.100 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.798 5.098 -14.991 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.043 5.168 -13.381 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.623 3.614 -14.025 1.00 0.00 H new ATOM 937 N MET A 110 -7.235 3.530 -10.978 1.00 0.00 N ATOM 938 CA MET A 110 -6.233 2.528 -10.619 1.00 0.00 C ATOM 939 C MET A 110 -6.780 1.588 -9.535 1.00 0.00 C ATOM 940 O MET A 110 -6.798 0.371 -9.692 1.00 0.00 O ATOM 941 CB MET A 110 -4.882 3.184 -10.211 1.00 0.00 C ATOM 942 CG MET A 110 -3.745 2.227 -10.583 1.00 0.00 C ATOM 943 SD MET A 110 -2.082 2.903 -10.409 1.00 0.00 S ATOM 944 CE MET A 110 -2.159 3.424 -8.692 1.00 0.00 C ATOM 0 H MET A 110 -6.957 4.479 -10.730 1.00 0.00 H new ATOM 0 HA MET A 110 -6.021 1.924 -11.501 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.755 4.139 -10.721 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.869 3.390 -9.141 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.824 1.336 -9.961 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.884 1.908 -11.616 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.155 3.432 -8.269 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.585 4.426 -8.634 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.784 2.731 -8.129 1.00 0.00 H new ATOM 954 N VAL A 111 -7.303 2.158 -8.450 1.00 0.00 N ATOM 955 CA VAL A 111 -7.929 1.441 -7.339 1.00 0.00 C ATOM 956 C VAL A 111 -9.220 0.733 -7.750 1.00 0.00 C ATOM 957 O VAL A 111 -9.468 -0.372 -7.280 1.00 0.00 O ATOM 958 CB VAL A 111 -8.159 2.409 -6.164 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.497 3.117 -6.150 1.00 0.00 C ATOM 960 CG2 VAL A 111 -8.043 1.700 -4.819 1.00 0.00 C ATOM 0 H VAL A 111 -7.302 3.169 -8.315 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.248 0.652 -7.020 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.377 3.153 -6.316 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.552 3.773 -5.281 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.605 3.709 -7.059 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.298 2.380 -6.100 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.212 2.416 -4.015 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.788 0.906 -4.761 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -7.046 1.270 -4.719 1.00 0.00 H new ATOM 970 N ASN A 112 -10.033 1.322 -8.640 1.00 0.00 N ATOM 971 CA ASN A 112 -11.291 0.730 -9.110 1.00 0.00 C ATOM 972 C ASN A 112 -11.029 -0.455 -10.048 1.00 0.00 C ATOM 973 O ASN A 112 -11.637 -1.513 -9.892 1.00 0.00 O ATOM 974 CB ASN A 112 -12.183 1.793 -9.770 1.00 0.00 C ATOM 975 CG ASN A 112 -12.993 2.588 -8.752 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.214 2.525 -8.717 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.358 3.336 -7.877 1.00 0.00 N ATOM 0 H ASN A 112 -9.832 2.231 -9.057 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.828 0.343 -8.244 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.561 2.476 -10.349 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.862 1.308 -10.472 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.883 3.858 -7.176 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.340 3.394 -7.899 1.00 0.00 H new ATOM 984 N TYR A 113 -10.042 -0.333 -10.936 1.00 0.00 N ATOM 985 CA TYR A 113 -9.431 -1.462 -11.638 1.00 0.00 C ATOM 986 C TYR A 113 -8.956 -2.554 -10.657 1.00 0.00 C ATOM 987 O TYR A 113 -9.231 -3.729 -10.868 1.00 0.00 O ATOM 988 CB TYR A 113 -8.292 -0.946 -12.538 1.00 0.00 C ATOM 989 CG TYR A 113 -7.186 -1.945 -12.788 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.471 -3.159 -13.437 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.895 -1.684 -12.291 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.472 -4.138 -13.559 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.904 -2.678 -12.398 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.187 -3.907 -13.030 1.00 0.00 C ATOM 995 OH TYR A 113 -4.229 -4.871 -13.132 1.00 0.00 O ATOM 0 H TYR A 113 -9.638 0.568 -11.192 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.181 -1.937 -12.271 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.713 -0.643 -13.496 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.862 -0.054 -12.082 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.456 -3.338 -13.841 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.668 -0.733 -11.833 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.689 -5.070 -14.059 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.919 -2.498 -11.993 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.792 -4.991 -12.263 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.372 -2.209 -9.510 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.936 -3.176 -8.506 1.00 0.00 C ATOM 1007 C TYR A 114 -9.047 -3.514 -7.502 1.00 0.00 C ATOM 1008 O TYR A 114 -8.829 -4.125 -6.451 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.693 -2.655 -7.806 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.438 -2.789 -8.625 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -5.092 -4.039 -9.185 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.578 -1.681 -8.732 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.815 -4.183 -9.753 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.298 -1.834 -9.284 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.901 -3.104 -9.755 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.655 -3.282 -10.263 1.00 0.00 O ATOM 0 H TYR A 114 -8.187 -1.240 -9.250 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.694 -4.109 -9.014 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.842 -1.605 -7.554 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.563 -3.193 -6.867 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.791 -4.862 -9.177 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.904 -0.710 -8.388 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.529 -5.127 -10.192 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.625 -0.992 -9.348 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.474 -4.241 -10.357 1.00 0.00 H new ATOM 1026 N THR A 115 -10.266 -3.104 -7.849 1.00 0.00 N ATOM 1027 CA THR A 115 -11.508 -3.472 -7.191 1.00 0.00 C ATOM 1028 C THR A 115 -12.368 -4.347 -8.128 1.00 0.00 C ATOM 1029 O THR A 115 -13.260 -5.062 -7.679 1.00 0.00 O ATOM 1030 CB THR A 115 -12.185 -2.226 -6.594 1.00 0.00 C ATOM 1031 OG1 THR A 115 -11.354 -1.705 -5.577 1.00 0.00 O ATOM 1032 CG2 THR A 115 -13.543 -2.476 -5.950 1.00 0.00 C ATOM 0 H THR A 115 -10.416 -2.474 -8.637 1.00 0.00 H new ATOM 0 HA THR A 115 -11.325 -4.110 -6.327 1.00 0.00 H new ATOM 0 HB THR A 115 -12.338 -1.551 -7.436 1.00 0.00 H new ATOM 0 HG1 THR A 115 -10.629 -1.185 -5.982 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.938 -1.538 -5.559 1.00 0.00 H new ATOM 0 HG22 THR A 115 -14.230 -2.877 -6.695 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.433 -3.191 -5.135 1.00 0.00 H new ATOM 1040 N SER A 116 -11.988 -4.412 -9.414 1.00 0.00 N ATOM 1041 CA SER A 116 -12.258 -5.526 -10.343 1.00 0.00 C ATOM 1042 C SER A 116 -11.387 -6.744 -10.028 1.00 0.00 C ATOM 1043 O SER A 116 -11.830 -7.888 -10.135 1.00 0.00 O ATOM 1044 CB SER A 116 -11.895 -5.098 -11.778 1.00 0.00 C ATOM 1045 OG SER A 116 -13.059 -4.917 -12.570 1.00 0.00 O ATOM 0 H SER A 116 -11.461 -3.658 -9.856 1.00 0.00 H new ATOM 0 HA SER A 116 -13.313 -5.779 -10.241 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.323 -4.170 -11.750 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.255 -5.853 -12.235 1.00 0.00 H new ATOM 0 HG SER A 116 -12.800 -4.644 -13.475 1.00 0.00 H new ATOM 1051 N VAL A 117 -10.115 -6.485 -9.709 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.986 -7.388 -9.960 1.00 0.00 C ATOM 1053 C VAL A 117 -7.963 -7.362 -8.825 1.00 0.00 C ATOM 1054 O VAL A 117 -7.866 -6.396 -8.069 1.00 0.00 O ATOM 1055 CB VAL A 117 -8.361 -6.958 -11.314 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.850 -6.984 -11.468 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -8.923 -7.802 -12.443 1.00 0.00 C ATOM 0 H VAL A 117 -9.834 -5.616 -9.256 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.330 -8.421 -10.007 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.636 -5.904 -11.348 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -6.581 -6.655 -12.472 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.398 -6.317 -10.734 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.485 -7.999 -11.309 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -8.477 -7.490 -13.387 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -8.693 -8.852 -12.262 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.004 -7.671 -12.492 1.00 0.00 H new ATOM 1067 N THR A 118 -7.136 -8.402 -8.763 1.00 0.00 N ATOM 1068 CA THR A 118 -5.889 -8.458 -7.993 1.00 0.00 C ATOM 1069 C THR A 118 -4.757 -8.838 -8.962 1.00 0.00 C ATOM 1070 O THR A 118 -4.976 -9.720 -9.795 1.00 0.00 O ATOM 1071 CB THR A 118 -6.024 -9.464 -6.836 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.213 -9.242 -6.101 1.00 0.00 O ATOM 1073 CG2 THR A 118 -4.885 -9.324 -5.837 1.00 0.00 C ATOM 0 H THR A 118 -7.321 -9.268 -9.269 1.00 0.00 H new ATOM 0 HA THR A 118 -5.663 -7.492 -7.541 1.00 0.00 H new ATOM 0 HB THR A 118 -6.020 -10.450 -7.300 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.275 -9.896 -5.373 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.014 -10.050 -5.034 1.00 0.00 H new ATOM 0 HG22 THR A 118 -3.935 -9.504 -6.340 1.00 0.00 H new ATOM 0 HG23 THR A 118 -4.889 -8.317 -5.419 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.571 -8.193 -8.931 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.547 -8.403 -9.961 1.00 0.00 C ATOM 1083 C PRO A 119 -1.793 -9.733 -9.835 1.00 0.00 C ATOM 1084 O PRO A 119 -1.169 -10.164 -10.803 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.595 -7.203 -9.864 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.776 -6.670 -8.441 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.133 -7.193 -7.971 1.00 0.00 C ATOM 0 HA PRO A 119 -3.025 -8.470 -10.938 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.563 -7.502 -10.045 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.841 -6.442 -10.605 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -0.975 -7.018 -7.788 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.750 -5.580 -8.425 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.053 -7.627 -6.974 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.856 -6.380 -7.907 1.00 0.00 H new ATOM 1095 N VAL A 120 -1.868 -10.383 -8.662 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.246 -11.670 -8.284 1.00 0.00 C ATOM 1097 C VAL A 120 0.172 -11.799 -8.840 1.00 0.00 C ATOM 1098 O VAL A 120 0.487 -12.459 -9.831 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.112 -12.860 -8.660 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.658 -14.116 -7.936 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.592 -12.645 -8.335 1.00 0.00 C ATOM 0 H VAL A 120 -2.408 -9.994 -7.889 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.167 -11.673 -7.197 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.999 -12.972 -9.738 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.295 -14.952 -8.224 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.625 -14.338 -8.205 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -1.727 -13.961 -6.859 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.160 -13.528 -8.626 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -3.708 -12.475 -7.265 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -3.963 -11.779 -8.883 1.00 0.00 H new ATOM 1111 N LEU A 121 1.036 -11.044 -8.192 1.00 0.00 N ATOM 1112 CA LEU A 121 1.823 -10.022 -8.891 1.00 0.00 C ATOM 1113 C LEU A 121 3.168 -10.597 -9.350 1.00 0.00 C ATOM 1114 O LEU A 121 3.630 -10.298 -10.454 1.00 0.00 O ATOM 1115 CB LEU A 121 1.829 -8.765 -7.992 1.00 0.00 C ATOM 1116 CG LEU A 121 2.662 -7.546 -8.443 1.00 0.00 C ATOM 1117 CD1 LEU A 121 2.197 -6.307 -7.656 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.161 -7.718 -8.228 1.00 0.00 C ATOM 0 H LEU A 121 1.217 -11.110 -7.190 1.00 0.00 H new ATOM 0 HA LEU A 121 1.392 -9.699 -9.839 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.797 -8.436 -7.873 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.184 -9.064 -7.006 1.00 0.00 H new ATOM 0 HG LEU A 121 2.501 -7.435 -9.515 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.779 -5.439 -7.967 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.141 -6.125 -7.854 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.342 -6.478 -6.589 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.682 -6.823 -8.568 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.361 -7.874 -7.168 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.513 -8.580 -8.795 1.00 0.00 H new ATOM 1130 N ARG A 122 3.708 -11.532 -8.562 1.00 0.00 N ATOM 1131 CA ARG A 122 4.606 -12.603 -9.026 1.00 0.00 C ATOM 1132 C ARG A 122 4.252 -13.955 -8.383 1.00 0.00 C ATOM 1133 O ARG A 122 5.126 -14.753 -8.040 1.00 0.00 O ATOM 1134 CB ARG A 122 6.081 -12.167 -8.892 1.00 0.00 C ATOM 1135 CG ARG A 122 6.900 -12.530 -10.136 1.00 0.00 C ATOM 1136 CD ARG A 122 7.071 -14.042 -10.348 1.00 0.00 C ATOM 1137 NE ARG A 122 7.899 -14.325 -11.535 1.00 0.00 N ATOM 1138 CZ ARG A 122 8.307 -15.511 -11.955 1.00 0.00 C ATOM 1139 NH1 ARG A 122 7.993 -16.610 -11.330 1.00 0.00 N ATOM 1140 NH2 ARG A 122 9.042 -15.615 -13.024 1.00 0.00 N ATOM 0 H ARG A 122 3.530 -11.569 -7.558 1.00 0.00 H new ATOM 0 HA ARG A 122 4.456 -12.773 -10.092 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.128 -11.090 -8.728 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.522 -12.642 -8.016 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.417 -12.102 -11.015 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.885 -12.070 -10.058 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.532 -14.485 -9.466 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.093 -14.508 -10.464 1.00 0.00 H new ATOM 0 HE ARG A 122 8.188 -13.520 -12.091 1.00 0.00 H new ATOM 0 HH11 ARG A 122 7.416 -16.572 -10.490 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.324 -17.509 -11.681 1.00 0.00 H new ATOM 0 HH21 ARG A 122 9.307 -14.779 -13.544 1.00 0.00 H new ATOM 0 HH22 ARG A 122 9.353 -16.533 -13.342 1.00 0.00 H new ATOM 1154 N GLY A 123 2.946 -14.209 -8.249 1.00 0.00 N ATOM 1155 CA GLY A 123 2.389 -15.558 -8.060 1.00 0.00 C ATOM 1156 C GLY A 123 1.455 -15.826 -6.872 1.00 0.00 C ATOM 1157 O GLY A 123 1.046 -16.980 -6.722 1.00 0.00 O ATOM 0 H GLY A 123 2.236 -13.477 -8.269 1.00 0.00 H new ATOM 0 HA2 GLY A 123 1.846 -15.818 -8.969 1.00 0.00 H new ATOM 0 HA3 GLY A 123 3.227 -16.250 -7.980 1.00 0.00 H new ATOM 1161 N GLN A 124 1.084 -14.850 -6.022 1.00 0.00 N ATOM 1162 CA GLN A 124 0.092 -15.054 -4.963 1.00 0.00 C ATOM 1163 C GLN A 124 -0.729 -13.793 -4.636 1.00 0.00 C ATOM 1164 O GLN A 124 -0.402 -12.745 -5.180 1.00 0.00 O ATOM 1165 CB GLN A 124 0.766 -15.733 -3.751 1.00 0.00 C ATOM 1166 CG GLN A 124 1.157 -14.858 -2.550 1.00 0.00 C ATOM 1167 CD GLN A 124 2.053 -13.668 -2.896 1.00 0.00 C ATOM 1168 OE1 GLN A 124 3.188 -13.798 -3.343 1.00 0.00 O ATOM 1169 NE2 GLN A 124 1.574 -12.465 -2.676 1.00 0.00 N ATOM 0 H GLN A 124 1.465 -13.904 -6.054 1.00 0.00 H new ATOM 0 HA GLN A 124 -0.675 -15.739 -5.326 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.094 -16.512 -3.390 1.00 0.00 H new ATOM 0 HB3 GLN A 124 1.668 -16.230 -4.108 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.248 -14.487 -2.076 1.00 0.00 H new ATOM 0 HG3 GLN A 124 1.668 -15.480 -1.815 1.00 0.00 H new ATOM 0 HE21 GLN A 124 0.631 -12.352 -2.304 1.00 0.00 H new ATOM 0 HE22 GLN A 124 2.145 -11.644 -2.877 1.00 0.00 H new ATOM 1178 N PRO A 125 -1.829 -13.867 -3.860 1.00 0.00 N ATOM 1179 CA PRO A 125 -2.734 -12.732 -3.650 1.00 0.00 C ATOM 1180 C PRO A 125 -2.072 -11.503 -3.006 1.00 0.00 C ATOM 1181 O PRO A 125 -1.162 -11.639 -2.185 1.00 0.00 O ATOM 1182 CB PRO A 125 -3.880 -13.263 -2.783 1.00 0.00 C ATOM 1183 CG PRO A 125 -3.902 -14.753 -3.105 1.00 0.00 C ATOM 1184 CD PRO A 125 -2.425 -15.080 -3.321 1.00 0.00 C ATOM 0 HA PRO A 125 -3.078 -12.363 -4.616 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -3.699 -13.083 -1.723 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.827 -12.784 -3.031 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -4.329 -15.336 -2.289 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -4.496 -14.965 -3.994 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -1.947 -15.369 -2.385 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -2.306 -15.915 -4.011 1.00 0.00 H new ATOM 1192 N ILE A 126 -2.552 -10.312 -3.387 1.00 0.00 N ATOM 1193 CA ILE A 126 -1.874 -9.014 -3.186 1.00 0.00 C ATOM 1194 C ILE A 126 -2.687 -8.034 -2.348 1.00 0.00 C ATOM 1195 O ILE A 126 -2.184 -7.544 -1.347 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.531 -8.357 -4.547 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -0.822 -9.281 -5.550 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.723 -7.067 -4.377 1.00 0.00 C ATOM 1199 CD1 ILE A 126 0.422 -9.965 -5.015 1.00 0.00 C ATOM 0 H ILE A 126 -3.451 -10.217 -3.859 1.00 0.00 H new ATOM 0 HA ILE A 126 -0.960 -9.238 -2.635 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.506 -8.125 -4.975 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.526 -10.045 -5.880 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.549 -8.698 -6.430 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.506 -6.642 -5.357 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.299 -6.351 -3.791 1.00 0.00 H new ATOM 0 HG23 ILE A 126 0.212 -7.288 -3.862 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.853 -10.596 -5.792 1.00 0.00 H new ATOM 0 HD12 ILE A 126 1.150 -9.212 -4.713 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.158 -10.580 -4.155 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.922 -7.741 -2.765 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.847 -6.739 -2.213 1.00 0.00 C ATOM 1213 C TYR A 127 -4.402 -5.270 -2.350 1.00 0.00 C ATOM 1214 O TYR A 127 -3.220 -4.927 -2.276 1.00 0.00 O ATOM 1215 CB TYR A 127 -5.118 -7.035 -0.735 1.00 0.00 C ATOM 1216 CG TYR A 127 -5.354 -8.483 -0.375 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -6.501 -9.170 -0.818 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.409 -9.136 0.431 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -6.720 -10.500 -0.411 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.643 -10.445 0.881 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.800 -11.137 0.451 1.00 0.00 C ATOM 1222 OH TYR A 127 -6.031 -12.416 0.854 1.00 0.00 O ATOM 0 H TYR A 127 -4.335 -8.234 -3.557 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.746 -6.835 -2.821 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -4.272 -6.671 -0.152 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.990 -6.459 -0.425 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -7.210 -8.678 -1.468 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.496 -8.629 0.707 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -7.592 -11.034 -0.758 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -3.944 -10.921 1.552 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.305 -12.710 1.443 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.394 -4.382 -2.444 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.273 -2.926 -2.439 1.00 0.00 C ATOM 1234 C ILE A 128 -6.400 -2.293 -1.610 1.00 0.00 C ATOM 1235 O ILE A 128 -7.536 -2.782 -1.615 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.253 -2.421 -3.912 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.841 -1.898 -4.220 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.327 -1.366 -4.248 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.646 -1.493 -5.684 1.00 0.00 C ATOM 0 H ILE A 128 -6.365 -4.682 -2.531 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.340 -2.624 -1.964 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.507 -3.268 -4.550 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.633 -1.038 -3.583 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.113 -2.668 -3.964 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.236 -1.074 -5.294 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.317 -1.787 -4.074 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.188 -0.490 -3.614 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.627 -1.134 -5.829 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.822 -2.356 -6.327 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.350 -0.701 -5.939 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.126 -1.133 -1.018 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.120 -0.091 -0.743 1.00 0.00 C ATOM 1253 C GLN A 129 -6.494 1.273 -1.043 1.00 0.00 C ATOM 1254 O GLN A 129 -5.272 1.415 -1.013 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.581 -0.168 0.727 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.930 0.514 0.989 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.460 0.223 2.395 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -8.730 0.144 3.375 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.749 0.029 2.555 1.00 0.00 N ATOM 0 H GLN A 129 -5.187 -0.883 -0.708 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.996 -0.236 -1.376 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -7.650 -1.215 1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -6.823 0.292 1.361 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.822 1.591 0.858 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.657 0.174 0.251 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.377 0.090 1.754 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -11.122 -0.182 3.481 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.307 2.307 -1.256 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.835 3.688 -1.113 1.00 0.00 C ATOM 1270 C PHE A 130 -6.147 3.897 0.253 1.00 0.00 C ATOM 1271 O PHE A 130 -6.492 3.255 1.254 1.00 0.00 O ATOM 1272 CB PHE A 130 -8.009 4.658 -1.252 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.224 5.321 -2.592 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.161 5.945 -3.267 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.530 5.425 -3.104 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.400 6.651 -4.458 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.772 6.152 -4.280 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.707 6.769 -4.958 1.00 0.00 C ATOM 0 H PHE A 130 -8.287 2.219 -1.526 1.00 0.00 H new ATOM 0 HA PHE A 130 -6.107 3.883 -1.901 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.921 4.118 -0.996 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.884 5.443 -0.507 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.159 5.882 -2.870 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.349 4.944 -2.591 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.577 7.104 -4.990 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.778 6.237 -4.664 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.893 7.332 -5.861 1.00 0.00 H new ATOM 1288 N SER A 131 -5.188 4.819 0.312 1.00 0.00 N ATOM 1289 CA SER A 131 -4.548 5.191 1.573 1.00 0.00 C ATOM 1290 C SER A 131 -5.491 6.011 2.466 1.00 0.00 C ATOM 1291 O SER A 131 -6.409 6.679 1.982 1.00 0.00 O ATOM 1292 CB SER A 131 -3.224 5.918 1.310 1.00 0.00 C ATOM 1293 OG SER A 131 -2.610 6.319 2.518 1.00 0.00 O ATOM 0 H SER A 131 -4.836 5.324 -0.501 1.00 0.00 H new ATOM 0 HA SER A 131 -4.320 4.277 2.122 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.551 5.263 0.757 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.404 6.792 0.684 1.00 0.00 H new ATOM 0 HG SER A 131 -2.281 5.529 2.995 1.00 0.00 H new ATOM 1299 N ASN A 132 -5.271 5.960 3.786 1.00 0.00 N ATOM 1300 CA ASN A 132 -5.863 6.912 4.734 1.00 0.00 C ATOM 1301 C ASN A 132 -5.137 8.279 4.728 1.00 0.00 C ATOM 1302 O ASN A 132 -5.715 9.288 5.143 1.00 0.00 O ATOM 1303 CB ASN A 132 -5.928 6.279 6.138 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.569 6.132 6.801 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -4.049 7.052 7.415 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.964 4.972 6.715 1.00 0.00 N ATOM 0 H ASN A 132 -4.677 5.257 4.227 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.882 7.128 4.413 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -6.569 6.890 6.774 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -6.395 5.297 6.064 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -3.057 4.836 7.161 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -4.400 4.206 6.202 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.903 8.330 4.212 1.00 0.00 N ATOM 1314 CA HIS A 133 -3.226 9.548 3.760 1.00 0.00 C ATOM 1315 C HIS A 133 -3.716 9.936 2.345 1.00 0.00 C ATOM 1316 O HIS A 133 -4.504 9.224 1.718 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.701 9.331 3.781 1.00 0.00 C ATOM 1318 CG HIS A 133 -1.174 8.637 5.021 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -1.229 9.098 6.324 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.631 7.384 5.058 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.720 8.135 7.120 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.308 7.090 6.385 1.00 0.00 N ATOM 0 H HIS A 133 -3.330 7.494 4.094 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.466 10.370 4.435 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -1.420 8.744 2.906 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.209 10.299 3.687 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -1.589 10.003 6.628 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.478 6.734 4.209 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.653 8.196 8.196 1.00 0.00 H new ATOM 1330 N LYS A 134 -3.251 11.077 1.820 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.725 11.661 0.544 1.00 0.00 C ATOM 1332 C LYS A 134 -2.640 11.805 -0.531 1.00 0.00 C ATOM 1333 O LYS A 134 -2.976 12.073 -1.679 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.411 13.009 0.848 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.716 12.820 1.645 1.00 0.00 C ATOM 1336 CD LYS A 134 -6.367 14.147 2.066 1.00 0.00 C ATOM 1337 CE LYS A 134 -6.975 14.897 0.877 1.00 0.00 C ATOM 1338 NZ LYS A 134 -7.581 16.189 1.294 1.00 0.00 N ATOM 0 H LYS A 134 -2.525 11.633 2.271 1.00 0.00 H new ATOM 0 HA LYS A 134 -4.437 10.961 0.107 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.729 13.645 1.413 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.628 13.526 -0.087 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -6.423 12.251 1.041 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.508 12.227 2.535 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -7.144 13.950 2.805 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.621 14.779 2.549 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.203 15.081 0.130 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -7.735 14.275 0.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.982 16.668 0.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.334 16.011 1.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -6.851 16.793 1.723 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.373 11.593 -0.180 1.00 0.00 N ATOM 1353 CA GLU A 135 -0.144 11.814 -0.959 1.00 0.00 C ATOM 1354 C GLU A 135 1.089 11.319 -0.153 1.00 0.00 C ATOM 1355 O GLU A 135 0.945 10.889 0.996 1.00 0.00 O ATOM 1356 CB GLU A 135 -0.011 13.309 -1.325 1.00 0.00 C ATOM 1357 CG GLU A 135 0.733 13.527 -2.650 1.00 0.00 C ATOM 1358 CD GLU A 135 0.606 14.989 -3.107 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -0.415 15.324 -3.758 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.510 15.809 -2.808 1.00 0.00 O ATOM 0 H GLU A 135 -1.154 11.226 0.746 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.195 11.243 -1.886 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -1.004 13.753 -1.393 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.517 13.830 -0.526 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.785 13.268 -2.530 1.00 0.00 H new ATOM 0 HG3 GLU A 135 0.327 12.865 -3.415 1.00 0.00 H new ATOM 1367 N LEU A 136 2.293 11.350 -0.737 1.00 0.00 N ATOM 1368 CA LEU A 136 3.492 10.638 -0.271 1.00 0.00 C ATOM 1369 C LEU A 136 4.774 11.492 -0.360 1.00 0.00 C ATOM 1370 O LEU A 136 5.163 11.922 -1.448 1.00 0.00 O ATOM 1371 CB LEU A 136 3.587 9.356 -1.125 1.00 0.00 C ATOM 1372 CG LEU A 136 4.861 8.514 -0.994 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.183 8.143 0.449 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.696 7.222 -1.786 1.00 0.00 C ATOM 0 H LEU A 136 2.467 11.894 -1.582 1.00 0.00 H new ATOM 0 HA LEU A 136 3.404 10.401 0.789 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.737 8.721 -0.875 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.477 9.640 -2.172 1.00 0.00 H new ATOM 0 HG LEU A 136 5.680 9.123 -1.378 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.095 7.547 0.477 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.325 9.051 1.035 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.360 7.565 0.868 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.601 6.621 -1.695 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.847 6.661 -1.395 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.522 7.458 -2.836 1.00 0.00 H new ATOM 1386 N LYS A 137 5.460 11.679 0.777 1.00 0.00 N ATOM 1387 CA LYS A 137 6.796 12.288 0.906 1.00 0.00 C ATOM 1388 C LYS A 137 7.822 11.242 1.372 1.00 0.00 C ATOM 1389 O LYS A 137 7.952 10.966 2.565 1.00 0.00 O ATOM 1390 CB LYS A 137 6.720 13.517 1.836 1.00 0.00 C ATOM 1391 CG LYS A 137 8.056 14.279 1.891 1.00 0.00 C ATOM 1392 CD LYS A 137 7.950 15.572 2.714 1.00 0.00 C ATOM 1393 CE LYS A 137 9.235 16.412 2.605 1.00 0.00 C ATOM 1394 NZ LYS A 137 10.350 15.867 3.418 1.00 0.00 N ATOM 0 H LYS A 137 5.080 11.395 1.680 1.00 0.00 H new ATOM 0 HA LYS A 137 7.139 12.641 -0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.934 14.187 1.488 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.444 13.196 2.840 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.822 13.636 2.324 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.377 14.520 0.878 1.00 0.00 H new ATOM 0 HD2 LYS A 137 7.099 16.158 2.366 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.762 15.326 3.759 1.00 0.00 H new ATOM 0 HE2 LYS A 137 9.544 16.462 1.561 1.00 0.00 H new ATOM 0 HE3 LYS A 137 9.024 17.433 2.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 11.258 16.145 2.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.291 16.244 4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 10.285 14.829 3.446 1.00 0.00 H new ATOM 1408 N THR A 138 8.549 10.644 0.428 1.00 0.00 N ATOM 1409 CA THR A 138 9.659 9.695 0.671 1.00 0.00 C ATOM 1410 C THR A 138 10.965 10.359 1.138 1.00 0.00 C ATOM 1411 O THR A 138 11.895 9.667 1.552 1.00 0.00 O ATOM 1412 CB THR A 138 9.942 8.862 -0.594 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.952 9.683 -1.751 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.855 7.811 -0.811 1.00 0.00 C ATOM 0 H THR A 138 8.383 10.806 -0.565 1.00 0.00 H new ATOM 0 HA THR A 138 9.320 9.057 1.487 1.00 0.00 H new ATOM 0 HB THR A 138 10.913 8.390 -0.445 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.434 9.226 -2.472 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.078 7.237 -1.710 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.820 7.141 0.048 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.890 8.304 -0.926 1.00 0.00 H new ATOM 1422 N ASP A 139 11.055 11.692 1.091 1.00 0.00 N ATOM 1423 CA ASP A 139 12.179 12.497 1.587 1.00 0.00 C ATOM 1424 C ASP A 139 12.258 12.498 3.130 1.00 0.00 C ATOM 1425 O ASP A 139 11.681 13.360 3.805 1.00 0.00 O ATOM 1426 CB ASP A 139 12.079 13.912 0.995 1.00 0.00 C ATOM 1427 CG ASP A 139 13.157 14.865 1.544 1.00 0.00 C ATOM 1428 OD1 ASP A 139 14.361 14.549 1.418 1.00 0.00 O ATOM 1429 OD2 ASP A 139 12.788 15.932 2.093 1.00 0.00 O ATOM 0 H ASP A 139 10.314 12.266 0.689 1.00 0.00 H new ATOM 0 HA ASP A 139 13.115 12.049 1.255 1.00 0.00 H new ATOM 0 HB2 ASP A 139 12.169 13.855 -0.090 1.00 0.00 H new ATOM 0 HB3 ASP A 139 11.093 14.323 1.211 1.00 0.00 H new ATOM 1434 N SER A 140 12.969 11.521 3.694 1.00 0.00 N ATOM 1435 CA SER A 140 13.253 11.354 5.122 1.00 0.00 C ATOM 1436 C SER A 140 14.610 10.669 5.371 1.00 0.00 C ATOM 1437 O SER A 140 14.694 9.463 5.612 1.00 0.00 O ATOM 1438 CB SER A 140 12.088 10.652 5.844 1.00 0.00 C ATOM 1439 OG SER A 140 11.763 9.393 5.271 1.00 0.00 O ATOM 0 H SER A 140 13.388 10.779 3.133 1.00 0.00 H new ATOM 0 HA SER A 140 13.341 12.349 5.557 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.348 10.512 6.893 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.209 11.296 5.817 1.00 0.00 H new ATOM 0 HG SER A 140 12.585 8.881 5.120 1.00 0.00 H new ATOM 1445 N SER A 141 15.694 11.449 5.285 1.00 0.00 N ATOM 1446 CA SER A 141 17.082 11.000 5.503 1.00 0.00 C ATOM 1447 C SER A 141 17.330 10.483 6.937 1.00 0.00 C ATOM 1448 O SER A 141 16.698 10.972 7.878 1.00 0.00 O ATOM 1449 CB SER A 141 18.048 12.164 5.228 1.00 0.00 C ATOM 1450 OG SER A 141 17.880 12.644 3.902 1.00 0.00 O ATOM 0 H SER A 141 15.632 12.441 5.055 1.00 0.00 H new ATOM 0 HA SER A 141 17.255 10.171 4.817 1.00 0.00 H new ATOM 0 HB2 SER A 141 17.868 12.970 5.939 1.00 0.00 H new ATOM 0 HB3 SER A 141 19.076 11.834 5.374 1.00 0.00 H new ATOM 0 HG SER A 141 18.500 13.386 3.742 1.00 0.00 H new ATOM 1456 N PRO A 142 18.291 9.561 7.155 1.00 0.00 N ATOM 1457 CA PRO A 142 18.554 8.983 8.478 1.00 0.00 C ATOM 1458 C PRO A 142 19.159 9.978 9.489 1.00 0.00 C ATOM 1459 O PRO A 142 18.999 9.796 10.697 1.00 0.00 O ATOM 1460 CB PRO A 142 19.484 7.791 8.221 1.00 0.00 C ATOM 1461 CG PRO A 142 20.213 8.176 6.936 1.00 0.00 C ATOM 1462 CD PRO A 142 19.139 8.927 6.153 1.00 0.00 C ATOM 0 HA PRO A 142 17.618 8.684 8.950 1.00 0.00 H new ATOM 0 HB2 PRO A 142 20.179 7.640 9.047 1.00 0.00 H new ATOM 0 HB3 PRO A 142 18.924 6.864 8.102 1.00 0.00 H new ATOM 0 HG2 PRO A 142 21.082 8.803 7.136 1.00 0.00 H new ATOM 0 HG3 PRO A 142 20.570 7.300 6.395 1.00 0.00 H new ATOM 0 HD2 PRO A 142 19.584 9.669 5.491 1.00 0.00 H new ATOM 0 HD3 PRO A 142 18.563 8.246 5.527 1.00 0.00 H new ATOM 1470 N ASN A 143 19.819 11.045 9.018 1.00 0.00 N ATOM 1471 CA ASN A 143 20.356 12.123 9.859 1.00 0.00 C ATOM 1472 C ASN A 143 19.256 12.956 10.561 1.00 0.00 C ATOM 1473 O ASN A 143 19.454 13.410 11.689 1.00 0.00 O ATOM 1474 CB ASN A 143 21.257 13.010 8.983 1.00 0.00 C ATOM 1475 CG ASN A 143 21.916 14.127 9.778 1.00 0.00 C ATOM 1476 OD1 ASN A 143 21.470 15.267 9.782 1.00 0.00 O ATOM 1477 ND2 ASN A 143 23.001 13.843 10.466 1.00 0.00 N ATOM 0 H ASN A 143 19.998 11.185 8.024 1.00 0.00 H new ATOM 0 HA ASN A 143 20.932 11.675 10.669 1.00 0.00 H new ATOM 0 HB2 ASN A 143 22.027 12.395 8.518 1.00 0.00 H new ATOM 0 HB3 ASN A 143 20.664 13.442 8.177 1.00 0.00 H new ATOM 0 HD21 ASN A 143 23.470 14.573 11.003 1.00 0.00 H new ATOM 0 HD22 ASN A 143 23.373 12.893 10.463 1.00 0.00 H new ATOM 1484 N GLN A 144 18.090 13.120 9.919 1.00 0.00 N ATOM 1485 CA GLN A 144 16.920 13.828 10.447 1.00 0.00 C ATOM 1486 C GLN A 144 15.701 12.896 10.474 1.00 0.00 C ATOM 1487 O GLN A 144 14.850 12.890 9.581 1.00 0.00 O ATOM 1488 CB GLN A 144 16.693 15.143 9.684 1.00 0.00 C ATOM 1489 CG GLN A 144 15.560 15.957 10.328 1.00 0.00 C ATOM 1490 CD GLN A 144 15.426 17.356 9.731 1.00 0.00 C ATOM 1491 OE1 GLN A 144 15.618 18.369 10.393 1.00 0.00 O ATOM 1492 NE2 GLN A 144 15.092 17.482 8.462 1.00 0.00 N ATOM 0 H GLN A 144 17.933 12.748 8.982 1.00 0.00 H new ATOM 0 HA GLN A 144 17.098 14.118 11.483 1.00 0.00 H new ATOM 0 HB2 GLN A 144 17.612 15.730 9.680 1.00 0.00 H new ATOM 0 HB3 GLN A 144 16.447 14.928 8.644 1.00 0.00 H new ATOM 0 HG2 GLN A 144 14.618 15.422 10.204 1.00 0.00 H new ATOM 0 HG3 GLN A 144 15.741 16.040 11.400 1.00 0.00 H new ATOM 0 HE21 GLN A 144 14.928 16.652 7.893 1.00 0.00 H new ATOM 0 HE22 GLN A 144 14.998 18.410 8.049 1.00 0.00 H new ATOM 1501 N ALA A 145 15.637 12.099 11.539 1.00 0.00 N ATOM 1502 CA ALA A 145 14.657 11.040 11.775 1.00 0.00 C ATOM 1503 C ALA A 145 13.186 11.506 11.854 1.00 0.00 C ATOM 1504 O ALA A 145 12.279 10.712 11.584 1.00 0.00 O ATOM 1505 CB ALA A 145 15.067 10.371 13.089 1.00 0.00 C ATOM 0 H ALA A 145 16.306 12.180 12.305 1.00 0.00 H new ATOM 0 HA ALA A 145 14.673 10.366 10.918 1.00 0.00 H new ATOM 0 HB1 ALA A 145 14.369 9.567 13.321 1.00 0.00 H new ATOM 0 HB2 ALA A 145 16.073 9.962 12.991 1.00 0.00 H new ATOM 0 HB3 ALA A 145 15.052 11.107 13.892 1.00 0.00 H new ATOM 1511 N ARG A 146 12.939 12.774 12.216 1.00 0.00 N ATOM 1512 CA ARG A 146 11.605 13.380 12.394 1.00 0.00 C ATOM 1513 C ARG A 146 11.566 14.809 11.838 1.00 0.00 C ATOM 1514 O ARG A 146 12.564 15.530 11.907 1.00 0.00 O ATOM 1515 CB ARG A 146 11.247 13.316 13.894 1.00 0.00 C ATOM 1516 CG ARG A 146 9.784 13.689 14.185 1.00 0.00 C ATOM 1517 CD ARG A 146 9.378 13.357 15.628 1.00 0.00 C ATOM 1518 NE ARG A 146 10.115 14.158 16.626 1.00 0.00 N ATOM 1519 CZ ARG A 146 9.784 15.333 17.132 1.00 0.00 C ATOM 1520 NH1 ARG A 146 8.713 15.976 16.756 1.00 0.00 N ATOM 1521 NH2 ARG A 146 10.533 15.896 18.035 1.00 0.00 N ATOM 1522 OXT ARG A 146 10.531 15.227 11.324 1.00 99.99 O ATOM 0 H ARG A 146 13.693 13.435 12.401 1.00 0.00 H new ATOM 0 HA ARG A 146 10.857 12.825 11.828 1.00 0.00 H new ATOM 0 HB2 ARG A 146 11.439 12.309 14.264 1.00 0.00 H new ATOM 0 HB3 ARG A 146 11.903 13.989 14.446 1.00 0.00 H new ATOM 0 HG2 ARG A 146 9.639 14.754 14.004 1.00 0.00 H new ATOM 0 HG3 ARG A 146 9.131 13.157 13.494 1.00 0.00 H new ATOM 0 HD2 ARG A 146 8.308 13.528 15.749 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.554 12.298 15.816 1.00 0.00 H new ATOM 0 HE ARG A 146 10.987 13.754 16.967 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.098 15.573 16.048 1.00 0.00 H new ATOM 0 HH12 ARG A 146 8.490 16.881 17.170 1.00 0.00 H new ATOM 0 HH21 ARG A 146 11.382 15.430 18.356 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.272 16.803 18.421 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -0.736 -11.428 5.019 1.00 0.00 O ATOM 1538 C5' C B 147 -1.943 -11.240 5.749 1.00 0.00 C ATOM 1539 C4' C B 147 -1.734 -10.356 6.984 1.00 0.00 C ATOM 1540 O4' C B 147 -0.673 -10.868 7.786 1.00 0.00 O ATOM 1541 C3' C B 147 -1.424 -8.885 6.660 1.00 0.00 C ATOM 1542 O3' C B 147 -2.145 -8.055 7.562 1.00 0.00 O ATOM 1543 C2' C B 147 0.078 -8.804 6.917 1.00 0.00 C ATOM 1544 O2' C B 147 0.541 -7.508 7.258 1.00 0.00 O ATOM 1545 C1' C B 147 0.239 -9.810 8.059 1.00 0.00 C ATOM 1546 N1 C B 147 1.634 -10.315 8.178 1.00 0.00 N ATOM 1547 C2 C B 147 2.277 -10.256 9.423 1.00 0.00 C ATOM 1548 O2 C B 147 1.704 -9.844 10.434 1.00 0.00 O ATOM 1549 N3 C B 147 3.569 -10.661 9.554 1.00 0.00 N ATOM 1550 C4 C B 147 4.199 -11.100 8.483 1.00 0.00 C ATOM 1551 N4 C B 147 5.435 -11.469 8.671 1.00 0.00 N ATOM 1552 C5 C B 147 3.606 -11.175 7.192 1.00 0.00 C ATOM 1553 C6 C B 147 2.316 -10.768 7.074 1.00 0.00 C ATOM 0 H5' C B 147 -2.334 -12.209 6.059 1.00 0.00 H new ATOM 0 H5'' C B 147 -2.692 -10.786 5.100 1.00 0.00 H new ATOM 0 H4' C B 147 -2.685 -10.380 7.516 1.00 0.00 H new ATOM 0 H3' C B 147 -1.698 -8.567 5.654 1.00 0.00 H new ATOM 0 H2' C B 147 0.675 -9.024 6.032 1.00 0.00 H new ATOM 0 HO2' C B 147 1.497 -7.548 7.472 1.00 0.00 H new ATOM 0 HO5' C B 147 0.018 -11.488 5.643 1.00 0.00 H new ATOM 0 H1' C B 147 0.026 -9.335 9.017 1.00 0.00 H new ATOM 0 H41 C B 147 5.987 -11.820 7.888 1.00 0.00 H new ATOM 0 H42 C B 147 5.850 -11.407 9.601 1.00 0.00 H new ATOM 0 H5 C B 147 4.160 -11.541 6.340 1.00 0.00 H new ATOM 0 H6 C B 147 1.826 -10.800 6.112 1.00 0.00 H new ATOM 1566 P U B 148 -3.573 -7.453 7.153 1.00 0.00 P ATOM 1567 OP1 U B 148 -4.504 -7.672 8.285 1.00 0.00 O ATOM 1568 OP2 U B 148 -3.946 -7.950 5.808 1.00 0.00 O ATOM 1569 O5' U B 148 -3.286 -5.880 7.045 1.00 0.00 O ATOM 1570 C5' U B 148 -2.097 -5.403 6.434 1.00 0.00 C ATOM 1571 C4' U B 148 -2.156 -3.909 6.112 1.00 0.00 C ATOM 1572 O4' U B 148 -3.031 -3.700 5.013 1.00 0.00 O ATOM 1573 C3' U B 148 -2.589 -3.043 7.300 1.00 0.00 C ATOM 1574 O3' U B 148 -1.724 -1.915 7.405 1.00 0.00 O ATOM 1575 C2' U B 148 -4.034 -2.699 6.915 1.00 0.00 C ATOM 1576 O2' U B 148 -4.505 -1.455 7.425 1.00 0.00 O ATOM 1577 C1' U B 148 -3.995 -2.740 5.384 1.00 0.00 C ATOM 1578 N1 U B 148 -5.325 -3.101 4.838 1.00 0.00 N ATOM 1579 C2 U B 148 -6.099 -2.095 4.244 1.00 0.00 C ATOM 1580 O2 U B 148 -5.672 -0.979 3.946 1.00 0.00 O ATOM 1581 N3 U B 148 -7.413 -2.401 3.972 1.00 0.00 N ATOM 1582 C4 U B 148 -8.018 -3.618 4.192 1.00 0.00 C ATOM 1583 O4 U B 148 -9.198 -3.779 3.901 1.00 0.00 O ATOM 1584 C5 U B 148 -7.144 -4.626 4.755 1.00 0.00 C ATOM 1585 C6 U B 148 -5.844 -4.358 5.057 1.00 0.00 C ATOM 0 H5' U B 148 -1.916 -5.961 5.515 1.00 0.00 H new ATOM 0 H5'' U B 148 -1.252 -5.595 7.095 1.00 0.00 H new ATOM 0 H4' U B 148 -1.142 -3.597 5.862 1.00 0.00 H new ATOM 0 H3' U B 148 -2.535 -3.509 8.284 1.00 0.00 H new ATOM 0 H2' U B 148 -4.748 -3.397 7.353 1.00 0.00 H new ATOM 0 HO2' U B 148 -4.039 -1.247 8.262 1.00 0.00 H new ATOM 0 H1' U B 148 -3.734 -1.761 4.983 1.00 0.00 H new ATOM 0 H3 U B 148 -7.990 -1.661 3.572 1.00 0.00 H new ATOM 0 H5 U B 148 -7.534 -5.616 4.940 1.00 0.00 H new ATOM 0 H6 U B 148 -5.217 -5.134 5.470 1.00 0.00 H new ATOM 1596 P C B 149 -1.451 -1.241 8.836 1.00 0.00 P ATOM 1597 OP1 C B 149 -0.414 -2.040 9.528 1.00 0.00 O ATOM 1598 OP2 C B 149 -2.764 -1.026 9.492 1.00 0.00 O ATOM 1599 O5' C B 149 -0.837 0.206 8.494 1.00 0.00 O ATOM 1600 C5' C B 149 0.547 0.362 8.228 1.00 0.00 C ATOM 1601 C4' C B 149 0.933 1.753 7.700 1.00 0.00 C ATOM 1602 O4' C B 149 0.544 1.888 6.337 1.00 0.00 O ATOM 1603 C3' C B 149 0.327 2.924 8.503 1.00 0.00 C ATOM 1604 O3' C B 149 1.195 4.044 8.623 1.00 0.00 O ATOM 1605 C2' C B 149 -0.855 3.325 7.627 1.00 0.00 C ATOM 1606 O2' C B 149 -1.290 4.669 7.785 1.00 0.00 O ATOM 1607 C1' C B 149 -0.371 2.968 6.215 1.00 0.00 C ATOM 1608 N1 C B 149 -1.559 2.575 5.410 1.00 0.00 N ATOM 1609 C2 C B 149 -2.110 3.467 4.490 1.00 0.00 C ATOM 1610 O2 C B 149 -1.545 4.506 4.178 1.00 0.00 O ATOM 1611 N3 C B 149 -3.297 3.205 3.895 1.00 0.00 N ATOM 1612 C4 C B 149 -3.890 2.058 4.140 1.00 0.00 C ATOM 1613 N4 C B 149 -5.008 1.811 3.516 1.00 0.00 N ATOM 1614 C5 C B 149 -3.359 1.106 5.039 1.00 0.00 C ATOM 1615 C6 C B 149 -2.201 1.396 5.669 1.00 0.00 C ATOM 0 H5' C B 149 0.853 -0.389 7.499 1.00 0.00 H new ATOM 0 H5'' C B 149 1.106 0.165 9.143 1.00 0.00 H new ATOM 0 H4' C B 149 2.016 1.814 7.811 1.00 0.00 H new ATOM 0 H3' C B 149 0.096 2.628 9.526 1.00 0.00 H new ATOM 0 H2' C B 149 -1.770 2.800 7.900 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.766 5.253 7.198 1.00 0.00 H new ATOM 0 H1' C B 149 0.126 3.805 5.724 1.00 0.00 H new ATOM 0 H41 C B 149 -5.499 0.932 3.679 1.00 0.00 H new ATOM 0 H42 C B 149 -5.391 2.497 2.865 1.00 0.00 H new ATOM 0 H5 C B 149 -3.867 0.170 5.218 1.00 0.00 H new ATOM 0 H6 C B 149 -1.782 0.697 6.377 1.00 0.00 H new ATOM 1627 P U B 150 2.503 4.001 9.539 1.00 0.00 P ATOM 1628 OP1 U B 150 2.314 2.980 10.599 1.00 0.00 O ATOM 1629 OP2 U B 150 2.835 5.397 9.922 1.00 0.00 O ATOM 1630 O5' U B 150 3.614 3.472 8.512 1.00 0.00 O ATOM 1631 C5' U B 150 3.775 4.089 7.246 1.00 0.00 C ATOM 1632 C4' U B 150 5.250 4.100 6.853 1.00 0.00 C ATOM 1633 O4' U B 150 5.390 4.538 5.512 1.00 0.00 O ATOM 1634 C3' U B 150 6.057 5.041 7.748 1.00 0.00 C ATOM 1635 O3' U B 150 6.648 4.364 8.851 1.00 0.00 O ATOM 1636 C2' U B 150 7.070 5.659 6.774 1.00 0.00 C ATOM 1637 O2' U B 150 8.337 5.000 6.759 1.00 0.00 O ATOM 1638 C1' U B 150 6.437 5.497 5.395 1.00 0.00 C ATOM 1639 N1 U B 150 5.957 6.816 4.881 1.00 0.00 N ATOM 1640 C2 U B 150 6.891 7.707 4.330 1.00 0.00 C ATOM 1641 O2 U B 150 8.098 7.485 4.273 1.00 0.00 O ATOM 1642 N3 U B 150 6.399 8.894 3.820 1.00 0.00 N ATOM 1643 C4 U B 150 5.069 9.235 3.725 1.00 0.00 C ATOM 1644 O4 U B 150 4.746 10.298 3.205 1.00 0.00 O ATOM 1645 C5 U B 150 4.159 8.249 4.258 1.00 0.00 C ATOM 1646 C6 U B 150 4.617 7.109 4.837 1.00 0.00 C ATOM 0 H5' U B 150 3.391 5.109 7.278 1.00 0.00 H new ATOM 0 H5'' U B 150 3.194 3.553 6.495 1.00 0.00 H new ATOM 0 H4' U B 150 5.626 3.083 6.967 1.00 0.00 H new ATOM 0 H3' U B 150 5.452 5.803 8.240 1.00 0.00 H new ATOM 0 H2' U B 150 7.269 6.689 7.071 1.00 0.00 H new ATOM 0 HO2' U B 150 8.733 5.031 7.655 1.00 0.00 H new ATOM 0 H1' U B 150 7.165 5.139 4.667 1.00 0.00 H new ATOM 0 H3 U B 150 7.080 9.576 3.485 1.00 0.00 H new ATOM 0 H5 U B 150 3.095 8.421 4.195 1.00 0.00 H new ATOM 0 H6 U B 150 3.911 6.418 5.273 1.00 0.00 H new ATOM 1657 P C B 151 7.493 5.151 9.957 1.00 0.00 P ATOM 1658 OP1 C B 151 6.906 6.501 10.148 1.00 0.00 O ATOM 1659 OP2 C B 151 8.923 5.034 9.579 1.00 0.00 O ATOM 1660 O5' C B 151 7.226 4.304 11.296 1.00 0.00 O ATOM 1661 C5' C B 151 7.761 3.000 11.456 1.00 0.00 C ATOM 1662 C4' C B 151 7.389 2.435 12.836 1.00 0.00 C ATOM 1663 O4' C B 151 6.025 1.997 12.863 1.00 0.00 O ATOM 1664 C3' C B 151 8.266 1.211 13.178 1.00 0.00 C ATOM 1665 O3' C B 151 8.551 1.137 14.573 1.00 0.00 O ATOM 1666 C2' C B 151 7.328 0.077 12.746 1.00 0.00 C ATOM 1667 O2' C B 151 7.677 -1.196 13.277 1.00 0.00 O ATOM 1668 C1' C B 151 5.998 0.629 13.257 1.00 0.00 C ATOM 1669 N1 C B 151 4.815 -0.105 12.722 1.00 0.00 N ATOM 1670 C2 C B 151 4.123 -0.973 13.579 1.00 0.00 C ATOM 1671 O2 C B 151 4.439 -1.116 14.763 1.00 0.00 O ATOM 1672 N3 C B 151 3.055 -1.680 13.128 1.00 0.00 N ATOM 1673 C4 C B 151 2.688 -1.539 11.873 1.00 0.00 C ATOM 1674 N4 C B 151 1.628 -2.221 11.540 1.00 0.00 N ATOM 1675 C5 C B 151 3.369 -0.702 10.944 1.00 0.00 C ATOM 1676 C6 C B 151 4.430 0.009 11.406 1.00 0.00 C ATOM 0 H5' C B 151 8.845 3.029 11.348 1.00 0.00 H new ATOM 0 H5'' C B 151 7.380 2.345 10.673 1.00 0.00 H new ATOM 0 H4' C B 151 7.545 3.237 13.558 1.00 0.00 H new ATOM 0 H3' C B 151 9.247 1.210 12.702 1.00 0.00 H new ATOM 0 H2' C B 151 7.343 -0.145 11.679 1.00 0.00 H new ATOM 0 HO2' C B 151 8.271 -1.077 14.047 1.00 0.00 H new ATOM 0 H1' C B 151 5.891 0.510 14.335 1.00 0.00 H new ATOM 0 H41 C B 151 1.270 -2.173 10.586 1.00 0.00 H new ATOM 0 H42 C B 151 1.157 -2.802 12.233 1.00 0.00 H new ATOM 0 H5 C B 151 3.054 -0.635 9.913 1.00 0.00 H new ATOM 0 H6 C B 151 4.972 0.664 10.740 1.00 0.00 H new ATOM 1688 P U B 152 9.567 2.181 15.261 1.00 0.00 P ATOM 1689 OP1 U B 152 8.781 3.311 15.804 1.00 0.00 O ATOM 1690 OP2 U B 152 10.659 2.464 14.301 1.00 0.00 O ATOM 1691 O5' U B 152 10.212 1.361 16.485 1.00 0.00 O ATOM 1692 C5' U B 152 9.458 1.013 17.642 1.00 0.00 C ATOM 1693 C4' U B 152 10.070 1.557 18.948 1.00 0.00 C ATOM 1694 O4' U B 152 11.345 0.963 19.188 1.00 0.00 O ATOM 1695 C3' U B 152 10.261 3.082 18.969 1.00 0.00 C ATOM 1696 O3' U B 152 10.050 3.585 20.291 1.00 0.00 O ATOM 1697 C2' U B 152 11.734 3.215 18.554 1.00 0.00 C ATOM 1698 O2' U B 152 12.321 4.454 18.955 1.00 0.00 O ATOM 1699 C1' U B 152 12.332 1.989 19.248 1.00 0.00 C ATOM 1700 N1 U B 152 13.613 1.556 18.624 1.00 0.00 N ATOM 1701 C2 U B 152 14.794 1.672 19.367 1.00 0.00 C ATOM 1702 O2 U B 152 14.838 2.087 20.529 1.00 0.00 O ATOM 1703 N3 U B 152 15.969 1.291 18.748 1.00 0.00 N ATOM 1704 C4 U B 152 16.076 0.800 17.467 1.00 0.00 C ATOM 1705 O4 U B 152 17.177 0.492 17.016 1.00 0.00 O ATOM 1706 C5 U B 152 14.820 0.702 16.758 1.00 0.00 C ATOM 1707 C6 U B 152 13.645 1.071 17.333 1.00 0.00 C ATOM 0 H5' U B 152 9.384 -0.073 17.707 1.00 0.00 H new ATOM 0 H5'' U B 152 8.443 1.396 17.536 1.00 0.00 H new ATOM 0 H4' U B 152 9.348 1.298 19.722 1.00 0.00 H new ATOM 0 H3' U B 152 9.574 3.636 18.329 1.00 0.00 H new ATOM 0 H2' U B 152 11.903 3.237 17.477 1.00 0.00 H new ATOM 0 HO2' U B 152 13.257 4.481 18.666 1.00 0.00 H new ATOM 0 HO3' U B 152 10.814 4.139 20.556 1.00 0.00 H new ATOM 0 H1' U B 152 12.584 2.226 20.282 1.00 0.00 H new ATOM 0 H3 U B 152 16.831 1.381 19.286 1.00 0.00 H new ATOM 0 H5 U B 152 14.815 0.326 15.746 1.00 0.00 H new ATOM 0 H6 U B 152 12.726 0.983 16.773 1.00 0.00 H new TER 1719 U B 152