USER MOD reduce.3.24.130724 H: found=0, std=0, add=800, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 804 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 109 MET CE :methyl 177:sc= -1.82 (180deg=-1.85) USER MOD Set 1.2: A 124 MET CE :methyl -142:sc= -0.139 (180deg=-1.17) USER MOD Set 2.1: A 107 HIS : no HE2:sc= -7.66! C(o=-16!,f=-18!) USER MOD Set 2.2: A 110 THR OG1 : rot -79:sc= 0.831 USER MOD Set 2.3: A 111 ASN : amide:sc= -8.33! C(o=-16!,f=-26!) USER MOD Set 2.4: B 34 MET CE :methyl 149:sc= -0.935 (180deg=-0.62) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 78:sc= -1.43! USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -144:sc= -0.062 (180deg=-4.61!) USER MOD Single : A 97 ASN : amide:sc= -0.0925 K(o=-0.092,f=-1.5!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 25:sc= 0.0784 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 161:sc= -2! USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= -0.754 K(o=-0.75,f=-9.7!) USER MOD Single : A 138 TYR OH : rot -15:sc= -2.47 USER MOD Single : A 143 GLN :FLIP amide:sc= -3.63! C(o=-4.5!,f=-3.6!) USER MOD Single : A 144 MET CE :methyl 176:sc= -0.599 (180deg=-0.682) USER MOD Single : A 145 MET CE :methyl -116:sc= -0.0149 (180deg=-2.21!) USER MOD Single : A 146 THR OG1 : rot 66:sc= 0.251 USER MOD Single : A 148 LYS NZ :NH3+ 152:sc= -0.0546 (180deg=-0.476) USER MOD Single : B 39 THR OG1 : rot 175:sc= 0.107 USER MOD Single : B 47 GLN :FLIP amide:sc= -4.01! C(o=-10!,f=-4!) USER MOD Single : B 48 SER OG : rot 180:sc= 0 USER MOD Single : B 49 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.25) USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 GLN :FLIP amide:sc= -0.315 F(o=-2.4!,f=-0.32) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 LYS NZ :NH3+ -135:sc= -0.0478 (180deg=-0.517) USER MOD Single : B 57 LYS NZ :NH3+ 161:sc= -0.0784 (180deg=-0.482) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 76 5.445 -11.738 -22.138 1.00 0.00 N ATOM 2 CA MET A 76 4.921 -10.716 -21.189 1.00 0.00 C ATOM 3 C MET A 76 4.344 -11.414 -19.962 1.00 0.00 C ATOM 4 O MET A 76 4.558 -10.978 -18.831 1.00 0.00 O ATOM 5 CB MET A 76 3.834 -9.890 -21.882 1.00 0.00 C ATOM 6 CG MET A 76 4.422 -8.556 -22.350 1.00 0.00 C ATOM 7 SD MET A 76 3.135 -7.578 -23.166 1.00 0.00 S ATOM 8 CE MET A 76 3.334 -8.268 -24.828 1.00 0.00 C ATOM 0 HA MET A 76 5.728 -10.054 -20.877 1.00 0.00 H new ATOM 0 HB2 MET A 76 3.432 -10.440 -22.733 1.00 0.00 H new ATOM 0 HB3 MET A 76 3.005 -9.713 -21.197 1.00 0.00 H new ATOM 0 HG2 MET A 76 4.826 -8.007 -21.500 1.00 0.00 H new ATOM 0 HG3 MET A 76 5.249 -8.733 -23.037 1.00 0.00 H new ATOM 0 HE1 MET A 76 2.623 -7.796 -25.506 1.00 0.00 H new ATOM 0 HE2 MET A 76 4.349 -8.082 -25.180 1.00 0.00 H new ATOM 0 HE3 MET A 76 3.151 -9.342 -24.800 1.00 0.00 H new ATOM 20 N LYS A 77 3.610 -12.497 -20.193 1.00 0.00 N ATOM 21 CA LYS A 77 3.007 -13.245 -19.096 1.00 0.00 C ATOM 22 C LYS A 77 4.082 -13.922 -18.251 1.00 0.00 C ATOM 23 O LYS A 77 5.170 -14.227 -18.739 1.00 0.00 O ATOM 24 CB LYS A 77 2.036 -14.293 -19.648 1.00 0.00 C ATOM 25 CG LYS A 77 2.791 -15.301 -20.521 1.00 0.00 C ATOM 26 CD LYS A 77 1.802 -16.322 -21.088 1.00 0.00 C ATOM 27 CE LYS A 77 2.552 -17.331 -21.960 1.00 0.00 C ATOM 28 NZ LYS A 77 1.588 -18.328 -22.506 1.00 0.00 N ATOM 0 H LYS A 77 3.419 -12.874 -21.121 1.00 0.00 H new ATOM 0 HA LYS A 77 2.458 -12.548 -18.463 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.541 -14.811 -18.826 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.256 -13.805 -20.233 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.303 -14.784 -21.333 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.556 -15.807 -19.933 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.290 -16.838 -20.276 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.037 -15.815 -21.676 1.00 0.00 H new ATOM 0 HE2 LYS A 77 3.060 -16.816 -22.775 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.320 -17.835 -21.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.097 -19.014 -23.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.122 -18.827 -21.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.871 -17.840 -23.080 1.00 0.00 H new ATOM 42 N ASP A 78 3.770 -14.150 -16.980 1.00 0.00 N ATOM 43 CA ASP A 78 4.724 -14.789 -16.081 1.00 0.00 C ATOM 44 C ASP A 78 6.044 -14.024 -16.097 1.00 0.00 C ATOM 45 O ASP A 78 7.078 -14.559 -16.497 1.00 0.00 O ATOM 46 CB ASP A 78 4.960 -16.238 -16.510 1.00 0.00 C ATOM 47 CG ASP A 78 5.745 -16.978 -15.431 1.00 0.00 C ATOM 48 OD1 ASP A 78 6.264 -16.318 -14.545 1.00 0.00 O ATOM 49 OD2 ASP A 78 5.816 -18.193 -15.506 1.00 0.00 O ATOM 0 H ASP A 78 2.876 -13.906 -16.553 1.00 0.00 H new ATOM 0 HA ASP A 78 4.317 -14.780 -15.070 1.00 0.00 H new ATOM 0 HB2 ASP A 78 4.006 -16.735 -16.683 1.00 0.00 H new ATOM 0 HB3 ASP A 78 5.508 -16.263 -17.452 1.00 0.00 H new ATOM 54 N THR A 79 5.996 -12.772 -15.652 1.00 0.00 N ATOM 55 CA THR A 79 7.194 -11.926 -15.606 1.00 0.00 C ATOM 56 C THR A 79 6.872 -10.512 -15.104 1.00 0.00 C ATOM 57 O THR A 79 7.669 -9.590 -15.287 1.00 0.00 O ATOM 58 CB THR A 79 7.829 -11.829 -17.002 1.00 0.00 C ATOM 59 OG1 THR A 79 7.009 -12.493 -17.952 1.00 0.00 O ATOM 60 CG2 THR A 79 9.219 -12.471 -16.983 1.00 0.00 C ATOM 0 H THR A 79 5.146 -12.318 -15.318 1.00 0.00 H new ATOM 0 HA THR A 79 7.892 -12.390 -14.909 1.00 0.00 H new ATOM 0 HB THR A 79 7.921 -10.779 -17.280 1.00 0.00 H new ATOM 0 HG1 THR A 79 6.250 -11.919 -18.186 1.00 0.00 H new ATOM 0 HG21 THR A 79 9.666 -12.400 -17.975 1.00 0.00 H new ATOM 0 HG22 THR A 79 9.850 -11.951 -16.262 1.00 0.00 H new ATOM 0 HG23 THR A 79 9.132 -13.520 -16.698 1.00 0.00 H new ATOM 68 N ASP A 80 5.704 -10.339 -14.484 1.00 0.00 N ATOM 69 CA ASP A 80 5.295 -9.030 -13.984 1.00 0.00 C ATOM 70 C ASP A 80 5.358 -8.982 -12.459 1.00 0.00 C ATOM 71 O ASP A 80 4.786 -9.827 -11.779 1.00 0.00 O ATOM 72 CB ASP A 80 3.870 -8.722 -14.446 1.00 0.00 C ATOM 73 CG ASP A 80 3.477 -7.310 -14.022 1.00 0.00 C ATOM 74 OD1 ASP A 80 4.293 -6.651 -13.400 1.00 0.00 O ATOM 75 OD2 ASP A 80 2.368 -6.907 -14.332 1.00 0.00 O ATOM 0 H ASP A 80 5.029 -11.086 -14.318 1.00 0.00 H new ATOM 0 HA ASP A 80 5.982 -8.283 -14.382 1.00 0.00 H new ATOM 0 HB2 ASP A 80 3.802 -8.817 -15.530 1.00 0.00 H new ATOM 0 HB3 ASP A 80 3.176 -9.445 -14.018 1.00 0.00 H new ATOM 80 N SER A 81 6.055 -7.985 -11.932 1.00 0.00 N ATOM 81 CA SER A 81 6.182 -7.822 -10.487 1.00 0.00 C ATOM 82 C SER A 81 4.942 -7.143 -9.922 1.00 0.00 C ATOM 83 O SER A 81 4.796 -7.002 -8.709 1.00 0.00 O ATOM 84 CB SER A 81 7.422 -6.999 -10.146 1.00 0.00 C ATOM 85 OG SER A 81 8.582 -7.699 -10.576 1.00 0.00 O ATOM 0 H SER A 81 6.541 -7.276 -12.481 1.00 0.00 H new ATOM 0 HA SER A 81 6.283 -8.811 -10.039 1.00 0.00 H new ATOM 0 HB2 SER A 81 7.371 -6.024 -10.631 1.00 0.00 H new ATOM 0 HB3 SER A 81 7.469 -6.819 -9.072 1.00 0.00 H new ATOM 0 HG SER A 81 9.380 -7.173 -10.360 1.00 0.00 H new ATOM 91 N GLU A 82 4.050 -6.723 -10.807 1.00 0.00 N ATOM 92 CA GLU A 82 2.829 -6.063 -10.374 1.00 0.00 C ATOM 93 C GLU A 82 2.069 -6.982 -9.431 1.00 0.00 C ATOM 94 O GLU A 82 1.503 -6.539 -8.431 1.00 0.00 O ATOM 95 CB GLU A 82 1.957 -5.725 -11.587 1.00 0.00 C ATOM 96 CG GLU A 82 0.705 -4.972 -11.131 1.00 0.00 C ATOM 97 CD GLU A 82 -0.140 -4.587 -12.341 1.00 0.00 C ATOM 98 OE1 GLU A 82 0.263 -4.910 -13.447 1.00 0.00 O ATOM 99 OE2 GLU A 82 -1.177 -3.976 -12.145 1.00 0.00 O ATOM 0 H GLU A 82 4.147 -6.826 -11.817 1.00 0.00 H new ATOM 0 HA GLU A 82 3.082 -5.138 -9.856 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.521 -5.117 -12.294 1.00 0.00 H new ATOM 0 HB3 GLU A 82 1.673 -6.639 -12.109 1.00 0.00 H new ATOM 0 HG2 GLU A 82 0.122 -5.595 -10.453 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.990 -4.078 -10.576 1.00 0.00 H new ATOM 106 N GLU A 83 2.074 -8.266 -9.753 1.00 0.00 N ATOM 107 CA GLU A 83 1.399 -9.263 -8.931 1.00 0.00 C ATOM 108 C GLU A 83 2.116 -9.455 -7.593 1.00 0.00 C ATOM 109 O GLU A 83 1.487 -9.763 -6.585 1.00 0.00 O ATOM 110 CB GLU A 83 1.363 -10.599 -9.669 1.00 0.00 C ATOM 111 CG GLU A 83 2.703 -10.826 -10.374 1.00 0.00 C ATOM 112 CD GLU A 83 3.057 -12.309 -10.357 1.00 0.00 C ATOM 113 OE1 GLU A 83 2.149 -13.117 -10.458 1.00 0.00 O ATOM 114 OE2 GLU A 83 4.233 -12.615 -10.243 1.00 0.00 O ATOM 0 H GLU A 83 2.538 -8.644 -10.579 1.00 0.00 H new ATOM 0 HA GLU A 83 0.386 -8.910 -8.738 1.00 0.00 H new ATOM 0 HB2 GLU A 83 1.167 -11.410 -8.967 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.551 -10.604 -10.396 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.647 -10.469 -11.402 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.486 -10.251 -9.879 1.00 0.00 H new ATOM 121 N GLU A 84 3.437 -9.291 -7.584 1.00 0.00 N ATOM 122 CA GLU A 84 4.197 -9.472 -6.348 1.00 0.00 C ATOM 123 C GLU A 84 3.750 -8.463 -5.292 1.00 0.00 C ATOM 124 O GLU A 84 3.544 -8.812 -4.127 1.00 0.00 O ATOM 125 CB GLU A 84 5.696 -9.314 -6.626 1.00 0.00 C ATOM 126 CG GLU A 84 6.195 -10.514 -7.433 1.00 0.00 C ATOM 127 CD GLU A 84 7.633 -10.280 -7.878 1.00 0.00 C ATOM 128 OE1 GLU A 84 8.090 -9.154 -7.770 1.00 0.00 O ATOM 129 OE2 GLU A 84 8.258 -11.229 -8.321 1.00 0.00 O ATOM 0 H GLU A 84 3.995 -9.038 -8.400 1.00 0.00 H new ATOM 0 HA GLU A 84 4.010 -10.476 -5.968 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.879 -8.391 -7.176 1.00 0.00 H new ATOM 0 HB3 GLU A 84 6.245 -9.240 -5.687 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.135 -11.419 -6.829 1.00 0.00 H new ATOM 0 HG3 GLU A 84 5.557 -10.669 -8.303 1.00 0.00 H new ATOM 136 N ILE A 85 3.573 -7.217 -5.713 1.00 0.00 N ATOM 137 CA ILE A 85 3.122 -6.171 -4.806 1.00 0.00 C ATOM 138 C ILE A 85 1.662 -6.403 -4.435 1.00 0.00 C ATOM 139 O ILE A 85 1.233 -6.089 -3.326 1.00 0.00 O ATOM 140 CB ILE A 85 3.285 -4.790 -5.455 1.00 0.00 C ATOM 141 CG1 ILE A 85 4.760 -4.368 -5.429 1.00 0.00 C ATOM 142 CG2 ILE A 85 2.453 -3.762 -4.682 1.00 0.00 C ATOM 143 CD1 ILE A 85 5.096 -3.689 -4.093 1.00 0.00 C ATOM 0 H ILE A 85 3.734 -6.908 -6.672 1.00 0.00 H new ATOM 0 HA ILE A 85 3.732 -6.204 -3.903 1.00 0.00 H new ATOM 0 HB ILE A 85 2.944 -4.841 -6.489 1.00 0.00 H new ATOM 0 HG12 ILE A 85 5.398 -5.240 -5.572 1.00 0.00 H new ATOM 0 HG13 ILE A 85 4.965 -3.685 -6.254 1.00 0.00 H new ATOM 0 HG21 ILE A 85 2.568 -2.781 -5.142 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.403 -4.053 -4.705 1.00 0.00 H new ATOM 0 HG23 ILE A 85 2.795 -3.720 -3.648 1.00 0.00 H new ATOM 0 HD11 ILE A 85 6.146 -3.395 -4.088 1.00 0.00 H new ATOM 0 HD12 ILE A 85 4.471 -2.805 -3.967 1.00 0.00 H new ATOM 0 HD13 ILE A 85 4.910 -4.385 -3.275 1.00 0.00 H new ATOM 155 N ARG A 86 0.916 -6.982 -5.372 1.00 0.00 N ATOM 156 CA ARG A 86 -0.493 -7.287 -5.160 1.00 0.00 C ATOM 157 C ARG A 86 -0.652 -8.288 -4.018 1.00 0.00 C ATOM 158 O ARG A 86 -1.586 -8.196 -3.223 1.00 0.00 O ATOM 159 CB ARG A 86 -1.081 -7.858 -6.450 1.00 0.00 C ATOM 160 CG ARG A 86 -2.580 -8.096 -6.299 1.00 0.00 C ATOM 161 CD ARG A 86 -3.158 -8.455 -7.667 1.00 0.00 C ATOM 162 NE ARG A 86 -3.154 -7.285 -8.537 1.00 0.00 N ATOM 163 CZ ARG A 86 -3.574 -7.362 -9.795 1.00 0.00 C ATOM 164 NH1 ARG A 86 -3.996 -8.501 -10.273 1.00 0.00 N ATOM 165 NH2 ARG A 86 -3.565 -6.300 -10.552 1.00 0.00 N ATOM 0 H ARG A 86 1.268 -7.250 -6.291 1.00 0.00 H new ATOM 0 HA ARG A 86 -1.025 -6.375 -4.891 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -0.898 -7.169 -7.275 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -0.582 -8.794 -6.700 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -2.765 -8.901 -5.587 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -3.067 -7.204 -5.905 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.572 -9.255 -8.119 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -4.175 -8.830 -7.553 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.823 -6.391 -8.173 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.003 -9.331 -9.681 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -4.319 -8.561 -11.239 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -3.235 -5.410 -10.178 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -3.888 -6.359 -11.518 1.00 0.00 H new ATOM 179 N GLU A 87 0.273 -9.246 -3.946 1.00 0.00 N ATOM 180 CA GLU A 87 0.230 -10.263 -2.899 1.00 0.00 C ATOM 181 C GLU A 87 0.275 -9.596 -1.529 1.00 0.00 C ATOM 182 O GLU A 87 -0.389 -10.032 -0.591 1.00 0.00 O ATOM 183 CB GLU A 87 1.414 -11.224 -3.039 1.00 0.00 C ATOM 184 CG GLU A 87 1.208 -12.118 -4.263 1.00 0.00 C ATOM 185 CD GLU A 87 2.471 -12.925 -4.537 1.00 0.00 C ATOM 186 OE1 GLU A 87 3.501 -12.588 -3.975 1.00 0.00 O ATOM 187 OE2 GLU A 87 2.392 -13.871 -5.304 1.00 0.00 O ATOM 0 H GLU A 87 1.054 -9.338 -4.595 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.697 -10.827 -3.000 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.342 -10.661 -3.139 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.507 -11.835 -2.141 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.366 -12.790 -4.095 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.961 -11.508 -5.132 1.00 0.00 H new ATOM 194 N ALA A 88 1.053 -8.530 -1.429 1.00 0.00 N ATOM 195 CA ALA A 88 1.164 -7.796 -0.176 1.00 0.00 C ATOM 196 C ALA A 88 -0.201 -7.267 0.251 1.00 0.00 C ATOM 197 O ALA A 88 -0.497 -7.197 1.444 1.00 0.00 O ATOM 198 CB ALA A 88 2.144 -6.633 -0.330 1.00 0.00 C ATOM 0 H ALA A 88 1.614 -8.155 -2.194 1.00 0.00 H new ATOM 0 HA ALA A 88 1.536 -8.476 0.591 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.218 -6.092 0.614 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.126 -7.018 -0.605 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.788 -5.958 -1.108 1.00 0.00 H new ATOM 204 N PHE A 89 -1.049 -6.934 -0.720 1.00 0.00 N ATOM 205 CA PHE A 89 -2.393 -6.459 -0.403 1.00 0.00 C ATOM 206 C PHE A 89 -3.299 -7.636 -0.031 1.00 0.00 C ATOM 207 O PHE A 89 -4.139 -7.524 0.861 1.00 0.00 O ATOM 208 CB PHE A 89 -2.980 -5.686 -1.587 1.00 0.00 C ATOM 209 CG PHE A 89 -2.304 -4.337 -1.675 1.00 0.00 C ATOM 210 CD1 PHE A 89 -2.809 -3.252 -0.948 1.00 0.00 C ATOM 211 CD2 PHE A 89 -1.169 -4.173 -2.475 1.00 0.00 C ATOM 212 CE1 PHE A 89 -2.177 -2.005 -1.022 1.00 0.00 C ATOM 213 CE2 PHE A 89 -0.535 -2.926 -2.550 1.00 0.00 C ATOM 214 CZ PHE A 89 -1.040 -1.842 -1.823 1.00 0.00 C ATOM 0 H PHE A 89 -0.835 -6.983 -1.716 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.330 -5.785 0.452 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.831 -6.243 -2.512 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.055 -5.561 -1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.686 -3.377 -0.330 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -0.780 -5.010 -3.036 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.567 -1.168 -0.461 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.342 -2.801 -3.168 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.553 -0.880 -1.880 1.00 0.00 H new ATOM 224 N ARG A 90 -3.129 -8.762 -0.728 1.00 0.00 N ATOM 225 CA ARG A 90 -3.951 -9.945 -0.463 1.00 0.00 C ATOM 226 C ARG A 90 -4.007 -10.236 1.028 1.00 0.00 C ATOM 227 O ARG A 90 -4.996 -10.776 1.525 1.00 0.00 O ATOM 228 CB ARG A 90 -3.397 -11.172 -1.194 1.00 0.00 C ATOM 229 CG ARG A 90 -4.139 -11.385 -2.519 1.00 0.00 C ATOM 230 CD ARG A 90 -3.874 -10.205 -3.452 1.00 0.00 C ATOM 231 NE ARG A 90 -4.598 -10.378 -4.705 1.00 0.00 N ATOM 232 CZ ARG A 90 -5.881 -10.048 -4.808 1.00 0.00 C ATOM 233 NH1 ARG A 90 -6.515 -9.560 -3.777 1.00 0.00 N ATOM 234 NH2 ARG A 90 -6.507 -10.212 -5.942 1.00 0.00 N ATOM 0 H ARG A 90 -2.439 -8.879 -1.470 1.00 0.00 H new ATOM 0 HA ARG A 90 -4.956 -9.735 -0.829 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.332 -11.040 -1.384 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -3.502 -12.056 -0.565 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.809 -12.312 -2.987 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -5.209 -11.483 -2.336 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.182 -9.276 -2.971 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -2.805 -10.122 -3.650 1.00 0.00 H new ATOM 0 HE ARG A 90 -4.112 -10.759 -5.517 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.026 -9.432 -2.891 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -7.500 -9.307 -3.857 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -6.011 -10.593 -6.748 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -7.492 -9.959 -6.022 1.00 0.00 H new ATOM 248 N VAL A 91 -2.954 -9.866 1.745 1.00 0.00 N ATOM 249 CA VAL A 91 -2.912 -10.083 3.182 1.00 0.00 C ATOM 250 C VAL A 91 -4.059 -9.347 3.857 1.00 0.00 C ATOM 251 O VAL A 91 -4.671 -9.855 4.796 1.00 0.00 O ATOM 252 CB VAL A 91 -1.579 -9.595 3.751 1.00 0.00 C ATOM 253 CG1 VAL A 91 -1.666 -9.561 5.281 1.00 0.00 C ATOM 254 CG2 VAL A 91 -0.470 -10.563 3.332 1.00 0.00 C ATOM 0 H VAL A 91 -2.124 -9.418 1.357 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.011 -11.151 3.375 1.00 0.00 H new ATOM 0 HB VAL A 91 -1.360 -8.597 3.373 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -0.718 -9.214 5.692 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.463 -8.883 5.585 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -1.879 -10.562 5.656 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.483 -10.220 3.735 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.691 -11.558 3.718 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.412 -10.601 2.244 1.00 0.00 H new ATOM 264 N PHE A 92 -4.348 -8.148 3.368 1.00 0.00 N ATOM 265 CA PHE A 92 -5.428 -7.357 3.932 1.00 0.00 C ATOM 266 C PHE A 92 -6.748 -7.684 3.232 1.00 0.00 C ATOM 267 O PHE A 92 -7.823 -7.498 3.801 1.00 0.00 O ATOM 268 CB PHE A 92 -5.120 -5.864 3.784 1.00 0.00 C ATOM 269 CG PHE A 92 -3.708 -5.577 4.261 1.00 0.00 C ATOM 270 CD1 PHE A 92 -3.318 -5.909 5.567 1.00 0.00 C ATOM 271 CD2 PHE A 92 -2.785 -4.978 3.391 1.00 0.00 C ATOM 272 CE1 PHE A 92 -2.013 -5.641 5.999 1.00 0.00 C ATOM 273 CE2 PHE A 92 -1.481 -4.712 3.826 1.00 0.00 C ATOM 274 CZ PHE A 92 -1.096 -5.043 5.130 1.00 0.00 C ATOM 0 H PHE A 92 -3.855 -7.708 2.591 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.520 -7.600 4.991 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.229 -5.563 2.742 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.834 -5.278 4.362 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -4.025 -6.372 6.240 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -3.081 -4.722 2.384 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -1.715 -5.897 7.005 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -0.772 -4.251 3.155 1.00 0.00 H new ATOM 0 HZ PHE A 92 -0.090 -4.836 5.465 1.00 0.00 H new ATOM 284 N ASP A 93 -6.661 -8.163 1.989 1.00 0.00 N ATOM 285 CA ASP A 93 -7.859 -8.499 1.221 1.00 0.00 C ATOM 286 C ASP A 93 -8.313 -9.926 1.538 1.00 0.00 C ATOM 287 O ASP A 93 -8.334 -10.795 0.667 1.00 0.00 O ATOM 288 CB ASP A 93 -7.581 -8.374 -0.288 1.00 0.00 C ATOM 289 CG ASP A 93 -6.525 -7.306 -0.560 1.00 0.00 C ATOM 290 OD1 ASP A 93 -6.219 -6.552 0.345 1.00 0.00 O ATOM 291 OD2 ASP A 93 -6.032 -7.262 -1.676 1.00 0.00 O ATOM 0 H ASP A 93 -5.782 -8.325 1.498 1.00 0.00 H new ATOM 0 HA ASP A 93 -8.649 -7.801 1.499 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -7.243 -9.333 -0.680 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -8.503 -8.122 -0.812 1.00 0.00 H new ATOM 296 N LYS A 94 -8.683 -10.168 2.790 1.00 0.00 N ATOM 297 CA LYS A 94 -9.132 -11.495 3.194 1.00 0.00 C ATOM 298 C LYS A 94 -10.486 -11.844 2.591 1.00 0.00 C ATOM 299 O LYS A 94 -10.824 -13.017 2.439 1.00 0.00 O ATOM 300 CB LYS A 94 -9.213 -11.572 4.717 1.00 0.00 C ATOM 301 CG LYS A 94 -10.132 -10.469 5.262 1.00 0.00 C ATOM 302 CD LYS A 94 -10.683 -10.887 6.630 1.00 0.00 C ATOM 303 CE LYS A 94 -9.532 -11.079 7.620 1.00 0.00 C ATOM 304 NZ LYS A 94 -10.087 -11.400 8.966 1.00 0.00 N ATOM 0 H LYS A 94 -8.682 -9.472 3.535 1.00 0.00 H new ATOM 0 HA LYS A 94 -8.405 -12.217 2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.590 -12.549 5.018 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -8.216 -11.468 5.146 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -9.580 -9.533 5.352 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -10.953 -10.290 4.568 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -11.371 -10.128 7.002 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.251 -11.813 6.535 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -8.878 -11.883 7.283 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -8.926 -10.174 7.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.496 -10.958 9.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -11.058 -11.035 9.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -10.094 -12.431 9.102 1.00 0.00 H new ATOM 318 N ASP A 95 -11.257 -10.822 2.251 1.00 0.00 N ATOM 319 CA ASP A 95 -12.575 -11.041 1.666 1.00 0.00 C ATOM 320 C ASP A 95 -12.453 -11.537 0.228 1.00 0.00 C ATOM 321 O ASP A 95 -13.348 -12.209 -0.284 1.00 0.00 O ATOM 322 CB ASP A 95 -13.385 -9.743 1.698 1.00 0.00 C ATOM 323 CG ASP A 95 -12.665 -8.655 0.907 1.00 0.00 C ATOM 324 OD1 ASP A 95 -11.601 -8.937 0.381 1.00 0.00 O ATOM 325 OD2 ASP A 95 -13.189 -7.555 0.838 1.00 0.00 O ATOM 0 H ASP A 95 -10.998 -9.842 2.368 1.00 0.00 H new ATOM 0 HA ASP A 95 -13.088 -11.802 2.254 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -14.376 -9.913 1.278 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -13.528 -9.420 2.729 1.00 0.00 H new ATOM 330 N GLY A 96 -11.340 -11.204 -0.417 1.00 0.00 N ATOM 331 CA GLY A 96 -11.113 -11.624 -1.795 1.00 0.00 C ATOM 332 C GLY A 96 -12.060 -10.903 -2.750 1.00 0.00 C ATOM 333 O GLY A 96 -12.370 -11.407 -3.829 1.00 0.00 O ATOM 0 H GLY A 96 -10.586 -10.649 -0.012 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -10.080 -11.417 -2.076 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -11.257 -12.701 -1.879 1.00 0.00 H new ATOM 337 N ASN A 97 -12.518 -9.721 -2.345 1.00 0.00 N ATOM 338 CA ASN A 97 -13.432 -8.943 -3.176 1.00 0.00 C ATOM 339 C ASN A 97 -12.668 -7.939 -4.036 1.00 0.00 C ATOM 340 O ASN A 97 -13.248 -7.287 -4.905 1.00 0.00 O ATOM 341 CB ASN A 97 -14.434 -8.200 -2.291 1.00 0.00 C ATOM 342 CG ASN A 97 -15.655 -7.795 -3.110 1.00 0.00 C ATOM 343 OD1 ASN A 97 -16.069 -8.525 -4.010 1.00 0.00 O ATOM 344 ND2 ASN A 97 -16.259 -6.668 -2.850 1.00 0.00 N ATOM 0 H ASN A 97 -12.274 -9.285 -1.456 1.00 0.00 H new ATOM 0 HA ASN A 97 -13.963 -9.631 -3.834 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -14.738 -8.836 -1.460 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -13.965 -7.315 -1.861 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -17.076 -6.390 -3.393 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -15.914 -6.065 -2.103 1.00 0.00 H new ATOM 351 N GLY A 98 -11.368 -7.819 -3.788 1.00 0.00 N ATOM 352 CA GLY A 98 -10.541 -6.883 -4.546 1.00 0.00 C ATOM 353 C GLY A 98 -10.389 -5.556 -3.802 1.00 0.00 C ATOM 354 O GLY A 98 -9.870 -4.583 -4.350 1.00 0.00 O ATOM 0 H GLY A 98 -10.867 -8.351 -3.076 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -9.558 -7.320 -4.720 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -10.989 -6.706 -5.524 1.00 0.00 H new ATOM 358 N TYR A 99 -10.864 -5.524 -2.559 1.00 0.00 N ATOM 359 CA TYR A 99 -10.792 -4.302 -1.756 1.00 0.00 C ATOM 360 C TYR A 99 -10.281 -4.575 -0.345 1.00 0.00 C ATOM 361 O TYR A 99 -10.418 -5.679 0.179 1.00 0.00 O ATOM 362 CB TYR A 99 -12.172 -3.653 -1.647 1.00 0.00 C ATOM 363 CG TYR A 99 -12.722 -3.344 -3.016 1.00 0.00 C ATOM 364 CD1 TYR A 99 -13.114 -4.388 -3.861 1.00 0.00 C ATOM 365 CD2 TYR A 99 -12.829 -2.016 -3.447 1.00 0.00 C ATOM 366 CE1 TYR A 99 -13.615 -4.109 -5.135 1.00 0.00 C ATOM 367 CE2 TYR A 99 -13.331 -1.735 -4.725 1.00 0.00 C ATOM 368 CZ TYR A 99 -13.724 -2.782 -5.568 1.00 0.00 C ATOM 369 OH TYR A 99 -14.218 -2.506 -6.826 1.00 0.00 O ATOM 0 H TYR A 99 -11.298 -6.318 -2.089 1.00 0.00 H new ATOM 0 HA TYR A 99 -10.094 -3.635 -2.263 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -12.853 -4.320 -1.118 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -12.104 -2.736 -1.061 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -13.029 -5.412 -3.528 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -12.525 -1.210 -2.796 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -13.918 -4.916 -5.785 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -13.415 -0.712 -5.060 1.00 0.00 H new ATOM 0 HH TYR A 99 -14.228 -1.536 -6.968 1.00 0.00 H new ATOM 379 N ILE A 100 -9.728 -3.532 0.273 1.00 0.00 N ATOM 380 CA ILE A 100 -9.234 -3.622 1.641 1.00 0.00 C ATOM 381 C ILE A 100 -9.804 -2.439 2.419 1.00 0.00 C ATOM 382 O ILE A 100 -9.947 -1.350 1.867 1.00 0.00 O ATOM 383 CB ILE A 100 -7.692 -3.594 1.666 1.00 0.00 C ATOM 384 CG1 ILE A 100 -7.173 -2.188 1.994 1.00 0.00 C ATOM 385 CG2 ILE A 100 -7.167 -3.987 0.289 1.00 0.00 C ATOM 386 CD1 ILE A 100 -5.662 -2.133 1.767 1.00 0.00 C ATOM 0 H ILE A 100 -9.612 -2.614 -0.156 1.00 0.00 H new ATOM 0 HA ILE A 100 -9.550 -4.562 2.095 1.00 0.00 H new ATOM 0 HB ILE A 100 -7.348 -4.289 2.432 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -7.672 -1.450 1.367 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -7.405 -1.936 3.029 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -6.077 -3.970 0.297 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.513 -4.990 0.041 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -7.536 -3.282 -0.456 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -5.295 -1.133 2.000 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -5.170 -2.860 2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.442 -2.366 0.725 1.00 0.00 H new ATOM 398 N SER A 101 -10.141 -2.643 3.685 1.00 0.00 N ATOM 399 CA SER A 101 -10.703 -1.552 4.473 1.00 0.00 C ATOM 400 C SER A 101 -9.719 -0.384 4.539 1.00 0.00 C ATOM 401 O SER A 101 -8.531 -0.582 4.743 1.00 0.00 O ATOM 402 CB SER A 101 -11.010 -2.040 5.890 1.00 0.00 C ATOM 403 OG SER A 101 -11.499 -0.954 6.665 1.00 0.00 O ATOM 0 H SER A 101 -10.039 -3.529 4.180 1.00 0.00 H new ATOM 0 HA SER A 101 -11.624 -1.215 3.996 1.00 0.00 H new ATOM 0 HB2 SER A 101 -11.748 -2.841 5.859 1.00 0.00 H new ATOM 0 HB3 SER A 101 -10.111 -2.453 6.348 1.00 0.00 H new ATOM 0 HG SER A 101 -11.903 -0.286 6.073 1.00 0.00 H new ATOM 409 N ALA A 102 -10.216 0.832 4.360 1.00 0.00 N ATOM 410 CA ALA A 102 -9.356 2.012 4.410 1.00 0.00 C ATOM 411 C ALA A 102 -8.743 2.183 5.802 1.00 0.00 C ATOM 412 O ALA A 102 -7.600 2.619 5.943 1.00 0.00 O ATOM 413 CB ALA A 102 -10.159 3.265 4.046 1.00 0.00 C ATOM 0 H ALA A 102 -11.200 1.029 4.180 1.00 0.00 H new ATOM 0 HA ALA A 102 -8.550 1.874 3.689 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -9.508 4.139 4.086 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -10.562 3.159 3.039 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -10.979 3.390 4.753 1.00 0.00 H new ATOM 419 N ALA A 103 -9.536 1.879 6.822 1.00 0.00 N ATOM 420 CA ALA A 103 -9.101 2.040 8.210 1.00 0.00 C ATOM 421 C ALA A 103 -7.854 1.212 8.541 1.00 0.00 C ATOM 422 O ALA A 103 -6.961 1.694 9.238 1.00 0.00 O ATOM 423 CB ALA A 103 -10.235 1.637 9.153 1.00 0.00 C ATOM 0 H ALA A 103 -10.485 1.519 6.717 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.842 3.090 8.343 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -9.909 1.758 10.186 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.103 2.270 8.970 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.502 0.595 8.976 1.00 0.00 H new ATOM 429 N GLU A 104 -7.789 -0.027 8.063 1.00 0.00 N ATOM 430 CA GLU A 104 -6.629 -0.869 8.358 1.00 0.00 C ATOM 431 C GLU A 104 -5.383 -0.328 7.668 1.00 0.00 C ATOM 432 O GLU A 104 -4.265 -0.501 8.154 1.00 0.00 O ATOM 433 CB GLU A 104 -6.882 -2.316 7.922 1.00 0.00 C ATOM 434 CG GLU A 104 -6.692 -2.461 6.413 1.00 0.00 C ATOM 435 CD GLU A 104 -5.260 -2.868 6.088 1.00 0.00 C ATOM 436 OE1 GLU A 104 -4.813 -3.865 6.624 1.00 0.00 O ATOM 437 OE2 GLU A 104 -4.631 -2.172 5.308 1.00 0.00 O ATOM 0 H GLU A 104 -8.505 -0.464 7.484 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.468 -0.853 9.436 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.199 -2.985 8.446 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.894 -2.613 8.197 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.385 -3.207 6.024 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.929 -1.518 5.919 1.00 0.00 H new ATOM 444 N LEU A 105 -5.584 0.328 6.533 1.00 0.00 N ATOM 445 CA LEU A 105 -4.468 0.893 5.783 1.00 0.00 C ATOM 446 C LEU A 105 -3.768 1.955 6.627 1.00 0.00 C ATOM 447 O LEU A 105 -2.542 1.966 6.739 1.00 0.00 O ATOM 448 CB LEU A 105 -4.990 1.524 4.483 1.00 0.00 C ATOM 449 CG LEU A 105 -3.827 1.995 3.595 1.00 0.00 C ATOM 450 CD1 LEU A 105 -3.117 0.795 2.954 1.00 0.00 C ATOM 451 CD2 LEU A 105 -4.374 2.904 2.493 1.00 0.00 C ATOM 0 H LEU A 105 -6.501 0.482 6.113 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.758 0.103 5.540 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -5.596 0.799 3.940 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.638 2.368 4.719 1.00 0.00 H new ATOM 0 HG LEU A 105 -3.111 2.538 4.211 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.297 1.149 2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -2.724 0.145 3.736 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.826 0.238 2.341 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.554 3.242 1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.095 2.352 1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.864 3.767 2.943 1.00 0.00 H new ATOM 463 N ARG A 106 -4.558 2.860 7.204 1.00 0.00 N ATOM 464 CA ARG A 106 -3.995 3.934 8.018 1.00 0.00 C ATOM 465 C ARG A 106 -3.186 3.362 9.176 1.00 0.00 C ATOM 466 O ARG A 106 -2.041 3.753 9.390 1.00 0.00 O ATOM 467 CB ARG A 106 -5.122 4.813 8.573 1.00 0.00 C ATOM 468 CG ARG A 106 -4.530 5.971 9.387 1.00 0.00 C ATOM 469 CD ARG A 106 -4.636 5.668 10.886 1.00 0.00 C ATOM 470 NE ARG A 106 -6.033 5.526 11.280 1.00 0.00 N ATOM 471 CZ ARG A 106 -6.364 5.127 12.503 1.00 0.00 C ATOM 472 NH1 ARG A 106 -5.432 4.858 13.377 1.00 0.00 N ATOM 473 NH2 ARG A 106 -7.621 5.005 12.834 1.00 0.00 N ATOM 0 H ARG A 106 -5.575 2.871 7.124 1.00 0.00 H new ATOM 0 HA ARG A 106 -3.337 4.533 7.388 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -5.726 5.204 7.754 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -5.784 4.217 9.201 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.486 6.123 9.112 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -5.059 6.896 9.156 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -4.092 4.752 11.117 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -4.170 6.470 11.459 1.00 0.00 H new ATOM 0 HE ARG A 106 -6.768 5.737 10.605 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -4.449 4.954 13.121 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -5.687 4.552 14.316 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -8.350 5.216 12.153 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -7.874 4.698 13.774 1.00 0.00 H new ATOM 487 N HIS A 107 -3.773 2.430 9.918 1.00 0.00 N ATOM 488 CA HIS A 107 -3.074 1.819 11.045 1.00 0.00 C ATOM 489 C HIS A 107 -1.818 1.100 10.571 1.00 0.00 C ATOM 490 O HIS A 107 -0.741 1.242 11.149 1.00 0.00 O ATOM 491 CB HIS A 107 -3.994 0.816 11.741 1.00 0.00 C ATOM 492 CG HIS A 107 -3.225 0.103 12.814 1.00 0.00 C ATOM 493 ND1 HIS A 107 -3.148 0.576 14.116 1.00 0.00 N ATOM 494 CD2 HIS A 107 -2.464 -1.036 12.783 1.00 0.00 C ATOM 495 CE1 HIS A 107 -2.363 -0.271 14.807 1.00 0.00 C ATOM 496 NE2 HIS A 107 -1.920 -1.271 14.042 1.00 0.00 N ATOM 0 H HIS A 107 -4.720 2.083 9.763 1.00 0.00 H new ATOM 0 HA HIS A 107 -2.790 2.607 11.742 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -4.852 1.331 12.173 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -4.383 0.099 11.018 1.00 0.00 H new ATOM 0 HD1 HIS A 107 -3.603 1.412 14.482 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -2.310 -1.657 11.913 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.121 -0.156 15.853 1.00 0.00 H new ATOM 505 N VAL A 108 -1.984 0.320 9.515 1.00 0.00 N ATOM 506 CA VAL A 108 -0.896 -0.456 8.932 1.00 0.00 C ATOM 507 C VAL A 108 0.233 0.455 8.443 1.00 0.00 C ATOM 508 O VAL A 108 1.411 0.121 8.569 1.00 0.00 O ATOM 509 CB VAL A 108 -1.461 -1.280 7.764 1.00 0.00 C ATOM 510 CG1 VAL A 108 -0.342 -1.947 6.956 1.00 0.00 C ATOM 511 CG2 VAL A 108 -2.380 -2.363 8.327 1.00 0.00 C ATOM 0 H VAL A 108 -2.877 0.205 9.036 1.00 0.00 H new ATOM 0 HA VAL A 108 -0.476 -1.116 9.691 1.00 0.00 H new ATOM 0 HB VAL A 108 -2.008 -0.610 7.101 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.777 -2.522 6.138 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.320 -1.182 6.550 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.228 -2.613 7.604 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -2.788 -2.956 7.508 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -1.813 -3.010 8.996 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -3.196 -1.897 8.879 1.00 0.00 H new ATOM 521 N MET A 109 -0.139 1.597 7.879 1.00 0.00 N ATOM 522 CA MET A 109 0.848 2.545 7.364 1.00 0.00 C ATOM 523 C MET A 109 1.523 3.318 8.488 1.00 0.00 C ATOM 524 O MET A 109 2.638 3.805 8.321 1.00 0.00 O ATOM 525 CB MET A 109 0.181 3.533 6.401 1.00 0.00 C ATOM 526 CG MET A 109 0.273 2.991 4.976 1.00 0.00 C ATOM 527 SD MET A 109 -0.128 1.225 4.981 1.00 0.00 S ATOM 528 CE MET A 109 0.526 0.832 3.343 1.00 0.00 C ATOM 0 H MET A 109 -1.109 1.890 7.766 1.00 0.00 H new ATOM 0 HA MET A 109 1.609 1.970 6.837 1.00 0.00 H new ATOM 0 HB2 MET A 109 -0.862 3.681 6.679 1.00 0.00 H new ATOM 0 HB3 MET A 109 0.669 4.506 6.464 1.00 0.00 H new ATOM 0 HG2 MET A 109 -0.415 3.530 4.324 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.276 3.147 4.579 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.428 -0.238 3.159 1.00 0.00 H new ATOM 0 HE2 MET A 109 -0.033 1.383 2.586 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.578 1.114 3.294 1.00 0.00 H new ATOM 538 N THR A 110 0.842 3.458 9.616 1.00 0.00 N ATOM 539 CA THR A 110 1.401 4.216 10.729 1.00 0.00 C ATOM 540 C THR A 110 1.907 3.306 11.853 1.00 0.00 C ATOM 541 O THR A 110 2.655 3.760 12.718 1.00 0.00 O ATOM 542 CB THR A 110 0.337 5.176 11.272 1.00 0.00 C ATOM 543 OG1 THR A 110 -0.736 4.428 11.828 1.00 0.00 O ATOM 544 CG2 THR A 110 -0.191 6.054 10.135 1.00 0.00 C ATOM 0 H THR A 110 -0.084 3.064 9.785 1.00 0.00 H new ATOM 0 HA THR A 110 2.259 4.776 10.356 1.00 0.00 H new ATOM 0 HB THR A 110 0.780 5.808 12.042 1.00 0.00 H new ATOM 0 HG1 THR A 110 -1.316 4.102 11.108 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.948 6.736 10.523 1.00 0.00 H new ATOM 0 HG22 THR A 110 0.631 6.629 9.708 1.00 0.00 H new ATOM 0 HG23 THR A 110 -0.633 5.423 9.363 1.00 0.00 H new ATOM 552 N ASN A 111 1.478 2.039 11.863 1.00 0.00 N ATOM 553 CA ASN A 111 1.892 1.114 12.927 1.00 0.00 C ATOM 554 C ASN A 111 2.790 -0.022 12.426 1.00 0.00 C ATOM 555 O ASN A 111 3.833 -0.297 13.019 1.00 0.00 O ATOM 556 CB ASN A 111 0.648 0.515 13.578 1.00 0.00 C ATOM 557 CG ASN A 111 -0.268 1.635 14.058 1.00 0.00 C ATOM 558 OD1 ASN A 111 -1.286 1.919 13.428 1.00 0.00 O ATOM 559 ND2 ASN A 111 0.035 2.290 15.144 1.00 0.00 N ATOM 0 H ASN A 111 0.857 1.635 11.162 1.00 0.00 H new ATOM 0 HA ASN A 111 2.477 1.692 13.643 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.121 -0.119 12.864 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.934 -0.119 14.417 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.573 3.040 15.473 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.880 2.052 15.664 1.00 0.00 H new ATOM 566 N LEU A 112 2.379 -0.697 11.358 1.00 0.00 N ATOM 567 CA LEU A 112 3.162 -1.819 10.830 1.00 0.00 C ATOM 568 C LEU A 112 4.205 -1.346 9.823 1.00 0.00 C ATOM 569 O LEU A 112 3.986 -0.371 9.109 1.00 0.00 O ATOM 570 CB LEU A 112 2.239 -2.825 10.146 1.00 0.00 C ATOM 571 CG LEU A 112 1.191 -3.347 11.134 1.00 0.00 C ATOM 572 CD1 LEU A 112 0.247 -4.302 10.404 1.00 0.00 C ATOM 573 CD2 LEU A 112 1.882 -4.096 12.279 1.00 0.00 C ATOM 0 H LEU A 112 1.522 -0.495 10.844 1.00 0.00 H new ATOM 0 HA LEU A 112 3.673 -2.287 11.671 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.744 -2.355 9.296 1.00 0.00 H new ATOM 0 HB3 LEU A 112 2.824 -3.657 9.754 1.00 0.00 H new ATOM 0 HG LEU A 112 0.629 -2.507 11.542 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.502 -4.677 11.102 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.248 -3.773 9.590 1.00 0.00 H new ATOM 0 HD13 LEU A 112 0.817 -5.138 9.999 1.00 0.00 H new ATOM 0 HD21 LEU A 112 1.131 -4.465 12.978 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.446 -4.937 11.876 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.561 -3.420 12.799 1.00 0.00 H new ATOM 585 N GLY A 113 5.333 -2.060 9.766 1.00 0.00 N ATOM 586 CA GLY A 113 6.409 -1.722 8.836 1.00 0.00 C ATOM 587 C GLY A 113 6.619 -0.218 8.772 1.00 0.00 C ATOM 588 O GLY A 113 5.876 0.481 8.093 1.00 0.00 O ATOM 0 H GLY A 113 5.522 -2.873 10.352 1.00 0.00 H new ATOM 0 HA2 GLY A 113 7.332 -2.209 9.150 1.00 0.00 H new ATOM 0 HA3 GLY A 113 6.169 -2.102 7.843 1.00 0.00 H new ATOM 592 N GLU A 114 7.645 0.280 9.456 1.00 0.00 N ATOM 593 CA GLU A 114 7.927 1.710 9.443 1.00 0.00 C ATOM 594 C GLU A 114 6.674 2.501 9.811 1.00 0.00 C ATOM 595 O GLU A 114 5.570 1.959 9.822 1.00 0.00 O ATOM 596 CB GLU A 114 8.416 2.133 8.057 1.00 0.00 C ATOM 597 CG GLU A 114 9.826 1.586 7.826 1.00 0.00 C ATOM 598 CD GLU A 114 10.251 1.832 6.382 1.00 0.00 C ATOM 599 OE1 GLU A 114 9.392 2.167 5.582 1.00 0.00 O ATOM 600 OE2 GLU A 114 11.427 1.679 6.097 1.00 0.00 O ATOM 0 H GLU A 114 8.287 -0.278 10.019 1.00 0.00 H new ATOM 0 HA GLU A 114 8.705 1.919 10.178 1.00 0.00 H new ATOM 0 HB2 GLU A 114 7.738 1.758 7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.418 3.220 7.976 1.00 0.00 H new ATOM 0 HG2 GLU A 114 10.528 2.067 8.507 1.00 0.00 H new ATOM 0 HG3 GLU A 114 9.851 0.518 8.044 1.00 0.00 H new ATOM 607 N LYS A 115 6.851 3.779 10.132 1.00 0.00 N ATOM 608 CA LYS A 115 5.721 4.617 10.513 1.00 0.00 C ATOM 609 C LYS A 115 5.633 5.856 9.627 1.00 0.00 C ATOM 610 O LYS A 115 6.541 6.687 9.618 1.00 0.00 O ATOM 611 CB LYS A 115 5.879 5.055 11.970 1.00 0.00 C ATOM 612 CG LYS A 115 5.876 3.825 12.881 1.00 0.00 C ATOM 613 CD LYS A 115 6.029 4.268 14.337 1.00 0.00 C ATOM 614 CE LYS A 115 6.034 3.041 15.250 1.00 0.00 C ATOM 615 NZ LYS A 115 6.192 3.476 16.667 1.00 0.00 N ATOM 0 H LYS A 115 7.755 4.252 10.136 1.00 0.00 H new ATOM 0 HA LYS A 115 4.808 4.035 10.390 1.00 0.00 H new ATOM 0 HB2 LYS A 115 6.809 5.610 12.094 1.00 0.00 H new ATOM 0 HB3 LYS A 115 5.067 5.727 12.248 1.00 0.00 H new ATOM 0 HG2 LYS A 115 4.947 3.268 12.755 1.00 0.00 H new ATOM 0 HG3 LYS A 115 6.690 3.154 12.606 1.00 0.00 H new ATOM 0 HD2 LYS A 115 6.955 4.830 14.461 1.00 0.00 H new ATOM 0 HD3 LYS A 115 5.212 4.935 14.612 1.00 0.00 H new ATOM 0 HE2 LYS A 115 5.106 2.482 15.131 1.00 0.00 H new ATOM 0 HE3 LYS A 115 6.847 2.371 14.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 6.195 2.642 17.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 7.089 3.991 16.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 5.402 4.099 16.929 1.00 0.00 H new ATOM 629 N LEU A 116 4.523 5.990 8.904 1.00 0.00 N ATOM 630 CA LEU A 116 4.324 7.155 8.051 1.00 0.00 C ATOM 631 C LEU A 116 3.719 8.277 8.890 1.00 0.00 C ATOM 632 O LEU A 116 3.061 8.012 9.897 1.00 0.00 O ATOM 633 CB LEU A 116 3.370 6.836 6.885 1.00 0.00 C ATOM 634 CG LEU A 116 4.122 6.205 5.700 1.00 0.00 C ATOM 635 CD1 LEU A 116 5.097 7.214 5.083 1.00 0.00 C ATOM 636 CD2 LEU A 116 4.902 4.984 6.179 1.00 0.00 C ATOM 0 H LEU A 116 3.758 5.315 8.892 1.00 0.00 H new ATOM 0 HA LEU A 116 5.288 7.452 7.637 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.590 6.155 7.227 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.874 7.750 6.558 1.00 0.00 H new ATOM 0 HG LEU A 116 3.393 5.908 4.946 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.620 6.750 4.247 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.544 8.084 4.728 1.00 0.00 H new ATOM 0 HD13 LEU A 116 5.821 7.527 5.835 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.434 4.539 5.338 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.619 5.287 6.942 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.211 4.253 6.599 1.00 0.00 H new ATOM 648 N THR A 117 3.923 9.522 8.479 1.00 0.00 N ATOM 649 CA THR A 117 3.368 10.648 9.218 1.00 0.00 C ATOM 650 C THR A 117 1.983 10.991 8.680 1.00 0.00 C ATOM 651 O THR A 117 1.550 10.443 7.667 1.00 0.00 O ATOM 652 CB THR A 117 4.290 11.863 9.107 1.00 0.00 C ATOM 653 OG1 THR A 117 4.367 12.274 7.752 1.00 0.00 O ATOM 654 CG2 THR A 117 5.686 11.493 9.611 1.00 0.00 C ATOM 0 H THR A 117 4.461 9.776 7.650 1.00 0.00 H new ATOM 0 HA THR A 117 3.283 10.370 10.269 1.00 0.00 H new ATOM 0 HB THR A 117 3.892 12.678 9.711 1.00 0.00 H new ATOM 0 HG1 THR A 117 4.690 13.198 7.708 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.343 12.359 9.532 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.625 11.178 10.653 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.086 10.678 9.008 1.00 0.00 H new ATOM 662 N ASP A 118 1.286 11.890 9.365 1.00 0.00 N ATOM 663 CA ASP A 118 -0.053 12.281 8.940 1.00 0.00 C ATOM 664 C ASP A 118 -0.025 12.842 7.521 1.00 0.00 C ATOM 665 O ASP A 118 -0.895 12.535 6.707 1.00 0.00 O ATOM 666 CB ASP A 118 -0.613 13.337 9.894 1.00 0.00 C ATOM 667 CG ASP A 118 -2.041 13.697 9.497 1.00 0.00 C ATOM 668 OD1 ASP A 118 -2.902 12.842 9.622 1.00 0.00 O ATOM 669 OD2 ASP A 118 -2.251 14.820 9.074 1.00 0.00 O ATOM 0 H ASP A 118 1.621 12.357 10.208 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.691 11.397 8.956 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.596 12.960 10.917 1.00 0.00 H new ATOM 0 HB3 ASP A 118 0.015 14.228 9.872 1.00 0.00 H new ATOM 674 N GLU A 119 0.973 13.669 7.234 1.00 0.00 N ATOM 675 CA GLU A 119 1.094 14.273 5.911 1.00 0.00 C ATOM 676 C GLU A 119 1.280 13.202 4.836 1.00 0.00 C ATOM 677 O GLU A 119 0.690 13.285 3.761 1.00 0.00 O ATOM 678 CB GLU A 119 2.279 15.240 5.885 1.00 0.00 C ATOM 679 CG GLU A 119 1.951 16.474 6.728 1.00 0.00 C ATOM 680 CD GLU A 119 3.185 17.360 6.855 1.00 0.00 C ATOM 681 OE1 GLU A 119 4.259 16.899 6.506 1.00 0.00 O ATOM 682 OE2 GLU A 119 3.038 18.486 7.300 1.00 0.00 O ATOM 0 H GLU A 119 1.705 13.936 7.893 1.00 0.00 H new ATOM 0 HA GLU A 119 0.174 14.818 5.700 1.00 0.00 H new ATOM 0 HB2 GLU A 119 3.171 14.749 6.273 1.00 0.00 H new ATOM 0 HB3 GLU A 119 2.498 15.535 4.859 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.137 17.034 6.267 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.609 16.169 7.717 1.00 0.00 H new ATOM 689 N GLU A 120 2.077 12.183 5.144 1.00 0.00 N ATOM 690 CA GLU A 120 2.294 11.093 4.203 1.00 0.00 C ATOM 691 C GLU A 120 1.043 10.228 4.093 1.00 0.00 C ATOM 692 O GLU A 120 0.662 9.798 3.004 1.00 0.00 O ATOM 693 CB GLU A 120 3.472 10.235 4.654 1.00 0.00 C ATOM 694 CG GLU A 120 4.783 10.925 4.276 1.00 0.00 C ATOM 695 CD GLU A 120 4.648 12.439 4.407 1.00 0.00 C ATOM 696 OE1 GLU A 120 4.358 12.896 5.498 1.00 0.00 O ATOM 697 OE2 GLU A 120 4.842 13.120 3.414 1.00 0.00 O ATOM 0 H GLU A 120 2.577 12.091 6.028 1.00 0.00 H new ATOM 0 HA GLU A 120 2.516 11.521 3.226 1.00 0.00 H new ATOM 0 HB2 GLU A 120 3.429 10.078 5.732 1.00 0.00 H new ATOM 0 HB3 GLU A 120 3.419 9.252 4.187 1.00 0.00 H new ATOM 0 HG2 GLU A 120 5.587 10.569 4.920 1.00 0.00 H new ATOM 0 HG3 GLU A 120 5.055 10.666 3.253 1.00 0.00 H new ATOM 704 N VAL A 121 0.409 9.983 5.237 1.00 0.00 N ATOM 705 CA VAL A 121 -0.804 9.176 5.292 1.00 0.00 C ATOM 706 C VAL A 121 -1.952 9.859 4.553 1.00 0.00 C ATOM 707 O VAL A 121 -2.720 9.206 3.847 1.00 0.00 O ATOM 708 CB VAL A 121 -1.192 8.945 6.758 1.00 0.00 C ATOM 709 CG1 VAL A 121 -2.575 8.312 6.826 1.00 0.00 C ATOM 710 CG2 VAL A 121 -0.183 8.007 7.430 1.00 0.00 C ATOM 0 H VAL A 121 0.719 10.335 6.143 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.610 8.221 4.805 1.00 0.00 H new ATOM 0 HB VAL A 121 -1.195 9.905 7.275 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.849 8.148 7.868 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -3.302 8.976 6.359 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.565 7.358 6.299 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -0.469 7.850 8.470 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -0.173 7.050 6.908 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.811 8.453 7.390 1.00 0.00 H new ATOM 720 N ASP A 122 -2.072 11.170 4.731 1.00 0.00 N ATOM 721 CA ASP A 122 -3.143 11.928 4.091 1.00 0.00 C ATOM 722 C ASP A 122 -3.076 11.800 2.568 1.00 0.00 C ATOM 723 O ASP A 122 -4.101 11.637 1.906 1.00 0.00 O ATOM 724 CB ASP A 122 -3.039 13.403 4.485 1.00 0.00 C ATOM 725 CG ASP A 122 -4.197 14.187 3.879 1.00 0.00 C ATOM 726 OD1 ASP A 122 -4.929 13.611 3.090 1.00 0.00 O ATOM 727 OD2 ASP A 122 -4.335 15.353 4.211 1.00 0.00 O ATOM 0 H ASP A 122 -1.445 11.728 5.310 1.00 0.00 H new ATOM 0 HA ASP A 122 -4.096 11.521 4.429 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -3.052 13.500 5.571 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.090 13.814 4.140 1.00 0.00 H new ATOM 732 N GLU A 123 -1.866 11.870 2.022 1.00 0.00 N ATOM 733 CA GLU A 123 -1.676 11.758 0.576 1.00 0.00 C ATOM 734 C GLU A 123 -2.151 10.398 0.083 1.00 0.00 C ATOM 735 O GLU A 123 -2.734 10.274 -0.996 1.00 0.00 O ATOM 736 CB GLU A 123 -0.191 11.896 0.228 1.00 0.00 C ATOM 737 CG GLU A 123 0.291 13.312 0.526 1.00 0.00 C ATOM 738 CD GLU A 123 -0.330 14.295 -0.461 1.00 0.00 C ATOM 739 OE1 GLU A 123 -0.833 13.845 -1.478 1.00 0.00 O ATOM 740 OE2 GLU A 123 -0.292 15.483 -0.187 1.00 0.00 O ATOM 0 H GLU A 123 -1.006 12.003 2.553 1.00 0.00 H new ATOM 0 HA GLU A 123 -2.252 12.551 0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.393 11.177 0.803 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -0.034 11.665 -0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 123 0.022 13.589 1.545 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.378 13.356 0.460 1.00 0.00 H new ATOM 747 N MET A 124 -1.907 9.388 0.901 1.00 0.00 N ATOM 748 CA MET A 124 -2.309 8.028 0.586 1.00 0.00 C ATOM 749 C MET A 124 -3.802 7.850 0.831 1.00 0.00 C ATOM 750 O MET A 124 -4.462 7.070 0.150 1.00 0.00 O ATOM 751 CB MET A 124 -1.527 7.070 1.481 1.00 0.00 C ATOM 752 CG MET A 124 -0.030 7.291 1.265 1.00 0.00 C ATOM 753 SD MET A 124 0.687 5.828 0.483 1.00 0.00 S ATOM 754 CE MET A 124 0.394 4.697 1.858 1.00 0.00 C ATOM 0 H MET A 124 -1.428 9.486 1.796 1.00 0.00 H new ATOM 0 HA MET A 124 -2.101 7.819 -0.463 1.00 0.00 H new ATOM 0 HB2 MET A 124 -1.785 7.238 2.527 1.00 0.00 H new ATOM 0 HB3 MET A 124 -1.792 6.038 1.249 1.00 0.00 H new ATOM 0 HG2 MET A 124 0.133 8.168 0.639 1.00 0.00 H new ATOM 0 HG3 MET A 124 0.461 7.485 2.218 1.00 0.00 H new ATOM 0 HE1 MET A 124 1.239 4.015 1.954 1.00 0.00 H new ATOM 0 HE2 MET A 124 0.281 5.267 2.780 1.00 0.00 H new ATOM 0 HE3 MET A 124 -0.515 4.125 1.671 1.00 0.00 H new ATOM 764 N ILE A 125 -4.317 8.561 1.832 1.00 0.00 N ATOM 765 CA ILE A 125 -5.728 8.452 2.188 1.00 0.00 C ATOM 766 C ILE A 125 -6.621 8.998 1.075 1.00 0.00 C ATOM 767 O ILE A 125 -7.705 8.470 0.831 1.00 0.00 O ATOM 768 CB ILE A 125 -5.992 9.206 3.519 1.00 0.00 C ATOM 769 CG1 ILE A 125 -6.712 8.311 4.549 1.00 0.00 C ATOM 770 CG2 ILE A 125 -6.843 10.465 3.292 1.00 0.00 C ATOM 771 CD1 ILE A 125 -5.701 7.822 5.588 1.00 0.00 C ATOM 0 H ILE A 125 -3.783 9.213 2.406 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.972 7.398 2.320 1.00 0.00 H new ATOM 0 HB ILE A 125 -5.014 9.489 3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -7.511 8.869 5.037 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -7.176 7.461 4.048 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -7.009 10.969 4.244 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -6.322 11.138 2.611 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.803 10.182 2.859 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -6.206 7.189 6.318 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -4.917 7.249 5.092 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -5.258 8.679 6.096 1.00 0.00 H new ATOM 783 N ARG A 126 -6.176 10.064 0.411 1.00 0.00 N ATOM 784 CA ARG A 126 -6.977 10.658 -0.654 1.00 0.00 C ATOM 785 C ARG A 126 -7.156 9.659 -1.791 1.00 0.00 C ATOM 786 O ARG A 126 -8.275 9.253 -2.104 1.00 0.00 O ATOM 787 CB ARG A 126 -6.282 11.917 -1.182 1.00 0.00 C ATOM 788 CG ARG A 126 -7.319 12.881 -1.771 1.00 0.00 C ATOM 789 CD ARG A 126 -7.882 13.779 -0.664 1.00 0.00 C ATOM 790 NE ARG A 126 -8.855 14.713 -1.218 1.00 0.00 N ATOM 791 CZ ARG A 126 -8.472 15.864 -1.763 1.00 0.00 C ATOM 792 NH1 ARG A 126 -7.206 16.175 -1.810 1.00 0.00 N ATOM 793 NH2 ARG A 126 -9.364 16.683 -2.248 1.00 0.00 N ATOM 0 H ARG A 126 -5.283 10.525 0.588 1.00 0.00 H new ATOM 0 HA ARG A 126 -7.956 10.924 -0.255 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -5.736 12.406 -0.375 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -5.551 11.646 -1.944 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -6.861 13.492 -2.549 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -8.126 12.319 -2.241 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -8.352 13.168 0.106 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -7.072 14.329 -0.185 1.00 0.00 H new ATOM 0 HE ARG A 126 -9.847 14.479 -1.187 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -6.509 15.535 -1.429 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -6.913 17.058 -2.228 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -10.354 16.440 -2.209 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -9.072 17.566 -2.666 1.00 0.00 H new ATOM 807 N GLU A 127 -6.049 9.286 -2.422 1.00 0.00 N ATOM 808 CA GLU A 127 -6.091 8.356 -3.545 1.00 0.00 C ATOM 809 C GLU A 127 -6.693 7.013 -3.142 1.00 0.00 C ATOM 810 O GLU A 127 -6.955 6.163 -3.993 1.00 0.00 O ATOM 811 CB GLU A 127 -4.672 8.148 -4.083 1.00 0.00 C ATOM 812 CG GLU A 127 -4.213 9.422 -4.797 1.00 0.00 C ATOM 813 CD GLU A 127 -2.732 9.329 -5.145 1.00 0.00 C ATOM 814 OE1 GLU A 127 -2.055 8.508 -4.551 1.00 0.00 O ATOM 815 OE2 GLU A 127 -2.294 10.088 -5.995 1.00 0.00 O ATOM 0 H GLU A 127 -5.114 9.612 -2.177 1.00 0.00 H new ATOM 0 HA GLU A 127 -6.727 8.785 -4.319 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.992 7.910 -3.266 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.651 7.303 -4.772 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -4.798 9.569 -5.705 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -4.390 10.288 -4.159 1.00 0.00 H new ATOM 822 N ALA A 128 -6.914 6.824 -1.847 1.00 0.00 N ATOM 823 CA ALA A 128 -7.489 5.573 -1.360 1.00 0.00 C ATOM 824 C ALA A 128 -8.983 5.490 -1.682 1.00 0.00 C ATOM 825 O ALA A 128 -9.389 4.684 -2.515 1.00 0.00 O ATOM 826 CB ALA A 128 -7.282 5.482 0.150 1.00 0.00 C ATOM 0 H ALA A 128 -6.707 7.511 -1.122 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.989 4.742 -1.858 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -7.709 4.550 0.520 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -6.215 5.506 0.373 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -7.774 6.325 0.636 1.00 0.00 H new ATOM 832 N ASP A 129 -9.790 6.329 -1.018 1.00 0.00 N ATOM 833 CA ASP A 129 -11.246 6.353 -1.237 1.00 0.00 C ATOM 834 C ASP A 129 -11.965 6.955 -0.028 1.00 0.00 C ATOM 835 O ASP A 129 -12.207 8.160 0.031 1.00 0.00 O ATOM 836 CB ASP A 129 -11.793 4.932 -1.483 1.00 0.00 C ATOM 837 CG ASP A 129 -11.905 4.632 -2.981 1.00 0.00 C ATOM 838 OD1 ASP A 129 -11.389 5.406 -3.771 1.00 0.00 O ATOM 839 OD2 ASP A 129 -12.510 3.626 -3.315 1.00 0.00 O ATOM 0 H ASP A 129 -9.461 7.001 -0.324 1.00 0.00 H new ATOM 0 HA ASP A 129 -11.432 6.968 -2.118 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -11.137 4.200 -1.011 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -12.772 4.831 -1.015 1.00 0.00 H new ATOM 844 N ILE A 130 -12.305 6.092 0.921 1.00 0.00 N ATOM 845 CA ILE A 130 -13.004 6.495 2.139 1.00 0.00 C ATOM 846 C ILE A 130 -14.374 7.103 1.828 1.00 0.00 C ATOM 847 O ILE A 130 -15.283 6.406 1.380 1.00 0.00 O ATOM 848 CB ILE A 130 -12.168 7.499 2.931 1.00 0.00 C ATOM 849 CG1 ILE A 130 -10.804 6.889 3.260 1.00 0.00 C ATOM 850 CG2 ILE A 130 -12.894 7.831 4.237 1.00 0.00 C ATOM 851 CD1 ILE A 130 -9.889 7.973 3.836 1.00 0.00 C ATOM 0 H ILE A 130 -12.105 5.093 0.870 1.00 0.00 H new ATOM 0 HA ILE A 130 -13.155 5.596 2.737 1.00 0.00 H new ATOM 0 HB ILE A 130 -12.028 8.403 2.338 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -10.920 6.076 3.977 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -10.359 6.461 2.362 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -12.304 8.547 4.809 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -13.870 8.262 4.012 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -13.026 6.921 4.822 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -8.916 7.541 4.071 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -9.764 8.771 3.104 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -10.334 8.380 4.744 1.00 0.00 H new ATOM 863 N ASP A 131 -14.510 8.401 2.097 1.00 0.00 N ATOM 864 CA ASP A 131 -15.771 9.113 1.877 1.00 0.00 C ATOM 865 C ASP A 131 -16.787 8.722 2.947 1.00 0.00 C ATOM 866 O ASP A 131 -17.829 9.358 3.099 1.00 0.00 O ATOM 867 CB ASP A 131 -16.335 8.791 0.487 1.00 0.00 C ATOM 868 CG ASP A 131 -17.273 9.905 0.024 1.00 0.00 C ATOM 869 OD1 ASP A 131 -16.996 11.056 0.324 1.00 0.00 O ATOM 870 OD2 ASP A 131 -18.253 9.590 -0.630 1.00 0.00 O ATOM 0 H ASP A 131 -13.760 8.984 2.469 1.00 0.00 H new ATOM 0 HA ASP A 131 -15.577 10.184 1.939 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -15.519 8.674 -0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -16.872 7.843 0.516 1.00 0.00 H new ATOM 875 N GLY A 132 -16.462 7.666 3.683 1.00 0.00 N ATOM 876 CA GLY A 132 -17.336 7.175 4.745 1.00 0.00 C ATOM 877 C GLY A 132 -17.322 5.653 4.790 1.00 0.00 C ATOM 878 O GLY A 132 -17.219 5.054 5.861 1.00 0.00 O ATOM 0 H GLY A 132 -15.601 7.133 3.565 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -17.011 7.576 5.705 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -18.353 7.530 4.579 1.00 0.00 H new ATOM 882 N ASP A 133 -17.450 5.033 3.624 1.00 0.00 N ATOM 883 CA ASP A 133 -17.475 3.578 3.547 1.00 0.00 C ATOM 884 C ASP A 133 -16.220 2.996 4.183 1.00 0.00 C ATOM 885 O ASP A 133 -16.276 1.960 4.844 1.00 0.00 O ATOM 886 CB ASP A 133 -17.575 3.126 2.089 1.00 0.00 C ATOM 887 CG ASP A 133 -18.968 3.425 1.545 1.00 0.00 C ATOM 888 OD1 ASP A 133 -19.842 3.726 2.342 1.00 0.00 O ATOM 889 OD2 ASP A 133 -19.141 3.349 0.339 1.00 0.00 O ATOM 0 H ASP A 133 -17.537 5.509 2.726 1.00 0.00 H new ATOM 0 HA ASP A 133 -18.348 3.217 4.090 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -16.823 3.638 1.488 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -17.368 2.058 2.016 1.00 0.00 H new ATOM 894 N GLY A 134 -15.096 3.674 4.002 1.00 0.00 N ATOM 895 CA GLY A 134 -13.851 3.209 4.590 1.00 0.00 C ATOM 896 C GLY A 134 -13.305 1.983 3.871 1.00 0.00 C ATOM 897 O GLY A 134 -12.768 1.078 4.508 1.00 0.00 O ATOM 0 H GLY A 134 -15.021 4.535 3.461 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -13.112 4.009 4.555 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -14.013 2.971 5.641 1.00 0.00 H new ATOM 901 N GLN A 135 -13.426 1.969 2.544 1.00 0.00 N ATOM 902 CA GLN A 135 -12.910 0.856 1.753 1.00 0.00 C ATOM 903 C GLN A 135 -11.980 1.366 0.669 1.00 0.00 C ATOM 904 O GLN A 135 -12.193 2.434 0.096 1.00 0.00 O ATOM 905 CB GLN A 135 -14.044 0.049 1.126 1.00 0.00 C ATOM 906 CG GLN A 135 -14.949 0.978 0.317 1.00 0.00 C ATOM 907 CD GLN A 135 -16.115 0.189 -0.269 1.00 0.00 C ATOM 908 OE1 GLN A 135 -16.895 -0.410 0.472 1.00 0.00 O ATOM 909 NE2 GLN A 135 -16.282 0.153 -1.562 1.00 0.00 N ATOM 0 H GLN A 135 -13.872 2.708 2.000 1.00 0.00 H new ATOM 0 HA GLN A 135 -12.355 0.201 2.424 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -13.636 -0.730 0.481 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -14.621 -0.451 1.904 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -15.325 1.779 0.954 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -14.378 1.449 -0.484 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -15.635 0.650 -2.174 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -17.060 -0.372 -1.961 1.00 0.00 H new ATOM 918 N VAL A 136 -10.932 0.596 0.421 1.00 0.00 N ATOM 919 CA VAL A 136 -9.934 0.966 -0.569 1.00 0.00 C ATOM 920 C VAL A 136 -9.648 -0.162 -1.544 1.00 0.00 C ATOM 921 O VAL A 136 -9.439 -1.308 -1.147 1.00 0.00 O ATOM 922 CB VAL A 136 -8.647 1.361 0.142 1.00 0.00 C ATOM 923 CG1 VAL A 136 -7.519 1.505 -0.880 1.00 0.00 C ATOM 924 CG2 VAL A 136 -8.869 2.691 0.850 1.00 0.00 C ATOM 0 H VAL A 136 -10.751 -0.290 0.893 1.00 0.00 H new ATOM 0 HA VAL A 136 -10.328 1.804 -1.143 1.00 0.00 H new ATOM 0 HB VAL A 136 -8.373 0.595 0.867 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.599 1.788 -0.369 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.371 0.556 -1.395 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.782 2.274 -1.606 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -7.954 2.987 1.364 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -9.136 3.453 0.118 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -9.676 2.587 1.576 1.00 0.00 H new ATOM 934 N ASN A 137 -9.596 0.189 -2.821 1.00 0.00 N ATOM 935 CA ASN A 137 -9.285 -0.781 -3.853 1.00 0.00 C ATOM 936 C ASN A 137 -7.781 -0.722 -4.120 1.00 0.00 C ATOM 937 O ASN A 137 -7.286 0.267 -4.661 1.00 0.00 O ATOM 938 CB ASN A 137 -10.048 -0.449 -5.135 1.00 0.00 C ATOM 939 CG ASN A 137 -9.780 -1.513 -6.193 1.00 0.00 C ATOM 940 OD1 ASN A 137 -9.090 -2.496 -5.924 1.00 0.00 O ATOM 941 ND2 ASN A 137 -10.287 -1.375 -7.387 1.00 0.00 N ATOM 0 H ASN A 137 -9.765 1.135 -3.163 1.00 0.00 H new ATOM 0 HA ASN A 137 -9.577 -1.779 -3.527 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -11.117 -0.392 -4.927 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -9.743 0.529 -5.506 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -10.112 -2.083 -8.100 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -10.859 -0.559 -7.607 1.00 0.00 H new ATOM 948 N TYR A 138 -7.052 -1.753 -3.717 1.00 0.00 N ATOM 949 CA TYR A 138 -5.602 -1.755 -3.901 1.00 0.00 C ATOM 950 C TYR A 138 -5.210 -1.685 -5.375 1.00 0.00 C ATOM 951 O TYR A 138 -4.033 -1.503 -5.692 1.00 0.00 O ATOM 952 CB TYR A 138 -4.980 -3.003 -3.273 1.00 0.00 C ATOM 953 CG TYR A 138 -5.602 -4.247 -3.862 1.00 0.00 C ATOM 954 CD1 TYR A 138 -5.137 -4.760 -5.078 1.00 0.00 C ATOM 955 CD2 TYR A 138 -6.641 -4.889 -3.186 1.00 0.00 C ATOM 956 CE1 TYR A 138 -5.715 -5.918 -5.615 1.00 0.00 C ATOM 957 CE2 TYR A 138 -7.217 -6.044 -3.718 1.00 0.00 C ATOM 958 CZ TYR A 138 -6.755 -6.561 -4.934 1.00 0.00 C ATOM 959 OH TYR A 138 -7.324 -7.702 -5.461 1.00 0.00 O ATOM 0 H TYR A 138 -7.430 -2.587 -3.268 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.221 -0.863 -3.404 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -3.904 -3.009 -3.446 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -5.129 -2.989 -2.193 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -4.333 -4.264 -5.602 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -7.000 -4.491 -2.249 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -5.358 -6.314 -6.554 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.019 -6.539 -3.191 1.00 0.00 H new ATOM 0 HH TYR A 138 -7.066 -7.791 -6.402 1.00 0.00 H new ATOM 969 N GLU A 139 -6.173 -1.836 -6.276 1.00 0.00 N ATOM 970 CA GLU A 139 -5.846 -1.789 -7.697 1.00 0.00 C ATOM 971 C GLU A 139 -5.224 -0.440 -8.051 1.00 0.00 C ATOM 972 O GLU A 139 -4.175 -0.387 -8.693 1.00 0.00 O ATOM 973 CB GLU A 139 -7.107 -2.015 -8.534 1.00 0.00 C ATOM 974 CG GLU A 139 -7.576 -3.462 -8.372 1.00 0.00 C ATOM 975 CD GLU A 139 -6.595 -4.409 -9.055 1.00 0.00 C ATOM 976 OE1 GLU A 139 -5.812 -3.937 -9.863 1.00 0.00 O ATOM 977 OE2 GLU A 139 -6.641 -5.591 -8.760 1.00 0.00 O ATOM 0 H GLU A 139 -7.158 -1.988 -6.059 1.00 0.00 H new ATOM 0 HA GLU A 139 -5.127 -2.578 -7.916 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -7.893 -1.329 -8.218 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -6.902 -1.803 -9.583 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -7.657 -3.710 -7.314 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -8.570 -3.581 -8.804 1.00 0.00 H new ATOM 984 N GLU A 140 -5.874 0.649 -7.646 1.00 0.00 N ATOM 985 CA GLU A 140 -5.363 1.983 -7.950 1.00 0.00 C ATOM 986 C GLU A 140 -3.987 2.192 -7.327 1.00 0.00 C ATOM 987 O GLU A 140 -3.097 2.768 -7.953 1.00 0.00 O ATOM 988 CB GLU A 140 -6.330 3.045 -7.422 1.00 0.00 C ATOM 989 CG GLU A 140 -7.610 3.032 -8.258 1.00 0.00 C ATOM 990 CD GLU A 140 -8.645 3.965 -7.640 1.00 0.00 C ATOM 991 OE1 GLU A 140 -8.433 4.392 -6.517 1.00 0.00 O ATOM 992 OE2 GLU A 140 -9.636 4.238 -8.298 1.00 0.00 O ATOM 0 H GLU A 140 -6.744 0.635 -7.114 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.274 2.076 -9.032 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -6.565 2.850 -6.376 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -5.865 4.030 -7.466 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -7.391 3.344 -9.279 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -8.008 2.019 -8.313 1.00 0.00 H new ATOM 999 N PHE A 141 -3.809 1.710 -6.103 1.00 0.00 N ATOM 1000 CA PHE A 141 -2.522 1.844 -5.433 1.00 0.00 C ATOM 1001 C PHE A 141 -1.446 1.122 -6.224 1.00 0.00 C ATOM 1002 O PHE A 141 -0.365 1.660 -6.453 1.00 0.00 O ATOM 1003 CB PHE A 141 -2.596 1.257 -4.022 1.00 0.00 C ATOM 1004 CG PHE A 141 -2.782 2.362 -3.013 1.00 0.00 C ATOM 1005 CD1 PHE A 141 -1.697 3.187 -2.693 1.00 0.00 C ATOM 1006 CD2 PHE A 141 -4.021 2.557 -2.384 1.00 0.00 C ATOM 1007 CE1 PHE A 141 -1.847 4.205 -1.748 1.00 0.00 C ATOM 1008 CE2 PHE A 141 -4.167 3.577 -1.439 1.00 0.00 C ATOM 1009 CZ PHE A 141 -3.081 4.399 -1.121 1.00 0.00 C ATOM 0 H PHE A 141 -4.528 1.230 -5.561 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.274 2.903 -5.368 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -3.423 0.550 -3.956 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -1.684 0.702 -3.802 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.743 3.036 -3.177 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -4.859 1.921 -2.629 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -1.010 4.842 -1.502 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -5.120 3.730 -0.954 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.196 5.185 -0.390 1.00 0.00 H new ATOM 1019 N VAL A 142 -1.755 -0.090 -6.657 1.00 0.00 N ATOM 1020 CA VAL A 142 -0.808 -0.863 -7.439 1.00 0.00 C ATOM 1021 C VAL A 142 -0.520 -0.172 -8.761 1.00 0.00 C ATOM 1022 O VAL A 142 0.624 -0.130 -9.204 1.00 0.00 O ATOM 1023 CB VAL A 142 -1.336 -2.274 -7.680 1.00 0.00 C ATOM 1024 CG1 VAL A 142 -0.454 -2.976 -8.714 1.00 0.00 C ATOM 1025 CG2 VAL A 142 -1.283 -3.052 -6.364 1.00 0.00 C ATOM 0 H VAL A 142 -2.646 -0.555 -6.482 1.00 0.00 H new ATOM 0 HA VAL A 142 0.123 -0.935 -6.876 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.361 -2.228 -8.047 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -0.829 -3.984 -8.888 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -0.473 -2.416 -9.649 1.00 0.00 H new ATOM 0 HG13 VAL A 142 0.570 -3.029 -8.343 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -1.658 -4.063 -6.524 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -0.253 -3.099 -6.010 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -1.900 -2.549 -5.619 1.00 0.00 H new ATOM 1035 N GLN A 143 -1.558 0.374 -9.394 1.00 0.00 N ATOM 1036 CA GLN A 143 -1.364 1.049 -10.668 1.00 0.00 C ATOM 1037 C GLN A 143 -0.334 2.158 -10.495 1.00 0.00 C ATOM 1038 O GLN A 143 0.557 2.321 -11.329 1.00 0.00 O ATOM 1039 CB GLN A 143 -2.687 1.642 -11.161 1.00 0.00 C ATOM 1040 CG GLN A 143 -2.615 1.879 -12.669 1.00 0.00 C ATOM 1041 CD GLN A 143 -1.563 2.935 -12.973 1.00 0.00 C ATOM 1042 OE1 GLN A 143 -0.450 2.574 -13.540 1.00 0.00 O flip ATOM 1043 NE2 GLN A 143 -1.747 4.111 -12.658 1.00 0.00 N flip ATOM 0 H GLN A 143 -2.519 0.362 -9.052 1.00 0.00 H new ATOM 0 HA GLN A 143 -1.009 0.329 -11.406 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.509 0.965 -10.928 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -2.891 2.580 -10.645 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -2.369 0.949 -13.182 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -3.587 2.202 -13.043 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -2.622 4.389 -12.213 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -1.025 4.807 -12.842 1.00 0.00 H new ATOM 1052 N MET A 144 -0.447 2.910 -9.402 1.00 0.00 N ATOM 1053 CA MET A 144 0.507 3.979 -9.150 1.00 0.00 C ATOM 1054 C MET A 144 1.905 3.379 -9.061 1.00 0.00 C ATOM 1055 O MET A 144 2.872 3.942 -9.574 1.00 0.00 O ATOM 1056 CB MET A 144 0.183 4.720 -7.838 1.00 0.00 C ATOM 1057 CG MET A 144 -1.087 5.566 -7.999 1.00 0.00 C ATOM 1058 SD MET A 144 -1.222 6.758 -6.628 1.00 0.00 S ATOM 1059 CE MET A 144 -1.708 5.632 -5.292 1.00 0.00 C ATOM 0 H MET A 144 -1.173 2.801 -8.694 1.00 0.00 H new ATOM 0 HA MET A 144 0.450 4.698 -9.967 1.00 0.00 H new ATOM 0 HB2 MET A 144 0.048 4.000 -7.031 1.00 0.00 H new ATOM 0 HB3 MET A 144 1.020 5.359 -7.558 1.00 0.00 H new ATOM 0 HG2 MET A 144 -1.062 6.096 -8.951 1.00 0.00 H new ATOM 0 HG3 MET A 144 -1.964 4.919 -8.017 1.00 0.00 H new ATOM 0 HE1 MET A 144 -1.767 6.184 -4.354 1.00 0.00 H new ATOM 0 HE2 MET A 144 -2.681 5.197 -5.519 1.00 0.00 H new ATOM 0 HE3 MET A 144 -0.968 4.837 -5.199 1.00 0.00 H new ATOM 1069 N MET A 145 1.996 2.229 -8.406 1.00 0.00 N ATOM 1070 CA MET A 145 3.267 1.534 -8.240 1.00 0.00 C ATOM 1071 C MET A 145 3.729 0.886 -9.546 1.00 0.00 C ATOM 1072 O MET A 145 4.906 0.564 -9.701 1.00 0.00 O ATOM 1073 CB MET A 145 3.113 0.462 -7.164 1.00 0.00 C ATOM 1074 CG MET A 145 2.793 1.139 -5.833 1.00 0.00 C ATOM 1075 SD MET A 145 2.501 -0.117 -4.565 1.00 0.00 S ATOM 1076 CE MET A 145 2.001 1.008 -3.237 1.00 0.00 C ATOM 0 H MET A 145 1.200 1.755 -7.979 1.00 0.00 H new ATOM 0 HA MET A 145 4.021 2.264 -7.944 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.317 -0.232 -7.435 1.00 0.00 H new ATOM 0 HB3 MET A 145 4.030 -0.121 -7.079 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.619 1.785 -5.535 1.00 0.00 H new ATOM 0 HG3 MET A 145 1.913 1.774 -5.939 1.00 0.00 H new ATOM 0 HE1 MET A 145 2.723 0.953 -2.422 1.00 0.00 H new ATOM 0 HE2 MET A 145 1.963 2.028 -3.619 1.00 0.00 H new ATOM 0 HE3 MET A 145 1.016 0.721 -2.869 1.00 0.00 H new ATOM 1086 N THR A 146 2.803 0.693 -10.481 1.00 0.00 N ATOM 1087 CA THR A 146 3.145 0.078 -11.761 1.00 0.00 C ATOM 1088 C THR A 146 3.435 1.143 -12.813 1.00 0.00 C ATOM 1089 O THR A 146 3.324 0.885 -14.011 1.00 0.00 O ATOM 1090 CB THR A 146 2.005 -0.824 -12.247 1.00 0.00 C ATOM 1091 OG1 THR A 146 1.253 -1.280 -11.134 1.00 0.00 O ATOM 1092 CG2 THR A 146 2.587 -2.026 -12.992 1.00 0.00 C ATOM 0 H THR A 146 1.821 0.950 -10.379 1.00 0.00 H new ATOM 0 HA THR A 146 4.040 -0.526 -11.612 1.00 0.00 H new ATOM 0 HB THR A 146 1.357 -0.258 -12.917 1.00 0.00 H new ATOM 0 HG1 THR A 146 0.798 -0.521 -10.714 1.00 0.00 H new ATOM 0 HG21 THR A 146 1.776 -2.667 -13.338 1.00 0.00 H new ATOM 0 HG22 THR A 146 3.165 -1.678 -13.848 1.00 0.00 H new ATOM 0 HG23 THR A 146 3.235 -2.590 -12.322 1.00 0.00 H new ATOM 1100 N ALA A 147 3.817 2.335 -12.358 1.00 0.00 N ATOM 1101 CA ALA A 147 4.136 3.430 -13.269 1.00 0.00 C ATOM 1102 C ALA A 147 5.587 3.858 -13.078 1.00 0.00 C ATOM 1103 O ALA A 147 5.868 4.881 -12.455 1.00 0.00 O ATOM 1104 CB ALA A 147 3.211 4.620 -13.004 1.00 0.00 C ATOM 0 H ALA A 147 3.912 2.565 -11.369 1.00 0.00 H new ATOM 0 HA ALA A 147 3.993 3.088 -14.294 1.00 0.00 H new ATOM 0 HB1 ALA A 147 3.457 5.432 -13.689 1.00 0.00 H new ATOM 0 HB2 ALA A 147 2.175 4.317 -13.158 1.00 0.00 H new ATOM 0 HB3 ALA A 147 3.341 4.960 -11.977 1.00 0.00 H new ATOM 1110 N LYS A 148 6.504 3.060 -13.613 1.00 0.00 N ATOM 1111 CA LYS A 148 7.927 3.356 -13.492 1.00 0.00 C ATOM 1112 C LYS A 148 8.662 2.991 -14.778 1.00 0.00 C ATOM 1113 O LYS A 148 8.499 1.871 -15.233 1.00 0.00 O ATOM 1114 CB LYS A 148 8.522 2.572 -12.320 1.00 0.00 C ATOM 1115 CG LYS A 148 9.634 3.394 -11.662 1.00 0.00 C ATOM 1116 CD LYS A 148 9.028 4.376 -10.658 1.00 0.00 C ATOM 1117 CE LYS A 148 9.066 3.764 -9.258 1.00 0.00 C ATOM 1118 NZ LYS A 148 10.476 3.706 -8.779 1.00 0.00 N ATOM 1119 OXT LYS A 148 9.379 3.837 -15.288 1.00 0.00 O ATOM 0 H LYS A 148 6.290 2.208 -14.132 1.00 0.00 H new ATOM 0 HA LYS A 148 8.045 4.425 -13.313 1.00 0.00 H new ATOM 0 HB2 LYS A 148 7.745 2.344 -11.591 1.00 0.00 H new ATOM 0 HB3 LYS A 148 8.919 1.620 -12.671 1.00 0.00 H new ATOM 0 HG2 LYS A 148 10.338 2.732 -11.158 1.00 0.00 H new ATOM 0 HG3 LYS A 148 10.196 3.937 -12.422 1.00 0.00 H new ATOM 0 HD2 LYS A 148 9.583 5.314 -10.671 1.00 0.00 H new ATOM 0 HD3 LYS A 148 8.000 4.609 -10.937 1.00 0.00 H new ATOM 0 HE2 LYS A 148 8.462 4.359 -8.573 1.00 0.00 H new ATOM 0 HE3 LYS A 148 8.635 2.763 -9.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 10.492 3.756 -7.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 10.912 2.814 -9.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 11.010 4.507 -9.172 1.00 0.00 H new TER 1133 LYS A 148 ATOM 1134 N PHE B 30 -9.427 -4.518 12.879 1.00 0.00 N ATOM 1135 CA PHE B 30 -9.044 -4.591 11.442 1.00 0.00 C ATOM 1136 C PHE B 30 -9.202 -6.025 10.951 1.00 0.00 C ATOM 1137 O PHE B 30 -9.086 -6.296 9.757 1.00 0.00 O ATOM 1138 CB PHE B 30 -7.586 -4.150 11.280 1.00 0.00 C ATOM 1139 CG PHE B 30 -7.340 -2.901 12.094 1.00 0.00 C ATOM 1140 CD1 PHE B 30 -7.947 -1.695 11.722 1.00 0.00 C ATOM 1141 CD2 PHE B 30 -6.507 -2.948 13.218 1.00 0.00 C ATOM 1142 CE1 PHE B 30 -7.719 -0.536 12.476 1.00 0.00 C ATOM 1143 CE2 PHE B 30 -6.279 -1.789 13.971 1.00 0.00 C ATOM 1144 CZ PHE B 30 -6.886 -0.584 13.599 1.00 0.00 C ATOM 0 HA PHE B 30 -9.687 -3.933 10.857 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -6.917 -4.946 11.606 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -7.368 -3.960 10.229 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -8.590 -1.658 10.855 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -6.040 -3.878 13.505 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -8.187 0.395 12.190 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -5.636 -1.825 14.838 1.00 0.00 H new ATOM 0 HZ PHE B 30 -6.711 0.310 14.179 1.00 0.00 H new ATOM 1154 N ASP B 31 -9.457 -6.940 11.883 1.00 0.00 N ATOM 1155 CA ASP B 31 -9.615 -8.350 11.540 1.00 0.00 C ATOM 1156 C ASP B 31 -8.379 -8.850 10.799 1.00 0.00 C ATOM 1157 O ASP B 31 -8.465 -9.711 9.925 1.00 0.00 O ATOM 1158 CB ASP B 31 -10.859 -8.545 10.669 1.00 0.00 C ATOM 1159 CG ASP B 31 -12.117 -8.283 11.491 1.00 0.00 C ATOM 1160 OD1 ASP B 31 -12.010 -8.249 12.705 1.00 0.00 O ATOM 1161 OD2 ASP B 31 -13.168 -8.121 10.893 1.00 0.00 O ATOM 0 H ASP B 31 -9.558 -6.732 12.876 1.00 0.00 H new ATOM 0 HA ASP B 31 -9.734 -8.923 12.460 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -10.825 -7.868 9.815 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -10.879 -9.560 10.271 1.00 0.00 H new ATOM 1166 N ILE B 32 -7.229 -8.297 11.169 1.00 0.00 N ATOM 1167 CA ILE B 32 -5.957 -8.671 10.558 1.00 0.00 C ATOM 1168 C ILE B 32 -4.949 -9.077 11.629 1.00 0.00 C ATOM 1169 O ILE B 32 -4.698 -8.329 12.573 1.00 0.00 O ATOM 1170 CB ILE B 32 -5.427 -7.487 9.747 1.00 0.00 C ATOM 1171 CG1 ILE B 32 -6.286 -7.307 8.497 1.00 0.00 C ATOM 1172 CG2 ILE B 32 -3.977 -7.731 9.334 1.00 0.00 C ATOM 1173 CD1 ILE B 32 -6.076 -5.904 7.936 1.00 0.00 C ATOM 0 H ILE B 32 -7.151 -7.584 11.894 1.00 0.00 H new ATOM 0 HA ILE B 32 -6.109 -9.525 9.898 1.00 0.00 H new ATOM 0 HB ILE B 32 -5.472 -6.588 10.362 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -6.020 -8.053 7.749 1.00 0.00 H new ATOM 0 HG13 ILE B 32 -7.338 -7.460 8.740 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -3.615 -6.880 8.758 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -3.361 -7.855 10.225 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -3.919 -8.633 8.724 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -6.688 -5.774 7.044 1.00 0.00 H new ATOM 0 HD12 ILE B 32 -6.364 -5.166 8.685 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -5.026 -5.769 7.678 1.00 0.00 H new ATOM 1185 N ASP B 33 -4.380 -10.270 11.481 1.00 0.00 N ATOM 1186 CA ASP B 33 -3.407 -10.761 12.451 1.00 0.00 C ATOM 1187 C ASP B 33 -2.059 -10.077 12.259 1.00 0.00 C ATOM 1188 O ASP B 33 -1.520 -10.043 11.152 1.00 0.00 O ATOM 1189 CB ASP B 33 -3.239 -12.275 12.299 1.00 0.00 C ATOM 1190 CG ASP B 33 -4.489 -12.992 12.796 1.00 0.00 C ATOM 1191 OD1 ASP B 33 -5.297 -12.350 13.447 1.00 0.00 O ATOM 1192 OD2 ASP B 33 -4.621 -14.172 12.518 1.00 0.00 O ATOM 0 H ASP B 33 -4.573 -10.908 10.709 1.00 0.00 H new ATOM 0 HA ASP B 33 -3.775 -10.532 13.451 1.00 0.00 H new ATOM 0 HB2 ASP B 33 -3.058 -12.526 11.254 1.00 0.00 H new ATOM 0 HB3 ASP B 33 -2.369 -12.611 12.863 1.00 0.00 H new ATOM 1197 N MET B 34 -1.516 -9.541 13.346 1.00 0.00 N ATOM 1198 CA MET B 34 -0.225 -8.867 13.290 1.00 0.00 C ATOM 1199 C MET B 34 0.876 -9.771 13.829 1.00 0.00 C ATOM 1200 O MET B 34 2.061 -9.451 13.730 1.00 0.00 O ATOM 1201 CB MET B 34 -0.283 -7.576 14.106 1.00 0.00 C ATOM 1202 CG MET B 34 -1.293 -6.626 13.465 1.00 0.00 C ATOM 1203 SD MET B 34 -1.406 -5.106 14.437 1.00 0.00 S ATOM 1204 CE MET B 34 -2.526 -4.230 13.321 1.00 0.00 C ATOM 0 H MET B 34 -1.946 -9.560 14.271 1.00 0.00 H new ATOM 0 HA MET B 34 0.001 -8.630 12.250 1.00 0.00 H new ATOM 0 HB2 MET B 34 -0.571 -7.794 15.134 1.00 0.00 H new ATOM 0 HB3 MET B 34 0.701 -7.110 14.143 1.00 0.00 H new ATOM 0 HG2 MET B 34 -0.990 -6.394 12.444 1.00 0.00 H new ATOM 0 HG3 MET B 34 -2.270 -7.105 13.407 1.00 0.00 H new ATOM 0 HE1 MET B 34 -3.159 -3.555 13.897 1.00 0.00 H new ATOM 0 HE2 MET B 34 -1.945 -3.655 12.600 1.00 0.00 H new ATOM 0 HE3 MET B 34 -3.150 -4.951 12.792 1.00 0.00 H new ATOM 1214 N ASP B 35 0.475 -10.899 14.402 1.00 0.00 N ATOM 1215 CA ASP B 35 1.433 -11.846 14.958 1.00 0.00 C ATOM 1216 C ASP B 35 2.348 -12.392 13.867 1.00 0.00 C ATOM 1217 O ASP B 35 3.548 -12.566 14.081 1.00 0.00 O ATOM 1218 CB ASP B 35 0.694 -13.003 15.631 1.00 0.00 C ATOM 1219 CG ASP B 35 0.036 -12.523 16.921 1.00 0.00 C ATOM 1220 OD1 ASP B 35 0.370 -11.436 17.364 1.00 0.00 O ATOM 1221 OD2 ASP B 35 -0.791 -13.249 17.447 1.00 0.00 O ATOM 0 H ASP B 35 -0.501 -11.179 14.494 1.00 0.00 H new ATOM 0 HA ASP B 35 2.041 -11.323 15.696 1.00 0.00 H new ATOM 0 HB2 ASP B 35 -0.061 -13.405 14.956 1.00 0.00 H new ATOM 0 HB3 ASP B 35 1.391 -13.813 15.848 1.00 0.00 H new ATOM 1226 N ALA B 36 1.777 -12.664 12.699 1.00 0.00 N ATOM 1227 CA ALA B 36 2.558 -13.194 11.588 1.00 0.00 C ATOM 1228 C ALA B 36 3.563 -12.142 11.093 1.00 0.00 C ATOM 1229 O ALA B 36 3.189 -10.985 10.894 1.00 0.00 O ATOM 1230 CB ALA B 36 1.627 -13.587 10.440 1.00 0.00 C ATOM 0 H ALA B 36 0.786 -12.528 12.498 1.00 0.00 H new ATOM 0 HA ALA B 36 3.103 -14.073 11.933 1.00 0.00 H new ATOM 0 HB1 ALA B 36 2.216 -13.982 9.613 1.00 0.00 H new ATOM 0 HB2 ALA B 36 0.927 -14.349 10.784 1.00 0.00 H new ATOM 0 HB3 ALA B 36 1.073 -12.710 10.104 1.00 0.00 H new ATOM 1236 N PRO B 37 4.818 -12.494 10.892 1.00 0.00 N ATOM 1237 CA PRO B 37 5.846 -11.522 10.417 1.00 0.00 C ATOM 1238 C PRO B 37 5.637 -11.121 8.960 1.00 0.00 C ATOM 1239 O PRO B 37 6.103 -10.070 8.522 1.00 0.00 O ATOM 1240 CB PRO B 37 7.165 -12.261 10.601 1.00 0.00 C ATOM 1241 CG PRO B 37 6.807 -13.694 10.498 1.00 0.00 C ATOM 1242 CD PRO B 37 5.404 -13.832 11.082 1.00 0.00 C ATOM 0 HA PRO B 37 5.803 -10.584 10.971 1.00 0.00 H new ATOM 0 HB2 PRO B 37 7.889 -11.977 9.837 1.00 0.00 H new ATOM 0 HB3 PRO B 37 7.616 -12.033 11.567 1.00 0.00 H new ATOM 0 HG2 PRO B 37 6.830 -14.026 9.460 1.00 0.00 H new ATOM 0 HG3 PRO B 37 7.518 -14.312 11.046 1.00 0.00 H new ATOM 0 HD2 PRO B 37 4.828 -14.599 10.565 1.00 0.00 H new ATOM 0 HD3 PRO B 37 5.434 -14.111 12.135 1.00 0.00 H new ATOM 1250 N GLU B 38 4.937 -11.969 8.215 1.00 0.00 N ATOM 1251 CA GLU B 38 4.676 -11.706 6.803 1.00 0.00 C ATOM 1252 C GLU B 38 3.838 -10.442 6.628 1.00 0.00 C ATOM 1253 O GLU B 38 4.049 -9.674 5.689 1.00 0.00 O ATOM 1254 CB GLU B 38 3.942 -12.895 6.179 1.00 0.00 C ATOM 1255 CG GLU B 38 4.876 -14.107 6.131 1.00 0.00 C ATOM 1256 CD GLU B 38 5.989 -13.870 5.116 1.00 0.00 C ATOM 1257 OE1 GLU B 38 5.837 -12.980 4.296 1.00 0.00 O ATOM 1258 OE2 GLU B 38 6.979 -14.581 5.175 1.00 0.00 O ATOM 0 H GLU B 38 4.541 -12.842 8.563 1.00 0.00 H new ATOM 0 HA GLU B 38 5.633 -11.561 6.302 1.00 0.00 H new ATOM 0 HB2 GLU B 38 3.052 -13.132 6.761 1.00 0.00 H new ATOM 0 HB3 GLU B 38 3.607 -12.641 5.173 1.00 0.00 H new ATOM 0 HG2 GLU B 38 5.304 -14.285 7.117 1.00 0.00 H new ATOM 0 HG3 GLU B 38 4.312 -15.000 5.862 1.00 0.00 H new ATOM 1265 N THR B 39 2.881 -10.235 7.527 1.00 0.00 N ATOM 1266 CA THR B 39 2.015 -9.063 7.446 1.00 0.00 C ATOM 1267 C THR B 39 2.841 -7.783 7.525 1.00 0.00 C ATOM 1268 O THR B 39 2.637 -6.854 6.745 1.00 0.00 O ATOM 1269 CB THR B 39 0.993 -9.084 8.584 1.00 0.00 C ATOM 1270 OG1 THR B 39 0.181 -10.245 8.467 1.00 0.00 O ATOM 1271 CG2 THR B 39 0.113 -7.835 8.506 1.00 0.00 C ATOM 0 H THR B 39 2.686 -10.856 8.312 1.00 0.00 H new ATOM 0 HA THR B 39 1.491 -9.088 6.490 1.00 0.00 H new ATOM 0 HB THR B 39 1.515 -9.099 9.541 1.00 0.00 H new ATOM 0 HG1 THR B 39 -0.419 -10.304 9.240 1.00 0.00 H new ATOM 0 HG21 THR B 39 -0.615 -7.851 9.317 1.00 0.00 H new ATOM 0 HG22 THR B 39 0.736 -6.945 8.595 1.00 0.00 H new ATOM 0 HG23 THR B 39 -0.410 -7.818 7.550 1.00 0.00 H new ATOM 1279 N GLU B 40 3.782 -7.746 8.462 1.00 0.00 N ATOM 1280 CA GLU B 40 4.638 -6.576 8.618 1.00 0.00 C ATOM 1281 C GLU B 40 5.447 -6.357 7.345 1.00 0.00 C ATOM 1282 O GLU B 40 5.639 -5.224 6.903 1.00 0.00 O ATOM 1283 CB GLU B 40 5.583 -6.771 9.807 1.00 0.00 C ATOM 1284 CG GLU B 40 6.430 -5.511 10.005 1.00 0.00 C ATOM 1285 CD GLU B 40 7.325 -5.670 11.229 1.00 0.00 C ATOM 1286 OE1 GLU B 40 7.259 -6.715 11.855 1.00 0.00 O ATOM 1287 OE2 GLU B 40 8.065 -4.745 11.521 1.00 0.00 O ATOM 0 H GLU B 40 3.970 -8.504 9.118 1.00 0.00 H new ATOM 0 HA GLU B 40 4.014 -5.701 8.802 1.00 0.00 H new ATOM 0 HB2 GLU B 40 5.009 -6.981 10.710 1.00 0.00 H new ATOM 0 HB3 GLU B 40 6.229 -7.632 9.633 1.00 0.00 H new ATOM 0 HG2 GLU B 40 7.040 -5.330 9.120 1.00 0.00 H new ATOM 0 HG3 GLU B 40 5.782 -4.643 10.129 1.00 0.00 H new ATOM 1294 N ARG B 41 5.918 -7.454 6.762 1.00 0.00 N ATOM 1295 CA ARG B 41 6.707 -7.388 5.537 1.00 0.00 C ATOM 1296 C ARG B 41 5.914 -6.708 4.426 1.00 0.00 C ATOM 1297 O ARG B 41 6.445 -5.876 3.690 1.00 0.00 O ATOM 1298 CB ARG B 41 7.083 -8.804 5.091 1.00 0.00 C ATOM 1299 CG ARG B 41 8.514 -9.142 5.525 1.00 0.00 C ATOM 1300 CD ARG B 41 8.711 -8.826 7.010 1.00 0.00 C ATOM 1301 NE ARG B 41 9.412 -7.558 7.169 1.00 0.00 N ATOM 1302 CZ ARG B 41 9.709 -7.084 8.375 1.00 0.00 C ATOM 1303 NH1 ARG B 41 9.374 -7.758 9.441 1.00 0.00 N ATOM 1304 NH2 ARG B 41 10.337 -5.946 8.492 1.00 0.00 N ATOM 0 H ARG B 41 5.768 -8.398 7.117 1.00 0.00 H new ATOM 0 HA ARG B 41 7.609 -6.809 5.736 1.00 0.00 H new ATOM 0 HB2 ARG B 41 6.387 -9.524 5.521 1.00 0.00 H new ATOM 0 HB3 ARG B 41 6.997 -8.885 4.007 1.00 0.00 H new ATOM 0 HG2 ARG B 41 8.717 -10.197 5.341 1.00 0.00 H new ATOM 0 HG3 ARG B 41 9.226 -8.572 4.928 1.00 0.00 H new ATOM 0 HD2 ARG B 41 7.744 -8.780 7.510 1.00 0.00 H new ATOM 0 HD3 ARG B 41 9.278 -9.625 7.487 1.00 0.00 H new ATOM 0 HE ARG B 41 9.679 -7.025 6.341 1.00 0.00 H new ATOM 0 HH11 ARG B 41 8.885 -8.648 9.349 1.00 0.00 H new ATOM 0 HH12 ARG B 41 9.602 -7.395 10.367 1.00 0.00 H new ATOM 0 HH21 ARG B 41 10.600 -5.420 7.658 1.00 0.00 H new ATOM 0 HH22 ARG B 41 10.565 -5.582 9.417 1.00 0.00 H new ATOM 1318 N ALA B 42 4.640 -7.069 4.310 1.00 0.00 N ATOM 1319 CA ALA B 42 3.784 -6.488 3.283 1.00 0.00 C ATOM 1320 C ALA B 42 3.657 -4.982 3.484 1.00 0.00 C ATOM 1321 O ALA B 42 3.678 -4.213 2.522 1.00 0.00 O ATOM 1322 CB ALA B 42 2.397 -7.131 3.331 1.00 0.00 C ATOM 0 H ALA B 42 4.181 -7.755 4.909 1.00 0.00 H new ATOM 0 HA ALA B 42 4.236 -6.677 2.309 1.00 0.00 H new ATOM 0 HB1 ALA B 42 1.765 -6.690 2.560 1.00 0.00 H new ATOM 0 HB2 ALA B 42 2.487 -8.203 3.157 1.00 0.00 H new ATOM 0 HB3 ALA B 42 1.949 -6.958 4.310 1.00 0.00 H new ATOM 1328 N ALA B 43 3.524 -4.565 4.740 1.00 0.00 N ATOM 1329 CA ALA B 43 3.394 -3.148 5.052 1.00 0.00 C ATOM 1330 C ALA B 43 4.640 -2.387 4.611 1.00 0.00 C ATOM 1331 O ALA B 43 4.551 -1.281 4.076 1.00 0.00 O ATOM 1332 CB ALA B 43 3.187 -2.961 6.558 1.00 0.00 C ATOM 0 H ALA B 43 3.504 -5.183 5.551 1.00 0.00 H new ATOM 0 HA ALA B 43 2.531 -2.754 4.515 1.00 0.00 H new ATOM 0 HB1 ALA B 43 3.091 -1.899 6.783 1.00 0.00 H new ATOM 0 HB2 ALA B 43 2.281 -3.481 6.868 1.00 0.00 H new ATOM 0 HB3 ALA B 43 4.042 -3.370 7.096 1.00 0.00 H new ATOM 1338 N VAL B 44 5.803 -2.988 4.843 1.00 0.00 N ATOM 1339 CA VAL B 44 7.068 -2.362 4.473 1.00 0.00 C ATOM 1340 C VAL B 44 7.171 -2.171 2.961 1.00 0.00 C ATOM 1341 O VAL B 44 7.595 -1.116 2.489 1.00 0.00 O ATOM 1342 CB VAL B 44 8.239 -3.223 4.953 1.00 0.00 C ATOM 1343 CG1 VAL B 44 9.544 -2.676 4.374 1.00 0.00 C ATOM 1344 CG2 VAL B 44 8.309 -3.196 6.482 1.00 0.00 C ATOM 0 H VAL B 44 5.896 -3.903 5.283 1.00 0.00 H new ATOM 0 HA VAL B 44 7.107 -1.383 4.951 1.00 0.00 H new ATOM 0 HB VAL B 44 8.092 -4.250 4.618 1.00 0.00 H new ATOM 0 HG11 VAL B 44 10.378 -3.289 4.715 1.00 0.00 H new ATOM 0 HG12 VAL B 44 9.497 -2.700 3.285 1.00 0.00 H new ATOM 0 HG13 VAL B 44 9.688 -1.648 4.708 1.00 0.00 H new ATOM 0 HG21 VAL B 44 9.144 -3.810 6.819 1.00 0.00 H new ATOM 0 HG22 VAL B 44 8.453 -2.170 6.822 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.380 -3.588 6.896 1.00 0.00 H new ATOM 1354 N ALA B 45 6.800 -3.202 2.206 1.00 0.00 N ATOM 1355 CA ALA B 45 6.880 -3.132 0.750 1.00 0.00 C ATOM 1356 C ALA B 45 6.003 -2.012 0.201 1.00 0.00 C ATOM 1357 O ALA B 45 6.431 -1.250 -0.666 1.00 0.00 O ATOM 1358 CB ALA B 45 6.442 -4.465 0.142 1.00 0.00 C ATOM 0 H ALA B 45 6.445 -4.085 2.573 1.00 0.00 H new ATOM 0 HA ALA B 45 7.915 -2.923 0.479 1.00 0.00 H new ATOM 0 HB1 ALA B 45 6.504 -4.407 -0.945 1.00 0.00 H new ATOM 0 HB2 ALA B 45 7.095 -5.261 0.501 1.00 0.00 H new ATOM 0 HB3 ALA B 45 5.414 -4.679 0.436 1.00 0.00 H new ATOM 1364 N ILE B 46 4.780 -1.909 0.706 1.00 0.00 N ATOM 1365 CA ILE B 46 3.874 -0.867 0.246 1.00 0.00 C ATOM 1366 C ILE B 46 4.425 0.510 0.607 1.00 0.00 C ATOM 1367 O ILE B 46 4.452 1.419 -0.224 1.00 0.00 O ATOM 1368 CB ILE B 46 2.492 -1.052 0.877 1.00 0.00 C ATOM 1369 CG1 ILE B 46 1.859 -2.337 0.339 1.00 0.00 C ATOM 1370 CG2 ILE B 46 1.602 0.139 0.512 1.00 0.00 C ATOM 1371 CD1 ILE B 46 0.611 -2.674 1.157 1.00 0.00 C ATOM 0 H ILE B 46 4.398 -2.525 1.424 1.00 0.00 H new ATOM 0 HA ILE B 46 3.784 -0.940 -0.838 1.00 0.00 H new ATOM 0 HB ILE B 46 2.591 -1.116 1.961 1.00 0.00 H new ATOM 0 HG12 ILE B 46 1.595 -2.213 -0.711 1.00 0.00 H new ATOM 0 HG13 ILE B 46 2.575 -3.157 0.393 1.00 0.00 H new ATOM 0 HG21 ILE B 46 0.617 0.008 0.961 1.00 0.00 H new ATOM 0 HG22 ILE B 46 2.053 1.058 0.887 1.00 0.00 H new ATOM 0 HG23 ILE B 46 1.502 0.200 -0.572 1.00 0.00 H new ATOM 0 HD11 ILE B 46 0.161 -3.589 0.773 1.00 0.00 H new ATOM 0 HD12 ILE B 46 0.888 -2.816 2.202 1.00 0.00 H new ATOM 0 HD13 ILE B 46 -0.106 -1.857 1.080 1.00 0.00 H new ATOM 1383 N GLN B 47 4.863 0.651 1.856 1.00 0.00 N ATOM 1384 CA GLN B 47 5.414 1.916 2.334 1.00 0.00 C ATOM 1385 C GLN B 47 6.704 2.273 1.608 1.00 0.00 C ATOM 1386 O GLN B 47 6.927 3.430 1.252 1.00 0.00 O ATOM 1387 CB GLN B 47 5.687 1.821 3.834 1.00 0.00 C ATOM 1388 CG GLN B 47 4.360 1.797 4.589 1.00 0.00 C ATOM 1389 CD GLN B 47 4.614 1.610 6.077 1.00 0.00 C ATOM 1390 OE1 GLN B 47 5.505 2.353 6.673 1.00 0.00 O flip ATOM 1391 NE2 GLN B 47 3.993 0.756 6.711 1.00 0.00 N flip ATOM 0 H GLN B 47 4.847 -0.093 2.553 1.00 0.00 H new ATOM 0 HA GLN B 47 4.682 2.699 2.133 1.00 0.00 H new ATOM 0 HB2 GLN B 47 6.260 0.920 4.054 1.00 0.00 H new ATOM 0 HB3 GLN B 47 6.289 2.669 4.160 1.00 0.00 H new ATOM 0 HG2 GLN B 47 3.817 2.727 4.418 1.00 0.00 H new ATOM 0 HG3 GLN B 47 3.733 0.988 4.214 1.00 0.00 H new ATOM 0 HE21 GLN B 47 3.297 0.177 6.241 1.00 0.00 H new ATOM 0 HE22 GLN B 47 4.175 0.627 7.706 1.00 0.00 H new ATOM 1400 N SER B 48 7.557 1.277 1.391 1.00 0.00 N ATOM 1401 CA SER B 48 8.821 1.513 0.708 1.00 0.00 C ATOM 1402 C SER B 48 8.572 2.020 -0.705 1.00 0.00 C ATOM 1403 O SER B 48 9.187 2.989 -1.148 1.00 0.00 O ATOM 1404 CB SER B 48 9.637 0.222 0.655 1.00 0.00 C ATOM 1405 OG SER B 48 10.863 0.468 -0.022 1.00 0.00 O ATOM 0 H SER B 48 7.398 0.310 1.675 1.00 0.00 H new ATOM 0 HA SER B 48 9.379 2.268 1.262 1.00 0.00 H new ATOM 0 HB2 SER B 48 9.832 -0.140 1.664 1.00 0.00 H new ATOM 0 HB3 SER B 48 9.074 -0.557 0.140 1.00 0.00 H new ATOM 0 HG SER B 48 11.389 -0.358 -0.056 1.00 0.00 H new ATOM 1411 N GLN B 49 7.660 1.357 -1.404 1.00 0.00 N ATOM 1412 CA GLN B 49 7.326 1.744 -2.767 1.00 0.00 C ATOM 1413 C GLN B 49 6.666 3.121 -2.785 1.00 0.00 C ATOM 1414 O GLN B 49 6.920 3.931 -3.676 1.00 0.00 O ATOM 1415 CB GLN B 49 6.380 0.711 -3.385 1.00 0.00 C ATOM 1416 CG GLN B 49 6.194 0.999 -4.877 1.00 0.00 C ATOM 1417 CD GLN B 49 7.514 0.818 -5.622 1.00 0.00 C ATOM 1418 OE1 GLN B 49 8.134 -0.243 -5.541 1.00 0.00 O ATOM 1419 NE2 GLN B 49 7.984 1.797 -6.347 1.00 0.00 N ATOM 0 H GLN B 49 7.141 0.553 -1.051 1.00 0.00 H new ATOM 0 HA GLN B 49 8.246 1.788 -3.351 1.00 0.00 H new ATOM 0 HB2 GLN B 49 6.783 -0.292 -3.247 1.00 0.00 H new ATOM 0 HB3 GLN B 49 5.416 0.739 -2.878 1.00 0.00 H new ATOM 0 HG2 GLN B 49 5.440 0.330 -5.292 1.00 0.00 H new ATOM 0 HG3 GLN B 49 5.828 2.016 -5.015 1.00 0.00 H new ATOM 0 HE21 GLN B 49 7.469 2.675 -6.413 1.00 0.00 H new ATOM 0 HE22 GLN B 49 8.866 1.684 -6.847 1.00 0.00 H new ATOM 1428 N PHE B 50 5.810 3.374 -1.795 1.00 0.00 N ATOM 1429 CA PHE B 50 5.110 4.653 -1.709 1.00 0.00 C ATOM 1430 C PHE B 50 6.097 5.809 -1.615 1.00 0.00 C ATOM 1431 O PHE B 50 5.959 6.809 -2.319 1.00 0.00 O ATOM 1432 CB PHE B 50 4.160 4.671 -0.502 1.00 0.00 C ATOM 1433 CG PHE B 50 3.586 6.063 -0.332 1.00 0.00 C ATOM 1434 CD1 PHE B 50 2.838 6.643 -1.367 1.00 0.00 C ATOM 1435 CD2 PHE B 50 3.822 6.783 0.849 1.00 0.00 C ATOM 1436 CE1 PHE B 50 2.324 7.939 -1.218 1.00 0.00 C ATOM 1437 CE2 PHE B 50 3.313 8.081 0.993 1.00 0.00 C ATOM 1438 CZ PHE B 50 2.564 8.659 -0.041 1.00 0.00 C ATOM 0 H PHE B 50 5.587 2.716 -1.048 1.00 0.00 H new ATOM 0 HA PHE B 50 4.523 4.774 -2.619 1.00 0.00 H new ATOM 0 HB2 PHE B 50 3.356 3.950 -0.648 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.695 4.374 0.400 1.00 0.00 H new ATOM 0 HD1 PHE B 50 2.658 6.092 -2.278 1.00 0.00 H new ATOM 0 HD2 PHE B 50 4.396 6.337 1.648 1.00 0.00 H new ATOM 0 HE1 PHE B 50 1.742 8.383 -2.012 1.00 0.00 H new ATOM 0 HE2 PHE B 50 3.498 8.636 1.901 1.00 0.00 H new ATOM 0 HZ PHE B 50 2.172 9.659 0.070 1.00 0.00 H new ATOM 1448 N ARG B 51 7.091 5.677 -0.744 1.00 0.00 N ATOM 1449 CA ARG B 51 8.082 6.732 -0.584 1.00 0.00 C ATOM 1450 C ARG B 51 8.810 6.971 -1.903 1.00 0.00 C ATOM 1451 O ARG B 51 9.065 8.112 -2.288 1.00 0.00 O ATOM 1452 CB ARG B 51 9.096 6.335 0.491 1.00 0.00 C ATOM 1453 CG ARG B 51 8.425 6.357 1.866 1.00 0.00 C ATOM 1454 CD ARG B 51 9.389 5.793 2.909 1.00 0.00 C ATOM 1455 NE ARG B 51 8.793 5.858 4.239 1.00 0.00 N ATOM 1456 CZ ARG B 51 9.388 5.298 5.287 1.00 0.00 C ATOM 1457 NH1 ARG B 51 10.524 4.673 5.135 1.00 0.00 N ATOM 1458 NH2 ARG B 51 8.836 5.369 6.467 1.00 0.00 N ATOM 0 H ARG B 51 7.231 4.862 -0.146 1.00 0.00 H new ATOM 0 HA ARG B 51 7.573 7.648 -0.283 1.00 0.00 H new ATOM 0 HB2 ARG B 51 9.490 5.340 0.284 1.00 0.00 H new ATOM 0 HB3 ARG B 51 9.942 7.022 0.478 1.00 0.00 H new ATOM 0 HG2 ARG B 51 8.143 7.376 2.129 1.00 0.00 H new ATOM 0 HG3 ARG B 51 7.508 5.768 1.845 1.00 0.00 H new ATOM 0 HD2 ARG B 51 9.636 4.760 2.664 1.00 0.00 H new ATOM 0 HD3 ARG B 51 10.322 6.356 2.894 1.00 0.00 H new ATOM 0 HE ARG B 51 7.904 6.342 4.367 1.00 0.00 H new ATOM 0 HH11 ARG B 51 10.955 4.615 4.212 1.00 0.00 H new ATOM 0 HH12 ARG B 51 10.981 4.243 5.939 1.00 0.00 H new ATOM 0 HH21 ARG B 51 7.947 5.855 6.586 1.00 0.00 H new ATOM 0 HH22 ARG B 51 9.293 4.939 7.271 1.00 0.00 H new ATOM 1472 N LYS B 52 9.131 5.884 -2.597 1.00 0.00 N ATOM 1473 CA LYS B 52 9.817 5.979 -3.881 1.00 0.00 C ATOM 1474 C LYS B 52 8.924 6.650 -4.924 1.00 0.00 C ATOM 1475 O LYS B 52 9.392 7.433 -5.750 1.00 0.00 O ATOM 1476 CB LYS B 52 10.202 4.576 -4.368 1.00 0.00 C ATOM 1477 CG LYS B 52 11.303 3.985 -3.476 1.00 0.00 C ATOM 1478 CD LYS B 52 12.681 4.485 -3.927 1.00 0.00 C ATOM 1479 CE LYS B 52 13.767 3.787 -3.105 1.00 0.00 C ATOM 1480 NZ LYS B 52 15.107 4.265 -3.546 1.00 0.00 N ATOM 0 H LYS B 52 8.928 4.931 -2.294 1.00 0.00 H new ATOM 0 HA LYS B 52 10.715 6.583 -3.747 1.00 0.00 H new ATOM 0 HB2 LYS B 52 9.327 3.927 -4.355 1.00 0.00 H new ATOM 0 HB3 LYS B 52 10.548 4.624 -5.400 1.00 0.00 H new ATOM 0 HG2 LYS B 52 11.129 4.266 -2.437 1.00 0.00 H new ATOM 0 HG3 LYS B 52 11.271 2.896 -3.521 1.00 0.00 H new ATOM 0 HD2 LYS B 52 12.825 4.281 -4.988 1.00 0.00 H new ATOM 0 HD3 LYS B 52 12.749 5.565 -3.798 1.00 0.00 H new ATOM 0 HE2 LYS B 52 13.626 3.995 -2.044 1.00 0.00 H new ATOM 0 HE3 LYS B 52 13.695 2.707 -3.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 15.846 3.791 -2.988 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 15.240 4.045 -4.554 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 15.173 5.293 -3.405 1.00 0.00 H new ATOM 1494 N PHE B 53 7.637 6.317 -4.890 1.00 0.00 N ATOM 1495 CA PHE B 53 6.679 6.869 -5.844 1.00 0.00 C ATOM 1496 C PHE B 53 6.610 8.392 -5.748 1.00 0.00 C ATOM 1497 O PHE B 53 6.701 9.088 -6.760 1.00 0.00 O ATOM 1498 CB PHE B 53 5.298 6.267 -5.575 1.00 0.00 C ATOM 1499 CG PHE B 53 4.273 6.875 -6.504 1.00 0.00 C ATOM 1500 CD1 PHE B 53 4.186 6.440 -7.832 1.00 0.00 C ATOM 1501 CD2 PHE B 53 3.402 7.865 -6.033 1.00 0.00 C ATOM 1502 CE1 PHE B 53 3.229 6.996 -8.690 1.00 0.00 C ATOM 1503 CE2 PHE B 53 2.445 8.420 -6.890 1.00 0.00 C ATOM 1504 CZ PHE B 53 2.358 7.986 -8.218 1.00 0.00 C ATOM 0 H PHE B 53 7.233 5.669 -4.214 1.00 0.00 H new ATOM 0 HA PHE B 53 7.008 6.614 -6.851 1.00 0.00 H new ATOM 0 HB2 PHE B 53 5.331 5.187 -5.715 1.00 0.00 H new ATOM 0 HB3 PHE B 53 5.011 6.445 -4.539 1.00 0.00 H new ATOM 0 HD1 PHE B 53 4.857 5.676 -8.195 1.00 0.00 H new ATOM 0 HD2 PHE B 53 3.469 8.200 -5.009 1.00 0.00 H new ATOM 0 HE1 PHE B 53 3.163 6.662 -9.715 1.00 0.00 H new ATOM 0 HE2 PHE B 53 1.773 9.184 -6.527 1.00 0.00 H new ATOM 0 HZ PHE B 53 1.619 8.415 -8.879 1.00 0.00 H new ATOM 1514 N GLN B 54 6.452 8.909 -4.533 1.00 0.00 N ATOM 1515 CA GLN B 54 6.378 10.355 -4.342 1.00 0.00 C ATOM 1516 C GLN B 54 7.743 10.999 -4.569 1.00 0.00 C ATOM 1517 O GLN B 54 7.834 12.167 -4.945 1.00 0.00 O ATOM 1518 CB GLN B 54 5.870 10.680 -2.936 1.00 0.00 C ATOM 1519 CG GLN B 54 6.828 10.107 -1.891 1.00 0.00 C ATOM 1520 CD GLN B 54 6.291 10.385 -0.490 1.00 0.00 C ATOM 1521 OE1 GLN B 54 5.933 9.389 0.273 1.00 0.00 O flip ATOM 1522 NE2 GLN B 54 6.188 11.543 -0.084 1.00 0.00 N flip ATOM 0 H GLN B 54 6.374 8.359 -3.678 1.00 0.00 H new ATOM 0 HA GLN B 54 5.678 10.761 -5.072 1.00 0.00 H new ATOM 0 HB2 GLN B 54 5.785 11.759 -2.811 1.00 0.00 H new ATOM 0 HB3 GLN B 54 4.873 10.263 -2.795 1.00 0.00 H new ATOM 0 HG2 GLN B 54 6.943 9.033 -2.040 1.00 0.00 H new ATOM 0 HG3 GLN B 54 7.816 10.553 -2.007 1.00 0.00 H new ATOM 0 HE21 GLN B 54 6.469 12.320 -0.682 1.00 0.00 H new ATOM 0 HE22 GLN B 54 5.822 11.725 0.851 1.00 0.00 H new ATOM 1531 N LYS B 55 8.800 10.225 -4.347 1.00 0.00 N ATOM 1532 CA LYS B 55 10.157 10.725 -4.538 1.00 0.00 C ATOM 1533 C LYS B 55 10.371 11.121 -5.996 1.00 0.00 C ATOM 1534 O LYS B 55 10.980 12.148 -6.290 1.00 0.00 O ATOM 1535 CB LYS B 55 11.171 9.649 -4.136 1.00 0.00 C ATOM 1536 CG LYS B 55 12.597 10.188 -4.294 1.00 0.00 C ATOM 1537 CD LYS B 55 13.597 9.117 -3.857 1.00 0.00 C ATOM 1538 CE LYS B 55 15.021 9.651 -4.020 1.00 0.00 C ATOM 1539 NZ LYS B 55 15.995 8.611 -3.583 1.00 0.00 N ATOM 0 H LYS B 55 8.745 9.255 -4.037 1.00 0.00 H new ATOM 0 HA LYS B 55 10.300 11.604 -3.909 1.00 0.00 H new ATOM 0 HB2 LYS B 55 11.001 9.345 -3.103 1.00 0.00 H new ATOM 0 HB3 LYS B 55 11.038 8.762 -4.756 1.00 0.00 H new ATOM 0 HG2 LYS B 55 12.778 10.469 -5.331 1.00 0.00 H new ATOM 0 HG3 LYS B 55 12.726 11.088 -3.693 1.00 0.00 H new ATOM 0 HD2 LYS B 55 13.418 8.840 -2.818 1.00 0.00 H new ATOM 0 HD3 LYS B 55 13.465 8.215 -4.455 1.00 0.00 H new ATOM 0 HE2 LYS B 55 15.203 9.920 -5.060 1.00 0.00 H new ATOM 0 HE3 LYS B 55 15.151 10.557 -3.429 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 16.963 8.974 -3.694 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 15.826 8.375 -2.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 15.876 7.758 -4.166 1.00 0.00 H new ATOM 1553 N LYS B 56 9.865 10.291 -6.902 1.00 0.00 N ATOM 1554 CA LYS B 56 10.005 10.551 -8.331 1.00 0.00 C ATOM 1555 C LYS B 56 9.354 11.881 -8.701 1.00 0.00 C ATOM 1556 O LYS B 56 9.918 12.668 -9.461 1.00 0.00 O ATOM 1557 CB LYS B 56 9.352 9.413 -9.126 1.00 0.00 C ATOM 1558 CG LYS B 56 9.519 9.662 -10.629 1.00 0.00 C ATOM 1559 CD LYS B 56 8.911 8.497 -11.410 1.00 0.00 C ATOM 1560 CE LYS B 56 9.090 8.739 -12.909 1.00 0.00 C ATOM 1561 NZ LYS B 56 8.338 9.963 -13.307 1.00 0.00 N ATOM 0 H LYS B 56 9.357 9.437 -6.674 1.00 0.00 H new ATOM 0 HA LYS B 56 11.066 10.605 -8.576 1.00 0.00 H new ATOM 0 HB2 LYS B 56 9.807 8.460 -8.854 1.00 0.00 H new ATOM 0 HB3 LYS B 56 8.293 9.344 -8.876 1.00 0.00 H new ATOM 0 HG2 LYS B 56 9.032 10.596 -10.910 1.00 0.00 H new ATOM 0 HG3 LYS B 56 10.575 9.767 -10.876 1.00 0.00 H new ATOM 0 HD2 LYS B 56 9.392 7.562 -11.122 1.00 0.00 H new ATOM 0 HD3 LYS B 56 7.852 8.398 -11.171 1.00 0.00 H new ATOM 0 HE2 LYS B 56 10.148 8.856 -13.146 1.00 0.00 H new ATOM 0 HE3 LYS B 56 8.730 7.878 -13.473 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 7.812 9.777 -14.184 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 7.672 10.222 -12.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 9.005 10.745 -13.463 1.00 0.00 H new ATOM 1575 N LYS B 57 8.162 12.121 -8.167 1.00 0.00 N ATOM 1576 CA LYS B 57 7.440 13.357 -8.454 1.00 0.00 C ATOM 1577 C LYS B 57 8.244 14.573 -8.000 1.00 0.00 C ATOM 1578 O LYS B 57 8.334 15.571 -8.714 1.00 0.00 O ATOM 1579 CB LYS B 57 6.086 13.340 -7.735 1.00 0.00 C ATOM 1580 CG LYS B 57 5.302 14.617 -8.060 1.00 0.00 C ATOM 1581 CD LYS B 57 3.940 14.570 -7.363 1.00 0.00 C ATOM 1582 CE LYS B 57 3.178 15.866 -7.642 1.00 0.00 C ATOM 1583 NZ LYS B 57 2.914 15.983 -9.103 1.00 0.00 N ATOM 0 H LYS B 57 7.677 11.482 -7.537 1.00 0.00 H new ATOM 0 HA LYS B 57 7.286 13.426 -9.531 1.00 0.00 H new ATOM 0 HB2 LYS B 57 5.514 12.464 -8.041 1.00 0.00 H new ATOM 0 HB3 LYS B 57 6.238 13.261 -6.659 1.00 0.00 H new ATOM 0 HG2 LYS B 57 5.861 15.493 -7.731 1.00 0.00 H new ATOM 0 HG3 LYS B 57 5.168 14.710 -9.138 1.00 0.00 H new ATOM 0 HD2 LYS B 57 3.366 13.715 -7.720 1.00 0.00 H new ATOM 0 HD3 LYS B 57 4.074 14.438 -6.289 1.00 0.00 H new ATOM 0 HE2 LYS B 57 2.238 15.874 -7.090 1.00 0.00 H new ATOM 0 HE3 LYS B 57 3.757 16.722 -7.297 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 2.144 16.663 -9.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 3.774 16.313 -9.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 2.640 15.054 -9.482 1.00 0.00 H new ATOM 1597 N ALA B 58 8.812 14.487 -6.802 1.00 0.00 N ATOM 1598 CA ALA B 58 9.591 15.591 -6.251 1.00 0.00 C ATOM 1599 C ALA B 58 11.082 15.416 -6.521 1.00 0.00 C ATOM 1600 O ALA B 58 11.911 16.070 -5.889 1.00 0.00 O ATOM 1601 CB ALA B 58 9.355 15.691 -4.744 1.00 0.00 C ATOM 0 H ALA B 58 8.749 13.669 -6.196 1.00 0.00 H new ATOM 0 HA ALA B 58 9.262 16.507 -6.741 1.00 0.00 H new ATOM 0 HB1 ALA B 58 9.939 16.517 -4.338 1.00 0.00 H new ATOM 0 HB2 ALA B 58 8.296 15.867 -4.552 1.00 0.00 H new ATOM 0 HB3 ALA B 58 9.661 14.761 -4.265 1.00 0.00 H new ATOM 1607 N GLY B 59 11.426 14.531 -7.451 1.00 0.00 N ATOM 1608 CA GLY B 59 12.832 14.299 -7.765 1.00 0.00 C ATOM 1609 C GLY B 59 13.495 15.582 -8.257 1.00 0.00 C ATOM 1610 O GLY B 59 14.599 15.922 -7.832 1.00 0.00 O ATOM 0 H GLY B 59 10.766 13.972 -7.991 1.00 0.00 H new ATOM 0 HA2 GLY B 59 13.351 13.932 -6.880 1.00 0.00 H new ATOM 0 HA3 GLY B 59 12.916 13.525 -8.528 1.00 0.00 H new ATOM 1614 N SER B 60 12.809 16.297 -9.140 1.00 0.00 N ATOM 1615 CA SER B 60 13.334 17.552 -9.669 1.00 0.00 C ATOM 1616 C SER B 60 14.825 17.434 -9.975 1.00 0.00 C ATOM 1617 O SER B 60 15.596 18.353 -9.698 1.00 0.00 O ATOM 1618 CB SER B 60 13.105 18.676 -8.658 1.00 0.00 C ATOM 1619 OG SER B 60 11.712 18.807 -8.410 1.00 0.00 O ATOM 0 H SER B 60 11.893 16.033 -9.504 1.00 0.00 H new ATOM 0 HA SER B 60 12.808 17.779 -10.596 1.00 0.00 H new ATOM 0 HB2 SER B 60 13.633 18.459 -7.729 1.00 0.00 H new ATOM 0 HB3 SER B 60 13.508 19.613 -9.042 1.00 0.00 H new ATOM 0 HG SER B 60 11.561 19.526 -7.761 1.00 0.00 H new ATOM 1625 N GLN B 61 15.228 16.302 -10.542 1.00 0.00 N ATOM 1626 CA GLN B 61 16.634 16.089 -10.872 1.00 0.00 C ATOM 1627 C GLN B 61 17.098 17.083 -11.934 1.00 0.00 C ATOM 1628 O GLN B 61 16.306 17.538 -12.759 1.00 0.00 O ATOM 1629 CB GLN B 61 16.845 14.658 -11.375 1.00 0.00 C ATOM 1630 CG GLN B 61 16.080 14.451 -12.685 1.00 0.00 C ATOM 1631 CD GLN B 61 16.161 12.988 -13.104 1.00 0.00 C ATOM 1632 OE1 GLN B 61 15.609 12.116 -12.432 1.00 0.00 O ATOM 1633 NE2 GLN B 61 16.820 12.664 -14.183 1.00 0.00 N ATOM 0 H GLN B 61 14.610 15.526 -10.781 1.00 0.00 H new ATOM 0 HA GLN B 61 17.224 16.245 -9.969 1.00 0.00 H new ATOM 0 HB2 GLN B 61 17.907 14.470 -11.530 1.00 0.00 H new ATOM 0 HB3 GLN B 61 16.501 13.945 -10.626 1.00 0.00 H new ATOM 0 HG2 GLN B 61 15.038 14.746 -12.559 1.00 0.00 H new ATOM 0 HG3 GLN B 61 16.499 15.086 -13.466 1.00 0.00 H new ATOM 0 HE21 GLN B 61 17.277 13.388 -14.738 1.00 0.00 H new ATOM 0 HE22 GLN B 61 16.878 11.687 -14.471 1.00 0.00 H new ATOM 1642 N SER B 62 18.387 17.412 -11.904 1.00 0.00 N ATOM 1643 CA SER B 62 18.950 18.353 -12.867 1.00 0.00 C ATOM 1644 C SER B 62 17.989 19.510 -13.114 1.00 0.00 C ATOM 1645 O SER B 62 17.852 19.905 -14.261 1.00 0.00 O ATOM 1646 CB SER B 62 19.244 17.639 -14.186 1.00 0.00 C ATOM 1647 OG SER B 62 19.817 16.366 -13.915 1.00 0.00 O ATOM 1648 OXT SER B 62 17.403 19.983 -12.155 1.00 0.00 O ATOM 0 H SER B 62 19.057 17.044 -11.228 1.00 0.00 H new ATOM 0 HA SER B 62 19.878 18.750 -12.456 1.00 0.00 H new ATOM 0 HB2 SER B 62 18.326 17.522 -14.762 1.00 0.00 H new ATOM 0 HB3 SER B 62 19.926 18.236 -14.792 1.00 0.00 H new ATOM 0 HG SER B 62 20.005 15.905 -14.759 1.00 0.00 H new TER 1654 SER B 62