USER MOD reduce.3.24.130724 H: found=0, std=0, add=1113, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1113 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 91 HIS :FLIP no HD1:sc= -0.366 F(o=-2,f=-0.55) USER MOD Set 1.2: A 124 SER OG : rot -86:sc= -0.702! USER MOD Set 1.3: A 128 THR OG1 : rot 72:sc= 0.519 USER MOD Set 2.1: A 64 LYS NZ :NH3+ 161:sc= 0.058 (180deg=0.00676) USER MOD Set 2.2: A 107 ASN : amide:sc= -1.9! C(o=-1.8!,f=-6.7!) USER MOD Set 3.1: A 53 HIS : no HD1:sc= 0.0385 K(o=0.93,f=-1.6!) USER MOD Set 3.2: A 71 TYR OH : rot -114:sc= 0.893 USER MOD Single : A 1 GLY N :NH3+ -177:sc= 0 (180deg=-0.015) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 CYS SG : rot -120:sc= -0.859 USER MOD Single : A 25 MET CE :methyl 174:sc= -1.14 (180deg=-1.22) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -150:sc= -0.419 (180deg=-1.53!) USER MOD Single : A 32 SER OG : rot 144:sc= 1.25 USER MOD Single : A 35 ASN : amide:sc= 0.159 X(o=0.16,f=0) USER MOD Single : A 38 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.027) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 THR OG1 : rot -1:sc= 0.306 USER MOD Single : A 44 ASN :FLIP amide:sc= -0.913 F(o=-2!,f=-0.91) USER MOD Single : A 45 LYS NZ :NH3+ -152:sc= -0.0555 (180deg=-0.53) USER MOD Single : A 46 LYS NZ :NH3+ -119:sc= 0.113 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 160:sc= -0.0624 (180deg=-0.764) USER MOD Single : A 58 ASN : amide:sc= 0.53 K(o=0.53,f=-6.3!) USER MOD Single : A 63 HIS : no HD1:sc=-0.00331 X(o=-0.0033,f=-0.12) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 56:sc= 0.046 USER MOD Single : A 75 TYR OH : rot 131:sc= 1.97 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.195) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0443 USER MOD Single : A 96 ASN : amide:sc= 2.25 K(o=2.3,f=-8.7!) USER MOD Single : A 101 GLN : amide:sc= -0.0848 X(o=-0.085,f=0) USER MOD Single : A 103 CYS SG : rot 180:sc= -0.238 USER MOD Single : A 105 LYS NZ :NH3+ 159:sc= -0.0329 (180deg=-0.23) USER MOD Single : A 111 THR OG1 : rot 47:sc= 1.21 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0.055) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 170:sc= -0.21 (180deg=-0.331) USER MOD Single : A 131 TYR OH : rot 171:sc= -1.58! USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= -1.12 USER MOD Single : A 135 THR OG1 : rot 180:sc= -0.13 USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.403 23.911 -7.195 1.00 0.00 N ATOM 2 CA GLY A 1 5.721 24.022 -6.510 1.00 0.00 C ATOM 3 C GLY A 1 6.255 22.676 -6.059 1.00 0.00 C ATOM 4 O GLY A 1 7.446 22.395 -6.199 1.00 0.00 O ATOM 0 H1 GLY A 1 4.105 24.850 -7.529 1.00 0.00 H new ATOM 0 H2 GLY A 1 4.487 23.266 -8.006 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.696 23.540 -6.529 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.440 24.487 -7.185 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.624 24.679 -5.646 1.00 0.00 H new ATOM 10 N SER A 2 5.373 21.844 -5.516 1.00 0.00 N ATOM 11 CA SER A 2 5.761 20.520 -5.043 1.00 0.00 C ATOM 12 C SER A 2 5.054 19.428 -5.840 1.00 0.00 C ATOM 13 O SER A 2 5.654 18.411 -6.184 1.00 0.00 O ATOM 14 CB SER A 2 5.436 20.373 -3.555 1.00 0.00 C ATOM 15 OG SER A 2 6.545 20.739 -2.752 1.00 0.00 O ATOM 0 H SER A 2 4.384 22.063 -5.392 1.00 0.00 H new ATOM 0 HA SER A 2 6.836 20.411 -5.187 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.579 20.998 -3.303 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.153 19.342 -3.342 1.00 0.00 H new ATOM 0 HG SER A 2 6.311 20.638 -1.806 1.00 0.00 H new ATOM 21 N SER A 3 3.775 19.649 -6.129 1.00 0.00 N ATOM 22 CA SER A 3 2.985 18.683 -6.884 1.00 0.00 C ATOM 23 C SER A 3 3.255 18.810 -8.380 1.00 0.00 C ATOM 24 O SER A 3 3.620 19.880 -8.867 1.00 0.00 O ATOM 25 CB SER A 3 1.495 18.885 -6.606 1.00 0.00 C ATOM 26 OG SER A 3 0.814 17.643 -6.553 1.00 0.00 O ATOM 0 H SER A 3 3.264 20.487 -5.852 1.00 0.00 H new ATOM 0 HA SER A 3 3.276 17.683 -6.564 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.366 19.415 -5.662 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.058 19.510 -7.385 1.00 0.00 H new ATOM 0 HG SER A 3 -0.137 17.799 -6.372 1.00 0.00 H new ATOM 32 N GLY A 4 3.075 17.710 -9.103 1.00 0.00 N ATOM 33 CA GLY A 4 3.303 17.719 -10.537 1.00 0.00 C ATOM 34 C GLY A 4 3.701 16.356 -11.069 1.00 0.00 C ATOM 35 O GLY A 4 2.970 15.751 -11.852 1.00 0.00 O ATOM 0 H GLY A 4 2.775 16.812 -8.722 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.398 18.053 -11.044 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.085 18.440 -10.773 1.00 0.00 H new ATOM 39 N SER A 5 4.864 15.874 -10.643 1.00 0.00 N ATOM 40 CA SER A 5 5.359 14.575 -11.082 1.00 0.00 C ATOM 41 C SER A 5 5.073 13.502 -10.038 1.00 0.00 C ATOM 42 O SER A 5 5.836 12.547 -9.888 1.00 0.00 O ATOM 43 CB SER A 5 6.862 14.645 -11.360 1.00 0.00 C ATOM 44 OG SER A 5 7.231 13.757 -12.401 1.00 0.00 O ATOM 0 H SER A 5 5.481 16.363 -9.995 1.00 0.00 H new ATOM 0 HA SER A 5 4.839 14.309 -12.002 1.00 0.00 H new ATOM 0 HB2 SER A 5 7.137 15.664 -11.632 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.414 14.397 -10.454 1.00 0.00 H new ATOM 0 HG SER A 5 8.196 13.822 -12.560 1.00 0.00 H new ATOM 50 N SER A 6 3.969 13.665 -9.316 1.00 0.00 N ATOM 51 CA SER A 6 3.582 12.709 -8.284 1.00 0.00 C ATOM 52 C SER A 6 2.107 12.339 -8.411 1.00 0.00 C ATOM 53 O SER A 6 1.264 13.192 -8.687 1.00 0.00 O ATOM 54 CB SER A 6 3.857 13.287 -6.895 1.00 0.00 C ATOM 55 OG SER A 6 4.298 12.280 -6.002 1.00 0.00 O ATOM 0 H SER A 6 3.327 14.450 -9.426 1.00 0.00 H new ATOM 0 HA SER A 6 4.178 11.806 -8.418 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.612 14.070 -6.966 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.951 13.752 -6.505 1.00 0.00 H new ATOM 0 HG SER A 6 4.469 12.675 -5.122 1.00 0.00 H new ATOM 61 N GLY A 7 1.804 11.061 -8.207 1.00 0.00 N ATOM 62 CA GLY A 7 0.430 10.601 -8.302 1.00 0.00 C ATOM 63 C GLY A 7 0.147 9.431 -7.381 1.00 0.00 C ATOM 64 O GLY A 7 -0.838 9.440 -6.643 1.00 0.00 O ATOM 0 H GLY A 7 2.484 10.336 -7.978 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.243 11.423 -8.058 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.218 10.310 -9.331 1.00 0.00 H new ATOM 68 N GLU A 8 1.011 8.423 -7.425 1.00 0.00 N ATOM 69 CA GLU A 8 0.849 7.240 -6.587 1.00 0.00 C ATOM 70 C GLU A 8 1.210 7.546 -5.138 1.00 0.00 C ATOM 71 O GLU A 8 1.959 8.482 -4.859 1.00 0.00 O ATOM 72 CB GLU A 8 1.719 6.096 -7.111 1.00 0.00 C ATOM 73 CG GLU A 8 1.353 4.740 -6.532 1.00 0.00 C ATOM 74 CD GLU A 8 -0.040 4.293 -6.928 1.00 0.00 C ATOM 75 OE1 GLU A 8 -1.016 4.782 -6.320 1.00 0.00 O ATOM 76 OE2 GLU A 8 -0.157 3.455 -7.847 1.00 0.00 O ATOM 0 H GLU A 8 1.831 8.401 -8.032 1.00 0.00 H new ATOM 0 HA GLU A 8 -0.198 6.939 -6.625 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.633 6.053 -8.197 1.00 0.00 H new ATOM 0 HB3 GLU A 8 2.763 6.310 -6.882 1.00 0.00 H new ATOM 0 HG2 GLU A 8 2.078 3.998 -6.868 1.00 0.00 H new ATOM 0 HG3 GLU A 8 1.421 4.783 -5.445 1.00 0.00 H new ATOM 83 N ALA A 9 0.673 6.751 -4.219 1.00 0.00 N ATOM 84 CA ALA A 9 0.939 6.937 -2.797 1.00 0.00 C ATOM 85 C ALA A 9 2.182 6.166 -2.367 1.00 0.00 C ATOM 86 O ALA A 9 3.161 6.754 -1.906 1.00 0.00 O ATOM 87 CB ALA A 9 -0.264 6.504 -1.974 1.00 0.00 C ATOM 0 H ALA A 9 0.051 5.972 -4.433 1.00 0.00 H new ATOM 0 HA ALA A 9 1.122 7.997 -2.622 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -0.051 6.648 -0.915 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -1.131 7.102 -2.255 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -0.473 5.451 -2.162 1.00 0.00 H new ATOM 93 N LEU A 10 2.137 4.848 -2.523 1.00 0.00 N ATOM 94 CA LEU A 10 3.260 3.996 -2.151 1.00 0.00 C ATOM 95 C LEU A 10 4.475 4.287 -3.026 1.00 0.00 C ATOM 96 O LEU A 10 4.402 5.087 -3.960 1.00 0.00 O ATOM 97 CB LEU A 10 2.872 2.521 -2.273 1.00 0.00 C ATOM 98 CG LEU A 10 1.610 2.119 -1.506 1.00 0.00 C ATOM 99 CD1 LEU A 10 1.186 0.707 -1.880 1.00 0.00 C ATOM 100 CD2 LEU A 10 1.843 2.229 -0.007 1.00 0.00 C ATOM 0 H LEU A 10 1.335 4.346 -2.904 1.00 0.00 H new ATOM 0 HA LEU A 10 3.519 4.211 -1.114 1.00 0.00 H new ATOM 0 HB2 LEU A 10 2.729 2.284 -3.327 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.704 1.912 -1.919 1.00 0.00 H new ATOM 0 HG LEU A 10 0.806 2.802 -1.780 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.287 0.438 -1.325 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.980 0.660 -2.949 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.987 0.009 -1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 10 0.936 1.940 0.524 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.660 1.569 0.284 1.00 0.00 H new ATOM 0 HD23 LEU A 10 2.100 3.257 0.247 1.00 0.00 H new ATOM 112 N ASP A 11 5.591 3.635 -2.718 1.00 0.00 N ATOM 113 CA ASP A 11 6.821 3.825 -3.476 1.00 0.00 C ATOM 114 C ASP A 11 6.819 2.967 -4.739 1.00 0.00 C ATOM 115 O ASP A 11 5.811 2.346 -5.077 1.00 0.00 O ATOM 116 CB ASP A 11 8.036 3.483 -2.611 1.00 0.00 C ATOM 117 CG ASP A 11 9.060 4.601 -2.583 1.00 0.00 C ATOM 118 OD1 ASP A 11 8.765 5.660 -1.989 1.00 0.00 O ATOM 119 OD2 ASP A 11 10.155 4.418 -3.155 1.00 0.00 O ATOM 0 H ASP A 11 5.668 2.970 -1.948 1.00 0.00 H new ATOM 0 HA ASP A 11 6.880 4.873 -3.771 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.706 3.271 -1.594 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.504 2.575 -2.990 1.00 0.00 H new ATOM 124 N ALA A 12 7.953 2.939 -5.430 1.00 0.00 N ATOM 125 CA ALA A 12 8.082 2.158 -6.655 1.00 0.00 C ATOM 126 C ALA A 12 8.215 0.671 -6.346 1.00 0.00 C ATOM 127 O ALA A 12 7.707 -0.174 -7.083 1.00 0.00 O ATOM 128 CB ALA A 12 9.277 2.639 -7.464 1.00 0.00 C ATOM 0 H ALA A 12 8.796 3.448 -5.163 1.00 0.00 H new ATOM 0 HA ALA A 12 7.176 2.301 -7.245 1.00 0.00 H new ATOM 0 HB1 ALA A 12 9.361 2.047 -8.376 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.142 3.689 -7.724 1.00 0.00 H new ATOM 0 HB3 ALA A 12 10.186 2.526 -6.873 1.00 0.00 H new ATOM 134 N ALA A 13 8.900 0.359 -5.250 1.00 0.00 N ATOM 135 CA ALA A 13 9.099 -1.027 -4.843 1.00 0.00 C ATOM 136 C ALA A 13 7.925 -1.529 -4.008 1.00 0.00 C ATOM 137 O ALA A 13 7.589 -2.712 -4.039 1.00 0.00 O ATOM 138 CB ALA A 13 10.399 -1.167 -4.067 1.00 0.00 C ATOM 0 H ALA A 13 9.326 1.047 -4.629 1.00 0.00 H new ATOM 0 HA ALA A 13 9.158 -1.639 -5.743 1.00 0.00 H new ATOM 0 HB1 ALA A 13 10.535 -2.207 -3.769 1.00 0.00 H new ATOM 0 HB2 ALA A 13 11.234 -0.858 -4.696 1.00 0.00 H new ATOM 0 HB3 ALA A 13 10.362 -0.537 -3.178 1.00 0.00 H new ATOM 144 N ALA A 14 7.305 -0.619 -3.263 1.00 0.00 N ATOM 145 CA ALA A 14 6.170 -0.969 -2.419 1.00 0.00 C ATOM 146 C ALA A 14 5.014 -1.512 -3.253 1.00 0.00 C ATOM 147 O ALA A 14 4.465 -2.573 -2.955 1.00 0.00 O ATOM 148 CB ALA A 14 5.719 0.240 -1.613 1.00 0.00 C ATOM 0 H ALA A 14 7.570 0.365 -3.227 1.00 0.00 H new ATOM 0 HA ALA A 14 6.488 -1.752 -1.731 1.00 0.00 H new ATOM 0 HB1 ALA A 14 4.870 -0.036 -0.987 1.00 0.00 H new ATOM 0 HB2 ALA A 14 6.539 0.583 -0.982 1.00 0.00 H new ATOM 0 HB3 ALA A 14 5.424 1.040 -2.292 1.00 0.00 H new ATOM 154 N ALA A 15 4.649 -0.777 -4.298 1.00 0.00 N ATOM 155 CA ALA A 15 3.557 -1.184 -5.175 1.00 0.00 C ATOM 156 C ALA A 15 3.845 -2.536 -5.819 1.00 0.00 C ATOM 157 O ALA A 15 2.960 -3.384 -5.927 1.00 0.00 O ATOM 158 CB ALA A 15 3.318 -0.129 -6.244 1.00 0.00 C ATOM 0 H ALA A 15 5.093 0.104 -4.558 1.00 0.00 H new ATOM 0 HA ALA A 15 2.656 -1.284 -4.570 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.500 -0.446 -6.891 1.00 0.00 H new ATOM 0 HB2 ALA A 15 3.059 0.818 -5.770 1.00 0.00 H new ATOM 0 HB3 ALA A 15 4.223 -0.002 -6.838 1.00 0.00 H new ATOM 164 N LEU A 16 5.089 -2.731 -6.244 1.00 0.00 N ATOM 165 CA LEU A 16 5.494 -3.980 -6.878 1.00 0.00 C ATOM 166 C LEU A 16 5.498 -5.125 -5.871 1.00 0.00 C ATOM 167 O LEU A 16 5.238 -6.276 -6.223 1.00 0.00 O ATOM 168 CB LEU A 16 6.881 -3.833 -7.506 1.00 0.00 C ATOM 169 CG LEU A 16 6.889 -3.308 -8.942 1.00 0.00 C ATOM 170 CD1 LEU A 16 8.304 -2.952 -9.373 1.00 0.00 C ATOM 171 CD2 LEU A 16 6.285 -4.334 -9.888 1.00 0.00 C ATOM 0 H LEU A 16 5.834 -2.040 -6.161 1.00 0.00 H new ATOM 0 HA LEU A 16 4.772 -4.211 -7.661 1.00 0.00 H new ATOM 0 HB2 LEU A 16 7.474 -3.161 -6.886 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.376 -4.804 -7.487 1.00 0.00 H new ATOM 0 HG LEU A 16 6.281 -2.404 -8.981 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.290 -2.580 -10.398 1.00 0.00 H new ATOM 0 HD12 LEU A 16 8.702 -2.181 -8.713 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.935 -3.839 -9.318 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.299 -3.943 -10.905 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.866 -5.255 -9.845 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.256 -4.540 -9.593 1.00 0.00 H new ATOM 183 N SER A 17 5.796 -4.802 -4.617 1.00 0.00 N ATOM 184 CA SER A 17 5.835 -5.804 -3.558 1.00 0.00 C ATOM 185 C SER A 17 4.450 -6.398 -3.320 1.00 0.00 C ATOM 186 O SER A 17 4.320 -7.563 -2.943 1.00 0.00 O ATOM 187 CB SER A 17 6.368 -5.187 -2.264 1.00 0.00 C ATOM 188 OG SER A 17 7.134 -6.127 -1.529 1.00 0.00 O ATOM 0 H SER A 17 6.014 -3.854 -4.309 1.00 0.00 H new ATOM 0 HA SER A 17 6.504 -6.605 -3.873 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.981 -4.317 -2.498 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.535 -4.836 -1.655 1.00 0.00 H new ATOM 0 HG SER A 17 7.465 -5.708 -0.707 1.00 0.00 H new ATOM 194 N VAL A 18 3.418 -5.590 -3.541 1.00 0.00 N ATOM 195 CA VAL A 18 2.045 -6.036 -3.350 1.00 0.00 C ATOM 196 C VAL A 18 1.639 -7.040 -4.426 1.00 0.00 C ATOM 197 O VAL A 18 1.055 -8.082 -4.128 1.00 0.00 O ATOM 198 CB VAL A 18 1.059 -4.851 -3.373 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.342 -5.313 -3.002 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.529 -3.746 -2.437 1.00 0.00 C ATOM 0 H VAL A 18 3.508 -4.623 -3.853 1.00 0.00 H new ATOM 0 HA VAL A 18 2.002 -6.516 -2.372 1.00 0.00 H new ATOM 0 HB VAL A 18 1.027 -4.449 -4.386 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.023 -4.462 -3.024 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.678 -6.065 -3.716 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.330 -5.743 -2.000 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.821 -2.918 -2.467 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.592 -4.133 -1.420 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.511 -3.394 -2.753 1.00 0.00 H new ATOM 210 N ALA A 19 1.951 -6.718 -5.676 1.00 0.00 N ATOM 211 CA ALA A 19 1.619 -7.590 -6.796 1.00 0.00 C ATOM 212 C ALA A 19 2.350 -8.924 -6.687 1.00 0.00 C ATOM 213 O ALA A 19 1.847 -9.957 -7.130 1.00 0.00 O ATOM 214 CB ALA A 19 1.954 -6.908 -8.113 1.00 0.00 C ATOM 0 H ALA A 19 2.434 -5.859 -5.939 1.00 0.00 H new ATOM 0 HA ALA A 19 0.548 -7.789 -6.766 1.00 0.00 H new ATOM 0 HB1 ALA A 19 1.701 -7.571 -8.941 1.00 0.00 H new ATOM 0 HB2 ALA A 19 1.382 -5.984 -8.200 1.00 0.00 H new ATOM 0 HB3 ALA A 19 3.019 -6.680 -8.144 1.00 0.00 H new ATOM 220 N GLU A 20 3.541 -8.894 -6.098 1.00 0.00 N ATOM 221 CA GLU A 20 4.341 -10.102 -5.932 1.00 0.00 C ATOM 222 C GLU A 20 3.852 -10.923 -4.743 1.00 0.00 C ATOM 223 O GLU A 20 3.937 -12.151 -4.746 1.00 0.00 O ATOM 224 CB GLU A 20 5.816 -9.739 -5.741 1.00 0.00 C ATOM 225 CG GLU A 20 6.438 -9.064 -6.953 1.00 0.00 C ATOM 226 CD GLU A 20 7.789 -9.647 -7.317 1.00 0.00 C ATOM 227 OE1 GLU A 20 8.622 -9.827 -6.404 1.00 0.00 O ATOM 228 OE2 GLU A 20 8.014 -9.923 -8.514 1.00 0.00 O ATOM 0 H GLU A 20 3.973 -8.047 -5.728 1.00 0.00 H new ATOM 0 HA GLU A 20 4.233 -10.704 -6.834 1.00 0.00 H new ATOM 0 HB2 GLU A 20 5.910 -9.078 -4.879 1.00 0.00 H new ATOM 0 HB3 GLU A 20 6.378 -10.644 -5.512 1.00 0.00 H new ATOM 0 HG2 GLU A 20 5.764 -9.161 -7.804 1.00 0.00 H new ATOM 0 HG3 GLU A 20 6.548 -7.998 -6.754 1.00 0.00 H new ATOM 235 N CYS A 21 3.338 -10.235 -3.727 1.00 0.00 N ATOM 236 CA CYS A 21 2.835 -10.902 -2.531 1.00 0.00 C ATOM 237 C CYS A 21 1.412 -11.408 -2.747 1.00 0.00 C ATOM 238 O CYS A 21 1.082 -12.536 -2.380 1.00 0.00 O ATOM 239 CB CYS A 21 2.874 -9.947 -1.337 1.00 0.00 C ATOM 240 SG CYS A 21 3.294 -10.744 0.231 1.00 0.00 S ATOM 0 H CYS A 21 3.259 -9.218 -3.708 1.00 0.00 H new ATOM 0 HA CYS A 21 3.477 -11.758 -2.325 1.00 0.00 H new ATOM 0 HB2 CYS A 21 3.601 -9.160 -1.538 1.00 0.00 H new ATOM 0 HB3 CYS A 21 1.901 -9.465 -1.239 1.00 0.00 H new ATOM 0 HG CYS A 21 2.320 -10.579 1.076 1.00 0.00 H new ATOM 246 N VAL A 22 0.572 -10.567 -3.342 1.00 0.00 N ATOM 247 CA VAL A 22 -0.814 -10.930 -3.605 1.00 0.00 C ATOM 248 C VAL A 22 -0.900 -12.167 -4.495 1.00 0.00 C ATOM 249 O VAL A 22 -1.847 -12.947 -4.400 1.00 0.00 O ATOM 250 CB VAL A 22 -1.582 -9.771 -4.272 1.00 0.00 C ATOM 251 CG1 VAL A 22 -0.956 -9.412 -5.612 1.00 0.00 C ATOM 252 CG2 VAL A 22 -3.052 -10.125 -4.439 1.00 0.00 C ATOM 0 H VAL A 22 0.828 -9.629 -3.651 1.00 0.00 H new ATOM 0 HA VAL A 22 -1.272 -11.150 -2.641 1.00 0.00 H new ATOM 0 HB VAL A 22 -1.516 -8.899 -3.622 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -1.513 -8.592 -6.066 1.00 0.00 H new ATOM 0 HG12 VAL A 22 0.079 -9.107 -5.460 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.985 -10.279 -6.271 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.575 -9.294 -4.911 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.144 -11.013 -5.064 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -3.492 -10.322 -3.461 1.00 0.00 H new ATOM 262 N GLU A 23 0.094 -12.338 -5.358 1.00 0.00 N ATOM 263 CA GLU A 23 0.131 -13.480 -6.265 1.00 0.00 C ATOM 264 C GLU A 23 0.759 -14.700 -5.593 1.00 0.00 C ATOM 265 O GLU A 23 0.563 -15.832 -6.036 1.00 0.00 O ATOM 266 CB GLU A 23 0.913 -13.126 -7.532 1.00 0.00 C ATOM 267 CG GLU A 23 0.113 -12.302 -8.529 1.00 0.00 C ATOM 268 CD GLU A 23 -0.144 -13.043 -9.827 1.00 0.00 C ATOM 269 OE1 GLU A 23 0.797 -13.683 -10.342 1.00 0.00 O ATOM 270 OE2 GLU A 23 -1.287 -12.984 -10.328 1.00 0.00 O ATOM 0 H GLU A 23 0.885 -11.701 -5.449 1.00 0.00 H new ATOM 0 HA GLU A 23 -0.896 -13.727 -6.533 1.00 0.00 H new ATOM 0 HB2 GLU A 23 1.810 -12.573 -7.253 1.00 0.00 H new ATOM 0 HB3 GLU A 23 1.243 -14.046 -8.015 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.840 -12.021 -8.081 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.649 -11.377 -8.743 1.00 0.00 H new ATOM 277 N ARG A 24 1.513 -14.464 -4.523 1.00 0.00 N ATOM 278 CA ARG A 24 2.167 -15.547 -3.797 1.00 0.00 C ATOM 279 C ARG A 24 1.253 -16.107 -2.708 1.00 0.00 C ATOM 280 O ARG A 24 1.359 -17.277 -2.339 1.00 0.00 O ATOM 281 CB ARG A 24 3.478 -15.054 -3.178 1.00 0.00 C ATOM 282 CG ARG A 24 4.712 -15.736 -3.746 1.00 0.00 C ATOM 283 CD ARG A 24 5.874 -14.765 -3.883 1.00 0.00 C ATOM 284 NE ARG A 24 7.139 -15.455 -4.122 1.00 0.00 N ATOM 285 CZ ARG A 24 7.856 -16.040 -3.167 1.00 0.00 C ATOM 286 NH1 ARG A 24 7.437 -16.023 -1.907 1.00 0.00 N ATOM 287 NH2 ARG A 24 8.996 -16.646 -3.471 1.00 0.00 N ATOM 0 H ARG A 24 1.686 -13.534 -4.141 1.00 0.00 H new ATOM 0 HA ARG A 24 2.385 -16.346 -4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 24 3.563 -13.979 -3.335 1.00 0.00 H new ATOM 0 HB3 ARG A 24 3.446 -15.218 -2.101 1.00 0.00 H new ATOM 0 HG2 ARG A 24 5.002 -16.563 -3.098 1.00 0.00 H new ATOM 0 HG3 ARG A 24 4.477 -16.163 -4.721 1.00 0.00 H new ATOM 0 HD2 ARG A 24 5.676 -14.076 -4.704 1.00 0.00 H new ATOM 0 HD3 ARG A 24 5.954 -14.165 -2.976 1.00 0.00 H new ATOM 0 HE ARG A 24 7.493 -15.490 -5.078 1.00 0.00 H new ATOM 0 HH11 ARG A 24 6.561 -15.559 -1.667 1.00 0.00 H new ATOM 0 HH12 ARG A 24 7.991 -16.474 -1.179 1.00 0.00 H new ATOM 0 HH21 ARG A 24 9.323 -16.663 -4.437 1.00 0.00 H new ATOM 0 HH22 ARG A 24 9.546 -17.095 -2.739 1.00 0.00 H new ATOM 301 N MET A 25 0.359 -15.266 -2.199 1.00 0.00 N ATOM 302 CA MET A 25 -0.569 -15.681 -1.152 1.00 0.00 C ATOM 303 C MET A 25 -1.842 -16.276 -1.748 1.00 0.00 C ATOM 304 O MET A 25 -2.499 -17.109 -1.124 1.00 0.00 O ATOM 305 CB MET A 25 -0.920 -14.493 -0.253 1.00 0.00 C ATOM 306 CG MET A 25 -1.678 -13.389 -0.972 1.00 0.00 C ATOM 307 SD MET A 25 -2.607 -12.335 0.158 1.00 0.00 S ATOM 308 CE MET A 25 -1.319 -11.224 0.721 1.00 0.00 C ATOM 0 H MET A 25 0.257 -14.295 -2.493 1.00 0.00 H new ATOM 0 HA MET A 25 -0.079 -16.450 -0.555 1.00 0.00 H new ATOM 0 HB2 MET A 25 -1.520 -14.847 0.586 1.00 0.00 H new ATOM 0 HB3 MET A 25 -0.002 -14.080 0.164 1.00 0.00 H new ATOM 0 HG2 MET A 25 -0.974 -12.778 -1.536 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.363 -13.834 -1.693 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.757 -10.445 1.345 1.00 0.00 H new ATOM 0 HE2 MET A 25 -0.584 -11.783 1.301 1.00 0.00 H new ATOM 0 HE3 MET A 25 -0.830 -10.767 -0.140 1.00 0.00 H new ATOM 318 N ALA A 26 -2.187 -15.843 -2.957 1.00 0.00 N ATOM 319 CA ALA A 26 -3.384 -16.333 -3.632 1.00 0.00 C ATOM 320 C ALA A 26 -3.353 -17.853 -3.780 1.00 0.00 C ATOM 321 O ALA A 26 -4.296 -18.540 -3.387 1.00 0.00 O ATOM 322 CB ALA A 26 -3.529 -15.669 -4.994 1.00 0.00 C ATOM 0 H ALA A 26 -1.655 -15.154 -3.489 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.248 -16.075 -3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.426 -16.043 -5.488 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.609 -14.590 -4.866 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.656 -15.898 -5.605 1.00 0.00 H new ATOM 328 N PRO A 27 -2.266 -18.401 -4.350 1.00 0.00 N ATOM 329 CA PRO A 27 -2.123 -19.848 -4.547 1.00 0.00 C ATOM 330 C PRO A 27 -2.351 -20.633 -3.260 1.00 0.00 C ATOM 331 O PRO A 27 -3.033 -21.659 -3.260 1.00 0.00 O ATOM 332 CB PRO A 27 -0.674 -20.003 -5.017 1.00 0.00 C ATOM 333 CG PRO A 27 -0.332 -18.690 -5.630 1.00 0.00 C ATOM 334 CD PRO A 27 -1.095 -17.657 -4.848 1.00 0.00 C ATOM 0 HA PRO A 27 -2.858 -20.237 -5.252 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -0.010 -20.236 -4.184 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.577 -20.814 -5.739 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.741 -18.504 -5.580 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.611 -18.667 -6.683 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -0.499 -17.251 -4.030 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -1.390 -16.816 -5.475 1.00 0.00 H new ATOM 342 N THR A 28 -1.777 -20.147 -2.165 1.00 0.00 N ATOM 343 CA THR A 28 -1.916 -20.805 -0.870 1.00 0.00 C ATOM 344 C THR A 28 -3.253 -20.458 -0.220 1.00 0.00 C ATOM 345 O THR A 28 -3.784 -21.232 0.576 1.00 0.00 O ATOM 346 CB THR A 28 -0.768 -20.403 0.054 1.00 0.00 C ATOM 347 OG1 THR A 28 -0.958 -20.940 1.351 1.00 0.00 O ATOM 348 CG2 THR A 28 -0.608 -18.906 0.196 1.00 0.00 C ATOM 0 H THR A 28 -1.210 -19.299 -2.148 1.00 0.00 H new ATOM 0 HA THR A 28 -1.883 -21.882 -1.034 1.00 0.00 H new ATOM 0 HB THR A 28 0.132 -20.804 -0.413 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.212 -20.673 1.928 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.225 -18.691 0.866 1.00 0.00 H new ATOM 0 HG22 THR A 28 -0.410 -18.467 -0.782 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.523 -18.480 0.607 1.00 0.00 H new ATOM 356 N LEU A 29 -3.792 -19.292 -0.562 1.00 0.00 N ATOM 357 CA LEU A 29 -5.067 -18.846 -0.009 1.00 0.00 C ATOM 358 C LEU A 29 -6.168 -19.876 -0.272 1.00 0.00 C ATOM 359 O LEU A 29 -6.417 -20.245 -1.420 1.00 0.00 O ATOM 360 CB LEU A 29 -5.462 -17.496 -0.611 1.00 0.00 C ATOM 361 CG LEU A 29 -5.071 -16.276 0.225 1.00 0.00 C ATOM 362 CD1 LEU A 29 -5.270 -14.996 -0.573 1.00 0.00 C ATOM 363 CD2 LEU A 29 -5.879 -16.234 1.514 1.00 0.00 C ATOM 0 H LEU A 29 -3.366 -18.639 -1.219 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.948 -18.736 1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.002 -17.406 -1.595 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.542 -17.484 -0.761 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.015 -16.358 0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.987 -14.139 0.038 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -4.649 -15.025 -1.468 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.317 -14.906 -0.861 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -5.589 -15.360 2.097 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -6.941 -16.175 1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.687 -17.137 2.093 1.00 0.00 H new ATOM 375 N PRO A 30 -6.844 -20.356 0.789 1.00 0.00 N ATOM 376 CA PRO A 30 -7.918 -21.345 0.656 1.00 0.00 C ATOM 377 C PRO A 30 -8.996 -20.899 -0.327 1.00 0.00 C ATOM 378 O PRO A 30 -8.949 -19.786 -0.852 1.00 0.00 O ATOM 379 CB PRO A 30 -8.495 -21.444 2.070 1.00 0.00 C ATOM 380 CG PRO A 30 -7.385 -21.012 2.964 1.00 0.00 C ATOM 381 CD PRO A 30 -6.616 -19.975 2.196 1.00 0.00 C ATOM 0 HA PRO A 30 -7.549 -22.294 0.267 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -9.369 -20.803 2.186 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -8.813 -22.461 2.297 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.772 -20.600 3.896 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -6.747 -21.855 3.229 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.979 -18.969 2.404 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.556 -19.990 2.450 1.00 0.00 H new ATOM 389 N LYS A 31 -9.966 -21.774 -0.571 1.00 0.00 N ATOM 390 CA LYS A 31 -11.056 -21.470 -1.490 1.00 0.00 C ATOM 391 C LYS A 31 -12.156 -20.680 -0.788 1.00 0.00 C ATOM 392 O LYS A 31 -12.216 -20.640 0.441 1.00 0.00 O ATOM 393 CB LYS A 31 -11.632 -22.760 -2.076 1.00 0.00 C ATOM 394 CG LYS A 31 -10.613 -23.588 -2.843 1.00 0.00 C ATOM 395 CD LYS A 31 -10.880 -23.561 -4.339 1.00 0.00 C ATOM 396 CE LYS A 31 -11.575 -24.832 -4.804 1.00 0.00 C ATOM 397 NZ LYS A 31 -10.854 -26.054 -4.356 1.00 0.00 N ATOM 0 H LYS A 31 -10.019 -22.699 -0.145 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.656 -20.859 -2.299 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -12.044 -23.364 -1.268 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.459 -22.510 -2.741 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.611 -23.207 -2.645 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -10.639 -24.618 -2.487 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -11.498 -22.697 -4.584 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.939 -23.443 -4.876 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -12.594 -24.850 -4.419 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.645 -24.830 -5.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.003 -26.818 -5.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -9.837 -25.849 -4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -11.217 -26.350 -3.427 1.00 0.00 H new ATOM 411 N SER A 32 -13.023 -20.054 -1.576 1.00 0.00 N ATOM 412 CA SER A 32 -14.121 -19.265 -1.029 1.00 0.00 C ATOM 413 C SER A 32 -15.462 -19.745 -1.574 1.00 0.00 C ATOM 414 O SER A 32 -15.615 -19.955 -2.778 1.00 0.00 O ATOM 415 CB SER A 32 -13.925 -17.783 -1.359 1.00 0.00 C ATOM 416 OG SER A 32 -12.571 -17.398 -1.189 1.00 0.00 O ATOM 0 H SER A 32 -12.987 -20.077 -2.595 1.00 0.00 H new ATOM 0 HA SER A 32 -14.123 -19.393 0.053 1.00 0.00 H new ATOM 0 HB2 SER A 32 -14.235 -17.592 -2.386 1.00 0.00 H new ATOM 0 HB3 SER A 32 -14.563 -17.176 -0.716 1.00 0.00 H new ATOM 0 HG SER A 32 -12.329 -16.743 -1.876 1.00 0.00 H new ATOM 422 N ASP A 33 -16.430 -19.917 -0.681 1.00 0.00 N ATOM 423 CA ASP A 33 -17.759 -20.373 -1.072 1.00 0.00 C ATOM 424 C ASP A 33 -18.704 -19.191 -1.266 1.00 0.00 C ATOM 425 O ASP A 33 -19.198 -18.613 -0.297 1.00 0.00 O ATOM 426 CB ASP A 33 -18.326 -21.325 -0.017 1.00 0.00 C ATOM 427 CG ASP A 33 -19.394 -22.242 -0.580 1.00 0.00 C ATOM 428 OD1 ASP A 33 -19.037 -23.319 -1.104 1.00 0.00 O ATOM 429 OD2 ASP A 33 -20.587 -21.884 -0.498 1.00 0.00 O ATOM 0 H ASP A 33 -16.320 -19.748 0.319 1.00 0.00 H new ATOM 0 HA ASP A 33 -17.669 -20.904 -2.020 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -17.517 -21.926 0.398 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -18.746 -20.744 0.804 1.00 0.00 H new ATOM 434 N LEU A 34 -18.949 -18.836 -2.523 1.00 0.00 N ATOM 435 CA LEU A 34 -19.832 -17.722 -2.846 1.00 0.00 C ATOM 436 C LEU A 34 -21.265 -18.015 -2.410 1.00 0.00 C ATOM 437 O LEU A 34 -22.025 -17.101 -2.087 1.00 0.00 O ATOM 438 CB LEU A 34 -19.794 -17.432 -4.347 1.00 0.00 C ATOM 439 CG LEU A 34 -18.461 -16.892 -4.868 1.00 0.00 C ATOM 440 CD1 LEU A 34 -18.383 -17.032 -6.381 1.00 0.00 C ATOM 441 CD2 LEU A 34 -18.277 -15.440 -4.454 1.00 0.00 C ATOM 0 H LEU A 34 -18.548 -19.305 -3.335 1.00 0.00 H new ATOM 0 HA LEU A 34 -19.479 -16.845 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -20.032 -18.349 -4.885 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -20.577 -16.712 -4.582 1.00 0.00 H new ATOM 0 HG LEU A 34 -17.655 -17.479 -4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -17.428 -16.643 -6.734 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -18.469 -18.084 -6.654 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -19.196 -16.470 -6.841 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.324 -15.072 -4.833 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -19.088 -14.839 -4.866 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -18.288 -15.368 -3.366 1.00 0.00 H new ATOM 453 N ASN A 35 -21.629 -19.293 -2.405 1.00 0.00 N ATOM 454 CA ASN A 35 -22.972 -19.704 -2.011 1.00 0.00 C ATOM 455 C ASN A 35 -23.156 -19.602 -0.500 1.00 0.00 C ATOM 456 O ASN A 35 -24.261 -19.356 -0.016 1.00 0.00 O ATOM 457 CB ASN A 35 -23.244 -21.137 -2.474 1.00 0.00 C ATOM 458 CG ASN A 35 -24.645 -21.309 -3.027 1.00 0.00 C ATOM 459 OD1 ASN A 35 -24.826 -21.706 -4.178 1.00 0.00 O ATOM 460 ND2 ASN A 35 -25.646 -21.011 -2.207 1.00 0.00 N ATOM 0 H ASN A 35 -21.013 -20.062 -2.669 1.00 0.00 H new ATOM 0 HA ASN A 35 -23.684 -19.031 -2.489 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -22.518 -21.413 -3.239 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -23.100 -21.820 -1.637 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -26.611 -21.108 -2.524 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -25.450 -20.685 -1.260 1.00 0.00 H new ATOM 467 N GLU A 36 -22.069 -19.792 0.240 1.00 0.00 N ATOM 468 CA GLU A 36 -22.114 -19.722 1.696 1.00 0.00 C ATOM 469 C GLU A 36 -22.216 -18.277 2.172 1.00 0.00 C ATOM 470 O GLU A 36 -22.834 -17.992 3.198 1.00 0.00 O ATOM 471 CB GLU A 36 -20.872 -20.383 2.298 1.00 0.00 C ATOM 472 CG GLU A 36 -21.120 -21.020 3.656 1.00 0.00 C ATOM 473 CD GLU A 36 -19.834 -21.334 4.395 1.00 0.00 C ATOM 474 OE1 GLU A 36 -18.888 -20.523 4.312 1.00 0.00 O ATOM 475 OE2 GLU A 36 -19.773 -22.391 5.057 1.00 0.00 O ATOM 0 H GLU A 36 -21.146 -19.996 -0.144 1.00 0.00 H new ATOM 0 HA GLU A 36 -23.002 -20.258 2.031 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -20.506 -21.145 1.610 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -20.084 -19.636 2.395 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -21.729 -20.349 4.262 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -21.692 -21.938 3.524 1.00 0.00 H new ATOM 482 N VAL A 37 -21.603 -17.366 1.422 1.00 0.00 N ATOM 483 CA VAL A 37 -21.625 -15.950 1.769 1.00 0.00 C ATOM 484 C VAL A 37 -22.866 -15.261 1.210 1.00 0.00 C ATOM 485 O VAL A 37 -23.303 -14.234 1.729 1.00 0.00 O ATOM 486 CB VAL A 37 -20.371 -15.225 1.247 1.00 0.00 C ATOM 487 CG1 VAL A 37 -19.136 -15.673 2.012 1.00 0.00 C ATOM 488 CG2 VAL A 37 -20.199 -15.464 -0.244 1.00 0.00 C ATOM 0 H VAL A 37 -21.085 -17.584 0.571 1.00 0.00 H new ATOM 0 HA VAL A 37 -21.644 -15.894 2.857 1.00 0.00 H new ATOM 0 HB VAL A 37 -20.500 -14.155 1.408 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -18.260 -15.149 1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -19.261 -15.444 3.070 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -19.000 -16.747 1.887 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -19.308 -14.944 -0.595 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -20.093 -16.533 -0.431 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -21.072 -15.087 -0.776 1.00 0.00 H new ATOM 498 N LYS A 38 -23.429 -15.828 0.147 1.00 0.00 N ATOM 499 CA LYS A 38 -24.620 -15.264 -0.479 1.00 0.00 C ATOM 500 C LYS A 38 -25.766 -15.157 0.522 1.00 0.00 C ATOM 501 O LYS A 38 -26.294 -14.071 0.762 1.00 0.00 O ATOM 502 CB LYS A 38 -25.044 -16.121 -1.675 1.00 0.00 C ATOM 503 CG LYS A 38 -24.781 -15.460 -3.019 1.00 0.00 C ATOM 504 CD LYS A 38 -24.774 -16.479 -4.148 1.00 0.00 C ATOM 505 CE LYS A 38 -23.917 -16.012 -5.314 1.00 0.00 C ATOM 506 NZ LYS A 38 -23.092 -17.117 -5.874 1.00 0.00 N ATOM 0 H LYS A 38 -23.080 -16.677 -0.298 1.00 0.00 H new ATOM 0 HA LYS A 38 -24.377 -14.260 -0.828 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -24.513 -17.072 -1.637 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -26.107 -16.346 -1.592 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -25.545 -14.707 -3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -23.823 -14.941 -2.989 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -24.397 -17.432 -3.777 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -25.794 -16.651 -4.491 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -24.558 -15.606 -6.096 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -23.265 -15.203 -4.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -22.473 -16.744 -6.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -22.511 -17.533 -5.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -23.715 -17.847 -6.274 1.00 0.00 H new ATOM 520 N GLU A 39 -26.146 -16.291 1.103 1.00 0.00 N ATOM 521 CA GLU A 39 -27.231 -16.327 2.078 1.00 0.00 C ATOM 522 C GLU A 39 -26.968 -15.360 3.228 1.00 0.00 C ATOM 523 O GLU A 39 -27.897 -14.772 3.782 1.00 0.00 O ATOM 524 CB GLU A 39 -27.409 -17.746 2.620 1.00 0.00 C ATOM 525 CG GLU A 39 -28.374 -18.593 1.806 1.00 0.00 C ATOM 526 CD GLU A 39 -27.665 -19.471 0.793 1.00 0.00 C ATOM 527 OE1 GLU A 39 -27.086 -20.499 1.202 1.00 0.00 O ATOM 528 OE2 GLU A 39 -27.691 -19.131 -0.409 1.00 0.00 O ATOM 0 H GLU A 39 -25.718 -17.198 0.915 1.00 0.00 H new ATOM 0 HA GLU A 39 -28.147 -16.019 1.574 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -26.438 -18.240 2.646 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -27.766 -17.691 3.648 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -28.959 -19.220 2.479 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -29.077 -17.940 1.288 1.00 0.00 H new ATOM 535 N LEU A 40 -25.698 -15.199 3.581 1.00 0.00 N ATOM 536 CA LEU A 40 -25.313 -14.302 4.665 1.00 0.00 C ATOM 537 C LEU A 40 -25.720 -12.866 4.354 1.00 0.00 C ATOM 538 O LEU A 40 -26.007 -12.081 5.258 1.00 0.00 O ATOM 539 CB LEU A 40 -23.805 -14.377 4.908 1.00 0.00 C ATOM 540 CG LEU A 40 -23.352 -15.517 5.821 1.00 0.00 C ATOM 541 CD1 LEU A 40 -21.836 -15.644 5.803 1.00 0.00 C ATOM 542 CD2 LEU A 40 -23.852 -15.291 7.240 1.00 0.00 C ATOM 0 H LEU A 40 -24.917 -15.678 3.133 1.00 0.00 H new ATOM 0 HA LEU A 40 -25.834 -14.620 5.568 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -23.302 -14.480 3.946 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -23.475 -13.433 5.340 1.00 0.00 H new ATOM 0 HG LEU A 40 -23.779 -16.448 5.449 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -21.531 -16.460 6.458 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -21.500 -15.850 4.787 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -21.389 -14.713 6.151 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -23.521 -16.111 7.877 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -23.452 -14.351 7.621 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -24.941 -15.249 7.240 1.00 0.00 H new ATOM 554 N LEU A 41 -25.743 -12.527 3.069 1.00 0.00 N ATOM 555 CA LEU A 41 -26.114 -11.183 2.639 1.00 0.00 C ATOM 556 C LEU A 41 -27.629 -11.007 2.649 1.00 0.00 C ATOM 557 O LEU A 41 -28.138 -9.944 3.008 1.00 0.00 O ATOM 558 CB LEU A 41 -25.564 -10.902 1.240 1.00 0.00 C ATOM 559 CG LEU A 41 -24.085 -10.518 1.191 1.00 0.00 C ATOM 560 CD1 LEU A 41 -23.500 -10.824 -0.178 1.00 0.00 C ATOM 561 CD2 LEU A 41 -23.906 -9.047 1.533 1.00 0.00 C ATOM 0 H LEU A 41 -25.509 -13.164 2.307 1.00 0.00 H new ATOM 0 HA LEU A 41 -25.680 -10.471 3.341 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -25.714 -11.788 0.623 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -26.147 -10.098 0.792 1.00 0.00 H new ATOM 0 HG LEU A 41 -23.550 -11.111 1.933 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -22.447 -10.544 -0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -23.596 -11.890 -0.385 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -24.038 -10.258 -0.938 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -22.847 -8.790 1.493 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -24.454 -8.437 0.815 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -24.288 -8.858 2.536 1.00 0.00 H new ATOM 573 N LYS A 42 -28.345 -12.054 2.254 1.00 0.00 N ATOM 574 CA LYS A 42 -29.803 -12.015 2.218 1.00 0.00 C ATOM 575 C LYS A 42 -30.375 -11.704 3.598 1.00 0.00 C ATOM 576 O LYS A 42 -31.459 -11.133 3.716 1.00 0.00 O ATOM 577 CB LYS A 42 -30.358 -13.348 1.712 1.00 0.00 C ATOM 578 CG LYS A 42 -30.402 -13.454 0.195 1.00 0.00 C ATOM 579 CD LYS A 42 -29.370 -14.441 -0.326 1.00 0.00 C ATOM 580 CE LYS A 42 -29.380 -14.508 -1.845 1.00 0.00 C ATOM 581 NZ LYS A 42 -30.519 -15.320 -2.357 1.00 0.00 N ATOM 0 H LYS A 42 -27.940 -12.941 1.954 1.00 0.00 H new ATOM 0 HA LYS A 42 -30.102 -11.221 1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -29.747 -14.160 2.107 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -31.365 -13.486 2.107 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -31.397 -13.767 -0.120 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -30.223 -12.473 -0.244 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -28.378 -14.149 0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -29.572 -15.430 0.084 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -29.441 -13.499 -2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -28.441 -14.937 -2.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -30.491 -15.341 -3.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -30.447 -16.290 -1.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -31.416 -14.896 -2.044 1.00 0.00 H new ATOM 595 N THR A 43 -29.639 -12.083 4.638 1.00 0.00 N ATOM 596 CA THR A 43 -30.075 -11.844 6.009 1.00 0.00 C ATOM 597 C THR A 43 -29.714 -10.431 6.456 1.00 0.00 C ATOM 598 O THR A 43 -30.437 -9.813 7.239 1.00 0.00 O ATOM 599 CB THR A 43 -29.441 -12.867 6.953 1.00 0.00 C ATOM 600 OG1 THR A 43 -28.033 -12.877 6.808 1.00 0.00 O ATOM 601 CG2 THR A 43 -29.936 -14.279 6.725 1.00 0.00 C ATOM 0 H THR A 43 -28.739 -12.556 4.558 1.00 0.00 H new ATOM 0 HA THR A 43 -31.159 -11.951 6.043 1.00 0.00 H new ATOM 0 HB THR A 43 -29.733 -12.555 7.956 1.00 0.00 H new ATOM 0 HG1 THR A 43 -27.771 -12.235 6.115 1.00 0.00 H new ATOM 0 HG21 THR A 43 -29.447 -14.954 7.427 1.00 0.00 H new ATOM 0 HG22 THR A 43 -31.015 -14.316 6.878 1.00 0.00 H new ATOM 0 HG23 THR A 43 -29.704 -14.586 5.705 1.00 0.00 H new ATOM 609 N ASN A 44 -28.593 -9.925 5.955 1.00 0.00 N ATOM 610 CA ASN A 44 -28.135 -8.585 6.303 1.00 0.00 C ATOM 611 C ASN A 44 -28.783 -7.538 5.402 1.00 0.00 C ATOM 612 O ASN A 44 -29.519 -7.873 4.474 1.00 0.00 O ATOM 613 CB ASN A 44 -26.612 -8.498 6.193 1.00 0.00 C ATOM 614 CG ASN A 44 -25.921 -8.785 7.511 1.00 0.00 C ATOM 615 OD1 ASN A 44 -24.903 -7.992 7.830 1.00 0.00 O flip ATOM 616 ND2 ASN A 44 -26.295 -9.708 8.234 1.00 0.00 N flip ATOM 0 H ASN A 44 -27.984 -10.423 5.306 1.00 0.00 H new ATOM 0 HA ASN A 44 -28.429 -8.384 7.333 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -26.264 -9.206 5.441 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -26.331 -7.503 5.848 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -27.081 -10.292 7.950 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -25.819 -9.889 9.118 1.00 0.00 H new ATOM 623 N LYS A 45 -28.503 -6.269 5.682 1.00 0.00 N ATOM 624 CA LYS A 45 -29.059 -5.173 4.898 1.00 0.00 C ATOM 625 C LYS A 45 -27.975 -4.165 4.528 1.00 0.00 C ATOM 626 O LYS A 45 -27.878 -3.738 3.377 1.00 0.00 O ATOM 627 CB LYS A 45 -30.175 -4.474 5.676 1.00 0.00 C ATOM 628 CG LYS A 45 -29.748 -3.994 7.053 1.00 0.00 C ATOM 629 CD LYS A 45 -29.250 -2.557 7.014 1.00 0.00 C ATOM 630 CE LYS A 45 -30.168 -1.626 7.790 1.00 0.00 C ATOM 631 NZ LYS A 45 -31.586 -1.748 7.350 1.00 0.00 N ATOM 0 H LYS A 45 -27.894 -5.975 6.446 1.00 0.00 H new ATOM 0 HA LYS A 45 -29.473 -5.591 3.980 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -30.531 -3.622 5.097 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -31.016 -5.159 5.784 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -30.589 -4.070 7.743 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -28.961 -4.643 7.437 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -28.244 -2.508 7.431 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -29.182 -2.223 5.979 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -30.098 -1.851 8.854 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -29.835 -0.596 7.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -32.079 -0.847 7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -31.616 -1.981 6.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -32.054 -2.502 7.893 1.00 0.00 H new ATOM 645 N LYS A 46 -27.163 -3.790 5.510 1.00 0.00 N ATOM 646 CA LYS A 46 -26.086 -2.832 5.286 1.00 0.00 C ATOM 647 C LYS A 46 -24.989 -3.439 4.419 1.00 0.00 C ATOM 648 O LYS A 46 -24.603 -2.866 3.399 1.00 0.00 O ATOM 649 CB LYS A 46 -25.500 -2.370 6.622 1.00 0.00 C ATOM 650 CG LYS A 46 -25.151 -0.891 6.655 1.00 0.00 C ATOM 651 CD LYS A 46 -23.827 -0.645 7.363 1.00 0.00 C ATOM 652 CE LYS A 46 -23.030 0.457 6.684 1.00 0.00 C ATOM 653 NZ LYS A 46 -21.650 0.562 7.232 1.00 0.00 N ATOM 0 H LYS A 46 -27.230 -4.134 6.468 1.00 0.00 H new ATOM 0 HA LYS A 46 -26.502 -1.971 4.763 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -26.215 -2.584 7.416 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -24.603 -2.951 6.836 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -25.097 -0.506 5.637 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -25.943 -0.341 7.162 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -24.013 -0.374 8.402 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -23.242 -1.565 7.374 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -22.981 0.262 5.613 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -23.545 1.409 6.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -21.512 1.505 7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -21.511 -0.163 7.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -20.961 0.417 6.467 1.00 0.00 H new ATOM 667 N LEU A 47 -24.490 -4.600 4.828 1.00 0.00 N ATOM 668 CA LEU A 47 -23.437 -5.284 4.086 1.00 0.00 C ATOM 669 C LEU A 47 -23.896 -5.613 2.669 1.00 0.00 C ATOM 670 O LEU A 47 -23.095 -5.635 1.736 1.00 0.00 O ATOM 671 CB LEU A 47 -23.023 -6.566 4.812 1.00 0.00 C ATOM 672 CG LEU A 47 -21.931 -6.387 5.868 1.00 0.00 C ATOM 673 CD1 LEU A 47 -21.790 -7.648 6.706 1.00 0.00 C ATOM 674 CD2 LEU A 47 -20.606 -6.033 5.208 1.00 0.00 C ATOM 0 H LEU A 47 -24.798 -5.087 5.669 1.00 0.00 H new ATOM 0 HA LEU A 47 -22.578 -4.616 4.024 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -23.903 -6.995 5.291 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -22.678 -7.289 4.073 1.00 0.00 H new ATOM 0 HG LEU A 47 -22.218 -5.567 6.526 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -21.009 -7.503 7.452 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -22.735 -7.860 7.206 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -21.525 -8.486 6.061 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -19.840 -5.909 5.973 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -20.313 -6.833 4.528 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -20.715 -5.103 4.650 1.00 0.00 H new ATOM 686 N ALA A 48 -25.192 -5.869 2.518 1.00 0.00 N ATOM 687 CA ALA A 48 -25.758 -6.197 1.216 1.00 0.00 C ATOM 688 C ALA A 48 -25.891 -4.951 0.344 1.00 0.00 C ATOM 689 O ALA A 48 -25.872 -5.038 -0.884 1.00 0.00 O ATOM 690 CB ALA A 48 -27.111 -6.871 1.385 1.00 0.00 C ATOM 0 H ALA A 48 -25.869 -5.855 3.281 1.00 0.00 H new ATOM 0 HA ALA A 48 -25.079 -6.887 0.716 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -27.523 -7.111 0.405 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -26.991 -7.788 1.962 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -27.790 -6.198 1.909 1.00 0.00 H new ATOM 696 N LYS A 49 -26.027 -3.796 0.986 1.00 0.00 N ATOM 697 CA LYS A 49 -26.164 -2.534 0.267 1.00 0.00 C ATOM 698 C LYS A 49 -24.802 -1.886 0.035 1.00 0.00 C ATOM 699 O LYS A 49 -24.608 -1.158 -0.939 1.00 0.00 O ATOM 700 CB LYS A 49 -27.074 -1.579 1.043 1.00 0.00 C ATOM 701 CG LYS A 49 -28.210 -1.006 0.208 1.00 0.00 C ATOM 702 CD LYS A 49 -29.527 -1.020 0.969 1.00 0.00 C ATOM 703 CE LYS A 49 -30.206 0.341 0.937 1.00 0.00 C ATOM 704 NZ LYS A 49 -29.984 1.102 2.198 1.00 0.00 N ATOM 0 H LYS A 49 -26.045 -3.707 2.002 1.00 0.00 H new ATOM 0 HA LYS A 49 -26.613 -2.744 -0.704 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.494 -2.106 1.899 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -26.474 -0.759 1.437 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -27.968 0.016 -0.083 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -28.314 -1.583 -0.711 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -30.190 -1.769 0.536 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -29.347 -1.314 2.003 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -29.825 0.917 0.094 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -31.276 0.209 0.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -30.462 2.023 2.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -30.370 0.565 3.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -28.964 1.250 2.339 1.00 0.00 H new ATOM 718 N MET A 50 -23.861 -2.154 0.936 1.00 0.00 N ATOM 719 CA MET A 50 -22.519 -1.593 0.828 1.00 0.00 C ATOM 720 C MET A 50 -21.673 -2.384 -0.165 1.00 0.00 C ATOM 721 O MET A 50 -21.300 -1.873 -1.221 1.00 0.00 O ATOM 722 CB MET A 50 -21.838 -1.580 2.198 1.00 0.00 C ATOM 723 CG MET A 50 -20.652 -0.633 2.279 1.00 0.00 C ATOM 724 SD MET A 50 -20.349 -0.042 3.955 1.00 0.00 S ATOM 725 CE MET A 50 -18.617 0.403 3.849 1.00 0.00 C ATOM 0 H MET A 50 -24.003 -2.755 1.748 1.00 0.00 H new ATOM 0 HA MET A 50 -22.610 -0.570 0.464 1.00 0.00 H new ATOM 0 HB2 MET A 50 -22.570 -1.298 2.955 1.00 0.00 H new ATOM 0 HB3 MET A 50 -21.503 -2.589 2.438 1.00 0.00 H new ATOM 0 HG2 MET A 50 -19.761 -1.141 1.910 1.00 0.00 H new ATOM 0 HG3 MET A 50 -20.827 0.220 1.623 1.00 0.00 H new ATOM 0 HE1 MET A 50 -18.280 0.787 4.812 1.00 0.00 H new ATOM 0 HE2 MET A 50 -18.031 -0.477 3.585 1.00 0.00 H new ATOM 0 HE3 MET A 50 -18.484 1.170 3.086 1.00 0.00 H new ATOM 735 N ILE A 51 -21.374 -3.632 0.179 1.00 0.00 N ATOM 736 CA ILE A 51 -20.570 -4.491 -0.683 1.00 0.00 C ATOM 737 C ILE A 51 -21.323 -5.766 -1.050 1.00 0.00 C ATOM 738 O ILE A 51 -20.733 -6.841 -1.150 1.00 0.00 O ATOM 739 CB ILE A 51 -19.236 -4.870 -0.011 1.00 0.00 C ATOM 740 CG1 ILE A 51 -19.489 -5.461 1.377 1.00 0.00 C ATOM 741 CG2 ILE A 51 -18.325 -3.655 0.082 1.00 0.00 C ATOM 742 CD1 ILE A 51 -18.386 -6.383 1.852 1.00 0.00 C ATOM 0 H ILE A 51 -21.676 -4.071 1.049 1.00 0.00 H new ATOM 0 HA ILE A 51 -20.363 -3.923 -1.590 1.00 0.00 H new ATOM 0 HB ILE A 51 -18.740 -5.625 -0.622 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -19.605 -4.648 2.093 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -20.430 -6.011 1.363 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -17.387 -3.939 0.559 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -18.122 -3.275 -0.919 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -18.812 -2.879 0.673 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -18.632 -6.765 2.843 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -18.284 -7.216 1.157 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -17.446 -5.832 1.899 1.00 0.00 H new ATOM 754 N GLY A 52 -22.630 -5.638 -1.252 1.00 0.00 N ATOM 755 CA GLY A 52 -23.441 -6.788 -1.607 1.00 0.00 C ATOM 756 C GLY A 52 -23.656 -6.904 -3.103 1.00 0.00 C ATOM 757 O GLY A 52 -23.592 -7.998 -3.663 1.00 0.00 O ATOM 0 H GLY A 52 -23.142 -4.759 -1.176 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -22.960 -7.695 -1.240 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -24.408 -6.715 -1.108 1.00 0.00 H new ATOM 761 N HIS A 53 -23.913 -5.773 -3.751 1.00 0.00 N ATOM 762 CA HIS A 53 -24.139 -5.752 -5.191 1.00 0.00 C ATOM 763 C HIS A 53 -22.914 -6.264 -5.943 1.00 0.00 C ATOM 764 O HIS A 53 -23.031 -6.819 -7.036 1.00 0.00 O ATOM 765 CB HIS A 53 -24.479 -4.334 -5.655 1.00 0.00 C ATOM 766 CG HIS A 53 -23.424 -3.325 -5.319 1.00 0.00 C ATOM 767 ND1 HIS A 53 -23.543 -2.430 -4.277 1.00 0.00 N ATOM 768 CD2 HIS A 53 -22.224 -3.074 -5.894 1.00 0.00 C ATOM 769 CE1 HIS A 53 -22.463 -1.670 -4.227 1.00 0.00 C ATOM 770 NE2 HIS A 53 -21.647 -2.042 -5.196 1.00 0.00 N ATOM 0 H HIS A 53 -23.970 -4.859 -3.302 1.00 0.00 H new ATOM 0 HA HIS A 53 -24.979 -6.411 -5.410 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -24.633 -4.341 -6.734 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -25.421 -4.028 -5.200 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -21.800 -3.589 -6.743 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -22.279 -0.879 -3.515 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -20.735 -1.629 -5.394 1.00 0.00 H new ATOM 779 N ILE A 54 -21.739 -6.074 -5.352 1.00 0.00 N ATOM 780 CA ILE A 54 -20.493 -6.519 -5.966 1.00 0.00 C ATOM 781 C ILE A 54 -20.443 -8.039 -6.063 1.00 0.00 C ATOM 782 O ILE A 54 -19.877 -8.593 -7.006 1.00 0.00 O ATOM 783 CB ILE A 54 -19.266 -6.023 -5.176 1.00 0.00 C ATOM 784 CG1 ILE A 54 -19.363 -4.517 -4.929 1.00 0.00 C ATOM 785 CG2 ILE A 54 -17.983 -6.360 -5.922 1.00 0.00 C ATOM 786 CD1 ILE A 54 -18.188 -3.953 -4.159 1.00 0.00 C ATOM 0 H ILE A 54 -21.623 -5.615 -4.449 1.00 0.00 H new ATOM 0 HA ILE A 54 -20.464 -6.092 -6.968 1.00 0.00 H new ATOM 0 HB ILE A 54 -19.247 -6.530 -4.211 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -19.438 -4.004 -5.888 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -20.281 -4.305 -4.381 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -17.126 -6.003 -5.351 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -17.910 -7.440 -6.050 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -17.994 -5.879 -6.900 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -18.325 -2.880 -4.021 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -18.124 -4.439 -3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -17.268 -4.133 -4.716 1.00 0.00 H new ATOM 798 N PHE A 55 -21.038 -8.710 -5.082 1.00 0.00 N ATOM 799 CA PHE A 55 -21.060 -10.168 -5.057 1.00 0.00 C ATOM 800 C PHE A 55 -21.872 -10.720 -6.224 1.00 0.00 C ATOM 801 O PHE A 55 -21.388 -11.553 -6.991 1.00 0.00 O ATOM 802 CB PHE A 55 -21.643 -10.668 -3.734 1.00 0.00 C ATOM 803 CG PHE A 55 -20.624 -10.795 -2.638 1.00 0.00 C ATOM 804 CD1 PHE A 55 -19.549 -11.660 -2.771 1.00 0.00 C ATOM 805 CD2 PHE A 55 -20.740 -10.051 -1.475 1.00 0.00 C ATOM 806 CE1 PHE A 55 -18.610 -11.779 -1.765 1.00 0.00 C ATOM 807 CE2 PHE A 55 -19.805 -10.167 -0.465 1.00 0.00 C ATOM 808 CZ PHE A 55 -18.738 -11.032 -0.611 1.00 0.00 C ATOM 0 H PHE A 55 -21.511 -8.267 -4.294 1.00 0.00 H new ATOM 0 HA PHE A 55 -20.034 -10.523 -5.151 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -22.428 -9.984 -3.411 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -22.112 -11.638 -3.897 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -19.444 -12.247 -3.671 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -21.572 -9.372 -1.357 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -17.776 -12.456 -1.881 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -19.908 -9.582 0.437 1.00 0.00 H new ATOM 0 HZ PHE A 55 -18.005 -11.124 0.177 1.00 0.00 H new ATOM 818 N GLU A 56 -23.107 -10.248 -6.353 1.00 0.00 N ATOM 819 CA GLU A 56 -23.988 -10.693 -7.429 1.00 0.00 C ATOM 820 C GLU A 56 -23.451 -10.258 -8.789 1.00 0.00 C ATOM 821 O GLU A 56 -23.696 -10.913 -9.801 1.00 0.00 O ATOM 822 CB GLU A 56 -25.398 -10.138 -7.224 1.00 0.00 C ATOM 823 CG GLU A 56 -26.014 -10.519 -5.887 1.00 0.00 C ATOM 824 CD GLU A 56 -27.262 -11.367 -6.037 1.00 0.00 C ATOM 825 OE1 GLU A 56 -28.351 -10.789 -6.241 1.00 0.00 O ATOM 826 OE2 GLU A 56 -27.151 -12.608 -5.952 1.00 0.00 O ATOM 0 H GLU A 56 -23.521 -9.558 -5.727 1.00 0.00 H new ATOM 0 HA GLU A 56 -24.026 -11.782 -7.406 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -25.367 -9.051 -7.304 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -26.041 -10.498 -8.027 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -25.279 -11.064 -5.295 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -26.260 -9.613 -5.334 1.00 0.00 H new ATOM 833 N MET A 57 -22.718 -9.149 -8.805 1.00 0.00 N ATOM 834 CA MET A 57 -22.148 -8.627 -10.043 1.00 0.00 C ATOM 835 C MET A 57 -21.249 -9.663 -10.710 1.00 0.00 C ATOM 836 O MET A 57 -20.977 -10.721 -10.144 1.00 0.00 O ATOM 837 CB MET A 57 -21.353 -7.349 -9.761 1.00 0.00 C ATOM 838 CG MET A 57 -21.558 -6.263 -10.807 1.00 0.00 C ATOM 839 SD MET A 57 -21.636 -4.612 -10.088 1.00 0.00 S ATOM 840 CE MET A 57 -20.136 -3.886 -10.744 1.00 0.00 C ATOM 0 H MET A 57 -22.505 -8.595 -7.976 1.00 0.00 H new ATOM 0 HA MET A 57 -22.968 -8.396 -10.723 1.00 0.00 H new ATOM 0 HB2 MET A 57 -21.640 -6.960 -8.784 1.00 0.00 H new ATOM 0 HB3 MET A 57 -20.292 -7.595 -9.707 1.00 0.00 H new ATOM 0 HG2 MET A 57 -20.743 -6.302 -11.530 1.00 0.00 H new ATOM 0 HG3 MET A 57 -22.480 -6.461 -11.354 1.00 0.00 H new ATOM 0 HE1 MET A 57 -20.207 -2.799 -10.698 1.00 0.00 H new ATOM 0 HE2 MET A 57 -19.282 -4.219 -10.154 1.00 0.00 H new ATOM 0 HE3 MET A 57 -20.004 -4.197 -11.780 1.00 0.00 H new ATOM 850 N ASN A 58 -20.791 -9.350 -11.918 1.00 0.00 N ATOM 851 CA ASN A 58 -19.924 -10.253 -12.666 1.00 0.00 C ATOM 852 C ASN A 58 -18.571 -10.403 -11.977 1.00 0.00 C ATOM 853 O ASN A 58 -18.107 -9.489 -11.294 1.00 0.00 O ATOM 854 CB ASN A 58 -19.729 -9.742 -14.093 1.00 0.00 C ATOM 855 CG ASN A 58 -19.338 -10.847 -15.056 1.00 0.00 C ATOM 856 OD1 ASN A 58 -18.228 -11.374 -14.995 1.00 0.00 O ATOM 857 ND2 ASN A 58 -20.252 -11.202 -15.950 1.00 0.00 N ATOM 0 H ASN A 58 -21.006 -8.477 -12.400 1.00 0.00 H new ATOM 0 HA ASN A 58 -20.404 -11.231 -12.701 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -20.651 -9.274 -14.437 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -18.959 -8.971 -14.098 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -20.047 -11.940 -16.624 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -21.160 -10.737 -15.964 1.00 0.00 H new ATOM 864 N ASP A 59 -17.944 -11.560 -12.160 1.00 0.00 N ATOM 865 CA ASP A 59 -16.644 -11.829 -11.557 1.00 0.00 C ATOM 866 C ASP A 59 -15.546 -11.031 -12.255 1.00 0.00 C ATOM 867 O ASP A 59 -14.558 -10.640 -11.632 1.00 0.00 O ATOM 868 CB ASP A 59 -16.326 -13.323 -11.626 1.00 0.00 C ATOM 869 CG ASP A 59 -15.461 -13.784 -10.468 1.00 0.00 C ATOM 870 OD1 ASP A 59 -15.618 -13.237 -9.355 1.00 0.00 O ATOM 871 OD2 ASP A 59 -14.626 -14.690 -10.674 1.00 0.00 O ATOM 0 H ASP A 59 -18.315 -12.327 -12.721 1.00 0.00 H new ATOM 0 HA ASP A 59 -16.685 -11.521 -10.512 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -17.257 -13.890 -11.629 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -15.817 -13.540 -12.565 1.00 0.00 H new ATOM 876 N ASP A 60 -15.725 -10.794 -13.550 1.00 0.00 N ATOM 877 CA ASP A 60 -14.750 -10.043 -14.332 1.00 0.00 C ATOM 878 C ASP A 60 -15.414 -8.867 -15.044 1.00 0.00 C ATOM 879 O ASP A 60 -15.484 -8.829 -16.272 1.00 0.00 O ATOM 880 CB ASP A 60 -14.070 -10.958 -15.353 1.00 0.00 C ATOM 881 CG ASP A 60 -15.065 -11.795 -16.132 1.00 0.00 C ATOM 882 OD1 ASP A 60 -15.872 -11.211 -16.886 1.00 0.00 O ATOM 883 OD2 ASP A 60 -15.039 -13.036 -15.988 1.00 0.00 O ATOM 0 H ASP A 60 -16.536 -11.111 -14.080 1.00 0.00 H new ATOM 0 HA ASP A 60 -13.996 -9.651 -13.649 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -13.486 -10.353 -16.047 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -13.370 -11.616 -14.838 1.00 0.00 H new ATOM 888 N ASP A 61 -15.899 -7.908 -14.261 1.00 0.00 N ATOM 889 CA ASP A 61 -16.557 -6.731 -14.815 1.00 0.00 C ATOM 890 C ASP A 61 -15.651 -5.503 -14.715 1.00 0.00 C ATOM 891 O ASP A 61 -14.873 -5.373 -13.770 1.00 0.00 O ATOM 892 CB ASP A 61 -17.877 -6.469 -14.086 1.00 0.00 C ATOM 893 CG ASP A 61 -19.041 -6.298 -15.042 1.00 0.00 C ATOM 894 OD1 ASP A 61 -19.079 -7.012 -16.066 1.00 0.00 O ATOM 895 OD2 ASP A 61 -19.916 -5.449 -14.766 1.00 0.00 O ATOM 0 H ASP A 61 -15.849 -7.923 -13.242 1.00 0.00 H new ATOM 0 HA ASP A 61 -16.764 -6.922 -15.868 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -18.085 -7.297 -13.409 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -17.779 -5.573 -13.473 1.00 0.00 H new ATOM 900 N PRO A 62 -15.742 -4.585 -15.692 1.00 0.00 N ATOM 901 CA PRO A 62 -14.926 -3.365 -15.708 1.00 0.00 C ATOM 902 C PRO A 62 -15.333 -2.382 -14.615 1.00 0.00 C ATOM 903 O PRO A 62 -14.498 -1.654 -14.080 1.00 0.00 O ATOM 904 CB PRO A 62 -15.202 -2.772 -17.090 1.00 0.00 C ATOM 905 CG PRO A 62 -16.549 -3.287 -17.460 1.00 0.00 C ATOM 906 CD PRO A 62 -16.644 -4.660 -16.857 1.00 0.00 C ATOM 0 HA PRO A 62 -13.873 -3.576 -15.523 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -15.188 -1.682 -17.063 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -14.447 -3.083 -17.812 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -17.335 -2.637 -17.076 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -16.668 -3.327 -18.543 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -17.665 -4.899 -16.560 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -16.329 -5.431 -17.560 1.00 0.00 H new ATOM 914 N HIS A 63 -16.621 -2.368 -14.289 1.00 0.00 N ATOM 915 CA HIS A 63 -17.140 -1.475 -13.260 1.00 0.00 C ATOM 916 C HIS A 63 -16.771 -1.973 -11.866 1.00 0.00 C ATOM 917 O HIS A 63 -16.666 -1.187 -10.924 1.00 0.00 O ATOM 918 CB HIS A 63 -18.660 -1.350 -13.384 1.00 0.00 C ATOM 919 CG HIS A 63 -19.103 -0.670 -14.642 1.00 0.00 C ATOM 920 ND1 HIS A 63 -18.461 0.430 -15.170 1.00 0.00 N ATOM 921 CD2 HIS A 63 -20.131 -0.943 -15.481 1.00 0.00 C ATOM 922 CE1 HIS A 63 -19.076 0.806 -16.277 1.00 0.00 C ATOM 923 NE2 HIS A 63 -20.091 -0.010 -16.488 1.00 0.00 N ATOM 0 H HIS A 63 -17.325 -2.965 -14.723 1.00 0.00 H new ATOM 0 HA HIS A 63 -16.687 -0.494 -13.405 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -19.103 -2.345 -13.343 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -19.042 -0.796 -12.527 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -20.848 -1.744 -15.377 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -18.795 1.640 -16.903 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -20.741 0.043 -17.272 1.00 0.00 H new ATOM 932 N LYS A 64 -16.576 -3.283 -11.740 1.00 0.00 N ATOM 933 CA LYS A 64 -16.219 -3.885 -10.460 1.00 0.00 C ATOM 934 C LYS A 64 -14.954 -3.250 -9.890 1.00 0.00 C ATOM 935 O LYS A 64 -14.828 -3.074 -8.678 1.00 0.00 O ATOM 936 CB LYS A 64 -16.022 -5.395 -10.623 1.00 0.00 C ATOM 937 CG LYS A 64 -17.008 -6.227 -9.818 1.00 0.00 C ATOM 938 CD LYS A 64 -16.295 -7.154 -8.846 1.00 0.00 C ATOM 939 CE LYS A 64 -15.446 -8.181 -9.577 1.00 0.00 C ATOM 940 NZ LYS A 64 -15.332 -9.453 -8.812 1.00 0.00 N ATOM 0 H LYS A 64 -16.659 -3.948 -12.509 1.00 0.00 H new ATOM 0 HA LYS A 64 -17.036 -3.705 -9.761 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -16.117 -5.654 -11.678 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -15.008 -5.656 -10.321 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -17.678 -5.567 -9.267 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.627 -6.815 -10.495 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.664 -6.567 -8.179 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -17.030 -7.665 -8.223 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -15.883 -8.383 -10.555 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -14.451 -7.772 -9.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.037 -10.218 -9.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -14.626 -9.342 -8.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.254 -9.689 -8.392 1.00 0.00 H new ATOM 954 N GLU A 65 -14.020 -2.908 -10.771 1.00 0.00 N ATOM 955 CA GLU A 65 -12.765 -2.293 -10.354 1.00 0.00 C ATOM 956 C GLU A 65 -13.019 -0.968 -9.640 1.00 0.00 C ATOM 957 O GLU A 65 -12.255 -0.569 -8.761 1.00 0.00 O ATOM 958 CB GLU A 65 -11.856 -2.068 -11.563 1.00 0.00 C ATOM 959 CG GLU A 65 -11.355 -3.356 -12.196 1.00 0.00 C ATOM 960 CD GLU A 65 -9.896 -3.278 -12.603 1.00 0.00 C ATOM 961 OE1 GLU A 65 -9.387 -2.149 -12.771 1.00 0.00 O ATOM 962 OE2 GLU A 65 -9.264 -4.343 -12.753 1.00 0.00 O ATOM 0 H GLU A 65 -14.108 -3.046 -11.778 1.00 0.00 H new ATOM 0 HA GLU A 65 -12.271 -2.971 -9.658 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -12.398 -1.492 -12.313 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -11.000 -1.467 -11.257 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -11.488 -4.178 -11.493 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -11.961 -3.585 -13.073 1.00 0.00 H new ATOM 969 N GLU A 66 -14.094 -0.290 -10.026 1.00 0.00 N ATOM 970 CA GLU A 66 -14.448 0.991 -9.424 1.00 0.00 C ATOM 971 C GLU A 66 -15.241 0.788 -8.137 1.00 0.00 C ATOM 972 O GLU A 66 -15.133 1.577 -7.199 1.00 0.00 O ATOM 973 CB GLU A 66 -15.261 1.834 -10.408 1.00 0.00 C ATOM 974 CG GLU A 66 -14.403 2.675 -11.340 1.00 0.00 C ATOM 975 CD GLU A 66 -15.231 3.561 -12.251 1.00 0.00 C ATOM 976 OE1 GLU A 66 -16.355 3.936 -11.853 1.00 0.00 O ATOM 977 OE2 GLU A 66 -14.757 3.879 -13.361 1.00 0.00 O ATOM 0 H GLU A 66 -14.736 -0.606 -10.753 1.00 0.00 H new ATOM 0 HA GLU A 66 -13.524 1.516 -9.182 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -15.892 1.175 -11.004 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -15.926 2.491 -9.848 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -13.730 3.296 -10.748 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -13.779 2.018 -11.946 1.00 0.00 H new ATOM 984 N GLU A 67 -16.038 -0.275 -8.101 1.00 0.00 N ATOM 985 CA GLU A 67 -16.851 -0.581 -6.930 1.00 0.00 C ATOM 986 C GLU A 67 -15.984 -1.077 -5.778 1.00 0.00 C ATOM 987 O GLU A 67 -16.270 -0.810 -4.611 1.00 0.00 O ATOM 988 CB GLU A 67 -17.907 -1.631 -7.277 1.00 0.00 C ATOM 989 CG GLU A 67 -18.960 -1.135 -8.253 1.00 0.00 C ATOM 990 CD GLU A 67 -19.889 -0.108 -7.638 1.00 0.00 C ATOM 991 OE1 GLU A 67 -20.054 -0.124 -6.400 1.00 0.00 O ATOM 992 OE2 GLU A 67 -20.450 0.713 -8.394 1.00 0.00 O ATOM 0 H GLU A 67 -16.138 -0.939 -8.869 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.349 0.336 -6.616 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -17.413 -2.505 -7.702 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.398 -1.957 -6.360 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -18.467 -0.699 -9.122 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -19.546 -1.982 -8.610 1.00 0.00 H new ATOM 999 N ILE A 68 -14.921 -1.802 -6.114 1.00 0.00 N ATOM 1000 CA ILE A 68 -14.012 -2.337 -5.108 1.00 0.00 C ATOM 1001 C ILE A 68 -13.023 -1.275 -4.639 1.00 0.00 C ATOM 1002 O ILE A 68 -12.784 -1.118 -3.443 1.00 0.00 O ATOM 1003 CB ILE A 68 -13.229 -3.550 -5.645 1.00 0.00 C ATOM 1004 CG1 ILE A 68 -14.185 -4.573 -6.262 1.00 0.00 C ATOM 1005 CG2 ILE A 68 -12.409 -4.189 -4.533 1.00 0.00 C ATOM 1006 CD1 ILE A 68 -13.560 -5.394 -7.369 1.00 0.00 C ATOM 0 H ILE A 68 -14.669 -2.032 -7.075 1.00 0.00 H new ATOM 0 HA ILE A 68 -14.626 -2.655 -4.266 1.00 0.00 H new ATOM 0 HB ILE A 68 -12.546 -3.204 -6.421 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -14.541 -5.244 -5.480 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -15.057 -4.052 -6.656 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -11.862 -5.044 -4.930 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -11.703 -3.459 -4.136 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -13.074 -4.521 -3.736 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -14.295 -6.098 -7.759 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -13.229 -4.733 -8.170 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -12.705 -5.944 -6.976 1.00 0.00 H new ATOM 1018 N ARG A 69 -12.448 -0.547 -5.592 1.00 0.00 N ATOM 1019 CA ARG A 69 -11.483 0.500 -5.278 1.00 0.00 C ATOM 1020 C ARG A 69 -12.101 1.561 -4.374 1.00 0.00 C ATOM 1021 O ARG A 69 -11.408 2.190 -3.574 1.00 0.00 O ATOM 1022 CB ARG A 69 -10.966 1.148 -6.564 1.00 0.00 C ATOM 1023 CG ARG A 69 -9.959 0.292 -7.315 1.00 0.00 C ATOM 1024 CD ARG A 69 -9.588 0.912 -8.654 1.00 0.00 C ATOM 1025 NE ARG A 69 -8.245 1.485 -8.636 1.00 0.00 N ATOM 1026 CZ ARG A 69 -7.772 2.294 -9.582 1.00 0.00 C ATOM 1027 NH1 ARG A 69 -8.530 2.629 -10.619 1.00 0.00 N ATOM 1028 NH2 ARG A 69 -6.539 2.772 -9.490 1.00 0.00 N ATOM 0 H ARG A 69 -12.634 -0.664 -6.588 1.00 0.00 H new ATOM 0 HA ARG A 69 -10.648 0.041 -4.748 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -11.811 1.359 -7.219 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -10.505 2.105 -6.319 1.00 0.00 H new ATOM 0 HG2 ARG A 69 -9.061 0.168 -6.709 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -10.374 -0.703 -7.476 1.00 0.00 H new ATOM 0 HD2 ARG A 69 -9.648 0.153 -9.434 1.00 0.00 H new ATOM 0 HD3 ARG A 69 -10.310 1.688 -8.907 1.00 0.00 H new ATOM 0 HE ARG A 69 -7.634 1.252 -7.853 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -9.480 2.266 -10.694 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -8.162 3.249 -11.340 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -5.952 2.520 -8.694 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -6.177 3.392 -10.215 1.00 0.00 H new ATOM 1042 N LYS A 70 -13.410 1.756 -4.506 1.00 0.00 N ATOM 1043 CA LYS A 70 -14.120 2.744 -3.700 1.00 0.00 C ATOM 1044 C LYS A 70 -14.167 2.323 -2.236 1.00 0.00 C ATOM 1045 O LYS A 70 -13.881 3.119 -1.341 1.00 0.00 O ATOM 1046 CB LYS A 70 -15.542 2.937 -4.233 1.00 0.00 C ATOM 1047 CG LYS A 70 -16.030 4.375 -4.158 1.00 0.00 C ATOM 1048 CD LYS A 70 -17.528 4.442 -3.909 1.00 0.00 C ATOM 1049 CE LYS A 70 -18.172 5.573 -4.695 1.00 0.00 C ATOM 1050 NZ LYS A 70 -19.478 5.984 -4.109 1.00 0.00 N ATOM 0 H LYS A 70 -14.000 1.244 -5.162 1.00 0.00 H new ATOM 0 HA LYS A 70 -13.580 3.688 -3.769 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -15.581 2.602 -5.270 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -16.223 2.301 -3.667 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -15.504 4.898 -3.360 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -15.791 4.890 -5.088 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -17.988 3.494 -4.190 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -17.715 4.584 -2.845 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -17.498 6.430 -4.716 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -18.321 5.258 -5.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -19.884 6.757 -4.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -20.130 5.174 -4.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -19.333 6.309 -3.132 1.00 0.00 H new ATOM 1064 N TYR A 71 -14.529 1.067 -1.996 1.00 0.00 N ATOM 1065 CA TYR A 71 -14.615 0.541 -0.639 1.00 0.00 C ATOM 1066 C TYR A 71 -13.241 0.121 -0.126 1.00 0.00 C ATOM 1067 O TYR A 71 -12.989 0.128 1.079 1.00 0.00 O ATOM 1068 CB TYR A 71 -15.575 -0.650 -0.591 1.00 0.00 C ATOM 1069 CG TYR A 71 -17.012 -0.282 -0.886 1.00 0.00 C ATOM 1070 CD1 TYR A 71 -17.711 0.585 -0.055 1.00 0.00 C ATOM 1071 CD2 TYR A 71 -17.669 -0.801 -1.995 1.00 0.00 C ATOM 1072 CE1 TYR A 71 -19.024 0.923 -0.321 1.00 0.00 C ATOM 1073 CE2 TYR A 71 -18.982 -0.466 -2.267 1.00 0.00 C ATOM 1074 CZ TYR A 71 -19.655 0.395 -1.428 1.00 0.00 C ATOM 1075 OH TYR A 71 -20.962 0.731 -1.696 1.00 0.00 O ATOM 0 H TYR A 71 -14.768 0.394 -2.725 1.00 0.00 H new ATOM 0 HA TYR A 71 -14.995 1.334 0.005 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -15.246 -1.400 -1.310 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -15.522 -1.109 0.396 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -17.220 1.001 0.812 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -17.145 -1.477 -2.655 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -19.554 1.598 0.335 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -19.478 -0.877 -3.134 1.00 0.00 H new ATOM 0 HH TYR A 71 -21.529 -0.063 -1.606 1.00 0.00 H new ATOM 1085 N SER A 72 -12.353 -0.245 -1.046 1.00 0.00 N ATOM 1086 CA SER A 72 -11.005 -0.668 -0.684 1.00 0.00 C ATOM 1087 C SER A 72 -10.288 0.415 0.117 1.00 0.00 C ATOM 1088 O SER A 72 -9.626 1.286 -0.449 1.00 0.00 O ATOM 1089 CB SER A 72 -10.199 -1.005 -1.941 1.00 0.00 C ATOM 1090 OG SER A 72 -9.861 0.168 -2.661 1.00 0.00 O ATOM 0 H SER A 72 -12.543 -0.257 -2.048 1.00 0.00 H new ATOM 0 HA SER A 72 -11.087 -1.559 -0.062 1.00 0.00 H new ATOM 0 HB2 SER A 72 -9.290 -1.538 -1.662 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.777 -1.673 -2.579 1.00 0.00 H new ATOM 0 HG SER A 72 -9.371 0.782 -2.075 1.00 0.00 H new ATOM 1096 N ALA A 73 -10.424 0.354 1.438 1.00 0.00 N ATOM 1097 CA ALA A 73 -9.789 1.328 2.318 1.00 0.00 C ATOM 1098 C ALA A 73 -10.018 0.976 3.784 1.00 0.00 C ATOM 1099 O ALA A 73 -11.155 0.780 4.215 1.00 0.00 O ATOM 1100 CB ALA A 73 -10.312 2.726 2.022 1.00 0.00 C ATOM 0 H ALA A 73 -10.968 -0.360 1.922 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.716 1.305 2.129 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.830 3.443 2.686 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.092 2.985 0.986 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.390 2.752 2.181 1.00 0.00 H new ATOM 1106 N ILE A 74 -8.932 0.895 4.545 1.00 0.00 N ATOM 1107 CA ILE A 74 -9.015 0.566 5.963 1.00 0.00 C ATOM 1108 C ILE A 74 -8.661 1.769 6.829 1.00 0.00 C ATOM 1109 O ILE A 74 -9.215 1.951 7.914 1.00 0.00 O ATOM 1110 CB ILE A 74 -8.080 -0.605 6.325 1.00 0.00 C ATOM 1111 CG1 ILE A 74 -8.270 -1.761 5.343 1.00 0.00 C ATOM 1112 CG2 ILE A 74 -8.337 -1.065 7.752 1.00 0.00 C ATOM 1113 CD1 ILE A 74 -7.247 -2.864 5.504 1.00 0.00 C ATOM 0 H ILE A 74 -7.984 1.053 4.203 1.00 0.00 H new ATOM 0 HA ILE A 74 -10.046 0.272 6.158 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.048 -0.262 6.255 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.268 -2.180 5.475 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.219 -1.375 4.325 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -7.670 -1.892 7.993 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -8.154 -0.239 8.439 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.372 -1.394 7.847 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.442 -3.651 4.775 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.248 -2.460 5.342 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.313 -3.277 6.511 1.00 0.00 H new ATOM 1125 N TYR A 75 -7.735 2.590 6.343 1.00 0.00 N ATOM 1126 CA TYR A 75 -7.308 3.779 7.074 1.00 0.00 C ATOM 1127 C TYR A 75 -7.592 5.044 6.270 1.00 0.00 C ATOM 1128 O TYR A 75 -7.325 5.101 5.070 1.00 0.00 O ATOM 1129 CB TYR A 75 -5.815 3.692 7.399 1.00 0.00 C ATOM 1130 CG TYR A 75 -5.464 2.561 8.339 1.00 0.00 C ATOM 1131 CD1 TYR A 75 -5.930 2.550 9.647 1.00 0.00 C ATOM 1132 CD2 TYR A 75 -4.667 1.505 7.917 1.00 0.00 C ATOM 1133 CE1 TYR A 75 -5.611 1.517 10.509 1.00 0.00 C ATOM 1134 CE2 TYR A 75 -4.345 0.468 8.772 1.00 0.00 C ATOM 1135 CZ TYR A 75 -4.818 0.479 10.067 1.00 0.00 C ATOM 1136 OH TYR A 75 -4.498 -0.550 10.922 1.00 0.00 O ATOM 0 H TYR A 75 -7.266 2.454 5.447 1.00 0.00 H new ATOM 0 HA TYR A 75 -7.875 3.827 8.004 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.257 3.568 6.471 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.493 4.634 7.842 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -6.551 3.361 9.997 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.293 1.494 6.904 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -5.981 1.523 11.524 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.726 -0.347 8.427 1.00 0.00 H new ATOM 0 HH TYR A 75 -4.677 -1.408 10.483 1.00 0.00 H new ATOM 1146 N GLY A 76 -8.135 6.054 6.941 1.00 0.00 N ATOM 1147 CA GLY A 76 -8.445 7.304 6.273 1.00 0.00 C ATOM 1148 C GLY A 76 -9.605 7.173 5.307 1.00 0.00 C ATOM 1149 O GLY A 76 -10.201 6.103 5.184 1.00 0.00 O ATOM 0 H GLY A 76 -8.366 6.029 7.934 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -8.682 8.062 7.019 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.564 7.652 5.733 1.00 0.00 H new ATOM 1153 N ARG A 77 -9.926 8.263 4.618 1.00 0.00 N ATOM 1154 CA ARG A 77 -11.022 8.265 3.656 1.00 0.00 C ATOM 1155 C ARG A 77 -10.633 9.020 2.390 1.00 0.00 C ATOM 1156 O ARG A 77 -9.467 9.366 2.194 1.00 0.00 O ATOM 1157 CB ARG A 77 -12.270 8.895 4.278 1.00 0.00 C ATOM 1158 CG ARG A 77 -13.563 8.194 3.890 1.00 0.00 C ATOM 1159 CD ARG A 77 -14.555 8.177 5.041 1.00 0.00 C ATOM 1160 NE ARG A 77 -15.923 8.423 4.589 1.00 0.00 N ATOM 1161 CZ ARG A 77 -16.693 7.498 4.021 1.00 0.00 C ATOM 1162 NH1 ARG A 77 -16.235 6.268 3.831 1.00 0.00 N ATOM 1163 NH2 ARG A 77 -17.925 7.806 3.639 1.00 0.00 N ATOM 0 H ARG A 77 -9.443 9.157 4.708 1.00 0.00 H new ATOM 0 HA ARG A 77 -11.240 7.231 3.387 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -12.171 8.882 5.363 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -12.328 9.941 3.976 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -14.008 8.698 3.032 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -13.345 7.172 3.581 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -14.508 7.212 5.546 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -14.274 8.934 5.773 1.00 0.00 H new ATOM 0 HE ARG A 77 -16.310 9.358 4.716 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -15.287 6.026 4.121 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -16.830 5.564 3.395 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -18.282 8.751 3.781 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -18.516 7.098 3.204 1.00 0.00 H new ATOM 1177 N PHE A 78 -11.616 9.274 1.533 1.00 0.00 N ATOM 1178 CA PHE A 78 -11.377 9.989 0.285 1.00 0.00 C ATOM 1179 C PHE A 78 -11.853 11.435 0.388 1.00 0.00 C ATOM 1180 O PHE A 78 -11.284 12.332 -0.234 1.00 0.00 O ATOM 1181 CB PHE A 78 -12.089 9.288 -0.873 1.00 0.00 C ATOM 1182 CG PHE A 78 -13.570 9.145 -0.668 1.00 0.00 C ATOM 1183 CD1 PHE A 78 -14.084 8.059 0.022 1.00 0.00 C ATOM 1184 CD2 PHE A 78 -14.447 10.096 -1.162 1.00 0.00 C ATOM 1185 CE1 PHE A 78 -15.446 7.924 0.214 1.00 0.00 C ATOM 1186 CE2 PHE A 78 -15.810 9.967 -0.974 1.00 0.00 C ATOM 1187 CZ PHE A 78 -16.310 8.879 -0.284 1.00 0.00 C ATOM 0 H PHE A 78 -12.586 8.995 1.680 1.00 0.00 H new ATOM 0 HA PHE A 78 -10.304 9.990 0.095 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -11.910 9.847 -1.791 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -11.652 8.299 -1.012 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -13.413 7.309 0.414 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -14.061 10.949 -1.701 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -15.834 7.072 0.753 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -16.483 10.715 -1.366 1.00 0.00 H new ATOM 0 HZ PHE A 78 -17.375 8.776 -0.135 1.00 0.00 H new ATOM 1197 N ASP A 79 -12.897 11.653 1.179 1.00 0.00 N ATOM 1198 CA ASP A 79 -13.451 12.990 1.366 1.00 0.00 C ATOM 1199 C ASP A 79 -12.660 13.762 2.416 1.00 0.00 C ATOM 1200 O ASP A 79 -12.577 13.349 3.573 1.00 0.00 O ATOM 1201 CB ASP A 79 -14.921 12.903 1.778 1.00 0.00 C ATOM 1202 CG ASP A 79 -15.852 12.808 0.585 1.00 0.00 C ATOM 1203 OD1 ASP A 79 -15.429 13.183 -0.529 1.00 0.00 O ATOM 1204 OD2 ASP A 79 -17.003 12.358 0.765 1.00 0.00 O ATOM 0 H ASP A 79 -13.378 10.921 1.702 1.00 0.00 H new ATOM 0 HA ASP A 79 -13.379 13.523 0.418 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -15.065 12.032 2.418 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -15.182 13.780 2.370 1.00 0.00 H new ATOM 1209 N SER A 80 -12.082 14.886 2.007 1.00 0.00 N ATOM 1210 CA SER A 80 -11.298 15.717 2.913 1.00 0.00 C ATOM 1211 C SER A 80 -12.176 16.292 4.020 1.00 0.00 C ATOM 1212 O SER A 80 -12.965 17.208 3.789 1.00 0.00 O ATOM 1213 CB SER A 80 -10.621 16.852 2.143 1.00 0.00 C ATOM 1214 OG SER A 80 -9.770 16.344 1.130 1.00 0.00 O ATOM 0 H SER A 80 -12.142 15.243 1.053 1.00 0.00 H new ATOM 0 HA SER A 80 -10.532 15.090 3.369 1.00 0.00 H new ATOM 0 HB2 SER A 80 -11.379 17.496 1.697 1.00 0.00 H new ATOM 0 HB3 SER A 80 -10.044 17.469 2.832 1.00 0.00 H new ATOM 0 HG SER A 80 -9.350 17.089 0.651 1.00 0.00 H new ATOM 1220 N LYS A 81 -12.031 15.749 5.225 1.00 0.00 N ATOM 1221 CA LYS A 81 -12.810 16.207 6.369 1.00 0.00 C ATOM 1222 C LYS A 81 -11.930 16.346 7.606 1.00 0.00 C ATOM 1223 O LYS A 81 -10.726 16.093 7.555 1.00 0.00 O ATOM 1224 CB LYS A 81 -13.959 15.238 6.652 1.00 0.00 C ATOM 1225 CG LYS A 81 -14.935 15.097 5.495 1.00 0.00 C ATOM 1226 CD LYS A 81 -16.158 14.286 5.894 1.00 0.00 C ATOM 1227 CE LYS A 81 -16.617 13.377 4.765 1.00 0.00 C ATOM 1228 NZ LYS A 81 -18.019 12.914 4.960 1.00 0.00 N ATOM 0 H LYS A 81 -11.381 14.991 5.434 1.00 0.00 H new ATOM 0 HA LYS A 81 -13.222 17.187 6.127 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.546 14.258 6.890 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -14.501 15.578 7.534 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -15.247 16.086 5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -14.437 14.616 4.654 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -15.927 13.686 6.774 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -16.968 14.960 6.172 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -16.539 13.908 3.816 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -15.955 12.513 4.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -18.294 12.297 4.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -18.089 12.385 5.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -18.655 13.736 4.994 1.00 0.00 H new ATOM 1242 N ARG A 82 -12.537 16.748 8.717 1.00 0.00 N ATOM 1243 CA ARG A 82 -11.808 16.919 9.968 1.00 0.00 C ATOM 1244 C ARG A 82 -10.709 17.966 9.820 1.00 0.00 C ATOM 1245 O ARG A 82 -10.530 18.543 8.746 1.00 0.00 O ATOM 1246 CB ARG A 82 -11.202 15.588 10.416 1.00 0.00 C ATOM 1247 CG ARG A 82 -12.218 14.460 10.515 1.00 0.00 C ATOM 1248 CD ARG A 82 -11.681 13.170 9.917 1.00 0.00 C ATOM 1249 NE ARG A 82 -12.519 12.021 10.252 1.00 0.00 N ATOM 1250 CZ ARG A 82 -12.494 10.867 9.588 1.00 0.00 C ATOM 1251 NH1 ARG A 82 -11.677 10.705 8.556 1.00 0.00 N ATOM 1252 NH2 ARG A 82 -13.290 9.873 9.959 1.00 0.00 N ATOM 0 H ARG A 82 -13.533 16.962 8.777 1.00 0.00 H new ATOM 0 HA ARG A 82 -12.513 17.263 10.725 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -10.419 15.300 9.714 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -10.726 15.723 11.387 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -12.480 14.296 11.560 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -13.134 14.748 9.998 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -11.620 13.271 8.833 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -10.667 12.997 10.279 1.00 0.00 H new ATOM 0 HE ARG A 82 -13.160 12.108 11.040 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -11.063 11.467 8.267 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -11.662 9.819 8.051 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -13.920 9.993 10.752 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -13.272 8.989 9.451 1.00 0.00 H new ATOM 1266 N LYS A 83 -9.977 18.207 10.901 1.00 0.00 N ATOM 1267 CA LYS A 83 -8.896 19.186 10.891 1.00 0.00 C ATOM 1268 C LYS A 83 -7.830 18.807 9.866 1.00 0.00 C ATOM 1269 O LYS A 83 -7.127 17.810 10.027 1.00 0.00 O ATOM 1270 CB LYS A 83 -8.265 19.297 12.281 1.00 0.00 C ATOM 1271 CG LYS A 83 -7.465 20.573 12.485 1.00 0.00 C ATOM 1272 CD LYS A 83 -6.659 20.524 13.773 1.00 0.00 C ATOM 1273 CE LYS A 83 -5.565 19.472 13.706 1.00 0.00 C ATOM 1274 NZ LYS A 83 -4.671 19.524 14.896 1.00 0.00 N ATOM 0 H LYS A 83 -10.112 17.738 11.796 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.317 20.152 10.613 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.052 19.247 13.033 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -7.613 18.439 12.445 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -6.793 20.722 11.639 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -8.141 21.428 12.510 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -6.214 21.501 13.963 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -7.322 20.308 14.610 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -6.017 18.483 13.634 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -4.975 19.619 12.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -3.938 18.791 14.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -4.220 20.460 14.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -5.230 19.358 15.757 1.00 0.00 H new ATOM 1288 N ASP A 84 -7.717 19.612 8.814 1.00 0.00 N ATOM 1289 CA ASP A 84 -6.738 19.365 7.760 1.00 0.00 C ATOM 1290 C ASP A 84 -7.039 18.059 7.030 1.00 0.00 C ATOM 1291 O ASP A 84 -7.598 18.066 5.933 1.00 0.00 O ATOM 1292 CB ASP A 84 -5.323 19.326 8.344 1.00 0.00 C ATOM 1293 CG ASP A 84 -4.615 20.662 8.234 1.00 0.00 C ATOM 1294 OD1 ASP A 84 -4.780 21.338 7.197 1.00 0.00 O ATOM 1295 OD2 ASP A 84 -3.894 21.032 9.186 1.00 0.00 O ATOM 0 H ASP A 84 -8.292 20.442 8.668 1.00 0.00 H new ATOM 0 HA ASP A 84 -6.802 20.183 7.042 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -5.373 19.030 9.392 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -4.740 18.565 7.825 1.00 0.00 H new ATOM 1300 N GLY A 85 -6.667 16.941 7.644 1.00 0.00 N ATOM 1301 CA GLY A 85 -6.907 15.645 7.037 1.00 0.00 C ATOM 1302 C GLY A 85 -5.621 14.906 6.719 1.00 0.00 C ATOM 1303 O GLY A 85 -5.466 14.360 5.627 1.00 0.00 O ATOM 0 H GLY A 85 -6.203 16.909 8.552 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -7.514 15.039 7.710 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -7.482 15.777 6.121 1.00 0.00 H new ATOM 1307 N LYS A 86 -4.698 14.891 7.674 1.00 0.00 N ATOM 1308 CA LYS A 86 -3.419 14.214 7.490 1.00 0.00 C ATOM 1309 C LYS A 86 -3.103 13.316 8.683 1.00 0.00 C ATOM 1310 O LYS A 86 -2.315 13.679 9.554 1.00 0.00 O ATOM 1311 CB LYS A 86 -2.299 15.239 7.295 1.00 0.00 C ATOM 1312 CG LYS A 86 -1.950 15.487 5.836 1.00 0.00 C ATOM 1313 CD LYS A 86 -2.425 16.855 5.372 1.00 0.00 C ATOM 1314 CE LYS A 86 -2.450 16.950 3.854 1.00 0.00 C ATOM 1315 NZ LYS A 86 -1.165 16.505 3.249 1.00 0.00 N ATOM 0 H LYS A 86 -4.811 15.340 8.583 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.490 13.591 6.598 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.596 16.182 7.754 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -1.408 14.896 7.820 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -0.871 15.411 5.701 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -2.404 14.714 5.216 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.423 17.048 5.766 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -1.768 17.626 5.775 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.265 16.339 3.465 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.654 17.979 3.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.158 16.742 2.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -0.374 16.986 3.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -1.065 15.476 3.365 1.00 0.00 H new ATOM 1329 N HIS A 87 -3.724 12.141 8.712 1.00 0.00 N ATOM 1330 CA HIS A 87 -3.509 11.190 9.796 1.00 0.00 C ATOM 1331 C HIS A 87 -2.519 10.108 9.382 1.00 0.00 C ATOM 1332 O HIS A 87 -1.689 9.673 10.180 1.00 0.00 O ATOM 1333 CB HIS A 87 -4.836 10.553 10.214 1.00 0.00 C ATOM 1334 CG HIS A 87 -5.754 11.495 10.929 1.00 0.00 C ATOM 1335 ND1 HIS A 87 -6.511 12.446 10.280 1.00 0.00 N ATOM 1336 CD2 HIS A 87 -6.035 11.628 12.247 1.00 0.00 C ATOM 1337 CE1 HIS A 87 -7.217 13.124 11.167 1.00 0.00 C ATOM 1338 NE2 HIS A 87 -6.947 12.647 12.368 1.00 0.00 N ATOM 0 H HIS A 87 -4.380 11.825 7.997 1.00 0.00 H new ATOM 0 HA HIS A 87 -3.092 11.732 10.645 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -5.341 10.170 9.327 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -4.632 9.698 10.859 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -5.619 11.042 13.053 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -7.899 13.932 10.947 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -7.350 12.981 13.243 1.00 0.00 H new ATOM 1347 N LEU A 88 -2.613 9.676 8.128 1.00 0.00 N ATOM 1348 CA LEU A 88 -1.725 8.642 7.608 1.00 0.00 C ATOM 1349 C LEU A 88 -0.278 9.123 7.599 1.00 0.00 C ATOM 1350 O LEU A 88 0.019 10.241 8.024 1.00 0.00 O ATOM 1351 CB LEU A 88 -2.149 8.242 6.194 1.00 0.00 C ATOM 1352 CG LEU A 88 -3.641 7.944 6.026 1.00 0.00 C ATOM 1353 CD1 LEU A 88 -3.945 7.542 4.591 1.00 0.00 C ATOM 1354 CD2 LEU A 88 -4.076 6.852 6.993 1.00 0.00 C ATOM 0 H LEU A 88 -3.294 10.025 7.454 1.00 0.00 H new ATOM 0 HA LEU A 88 -1.797 7.773 8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.874 9.043 5.508 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.582 7.360 5.897 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.204 8.849 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -5.010 7.334 4.489 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -3.668 8.355 3.919 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.375 6.649 4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -5.139 6.652 6.861 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -3.508 5.943 6.795 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -3.893 7.178 8.017 1.00 0.00 H new ATOM 1366 N THR A 89 0.620 8.273 7.113 1.00 0.00 N ATOM 1367 CA THR A 89 2.038 8.612 7.049 1.00 0.00 C ATOM 1368 C THR A 89 2.728 7.853 5.920 1.00 0.00 C ATOM 1369 O THR A 89 3.383 8.451 5.066 1.00 0.00 O ATOM 1370 CB THR A 89 2.720 8.299 8.381 1.00 0.00 C ATOM 1371 OG1 THR A 89 4.129 8.323 8.240 1.00 0.00 O ATOM 1372 CG2 THR A 89 2.338 6.948 8.949 1.00 0.00 C ATOM 0 H THR A 89 0.392 7.345 6.758 1.00 0.00 H new ATOM 0 HA THR A 89 2.122 9.680 6.849 1.00 0.00 H new ATOM 0 HB THR A 89 2.378 9.073 9.068 1.00 0.00 H new ATOM 0 HG1 THR A 89 4.548 8.122 9.103 1.00 0.00 H new ATOM 0 HG21 THR A 89 2.858 6.791 9.894 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.262 6.915 9.117 1.00 0.00 H new ATOM 0 HG23 THR A 89 2.620 6.165 8.245 1.00 0.00 H new ATOM 1380 N LEU A 90 2.578 6.532 5.921 1.00 0.00 N ATOM 1381 CA LEU A 90 3.188 5.692 4.897 1.00 0.00 C ATOM 1382 C LEU A 90 2.783 4.233 5.076 1.00 0.00 C ATOM 1383 O LEU A 90 2.512 3.529 4.103 1.00 0.00 O ATOM 1384 CB LEU A 90 4.712 5.819 4.945 1.00 0.00 C ATOM 1385 CG LEU A 90 5.445 5.291 3.712 1.00 0.00 C ATOM 1386 CD1 LEU A 90 5.167 6.174 2.505 1.00 0.00 C ATOM 1387 CD2 LEU A 90 6.941 5.205 3.978 1.00 0.00 C ATOM 0 H LEU A 90 2.039 6.020 6.620 1.00 0.00 H new ATOM 0 HA LEU A 90 2.831 6.032 3.925 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.970 6.870 5.080 1.00 0.00 H new ATOM 0 HB3 LEU A 90 5.078 5.286 5.822 1.00 0.00 H new ATOM 0 HG LEU A 90 5.075 4.289 3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 90 5.698 5.782 1.637 1.00 0.00 H new ATOM 0 HD12 LEU A 90 4.096 6.185 2.301 1.00 0.00 H new ATOM 0 HD13 LEU A 90 5.508 7.189 2.710 1.00 0.00 H new ATOM 0 HD21 LEU A 90 7.447 4.827 3.090 1.00 0.00 H new ATOM 0 HD22 LEU A 90 7.325 6.196 4.221 1.00 0.00 H new ATOM 0 HD23 LEU A 90 7.124 4.530 4.814 1.00 0.00 H new ATOM 1399 N HIS A 91 2.744 3.784 6.326 1.00 0.00 N ATOM 1400 CA HIS A 91 2.374 2.407 6.633 1.00 0.00 C ATOM 1401 C HIS A 91 0.902 2.156 6.321 1.00 0.00 C ATOM 1402 O HIS A 91 0.558 1.189 5.641 1.00 0.00 O ATOM 1403 CB HIS A 91 2.655 2.098 8.105 1.00 0.00 C ATOM 1404 CG HIS A 91 3.154 0.706 8.339 1.00 0.00 C ATOM 1405 ND1 HIS A 91 4.410 0.199 8.319 1.00 0.00 N flip ATOM 1406 CD2 HIS A 91 2.321 -0.353 8.633 1.00 0.00 C flip ATOM 1407 CE1 HIS A 91 4.313 -1.141 8.599 1.00 0.00 C flip ATOM 1408 NE2 HIS A 91 3.042 -1.450 8.785 1.00 0.00 N flip ATOM 0 H HIS A 91 2.964 4.354 7.143 1.00 0.00 H new ATOM 0 HA HIS A 91 2.976 1.747 6.008 1.00 0.00 H new ATOM 0 HB2 HIS A 91 3.391 2.808 8.483 1.00 0.00 H new ATOM 0 HB3 HIS A 91 1.742 2.250 8.680 1.00 0.00 H new ATOM 0 HD2 HIS A 91 1.246 -0.295 8.725 1.00 0.00 H new ATOM 0 HE1 HIS A 91 5.142 -1.831 8.658 1.00 0.00 H new ATOM 0 HE2 HIS A 91 2.679 -2.377 9.008 1.00 0.00 H new ATOM 1417 N GLU A 92 0.037 3.032 6.824 1.00 0.00 N ATOM 1418 CA GLU A 92 -1.398 2.903 6.599 1.00 0.00 C ATOM 1419 C GLU A 92 -1.724 2.931 5.108 1.00 0.00 C ATOM 1420 O GLU A 92 -2.682 2.303 4.660 1.00 0.00 O ATOM 1421 CB GLU A 92 -2.150 4.026 7.317 1.00 0.00 C ATOM 1422 CG GLU A 92 -2.305 3.793 8.811 1.00 0.00 C ATOM 1423 CD GLU A 92 -1.349 4.635 9.634 1.00 0.00 C ATOM 1424 OE1 GLU A 92 -1.447 5.879 9.570 1.00 0.00 O ATOM 1425 OE2 GLU A 92 -0.504 4.049 10.342 1.00 0.00 O ATOM 0 H GLU A 92 0.305 3.838 7.389 1.00 0.00 H new ATOM 0 HA GLU A 92 -1.717 1.942 7.003 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.622 4.966 7.157 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.138 4.135 6.870 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -3.330 4.020 9.106 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -2.136 2.739 9.030 1.00 0.00 H new ATOM 1432 N LEU A 93 -0.919 3.665 4.346 1.00 0.00 N ATOM 1433 CA LEU A 93 -1.123 3.775 2.906 1.00 0.00 C ATOM 1434 C LEU A 93 -1.006 2.411 2.232 1.00 0.00 C ATOM 1435 O LEU A 93 -1.855 2.030 1.427 1.00 0.00 O ATOM 1436 CB LEU A 93 -0.108 4.747 2.299 1.00 0.00 C ATOM 1437 CG LEU A 93 -0.572 6.202 2.220 1.00 0.00 C ATOM 1438 CD1 LEU A 93 0.575 7.106 1.795 1.00 0.00 C ATOM 1439 CD2 LEU A 93 -1.743 6.336 1.259 1.00 0.00 C ATOM 0 H LEU A 93 -0.121 4.192 4.701 1.00 0.00 H new ATOM 0 HA LEU A 93 -2.129 4.158 2.735 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.809 4.705 2.887 1.00 0.00 H new ATOM 0 HB3 LEU A 93 0.142 4.406 1.294 1.00 0.00 H new ATOM 0 HG LEU A 93 -0.903 6.512 3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.226 8.137 1.744 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.385 7.032 2.521 1.00 0.00 H new ATOM 0 HD13 LEU A 93 0.938 6.797 0.815 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -2.060 7.378 1.215 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.438 6.007 0.266 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -2.571 5.719 1.607 1.00 0.00 H new ATOM 1451 N THR A 94 0.055 1.681 2.565 1.00 0.00 N ATOM 1452 CA THR A 94 0.285 0.361 1.991 1.00 0.00 C ATOM 1453 C THR A 94 -0.847 -0.597 2.350 1.00 0.00 C ATOM 1454 O THR A 94 -1.361 -1.314 1.493 1.00 0.00 O ATOM 1455 CB THR A 94 1.620 -0.205 2.480 1.00 0.00 C ATOM 1456 OG1 THR A 94 2.529 0.840 2.775 1.00 0.00 O ATOM 1457 CG2 THR A 94 2.285 -1.120 1.475 1.00 0.00 C ATOM 0 H THR A 94 0.768 1.982 3.229 1.00 0.00 H new ATOM 0 HA THR A 94 0.316 0.466 0.907 1.00 0.00 H new ATOM 0 HB THR A 94 1.380 -0.784 3.372 1.00 0.00 H new ATOM 0 HG1 THR A 94 3.376 0.458 3.088 1.00 0.00 H new ATOM 0 HG21 THR A 94 3.226 -1.487 1.884 1.00 0.00 H new ATOM 0 HG22 THR A 94 1.629 -1.964 1.261 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.479 -0.569 0.555 1.00 0.00 H new ATOM 1465 N VAL A 95 -1.228 -0.604 3.623 1.00 0.00 N ATOM 1466 CA VAL A 95 -2.298 -1.476 4.098 1.00 0.00 C ATOM 1467 C VAL A 95 -3.587 -1.253 3.311 1.00 0.00 C ATOM 1468 O VAL A 95 -4.402 -2.164 3.166 1.00 0.00 O ATOM 1469 CB VAL A 95 -2.582 -1.253 5.595 1.00 0.00 C ATOM 1470 CG1 VAL A 95 -3.537 -2.312 6.123 1.00 0.00 C ATOM 1471 CG2 VAL A 95 -1.284 -1.252 6.390 1.00 0.00 C ATOM 0 H VAL A 95 -0.812 -0.016 4.345 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.957 -2.500 3.947 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.056 -0.279 5.714 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.725 -2.137 7.182 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.477 -2.260 5.574 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -3.094 -3.299 5.991 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.504 -1.093 7.446 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -0.780 -2.210 6.265 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.637 -0.452 6.030 1.00 0.00 H new ATOM 1481 N ASN A 96 -3.765 -0.038 2.806 1.00 0.00 N ATOM 1482 CA ASN A 96 -4.956 0.303 2.035 1.00 0.00 C ATOM 1483 C ASN A 96 -4.887 -0.288 0.630 1.00 0.00 C ATOM 1484 O ASN A 96 -5.729 -1.100 0.246 1.00 0.00 O ATOM 1485 CB ASN A 96 -5.118 1.822 1.954 1.00 0.00 C ATOM 1486 CG ASN A 96 -5.958 2.374 3.089 1.00 0.00 C ATOM 1487 OD1 ASN A 96 -6.121 1.732 4.126 1.00 0.00 O ATOM 1488 ND2 ASN A 96 -6.498 3.572 2.897 1.00 0.00 N ATOM 0 H ASN A 96 -3.100 0.728 2.916 1.00 0.00 H new ATOM 0 HA ASN A 96 -5.820 -0.123 2.545 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -4.134 2.291 1.972 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -5.580 2.085 1.002 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -7.074 3.994 3.625 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -6.337 4.070 2.021 1.00 0.00 H new ATOM 1495 N GLU A 97 -3.882 0.128 -0.134 1.00 0.00 N ATOM 1496 CA GLU A 97 -3.705 -0.356 -1.499 1.00 0.00 C ATOM 1497 C GLU A 97 -3.395 -1.850 -1.516 1.00 0.00 C ATOM 1498 O GLU A 97 -3.740 -2.554 -2.466 1.00 0.00 O ATOM 1499 CB GLU A 97 -2.583 0.416 -2.194 1.00 0.00 C ATOM 1500 CG GLU A 97 -2.948 1.855 -2.522 1.00 0.00 C ATOM 1501 CD GLU A 97 -2.458 2.283 -3.892 1.00 0.00 C ATOM 1502 OE1 GLU A 97 -2.956 1.736 -4.898 1.00 0.00 O ATOM 1503 OE2 GLU A 97 -1.576 3.166 -3.958 1.00 0.00 O ATOM 0 H GLU A 97 -3.177 0.800 0.169 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.639 -0.193 -2.037 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.700 0.410 -1.555 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -2.314 -0.101 -3.115 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.031 1.971 -2.475 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -2.523 2.515 -1.766 1.00 0.00 H new ATOM 1510 N ALA A 98 -2.741 -2.328 -0.463 1.00 0.00 N ATOM 1511 CA ALA A 98 -2.383 -3.738 -0.362 1.00 0.00 C ATOM 1512 C ALA A 98 -3.625 -4.621 -0.312 1.00 0.00 C ATOM 1513 O ALA A 98 -3.602 -5.767 -0.762 1.00 0.00 O ATOM 1514 CB ALA A 98 -1.517 -3.975 0.867 1.00 0.00 C ATOM 0 H ALA A 98 -2.448 -1.760 0.332 1.00 0.00 H new ATOM 0 HA ALA A 98 -1.815 -4.006 -1.253 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -1.257 -5.032 0.931 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.606 -3.381 0.790 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -2.067 -3.682 1.761 1.00 0.00 H new ATOM 1520 N ALA A 99 -4.708 -4.084 0.240 1.00 0.00 N ATOM 1521 CA ALA A 99 -5.958 -4.827 0.350 1.00 0.00 C ATOM 1522 C ALA A 99 -6.830 -4.627 -0.885 1.00 0.00 C ATOM 1523 O ALA A 99 -7.623 -5.497 -1.244 1.00 0.00 O ATOM 1524 CB ALA A 99 -6.710 -4.408 1.604 1.00 0.00 C ATOM 0 H ALA A 99 -4.745 -3.137 0.618 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.716 -5.887 0.420 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -7.641 -4.970 1.675 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -6.096 -4.611 2.481 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -6.932 -3.342 1.556 1.00 0.00 H new ATOM 1530 N ALA A 100 -6.682 -3.474 -1.531 1.00 0.00 N ATOM 1531 CA ALA A 100 -7.459 -3.162 -2.725 1.00 0.00 C ATOM 1532 C ALA A 100 -7.231 -4.201 -3.819 1.00 0.00 C ATOM 1533 O ALA A 100 -8.181 -4.694 -4.426 1.00 0.00 O ATOM 1534 CB ALA A 100 -7.107 -1.773 -3.234 1.00 0.00 C ATOM 0 H ALA A 100 -6.032 -2.741 -1.248 1.00 0.00 H new ATOM 0 HA ALA A 100 -8.515 -3.183 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -7.694 -1.553 -4.126 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -7.329 -1.036 -2.462 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -6.046 -1.734 -3.479 1.00 0.00 H new ATOM 1540 N GLN A 101 -5.967 -4.527 -4.065 1.00 0.00 N ATOM 1541 CA GLN A 101 -5.615 -5.505 -5.088 1.00 0.00 C ATOM 1542 C GLN A 101 -6.112 -6.898 -4.707 1.00 0.00 C ATOM 1543 O GLN A 101 -6.462 -7.700 -5.571 1.00 0.00 O ATOM 1544 CB GLN A 101 -4.100 -5.532 -5.299 1.00 0.00 C ATOM 1545 CG GLN A 101 -3.490 -4.155 -5.501 1.00 0.00 C ATOM 1546 CD GLN A 101 -2.476 -4.126 -6.627 1.00 0.00 C ATOM 1547 OE1 GLN A 101 -2.694 -3.489 -7.658 1.00 0.00 O ATOM 1548 NE2 GLN A 101 -1.357 -4.816 -6.435 1.00 0.00 N ATOM 0 H GLN A 101 -5.169 -4.128 -3.570 1.00 0.00 H new ATOM 0 HA GLN A 101 -6.100 -5.209 -6.018 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.630 -6.006 -4.437 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -3.873 -6.152 -6.167 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -4.283 -3.438 -5.713 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.010 -3.835 -4.576 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -1.218 -5.330 -5.565 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -0.637 -4.832 -7.158 1.00 0.00 H new ATOM 1557 N LEU A 102 -6.138 -7.176 -3.408 1.00 0.00 N ATOM 1558 CA LEU A 102 -6.591 -8.470 -2.913 1.00 0.00 C ATOM 1559 C LEU A 102 -8.107 -8.602 -3.039 1.00 0.00 C ATOM 1560 O LEU A 102 -8.620 -9.664 -3.392 1.00 0.00 O ATOM 1561 CB LEU A 102 -6.169 -8.659 -1.454 1.00 0.00 C ATOM 1562 CG LEU A 102 -4.878 -9.453 -1.252 1.00 0.00 C ATOM 1563 CD1 LEU A 102 -4.406 -9.346 0.190 1.00 0.00 C ATOM 1564 CD2 LEU A 102 -5.083 -10.909 -1.640 1.00 0.00 C ATOM 0 H LEU A 102 -5.851 -6.523 -2.679 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.126 -9.246 -3.521 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.049 -7.677 -0.996 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -6.975 -9.163 -0.921 1.00 0.00 H new ATOM 0 HG LEU A 102 -4.108 -9.030 -1.897 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.486 -9.917 0.315 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -4.220 -8.300 0.435 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -5.173 -9.744 0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.154 -11.460 -1.490 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.867 -11.344 -1.020 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -5.375 -10.969 -2.689 1.00 0.00 H new ATOM 1576 N CYS A 103 -8.816 -7.517 -2.750 1.00 0.00 N ATOM 1577 CA CYS A 103 -10.272 -7.511 -2.831 1.00 0.00 C ATOM 1578 C CYS A 103 -10.743 -7.856 -4.240 1.00 0.00 C ATOM 1579 O CYS A 103 -11.809 -8.443 -4.423 1.00 0.00 O ATOM 1580 CB CYS A 103 -10.821 -6.144 -2.418 1.00 0.00 C ATOM 1581 SG CYS A 103 -11.097 -5.966 -0.640 1.00 0.00 S ATOM 0 H CYS A 103 -8.406 -6.630 -2.457 1.00 0.00 H new ATOM 0 HA CYS A 103 -10.651 -8.270 -2.146 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -10.126 -5.371 -2.746 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -11.762 -5.969 -2.940 1.00 0.00 H new ATOM 0 HG CYS A 103 -11.559 -4.777 -0.389 1.00 0.00 H new ATOM 1587 N VAL A 104 -9.938 -7.490 -5.234 1.00 0.00 N ATOM 1588 CA VAL A 104 -10.273 -7.762 -6.626 1.00 0.00 C ATOM 1589 C VAL A 104 -10.230 -9.258 -6.921 1.00 0.00 C ATOM 1590 O VAL A 104 -11.174 -9.820 -7.473 1.00 0.00 O ATOM 1591 CB VAL A 104 -9.316 -7.034 -7.588 1.00 0.00 C ATOM 1592 CG1 VAL A 104 -9.796 -7.167 -9.024 1.00 0.00 C ATOM 1593 CG2 VAL A 104 -9.178 -5.570 -7.197 1.00 0.00 C ATOM 0 H VAL A 104 -9.051 -7.005 -5.100 1.00 0.00 H new ATOM 0 HA VAL A 104 -11.286 -7.392 -6.784 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.334 -7.500 -7.515 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.106 -6.646 -9.688 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.837 -8.221 -9.298 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.790 -6.729 -9.117 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.498 -5.071 -7.888 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.155 -5.089 -7.239 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.782 -5.500 -6.184 1.00 0.00 H new ATOM 1603 N LYS A 105 -9.126 -9.897 -6.547 1.00 0.00 N ATOM 1604 CA LYS A 105 -8.960 -11.329 -6.772 1.00 0.00 C ATOM 1605 C LYS A 105 -10.024 -12.125 -6.024 1.00 0.00 C ATOM 1606 O LYS A 105 -10.586 -13.081 -6.559 1.00 0.00 O ATOM 1607 CB LYS A 105 -7.565 -11.778 -6.329 1.00 0.00 C ATOM 1608 CG LYS A 105 -6.439 -10.966 -6.947 1.00 0.00 C ATOM 1609 CD LYS A 105 -6.498 -10.998 -8.466 1.00 0.00 C ATOM 1610 CE LYS A 105 -7.032 -9.692 -9.032 1.00 0.00 C ATOM 1611 NZ LYS A 105 -6.082 -8.564 -8.820 1.00 0.00 N ATOM 0 H LYS A 105 -8.334 -9.447 -6.088 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.074 -11.519 -7.839 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -7.498 -11.709 -5.243 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.430 -12.828 -6.590 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -6.501 -9.934 -6.601 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -5.479 -11.358 -6.611 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -5.502 -11.188 -8.866 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -7.134 -11.822 -8.789 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -7.223 -9.810 -10.099 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.986 -9.456 -8.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -6.289 -7.804 -9.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -6.185 -8.201 -7.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -5.108 -8.899 -8.962 1.00 0.00 H new ATOM 1625 N ASP A 106 -10.295 -11.724 -4.787 1.00 0.00 N ATOM 1626 CA ASP A 106 -11.294 -12.400 -3.967 1.00 0.00 C ATOM 1627 C ASP A 106 -12.348 -11.417 -3.468 1.00 0.00 C ATOM 1628 O ASP A 106 -12.052 -10.522 -2.676 1.00 0.00 O ATOM 1629 CB ASP A 106 -10.623 -13.091 -2.778 1.00 0.00 C ATOM 1630 CG ASP A 106 -11.549 -14.066 -2.078 1.00 0.00 C ATOM 1631 OD1 ASP A 106 -11.588 -15.245 -2.487 1.00 0.00 O ATOM 1632 OD2 ASP A 106 -12.236 -13.650 -1.121 1.00 0.00 O ATOM 0 H ASP A 106 -9.838 -10.935 -4.330 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.788 -13.149 -4.586 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -9.735 -13.621 -3.123 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -10.287 -12.338 -2.065 1.00 0.00 H new ATOM 1637 N ASN A 107 -13.579 -11.589 -3.939 1.00 0.00 N ATOM 1638 CA ASN A 107 -14.677 -10.717 -3.541 1.00 0.00 C ATOM 1639 C ASN A 107 -15.075 -10.968 -2.090 1.00 0.00 C ATOM 1640 O ASN A 107 -15.538 -10.063 -1.397 1.00 0.00 O ATOM 1641 CB ASN A 107 -15.884 -10.931 -4.461 1.00 0.00 C ATOM 1642 CG ASN A 107 -16.357 -9.641 -5.101 1.00 0.00 C ATOM 1643 OD1 ASN A 107 -17.553 -9.346 -5.117 1.00 0.00 O ATOM 1644 ND2 ASN A 107 -15.422 -8.866 -5.636 1.00 0.00 N ATOM 0 H ASN A 107 -13.841 -12.324 -4.596 1.00 0.00 H new ATOM 0 HA ASN A 107 -14.339 -9.684 -3.630 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -15.621 -11.646 -5.241 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -16.701 -11.370 -3.888 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -15.683 -7.987 -6.083 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -14.443 -9.149 -5.600 1.00 0.00 H new ATOM 1651 N ALA A 108 -14.892 -12.204 -1.637 1.00 0.00 N ATOM 1652 CA ALA A 108 -15.231 -12.576 -0.269 1.00 0.00 C ATOM 1653 C ALA A 108 -14.407 -11.780 0.739 1.00 0.00 C ATOM 1654 O ALA A 108 -14.858 -11.513 1.852 1.00 0.00 O ATOM 1655 CB ALA A 108 -15.025 -14.068 -0.061 1.00 0.00 C ATOM 0 H ALA A 108 -14.510 -12.965 -2.198 1.00 0.00 H new ATOM 0 HA ALA A 108 -16.282 -12.339 -0.106 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -15.282 -14.331 0.965 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -15.663 -14.623 -0.749 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -13.982 -14.321 -0.250 1.00 0.00 H new ATOM 1661 N LEU A 109 -13.195 -11.407 0.341 1.00 0.00 N ATOM 1662 CA LEU A 109 -12.306 -10.644 1.209 1.00 0.00 C ATOM 1663 C LEU A 109 -12.931 -9.305 1.590 1.00 0.00 C ATOM 1664 O LEU A 109 -12.670 -8.772 2.668 1.00 0.00 O ATOM 1665 CB LEU A 109 -10.960 -10.413 0.519 1.00 0.00 C ATOM 1666 CG LEU A 109 -9.924 -11.517 0.735 1.00 0.00 C ATOM 1667 CD1 LEU A 109 -8.639 -11.196 -0.013 1.00 0.00 C ATOM 1668 CD2 LEU A 109 -9.648 -11.704 2.219 1.00 0.00 C ATOM 0 H LEU A 109 -12.806 -11.621 -0.577 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.146 -11.221 2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -11.132 -10.302 -0.552 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.544 -9.470 0.875 1.00 0.00 H new ATOM 0 HG LEU A 109 -10.326 -12.450 0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.913 -11.992 0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.850 -11.112 -1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.232 -10.253 0.351 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -8.909 -12.493 2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.266 -10.773 2.638 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -10.571 -11.980 2.729 1.00 0.00 H new ATOM 1680 N LEU A 110 -13.759 -8.767 0.699 1.00 0.00 N ATOM 1681 CA LEU A 110 -14.420 -7.489 0.943 1.00 0.00 C ATOM 1682 C LEU A 110 -15.257 -7.542 2.217 1.00 0.00 C ATOM 1683 O LEU A 110 -15.404 -6.539 2.915 1.00 0.00 O ATOM 1684 CB LEU A 110 -15.305 -7.116 -0.248 1.00 0.00 C ATOM 1685 CG LEU A 110 -14.558 -6.561 -1.462 1.00 0.00 C ATOM 1686 CD1 LEU A 110 -15.293 -6.910 -2.746 1.00 0.00 C ATOM 1687 CD2 LEU A 110 -14.384 -5.055 -1.337 1.00 0.00 C ATOM 0 H LEU A 110 -13.988 -9.196 -0.198 1.00 0.00 H new ATOM 0 HA LEU A 110 -13.650 -6.728 1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -15.863 -8.000 -0.557 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -16.035 -6.376 0.079 1.00 0.00 H new ATOM 0 HG LEU A 110 -13.570 -7.019 -1.498 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -14.747 -6.507 -3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -15.366 -7.993 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -16.294 -6.480 -2.720 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -13.851 -4.677 -2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -15.363 -4.579 -1.276 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -13.814 -4.828 -0.436 1.00 0.00 H new ATOM 1699 N THR A 111 -15.802 -8.717 2.514 1.00 0.00 N ATOM 1700 CA THR A 111 -16.623 -8.899 3.705 1.00 0.00 C ATOM 1701 C THR A 111 -15.758 -9.249 4.913 1.00 0.00 C ATOM 1702 O THR A 111 -16.020 -8.797 6.027 1.00 0.00 O ATOM 1703 CB THR A 111 -17.662 -9.996 3.472 1.00 0.00 C ATOM 1704 OG1 THR A 111 -17.188 -10.946 2.533 1.00 0.00 O ATOM 1705 CG2 THR A 111 -18.985 -9.467 2.960 1.00 0.00 C ATOM 0 H THR A 111 -15.690 -9.557 1.946 1.00 0.00 H new ATOM 0 HA THR A 111 -17.137 -7.960 3.908 1.00 0.00 H new ATOM 0 HB THR A 111 -17.823 -10.453 4.448 1.00 0.00 H new ATOM 0 HG1 THR A 111 -16.273 -11.209 2.767 1.00 0.00 H new ATOM 0 HG21 THR A 111 -19.677 -10.297 2.816 1.00 0.00 H new ATOM 0 HG22 THR A 111 -19.402 -8.768 3.685 1.00 0.00 H new ATOM 0 HG23 THR A 111 -18.829 -8.955 2.010 1.00 0.00 H new ATOM 1713 N ARG A 112 -14.729 -10.057 4.683 1.00 0.00 N ATOM 1714 CA ARG A 112 -13.826 -10.468 5.751 1.00 0.00 C ATOM 1715 C ARG A 112 -12.796 -9.381 6.041 1.00 0.00 C ATOM 1716 O ARG A 112 -11.714 -9.365 5.455 1.00 0.00 O ATOM 1717 CB ARG A 112 -13.117 -11.770 5.374 1.00 0.00 C ATOM 1718 CG ARG A 112 -14.067 -12.878 4.949 1.00 0.00 C ATOM 1719 CD ARG A 112 -13.330 -14.189 4.724 1.00 0.00 C ATOM 1720 NE ARG A 112 -12.946 -14.368 3.327 1.00 0.00 N ATOM 1721 CZ ARG A 112 -12.011 -15.224 2.919 1.00 0.00 C ATOM 1722 NH1 ARG A 112 -11.363 -15.978 3.797 1.00 0.00 N ATOM 1723 NH2 ARG A 112 -11.722 -15.324 1.628 1.00 0.00 N ATOM 0 H ARG A 112 -14.500 -10.440 3.766 1.00 0.00 H new ATOM 0 HA ARG A 112 -14.418 -10.632 6.651 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -12.417 -11.571 4.562 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -12.529 -12.113 6.225 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -14.832 -13.016 5.713 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -14.581 -12.587 4.033 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -12.439 -14.216 5.351 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -13.964 -15.019 5.035 1.00 0.00 H new ATOM 0 HE ARG A 112 -13.422 -13.805 2.622 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -11.580 -15.904 4.791 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -10.648 -16.632 3.478 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -12.216 -14.745 0.949 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.006 -15.979 1.315 1.00 0.00 H new ATOM 1737 N ARG A 113 -13.140 -8.474 6.950 1.00 0.00 N ATOM 1738 CA ARG A 113 -12.245 -7.383 7.317 1.00 0.00 C ATOM 1739 C ARG A 113 -11.046 -7.903 8.102 1.00 0.00 C ATOM 1740 O ARG A 113 -9.908 -7.504 7.855 1.00 0.00 O ATOM 1741 CB ARG A 113 -12.995 -6.336 8.142 1.00 0.00 C ATOM 1742 CG ARG A 113 -12.537 -4.911 7.879 1.00 0.00 C ATOM 1743 CD ARG A 113 -12.735 -4.024 9.099 1.00 0.00 C ATOM 1744 NE ARG A 113 -11.524 -3.280 9.437 1.00 0.00 N ATOM 1745 CZ ARG A 113 -11.511 -2.197 10.211 1.00 0.00 C ATOM 1746 NH1 ARG A 113 -12.640 -1.728 10.727 1.00 0.00 N ATOM 1747 NH2 ARG A 113 -10.366 -1.581 10.469 1.00 0.00 N ATOM 0 H ARG A 113 -14.032 -8.473 7.445 1.00 0.00 H new ATOM 0 HA ARG A 113 -11.882 -6.920 6.399 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -14.061 -6.412 7.927 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -12.867 -6.560 9.201 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -11.484 -4.913 7.597 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -13.092 -4.500 7.036 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -13.549 -3.325 8.910 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -13.033 -4.638 9.949 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.636 -3.610 9.058 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -13.524 -2.198 10.531 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -12.624 -0.898 11.319 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -9.495 -1.937 10.074 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.356 -0.751 11.062 1.00 0.00 H new ATOM 1761 N ASP A 114 -11.308 -8.796 9.051 1.00 0.00 N ATOM 1762 CA ASP A 114 -10.250 -9.371 9.873 1.00 0.00 C ATOM 1763 C ASP A 114 -9.260 -10.153 9.016 1.00 0.00 C ATOM 1764 O ASP A 114 -8.071 -10.221 9.329 1.00 0.00 O ATOM 1765 CB ASP A 114 -10.848 -10.283 10.947 1.00 0.00 C ATOM 1766 CG ASP A 114 -10.195 -10.087 12.301 1.00 0.00 C ATOM 1767 OD1 ASP A 114 -8.976 -9.815 12.338 1.00 0.00 O ATOM 1768 OD2 ASP A 114 -10.902 -10.202 13.324 1.00 0.00 O ATOM 0 H ASP A 114 -12.244 -9.137 9.270 1.00 0.00 H new ATOM 0 HA ASP A 114 -9.716 -8.554 10.358 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -11.917 -10.088 11.031 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -10.736 -11.323 10.640 1.00 0.00 H new ATOM 1773 N GLU A 115 -9.758 -10.742 7.934 1.00 0.00 N ATOM 1774 CA GLU A 115 -8.918 -11.520 7.030 1.00 0.00 C ATOM 1775 C GLU A 115 -8.188 -10.608 6.048 1.00 0.00 C ATOM 1776 O GLU A 115 -7.014 -10.820 5.744 1.00 0.00 O ATOM 1777 CB GLU A 115 -9.762 -12.540 6.265 1.00 0.00 C ATOM 1778 CG GLU A 115 -8.969 -13.738 5.772 1.00 0.00 C ATOM 1779 CD GLU A 115 -9.237 -14.990 6.583 1.00 0.00 C ATOM 1780 OE1 GLU A 115 -8.905 -15.000 7.787 1.00 0.00 O ATOM 1781 OE2 GLU A 115 -9.781 -15.961 6.016 1.00 0.00 O ATOM 0 H GLU A 115 -10.740 -10.695 7.661 1.00 0.00 H new ATOM 0 HA GLU A 115 -8.177 -12.050 7.628 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -10.568 -12.889 6.910 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.228 -12.047 5.412 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -9.216 -13.927 4.727 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -7.905 -13.505 5.811 1.00 0.00 H new ATOM 1788 N LEU A 116 -8.890 -9.594 5.557 1.00 0.00 N ATOM 1789 CA LEU A 116 -8.311 -8.650 4.609 1.00 0.00 C ATOM 1790 C LEU A 116 -7.221 -7.812 5.272 1.00 0.00 C ATOM 1791 O LEU A 116 -6.247 -7.421 4.628 1.00 0.00 O ATOM 1792 CB LEU A 116 -9.396 -7.735 4.038 1.00 0.00 C ATOM 1793 CG LEU A 116 -8.904 -6.699 3.026 1.00 0.00 C ATOM 1794 CD1 LEU A 116 -8.506 -7.374 1.723 1.00 0.00 C ATOM 1795 CD2 LEU A 116 -9.976 -5.648 2.778 1.00 0.00 C ATOM 0 H LEU A 116 -9.862 -9.404 5.800 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.863 -9.221 3.796 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -10.157 -8.353 3.561 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -9.880 -7.213 4.863 1.00 0.00 H new ATOM 0 HG LEU A 116 -8.025 -6.204 3.438 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -8.159 -6.622 1.015 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.706 -8.090 1.913 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -9.367 -7.895 1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -9.610 -4.918 2.056 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -10.873 -6.128 2.386 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -10.214 -5.143 3.714 1.00 0.00 H new ATOM 1807 N PHE A 117 -7.392 -7.542 6.561 1.00 0.00 N ATOM 1808 CA PHE A 117 -6.423 -6.751 7.311 1.00 0.00 C ATOM 1809 C PHE A 117 -5.131 -7.532 7.523 1.00 0.00 C ATOM 1810 O PHE A 117 -4.035 -6.996 7.355 1.00 0.00 O ATOM 1811 CB PHE A 117 -7.009 -6.336 8.662 1.00 0.00 C ATOM 1812 CG PHE A 117 -6.149 -5.361 9.415 1.00 0.00 C ATOM 1813 CD1 PHE A 117 -5.700 -4.200 8.806 1.00 0.00 C ATOM 1814 CD2 PHE A 117 -5.790 -5.606 10.730 1.00 0.00 C ATOM 1815 CE1 PHE A 117 -4.909 -3.301 9.496 1.00 0.00 C ATOM 1816 CE2 PHE A 117 -4.998 -4.711 11.425 1.00 0.00 C ATOM 1817 CZ PHE A 117 -4.558 -3.557 10.807 1.00 0.00 C ATOM 0 H PHE A 117 -8.192 -7.859 7.109 1.00 0.00 H new ATOM 0 HA PHE A 117 -6.195 -5.857 6.731 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -7.992 -5.893 8.502 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -7.156 -7.226 9.274 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -5.971 -3.995 7.781 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -6.133 -6.506 11.218 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -4.566 -2.399 9.011 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -4.724 -4.914 12.450 1.00 0.00 H new ATOM 0 HZ PHE A 117 -3.940 -2.856 11.348 1.00 0.00 H new ATOM 1827 N ALA A 118 -5.266 -8.802 7.892 1.00 0.00 N ATOM 1828 CA ALA A 118 -4.108 -9.657 8.126 1.00 0.00 C ATOM 1829 C ALA A 118 -3.254 -9.780 6.869 1.00 0.00 C ATOM 1830 O ALA A 118 -2.032 -9.914 6.947 1.00 0.00 O ATOM 1831 CB ALA A 118 -4.556 -11.031 8.599 1.00 0.00 C ATOM 0 H ALA A 118 -6.165 -9.261 8.035 1.00 0.00 H new ATOM 0 HA ALA A 118 -3.498 -9.198 8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -3.682 -11.660 8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -5.118 -10.931 9.527 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -5.189 -11.489 7.839 1.00 0.00 H new ATOM 1837 N LEU A 119 -3.904 -9.736 5.711 1.00 0.00 N ATOM 1838 CA LEU A 119 -3.204 -9.843 4.437 1.00 0.00 C ATOM 1839 C LEU A 119 -2.503 -8.533 4.090 1.00 0.00 C ATOM 1840 O LEU A 119 -1.312 -8.518 3.780 1.00 0.00 O ATOM 1841 CB LEU A 119 -4.181 -10.223 3.323 1.00 0.00 C ATOM 1842 CG LEU A 119 -4.880 -11.571 3.506 1.00 0.00 C ATOM 1843 CD1 LEU A 119 -5.999 -11.734 2.489 1.00 0.00 C ATOM 1844 CD2 LEU A 119 -3.879 -12.710 3.387 1.00 0.00 C ATOM 0 H LEU A 119 -4.915 -9.627 5.629 1.00 0.00 H new ATOM 0 HA LEU A 119 -2.450 -10.625 4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -4.940 -9.445 3.246 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.641 -10.237 2.376 1.00 0.00 H new ATOM 0 HG LEU A 119 -5.317 -11.600 4.504 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -6.485 -12.699 2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.730 -10.936 2.621 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -5.585 -11.684 1.482 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -4.393 -13.662 3.520 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -3.413 -12.684 2.402 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.112 -12.602 4.154 1.00 0.00 H new ATOM 1856 N ALA A 120 -3.252 -7.436 4.143 1.00 0.00 N ATOM 1857 CA ALA A 120 -2.702 -6.121 3.833 1.00 0.00 C ATOM 1858 C ALA A 120 -1.546 -5.777 4.766 1.00 0.00 C ATOM 1859 O ALA A 120 -0.575 -5.138 4.357 1.00 0.00 O ATOM 1860 CB ALA A 120 -3.790 -5.061 3.925 1.00 0.00 C ATOM 0 H ALA A 120 -4.240 -7.431 4.397 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.317 -6.145 2.813 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.367 -4.084 3.691 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -4.584 -5.292 3.215 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -4.200 -5.047 4.935 1.00 0.00 H new ATOM 1866 N ARG A 121 -1.656 -6.203 6.020 1.00 0.00 N ATOM 1867 CA ARG A 121 -0.619 -5.940 7.010 1.00 0.00 C ATOM 1868 C ARG A 121 0.612 -6.803 6.751 1.00 0.00 C ATOM 1869 O ARG A 121 1.739 -6.397 7.036 1.00 0.00 O ATOM 1870 CB ARG A 121 -1.152 -6.201 8.420 1.00 0.00 C ATOM 1871 CG ARG A 121 -0.657 -5.202 9.453 1.00 0.00 C ATOM 1872 CD ARG A 121 -1.238 -5.489 10.829 1.00 0.00 C ATOM 1873 NE ARG A 121 -0.875 -4.461 11.801 1.00 0.00 N ATOM 1874 CZ ARG A 121 0.348 -4.319 12.307 1.00 0.00 C ATOM 1875 NH1 ARG A 121 1.327 -5.134 11.935 1.00 0.00 N ATOM 1876 NH2 ARG A 121 0.594 -3.358 13.187 1.00 0.00 N ATOM 0 H ARG A 121 -2.453 -6.732 6.374 1.00 0.00 H new ATOM 0 HA ARG A 121 -0.330 -4.892 6.927 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -2.242 -6.178 8.397 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.861 -7.205 8.729 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.431 -5.237 9.502 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -0.930 -4.193 9.145 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -2.324 -5.554 10.758 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -0.883 -6.459 11.177 1.00 0.00 H new ATOM 0 HE ARG A 121 -1.601 -3.814 12.110 1.00 0.00 H new ATOM 0 HH11 ARG A 121 1.145 -5.874 11.258 1.00 0.00 H new ATOM 0 HH12 ARG A 121 2.262 -5.020 12.326 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -0.154 -2.728 13.476 1.00 0.00 H new ATOM 0 HH22 ARG A 121 1.531 -3.249 13.575 1.00 0.00 H new ATOM 1890 N GLN A 122 0.389 -7.996 6.209 1.00 0.00 N ATOM 1891 CA GLN A 122 1.480 -8.917 5.911 1.00 0.00 C ATOM 1892 C GLN A 122 2.461 -8.297 4.921 1.00 0.00 C ATOM 1893 O GLN A 122 3.675 -8.437 5.065 1.00 0.00 O ATOM 1894 CB GLN A 122 0.929 -10.228 5.347 1.00 0.00 C ATOM 1895 CG GLN A 122 1.730 -11.452 5.759 1.00 0.00 C ATOM 1896 CD GLN A 122 2.046 -12.365 4.589 1.00 0.00 C ATOM 1897 OE1 GLN A 122 3.072 -12.210 3.927 1.00 0.00 O ATOM 1898 NE2 GLN A 122 1.163 -13.322 4.330 1.00 0.00 N ATOM 0 H GLN A 122 -0.537 -8.348 5.967 1.00 0.00 H new ATOM 0 HA GLN A 122 2.011 -9.124 6.840 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -0.102 -10.351 5.678 1.00 0.00 H new ATOM 0 HB3 GLN A 122 0.910 -10.166 4.259 1.00 0.00 H new ATOM 0 HG2 GLN A 122 2.661 -11.132 6.227 1.00 0.00 H new ATOM 0 HG3 GLN A 122 1.172 -12.011 6.510 1.00 0.00 H new ATOM 0 HE21 GLN A 122 0.326 -13.413 4.906 1.00 0.00 H new ATOM 0 HE22 GLN A 122 1.322 -13.966 3.555 1.00 0.00 H new ATOM 1907 N ILE A 123 1.925 -7.611 3.916 1.00 0.00 N ATOM 1908 CA ILE A 123 2.753 -6.969 2.903 1.00 0.00 C ATOM 1909 C ILE A 123 3.378 -5.686 3.438 1.00 0.00 C ATOM 1910 O ILE A 123 4.504 -5.338 3.084 1.00 0.00 O ATOM 1911 CB ILE A 123 1.939 -6.641 1.637 1.00 0.00 C ATOM 1912 CG1 ILE A 123 1.145 -7.867 1.183 1.00 0.00 C ATOM 1913 CG2 ILE A 123 2.860 -6.158 0.525 1.00 0.00 C ATOM 1914 CD1 ILE A 123 0.022 -7.537 0.221 1.00 0.00 C ATOM 0 H ILE A 123 0.922 -7.486 3.782 1.00 0.00 H new ATOM 0 HA ILE A 123 3.542 -7.675 2.645 1.00 0.00 H new ATOM 0 HB ILE A 123 1.235 -5.842 1.872 1.00 0.00 H new ATOM 0 HG12 ILE A 123 1.824 -8.574 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 123 0.728 -8.365 2.059 1.00 0.00 H new ATOM 0 HG21 ILE A 123 2.270 -5.930 -0.363 1.00 0.00 H new ATOM 0 HG22 ILE A 123 3.385 -5.261 0.852 1.00 0.00 H new ATOM 0 HG23 ILE A 123 3.585 -6.937 0.289 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.498 -8.453 -0.059 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -0.679 -6.854 0.701 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.434 -7.066 -0.672 1.00 0.00 H new ATOM 1926 N SER A 124 2.639 -4.986 4.292 1.00 0.00 N ATOM 1927 CA SER A 124 3.121 -3.740 4.877 1.00 0.00 C ATOM 1928 C SER A 124 4.402 -3.970 5.671 1.00 0.00 C ATOM 1929 O SER A 124 5.398 -3.273 5.477 1.00 0.00 O ATOM 1930 CB SER A 124 2.048 -3.130 5.781 1.00 0.00 C ATOM 1931 OG SER A 124 2.351 -1.780 6.092 1.00 0.00 O ATOM 0 H SER A 124 1.704 -5.260 4.594 1.00 0.00 H new ATOM 0 HA SER A 124 3.340 -3.047 4.065 1.00 0.00 H new ATOM 0 HB2 SER A 124 1.078 -3.184 5.287 1.00 0.00 H new ATOM 0 HB3 SER A 124 1.970 -3.710 6.701 1.00 0.00 H new ATOM 0 HG SER A 124 2.949 -1.749 6.868 1.00 0.00 H new ATOM 1937 N ARG A 125 4.369 -4.953 6.565 1.00 0.00 N ATOM 1938 CA ARG A 125 5.528 -5.275 7.388 1.00 0.00 C ATOM 1939 C ARG A 125 6.696 -5.743 6.525 1.00 0.00 C ATOM 1940 O ARG A 125 7.859 -5.530 6.867 1.00 0.00 O ATOM 1941 CB ARG A 125 5.170 -6.356 8.410 1.00 0.00 C ATOM 1942 CG ARG A 125 4.291 -5.852 9.545 1.00 0.00 C ATOM 1943 CD ARG A 125 4.775 -6.353 10.898 1.00 0.00 C ATOM 1944 NE ARG A 125 3.746 -7.117 11.599 1.00 0.00 N ATOM 1945 CZ ARG A 125 3.767 -7.361 12.908 1.00 0.00 C ATOM 1946 NH1 ARG A 125 4.759 -6.902 13.660 1.00 0.00 N ATOM 1947 NH2 ARG A 125 2.792 -8.066 13.466 1.00 0.00 N ATOM 0 H ARG A 125 3.553 -5.540 6.738 1.00 0.00 H new ATOM 0 HA ARG A 125 5.829 -4.370 7.916 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.658 -7.172 7.900 1.00 0.00 H new ATOM 0 HB3 ARG A 125 6.089 -6.768 8.828 1.00 0.00 H new ATOM 0 HG2 ARG A 125 4.283 -4.762 9.542 1.00 0.00 H new ATOM 0 HG3 ARG A 125 3.264 -6.179 9.382 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.658 -6.977 10.759 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.078 -5.505 11.512 1.00 0.00 H new ATOM 0 HE ARG A 125 2.966 -7.485 11.054 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.511 -6.359 13.236 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.769 -7.092 14.662 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.027 -8.421 12.893 1.00 0.00 H new ATOM 0 HH22 ARG A 125 2.807 -8.253 14.469 1.00 0.00 H new ATOM 1961 N GLU A 126 6.377 -6.383 5.404 1.00 0.00 N ATOM 1962 CA GLU A 126 7.401 -6.880 4.492 1.00 0.00 C ATOM 1963 C GLU A 126 8.143 -5.728 3.824 1.00 0.00 C ATOM 1964 O GLU A 126 9.369 -5.746 3.716 1.00 0.00 O ATOM 1965 CB GLU A 126 6.770 -7.781 3.427 1.00 0.00 C ATOM 1966 CG GLU A 126 6.567 -9.215 3.887 1.00 0.00 C ATOM 1967 CD GLU A 126 6.373 -10.176 2.730 1.00 0.00 C ATOM 1968 OE1 GLU A 126 7.173 -10.120 1.772 1.00 0.00 O ATOM 1969 OE2 GLU A 126 5.422 -10.983 2.781 1.00 0.00 O ATOM 0 H GLU A 126 5.419 -6.569 5.106 1.00 0.00 H new ATOM 0 HA GLU A 126 8.118 -7.460 5.073 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.807 -7.363 3.133 1.00 0.00 H new ATOM 0 HB3 GLU A 126 7.403 -7.779 2.540 1.00 0.00 H new ATOM 0 HG2 GLU A 126 7.429 -9.530 4.475 1.00 0.00 H new ATOM 0 HG3 GLU A 126 5.698 -9.263 4.544 1.00 0.00 H new ATOM 1976 N VAL A 127 7.392 -4.726 3.379 1.00 0.00 N ATOM 1977 CA VAL A 127 7.981 -3.565 2.722 1.00 0.00 C ATOM 1978 C VAL A 127 8.828 -2.753 3.696 1.00 0.00 C ATOM 1979 O VAL A 127 9.838 -2.163 3.314 1.00 0.00 O ATOM 1980 CB VAL A 127 6.899 -2.652 2.116 1.00 0.00 C ATOM 1981 CG1 VAL A 127 7.533 -1.560 1.268 1.00 0.00 C ATOM 1982 CG2 VAL A 127 5.906 -3.467 1.298 1.00 0.00 C ATOM 0 H VAL A 127 6.376 -4.695 3.461 1.00 0.00 H new ATOM 0 HA VAL A 127 8.616 -3.944 1.921 1.00 0.00 H new ATOM 0 HB VAL A 127 6.355 -2.175 2.931 1.00 0.00 H new ATOM 0 HG11 VAL A 127 6.752 -0.926 0.849 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.197 -0.957 1.888 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.105 -2.014 0.459 1.00 0.00 H new ATOM 0 HG21 VAL A 127 5.150 -2.804 0.878 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.431 -3.976 0.490 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.425 -4.205 1.940 1.00 0.00 H new ATOM 1992 N THR A 128 8.408 -2.729 4.957 1.00 0.00 N ATOM 1993 CA THR A 128 9.128 -1.989 5.987 1.00 0.00 C ATOM 1994 C THR A 128 10.498 -2.609 6.246 1.00 0.00 C ATOM 1995 O THR A 128 11.453 -1.910 6.582 1.00 0.00 O ATOM 1996 CB THR A 128 8.317 -1.958 7.284 1.00 0.00 C ATOM 1997 OG1 THR A 128 6.928 -1.948 7.006 1.00 0.00 O ATOM 1998 CG2 THR A 128 8.620 -0.755 8.151 1.00 0.00 C ATOM 0 H THR A 128 7.574 -3.213 5.290 1.00 0.00 H new ATOM 0 HA THR A 128 9.272 -0.969 5.632 1.00 0.00 H new ATOM 0 HB THR A 128 8.605 -2.858 7.827 1.00 0.00 H new ATOM 0 HG1 THR A 128 6.654 -2.829 6.676 1.00 0.00 H new ATOM 0 HG21 THR A 128 8.011 -0.795 9.054 1.00 0.00 H new ATOM 0 HG22 THR A 128 9.675 -0.760 8.424 1.00 0.00 H new ATOM 0 HG23 THR A 128 8.392 0.157 7.600 1.00 0.00 H new ATOM 2006 N TYR A 129 10.586 -3.926 6.086 1.00 0.00 N ATOM 2007 CA TYR A 129 11.838 -4.640 6.302 1.00 0.00 C ATOM 2008 C TYR A 129 12.916 -4.148 5.341 1.00 0.00 C ATOM 2009 O TYR A 129 14.001 -3.747 5.763 1.00 0.00 O ATOM 2010 CB TYR A 129 11.629 -6.145 6.125 1.00 0.00 C ATOM 2011 CG TYR A 129 12.861 -6.967 6.425 1.00 0.00 C ATOM 2012 CD1 TYR A 129 13.593 -6.758 7.588 1.00 0.00 C ATOM 2013 CD2 TYR A 129 13.293 -7.953 5.546 1.00 0.00 C ATOM 2014 CE1 TYR A 129 14.720 -7.508 7.865 1.00 0.00 C ATOM 2015 CE2 TYR A 129 14.419 -8.708 5.818 1.00 0.00 C ATOM 2016 CZ TYR A 129 15.129 -8.481 6.978 1.00 0.00 C ATOM 2017 OH TYR A 129 16.250 -9.230 7.252 1.00 0.00 O ATOM 0 H TYR A 129 9.805 -4.520 5.807 1.00 0.00 H new ATOM 0 HA TYR A 129 12.168 -4.444 7.322 1.00 0.00 H new ATOM 0 HB2 TYR A 129 10.818 -6.470 6.777 1.00 0.00 H new ATOM 0 HB3 TYR A 129 11.312 -6.341 5.101 1.00 0.00 H new ATOM 0 HD1 TYR A 129 13.276 -5.997 8.286 1.00 0.00 H new ATOM 0 HD2 TYR A 129 12.740 -8.132 4.636 1.00 0.00 H new ATOM 0 HE1 TYR A 129 15.278 -7.333 8.773 1.00 0.00 H new ATOM 0 HE2 TYR A 129 14.741 -9.472 5.125 1.00 0.00 H new ATOM 0 HH TYR A 129 16.400 -9.872 6.527 1.00 0.00 H new ATOM 2027 N LYS A 130 12.610 -4.182 4.049 1.00 0.00 N ATOM 2028 CA LYS A 130 13.552 -3.739 3.028 1.00 0.00 C ATOM 2029 C LYS A 130 13.205 -2.336 2.541 1.00 0.00 C ATOM 2030 O LYS A 130 12.071 -2.069 2.142 1.00 0.00 O ATOM 2031 CB LYS A 130 13.556 -4.720 1.851 1.00 0.00 C ATOM 2032 CG LYS A 130 14.829 -5.544 1.752 1.00 0.00 C ATOM 2033 CD LYS A 130 14.780 -6.506 0.576 1.00 0.00 C ATOM 2034 CE LYS A 130 14.419 -7.914 1.022 1.00 0.00 C ATOM 2035 NZ LYS A 130 13.182 -7.933 1.852 1.00 0.00 N ATOM 0 H LYS A 130 11.717 -4.512 3.684 1.00 0.00 H new ATOM 0 HA LYS A 130 14.548 -3.711 3.471 1.00 0.00 H new ATOM 0 HB2 LYS A 130 12.704 -5.393 1.946 1.00 0.00 H new ATOM 0 HB3 LYS A 130 13.420 -4.163 0.924 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.686 -4.880 1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 130 14.974 -6.104 2.676 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.049 -6.155 -0.152 1.00 0.00 H new ATOM 0 HD3 LYS A 130 15.748 -6.519 0.075 1.00 0.00 H new ATOM 0 HE2 LYS A 130 14.278 -8.548 0.146 1.00 0.00 H new ATOM 0 HE3 LYS A 130 15.246 -8.337 1.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 12.874 -8.916 1.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 13.376 -7.494 2.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 12.431 -7.402 1.367 1.00 0.00 H new ATOM 2049 N TYR A 131 14.189 -1.444 2.575 1.00 0.00 N ATOM 2050 CA TYR A 131 13.988 -0.068 2.137 1.00 0.00 C ATOM 2051 C TYR A 131 15.292 0.535 1.622 1.00 0.00 C ATOM 2052 O TYR A 131 15.596 1.699 1.885 1.00 0.00 O ATOM 2053 CB TYR A 131 13.436 0.779 3.287 1.00 0.00 C ATOM 2054 CG TYR A 131 12.228 1.606 2.905 1.00 0.00 C ATOM 2055 CD1 TYR A 131 10.989 1.011 2.704 1.00 0.00 C ATOM 2056 CD2 TYR A 131 12.328 2.983 2.747 1.00 0.00 C ATOM 2057 CE1 TYR A 131 9.884 1.763 2.355 1.00 0.00 C ATOM 2058 CE2 TYR A 131 11.227 3.742 2.398 1.00 0.00 C ATOM 2059 CZ TYR A 131 10.008 3.128 2.204 1.00 0.00 C ATOM 2060 OH TYR A 131 8.910 3.881 1.857 1.00 0.00 O ATOM 0 H TYR A 131 15.133 -1.649 2.901 1.00 0.00 H new ATOM 0 HA TYR A 131 13.266 -0.073 1.321 1.00 0.00 H new ATOM 0 HB2 TYR A 131 13.169 0.122 4.115 1.00 0.00 H new ATOM 0 HB3 TYR A 131 14.221 1.443 3.647 1.00 0.00 H new ATOM 0 HD1 TYR A 131 10.888 -0.058 2.823 1.00 0.00 H new ATOM 0 HD2 TYR A 131 13.281 3.468 2.899 1.00 0.00 H new ATOM 0 HE1 TYR A 131 8.928 1.284 2.201 1.00 0.00 H new ATOM 0 HE2 TYR A 131 11.321 4.811 2.278 1.00 0.00 H new ATOM 0 HH TYR A 131 9.129 4.833 1.932 1.00 0.00 H new ATOM 2070 N THR A 132 16.058 -0.263 0.887 1.00 0.00 N ATOM 2071 CA THR A 132 17.329 0.192 0.336 1.00 0.00 C ATOM 2072 C THR A 132 17.461 -0.207 -1.130 1.00 0.00 C ATOM 2073 O THR A 132 16.889 -1.206 -1.566 1.00 0.00 O ATOM 2074 CB THR A 132 18.494 -0.387 1.140 1.00 0.00 C ATOM 2075 OG1 THR A 132 19.729 -0.105 0.507 1.00 0.00 O ATOM 2076 CG2 THR A 132 18.406 -1.886 1.327 1.00 0.00 C ATOM 0 H THR A 132 15.821 -1.228 0.659 1.00 0.00 H new ATOM 0 HA THR A 132 17.356 1.280 0.402 1.00 0.00 H new ATOM 0 HB THR A 132 18.434 0.089 2.119 1.00 0.00 H new ATOM 0 HG1 THR A 132 20.462 -0.482 1.037 1.00 0.00 H new ATOM 0 HG21 THR A 132 19.263 -2.231 1.905 1.00 0.00 H new ATOM 0 HG22 THR A 132 17.487 -2.133 1.858 1.00 0.00 H new ATOM 0 HG23 THR A 132 18.405 -2.375 0.353 1.00 0.00 H new ATOM 2084 N TYR A 133 18.218 0.582 -1.886 1.00 0.00 N ATOM 2085 CA TYR A 133 18.426 0.312 -3.304 1.00 0.00 C ATOM 2086 C TYR A 133 19.909 0.136 -3.613 1.00 0.00 C ATOM 2087 O TYR A 133 20.751 0.187 -2.716 1.00 0.00 O ATOM 2088 CB TYR A 133 17.851 1.450 -4.151 1.00 0.00 C ATOM 2089 CG TYR A 133 16.355 1.356 -4.355 1.00 0.00 C ATOM 2090 CD1 TYR A 133 15.484 1.383 -3.273 1.00 0.00 C ATOM 2091 CD2 TYR A 133 15.815 1.241 -5.630 1.00 0.00 C ATOM 2092 CE1 TYR A 133 14.117 1.297 -3.456 1.00 0.00 C ATOM 2093 CE2 TYR A 133 14.449 1.156 -5.820 1.00 0.00 C ATOM 2094 CZ TYR A 133 13.605 1.184 -4.731 1.00 0.00 C ATOM 2095 OH TYR A 133 12.244 1.099 -4.916 1.00 0.00 O ATOM 0 H TYR A 133 18.697 1.413 -1.540 1.00 0.00 H new ATOM 0 HA TYR A 133 17.908 -0.615 -3.551 1.00 0.00 H new ATOM 0 HB2 TYR A 133 18.085 2.401 -3.673 1.00 0.00 H new ATOM 0 HB3 TYR A 133 18.343 1.452 -5.124 1.00 0.00 H new ATOM 0 HD1 TYR A 133 15.882 1.473 -2.273 1.00 0.00 H new ATOM 0 HD2 TYR A 133 16.473 1.218 -6.486 1.00 0.00 H new ATOM 0 HE1 TYR A 133 13.453 1.318 -2.604 1.00 0.00 H new ATOM 0 HE2 TYR A 133 14.045 1.068 -6.818 1.00 0.00 H new ATOM 0 HH TYR A 133 12.048 1.025 -5.873 1.00 0.00 H new ATOM 2105 N ARG A 134 20.223 -0.073 -4.888 1.00 0.00 N ATOM 2106 CA ARG A 134 21.605 -0.257 -5.315 1.00 0.00 C ATOM 2107 C ARG A 134 22.227 1.074 -5.726 1.00 0.00 C ATOM 2108 O ARG A 134 22.826 1.188 -6.796 1.00 0.00 O ATOM 2109 CB ARG A 134 21.672 -1.250 -6.478 1.00 0.00 C ATOM 2110 CG ARG A 134 20.968 -0.762 -7.734 1.00 0.00 C ATOM 2111 CD ARG A 134 21.730 -1.157 -8.990 1.00 0.00 C ATOM 2112 NE ARG A 134 22.854 -0.260 -9.252 1.00 0.00 N ATOM 2113 CZ ARG A 134 22.721 0.970 -9.741 1.00 0.00 C ATOM 2114 NH1 ARG A 134 21.517 1.455 -10.021 1.00 0.00 N ATOM 2115 NH2 ARG A 134 23.794 1.720 -9.951 1.00 0.00 N ATOM 0 H ARG A 134 19.539 -0.119 -5.643 1.00 0.00 H new ATOM 0 HA ARG A 134 22.172 -0.657 -4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 134 22.717 -1.453 -6.712 1.00 0.00 H new ATOM 0 HB3 ARG A 134 21.227 -2.194 -6.165 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.961 -1.177 -7.772 1.00 0.00 H new ATOM 0 HG3 ARG A 134 20.864 0.322 -7.696 1.00 0.00 H new ATOM 0 HD2 ARG A 134 22.097 -2.178 -8.885 1.00 0.00 H new ATOM 0 HD3 ARG A 134 21.052 -1.148 -9.843 1.00 0.00 H new ATOM 0 HE ARG A 134 23.795 -0.597 -9.048 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.687 0.884 -9.861 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.422 2.399 -10.396 1.00 0.00 H new ATOM 0 HH21 ARG A 134 24.722 1.354 -9.738 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.692 2.663 -10.326 1.00 0.00 H new ATOM 2129 N THR A 135 22.083 2.078 -4.868 1.00 0.00 N ATOM 2130 CA THR A 135 22.630 3.402 -5.142 1.00 0.00 C ATOM 2131 C THR A 135 22.819 4.190 -3.850 1.00 0.00 C ATOM 2132 O THR A 135 22.252 3.847 -2.813 1.00 0.00 O ATOM 2133 CB THR A 135 21.708 4.170 -6.092 1.00 0.00 C ATOM 2134 OG1 THR A 135 22.231 5.458 -6.366 1.00 0.00 O ATOM 2135 CG2 THR A 135 20.306 4.347 -5.551 1.00 0.00 C ATOM 0 H THR A 135 21.592 2.000 -3.977 1.00 0.00 H new ATOM 0 HA THR A 135 23.604 3.276 -5.615 1.00 0.00 H new ATOM 0 HB THR A 135 21.656 3.565 -6.997 1.00 0.00 H new ATOM 0 HG1 THR A 135 21.629 5.933 -6.976 1.00 0.00 H new ATOM 0 HG21 THR A 135 19.704 4.899 -6.273 1.00 0.00 H new ATOM 0 HG22 THR A 135 19.857 3.369 -5.377 1.00 0.00 H new ATOM 0 HG23 THR A 135 20.345 4.900 -4.613 1.00 0.00 H new ATOM 2143 N THR A 136 23.620 5.248 -3.920 1.00 0.00 N ATOM 2144 CA THR A 136 23.885 6.087 -2.756 1.00 0.00 C ATOM 2145 C THR A 136 22.589 6.664 -2.194 1.00 0.00 C ATOM 2146 O THR A 136 21.628 6.890 -2.929 1.00 0.00 O ATOM 2147 CB THR A 136 24.842 7.220 -3.127 1.00 0.00 C ATOM 2148 OG1 THR A 136 25.158 8.002 -1.988 1.00 0.00 O ATOM 2149 CG2 THR A 136 24.288 8.152 -4.183 1.00 0.00 C ATOM 0 H THR A 136 24.097 5.545 -4.771 1.00 0.00 H new ATOM 0 HA THR A 136 24.347 5.466 -1.989 1.00 0.00 H new ATOM 0 HB THR A 136 25.728 6.729 -3.529 1.00 0.00 H new ATOM 0 HG1 THR A 136 25.773 8.721 -2.245 1.00 0.00 H new ATOM 0 HG21 THR A 136 25.018 8.932 -4.399 1.00 0.00 H new ATOM 0 HG22 THR A 136 24.080 7.589 -5.092 1.00 0.00 H new ATOM 0 HG23 THR A 136 23.367 8.607 -3.819 1.00 0.00 H new ATOM 2157 N SER A 137 22.571 6.900 -0.886 1.00 0.00 N ATOM 2158 CA SER A 137 21.394 7.450 -0.224 1.00 0.00 C ATOM 2159 C SER A 137 21.234 8.933 -0.544 1.00 0.00 C ATOM 2160 O SER A 137 21.953 9.775 -0.007 1.00 0.00 O ATOM 2161 CB SER A 137 21.493 7.250 1.288 1.00 0.00 C ATOM 2162 OG SER A 137 20.978 5.986 1.671 1.00 0.00 O ATOM 0 H SER A 137 23.359 6.719 -0.264 1.00 0.00 H new ATOM 0 HA SER A 137 20.517 6.920 -0.596 1.00 0.00 H new ATOM 0 HB2 SER A 137 22.534 7.332 1.601 1.00 0.00 H new ATOM 0 HB3 SER A 137 20.943 8.040 1.799 1.00 0.00 H new ATOM 0 HG SER A 137 21.055 5.882 2.642 1.00 0.00 H new ATOM 2168 N GLY A 138 20.285 9.245 -1.422 1.00 0.00 N ATOM 2169 CA GLY A 138 20.048 10.626 -1.796 1.00 0.00 C ATOM 2170 C GLY A 138 18.965 10.765 -2.850 1.00 0.00 C ATOM 2171 O GLY A 138 19.227 11.246 -3.952 1.00 0.00 O ATOM 0 H GLY A 138 19.677 8.566 -1.880 1.00 0.00 H new ATOM 0 HA2 GLY A 138 19.764 11.195 -0.911 1.00 0.00 H new ATOM 0 HA3 GLY A 138 20.974 11.061 -2.172 1.00 0.00 H new ATOM 2175 N PRO A 139 17.725 10.349 -2.537 1.00 0.00 N ATOM 2176 CA PRO A 139 16.603 10.435 -3.478 1.00 0.00 C ATOM 2177 C PRO A 139 16.419 11.844 -4.031 1.00 0.00 C ATOM 2178 O PRO A 139 17.040 12.794 -3.556 1.00 0.00 O ATOM 2179 CB PRO A 139 15.393 10.032 -2.629 1.00 0.00 C ATOM 2180 CG PRO A 139 15.958 9.199 -1.532 1.00 0.00 C ATOM 2181 CD PRO A 139 17.322 9.763 -1.246 1.00 0.00 C ATOM 0 HA PRO A 139 16.756 9.803 -4.353 1.00 0.00 H new ATOM 0 HB2 PRO A 139 14.877 10.908 -2.235 1.00 0.00 H new ATOM 0 HB3 PRO A 139 14.666 9.472 -3.217 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.325 9.239 -0.645 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.023 8.153 -1.830 1.00 0.00 H new ATOM 0 HD2 PRO A 139 17.289 10.514 -0.456 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.017 8.989 -0.921 1.00 0.00 H new ATOM 2189 N SER A 140 15.561 11.972 -5.038 1.00 0.00 N ATOM 2190 CA SER A 140 15.295 13.265 -5.657 1.00 0.00 C ATOM 2191 C SER A 140 14.211 13.147 -6.723 1.00 0.00 C ATOM 2192 O SER A 140 13.190 13.831 -6.661 1.00 0.00 O ATOM 2193 CB SER A 140 16.575 13.830 -6.276 1.00 0.00 C ATOM 2194 OG SER A 140 16.402 15.184 -6.658 1.00 0.00 O ATOM 0 H SER A 140 15.038 11.195 -5.443 1.00 0.00 H new ATOM 0 HA SER A 140 14.943 13.945 -4.881 1.00 0.00 H new ATOM 0 HB2 SER A 140 17.394 13.752 -5.561 1.00 0.00 H new ATOM 0 HB3 SER A 140 16.855 13.236 -7.146 1.00 0.00 H new ATOM 0 HG SER A 140 17.234 15.522 -7.049 1.00 0.00 H new ATOM 2200 N SER A 141 14.440 12.273 -7.698 1.00 0.00 N ATOM 2201 CA SER A 141 13.481 12.065 -8.777 1.00 0.00 C ATOM 2202 C SER A 141 13.257 13.354 -9.561 1.00 0.00 C ATOM 2203 O SER A 141 12.599 14.277 -9.081 1.00 0.00 O ATOM 2204 CB SER A 141 12.153 11.556 -8.217 1.00 0.00 C ATOM 2205 OG SER A 141 12.303 10.275 -7.629 1.00 0.00 O ATOM 0 H SER A 141 15.280 11.698 -7.763 1.00 0.00 H new ATOM 0 HA SER A 141 13.891 11.316 -9.455 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.775 12.258 -7.474 1.00 0.00 H new ATOM 0 HB3 SER A 141 11.413 11.508 -9.016 1.00 0.00 H new ATOM 0 HG SER A 141 11.439 9.973 -7.277 1.00 0.00 H new ATOM 2211 N GLY A 142 13.806 13.410 -10.770 1.00 0.00 N ATOM 2212 CA GLY A 142 13.652 14.589 -11.601 1.00 0.00 C ATOM 2213 C GLY A 142 14.909 14.914 -12.383 1.00 0.00 C ATOM 2214 O GLY A 142 14.947 15.984 -13.027 1.00 0.00 O ATOM 2215 OXT GLY A 142 15.856 14.101 -12.353 1.00 0.00 O ATOM 0 H GLY A 142 14.355 12.659 -11.189 1.00 0.00 H new ATOM 0 HA2 GLY A 142 12.825 14.435 -12.295 1.00 0.00 H new ATOM 0 HA3 GLY A 142 13.388 15.440 -10.974 1.00 0.00 H new TER 2219 GLY A 142