USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=35 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 143 ASN : amide:sc= 0 X(o=0.61,f=0.21) USER MOD Set 1.2: A 144 GLN : amide:sc= 0.614 K(o=0.61,f=-0.015) USER MOD Set 2.1: A 132 ASN : amide:sc= 0.719 K(o=3.3,f=1.3) USER MOD Set 2.2: A 133 HIS : no HE2:sc= 0.628 K(o=3.3,f=0.028) USER MOD Set 2.3: B 149 C O2' : rot 75:sc= 1.92 USER MOD Set 3.1: A 65 LYS NZ :NH3+ 152:sc= 1.9 (180deg=1.15) USER MOD Set 3.2: B 147 C O2' : rot 180:sc= 0.989 USER MOD Set 4.1: A 62 HIS : no HE2:sc= -1.43 K(o=-2.6,f=-5.7) USER MOD Set 4.2: A 96 GLN : amide:sc= -1.15 K(o=-2.6,f=-3.2) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -43:sc= 0.875 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.466 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 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.0893 X(o=-0.089,f=-0.15) USER MOD Single : A 90 MET CE :methyl 173:sc= -0.14 (180deg=-0.272) USER MOD Single : A 92 LYS NZ :NH3+ 168:sc= 1.22 (180deg=1.03) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 1.3 (180deg=1.3) USER MOD Single : A 95 ASN : amide:sc= 0.975 K(o=0.97,f=-1.3) USER MOD Single : A 101 MET CE :methyl 163:sc= -4.23 (180deg=-4.95!) USER MOD Single : A 102 ASN :FLIP amide:sc= -5! C(o=-6.1!,f=-5!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.378 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 165:sc= -0.537 (180deg=-1.12) USER MOD Single : A 112 ASN : amide:sc= 0.361 X(o=0.36,f=-0.0012) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 141:sc= 0.356 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 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 K(o=0,f=-1.4) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.339 X(o=0.34,f=0) USER MOD Single : A 131 SER OG : rot -80:sc= -0.0505 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 179:sc= 2.16 (180deg=2.09) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.121 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : B 147 C O5' : rot 33:sc= 0.0198 USER MOD Single : B 148 U O2' : rot -22:sc= 1.21 USER MOD Single : B 150 U O2' : rot -15:sc= 0.134 USER MOD Single : B 151 C O2' : rot 27:sc= 0.103 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 133:sc= 0.0261 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -24.356 2.315 1.655 1.00 0.00 N ATOM 2 CA GLY A 49 -23.599 1.193 2.254 1.00 0.00 C ATOM 3 C GLY A 49 -22.548 1.695 3.228 1.00 0.00 C ATOM 4 O GLY A 49 -21.744 2.559 2.884 1.00 0.00 O ATOM 0 HA2 GLY A 49 -24.286 0.523 2.770 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -23.120 0.613 1.466 1.00 0.00 H new ATOM 8 N ASP A 50 -22.534 1.161 4.453 1.00 0.00 N ATOM 9 CA ASP A 50 -21.636 1.587 5.546 1.00 0.00 C ATOM 10 C ASP A 50 -20.133 1.366 5.259 1.00 0.00 C ATOM 11 O ASP A 50 -19.278 2.043 5.833 1.00 0.00 O ATOM 12 CB ASP A 50 -22.060 0.852 6.827 1.00 0.00 C ATOM 13 CG ASP A 50 -21.327 1.367 8.080 1.00 0.00 C ATOM 14 OD1 ASP A 50 -21.565 2.530 8.488 1.00 0.00 O ATOM 15 OD2 ASP A 50 -20.535 0.599 8.682 1.00 0.00 O ATOM 0 H ASP A 50 -23.159 0.402 4.725 1.00 0.00 H new ATOM 0 HA ASP A 50 -21.741 2.666 5.655 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -23.135 0.967 6.967 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -21.866 -0.214 6.710 1.00 0.00 H new ATOM 20 N SER A 51 -19.802 0.458 4.333 1.00 0.00 N ATOM 21 CA SER A 51 -18.440 0.096 3.900 1.00 0.00 C ATOM 22 C SER A 51 -17.689 1.188 3.108 1.00 0.00 C ATOM 23 O SER A 51 -16.532 0.982 2.730 1.00 0.00 O ATOM 24 CB SER A 51 -18.497 -1.181 3.048 1.00 0.00 C ATOM 25 OG SER A 51 -19.180 -2.224 3.738 1.00 0.00 O ATOM 0 H SER A 51 -20.515 -0.076 3.836 1.00 0.00 H new ATOM 0 HA SER A 51 -17.875 -0.049 4.821 1.00 0.00 H new ATOM 0 HB2 SER A 51 -19.003 -0.972 2.105 1.00 0.00 H new ATOM 0 HB3 SER A 51 -17.485 -1.504 2.802 1.00 0.00 H new ATOM 0 HG SER A 51 -19.205 -3.026 3.176 1.00 0.00 H new ATOM 31 N ARG A 52 -18.326 2.338 2.830 1.00 0.00 N ATOM 32 CA ARG A 52 -17.766 3.514 2.131 1.00 0.00 C ATOM 33 C ARG A 52 -16.509 4.091 2.823 1.00 0.00 C ATOM 34 O ARG A 52 -16.315 3.915 4.029 1.00 0.00 O ATOM 35 CB ARG A 52 -18.908 4.544 2.002 1.00 0.00 C ATOM 36 CG ARG A 52 -18.628 5.728 1.060 1.00 0.00 C ATOM 37 CD ARG A 52 -19.875 6.612 0.929 1.00 0.00 C ATOM 38 NE ARG A 52 -19.631 7.759 0.029 1.00 0.00 N ATOM 39 CZ ARG A 52 -20.013 7.907 -1.228 1.00 0.00 C ATOM 40 NH1 ARG A 52 -20.667 6.986 -1.877 1.00 0.00 N ATOM 41 NH2 ARG A 52 -19.739 9.005 -1.871 1.00 0.00 N ATOM 0 H ARG A 52 -19.299 2.483 3.100 1.00 0.00 H new ATOM 0 HA ARG A 52 -17.405 3.225 1.144 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -19.802 4.028 1.652 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.134 4.936 2.994 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.795 6.317 1.443 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.332 5.358 0.078 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.705 6.018 0.547 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.170 6.976 1.913 1.00 0.00 H new ATOM 0 HE ARG A 52 -19.101 8.534 0.428 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -20.904 6.108 -1.416 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -20.942 7.143 -2.847 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.228 9.755 -1.405 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.035 9.116 -2.841 1.00 0.00 H new ATOM 55 N SER A 53 -15.699 4.835 2.063 1.00 0.00 N ATOM 56 CA SER A 53 -14.382 5.415 2.420 1.00 0.00 C ATOM 57 C SER A 53 -13.277 4.380 2.725 1.00 0.00 C ATOM 58 O SER A 53 -13.500 3.169 2.629 1.00 0.00 O ATOM 59 CB SER A 53 -14.516 6.512 3.490 1.00 0.00 C ATOM 60 OG SER A 53 -14.597 5.990 4.805 1.00 0.00 O ATOM 0 H SER A 53 -15.959 5.071 1.105 1.00 0.00 H new ATOM 0 HA SER A 53 -14.021 5.899 1.513 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.661 7.185 3.423 1.00 0.00 H new ATOM 0 HB3 SER A 53 -15.406 7.107 3.285 1.00 0.00 H new ATOM 0 HG SER A 53 -15.194 5.213 4.812 1.00 0.00 H new ATOM 66 N ALA A 54 -12.051 4.853 3.003 1.00 0.00 N ATOM 67 CA ALA A 54 -10.827 4.034 3.023 1.00 0.00 C ATOM 68 C ALA A 54 -9.824 4.310 4.170 1.00 0.00 C ATOM 69 O ALA A 54 -8.997 3.443 4.462 1.00 0.00 O ATOM 70 CB ALA A 54 -10.116 4.215 1.672 1.00 0.00 C ATOM 0 H ALA A 54 -11.879 5.834 3.224 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.162 3.013 3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -9.204 3.619 1.658 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.775 3.889 0.867 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.864 5.266 1.531 1.00 0.00 H new ATOM 76 N GLY A 55 -9.857 5.489 4.797 1.00 0.00 N ATOM 77 CA GLY A 55 -8.872 5.938 5.789 1.00 0.00 C ATOM 78 C GLY A 55 -8.674 7.447 5.681 1.00 0.00 C ATOM 79 O GLY A 55 -9.377 8.209 6.346 1.00 0.00 O ATOM 0 H GLY A 55 -10.589 6.178 4.625 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -9.209 5.678 6.792 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -7.923 5.426 5.629 1.00 0.00 H new ATOM 83 N VAL A 56 -7.790 7.873 4.769 1.00 0.00 N ATOM 84 CA VAL A 56 -7.695 9.270 4.267 1.00 0.00 C ATOM 85 C VAL A 56 -7.330 9.228 2.768 1.00 0.00 C ATOM 86 O VAL A 56 -6.170 9.411 2.384 1.00 0.00 O ATOM 87 CB VAL A 56 -6.727 10.161 5.063 1.00 0.00 C ATOM 88 CG1 VAL A 56 -6.896 11.632 4.656 1.00 0.00 C ATOM 89 CG2 VAL A 56 -6.927 10.124 6.584 1.00 0.00 C ATOM 0 H VAL A 56 -7.102 7.251 4.344 1.00 0.00 H new ATOM 0 HA VAL A 56 -8.669 9.740 4.408 1.00 0.00 H new ATOM 0 HB VAL A 56 -5.742 9.760 4.827 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -6.204 12.250 5.228 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -6.686 11.742 3.592 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.919 11.950 4.858 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -6.201 10.782 7.063 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -7.936 10.459 6.827 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -6.786 9.105 6.945 1.00 0.00 H new ATOM 99 N PRO A 57 -8.300 8.863 1.915 1.00 0.00 N ATOM 100 CA PRO A 57 -8.016 8.244 0.630 1.00 0.00 C ATOM 101 C PRO A 57 -7.868 9.219 -0.550 1.00 0.00 C ATOM 102 O PRO A 57 -8.816 9.462 -1.298 1.00 0.00 O ATOM 103 CB PRO A 57 -9.157 7.242 0.508 1.00 0.00 C ATOM 104 CG PRO A 57 -10.362 7.916 1.134 1.00 0.00 C ATOM 105 CD PRO A 57 -9.682 8.595 2.309 1.00 0.00 C ATOM 0 HA PRO A 57 -7.032 7.778 0.588 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -9.347 6.990 -0.535 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.918 6.311 1.022 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.843 8.625 0.460 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -11.126 7.204 1.446 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -10.195 9.522 2.567 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -9.713 7.957 3.192 1.00 0.00 H new ATOM 113 N SER A 58 -6.646 9.731 -0.741 1.00 0.00 N ATOM 114 CA SER A 58 -6.269 10.646 -1.834 1.00 0.00 C ATOM 115 C SER A 58 -4.870 10.348 -2.404 1.00 0.00 C ATOM 116 O SER A 58 -3.871 10.394 -1.681 1.00 0.00 O ATOM 117 CB SER A 58 -6.312 12.100 -1.351 1.00 0.00 C ATOM 118 OG SER A 58 -7.630 12.500 -1.007 1.00 0.00 O ATOM 0 H SER A 58 -5.865 9.515 -0.121 1.00 0.00 H new ATOM 0 HA SER A 58 -6.995 10.490 -2.632 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.659 12.216 -0.486 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.925 12.755 -2.132 1.00 0.00 H new ATOM 0 HG SER A 58 -7.620 13.431 -0.702 1.00 0.00 H new ATOM 124 N ARG A 59 -4.816 10.087 -3.721 1.00 0.00 N ATOM 125 CA ARG A 59 -3.661 9.896 -4.638 1.00 0.00 C ATOM 126 C ARG A 59 -2.680 8.749 -4.336 1.00 0.00 C ATOM 127 O ARG A 59 -2.145 8.185 -5.291 1.00 0.00 O ATOM 128 CB ARG A 59 -2.913 11.219 -4.862 1.00 0.00 C ATOM 129 CG ARG A 59 -3.517 12.093 -5.985 1.00 0.00 C ATOM 130 CD ARG A 59 -2.772 13.427 -6.113 1.00 0.00 C ATOM 131 NE ARG A 59 -1.311 13.234 -6.218 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.379 14.121 -6.485 1.00 0.00 C ATOM 133 NH1 ARG A 59 -0.646 15.347 -6.833 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.863 13.753 -6.401 1.00 0.00 N ATOM 0 H ARG A 59 -5.688 9.991 -4.241 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.140 9.559 -5.557 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.912 11.788 -3.932 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.873 11.001 -5.103 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.470 11.556 -6.932 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.570 12.281 -5.776 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.132 13.961 -6.993 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -2.994 14.052 -5.248 1.00 0.00 H new ATOM 0 HE ARG A 59 -0.981 12.282 -6.062 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -1.615 15.656 -6.909 1.00 0.00 H new ATOM 0 HH12 ARG A 59 0.114 15.998 -7.030 1.00 0.00 H new ATOM 0 HH21 ARG A 59 1.094 12.796 -6.133 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.607 14.420 -6.603 1.00 0.00 H new ATOM 148 N VAL A 60 -2.493 8.337 -3.080 1.00 0.00 N ATOM 149 CA VAL A 60 -1.788 7.095 -2.719 1.00 0.00 C ATOM 150 C VAL A 60 -2.755 5.946 -2.435 1.00 0.00 C ATOM 151 O VAL A 60 -3.734 6.078 -1.695 1.00 0.00 O ATOM 152 CB VAL A 60 -0.730 7.269 -1.612 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.110 8.111 -0.393 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.212 5.909 -1.161 1.00 0.00 C ATOM 0 H VAL A 60 -2.829 8.860 -2.272 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.217 6.820 -3.606 1.00 0.00 H new ATOM 0 HB VAL A 60 0.044 7.861 -2.100 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.270 8.146 0.301 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.359 9.123 -0.713 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.972 7.665 0.103 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.535 6.045 -0.379 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.039 5.315 -0.773 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.240 5.393 -2.008 1.00 0.00 H new ATOM 164 N ILE A 61 -2.421 4.789 -3.000 1.00 0.00 N ATOM 165 CA ILE A 61 -2.997 3.467 -2.738 1.00 0.00 C ATOM 166 C ILE A 61 -1.950 2.624 -2.010 1.00 0.00 C ATOM 167 O ILE A 61 -0.838 2.467 -2.498 1.00 0.00 O ATOM 168 CB ILE A 61 -3.409 2.831 -4.076 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.519 3.649 -4.768 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.851 1.371 -3.918 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.511 3.401 -6.271 1.00 0.00 C ATOM 0 H ILE A 61 -1.686 4.744 -3.706 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.885 3.536 -2.110 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.520 2.841 -4.707 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.490 3.377 -4.354 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.374 4.711 -4.569 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.132 0.968 -4.891 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -3.030 0.785 -3.506 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.706 1.321 -3.244 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.301 3.987 -6.741 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.546 3.696 -6.683 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.680 2.342 -6.466 1.00 0.00 H new ATOM 183 N HIS A 62 -2.278 2.087 -0.843 1.00 0.00 N ATOM 184 CA HIS A 62 -1.451 1.084 -0.173 1.00 0.00 C ATOM 185 C HIS A 62 -1.737 -0.327 -0.717 1.00 0.00 C ATOM 186 O HIS A 62 -2.863 -0.664 -1.098 1.00 0.00 O ATOM 187 CB HIS A 62 -1.691 1.198 1.334 1.00 0.00 C ATOM 188 CG HIS A 62 -1.129 0.086 2.193 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.603 -1.205 2.306 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.125 0.225 3.104 1.00 0.00 C ATOM 191 CE1 HIS A 62 -0.863 -1.834 3.241 1.00 0.00 C ATOM 192 NE2 HIS A 62 0.060 -1.005 3.747 1.00 0.00 N ATOM 0 H HIS A 62 -3.125 2.333 -0.331 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.395 1.266 -0.374 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.266 2.142 1.677 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.766 1.251 1.505 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.375 -1.611 1.777 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.433 1.129 3.297 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.996 -2.863 3.541 1.00 0.00 H new ATOM 200 N ILE A 63 -0.710 -1.174 -0.704 1.00 0.00 N ATOM 201 CA ILE A 63 -0.724 -2.569 -1.152 1.00 0.00 C ATOM 202 C ILE A 63 -0.237 -3.468 -0.004 1.00 0.00 C ATOM 203 O ILE A 63 0.717 -3.108 0.688 1.00 0.00 O ATOM 204 CB ILE A 63 0.150 -2.763 -2.421 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.017 -1.621 -3.463 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.215 -4.117 -3.063 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.966 -1.755 -4.661 1.00 0.00 C ATOM 0 H ILE A 63 0.208 -0.891 -0.361 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.743 -2.847 -1.422 1.00 0.00 H new ATOM 0 HB ILE A 63 1.192 -2.743 -2.102 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.010 -1.594 -3.827 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.205 -0.668 -2.968 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.390 -4.271 -3.957 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.022 -4.920 -2.352 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.271 -4.118 -3.334 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.811 -0.919 -5.343 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.998 -1.751 -4.310 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.764 -2.691 -5.182 1.00 0.00 H new ATOM 219 N ARG A 64 -0.851 -4.644 0.174 1.00 0.00 N ATOM 220 CA ARG A 64 -0.391 -5.783 0.999 1.00 0.00 C ATOM 221 C ARG A 64 -0.287 -7.052 0.149 1.00 0.00 C ATOM 222 O ARG A 64 -0.789 -7.110 -0.974 1.00 0.00 O ATOM 223 CB ARG A 64 -1.240 -6.016 2.280 1.00 0.00 C ATOM 224 CG ARG A 64 -2.534 -5.187 2.397 1.00 0.00 C ATOM 225 CD ARG A 64 -3.269 -5.420 3.723 1.00 0.00 C ATOM 226 NE ARG A 64 -4.289 -4.376 3.947 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.542 -4.340 3.527 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.100 -5.339 2.912 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.273 -3.278 3.724 1.00 0.00 N ATOM 0 H ARG A 64 -1.741 -4.845 -0.281 1.00 0.00 H new ATOM 0 HA ARG A 64 0.602 -5.520 1.362 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.504 -7.072 2.329 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.616 -5.803 3.148 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.292 -4.128 2.302 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.198 -5.438 1.570 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.743 -6.402 3.714 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -2.554 -5.419 4.546 1.00 0.00 H new ATOM 0 HE ARG A 64 -3.986 -3.575 4.500 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.568 -6.192 2.737 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.070 -5.271 2.604 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -5.879 -2.469 4.204 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.239 -3.256 3.398 1.00 0.00 H new ATOM 243 N LYS A 65 0.351 -8.087 0.706 1.00 0.00 N ATOM 244 CA LYS A 65 0.632 -9.384 0.051 1.00 0.00 C ATOM 245 C LYS A 65 1.358 -9.234 -1.288 1.00 0.00 C ATOM 246 O LYS A 65 1.117 -9.964 -2.245 1.00 0.00 O ATOM 247 CB LYS A 65 -0.639 -10.256 -0.022 1.00 0.00 C ATOM 248 CG LYS A 65 -1.396 -10.327 1.304 1.00 0.00 C ATOM 249 CD LYS A 65 -0.556 -10.539 2.569 1.00 0.00 C ATOM 250 CE LYS A 65 -1.218 -11.440 3.604 1.00 0.00 C ATOM 251 NZ LYS A 65 -0.379 -11.478 4.827 1.00 0.00 N ATOM 0 H LYS A 65 0.702 -8.050 1.663 1.00 0.00 H new ATOM 0 HA LYS A 65 1.340 -9.922 0.681 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.302 -9.858 -0.791 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.363 -11.264 -0.330 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.961 -9.403 1.422 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.121 -11.138 1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.405 -10.970 2.288 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.350 -9.570 3.023 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.214 -11.068 3.844 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -1.342 -12.446 3.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.981 -11.659 5.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.328 -12.236 4.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.105 -10.565 4.944 1.00 0.00 H new ATOM 265 N LEU A 66 2.321 -8.321 -1.297 1.00 0.00 N ATOM 266 CA LEU A 66 3.438 -8.239 -2.247 1.00 0.00 C ATOM 267 C LEU A 66 4.353 -9.481 -2.088 1.00 0.00 C ATOM 268 O LEU A 66 4.156 -10.287 -1.172 1.00 0.00 O ATOM 269 CB LEU A 66 4.232 -6.952 -1.902 1.00 0.00 C ATOM 270 CG LEU A 66 4.277 -5.884 -2.990 1.00 0.00 C ATOM 271 CD1 LEU A 66 2.942 -5.182 -3.093 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.324 -4.848 -2.606 1.00 0.00 C ATOM 0 H LEU A 66 2.351 -7.573 -0.605 1.00 0.00 H new ATOM 0 HA LEU A 66 3.077 -8.210 -3.275 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.798 -6.511 -1.005 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.255 -7.235 -1.655 1.00 0.00 H new ATOM 0 HG LEU A 66 4.516 -6.356 -3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.989 -4.423 -3.874 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.167 -5.908 -3.340 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.705 -4.709 -2.140 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.370 -4.075 -3.374 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.055 -4.396 -1.651 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.298 -5.330 -2.518 1.00 0.00 H new ATOM 284 N PRO A 67 5.401 -9.623 -2.913 1.00 0.00 N ATOM 285 CA PRO A 67 6.667 -10.262 -2.545 1.00 0.00 C ATOM 286 C PRO A 67 7.402 -9.595 -1.363 1.00 0.00 C ATOM 287 O PRO A 67 6.939 -8.643 -0.737 1.00 0.00 O ATOM 288 CB PRO A 67 7.538 -10.194 -3.806 1.00 0.00 C ATOM 289 CG PRO A 67 6.513 -10.078 -4.928 1.00 0.00 C ATOM 290 CD PRO A 67 5.433 -9.196 -4.293 1.00 0.00 C ATOM 0 HA PRO A 67 6.467 -11.277 -2.203 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.211 -9.337 -3.785 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.158 -11.084 -3.916 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.938 -9.621 -5.822 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.121 -11.051 -5.223 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.681 -8.138 -4.378 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.467 -9.337 -4.777 1.00 0.00 H new ATOM 298 N ILE A 68 8.595 -10.100 -1.077 1.00 0.00 N ATOM 299 CA ILE A 68 9.473 -9.678 0.030 1.00 0.00 C ATOM 300 C ILE A 68 10.290 -8.416 -0.284 1.00 0.00 C ATOM 301 O ILE A 68 10.614 -7.629 0.605 1.00 0.00 O ATOM 302 CB ILE A 68 10.418 -10.843 0.404 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.309 -11.301 -0.782 1.00 0.00 C ATOM 304 CG2 ILE A 68 9.545 -11.999 0.905 1.00 0.00 C ATOM 305 CD1 ILE A 68 12.264 -12.453 -0.449 1.00 0.00 C ATOM 0 H ILE A 68 9.005 -10.852 -1.631 1.00 0.00 H new ATOM 0 HA ILE A 68 8.828 -9.421 0.870 1.00 0.00 H new ATOM 0 HB ILE A 68 11.109 -10.506 1.177 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.666 -11.606 -1.607 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.894 -10.450 -1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 68 10.180 -12.842 1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.976 -11.674 1.776 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.857 -12.304 0.116 1.00 0.00 H new ATOM 0 HD11 ILE A 68 12.848 -12.709 -1.333 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.936 -12.148 0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.689 -13.322 -0.130 1.00 0.00 H new ATOM 317 N ASP A 69 10.643 -8.251 -1.557 1.00 0.00 N ATOM 318 CA ASP A 69 11.617 -7.277 -2.078 1.00 0.00 C ATOM 319 C ASP A 69 11.342 -6.972 -3.567 1.00 0.00 C ATOM 320 O ASP A 69 12.260 -6.854 -4.383 1.00 0.00 O ATOM 321 CB ASP A 69 13.039 -7.827 -1.835 1.00 0.00 C ATOM 322 CG ASP A 69 14.155 -6.811 -2.134 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.029 -5.630 -1.734 1.00 0.00 O ATOM 324 OD2 ASP A 69 15.202 -7.209 -2.697 1.00 0.00 O ATOM 0 H ASP A 69 10.238 -8.822 -2.299 1.00 0.00 H new ATOM 0 HA ASP A 69 11.522 -6.326 -1.553 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.122 -8.149 -0.797 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.188 -8.710 -2.456 1.00 0.00 H new ATOM 329 N VAL A 70 10.055 -6.909 -3.942 1.00 0.00 N ATOM 330 CA VAL A 70 9.612 -6.586 -5.314 1.00 0.00 C ATOM 331 C VAL A 70 10.249 -5.294 -5.854 1.00 0.00 C ATOM 332 O VAL A 70 10.639 -4.406 -5.090 1.00 0.00 O ATOM 333 CB VAL A 70 8.068 -6.524 -5.406 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.500 -5.126 -5.180 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.576 -6.993 -6.775 1.00 0.00 C ATOM 0 H VAL A 70 9.283 -7.082 -3.298 1.00 0.00 H new ATOM 0 HA VAL A 70 9.961 -7.399 -5.951 1.00 0.00 H new ATOM 0 HB VAL A 70 7.718 -7.182 -4.611 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.413 -5.158 -5.259 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.782 -4.775 -4.187 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.899 -4.445 -5.932 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.488 -6.938 -6.809 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.996 -6.353 -7.551 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.893 -8.022 -6.942 1.00 0.00 H new ATOM 345 N THR A 71 10.319 -5.160 -7.177 1.00 0.00 N ATOM 346 CA THR A 71 10.974 -4.016 -7.828 1.00 0.00 C ATOM 347 C THR A 71 10.021 -2.845 -8.028 1.00 0.00 C ATOM 348 O THR A 71 8.834 -3.001 -8.340 1.00 0.00 O ATOM 349 CB THR A 71 11.674 -4.393 -9.153 1.00 0.00 C ATOM 350 OG1 THR A 71 10.837 -4.244 -10.276 1.00 0.00 O ATOM 351 CG2 THR A 71 12.174 -5.838 -9.181 1.00 0.00 C ATOM 0 H THR A 71 9.926 -5.837 -7.831 1.00 0.00 H new ATOM 0 HA THR A 71 11.755 -3.696 -7.138 1.00 0.00 H new ATOM 0 HB THR A 71 12.513 -3.699 -9.202 1.00 0.00 H new ATOM 0 HG1 THR A 71 11.329 -4.494 -11.086 1.00 0.00 H new ATOM 0 HG21 THR A 71 12.655 -6.038 -10.138 1.00 0.00 H new ATOM 0 HG22 THR A 71 12.892 -5.990 -8.375 1.00 0.00 H new ATOM 0 HG23 THR A 71 11.332 -6.517 -9.050 1.00 0.00 H new ATOM 359 N GLU A 72 10.562 -1.633 -7.889 1.00 0.00 N ATOM 360 CA GLU A 72 9.830 -0.418 -8.227 1.00 0.00 C ATOM 361 C GLU A 72 9.379 -0.434 -9.693 1.00 0.00 C ATOM 362 O GLU A 72 8.238 -0.095 -9.996 1.00 0.00 O ATOM 363 CB GLU A 72 10.682 0.816 -7.882 1.00 0.00 C ATOM 364 CG GLU A 72 10.237 2.096 -8.601 1.00 0.00 C ATOM 365 CD GLU A 72 11.097 3.342 -8.269 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.101 3.243 -7.521 1.00 0.00 O ATOM 367 OE2 GLU A 72 10.787 4.438 -8.796 1.00 0.00 O ATOM 0 H GLU A 72 11.508 -1.470 -7.543 1.00 0.00 H new ATOM 0 HA GLU A 72 8.920 -0.368 -7.630 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.644 0.983 -6.806 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.722 0.611 -8.136 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.267 1.924 -9.677 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.199 2.304 -8.340 1.00 0.00 H new ATOM 374 N GLY A 73 10.265 -0.870 -10.593 1.00 0.00 N ATOM 375 CA GLY A 73 10.008 -0.998 -12.027 1.00 0.00 C ATOM 376 C GLY A 73 8.762 -1.833 -12.338 1.00 0.00 C ATOM 377 O GLY A 73 7.976 -1.464 -13.206 1.00 0.00 O ATOM 0 H GLY A 73 11.210 -1.152 -10.334 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.891 -0.005 -12.460 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.874 -1.454 -12.507 1.00 0.00 H new ATOM 381 N GLU A 74 8.537 -2.919 -11.601 1.00 0.00 N ATOM 382 CA GLU A 74 7.328 -3.748 -11.682 1.00 0.00 C ATOM 383 C GLU A 74 6.093 -3.015 -11.163 1.00 0.00 C ATOM 384 O GLU A 74 5.076 -2.962 -11.854 1.00 0.00 O ATOM 385 CB GLU A 74 7.564 -5.067 -10.933 1.00 0.00 C ATOM 386 CG GLU A 74 8.431 -6.003 -11.784 1.00 0.00 C ATOM 387 CD GLU A 74 7.596 -6.789 -12.815 1.00 0.00 C ATOM 388 OE1 GLU A 74 7.125 -7.907 -12.492 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.420 -6.304 -13.960 1.00 0.00 O ATOM 0 H GLU A 74 9.207 -3.259 -10.911 1.00 0.00 H new ATOM 0 HA GLU A 74 7.128 -3.968 -12.731 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.054 -4.871 -9.979 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.610 -5.544 -10.710 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.192 -5.420 -12.303 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.955 -6.703 -11.133 1.00 0.00 H new ATOM 396 N VAL A 75 6.174 -2.411 -9.977 1.00 0.00 N ATOM 397 CA VAL A 75 5.043 -1.683 -9.367 1.00 0.00 C ATOM 398 C VAL A 75 4.592 -0.493 -10.229 1.00 0.00 C ATOM 399 O VAL A 75 3.395 -0.320 -10.479 1.00 0.00 O ATOM 400 CB VAL A 75 5.392 -1.269 -7.926 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.270 -0.477 -7.242 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.656 -2.532 -7.095 1.00 0.00 C ATOM 0 H VAL A 75 7.020 -2.408 -9.407 1.00 0.00 H new ATOM 0 HA VAL A 75 4.187 -2.357 -9.321 1.00 0.00 H new ATOM 0 HB VAL A 75 6.270 -0.626 -7.983 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.576 -0.214 -6.229 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.069 0.432 -7.808 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.367 -1.086 -7.202 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.904 -2.249 -6.072 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.764 -3.159 -7.092 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.487 -3.087 -7.530 1.00 0.00 H new ATOM 412 N ILE A 76 5.519 0.316 -10.749 1.00 0.00 N ATOM 413 CA ILE A 76 5.188 1.433 -11.636 1.00 0.00 C ATOM 414 C ILE A 76 4.807 0.970 -13.042 1.00 0.00 C ATOM 415 O ILE A 76 3.955 1.606 -13.657 1.00 0.00 O ATOM 416 CB ILE A 76 6.295 2.498 -11.673 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.580 2.101 -12.430 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.629 2.913 -10.242 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.522 2.517 -13.904 1.00 0.00 C ATOM 0 H ILE A 76 6.518 0.215 -10.567 1.00 0.00 H new ATOM 0 HA ILE A 76 4.304 1.905 -11.207 1.00 0.00 H new ATOM 0 HB ILE A 76 5.890 3.329 -12.250 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.442 2.568 -11.954 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.724 1.023 -12.362 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.414 3.669 -10.256 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.739 3.323 -9.765 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.973 2.043 -9.682 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.445 2.220 -14.402 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.675 2.029 -14.387 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.405 3.598 -13.972 1.00 0.00 H new ATOM 431 N SER A 77 5.341 -0.154 -13.542 1.00 0.00 N ATOM 432 CA SER A 77 4.843 -0.751 -14.796 1.00 0.00 C ATOM 433 C SER A 77 3.379 -1.159 -14.649 1.00 0.00 C ATOM 434 O SER A 77 2.587 -1.043 -15.590 1.00 0.00 O ATOM 435 CB SER A 77 5.694 -1.954 -15.214 1.00 0.00 C ATOM 436 OG SER A 77 5.265 -2.494 -16.455 1.00 0.00 O ATOM 0 H SER A 77 6.108 -0.665 -13.106 1.00 0.00 H new ATOM 0 HA SER A 77 4.919 0.003 -15.579 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.739 -1.652 -15.290 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.640 -2.723 -14.444 1.00 0.00 H new ATOM 0 HG SER A 77 5.830 -3.259 -16.692 1.00 0.00 H new ATOM 442 N LEU A 78 3.000 -1.547 -13.431 1.00 0.00 N ATOM 443 CA LEU A 78 1.633 -1.882 -13.089 1.00 0.00 C ATOM 444 C LEU A 78 0.727 -0.659 -12.866 1.00 0.00 C ATOM 445 O LEU A 78 -0.487 -0.778 -13.029 1.00 0.00 O ATOM 446 CB LEU A 78 1.662 -2.826 -11.874 1.00 0.00 C ATOM 447 CG LEU A 78 1.750 -4.298 -12.301 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.212 -5.156 -11.127 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.389 -4.796 -12.794 1.00 0.00 C ATOM 0 H LEU A 78 3.649 -1.636 -12.649 1.00 0.00 H new ATOM 0 HA LEU A 78 1.177 -2.386 -13.941 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.515 -2.579 -11.241 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.765 -2.674 -11.274 1.00 0.00 H new ATOM 0 HG LEU A 78 2.471 -4.378 -13.114 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.271 -6.199 -11.439 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.194 -4.820 -10.795 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.501 -5.063 -10.306 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.470 -5.841 -13.092 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.344 -4.703 -11.993 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.071 -4.198 -13.648 1.00 0.00 H new ATOM 461 N GLY A 79 1.286 0.519 -12.560 1.00 0.00 N ATOM 462 CA GLY A 79 0.517 1.757 -12.415 1.00 0.00 C ATOM 463 C GLY A 79 0.524 2.675 -13.639 1.00 0.00 C ATOM 464 O GLY A 79 -0.299 3.580 -13.721 1.00 0.00 O ATOM 0 H GLY A 79 2.287 0.638 -12.406 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.516 1.499 -12.180 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.909 2.312 -11.562 1.00 0.00 H new ATOM 468 N LEU A 80 1.440 2.491 -14.593 1.00 0.00 N ATOM 469 CA LEU A 80 1.689 3.452 -15.663 1.00 0.00 C ATOM 470 C LEU A 80 0.490 3.820 -16.561 1.00 0.00 C ATOM 471 O LEU A 80 0.203 5.015 -16.670 1.00 0.00 O ATOM 472 CB LEU A 80 2.923 3.025 -16.484 1.00 0.00 C ATOM 473 CG LEU A 80 4.155 3.885 -16.160 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.377 3.369 -16.918 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.911 5.339 -16.571 1.00 0.00 C ATOM 0 H LEU A 80 2.033 1.663 -14.642 1.00 0.00 H new ATOM 0 HA LEU A 80 1.888 4.392 -15.148 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.148 1.978 -16.282 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.696 3.103 -17.547 1.00 0.00 H new ATOM 0 HG LEU A 80 4.332 3.827 -15.086 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.242 3.988 -16.679 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.577 2.338 -16.627 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.185 3.413 -17.990 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.792 5.936 -16.336 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.716 5.386 -17.642 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.051 5.731 -16.028 1.00 0.00 H new ATOM 487 N PRO A 81 -0.226 2.869 -17.199 1.00 0.00 N ATOM 488 CA PRO A 81 -1.318 3.156 -18.145 1.00 0.00 C ATOM 489 C PRO A 81 -2.645 3.556 -17.471 1.00 0.00 C ATOM 490 O PRO A 81 -3.733 3.158 -17.896 1.00 0.00 O ATOM 491 CB PRO A 81 -1.393 1.899 -19.023 1.00 0.00 C ATOM 492 CG PRO A 81 -1.037 0.782 -18.048 1.00 0.00 C ATOM 493 CD PRO A 81 0.014 1.430 -17.146 1.00 0.00 C ATOM 0 HA PRO A 81 -1.119 4.045 -18.743 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.387 1.762 -19.449 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -0.693 1.946 -19.857 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.906 0.451 -17.480 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.641 -0.093 -18.564 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.070 1.060 -16.124 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.021 1.191 -17.490 1.00 0.00 H new ATOM 501 N PHE A 82 -2.547 4.391 -16.433 1.00 0.00 N ATOM 502 CA PHE A 82 -3.661 4.918 -15.650 1.00 0.00 C ATOM 503 C PHE A 82 -3.608 6.442 -15.503 1.00 0.00 C ATOM 504 O PHE A 82 -4.626 7.116 -15.668 1.00 0.00 O ATOM 505 CB PHE A 82 -3.720 4.228 -14.278 1.00 0.00 C ATOM 506 CG PHE A 82 -3.934 2.737 -14.385 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.885 1.861 -14.727 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.229 2.237 -14.212 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.151 0.496 -14.935 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.509 0.893 -14.481 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.470 0.024 -14.850 1.00 0.00 C ATOM 0 H PHE A 82 -1.644 4.732 -16.102 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.578 4.695 -16.196 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.792 4.420 -13.739 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.527 4.666 -13.690 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.878 2.237 -14.829 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.016 2.892 -13.869 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.344 -0.186 -15.159 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.522 0.525 -14.405 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.686 -1.011 -15.069 1.00 0.00 H new ATOM 521 N GLY A 83 -2.415 6.987 -15.248 1.00 0.00 N ATOM 522 CA GLY A 83 -2.124 8.418 -15.329 1.00 0.00 C ATOM 523 C GLY A 83 -0.640 8.651 -15.570 1.00 0.00 C ATOM 524 O GLY A 83 -0.166 8.524 -16.700 1.00 0.00 O ATOM 0 H GLY A 83 -1.606 6.430 -14.973 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.704 8.867 -16.135 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.429 8.909 -14.405 1.00 0.00 H new ATOM 528 N LYS A 84 0.096 8.965 -14.497 1.00 0.00 N ATOM 529 CA LYS A 84 1.536 9.238 -14.530 1.00 0.00 C ATOM 530 C LYS A 84 2.374 8.591 -13.414 1.00 0.00 C ATOM 531 O LYS A 84 3.594 8.565 -13.533 1.00 0.00 O ATOM 532 CB LYS A 84 1.700 10.770 -14.585 1.00 0.00 C ATOM 533 CG LYS A 84 3.075 11.265 -15.050 1.00 0.00 C ATOM 534 CD LYS A 84 3.556 10.637 -16.368 1.00 0.00 C ATOM 535 CE LYS A 84 4.825 11.343 -16.857 1.00 0.00 C ATOM 536 NZ LYS A 84 5.334 10.748 -18.122 1.00 0.00 N ATOM 0 H LYS A 84 -0.303 9.038 -13.561 1.00 0.00 H new ATOM 0 HA LYS A 84 1.948 8.756 -15.417 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.941 11.177 -15.253 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.502 11.176 -13.593 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.038 12.348 -15.168 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.808 11.054 -14.271 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.755 9.575 -16.222 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.774 10.714 -17.123 1.00 0.00 H new ATOM 0 HE2 LYS A 84 4.616 12.402 -17.011 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.596 11.279 -16.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 6.193 11.252 -18.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 5.557 9.744 -17.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.608 10.832 -18.862 1.00 0.00 H new ATOM 550 N VAL A 85 1.729 8.060 -12.365 1.00 0.00 N ATOM 551 CA VAL A 85 2.299 7.490 -11.117 1.00 0.00 C ATOM 552 C VAL A 85 3.631 8.149 -10.699 1.00 0.00 C ATOM 553 O VAL A 85 4.732 7.691 -11.010 1.00 0.00 O ATOM 554 CB VAL A 85 2.350 5.953 -11.082 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.941 5.217 -9.794 1.00 0.00 C ATOM 556 CG2 VAL A 85 2.259 5.271 -12.447 1.00 0.00 C ATOM 0 H VAL A 85 0.710 8.010 -12.359 1.00 0.00 H new ATOM 0 HA VAL A 85 1.576 7.756 -10.346 1.00 0.00 H new ATOM 0 HB VAL A 85 3.393 5.735 -10.853 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.036 4.142 -9.944 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.590 5.528 -8.975 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.907 5.459 -9.549 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.304 4.190 -12.317 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.318 5.540 -12.926 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.091 5.596 -13.072 1.00 0.00 H new ATOM 566 N THR A 86 3.518 9.292 -10.024 1.00 0.00 N ATOM 567 CA THR A 86 4.647 10.175 -9.706 1.00 0.00 C ATOM 568 C THR A 86 5.612 9.553 -8.689 1.00 0.00 C ATOM 569 O THR A 86 6.819 9.785 -8.793 1.00 0.00 O ATOM 570 CB THR A 86 4.152 11.570 -9.289 1.00 0.00 C ATOM 571 OG1 THR A 86 5.216 12.489 -9.210 1.00 0.00 O ATOM 572 CG2 THR A 86 3.427 11.588 -7.947 1.00 0.00 C ATOM 0 H THR A 86 2.625 9.639 -9.675 1.00 0.00 H new ATOM 0 HA THR A 86 5.233 10.302 -10.616 1.00 0.00 H new ATOM 0 HB THR A 86 3.446 11.855 -10.069 1.00 0.00 H new ATOM 0 HG1 THR A 86 4.871 13.367 -8.944 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.107 12.605 -7.720 1.00 0.00 H new ATOM 0 HG22 THR A 86 2.555 10.936 -7.996 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.100 11.236 -7.165 1.00 0.00 H new ATOM 580 N ASN A 87 5.123 8.709 -7.765 1.00 0.00 N ATOM 581 CA ASN A 87 5.958 7.979 -6.809 1.00 0.00 C ATOM 582 C ASN A 87 5.413 6.591 -6.409 1.00 0.00 C ATOM 583 O ASN A 87 4.297 6.189 -6.724 1.00 0.00 O ATOM 584 CB ASN A 87 6.169 8.856 -5.544 1.00 0.00 C ATOM 585 CG ASN A 87 7.064 10.069 -5.751 1.00 0.00 C ATOM 586 OD1 ASN A 87 6.616 11.205 -5.797 1.00 0.00 O ATOM 587 ND2 ASN A 87 8.361 9.873 -5.825 1.00 0.00 N ATOM 0 H ASN A 87 4.127 8.516 -7.664 1.00 0.00 H new ATOM 0 HA ASN A 87 6.904 7.782 -7.314 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.196 9.196 -5.188 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.597 8.236 -4.756 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.992 10.668 -5.921 1.00 0.00 H new ATOM 0 HD22 ASN A 87 8.737 8.925 -5.787 1.00 0.00 H new ATOM 594 N LEU A 88 6.223 5.870 -5.639 1.00 0.00 N ATOM 595 CA LEU A 88 5.854 4.773 -4.749 1.00 0.00 C ATOM 596 C LEU A 88 6.703 4.785 -3.459 1.00 0.00 C ATOM 597 O LEU A 88 7.650 5.561 -3.330 1.00 0.00 O ATOM 598 CB LEU A 88 5.962 3.460 -5.543 1.00 0.00 C ATOM 599 CG LEU A 88 7.362 2.824 -5.546 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.273 1.567 -6.377 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.488 3.679 -6.123 1.00 0.00 C ATOM 0 H LEU A 88 7.227 6.050 -5.619 1.00 0.00 H new ATOM 0 HA LEU A 88 4.825 4.884 -4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.253 2.742 -5.130 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.661 3.649 -6.574 1.00 0.00 H new ATOM 0 HG LEU A 88 7.624 2.665 -4.500 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.248 1.081 -6.407 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.543 0.889 -5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.964 1.822 -7.391 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.427 3.127 -6.072 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.265 3.921 -7.162 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.577 4.600 -5.547 1.00 0.00 H new ATOM 613 N LEU A 89 6.379 3.895 -2.523 1.00 0.00 N ATOM 614 CA LEU A 89 7.152 3.558 -1.317 1.00 0.00 C ATOM 615 C LEU A 89 7.010 2.053 -1.064 1.00 0.00 C ATOM 616 O LEU A 89 6.007 1.452 -1.447 1.00 0.00 O ATOM 617 CB LEU A 89 6.680 4.464 -0.163 1.00 0.00 C ATOM 618 CG LEU A 89 6.561 3.932 1.270 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.618 2.776 1.490 1.00 0.00 C ATOM 620 CD2 LEU A 89 7.889 3.761 2.009 1.00 0.00 C ATOM 0 H LEU A 89 5.517 3.353 -2.585 1.00 0.00 H new ATOM 0 HA LEU A 89 8.220 3.749 -1.426 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.359 5.316 -0.130 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.699 4.848 -0.442 1.00 0.00 H new ATOM 0 HG LEU A 89 6.056 4.769 1.751 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.626 2.496 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.609 3.069 1.200 1.00 0.00 H new ATOM 0 HD13 LEU A 89 5.937 1.926 0.886 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.700 3.381 3.013 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.519 3.056 1.466 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.395 4.724 2.075 1.00 0.00 H new ATOM 632 N MET A 90 7.988 1.441 -0.395 1.00 0.00 N ATOM 633 CA MET A 90 8.042 -0.004 -0.130 1.00 0.00 C ATOM 634 C MET A 90 8.306 -0.271 1.361 1.00 0.00 C ATOM 635 O MET A 90 9.417 -0.048 1.844 1.00 0.00 O ATOM 636 CB MET A 90 9.087 -0.664 -1.052 1.00 0.00 C ATOM 637 CG MET A 90 8.959 -0.139 -2.490 1.00 0.00 C ATOM 638 SD MET A 90 9.753 -1.140 -3.766 1.00 0.00 S ATOM 639 CE MET A 90 8.225 -1.627 -4.596 1.00 0.00 C ATOM 0 H MET A 90 8.787 1.946 -0.011 1.00 0.00 H new ATOM 0 HA MET A 90 7.077 -0.457 -0.357 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.090 -0.462 -0.675 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.955 -1.746 -1.042 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.900 -0.050 -2.731 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.380 0.866 -2.529 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.465 -2.164 -5.513 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.644 -2.273 -3.938 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.643 -0.738 -4.838 1.00 0.00 H new ATOM 649 N LEU A 91 7.285 -0.717 2.106 1.00 0.00 N ATOM 650 CA LEU A 91 7.413 -1.140 3.508 1.00 0.00 C ATOM 651 C LEU A 91 8.110 -2.515 3.597 1.00 0.00 C ATOM 652 O LEU A 91 7.478 -3.550 3.840 1.00 0.00 O ATOM 653 CB LEU A 91 6.041 -1.183 4.218 1.00 0.00 C ATOM 654 CG LEU A 91 5.178 0.082 4.403 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.998 1.329 4.682 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.206 0.327 3.259 1.00 0.00 C ATOM 0 H LEU A 91 6.334 -0.795 1.747 1.00 0.00 H new ATOM 0 HA LEU A 91 8.027 -0.400 4.021 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.429 -1.905 3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.214 -1.594 5.213 1.00 0.00 H new ATOM 0 HG LEU A 91 4.583 -0.128 5.292 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.332 2.183 4.802 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.575 1.188 5.596 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.676 1.512 3.849 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.632 1.233 3.456 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.761 0.445 2.329 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.527 -0.521 3.171 1.00 0.00 H new ATOM 668 N LYS A 92 9.435 -2.514 3.409 1.00 0.00 N ATOM 669 CA LYS A 92 10.310 -3.681 3.577 1.00 0.00 C ATOM 670 C LYS A 92 10.314 -4.136 5.043 1.00 0.00 C ATOM 671 O LYS A 92 10.967 -3.538 5.899 1.00 0.00 O ATOM 672 CB LYS A 92 11.723 -3.387 3.040 1.00 0.00 C ATOM 673 CG LYS A 92 11.708 -3.336 1.501 1.00 0.00 C ATOM 674 CD LYS A 92 13.091 -3.102 0.881 1.00 0.00 C ATOM 675 CE LYS A 92 14.091 -4.199 1.275 1.00 0.00 C ATOM 676 NZ LYS A 92 15.236 -4.248 0.334 1.00 0.00 N ATOM 0 H LYS A 92 9.944 -1.676 3.127 1.00 0.00 H new ATOM 0 HA LYS A 92 9.920 -4.510 2.986 1.00 0.00 H new ATOM 0 HB2 LYS A 92 12.081 -2.438 3.439 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.416 -4.157 3.379 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.301 -4.272 1.119 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.035 -2.541 1.179 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.000 -3.067 -0.205 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.472 -2.132 1.201 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.456 -4.015 2.286 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.587 -5.165 1.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 15.986 -4.849 0.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.921 -4.643 -0.575 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.604 -3.287 0.185 1.00 0.00 H new ATOM 690 N GLY A 93 9.510 -5.160 5.325 1.00 0.00 N ATOM 691 CA GLY A 93 9.117 -5.601 6.668 1.00 0.00 C ATOM 692 C GLY A 93 7.977 -6.624 6.644 1.00 0.00 C ATOM 693 O GLY A 93 8.090 -7.694 7.245 1.00 0.00 O ATOM 0 H GLY A 93 9.094 -5.733 4.591 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.981 -6.037 7.170 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.811 -4.735 7.255 1.00 0.00 H new ATOM 697 N LYS A 94 6.874 -6.284 5.960 1.00 0.00 N ATOM 698 CA LYS A 94 5.572 -6.983 6.042 1.00 0.00 C ATOM 699 C LYS A 94 4.922 -7.289 4.678 1.00 0.00 C ATOM 700 O LYS A 94 3.742 -7.639 4.631 1.00 0.00 O ATOM 701 CB LYS A 94 4.630 -6.156 6.940 1.00 0.00 C ATOM 702 CG LYS A 94 5.063 -6.115 8.417 1.00 0.00 C ATOM 703 CD LYS A 94 4.372 -4.986 9.193 1.00 0.00 C ATOM 704 CE LYS A 94 5.013 -3.639 8.836 1.00 0.00 C ATOM 705 NZ LYS A 94 4.397 -2.529 9.607 1.00 0.00 N ATOM 0 H LYS A 94 6.857 -5.494 5.315 1.00 0.00 H new ATOM 0 HA LYS A 94 5.757 -7.966 6.476 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.579 -5.137 6.557 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.624 -6.571 6.877 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.833 -7.071 8.888 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.144 -5.984 8.473 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.309 -4.967 8.955 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.455 -5.166 10.265 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.083 -3.677 9.040 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.899 -3.451 7.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 4.851 -1.631 9.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.381 -2.479 9.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 4.528 -2.699 10.625 1.00 0.00 H new ATOM 719 N ASN A 95 5.666 -7.149 3.576 1.00 0.00 N ATOM 720 CA ASN A 95 5.184 -7.245 2.188 1.00 0.00 C ATOM 721 C ASN A 95 4.099 -6.200 1.877 1.00 0.00 C ATOM 722 O ASN A 95 3.005 -6.532 1.408 1.00 0.00 O ATOM 723 CB ASN A 95 4.696 -8.669 1.855 1.00 0.00 C ATOM 724 CG ASN A 95 5.732 -9.778 1.950 1.00 0.00 C ATOM 725 OD1 ASN A 95 6.661 -9.776 2.747 1.00 0.00 O ATOM 726 ND2 ASN A 95 5.567 -10.805 1.150 1.00 0.00 N ATOM 0 H ASN A 95 6.666 -6.957 3.626 1.00 0.00 H new ATOM 0 HA ASN A 95 6.036 -7.025 1.545 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.872 -8.913 2.525 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.293 -8.664 0.842 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.211 -11.595 1.195 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.795 -10.813 0.483 1.00 0.00 H new ATOM 733 N GLN A 96 4.407 -4.929 2.147 1.00 0.00 N ATOM 734 CA GLN A 96 3.510 -3.804 1.937 1.00 0.00 C ATOM 735 C GLN A 96 4.197 -2.657 1.156 1.00 0.00 C ATOM 736 O GLN A 96 5.422 -2.629 1.030 1.00 0.00 O ATOM 737 CB GLN A 96 2.993 -3.344 3.297 1.00 0.00 C ATOM 738 CG GLN A 96 2.133 -4.372 4.040 1.00 0.00 C ATOM 739 CD GLN A 96 1.905 -3.917 5.472 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.927 -4.678 6.426 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.679 -2.649 5.675 1.00 0.00 N ATOM 0 H GLN A 96 5.312 -4.653 2.527 1.00 0.00 H new ATOM 0 HA GLN A 96 2.669 -4.117 1.318 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.845 -3.083 3.924 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.409 -2.434 3.159 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.177 -4.495 3.532 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.625 -5.345 4.032 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.658 -2.002 4.887 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.523 -2.304 6.622 1.00 0.00 H new ATOM 750 N ALA A 97 3.425 -1.694 0.647 1.00 0.00 N ATOM 751 CA ALA A 97 3.872 -0.552 -0.171 1.00 0.00 C ATOM 752 C ALA A 97 2.770 0.502 -0.272 1.00 0.00 C ATOM 753 O ALA A 97 1.619 0.260 0.087 1.00 0.00 O ATOM 754 CB ALA A 97 4.181 -1.110 -1.579 1.00 0.00 C ATOM 0 H ALA A 97 2.417 -1.685 0.800 1.00 0.00 H new ATOM 0 HA ALA A 97 4.746 -0.079 0.277 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.517 -0.300 -2.226 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.963 -1.866 -1.507 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.280 -1.559 -1.998 1.00 0.00 H new ATOM 760 N PHE A 98 3.135 1.660 -0.809 1.00 0.00 N ATOM 761 CA PHE A 98 2.269 2.740 -1.287 1.00 0.00 C ATOM 762 C PHE A 98 2.570 2.872 -2.793 1.00 0.00 C ATOM 763 O PHE A 98 3.740 2.840 -3.177 1.00 0.00 O ATOM 764 CB PHE A 98 2.691 4.074 -0.640 1.00 0.00 C ATOM 765 CG PHE A 98 2.324 4.385 0.806 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.055 3.369 1.743 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.261 5.728 1.239 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.711 3.693 3.057 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.884 6.060 2.535 1.00 0.00 C ATOM 770 CZ PHE A 98 1.600 5.035 3.428 1.00 0.00 C ATOM 0 H PHE A 98 4.121 1.890 -0.933 1.00 0.00 H new ATOM 0 HA PHE A 98 1.224 2.530 -1.059 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.776 4.139 -0.717 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.279 4.874 -1.255 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.115 2.333 1.444 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.512 6.517 0.545 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.532 2.912 3.781 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.813 7.093 2.841 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.286 5.281 4.432 1.00 0.00 H new ATOM 780 N ILE A 99 1.575 3.111 -3.636 1.00 0.00 N ATOM 781 CA ILE A 99 1.729 3.525 -5.034 1.00 0.00 C ATOM 782 C ILE A 99 0.989 4.861 -5.203 1.00 0.00 C ATOM 783 O ILE A 99 -0.219 4.958 -4.978 1.00 0.00 O ATOM 784 CB ILE A 99 1.349 2.372 -5.995 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.590 2.808 -7.453 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.075 1.832 -5.791 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.359 1.699 -8.491 1.00 0.00 C ATOM 0 H ILE A 99 0.598 3.020 -3.359 1.00 0.00 H new ATOM 0 HA ILE A 99 2.765 3.721 -5.311 1.00 0.00 H new ATOM 0 HB ILE A 99 2.001 1.532 -5.755 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.933 3.647 -7.682 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.614 3.170 -7.547 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.264 1.027 -6.502 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.177 1.451 -4.775 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.795 2.635 -5.951 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.550 2.090 -9.490 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.035 0.867 -8.291 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.328 1.352 -8.429 1.00 0.00 H new ATOM 799 N GLU A 100 1.753 5.920 -5.461 1.00 0.00 N ATOM 800 CA GLU A 100 1.365 7.334 -5.392 1.00 0.00 C ATOM 801 C GLU A 100 1.291 7.930 -6.788 1.00 0.00 C ATOM 802 O GLU A 100 2.283 8.017 -7.515 1.00 0.00 O ATOM 803 CB GLU A 100 2.374 8.099 -4.531 1.00 0.00 C ATOM 804 CG GLU A 100 2.434 9.633 -4.728 1.00 0.00 C ATOM 805 CD GLU A 100 1.112 10.359 -4.453 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.459 10.056 -3.427 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.747 11.249 -5.262 1.00 0.00 O ATOM 0 H GLU A 100 2.727 5.809 -5.743 1.00 0.00 H new ATOM 0 HA GLU A 100 0.378 7.415 -4.937 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.148 7.899 -3.484 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.366 7.692 -4.727 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.202 10.042 -4.072 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.744 9.844 -5.751 1.00 0.00 H new ATOM 814 N MET A 101 0.097 8.355 -7.168 1.00 0.00 N ATOM 815 CA MET A 101 -0.169 8.725 -8.539 1.00 0.00 C ATOM 816 C MET A 101 -0.645 10.152 -8.713 1.00 0.00 C ATOM 817 O MET A 101 -1.288 10.737 -7.853 1.00 0.00 O ATOM 818 CB MET A 101 -0.971 7.589 -9.172 1.00 0.00 C ATOM 819 CG MET A 101 -1.999 7.941 -10.243 1.00 0.00 C ATOM 820 SD MET A 101 -1.378 7.717 -11.905 1.00 0.00 S ATOM 821 CE MET A 101 -1.124 5.930 -11.799 1.00 0.00 C ATOM 0 H MET A 101 -0.702 8.451 -6.541 1.00 0.00 H new ATOM 0 HA MET A 101 0.746 8.805 -9.125 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.263 6.885 -9.609 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.491 7.063 -8.372 1.00 0.00 H new ATOM 0 HG2 MET A 101 -2.886 7.322 -10.106 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.310 8.978 -10.114 1.00 0.00 H new ATOM 0 HE1 MET A 101 -1.026 5.516 -12.803 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.216 5.725 -11.231 1.00 0.00 H new ATOM 0 HE3 MET A 101 -1.977 5.470 -11.299 1.00 0.00 H new ATOM 831 N ASN A 102 -0.236 10.719 -9.852 1.00 0.00 N ATOM 832 CA ASN A 102 -0.205 12.163 -10.065 1.00 0.00 C ATOM 833 C ASN A 102 -1.581 12.849 -10.013 1.00 0.00 C ATOM 834 O ASN A 102 -1.639 14.070 -9.860 1.00 0.00 O ATOM 835 CB ASN A 102 0.499 12.403 -11.412 1.00 0.00 C ATOM 836 CG ASN A 102 -0.385 12.238 -12.634 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.074 11.125 -12.778 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.410 13.082 -13.517 1.00 0.00 N flip ATOM 0 H ASN A 102 0.085 10.181 -10.657 1.00 0.00 H new ATOM 0 HA ASN A 102 0.339 12.622 -9.239 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.913 13.411 -11.414 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.339 11.714 -11.494 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.121 13.946 -13.412 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.962 12.922 -14.360 1.00 0.00 H new ATOM 845 N THR A 103 -2.670 12.083 -10.155 1.00 0.00 N ATOM 846 CA THR A 103 -4.037 12.622 -10.200 1.00 0.00 C ATOM 847 C THR A 103 -5.000 11.740 -9.420 1.00 0.00 C ATOM 848 O THR A 103 -4.859 10.511 -9.358 1.00 0.00 O ATOM 849 CB THR A 103 -4.562 12.861 -11.636 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.055 11.687 -12.241 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.526 13.435 -12.608 1.00 0.00 C ATOM 0 H THR A 103 -2.629 11.068 -10.242 1.00 0.00 H new ATOM 0 HA THR A 103 -3.984 13.601 -9.725 1.00 0.00 H new ATOM 0 HB THR A 103 -5.355 13.591 -11.474 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.375 11.894 -13.144 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.982 13.569 -13.589 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.173 14.397 -12.237 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.684 12.747 -12.691 1.00 0.00 H new ATOM 859 N GLU A 104 -5.994 12.387 -8.813 1.00 0.00 N ATOM 860 CA GLU A 104 -7.038 11.719 -8.039 1.00 0.00 C ATOM 861 C GLU A 104 -7.812 10.718 -8.905 1.00 0.00 C ATOM 862 O GLU A 104 -8.087 9.612 -8.450 1.00 0.00 O ATOM 863 CB GLU A 104 -8.004 12.754 -7.438 1.00 0.00 C ATOM 864 CG GLU A 104 -7.342 13.627 -6.363 1.00 0.00 C ATOM 865 CD GLU A 104 -8.322 14.703 -5.850 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.122 14.419 -4.925 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.299 15.847 -6.368 1.00 0.00 O ATOM 0 H GLU A 104 -6.098 13.401 -8.846 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.557 11.170 -7.230 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.387 13.393 -8.234 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.860 12.237 -7.004 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.014 13.002 -5.532 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.453 14.105 -6.773 1.00 0.00 H new ATOM 874 N GLU A 105 -8.134 11.065 -10.158 1.00 0.00 N ATOM 875 CA GLU A 105 -8.911 10.192 -11.043 1.00 0.00 C ATOM 876 C GLU A 105 -8.112 9.041 -11.656 1.00 0.00 C ATOM 877 O GLU A 105 -8.664 7.949 -11.780 1.00 0.00 O ATOM 878 CB GLU A 105 -9.582 10.986 -12.171 1.00 0.00 C ATOM 879 CG GLU A 105 -10.727 11.888 -11.682 1.00 0.00 C ATOM 880 CD GLU A 105 -11.833 11.102 -10.947 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.405 10.146 -11.529 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.136 11.433 -9.776 1.00 0.00 O ATOM 0 H GLU A 105 -7.865 11.952 -10.583 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.664 9.750 -10.391 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.832 11.600 -12.669 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.969 10.290 -12.915 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.324 12.650 -11.015 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.163 12.409 -12.534 1.00 0.00 H new ATOM 889 N ALA A 106 -6.833 9.223 -11.997 1.00 0.00 N ATOM 890 CA ALA A 106 -5.968 8.107 -12.365 1.00 0.00 C ATOM 891 C ALA A 106 -5.902 7.095 -11.230 1.00 0.00 C ATOM 892 O ALA A 106 -6.156 5.922 -11.458 1.00 0.00 O ATOM 893 CB ALA A 106 -4.576 8.592 -12.719 1.00 0.00 C ATOM 0 H ALA A 106 -6.377 10.135 -12.025 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.393 7.624 -13.245 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.952 7.740 -12.989 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.634 9.281 -13.561 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.140 9.104 -11.861 1.00 0.00 H new ATOM 899 N ALA A 107 -5.606 7.514 -9.999 1.00 0.00 N ATOM 900 CA ALA A 107 -5.568 6.562 -8.898 1.00 0.00 C ATOM 901 C ALA A 107 -6.943 5.996 -8.513 1.00 0.00 C ATOM 902 O ALA A 107 -7.043 4.806 -8.233 1.00 0.00 O ATOM 903 CB ALA A 107 -4.897 7.230 -7.731 1.00 0.00 C ATOM 0 H ALA A 107 -5.395 8.480 -9.747 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.000 5.690 -9.222 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -4.855 6.538 -6.890 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -3.885 7.522 -8.011 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.464 8.116 -7.444 1.00 0.00 H new ATOM 909 N ASN A 108 -8.019 6.782 -8.565 1.00 0.00 N ATOM 910 CA ASN A 108 -9.377 6.264 -8.402 1.00 0.00 C ATOM 911 C ASN A 108 -9.690 5.184 -9.447 1.00 0.00 C ATOM 912 O ASN A 108 -10.132 4.096 -9.084 1.00 0.00 O ATOM 913 CB ASN A 108 -10.379 7.425 -8.434 1.00 0.00 C ATOM 914 CG ASN A 108 -11.808 6.958 -8.208 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.124 6.290 -7.234 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.723 7.292 -9.091 1.00 0.00 N ATOM 0 H ASN A 108 -7.974 7.789 -8.720 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.462 5.777 -7.431 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.112 8.154 -7.669 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.313 7.933 -9.396 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.690 6.994 -8.961 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.466 7.849 -9.906 1.00 0.00 H new ATOM 923 N THR A 109 -9.386 5.419 -10.724 1.00 0.00 N ATOM 924 CA THR A 109 -9.524 4.379 -11.743 1.00 0.00 C ATOM 925 C THR A 109 -8.558 3.226 -11.479 1.00 0.00 C ATOM 926 O THR A 109 -8.945 2.090 -11.713 1.00 0.00 O ATOM 927 CB THR A 109 -9.419 4.930 -13.178 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.439 4.361 -13.972 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.102 4.657 -13.907 1.00 0.00 C ATOM 0 H THR A 109 -9.045 6.314 -11.075 1.00 0.00 H new ATOM 0 HA THR A 109 -10.535 3.980 -11.664 1.00 0.00 H new ATOM 0 HB THR A 109 -9.500 6.010 -13.055 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.376 4.711 -14.885 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.143 5.090 -14.906 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.279 5.105 -13.351 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.945 3.581 -13.984 1.00 0.00 H new ATOM 937 N MET A 110 -7.351 3.470 -10.942 1.00 0.00 N ATOM 938 CA MET A 110 -6.341 2.454 -10.674 1.00 0.00 C ATOM 939 C MET A 110 -6.803 1.487 -9.571 1.00 0.00 C ATOM 940 O MET A 110 -6.761 0.269 -9.722 1.00 0.00 O ATOM 941 CB MET A 110 -4.969 3.095 -10.333 1.00 0.00 C ATOM 942 CG MET A 110 -3.857 2.147 -10.792 1.00 0.00 C ATOM 943 SD MET A 110 -2.185 2.814 -10.666 1.00 0.00 S ATOM 944 CE MET A 110 -2.183 3.231 -8.921 1.00 0.00 C ATOM 0 H MET A 110 -7.051 4.408 -10.678 1.00 0.00 H new ATOM 0 HA MET A 110 -6.208 1.871 -11.586 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.870 4.061 -10.828 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.893 3.276 -9.261 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.913 1.233 -10.201 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.043 1.868 -11.829 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.160 3.408 -8.590 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.777 4.131 -8.761 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.611 2.408 -8.350 1.00 0.00 H new ATOM 954 N VAL A 111 -7.305 2.030 -8.466 1.00 0.00 N ATOM 955 CA VAL A 111 -7.816 1.269 -7.323 1.00 0.00 C ATOM 956 C VAL A 111 -9.105 0.515 -7.664 1.00 0.00 C ATOM 957 O VAL A 111 -9.263 -0.634 -7.264 1.00 0.00 O ATOM 958 CB VAL A 111 -7.964 2.213 -6.115 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.322 2.863 -5.943 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.621 1.491 -4.813 1.00 0.00 C ATOM 0 H VAL A 111 -7.371 3.039 -8.334 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.100 0.491 -7.057 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.260 3.015 -6.337 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.309 3.505 -5.062 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.553 3.461 -6.824 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.082 2.091 -5.819 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.733 2.179 -3.975 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.293 0.643 -4.679 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.592 1.135 -4.855 1.00 0.00 H new ATOM 970 N ASN A 112 -9.999 1.119 -8.453 1.00 0.00 N ATOM 971 CA ASN A 112 -11.236 0.477 -8.913 1.00 0.00 C ATOM 972 C ASN A 112 -10.923 -0.634 -9.933 1.00 0.00 C ATOM 973 O ASN A 112 -11.406 -1.758 -9.800 1.00 0.00 O ATOM 974 CB ASN A 112 -12.195 1.539 -9.474 1.00 0.00 C ATOM 975 CG ASN A 112 -12.943 2.286 -8.375 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.140 2.116 -8.187 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.278 3.116 -7.604 1.00 0.00 N ATOM 0 H ASN A 112 -9.885 2.074 -8.793 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.734 -0.003 -8.071 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.631 2.252 -10.075 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.914 1.060 -10.138 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.760 3.613 -6.855 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.280 3.263 -7.754 1.00 0.00 H new ATOM 984 N TYR A 113 -10.014 -0.368 -10.870 1.00 0.00 N ATOM 985 CA TYR A 113 -9.380 -1.371 -11.728 1.00 0.00 C ATOM 986 C TYR A 113 -8.827 -2.558 -10.919 1.00 0.00 C ATOM 987 O TYR A 113 -9.006 -3.701 -11.318 1.00 0.00 O ATOM 988 CB TYR A 113 -8.292 -0.688 -12.576 1.00 0.00 C ATOM 989 CG TYR A 113 -7.311 -1.633 -13.215 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.651 -2.272 -14.418 1.00 0.00 C ATOM 991 CD2 TYR A 113 -6.052 -1.849 -12.619 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.773 -3.206 -14.997 1.00 0.00 C ATOM 993 CE2 TYR A 113 -5.193 -2.807 -13.179 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.539 -3.484 -14.368 1.00 0.00 C ATOM 995 OH TYR A 113 -4.680 -4.392 -14.905 1.00 0.00 O ATOM 0 H TYR A 113 -9.688 0.580 -11.060 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.132 -1.795 -12.394 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.774 -0.102 -13.358 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.744 0.012 -11.945 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.590 -2.046 -14.901 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.754 -1.287 -11.746 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -7.040 -3.707 -15.916 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -4.254 -3.029 -12.693 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.880 -4.458 -14.343 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.263 -2.344 -9.729 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.658 -3.393 -8.921 1.00 0.00 C ATOM 1007 C TYR A 114 -8.624 -4.047 -7.949 1.00 0.00 C ATOM 1008 O TYR A 114 -8.329 -5.141 -7.463 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.424 -2.860 -8.194 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.190 -2.780 -9.050 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.801 -3.915 -9.785 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.401 -1.613 -9.055 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.591 -3.900 -10.488 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.206 -1.581 -9.797 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.808 -2.730 -10.515 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.710 -2.700 -11.300 1.00 0.00 O ATOM 0 H TYR A 114 -8.215 -1.421 -9.297 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.357 -4.180 -9.612 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.647 -1.867 -7.804 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -6.217 -3.500 -7.336 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.432 -4.791 -9.806 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.712 -0.746 -8.491 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.258 -4.785 -11.009 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.600 -0.687 -9.817 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.629 -1.816 -11.716 1.00 0.00 H new ATOM 1026 N THR A 115 -9.802 -3.447 -7.740 1.00 0.00 N ATOM 1027 CA THR A 115 -10.888 -4.129 -7.032 1.00 0.00 C ATOM 1028 C THR A 115 -11.691 -5.025 -7.990 1.00 0.00 C ATOM 1029 O THR A 115 -12.387 -5.955 -7.578 1.00 0.00 O ATOM 1030 CB THR A 115 -11.729 -3.164 -6.171 1.00 0.00 C ATOM 1031 OG1 THR A 115 -12.212 -3.838 -5.025 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.954 -2.549 -6.845 1.00 0.00 C ATOM 0 H THR A 115 -10.025 -2.500 -8.048 1.00 0.00 H new ATOM 0 HA THR A 115 -10.452 -4.809 -6.300 1.00 0.00 H new ATOM 0 HB THR A 115 -11.035 -2.353 -5.952 1.00 0.00 H new ATOM 0 HG1 THR A 115 -12.744 -3.220 -4.482 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.464 -1.890 -6.142 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.640 -1.976 -7.717 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.634 -3.342 -7.157 1.00 0.00 H new ATOM 1040 N SER A 116 -11.503 -4.790 -9.295 1.00 0.00 N ATOM 1041 CA SER A 116 -11.893 -5.615 -10.433 1.00 0.00 C ATOM 1042 C SER A 116 -10.936 -6.798 -10.632 1.00 0.00 C ATOM 1043 O SER A 116 -11.353 -7.957 -10.640 1.00 0.00 O ATOM 1044 CB SER A 116 -11.851 -4.725 -11.693 1.00 0.00 C ATOM 1045 OG SER A 116 -13.115 -4.666 -12.334 1.00 0.00 O ATOM 0 H SER A 116 -11.031 -3.940 -9.603 1.00 0.00 H new ATOM 0 HA SER A 116 -12.890 -6.018 -10.253 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.535 -3.719 -11.418 1.00 0.00 H new ATOM 0 HB3 SER A 116 -11.107 -5.114 -12.389 1.00 0.00 H new ATOM 0 HG SER A 116 -13.053 -4.093 -13.127 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.652 -6.491 -10.857 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.723 -7.359 -11.596 1.00 0.00 C ATOM 1053 C VAL A 117 -7.907 -8.290 -10.689 1.00 0.00 C ATOM 1054 O VAL A 117 -7.852 -9.498 -10.914 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.830 -6.482 -12.516 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.509 -6.036 -11.954 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -7.600 -7.132 -13.870 1.00 0.00 C ATOM 0 H VAL A 117 -9.224 -5.625 -10.529 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.310 -8.037 -12.216 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.424 -5.574 -12.614 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.984 -5.432 -12.694 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.678 -5.443 -11.055 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.906 -6.909 -11.705 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.971 -6.485 -14.482 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.106 -8.094 -13.733 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -8.558 -7.283 -14.368 1.00 0.00 H new ATOM 1067 N THR A 118 -7.306 -7.698 -9.651 1.00 0.00 N ATOM 1068 CA THR A 118 -6.127 -8.136 -8.869 1.00 0.00 C ATOM 1069 C THR A 118 -4.882 -8.411 -9.750 1.00 0.00 C ATOM 1070 O THR A 118 -4.995 -9.123 -10.749 1.00 0.00 O ATOM 1071 CB THR A 118 -6.456 -9.336 -7.960 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.697 -9.159 -7.306 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.417 -9.465 -6.848 1.00 0.00 C ATOM 0 H THR A 118 -7.663 -6.811 -9.296 1.00 0.00 H new ATOM 0 HA THR A 118 -5.865 -7.297 -8.225 1.00 0.00 H new ATOM 0 HB THR A 118 -6.473 -10.215 -8.604 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.881 -9.936 -6.738 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.665 -10.317 -6.216 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.431 -9.614 -7.287 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.413 -8.556 -6.246 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.682 -7.861 -9.452 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.521 -7.992 -10.346 1.00 0.00 C ATOM 1083 C PRO A 119 -1.842 -9.366 -10.319 1.00 0.00 C ATOM 1084 O PRO A 119 -1.183 -9.718 -11.292 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.542 -6.891 -9.931 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.910 -6.542 -8.490 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.353 -7.017 -8.314 1.00 0.00 C ATOM 0 HA PRO A 119 -2.859 -7.891 -11.377 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.510 -7.236 -10.000 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.631 -6.021 -10.581 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.244 -7.037 -7.783 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.824 -5.470 -8.311 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.462 -7.572 -7.382 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.032 -6.166 -8.260 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.026 -10.132 -9.232 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.582 -11.520 -8.980 1.00 0.00 C ATOM 1097 C VAL A 120 -0.184 -11.814 -9.528 1.00 0.00 C ATOM 1098 O VAL A 120 0.045 -12.206 -10.677 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.597 -12.542 -9.471 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.316 -13.898 -8.844 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -4.031 -12.154 -9.113 1.00 0.00 C ATOM 0 H VAL A 120 -2.537 -9.764 -8.429 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.514 -11.615 -7.896 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.500 -12.579 -10.556 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -3.048 -14.623 -9.201 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.314 -14.227 -9.121 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.384 -13.818 -7.759 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.717 -12.915 -9.485 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.127 -12.077 -8.030 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.273 -11.194 -9.568 1.00 0.00 H new ATOM 1111 N LEU A 121 0.782 -11.564 -8.664 1.00 0.00 N ATOM 1112 CA LEU A 121 1.972 -10.800 -9.051 1.00 0.00 C ATOM 1113 C LEU A 121 3.159 -11.748 -9.304 1.00 0.00 C ATOM 1114 O LEU A 121 3.762 -11.722 -10.378 1.00 0.00 O ATOM 1115 CB LEU A 121 2.149 -9.687 -7.988 1.00 0.00 C ATOM 1116 CG LEU A 121 3.400 -8.792 -8.088 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.248 -7.643 -7.084 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.705 -9.528 -7.786 1.00 0.00 C ATOM 0 H LEU A 121 0.774 -11.873 -7.692 1.00 0.00 H new ATOM 0 HA LEU A 121 1.882 -10.290 -10.010 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.271 -9.042 -8.029 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.152 -10.159 -7.006 1.00 0.00 H new ATOM 0 HG LEU A 121 3.464 -8.441 -9.118 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.123 -6.995 -7.137 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.355 -7.066 -7.324 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.158 -8.050 -6.077 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.542 -8.836 -7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.671 -9.927 -6.772 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.833 -10.346 -8.494 1.00 0.00 H new ATOM 1130 N ARG A 122 3.423 -12.644 -8.344 1.00 0.00 N ATOM 1131 CA ARG A 122 4.300 -13.833 -8.471 1.00 0.00 C ATOM 1132 C ARG A 122 3.528 -15.161 -8.579 1.00 0.00 C ATOM 1133 O ARG A 122 4.141 -16.225 -8.654 1.00 0.00 O ATOM 1134 CB ARG A 122 5.379 -13.840 -7.364 1.00 0.00 C ATOM 1135 CG ARG A 122 4.966 -14.385 -5.979 1.00 0.00 C ATOM 1136 CD ARG A 122 3.714 -13.707 -5.424 1.00 0.00 C ATOM 1137 NE ARG A 122 3.529 -13.964 -3.986 1.00 0.00 N ATOM 1138 CZ ARG A 122 2.944 -13.158 -3.119 1.00 0.00 C ATOM 1139 NH1 ARG A 122 2.421 -12.033 -3.500 1.00 0.00 N ATOM 1140 NH2 ARG A 122 2.861 -13.471 -1.860 1.00 0.00 N ATOM 0 H ARG A 122 3.016 -12.563 -7.412 1.00 0.00 H new ATOM 0 HA ARG A 122 4.816 -13.748 -9.427 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.225 -14.429 -7.720 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.735 -12.818 -7.233 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.789 -15.458 -6.054 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.790 -14.246 -5.279 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.781 -12.632 -5.593 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.840 -14.062 -5.969 1.00 0.00 H new ATOM 0 HE ARG A 122 3.887 -14.849 -3.625 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.458 -11.760 -4.482 1.00 0.00 H new ATOM 0 HH12 ARG A 122 1.973 -11.422 -2.817 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.252 -14.352 -1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.405 -12.835 -1.205 1.00 0.00 H new ATOM 1154 N GLY A 123 2.191 -15.089 -8.587 1.00 0.00 N ATOM 1155 CA GLY A 123 1.278 -16.219 -8.783 1.00 0.00 C ATOM 1156 C GLY A 123 0.205 -16.447 -7.707 1.00 0.00 C ATOM 1157 O GLY A 123 -0.417 -17.509 -7.721 1.00 0.00 O ATOM 0 H GLY A 123 1.698 -14.207 -8.452 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.774 -16.085 -9.740 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.876 -17.127 -8.862 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.036 -15.504 -6.781 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.120 -15.584 -5.801 1.00 0.00 C ATOM 1163 C GLN A 124 -1.700 -14.204 -5.437 1.00 0.00 C ATOM 1164 O GLN A 124 -1.081 -13.205 -5.799 1.00 0.00 O ATOM 1165 CB GLN A 124 -0.628 -16.383 -4.580 1.00 0.00 C ATOM 1166 CG GLN A 124 0.252 -15.558 -3.626 1.00 0.00 C ATOM 1167 CD GLN A 124 0.968 -16.421 -2.583 1.00 0.00 C ATOM 1168 OE1 GLN A 124 2.188 -16.441 -2.490 1.00 0.00 O ATOM 1169 NE2 GLN A 124 0.253 -17.147 -1.747 1.00 0.00 N ATOM 0 H GLN A 124 0.526 -14.657 -6.695 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.962 -16.116 -6.244 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -1.490 -16.762 -4.031 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -0.064 -17.250 -4.925 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.993 -15.008 -4.207 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.366 -14.819 -3.117 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -0.765 -17.143 -1.810 1.00 0.00 H new ATOM 0 HE22 GLN A 124 0.718 -17.713 -1.037 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.893 -14.119 -4.813 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.627 -12.863 -4.638 1.00 0.00 C ATOM 1180 C PRO A 125 -2.866 -11.745 -3.911 1.00 0.00 C ATOM 1181 O PRO A 125 -2.127 -11.981 -2.952 1.00 0.00 O ATOM 1182 CB PRO A 125 -4.900 -13.235 -3.873 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.158 -14.669 -4.317 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.743 -15.237 -4.417 1.00 0.00 C ATOM 0 HA PRO A 125 -3.817 -12.434 -5.622 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -4.758 -13.166 -2.795 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.731 -12.578 -4.128 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.766 -15.215 -3.596 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.682 -14.711 -5.272 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.421 -15.654 -3.463 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.696 -16.043 -5.150 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.103 -10.509 -4.364 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.505 -9.249 -3.880 1.00 0.00 C ATOM 1194 C ILE A 126 -3.636 -8.355 -3.354 1.00 0.00 C ATOM 1195 O ILE A 126 -4.752 -8.401 -3.874 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.721 -8.530 -5.012 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.018 -9.462 -6.025 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.687 -7.550 -4.442 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.016 -10.448 -5.452 1.00 0.00 C ATOM 0 H ILE A 126 -3.759 -10.346 -5.128 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.793 -9.463 -3.083 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.496 -7.999 -5.565 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.783 -10.024 -6.560 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.505 -8.842 -6.761 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.156 -7.064 -5.261 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.194 -6.796 -3.840 1.00 0.00 H new ATOM 0 HG23 ILE A 126 0.025 -8.093 -3.820 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.409 -11.045 -6.259 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.780 -9.904 -4.944 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.517 -11.104 -4.741 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.385 -7.541 -2.333 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.429 -6.801 -1.607 1.00 0.00 C ATOM 1213 C TYR A 127 -4.227 -5.284 -1.742 1.00 0.00 C ATOM 1214 O TYR A 127 -3.145 -4.790 -1.436 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.381 -7.214 -0.131 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.723 -8.643 0.262 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -5.331 -9.562 -0.617 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.410 -9.046 1.573 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -5.618 -10.873 -0.185 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.700 -10.350 2.013 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.304 -11.273 1.129 1.00 0.00 C ATOM 1222 OH TYR A 127 -5.579 -12.544 1.532 1.00 0.00 O ATOM 0 H TYR A 127 -2.444 -7.370 -1.978 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.403 -7.041 -2.033 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.374 -7.008 0.232 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.057 -6.555 0.414 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.578 -9.261 -1.624 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -3.942 -8.346 2.249 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -6.081 -11.574 -0.864 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -4.462 -10.646 3.024 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.300 -12.659 2.464 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.253 -4.535 -2.153 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.200 -3.073 -2.357 1.00 0.00 C ATOM 1234 C ILE A 128 -6.276 -2.304 -1.557 1.00 0.00 C ATOM 1235 O ILE A 128 -7.401 -2.781 -1.397 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.231 -2.778 -3.885 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.836 -2.273 -4.311 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.347 -1.811 -4.323 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.680 -1.942 -5.799 1.00 0.00 C ATOM 0 H ILE A 128 -6.169 -4.932 -2.360 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.262 -2.695 -1.950 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.473 -3.709 -4.397 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.599 -1.381 -3.731 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -3.098 -3.030 -4.046 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.296 -1.661 -5.401 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.317 -2.233 -4.061 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.219 -0.854 -3.817 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.664 -1.597 -5.990 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.878 -2.834 -6.393 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.387 -1.159 -6.074 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.947 -1.081 -1.119 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.887 -0.011 -0.722 1.00 0.00 C ATOM 1253 C GLN A 129 -6.189 1.360 -0.802 1.00 0.00 C ATOM 1254 O GLN A 129 -4.966 1.436 -0.727 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.390 -0.262 0.715 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.638 0.542 1.121 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.264 -0.018 2.401 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.807 -1.117 2.427 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -9.224 0.685 3.511 1.00 0.00 N ATOM 0 H GLN A 129 -4.973 -0.792 -1.026 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.738 -0.015 -1.403 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -7.609 -1.324 0.826 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -6.584 -0.028 1.411 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.367 1.587 1.272 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.370 0.516 0.313 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -8.778 1.603 3.518 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.638 0.313 4.366 1.00 0.00 H new ATOM 1268 N PHE A 130 -6.932 2.466 -0.893 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.365 3.810 -0.689 1.00 0.00 C ATOM 1270 C PHE A 130 -5.668 3.974 0.692 1.00 0.00 C ATOM 1271 O PHE A 130 -5.893 3.190 1.623 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.450 4.870 -0.841 1.00 0.00 C ATOM 1273 CG PHE A 130 -7.942 5.225 -2.229 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.040 5.689 -3.206 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.328 5.286 -2.474 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.519 6.212 -4.421 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.809 5.821 -3.681 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.903 6.296 -4.646 1.00 0.00 C ATOM 0 H PHE A 130 -7.929 2.462 -1.107 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.600 3.942 -1.455 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.312 4.543 -0.260 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.082 5.786 -0.378 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -5.977 5.643 -3.022 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.023 4.921 -1.732 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.825 6.548 -5.178 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.872 5.867 -3.867 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.273 6.727 -5.564 1.00 0.00 H new ATOM 1288 N SER A 131 -4.824 5.008 0.831 1.00 0.00 N ATOM 1289 CA SER A 131 -3.999 5.256 2.027 1.00 0.00 C ATOM 1290 C SER A 131 -4.752 5.749 3.283 1.00 0.00 C ATOM 1291 O SER A 131 -5.936 6.101 3.248 1.00 0.00 O ATOM 1292 CB SER A 131 -2.868 6.237 1.710 1.00 0.00 C ATOM 1293 OG SER A 131 -3.295 7.583 1.876 1.00 0.00 O ATOM 0 H SER A 131 -4.692 5.709 0.102 1.00 0.00 H new ATOM 0 HA SER A 131 -3.615 4.269 2.284 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.018 6.039 2.362 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.527 6.084 0.686 1.00 0.00 H new ATOM 0 HG SER A 131 -3.802 7.865 1.086 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.010 5.864 4.389 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.368 6.558 5.629 1.00 0.00 C ATOM 1301 C ASN A 132 -3.840 8.015 5.714 1.00 0.00 C ATOM 1302 O ASN A 132 -4.024 8.656 6.751 1.00 0.00 O ATOM 1303 CB ASN A 132 -3.809 5.747 6.813 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.406 4.359 6.967 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.574 4.111 6.708 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.628 3.419 7.448 1.00 0.00 N ATOM 0 H ASN A 132 -3.081 5.446 4.445 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.455 6.628 5.655 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -2.730 5.653 6.694 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -3.981 6.306 7.733 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -3.998 2.482 7.606 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.653 3.625 7.664 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.167 8.550 4.680 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.330 9.760 4.809 1.00 0.00 C ATOM 1315 C HIS A 133 -2.683 10.957 3.912 1.00 0.00 C ATOM 1316 O HIS A 133 -2.377 12.082 4.317 1.00 0.00 O ATOM 1317 CB HIS A 133 -0.860 9.383 4.576 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.329 8.397 5.580 1.00 0.00 C ATOM 1319 ND1 HIS A 133 0.125 8.677 6.853 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.214 7.052 5.382 1.00 0.00 C ATOM 1321 CE1 HIS A 133 0.519 7.519 7.411 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.329 6.505 6.550 1.00 0.00 N ATOM 0 H HIS A 133 -3.186 8.161 3.737 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.528 10.112 5.821 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.755 8.964 3.575 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.251 10.287 4.609 1.00 0.00 H new ATOM 0 HD1 HIS A 133 0.156 9.597 7.292 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.491 6.510 4.490 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.928 7.419 8.405 1.00 0.00 H new ATOM 1330 N LYS A 134 -3.301 10.748 2.737 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.419 11.724 1.625 1.00 0.00 C ATOM 1332 C LYS A 134 -2.052 12.200 1.095 1.00 0.00 C ATOM 1333 O LYS A 134 -1.347 12.968 1.747 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.385 12.874 1.997 1.00 0.00 C ATOM 1335 CG LYS A 134 -4.300 14.115 1.083 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.440 15.114 1.339 1.00 0.00 C ATOM 1337 CE LYS A 134 -5.479 15.695 2.764 1.00 0.00 C ATOM 1338 NZ LYS A 134 -4.282 16.520 3.081 1.00 0.00 N ATOM 0 H LYS A 134 -3.753 9.859 2.521 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.868 11.206 0.777 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -5.406 12.493 1.974 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.182 13.182 3.023 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.343 14.613 1.240 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -4.327 13.797 0.041 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -5.351 15.936 0.629 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -6.390 14.620 1.137 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.376 16.304 2.879 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -5.553 14.879 3.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -4.360 16.886 4.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -3.426 15.935 2.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -4.223 17.316 2.414 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.716 11.762 -0.121 1.00 0.00 N ATOM 1353 CA GLU A 135 -0.520 12.102 -0.910 1.00 0.00 C ATOM 1354 C GLU A 135 0.833 11.737 -0.255 1.00 0.00 C ATOM 1355 O GLU A 135 1.267 12.340 0.729 1.00 0.00 O ATOM 1356 CB GLU A 135 -0.571 13.576 -1.347 1.00 0.00 C ATOM 1357 CG GLU A 135 0.367 13.863 -2.525 1.00 0.00 C ATOM 1358 CD GLU A 135 0.346 15.359 -2.894 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -0.690 15.855 -3.395 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.369 16.052 -2.682 1.00 0.00 O ATOM 0 H GLU A 135 -2.318 11.109 -0.622 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.558 11.461 -1.791 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -1.592 13.835 -1.626 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -0.299 14.213 -0.505 1.00 0.00 H new ATOM 0 HG2 GLU A 135 1.383 13.562 -2.268 1.00 0.00 H new ATOM 0 HG3 GLU A 135 0.067 13.268 -3.387 1.00 0.00 H new ATOM 1367 N LEU A 136 1.526 10.743 -0.811 1.00 0.00 N ATOM 1368 CA LEU A 136 2.883 10.332 -0.413 1.00 0.00 C ATOM 1369 C LEU A 136 3.939 11.377 -0.840 1.00 0.00 C ATOM 1370 O LEU A 136 3.904 11.891 -1.960 1.00 0.00 O ATOM 1371 CB LEU A 136 3.166 8.976 -1.087 1.00 0.00 C ATOM 1372 CG LEU A 136 4.574 8.367 -0.939 1.00 0.00 C ATOM 1373 CD1 LEU A 136 4.869 7.843 0.459 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.737 7.178 -1.880 1.00 0.00 C ATOM 0 H LEU A 136 1.151 10.181 -1.575 1.00 0.00 H new ATOM 0 HA LEU A 136 2.943 10.249 0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.449 8.254 -0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.961 9.085 -2.152 1.00 0.00 H new ATOM 0 HG LEU A 136 5.260 9.182 -1.169 1.00 0.00 H new ATOM 0 HD11 LEU A 136 5.877 7.429 0.487 1.00 0.00 H new ATOM 0 HD12 LEU A 136 4.791 8.659 1.177 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.150 7.065 0.715 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.736 6.757 -1.765 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.994 6.418 -1.639 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.598 7.507 -2.910 1.00 0.00 H new ATOM 1386 N LYS A 137 4.933 11.615 0.023 1.00 0.00 N ATOM 1387 CA LYS A 137 6.172 12.372 -0.260 1.00 0.00 C ATOM 1388 C LYS A 137 7.392 11.672 0.356 1.00 0.00 C ATOM 1389 O LYS A 137 7.503 11.584 1.579 1.00 0.00 O ATOM 1390 CB LYS A 137 6.054 13.847 0.190 1.00 0.00 C ATOM 1391 CG LYS A 137 5.387 14.094 1.557 1.00 0.00 C ATOM 1392 CD LYS A 137 3.924 14.547 1.397 1.00 0.00 C ATOM 1393 CE LYS A 137 3.154 14.529 2.724 1.00 0.00 C ATOM 1394 NZ LYS A 137 2.632 13.174 3.039 1.00 0.00 N ATOM 0 H LYS A 137 4.901 11.272 0.983 1.00 0.00 H new ATOM 0 HA LYS A 137 6.318 12.389 -1.340 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.055 14.278 0.215 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.492 14.392 -0.568 1.00 0.00 H new ATOM 0 HG2 LYS A 137 5.423 13.181 2.151 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.946 14.853 2.104 1.00 0.00 H new ATOM 0 HD2 LYS A 137 3.903 15.555 0.982 1.00 0.00 H new ATOM 0 HD3 LYS A 137 3.422 13.897 0.681 1.00 0.00 H new ATOM 0 HE2 LYS A 137 3.809 14.863 3.529 1.00 0.00 H new ATOM 0 HE3 LYS A 137 2.325 15.235 2.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.132 13.198 3.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 1.975 12.873 2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 3.423 12.502 3.095 1.00 0.00 H new ATOM 1408 N THR A 138 8.269 11.128 -0.484 1.00 0.00 N ATOM 1409 CA THR A 138 9.457 10.341 -0.090 1.00 0.00 C ATOM 1410 C THR A 138 10.740 11.184 -0.096 1.00 0.00 C ATOM 1411 O THR A 138 11.232 11.571 0.963 1.00 0.00 O ATOM 1412 CB THR A 138 9.621 9.102 -0.992 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.524 9.466 -2.354 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.537 8.061 -0.736 1.00 0.00 C ATOM 0 H THR A 138 8.178 11.221 -1.496 1.00 0.00 H new ATOM 0 HA THR A 138 9.291 10.009 0.935 1.00 0.00 H new ATOM 0 HB THR A 138 10.600 8.684 -0.759 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.632 8.669 -2.914 1.00 0.00 H new ATOM 0 HG21 THR A 138 8.692 7.205 -1.393 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.585 7.734 0.303 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.558 8.498 -0.934 1.00 0.00 H new ATOM 1422 N ASP A 139 11.290 11.477 -1.278 1.00 0.00 N ATOM 1423 CA ASP A 139 12.579 12.163 -1.480 1.00 0.00 C ATOM 1424 C ASP A 139 12.567 13.656 -1.080 1.00 0.00 C ATOM 1425 O ASP A 139 13.613 14.233 -0.776 1.00 0.00 O ATOM 1426 CB ASP A 139 12.969 12.005 -2.959 1.00 0.00 C ATOM 1427 CG ASP A 139 14.394 12.512 -3.252 1.00 0.00 C ATOM 1428 OD1 ASP A 139 15.371 11.874 -2.788 1.00 0.00 O ATOM 1429 OD2 ASP A 139 14.542 13.520 -3.982 1.00 0.00 O ATOM 0 H ASP A 139 10.835 11.235 -2.158 1.00 0.00 H new ATOM 0 HA ASP A 139 13.312 11.699 -0.820 1.00 0.00 H new ATOM 0 HB2 ASP A 139 12.896 10.954 -3.240 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.258 12.551 -3.579 1.00 0.00 H new ATOM 1434 N SER A 140 11.386 14.283 -1.063 1.00 0.00 N ATOM 1435 CA SER A 140 11.138 15.701 -0.768 1.00 0.00 C ATOM 1436 C SER A 140 11.255 16.051 0.731 1.00 0.00 C ATOM 1437 O SER A 140 10.325 16.595 1.336 1.00 0.00 O ATOM 1438 CB SER A 140 9.758 16.103 -1.319 1.00 0.00 C ATOM 1439 OG SER A 140 9.635 15.779 -2.698 1.00 0.00 O ATOM 0 H SER A 140 10.521 13.783 -1.268 1.00 0.00 H new ATOM 0 HA SER A 140 11.921 16.274 -1.263 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.977 15.595 -0.753 1.00 0.00 H new ATOM 0 HB3 SER A 140 9.607 17.174 -1.180 1.00 0.00 H new ATOM 0 HG SER A 140 8.748 16.045 -3.019 1.00 0.00 H new ATOM 1445 N SER A 141 12.394 15.733 1.358 1.00 0.00 N ATOM 1446 CA SER A 141 12.688 16.027 2.771 1.00 0.00 C ATOM 1447 C SER A 141 12.651 17.540 3.076 1.00 0.00 C ATOM 1448 O SER A 141 13.094 18.338 2.241 1.00 0.00 O ATOM 1449 CB SER A 141 14.074 15.480 3.144 1.00 0.00 C ATOM 1450 OG SER A 141 14.162 14.080 2.913 1.00 0.00 O ATOM 0 H SER A 141 13.159 15.251 0.886 1.00 0.00 H new ATOM 0 HA SER A 141 11.912 15.542 3.364 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.838 15.995 2.561 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.279 15.690 4.194 1.00 0.00 H new ATOM 0 HG SER A 141 15.056 13.764 3.159 1.00 0.00 H new ATOM 1456 N PRO A 142 12.177 17.967 4.264 1.00 0.00 N ATOM 1457 CA PRO A 142 12.069 19.379 4.652 1.00 0.00 C ATOM 1458 C PRO A 142 13.426 19.967 5.102 1.00 0.00 C ATOM 1459 O PRO A 142 13.627 20.320 6.268 1.00 0.00 O ATOM 1460 CB PRO A 142 11.000 19.385 5.755 1.00 0.00 C ATOM 1461 CG PRO A 142 11.229 18.049 6.461 1.00 0.00 C ATOM 1462 CD PRO A 142 11.581 17.122 5.298 1.00 0.00 C ATOM 0 HA PRO A 142 11.784 20.023 3.820 1.00 0.00 H new ATOM 0 HB2 PRO A 142 11.126 20.228 6.435 1.00 0.00 H new ATOM 0 HB3 PRO A 142 9.994 19.456 5.342 1.00 0.00 H new ATOM 0 HG2 PRO A 142 12.035 18.108 7.192 1.00 0.00 H new ATOM 0 HG3 PRO A 142 10.340 17.713 6.994 1.00 0.00 H new ATOM 0 HD2 PRO A 142 12.278 16.347 5.616 1.00 0.00 H new ATOM 0 HD3 PRO A 142 10.692 16.616 4.922 1.00 0.00 H new ATOM 1470 N ASN A 143 14.383 20.070 4.174 1.00 0.00 N ATOM 1471 CA ASN A 143 15.741 20.576 4.430 1.00 0.00 C ATOM 1472 C ASN A 143 15.807 22.092 4.736 1.00 0.00 C ATOM 1473 O ASN A 143 16.789 22.558 5.317 1.00 0.00 O ATOM 1474 CB ASN A 143 16.645 20.214 3.235 1.00 0.00 C ATOM 1475 CG ASN A 143 16.404 21.088 2.012 1.00 0.00 C ATOM 1476 OD1 ASN A 143 15.391 20.989 1.337 1.00 0.00 O ATOM 1477 ND2 ASN A 143 17.308 21.986 1.697 1.00 0.00 N ATOM 0 H ASN A 143 14.235 19.799 3.202 1.00 0.00 H new ATOM 0 HA ASN A 143 16.096 20.091 5.339 1.00 0.00 H new ATOM 0 HB2 ASN A 143 17.688 20.304 3.537 1.00 0.00 H new ATOM 0 HB3 ASN A 143 16.480 19.171 2.966 1.00 0.00 H new ATOM 0 HD21 ASN A 143 17.162 22.596 0.893 1.00 0.00 H new ATOM 0 HD22 ASN A 143 18.156 22.074 2.257 1.00 0.00 H new ATOM 1484 N GLN A 144 14.783 22.859 4.340 1.00 0.00 N ATOM 1485 CA GLN A 144 14.671 24.312 4.524 1.00 0.00 C ATOM 1486 C GLN A 144 13.203 24.783 4.607 1.00 0.00 C ATOM 1487 O GLN A 144 12.271 23.979 4.521 1.00 0.00 O ATOM 1488 CB GLN A 144 15.427 25.031 3.384 1.00 0.00 C ATOM 1489 CG GLN A 144 14.785 24.861 1.995 1.00 0.00 C ATOM 1490 CD GLN A 144 15.447 25.765 0.962 1.00 0.00 C ATOM 1491 OE1 GLN A 144 16.331 25.361 0.216 1.00 0.00 O ATOM 1492 NE2 GLN A 144 15.046 27.018 0.873 1.00 0.00 N ATOM 0 H GLN A 144 13.973 22.466 3.861 1.00 0.00 H new ATOM 0 HA GLN A 144 15.126 24.571 5.480 1.00 0.00 H new ATOM 0 HB2 GLN A 144 15.486 26.094 3.617 1.00 0.00 H new ATOM 0 HB3 GLN A 144 16.449 24.655 3.348 1.00 0.00 H new ATOM 0 HG2 GLN A 144 14.869 23.821 1.678 1.00 0.00 H new ATOM 0 HG3 GLN A 144 13.721 25.091 2.054 1.00 0.00 H new ATOM 0 HE21 GLN A 144 14.311 27.363 1.490 1.00 0.00 H new ATOM 0 HE22 GLN A 144 15.471 27.642 0.187 1.00 0.00 H new ATOM 1501 N ALA A 145 13.012 26.101 4.709 1.00 0.00 N ATOM 1502 CA ALA A 145 11.747 26.813 4.514 1.00 0.00 C ATOM 1503 C ALA A 145 11.865 27.865 3.382 1.00 0.00 C ATOM 1504 O ALA A 145 12.902 27.971 2.716 1.00 0.00 O ATOM 1505 CB ALA A 145 11.330 27.414 5.868 1.00 0.00 C ATOM 0 H ALA A 145 13.777 26.734 4.942 1.00 0.00 H new ATOM 0 HA ALA A 145 10.964 26.130 4.183 1.00 0.00 H new ATOM 0 HB1 ALA A 145 10.389 27.952 5.753 1.00 0.00 H new ATOM 0 HB2 ALA A 145 11.204 26.614 6.598 1.00 0.00 H new ATOM 0 HB3 ALA A 145 12.101 28.102 6.213 1.00 0.00 H new ATOM 1511 N ARG A 146 10.795 28.640 3.155 1.00 0.00 N ATOM 1512 CA ARG A 146 10.711 29.733 2.160 1.00 0.00 C ATOM 1513 C ARG A 146 11.731 30.860 2.399 1.00 0.00 C ATOM 1514 O ARG A 146 12.207 31.470 1.438 1.00 0.00 O ATOM 1515 CB ARG A 146 9.269 30.277 2.175 1.00 0.00 C ATOM 1516 CG ARG A 146 8.985 31.338 1.101 1.00 0.00 C ATOM 1517 CD ARG A 146 7.523 31.796 1.166 1.00 0.00 C ATOM 1518 NE ARG A 146 7.242 32.856 0.178 1.00 0.00 N ATOM 1519 CZ ARG A 146 7.298 34.166 0.346 1.00 0.00 C ATOM 1520 NH1 ARG A 146 7.634 34.717 1.479 1.00 0.00 N ATOM 1521 NH2 ARG A 146 7.014 34.966 -0.640 1.00 0.00 N ATOM 1522 OXT ARG A 146 12.067 31.147 3.546 1.00 0.00 O ATOM 0 H ARG A 146 9.927 28.523 3.677 1.00 0.00 H new ATOM 0 HA ARG A 146 10.964 29.327 1.181 1.00 0.00 H new ATOM 0 HB2 ARG A 146 8.577 29.445 2.040 1.00 0.00 H new ATOM 0 HB3 ARG A 146 9.064 30.706 3.156 1.00 0.00 H new ATOM 0 HG2 ARG A 146 9.646 32.193 1.243 1.00 0.00 H new ATOM 0 HG3 ARG A 146 9.200 30.930 0.113 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.866 30.945 0.985 1.00 0.00 H new ATOM 0 HD3 ARG A 146 7.300 32.163 2.168 1.00 0.00 H new ATOM 0 HE ARG A 146 6.970 32.537 -0.752 1.00 0.00 H new ATOM 0 HH11 ARG A 146 7.867 34.132 2.281 1.00 0.00 H new ATOM 0 HH12 ARG A 146 7.664 35.733 1.563 1.00 0.00 H new ATOM 0 HH21 ARG A 146 6.747 34.583 -1.547 1.00 0.00 H new ATOM 0 HH22 ARG A 146 7.058 35.976 -0.506 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -6.531 -7.925 5.371 1.00 0.00 O ATOM 1538 C5' C B 147 -5.307 -8.642 5.226 1.00 0.00 C ATOM 1539 C4' C B 147 -4.483 -8.658 6.526 1.00 0.00 C ATOM 1540 O4' C B 147 -5.094 -9.527 7.476 1.00 0.00 O ATOM 1541 C3' C B 147 -3.048 -9.160 6.291 1.00 0.00 C ATOM 1542 O3' C B 147 -2.162 -8.522 7.198 1.00 0.00 O ATOM 1543 C2' C B 147 -3.174 -10.647 6.628 1.00 0.00 C ATOM 1544 O2' C B 147 -1.980 -11.261 7.099 1.00 0.00 O ATOM 1545 C1' C B 147 -4.233 -10.626 7.734 1.00 0.00 C ATOM 1546 N1 C B 147 -4.994 -11.900 7.803 1.00 0.00 N ATOM 1547 C2 C B 147 -4.916 -12.689 8.959 1.00 0.00 C ATOM 1548 O2 C B 147 -4.288 -12.326 9.958 1.00 0.00 O ATOM 1549 N3 C B 147 -5.553 -13.886 9.019 1.00 0.00 N ATOM 1550 C4 C B 147 -6.237 -14.288 7.966 1.00 0.00 C ATOM 1551 N4 C B 147 -6.830 -15.444 8.088 1.00 0.00 N ATOM 1552 C5 C B 147 -6.349 -13.535 6.765 1.00 0.00 C ATOM 1553 C6 C B 147 -5.707 -12.342 6.716 1.00 0.00 C ATOM 0 H5' C B 147 -4.716 -8.190 4.429 1.00 0.00 H new ATOM 0 H5'' C B 147 -5.522 -9.666 4.922 1.00 0.00 H new ATOM 0 H4' C B 147 -4.448 -7.632 6.893 1.00 0.00 H new ATOM 0 H3' C B 147 -2.661 -8.966 5.290 1.00 0.00 H new ATOM 0 H2' C B 147 -3.418 -11.235 5.744 1.00 0.00 H new ATOM 0 HO2' C B 147 -2.152 -12.207 7.290 1.00 0.00 H new ATOM 0 HO5' C B 147 -6.403 -7.184 5.999 1.00 0.00 H new ATOM 0 H1' C B 147 -3.749 -10.516 8.705 1.00 0.00 H new ATOM 0 H41 C B 147 -7.378 -15.820 7.314 1.00 0.00 H new ATOM 0 H42 C B 147 -6.746 -15.971 8.957 1.00 0.00 H new ATOM 0 H5 C B 147 -6.923 -13.899 5.925 1.00 0.00 H new ATOM 0 H6 C B 147 -5.756 -11.739 5.821 1.00 0.00 H new ATOM 1566 P U B 148 -0.703 -8.049 6.742 1.00 0.00 P ATOM 1567 OP1 U B 148 -0.320 -8.777 5.513 1.00 0.00 O ATOM 1568 OP2 U B 148 0.182 -8.128 7.929 1.00 0.00 O ATOM 1569 O5' U B 148 -0.983 -6.509 6.374 1.00 0.00 O ATOM 1570 C5' U B 148 -1.239 -5.589 7.422 1.00 0.00 C ATOM 1571 C4' U B 148 -1.313 -4.134 6.969 1.00 0.00 C ATOM 1572 O4' U B 148 -2.541 -3.824 6.333 1.00 0.00 O ATOM 1573 C3' U B 148 -1.189 -3.243 8.208 1.00 0.00 C ATOM 1574 O3' U B 148 -0.466 -2.071 7.874 1.00 0.00 O ATOM 1575 C2' U B 148 -2.659 -2.997 8.565 1.00 0.00 C ATOM 1576 O2' U B 148 -2.902 -1.809 9.311 1.00 0.00 O ATOM 1577 C1' U B 148 -3.288 -2.966 7.174 1.00 0.00 C ATOM 1578 N1 U B 148 -4.703 -3.410 7.191 1.00 0.00 N ATOM 1579 C2 U B 148 -5.706 -2.501 6.847 1.00 0.00 C ATOM 1580 O2 U B 148 -5.482 -1.411 6.319 1.00 0.00 O ATOM 1581 N3 U B 148 -7.012 -2.907 7.051 1.00 0.00 N ATOM 1582 C4 U B 148 -7.404 -4.167 7.457 1.00 0.00 C ATOM 1583 O4 U B 148 -8.595 -4.429 7.588 1.00 0.00 O ATOM 1584 C5 U B 148 -6.310 -5.095 7.670 1.00 0.00 C ATOM 1585 C6 U B 148 -5.014 -4.705 7.533 1.00 0.00 C ATOM 0 H5' U B 148 -0.456 -5.685 8.174 1.00 0.00 H new ATOM 0 H5'' U B 148 -2.179 -5.856 7.904 1.00 0.00 H new ATOM 0 H4' U B 148 -0.509 -3.967 6.252 1.00 0.00 H new ATOM 0 H3' U B 148 -0.639 -3.664 9.050 1.00 0.00 H new ATOM 0 H2' U B 148 -3.068 -3.751 9.238 1.00 0.00 H new ATOM 0 HO2' U B 148 -2.080 -1.538 9.771 1.00 0.00 H new ATOM 0 H1' U B 148 -3.272 -1.939 6.810 1.00 0.00 H new ATOM 0 H3 U B 148 -7.747 -2.218 6.888 1.00 0.00 H new ATOM 0 H5 U B 148 -6.529 -6.117 7.943 1.00 0.00 H new ATOM 0 H6 U B 148 -4.221 -5.420 7.695 1.00 0.00 H new ATOM 1596 P C B 149 0.426 -1.358 8.982 1.00 0.00 P ATOM 1597 OP1 C B 149 1.713 -2.085 9.056 1.00 0.00 O ATOM 1598 OP2 C B 149 -0.401 -1.203 10.200 1.00 0.00 O ATOM 1599 O5' C B 149 0.679 0.088 8.363 1.00 0.00 O ATOM 1600 C5' C B 149 1.918 0.437 7.768 1.00 0.00 C ATOM 1601 C4' C B 149 1.898 1.867 7.216 1.00 0.00 C ATOM 1602 O4' C B 149 1.164 1.885 5.999 1.00 0.00 O ATOM 1603 C3' C B 149 1.253 2.875 8.187 1.00 0.00 C ATOM 1604 O3' C B 149 1.900 4.139 8.177 1.00 0.00 O ATOM 1605 C2' C B 149 -0.148 3.015 7.601 1.00 0.00 C ATOM 1606 O2' C B 149 -0.835 4.214 7.930 1.00 0.00 O ATOM 1607 C1' C B 149 0.122 2.841 6.114 1.00 0.00 C ATOM 1608 N1 C B 149 -1.114 2.350 5.460 1.00 0.00 N ATOM 1609 C2 C B 149 -1.861 3.204 4.640 1.00 0.00 C ATOM 1610 O2 C B 149 -1.505 4.351 4.396 1.00 0.00 O ATOM 1611 N3 C B 149 -3.022 2.784 4.088 1.00 0.00 N ATOM 1612 C4 C B 149 -3.428 1.560 4.324 1.00 0.00 C ATOM 1613 N4 C B 149 -4.552 1.227 3.751 1.00 0.00 N ATOM 1614 C5 C B 149 -2.701 0.644 5.131 1.00 0.00 C ATOM 1615 C6 C B 149 -1.562 1.082 5.713 1.00 0.00 C ATOM 0 H5' C B 149 2.144 -0.261 6.962 1.00 0.00 H new ATOM 0 H5'' C B 149 2.715 0.342 8.505 1.00 0.00 H new ATOM 0 H4' C B 149 2.935 2.166 7.065 1.00 0.00 H new ATOM 0 H3' C B 149 1.298 2.542 9.224 1.00 0.00 H new ATOM 0 H2' C B 149 -0.847 2.287 8.014 1.00 0.00 H new ATOM 0 HO2' C B 149 -0.466 4.956 7.408 1.00 0.00 H new ATOM 0 H1' C B 149 0.413 3.776 5.636 1.00 0.00 H new ATOM 0 H41 C B 149 -4.935 0.291 3.885 1.00 0.00 H new ATOM 0 H42 C B 149 -5.047 1.902 3.169 1.00 0.00 H new ATOM 0 H5 C B 149 -3.047 -0.369 5.275 1.00 0.00 H new ATOM 0 H6 C B 149 -1.008 0.433 6.375 1.00 0.00 H new ATOM 1627 P U B 150 3.298 4.376 8.910 1.00 0.00 P ATOM 1628 OP1 U B 150 3.428 3.419 10.036 1.00 0.00 O ATOM 1629 OP2 U B 150 3.422 5.825 9.182 1.00 0.00 O ATOM 1630 O5' U B 150 4.383 3.984 7.796 1.00 0.00 O ATOM 1631 C5' U B 150 4.383 4.625 6.532 1.00 0.00 C ATOM 1632 C4' U B 150 5.798 4.636 5.941 1.00 0.00 C ATOM 1633 O4' U B 150 5.756 5.021 4.569 1.00 0.00 O ATOM 1634 C3' U B 150 6.718 5.588 6.706 1.00 0.00 C ATOM 1635 O3' U B 150 7.554 4.908 7.638 1.00 0.00 O ATOM 1636 C2' U B 150 7.520 6.249 5.579 1.00 0.00 C ATOM 1637 O2' U B 150 8.778 5.627 5.317 1.00 0.00 O ATOM 1638 C1' U B 150 6.665 6.095 4.328 1.00 0.00 C ATOM 1639 N1 U B 150 6.016 7.393 4.001 1.00 0.00 N ATOM 1640 C2 U B 150 6.785 8.399 3.396 1.00 0.00 C ATOM 1641 O2 U B 150 7.971 8.265 3.098 1.00 0.00 O ATOM 1642 N3 U B 150 6.144 9.590 3.112 1.00 0.00 N ATOM 1643 C4 U B 150 4.801 9.833 3.266 1.00 0.00 C ATOM 1644 O4 U B 150 4.324 10.895 2.882 1.00 0.00 O ATOM 1645 C5 U B 150 4.063 8.745 3.863 1.00 0.00 C ATOM 1646 C6 U B 150 4.683 7.599 4.247 1.00 0.00 C ATOM 0 H5' U B 150 4.016 5.646 6.635 1.00 0.00 H new ATOM 0 H5'' U B 150 3.703 4.109 5.855 1.00 0.00 H new ATOM 0 H4' U B 150 6.198 3.626 6.028 1.00 0.00 H new ATOM 0 H3' U B 150 6.176 6.302 7.326 1.00 0.00 H new ATOM 0 H2' U B 150 7.736 7.278 5.866 1.00 0.00 H new ATOM 0 HO2' U B 150 9.009 5.030 6.059 1.00 0.00 H new ATOM 0 H1' U B 150 7.252 5.841 3.445 1.00 0.00 H new ATOM 0 H3 U B 150 6.718 10.355 2.757 1.00 0.00 H new ATOM 0 H5 U B 150 2.997 8.844 4.007 1.00 0.00 H new ATOM 0 H6 U B 150 4.115 6.835 4.756 1.00 0.00 H new ATOM 1657 P C B 151 8.427 5.702 8.729 1.00 0.00 P ATOM 1658 OP1 C B 151 8.177 7.157 8.589 1.00 0.00 O ATOM 1659 OP2 C B 151 9.818 5.201 8.620 1.00 0.00 O ATOM 1660 O5' C B 151 7.830 5.173 10.130 1.00 0.00 O ATOM 1661 C5' C B 151 6.552 5.567 10.614 1.00 0.00 C ATOM 1662 C4' C B 151 6.690 6.538 11.802 1.00 0.00 C ATOM 1663 O4' C B 151 7.077 7.838 11.359 1.00 0.00 O ATOM 1664 C3' C B 151 5.372 6.729 12.568 1.00 0.00 C ATOM 1665 O3' C B 151 5.653 7.136 13.904 1.00 0.00 O ATOM 1666 C2' C B 151 4.721 7.868 11.773 1.00 0.00 C ATOM 1667 O2' C B 151 3.794 8.623 12.545 1.00 0.00 O ATOM 1668 C1' C B 151 5.940 8.698 11.345 1.00 0.00 C ATOM 1669 N1 C B 151 5.810 9.394 10.025 1.00 0.00 N ATOM 1670 C2 C B 151 6.229 10.731 9.935 1.00 0.00 C ATOM 1671 O2 C B 151 6.709 11.330 10.899 1.00 0.00 O ATOM 1672 N3 C B 151 6.107 11.420 8.770 1.00 0.00 N ATOM 1673 C4 C B 151 5.580 10.805 7.729 1.00 0.00 C ATOM 1674 N4 C B 151 5.481 11.521 6.644 1.00 0.00 N ATOM 1675 C5 C B 151 5.135 9.457 7.751 1.00 0.00 C ATOM 1676 C6 C B 151 5.269 8.779 8.919 1.00 0.00 C ATOM 0 H5' C B 151 5.988 4.687 10.922 1.00 0.00 H new ATOM 0 H5'' C B 151 5.986 6.044 9.813 1.00 0.00 H new ATOM 0 H4' C B 151 7.442 6.088 12.450 1.00 0.00 H new ATOM 0 H3' C B 151 4.750 5.837 12.646 1.00 0.00 H new ATOM 0 H2' C B 151 4.115 7.517 10.937 1.00 0.00 H new ATOM 0 HO2' C B 151 4.041 8.575 13.492 1.00 0.00 H new ATOM 0 H1' C B 151 6.040 9.516 12.059 1.00 0.00 H new ATOM 0 H41 C B 151 5.083 11.113 5.798 1.00 0.00 H new ATOM 0 H42 C B 151 5.801 12.489 6.641 1.00 0.00 H new ATOM 0 H5 C B 151 4.708 8.991 6.875 1.00 0.00 H new ATOM 0 H6 C B 151 4.949 7.749 8.981 1.00 0.00 H new ATOM 1688 P U B 152 5.792 6.060 15.080 1.00 0.00 P ATOM 1689 OP1 U B 152 6.389 6.747 16.250 1.00 0.00 O ATOM 1690 OP2 U B 152 6.440 4.840 14.545 1.00 0.00 O ATOM 1691 O5' U B 152 4.249 5.723 15.396 1.00 0.00 O ATOM 1692 C5' U B 152 3.859 4.775 16.379 1.00 0.00 C ATOM 1693 C4' U B 152 4.002 5.297 17.821 1.00 0.00 C ATOM 1694 O4' U B 152 3.197 6.465 18.014 1.00 0.00 O ATOM 1695 C3' U B 152 3.504 4.251 18.836 1.00 0.00 C ATOM 1696 O3' U B 152 4.201 4.420 20.073 1.00 0.00 O ATOM 1697 C2' U B 152 2.023 4.634 18.948 1.00 0.00 C ATOM 1698 O2' U B 152 1.386 4.143 20.127 1.00 0.00 O ATOM 1699 C1' U B 152 2.111 6.164 18.880 1.00 0.00 C ATOM 1700 N1 U B 152 0.849 6.795 18.398 1.00 0.00 N ATOM 1701 C2 U B 152 0.073 7.522 19.313 1.00 0.00 C ATOM 1702 O2 U B 152 0.389 7.698 20.491 1.00 0.00 O ATOM 1703 N3 U B 152 -1.104 8.070 18.839 1.00 0.00 N ATOM 1704 C4 U B 152 -1.576 7.975 17.549 1.00 0.00 C ATOM 1705 O4 U B 152 -2.631 8.518 17.235 1.00 0.00 O ATOM 1706 C5 U B 152 -0.724 7.217 16.660 1.00 0.00 C ATOM 1707 C6 U B 152 0.437 6.652 17.088 1.00 0.00 C ATOM 0 H5' U B 152 4.462 3.875 16.265 1.00 0.00 H new ATOM 0 H5'' U B 152 2.822 4.488 16.205 1.00 0.00 H new ATOM 0 H4' U B 152 5.059 5.515 17.975 1.00 0.00 H new ATOM 0 H3' U B 152 3.658 3.208 18.558 1.00 0.00 H new ATOM 0 H2' U B 152 1.394 4.194 18.175 1.00 0.00 H new ATOM 0 HO2' U B 152 0.448 4.425 20.133 1.00 0.00 H new ATOM 0 HO3' U B 152 3.559 4.417 20.813 1.00 0.00 H new ATOM 0 H1' U B 152 2.268 6.571 19.879 1.00 0.00 H new ATOM 0 H3 U B 152 -1.674 8.592 19.505 1.00 0.00 H new ATOM 0 H5 U B 152 -1.018 7.096 15.628 1.00 0.00 H new ATOM 0 H6 U B 152 1.043 6.086 16.396 1.00 0.00 H new TER 1719 U B 152