USER MOD reduce.3.24.130724 H: found=0, std=0, add=1359, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1359 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 1 GLY N :NH3+ -119:sc= 1.09 (180deg=0) USER MOD Set 1.2: A 169 GLN : amide:sc= 0.465 K(o=1.6,f=-6.6!) USER MOD Set 2.1: A 62 TYR OH : rot 154:sc= 1.18 USER MOD Set 2.2: A 70 GLN : amide:sc= -0.117 K(o=1.1,f=-1.2!) USER MOD Set 3.1: A 47 CYS SG : rot -156:sc= 1.11 USER MOD Set 3.2: A 51 CYS SG : rot 89:sc= 1.42 USER MOD Set 4.1: A 3 MET CE :methyl 174:sc=-0.00343 (180deg=-0.0703) USER MOD Set 4.2: A 5 THR OG1 : rot 44:sc= 0.661 USER MOD Single : A 4 HIS : no HD1:sc= -0.196 X(o=-0.2,f=-0.24) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 69:sc= 0.828 USER MOD Single : A 13 ASN : amide:sc= -0.047 K(o=-0.047,f=-0.87) USER MOD Single : A 15 LYS NZ :NH3+ 179:sc= 1.28 (180deg=1.21) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 31 SER OG : rot -133:sc= 1.78 USER MOD Single : A 32 GLN : amide:sc= 0.38 K(o=0.38,f=-6.6!) USER MOD Single : A 34 GLN : amide:sc= 0.802 K(o=0.8,f=0) USER MOD Single : A 36 LYS NZ :NH3+ -155:sc= 1.6 (180deg=0.216!) USER MOD Single : A 45 THR OG1 : rot 96:sc= 1.23 USER MOD Single : A 53 THR OG1 : rot 99:sc= 1.22 USER MOD Single : A 54 THR OG1 : rot 28:sc= 1.19 USER MOD Single : A 59 LYS NZ :NH3+ -160:sc= 1.17 (180deg=0.207) USER MOD Single : A 64 LYS NZ :NH3+ 134:sc= 1.18 (180deg=-0.732!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc=-0.00898 K(o=-0.009,f=-2) USER MOD Single : A 79 SER OG : rot 84:sc= 1.12 USER MOD Single : A 93 TYR OH : rot 180:sc= -0.0779 USER MOD Single : A 95 LYS NZ :NH3+ -128:sc= 1.33 (180deg=-0.266) USER MOD Single : A 98 HIS : no HE2:sc= -2.92! K(o=-2.9!,f=-1.2) USER MOD Single : A 100 SER OG : rot -140:sc= 0.0103 USER MOD Single : A 105 SER OG : rot 154:sc= 1.31 USER MOD Single : A 107 SER OG : rot -60:sc= 1.08 USER MOD Single : A 116 GLN : amide:sc= 1.03 K(o=1,f=-8.5!) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 1.17 K(o=1.2,f=0) USER MOD Single : A 124 LYS NZ :NH3+ -170:sc= 1.07 (180deg=0.496) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 GLN : amide:sc= 0.509 K(o=0.51,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 153:sc= 1.19 USER MOD Single : A 137 HIS : no HE2:sc= 0.224 K(o=0.22,f=-1.7) USER MOD Single : A 138 THR OG1 : rot -131:sc= 0.572 USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot -160:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ -166:sc= 0.808 (180deg=0.524) USER MOD Single : A 153 TYR OH : rot -8:sc= 0.656 USER MOD Single : A 154 SER OG : rot 74:sc= 1.23 USER MOD Single : A 157 LYS NZ :NH3+ 179:sc= 1.78 (180deg=1.78) USER MOD Single : A 161 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 12.905 17.150 11.706 1.00 9.68 N ATOM 2 CA GLY A 1 13.739 16.664 12.821 1.00 9.18 C ATOM 3 C GLY A 1 15.196 16.912 12.496 1.00 8.01 C ATOM 4 O GLY A 1 15.471 17.880 11.798 1.00 8.00 O ATOM 0 H1 GLY A 1 12.269 17.899 12.048 1.00 9.68 H new ATOM 0 H2 GLY A 1 13.516 17.531 10.956 1.00 9.68 H new ATOM 0 H3 GLY A 1 12.340 16.363 11.326 1.00 9.68 H new ATOM 0 HA2 GLY A 1 13.468 17.176 13.744 1.00 9.18 H new ATOM 0 HA3 GLY A 1 13.566 15.600 12.984 1.00 9.18 H new ATOM 10 N ALA A 2 16.102 16.052 12.959 1.00 7.69 N ATOM 11 CA ALA A 2 17.519 16.060 12.580 1.00 7.04 C ATOM 12 C ALA A 2 17.859 14.871 11.657 1.00 6.18 C ATOM 13 O ALA A 2 16.997 14.032 11.405 1.00 6.49 O ATOM 14 CB ALA A 2 18.350 16.040 13.874 1.00 7.90 C ATOM 0 H ALA A 2 15.869 15.313 13.623 1.00 7.69 H new ATOM 0 HA ALA A 2 17.753 16.958 12.009 1.00 7.04 H new ATOM 0 HB1 ALA A 2 19.411 16.045 13.625 1.00 7.90 H new ATOM 0 HB2 ALA A 2 18.113 16.920 14.472 1.00 7.90 H new ATOM 0 HB3 ALA A 2 18.115 15.140 14.443 1.00 7.90 H new ATOM 20 N MET A 3 19.114 14.807 11.187 1.00 5.68 N ATOM 21 CA MET A 3 19.645 13.788 10.256 1.00 5.00 C ATOM 22 C MET A 3 18.946 13.879 8.880 1.00 4.17 C ATOM 23 O MET A 3 18.513 14.958 8.492 1.00 4.95 O ATOM 24 CB MET A 3 19.613 12.379 10.899 1.00 5.79 C ATOM 25 CG MET A 3 20.489 12.289 12.156 1.00 6.87 C ATOM 26 SD MET A 3 20.268 10.781 13.138 1.00 8.26 S ATOM 27 CE MET A 3 20.600 9.490 11.911 1.00 8.72 C ATOM 0 H MET A 3 19.821 15.492 11.454 1.00 5.68 H new ATOM 0 HA MET A 3 20.698 13.993 10.060 1.00 5.00 H new ATOM 0 HB2 MET A 3 18.585 12.124 11.157 1.00 5.79 H new ATOM 0 HB3 MET A 3 19.951 11.642 10.170 1.00 5.79 H new ATOM 0 HG2 MET A 3 21.535 12.360 11.857 1.00 6.87 H new ATOM 0 HG3 MET A 3 20.279 13.151 12.789 1.00 6.87 H new ATOM 0 HE1 MET A 3 20.605 8.516 12.400 1.00 8.72 H new ATOM 0 HE2 MET A 3 19.825 9.508 11.145 1.00 8.72 H new ATOM 0 HE3 MET A 3 21.571 9.668 11.449 1.00 8.72 H new ATOM 37 N HIS A 4 18.875 12.766 8.139 1.00 3.31 N ATOM 38 CA HIS A 4 18.350 12.617 6.763 1.00 2.93 C ATOM 39 C HIS A 4 18.556 11.176 6.240 1.00 2.76 C ATOM 40 O HIS A 4 18.777 10.949 5.049 1.00 3.09 O ATOM 41 CB HIS A 4 18.929 13.691 5.810 1.00 3.96 C ATOM 42 CG HIS A 4 20.397 13.980 6.009 1.00 5.36 C ATOM 43 ND1 HIS A 4 20.917 15.144 6.517 1.00 6.28 N ATOM 44 CD2 HIS A 4 21.447 13.122 5.807 1.00 6.68 C ATOM 45 CE1 HIS A 4 22.250 14.998 6.615 1.00 7.62 C ATOM 46 NE2 HIS A 4 22.620 13.776 6.204 1.00 7.96 N ATOM 0 H HIS A 4 19.207 11.875 8.508 1.00 3.31 H new ATOM 0 HA HIS A 4 17.274 12.788 6.793 1.00 2.93 H new ATOM 0 HB2 HIS A 4 18.772 13.368 4.781 1.00 3.96 H new ATOM 0 HB3 HIS A 4 18.368 14.616 5.943 1.00 3.96 H new ATOM 0 HD2 HIS A 4 21.381 12.119 5.412 1.00 6.68 H new ATOM 0 HE1 HIS A 4 22.928 15.758 6.974 1.00 7.62 H new ATOM 0 HE2 HIS A 4 23.567 13.398 6.184 1.00 7.96 H new ATOM 55 N THR A 5 18.540 10.183 7.141 1.00 2.45 N ATOM 56 CA THR A 5 18.752 8.776 6.798 1.00 2.38 C ATOM 57 C THR A 5 17.452 8.188 6.282 1.00 2.00 C ATOM 58 O THR A 5 16.584 7.843 7.084 1.00 2.67 O ATOM 59 CB THR A 5 19.260 7.978 8.002 1.00 3.41 C ATOM 60 OG1 THR A 5 18.397 8.199 9.094 1.00 4.19 O ATOM 61 CG2 THR A 5 20.678 8.396 8.380 1.00 4.27 C ATOM 0 H THR A 5 18.378 10.339 8.136 1.00 2.45 H new ATOM 0 HA THR A 5 19.515 8.716 6.022 1.00 2.38 H new ATOM 0 HB THR A 5 19.276 6.920 7.739 1.00 3.41 H new ATOM 0 HG1 THR A 5 17.467 8.157 8.789 1.00 4.19 H new ATOM 0 HG21 THR A 5 21.013 7.813 9.238 1.00 4.27 H new ATOM 0 HG22 THR A 5 21.346 8.218 7.538 1.00 4.27 H new ATOM 0 HG23 THR A 5 20.689 9.456 8.635 1.00 4.27 H new ATOM 69 N PHE A 6 17.344 8.061 4.964 1.00 1.56 N ATOM 70 CA PHE A 6 16.268 7.305 4.328 1.00 1.85 C ATOM 71 C PHE A 6 16.541 5.791 4.402 1.00 2.20 C ATOM 72 O PHE A 6 17.571 5.365 4.930 1.00 2.66 O ATOM 73 CB PHE A 6 16.002 7.857 2.911 1.00 2.74 C ATOM 74 CG PHE A 6 16.853 7.271 1.800 1.00 3.62 C ATOM 75 CD1 PHE A 6 18.113 7.822 1.504 1.00 4.46 C ATOM 76 CD2 PHE A 6 16.386 6.163 1.067 1.00 4.97 C ATOM 77 CE1 PHE A 6 18.904 7.261 0.485 1.00 6.05 C ATOM 78 CE2 PHE A 6 17.189 5.584 0.070 1.00 6.68 C ATOM 79 CZ PHE A 6 18.445 6.138 -0.228 1.00 7.14 C ATOM 0 H PHE A 6 18.000 8.479 4.305 1.00 1.56 H new ATOM 0 HA PHE A 6 15.335 7.441 4.875 1.00 1.85 H new ATOM 0 HB2 PHE A 6 14.953 7.687 2.667 1.00 2.74 H new ATOM 0 HB3 PHE A 6 16.154 8.936 2.928 1.00 2.74 H new ATOM 0 HD1 PHE A 6 18.473 8.676 2.059 1.00 4.46 H new ATOM 0 HD2 PHE A 6 15.407 5.757 1.272 1.00 4.97 H new ATOM 0 HE1 PHE A 6 19.865 7.693 0.249 1.00 6.05 H new ATOM 0 HE2 PHE A 6 16.841 4.714 -0.467 1.00 6.68 H new ATOM 0 HZ PHE A 6 19.058 5.703 -1.003 1.00 7.14 H new ATOM 89 N TYR A 7 15.632 4.963 3.878 1.00 1.54 N ATOM 90 CA TYR A 7 15.756 3.503 3.982 1.00 1.37 C ATOM 91 C TYR A 7 15.053 2.701 2.877 1.00 1.37 C ATOM 92 O TYR A 7 15.483 1.579 2.607 1.00 1.40 O ATOM 93 CB TYR A 7 15.251 3.063 5.362 1.00 1.77 C ATOM 94 CG TYR A 7 15.676 1.662 5.758 1.00 1.39 C ATOM 95 CD1 TYR A 7 17.022 1.410 6.095 1.00 2.35 C ATOM 96 CD2 TYR A 7 14.720 0.635 5.874 1.00 2.15 C ATOM 97 CE1 TYR A 7 17.417 0.133 6.535 1.00 2.85 C ATOM 98 CE2 TYR A 7 15.108 -0.638 6.332 1.00 2.34 C ATOM 99 CZ TYR A 7 16.457 -0.897 6.654 1.00 2.29 C ATOM 100 OH TYR A 7 16.820 -2.133 7.088 1.00 3.08 O ATOM 0 H TYR A 7 14.801 5.278 3.377 1.00 1.54 H new ATOM 0 HA TYR A 7 16.814 3.279 3.849 1.00 1.37 H new ATOM 0 HB2 TYR A 7 15.614 3.767 6.111 1.00 1.77 H new ATOM 0 HB3 TYR A 7 14.162 3.118 5.373 1.00 1.77 H new ATOM 0 HD1 TYR A 7 17.753 2.201 6.015 1.00 2.35 H new ATOM 0 HD2 TYR A 7 13.690 0.824 5.612 1.00 2.15 H new ATOM 0 HE1 TYR A 7 18.451 -0.059 6.781 1.00 2.85 H new ATOM 0 HE2 TYR A 7 14.370 -1.420 6.437 1.00 2.34 H new ATOM 0 HH TYR A 7 16.033 -2.716 7.110 1.00 3.08 H new ATOM 110 N GLY A 8 14.031 3.261 2.215 1.00 1.10 N ATOM 111 CA GLY A 8 13.324 2.637 1.091 1.00 1.02 C ATOM 112 C GLY A 8 14.199 2.609 -0.171 1.00 1.17 C ATOM 113 O GLY A 8 15.199 1.894 -0.235 1.00 2.25 O ATOM 0 H GLY A 8 13.665 4.183 2.453 1.00 1.10 H new ATOM 0 HA2 GLY A 8 13.036 1.621 1.359 1.00 1.02 H new ATOM 0 HA3 GLY A 8 12.405 3.186 0.887 1.00 1.02 H new ATOM 117 N THR A 9 13.824 3.406 -1.174 1.00 1.01 N ATOM 118 CA THR A 9 14.579 3.716 -2.399 1.00 1.05 C ATOM 119 C THR A 9 14.184 5.121 -2.840 1.00 1.29 C ATOM 120 O THR A 9 13.123 5.294 -3.446 1.00 1.25 O ATOM 121 CB THR A 9 14.310 2.715 -3.542 1.00 1.21 C ATOM 122 OG1 THR A 9 13.933 1.455 -3.052 1.00 1.48 O ATOM 123 CG2 THR A 9 15.555 2.536 -4.407 1.00 1.18 C ATOM 0 H THR A 9 12.924 3.886 -1.154 1.00 1.01 H new ATOM 0 HA THR A 9 15.644 3.646 -2.176 1.00 1.05 H new ATOM 0 HB THR A 9 13.494 3.129 -4.134 1.00 1.21 H new ATOM 0 HG1 THR A 9 13.045 1.516 -2.642 1.00 1.48 H new ATOM 0 HG21 THR A 9 15.343 1.826 -5.207 1.00 1.18 H new ATOM 0 HG22 THR A 9 15.839 3.496 -4.839 1.00 1.18 H new ATOM 0 HG23 THR A 9 16.373 2.158 -3.794 1.00 1.18 H new ATOM 131 N ARG A 10 14.982 6.133 -2.480 1.00 1.06 N ATOM 132 CA ARG A 10 14.647 7.539 -2.726 1.00 1.10 C ATOM 133 C ARG A 10 14.955 7.945 -4.163 1.00 1.47 C ATOM 134 O ARG A 10 16.090 7.870 -4.625 1.00 1.75 O ATOM 135 CB ARG A 10 15.266 8.455 -1.664 1.00 1.17 C ATOM 136 CG ARG A 10 14.528 9.804 -1.563 1.00 1.56 C ATOM 137 CD ARG A 10 15.000 10.898 -2.525 1.00 2.26 C ATOM 138 NE ARG A 10 16.384 11.306 -2.235 1.00 2.40 N ATOM 139 CZ ARG A 10 17.318 11.613 -3.127 1.00 3.66 C ATOM 140 NH1 ARG A 10 17.087 11.621 -4.424 1.00 4.55 N ATOM 141 NH2 ARG A 10 18.527 11.921 -2.700 1.00 4.75 N ATOM 0 H ARG A 10 15.878 6.000 -2.010 1.00 1.06 H new ATOM 0 HA ARG A 10 13.569 7.662 -2.620 1.00 1.10 H new ATOM 0 HB2 ARG A 10 15.242 7.955 -0.696 1.00 1.17 H new ATOM 0 HB3 ARG A 10 16.314 8.632 -1.905 1.00 1.17 H new ATOM 0 HG2 ARG A 10 13.466 9.629 -1.735 1.00 1.56 H new ATOM 0 HG3 ARG A 10 14.628 10.176 -0.543 1.00 1.56 H new ATOM 0 HD2 ARG A 10 14.933 10.536 -3.551 1.00 2.26 H new ATOM 0 HD3 ARG A 10 14.340 11.762 -2.448 1.00 2.26 H new ATOM 0 HE ARG A 10 16.652 11.358 -1.252 1.00 2.40 H new ATOM 0 HH11 ARG A 10 16.160 11.385 -4.778 1.00 4.55 H new ATOM 0 HH12 ARG A 10 17.835 11.863 -5.074 1.00 4.55 H new ATOM 0 HH21 ARG A 10 18.730 11.920 -1.700 1.00 4.75 H new ATOM 0 HH22 ARG A 10 19.259 12.160 -3.369 1.00 4.75 H new ATOM 155 N LEU A 11 13.900 8.374 -4.852 1.00 1.09 N ATOM 156 CA LEU A 11 13.864 8.540 -6.307 1.00 1.07 C ATOM 157 C LEU A 11 14.417 9.904 -6.765 1.00 1.55 C ATOM 158 O LEU A 11 14.865 10.713 -5.948 1.00 2.18 O ATOM 159 CB LEU A 11 12.423 8.273 -6.798 1.00 0.90 C ATOM 160 CG LEU A 11 11.830 6.910 -6.364 1.00 0.96 C ATOM 161 CD1 LEU A 11 10.411 6.768 -6.927 1.00 0.94 C ATOM 162 CD2 LEU A 11 12.681 5.713 -6.812 1.00 1.11 C ATOM 0 H LEU A 11 13.019 8.624 -4.402 1.00 1.09 H new ATOM 0 HA LEU A 11 14.532 7.812 -6.767 1.00 1.07 H new ATOM 0 HB2 LEU A 11 11.776 9.069 -6.429 1.00 0.90 H new ATOM 0 HB3 LEU A 11 12.409 8.329 -7.886 1.00 0.90 H new ATOM 0 HG LEU A 11 11.816 6.901 -5.274 1.00 0.96 H new ATOM 0 HD11 LEU A 11 9.993 5.809 -6.622 1.00 0.94 H new ATOM 0 HD12 LEU A 11 9.785 7.575 -6.545 1.00 0.94 H new ATOM 0 HD13 LEU A 11 10.444 6.820 -8.015 1.00 0.94 H new ATOM 0 HD21 LEU A 11 12.212 4.788 -6.477 1.00 1.11 H new ATOM 0 HD22 LEU A 11 12.758 5.708 -7.899 1.00 1.11 H new ATOM 0 HD23 LEU A 11 13.678 5.792 -6.378 1.00 1.11 H new ATOM 174 N LEU A 12 14.403 10.136 -8.083 1.00 1.50 N ATOM 175 CA LEU A 12 14.862 11.371 -8.737 1.00 1.72 C ATOM 176 C LEU A 12 13.768 12.021 -9.595 1.00 2.09 C ATOM 177 O LEU A 12 13.557 13.223 -9.486 1.00 2.49 O ATOM 178 CB LEU A 12 16.115 11.074 -9.568 1.00 1.97 C ATOM 179 CG LEU A 12 17.361 10.780 -8.705 1.00 1.96 C ATOM 180 CD1 LEU A 12 18.498 10.431 -9.657 1.00 3.03 C ATOM 181 CD2 LEU A 12 17.803 11.970 -7.834 1.00 2.82 C ATOM 0 H LEU A 12 14.059 9.444 -8.749 1.00 1.50 H new ATOM 0 HA LEU A 12 15.108 12.094 -7.959 1.00 1.72 H new ATOM 0 HB2 LEU A 12 15.920 10.219 -10.216 1.00 1.97 H new ATOM 0 HB3 LEU A 12 16.323 11.925 -10.217 1.00 1.97 H new ATOM 0 HG LEU A 12 17.111 9.968 -8.022 1.00 1.96 H new ATOM 0 HD11 LEU A 12 19.400 10.216 -9.084 1.00 3.03 H new ATOM 0 HD12 LEU A 12 18.224 9.555 -10.245 1.00 3.03 H new ATOM 0 HD13 LEU A 12 18.685 11.272 -10.325 1.00 3.03 H new ATOM 0 HD21 LEU A 12 18.683 11.690 -7.256 1.00 2.82 H new ATOM 0 HD22 LEU A 12 18.044 12.819 -8.473 1.00 2.82 H new ATOM 0 HD23 LEU A 12 16.995 12.244 -7.155 1.00 2.82 H new ATOM 193 N ASN A 13 13.047 11.239 -10.406 1.00 1.75 N ATOM 194 CA ASN A 13 11.911 11.703 -11.213 1.00 1.88 C ATOM 195 C ASN A 13 10.585 11.126 -10.663 1.00 1.74 C ATOM 196 O ASN A 13 10.201 10.021 -11.067 1.00 1.92 O ATOM 197 CB ASN A 13 12.155 11.293 -12.677 1.00 2.16 C ATOM 198 CG ASN A 13 11.025 11.712 -13.614 1.00 3.27 C ATOM 199 OD1 ASN A 13 10.178 12.531 -13.289 1.00 4.14 O ATOM 200 ND2 ASN A 13 10.975 11.155 -14.809 1.00 3.86 N ATOM 0 H ASN A 13 13.240 10.244 -10.523 1.00 1.75 H new ATOM 0 HA ASN A 13 11.826 12.788 -11.161 1.00 1.88 H new ATOM 0 HB2 ASN A 13 13.088 11.738 -13.022 1.00 2.16 H new ATOM 0 HB3 ASN A 13 12.279 10.211 -12.729 1.00 2.16 H new ATOM 0 HD21 ASN A 13 10.231 11.408 -15.459 1.00 3.86 H new ATOM 0 HD22 ASN A 13 11.681 10.471 -15.083 1.00 3.86 H new ATOM 207 N PRO A 14 9.906 11.812 -9.721 1.00 1.45 N ATOM 208 CA PRO A 14 8.677 11.308 -9.132 1.00 1.36 C ATOM 209 C PRO A 14 7.506 11.543 -10.077 1.00 1.65 C ATOM 210 O PRO A 14 6.994 12.650 -10.250 1.00 2.03 O ATOM 211 CB PRO A 14 8.541 12.017 -7.788 1.00 1.35 C ATOM 212 CG PRO A 14 9.219 13.365 -8.041 1.00 1.41 C ATOM 213 CD PRO A 14 10.336 13.019 -9.027 1.00 1.42 C ATOM 0 HA PRO A 14 8.691 10.230 -8.970 1.00 1.36 H new ATOM 0 HB2 PRO A 14 7.497 12.138 -7.499 1.00 1.35 H new ATOM 0 HB3 PRO A 14 9.031 11.463 -6.988 1.00 1.35 H new ATOM 0 HG2 PRO A 14 8.524 14.092 -8.460 1.00 1.41 H new ATOM 0 HG3 PRO A 14 9.614 13.795 -7.121 1.00 1.41 H new ATOM 0 HD2 PRO A 14 10.501 13.835 -9.731 1.00 1.42 H new ATOM 0 HD3 PRO A 14 11.278 12.853 -8.505 1.00 1.42 H new ATOM 221 N LYS A 15 7.094 10.452 -10.714 1.00 1.34 N ATOM 222 CA LYS A 15 6.161 10.476 -11.834 1.00 1.52 C ATOM 223 C LYS A 15 4.704 10.611 -11.348 1.00 1.64 C ATOM 224 O LYS A 15 4.353 9.922 -10.387 1.00 1.61 O ATOM 225 CB LYS A 15 6.422 9.226 -12.697 1.00 1.77 C ATOM 226 CG LYS A 15 5.666 7.957 -12.265 1.00 1.85 C ATOM 227 CD LYS A 15 5.981 6.751 -13.156 1.00 1.73 C ATOM 228 CE LYS A 15 5.071 5.587 -12.743 1.00 2.11 C ATOM 229 NZ LYS A 15 5.220 4.403 -13.627 1.00 2.75 N ATOM 0 H LYS A 15 7.403 9.513 -10.463 1.00 1.34 H new ATOM 0 HA LYS A 15 6.322 11.356 -12.457 1.00 1.52 H new ATOM 0 HB2 LYS A 15 6.154 9.455 -13.728 1.00 1.77 H new ATOM 0 HB3 LYS A 15 7.491 9.014 -12.685 1.00 1.77 H new ATOM 0 HG2 LYS A 15 5.924 7.719 -11.233 1.00 1.85 H new ATOM 0 HG3 LYS A 15 4.594 8.152 -12.289 1.00 1.85 H new ATOM 0 HD2 LYS A 15 5.821 7.003 -14.204 1.00 1.73 H new ATOM 0 HD3 LYS A 15 7.028 6.468 -13.053 1.00 1.73 H new ATOM 0 HE2 LYS A 15 5.298 5.300 -11.716 1.00 2.11 H new ATOM 0 HE3 LYS A 15 4.033 5.919 -12.759 1.00 2.11 H new ATOM 0 HZ1 LYS A 15 4.596 3.640 -13.294 1.00 2.75 H new ATOM 0 HZ2 LYS A 15 4.961 4.662 -14.600 1.00 2.75 H new ATOM 0 HZ3 LYS A 15 6.207 4.076 -13.606 1.00 2.75 H new ATOM 243 N PRO A 16 3.847 11.437 -11.980 1.00 1.50 N ATOM 244 CA PRO A 16 2.424 11.466 -11.662 1.00 1.46 C ATOM 245 C PRO A 16 1.826 10.086 -11.951 1.00 1.43 C ATOM 246 O PRO A 16 2.260 9.407 -12.882 1.00 1.34 O ATOM 247 CB PRO A 16 1.816 12.566 -12.533 1.00 1.75 C ATOM 248 CG PRO A 16 2.758 12.621 -13.737 1.00 1.81 C ATOM 249 CD PRO A 16 4.120 12.282 -13.133 1.00 1.74 C ATOM 0 HA PRO A 16 2.222 11.683 -10.613 1.00 1.46 H new ATOM 0 HB2 PRO A 16 0.796 12.325 -12.831 1.00 1.75 H new ATOM 0 HB3 PRO A 16 1.778 13.520 -12.008 1.00 1.75 H new ATOM 0 HG2 PRO A 16 2.470 11.905 -14.506 1.00 1.81 H new ATOM 0 HG3 PRO A 16 2.758 13.606 -14.203 1.00 1.81 H new ATOM 0 HD2 PRO A 16 4.750 11.764 -13.856 1.00 1.74 H new ATOM 0 HD3 PRO A 16 4.652 13.186 -12.837 1.00 1.74 H new ATOM 257 N VAL A 17 0.864 9.664 -11.130 1.00 1.04 N ATOM 258 CA VAL A 17 0.227 8.341 -11.201 1.00 0.91 C ATOM 259 C VAL A 17 -1.264 8.440 -10.878 1.00 1.38 C ATOM 260 O VAL A 17 -1.715 9.357 -10.190 1.00 1.60 O ATOM 261 CB VAL A 17 0.896 7.291 -10.270 1.00 0.87 C ATOM 262 CG1 VAL A 17 2.296 6.890 -10.763 1.00 0.94 C ATOM 263 CG2 VAL A 17 0.986 7.741 -8.800 1.00 1.15 C ATOM 0 H VAL A 17 0.494 10.244 -10.377 1.00 1.04 H new ATOM 0 HA VAL A 17 0.360 7.996 -12.226 1.00 0.91 H new ATOM 0 HB VAL A 17 0.236 6.425 -10.313 1.00 0.87 H new ATOM 0 HG11 VAL A 17 2.725 6.155 -10.082 1.00 0.94 H new ATOM 0 HG12 VAL A 17 2.221 6.459 -11.761 1.00 0.94 H new ATOM 0 HG13 VAL A 17 2.936 7.771 -10.796 1.00 0.94 H new ATOM 0 HG21 VAL A 17 1.463 6.960 -8.209 1.00 1.15 H new ATOM 0 HG22 VAL A 17 1.575 8.656 -8.735 1.00 1.15 H new ATOM 0 HG23 VAL A 17 -0.016 7.926 -8.414 1.00 1.15 H new ATOM 273 N ASP A 18 -2.006 7.448 -11.360 1.00 0.87 N ATOM 274 CA ASP A 18 -3.391 7.158 -10.997 1.00 0.98 C ATOM 275 C ASP A 18 -3.653 5.651 -11.154 1.00 1.10 C ATOM 276 O ASP A 18 -2.824 4.912 -11.690 1.00 1.46 O ATOM 277 CB ASP A 18 -4.370 8.008 -11.843 1.00 1.33 C ATOM 278 CG ASP A 18 -5.816 8.094 -11.314 1.00 1.61 C ATOM 279 OD1 ASP A 18 -6.140 7.628 -10.197 1.00 2.11 O ATOM 280 OD2 ASP A 18 -6.629 8.783 -11.968 1.00 2.52 O ATOM 0 H ASP A 18 -1.640 6.791 -12.049 1.00 0.87 H new ATOM 0 HA ASP A 18 -3.560 7.428 -9.955 1.00 0.98 H new ATOM 0 HB2 ASP A 18 -3.971 9.019 -11.919 1.00 1.33 H new ATOM 0 HB3 ASP A 18 -4.397 7.599 -12.853 1.00 1.33 H new ATOM 285 N PHE A 19 -4.815 5.221 -10.680 1.00 0.98 N ATOM 286 CA PHE A 19 -5.459 3.947 -10.962 1.00 1.01 C ATOM 287 C PHE A 19 -6.934 4.054 -10.602 1.00 1.72 C ATOM 288 O PHE A 19 -7.285 4.776 -9.672 1.00 1.86 O ATOM 289 CB PHE A 19 -4.805 2.788 -10.195 1.00 1.11 C ATOM 290 CG PHE A 19 -4.774 2.880 -8.670 1.00 1.15 C ATOM 291 CD1 PHE A 19 -5.921 2.629 -7.890 1.00 1.89 C ATOM 292 CD2 PHE A 19 -3.555 3.151 -8.021 1.00 2.19 C ATOM 293 CE1 PHE A 19 -5.855 2.671 -6.484 1.00 1.80 C ATOM 294 CE2 PHE A 19 -3.482 3.180 -6.617 1.00 2.13 C ATOM 295 CZ PHE A 19 -4.634 2.941 -5.845 1.00 1.39 C ATOM 0 H PHE A 19 -5.370 5.794 -10.044 1.00 0.98 H new ATOM 0 HA PHE A 19 -5.344 3.729 -12.024 1.00 1.01 H new ATOM 0 HB2 PHE A 19 -5.325 1.869 -10.466 1.00 1.11 H new ATOM 0 HB3 PHE A 19 -3.778 2.689 -10.547 1.00 1.11 H new ATOM 0 HD1 PHE A 19 -6.859 2.402 -8.375 1.00 1.89 H new ATOM 0 HD2 PHE A 19 -2.667 3.338 -8.607 1.00 2.19 H new ATOM 0 HE1 PHE A 19 -6.744 2.495 -5.897 1.00 1.80 H new ATOM 0 HE2 PHE A 19 -2.540 3.386 -6.130 1.00 2.13 H new ATOM 0 HZ PHE A 19 -4.579 2.965 -4.767 1.00 1.39 H new ATOM 305 N ALA A 20 -7.787 3.269 -11.254 1.00 0.98 N ATOM 306 CA ALA A 20 -9.128 2.986 -10.761 1.00 0.95 C ATOM 307 C ALA A 20 -9.084 1.658 -10.001 1.00 0.93 C ATOM 308 O ALA A 20 -8.309 0.777 -10.353 1.00 1.10 O ATOM 309 CB ALA A 20 -10.096 2.936 -11.950 1.00 1.21 C ATOM 0 H ALA A 20 -7.566 2.812 -12.139 1.00 0.98 H new ATOM 0 HA ALA A 20 -9.479 3.763 -10.082 1.00 0.95 H new ATOM 0 HB1 ALA A 20 -11.103 2.725 -11.591 1.00 1.21 H new ATOM 0 HB2 ALA A 20 -10.089 3.896 -12.466 1.00 1.21 H new ATOM 0 HB3 ALA A 20 -9.785 2.152 -12.640 1.00 1.21 H new ATOM 315 N LEU A 21 -9.881 1.549 -8.945 1.00 0.87 N ATOM 316 CA LEU A 21 -10.181 0.362 -8.153 1.00 0.76 C ATOM 317 C LEU A 21 -11.649 0.443 -7.700 1.00 1.09 C ATOM 318 O LEU A 21 -12.310 1.467 -7.914 1.00 1.41 O ATOM 319 CB LEU A 21 -9.232 0.353 -6.933 1.00 0.64 C ATOM 320 CG LEU A 21 -8.237 -0.811 -6.818 1.00 0.75 C ATOM 321 CD1 LEU A 21 -8.951 -2.144 -6.569 1.00 1.19 C ATOM 322 CD2 LEU A 21 -7.280 -0.946 -8.002 1.00 1.11 C ATOM 0 H LEU A 21 -10.380 2.364 -8.589 1.00 0.87 H new ATOM 0 HA LEU A 21 -10.038 -0.553 -8.728 1.00 0.76 H new ATOM 0 HB2 LEU A 21 -8.663 1.283 -6.943 1.00 0.64 H new ATOM 0 HB3 LEU A 21 -9.844 0.363 -6.031 1.00 0.64 H new ATOM 0 HG LEU A 21 -7.623 -0.559 -5.953 1.00 0.75 H new ATOM 0 HD11 LEU A 21 -8.214 -2.943 -6.494 1.00 1.19 H new ATOM 0 HD12 LEU A 21 -9.518 -2.085 -5.640 1.00 1.19 H new ATOM 0 HD13 LEU A 21 -9.630 -2.353 -7.396 1.00 1.19 H new ATOM 0 HD21 LEU A 21 -6.614 -1.793 -7.837 1.00 1.11 H new ATOM 0 HD22 LEU A 21 -7.852 -1.108 -8.916 1.00 1.11 H new ATOM 0 HD23 LEU A 21 -6.691 -0.034 -8.099 1.00 1.11 H new ATOM 334 N GLU A 22 -12.124 -0.550 -6.952 1.00 0.69 N ATOM 335 CA GLU A 22 -13.326 -0.410 -6.123 1.00 0.52 C ATOM 336 C GLU A 22 -13.007 -0.624 -4.630 1.00 0.90 C ATOM 337 O GLU A 22 -11.924 -1.080 -4.256 1.00 1.14 O ATOM 338 CB GLU A 22 -14.469 -1.313 -6.630 1.00 0.75 C ATOM 339 CG GLU A 22 -14.951 -0.986 -8.059 1.00 1.56 C ATOM 340 CD GLU A 22 -14.424 -1.953 -9.124 1.00 2.32 C ATOM 341 OE1 GLU A 22 -15.006 -3.044 -9.295 1.00 2.90 O ATOM 342 OE2 GLU A 22 -13.419 -1.657 -9.801 1.00 3.45 O ATOM 0 H GLU A 22 -11.691 -1.472 -6.901 1.00 0.69 H new ATOM 0 HA GLU A 22 -13.683 0.616 -6.216 1.00 0.52 H new ATOM 0 HB2 GLU A 22 -14.137 -2.351 -6.600 1.00 0.75 H new ATOM 0 HB3 GLU A 22 -15.314 -1.229 -5.946 1.00 0.75 H new ATOM 0 HG2 GLU A 22 -16.041 -0.999 -8.077 1.00 1.56 H new ATOM 0 HG3 GLU A 22 -14.640 0.027 -8.315 1.00 1.56 H new ATOM 349 N GLY A 23 -13.951 -0.240 -3.771 1.00 0.53 N ATOM 350 CA GLY A 23 -13.960 -0.496 -2.328 1.00 0.55 C ATOM 351 C GLY A 23 -15.375 -0.850 -1.849 1.00 0.68 C ATOM 352 O GLY A 23 -16.299 -0.854 -2.667 1.00 0.86 O ATOM 0 H GLY A 23 -14.771 0.284 -4.076 1.00 0.53 H new ATOM 0 HA2 GLY A 23 -13.277 -1.312 -2.094 1.00 0.55 H new ATOM 0 HA3 GLY A 23 -13.600 0.384 -1.795 1.00 0.55 H new ATOM 356 N PRO A 24 -15.588 -1.111 -0.543 1.00 0.55 N ATOM 357 CA PRO A 24 -16.837 -1.640 0.032 1.00 0.77 C ATOM 358 C PRO A 24 -17.970 -0.589 0.134 1.00 1.07 C ATOM 359 O PRO A 24 -18.710 -0.539 1.116 1.00 1.13 O ATOM 360 CB PRO A 24 -16.407 -2.190 1.396 1.00 0.87 C ATOM 361 CG PRO A 24 -15.341 -1.184 1.811 1.00 0.77 C ATOM 362 CD PRO A 24 -14.580 -0.991 0.505 1.00 0.55 C ATOM 0 HA PRO A 24 -17.284 -2.404 -0.605 1.00 0.77 H new ATOM 0 HB2 PRO A 24 -17.235 -2.224 2.103 1.00 0.87 H new ATOM 0 HB3 PRO A 24 -16.009 -3.202 1.322 1.00 0.87 H new ATOM 0 HG2 PRO A 24 -15.775 -0.253 2.174 1.00 0.77 H new ATOM 0 HG3 PRO A 24 -14.701 -1.568 2.605 1.00 0.77 H new ATOM 0 HD2 PRO A 24 -14.092 -0.017 0.473 1.00 0.55 H new ATOM 0 HD3 PRO A 24 -13.799 -1.742 0.389 1.00 0.55 H new ATOM 370 N GLN A 25 -18.086 0.276 -0.874 1.00 1.15 N ATOM 371 CA GLN A 25 -19.018 1.402 -0.921 1.00 1.31 C ATOM 372 C GLN A 25 -19.179 1.976 -2.341 1.00 1.58 C ATOM 373 O GLN A 25 -20.234 2.523 -2.648 1.00 2.31 O ATOM 374 CB GLN A 25 -18.543 2.483 0.070 1.00 1.38 C ATOM 375 CG GLN A 25 -19.596 3.571 0.326 1.00 2.38 C ATOM 376 CD GLN A 25 -19.221 4.480 1.497 1.00 2.59 C ATOM 377 OE1 GLN A 25 -18.074 4.634 1.879 1.00 2.73 O ATOM 378 NE2 GLN A 25 -20.180 5.121 2.130 1.00 3.45 N ATOM 0 H GLN A 25 -17.510 0.208 -1.713 1.00 1.15 H new ATOM 0 HA GLN A 25 -20.006 1.045 -0.631 1.00 1.31 H new ATOM 0 HB2 GLN A 25 -18.281 2.010 1.016 1.00 1.38 H new ATOM 0 HB3 GLN A 25 -17.636 2.948 -0.316 1.00 1.38 H new ATOM 0 HG2 GLN A 25 -19.718 4.174 -0.574 1.00 2.38 H new ATOM 0 HG3 GLN A 25 -20.559 3.101 0.528 1.00 2.38 H new ATOM 0 HE21 GLN A 25 -21.149 5.011 1.832 1.00 3.45 H new ATOM 0 HE22 GLN A 25 -19.954 5.728 2.918 1.00 3.45 H new ATOM 387 N GLY A 26 -18.172 1.852 -3.220 1.00 1.00 N ATOM 388 CA GLY A 26 -18.195 2.378 -4.585 1.00 1.12 C ATOM 389 C GLY A 26 -16.829 2.310 -5.286 1.00 1.26 C ATOM 390 O GLY A 26 -15.861 1.832 -4.688 1.00 1.45 O ATOM 0 H GLY A 26 -17.302 1.372 -2.992 1.00 1.00 H new ATOM 0 HA2 GLY A 26 -18.924 1.818 -5.170 1.00 1.12 H new ATOM 0 HA3 GLY A 26 -18.533 3.414 -4.562 1.00 1.12 H new ATOM 394 N PRO A 27 -16.743 2.770 -6.551 1.00 1.25 N ATOM 395 CA PRO A 27 -15.500 2.856 -7.311 1.00 1.39 C ATOM 396 C PRO A 27 -14.646 4.039 -6.837 1.00 1.45 C ATOM 397 O PRO A 27 -15.174 5.089 -6.476 1.00 1.39 O ATOM 398 CB PRO A 27 -15.933 3.007 -8.771 1.00 1.47 C ATOM 399 CG PRO A 27 -17.263 3.755 -8.662 1.00 1.39 C ATOM 400 CD PRO A 27 -17.862 3.231 -7.354 1.00 1.22 C ATOM 0 HA PRO A 27 -14.872 1.975 -7.176 1.00 1.39 H new ATOM 0 HB2 PRO A 27 -15.201 3.568 -9.353 1.00 1.47 H new ATOM 0 HB3 PRO A 27 -16.053 2.039 -9.258 1.00 1.47 H new ATOM 0 HG2 PRO A 27 -17.115 4.834 -8.632 1.00 1.39 H new ATOM 0 HG3 PRO A 27 -17.912 3.546 -9.513 1.00 1.39 H new ATOM 0 HD2 PRO A 27 -18.415 4.016 -6.837 1.00 1.22 H new ATOM 0 HD3 PRO A 27 -18.564 2.420 -7.545 1.00 1.22 H new ATOM 408 N VAL A 28 -13.320 3.872 -6.846 1.00 1.27 N ATOM 409 CA VAL A 28 -12.359 4.857 -6.313 1.00 1.28 C ATOM 410 C VAL A 28 -11.168 4.977 -7.261 1.00 1.47 C ATOM 411 O VAL A 28 -10.612 3.968 -7.681 1.00 1.27 O ATOM 412 CB VAL A 28 -11.855 4.471 -4.895 1.00 1.29 C ATOM 413 CG1 VAL A 28 -10.854 5.508 -4.349 1.00 1.48 C ATOM 414 CG2 VAL A 28 -13.015 4.349 -3.888 1.00 1.97 C ATOM 0 H VAL A 28 -12.872 3.039 -7.228 1.00 1.27 H new ATOM 0 HA VAL A 28 -12.876 5.813 -6.234 1.00 1.28 H new ATOM 0 HB VAL A 28 -11.364 3.504 -5.004 1.00 1.29 H new ATOM 0 HG11 VAL A 28 -10.523 5.206 -3.356 1.00 1.48 H new ATOM 0 HG12 VAL A 28 -9.994 5.569 -5.016 1.00 1.48 H new ATOM 0 HG13 VAL A 28 -11.337 6.483 -4.289 1.00 1.48 H new ATOM 0 HG21 VAL A 28 -12.620 4.078 -2.909 1.00 1.97 H new ATOM 0 HG22 VAL A 28 -13.537 5.303 -3.817 1.00 1.97 H new ATOM 0 HG23 VAL A 28 -13.710 3.580 -4.225 1.00 1.97 H new ATOM 424 N ARG A 29 -10.759 6.211 -7.566 1.00 1.43 N ATOM 425 CA ARG A 29 -9.489 6.499 -8.243 1.00 1.33 C ATOM 426 C ARG A 29 -8.432 6.984 -7.247 1.00 1.52 C ATOM 427 O ARG A 29 -8.763 7.756 -6.347 1.00 1.71 O ATOM 428 CB ARG A 29 -9.669 7.554 -9.346 1.00 1.30 C ATOM 429 CG ARG A 29 -9.600 7.002 -10.780 1.00 1.61 C ATOM 430 CD ARG A 29 -10.022 8.024 -11.857 1.00 1.86 C ATOM 431 NE ARG A 29 -9.638 9.407 -11.513 1.00 2.23 N ATOM 432 CZ ARG A 29 -10.395 10.294 -10.871 1.00 3.17 C ATOM 433 NH1 ARG A 29 -11.695 10.152 -10.734 1.00 3.77 N ATOM 434 NH2 ARG A 29 -9.861 11.342 -10.292 1.00 4.67 N ATOM 0 H ARG A 29 -11.303 7.046 -7.349 1.00 1.43 H new ATOM 0 HA ARG A 29 -9.152 5.568 -8.698 1.00 1.33 H new ATOM 0 HB2 ARG A 29 -10.632 8.046 -9.206 1.00 1.30 H new ATOM 0 HB3 ARG A 29 -8.901 8.318 -9.228 1.00 1.30 H new ATOM 0 HG2 ARG A 29 -8.582 6.671 -10.984 1.00 1.61 H new ATOM 0 HG3 ARG A 29 -10.241 6.124 -10.853 1.00 1.61 H new ATOM 0 HD2 ARG A 29 -9.566 7.751 -12.809 1.00 1.86 H new ATOM 0 HD3 ARG A 29 -11.102 7.975 -11.995 1.00 1.86 H new ATOM 0 HE ARG A 29 -8.706 9.711 -11.793 1.00 2.23 H new ATOM 0 HH11 ARG A 29 -12.163 9.336 -11.128 1.00 3.77 H new ATOM 0 HH12 ARG A 29 -12.235 10.858 -10.234 1.00 3.77 H new ATOM 0 HH21 ARG A 29 -8.852 11.487 -10.330 1.00 4.67 H new ATOM 0 HH22 ARG A 29 -10.455 12.013 -9.804 1.00 4.67 H new ATOM 448 N LEU A 30 -7.160 6.645 -7.457 1.00 1.26 N ATOM 449 CA LEU A 30 -6.029 7.204 -6.700 1.00 1.28 C ATOM 450 C LEU A 30 -6.025 8.741 -6.786 1.00 1.49 C ATOM 451 O LEU A 30 -5.852 9.422 -5.777 1.00 1.63 O ATOM 452 CB LEU A 30 -4.748 6.552 -7.255 1.00 1.36 C ATOM 453 CG LEU A 30 -3.390 6.827 -6.574 1.00 1.33 C ATOM 454 CD1 LEU A 30 -2.810 8.217 -6.871 1.00 2.21 C ATOM 455 CD2 LEU A 30 -3.439 6.591 -5.061 1.00 2.37 C ATOM 0 H LEU A 30 -6.878 5.967 -8.165 1.00 1.26 H new ATOM 0 HA LEU A 30 -6.104 6.981 -5.636 1.00 1.28 H new ATOM 0 HB2 LEU A 30 -4.903 5.473 -7.248 1.00 1.36 H new ATOM 0 HB3 LEU A 30 -4.655 6.854 -8.298 1.00 1.36 H new ATOM 0 HG LEU A 30 -2.713 6.100 -7.022 1.00 1.33 H new ATOM 0 HD11 LEU A 30 -1.856 8.331 -6.356 1.00 2.21 H new ATOM 0 HD12 LEU A 30 -2.658 8.326 -7.945 1.00 2.21 H new ATOM 0 HD13 LEU A 30 -3.504 8.983 -6.523 1.00 2.21 H new ATOM 0 HD21 LEU A 30 -2.460 6.798 -4.629 1.00 2.37 H new ATOM 0 HD22 LEU A 30 -4.181 7.253 -4.613 1.00 2.37 H new ATOM 0 HD23 LEU A 30 -3.711 5.554 -4.863 1.00 2.37 H new ATOM 467 N SER A 31 -6.319 9.310 -7.955 1.00 1.25 N ATOM 468 CA SER A 31 -6.389 10.770 -8.137 1.00 1.28 C ATOM 469 C SER A 31 -7.681 11.410 -7.585 1.00 1.72 C ATOM 470 O SER A 31 -7.936 12.581 -7.841 1.00 2.22 O ATOM 471 CB SER A 31 -6.119 11.144 -9.600 1.00 1.48 C ATOM 472 OG SER A 31 -7.168 10.710 -10.436 1.00 1.77 O ATOM 0 H SER A 31 -6.516 8.779 -8.803 1.00 1.25 H new ATOM 0 HA SER A 31 -5.596 11.200 -7.526 1.00 1.28 H new ATOM 0 HB2 SER A 31 -6.003 12.224 -9.687 1.00 1.48 H new ATOM 0 HB3 SER A 31 -5.181 10.696 -9.926 1.00 1.48 H new ATOM 0 HG SER A 31 -6.795 10.261 -11.223 1.00 1.77 H new ATOM 478 N GLN A 32 -8.505 10.693 -6.805 1.00 1.70 N ATOM 479 CA GLN A 32 -9.555 11.321 -5.985 1.00 2.07 C ATOM 480 C GLN A 32 -8.997 11.971 -4.715 1.00 2.24 C ATOM 481 O GLN A 32 -9.731 12.714 -4.071 1.00 2.60 O ATOM 482 CB GLN A 32 -10.636 10.296 -5.594 1.00 2.14 C ATOM 483 CG GLN A 32 -11.482 9.825 -6.783 1.00 2.79 C ATOM 484 CD GLN A 32 -12.393 10.930 -7.313 1.00 3.38 C ATOM 485 OE1 GLN A 32 -12.154 11.516 -8.359 1.00 3.95 O ATOM 486 NE2 GLN A 32 -13.455 11.261 -6.614 1.00 3.66 N ATOM 0 H GLN A 32 -8.465 9.677 -6.724 1.00 1.70 H new ATOM 0 HA GLN A 32 -9.995 12.104 -6.602 1.00 2.07 H new ATOM 0 HB2 GLN A 32 -10.158 9.432 -5.132 1.00 2.14 H new ATOM 0 HB3 GLN A 32 -11.291 10.737 -4.843 1.00 2.14 H new ATOM 0 HG2 GLN A 32 -10.825 9.483 -7.582 1.00 2.79 H new ATOM 0 HG3 GLN A 32 -12.087 8.970 -6.481 1.00 2.79 H new ATOM 0 HE21 GLN A 32 -13.662 10.777 -5.740 1.00 3.66 H new ATOM 0 HE22 GLN A 32 -14.073 12.002 -6.945 1.00 3.66 H new ATOM 495 N PHE A 33 -7.736 11.703 -4.344 1.00 1.87 N ATOM 496 CA PHE A 33 -7.087 12.374 -3.215 1.00 2.16 C ATOM 497 C PHE A 33 -6.407 13.675 -3.634 1.00 3.30 C ATOM 498 O PHE A 33 -6.792 14.757 -3.221 1.00 5.00 O ATOM 499 CB PHE A 33 -6.157 11.392 -2.481 1.00 1.88 C ATOM 500 CG PHE A 33 -6.892 10.211 -1.865 1.00 1.39 C ATOM 501 CD1 PHE A 33 -7.746 10.411 -0.762 1.00 2.11 C ATOM 502 CD2 PHE A 33 -6.756 8.922 -2.414 1.00 2.26 C ATOM 503 CE1 PHE A 33 -8.463 9.330 -0.216 1.00 2.00 C ATOM 504 CE2 PHE A 33 -7.477 7.842 -1.872 1.00 2.07 C ATOM 505 CZ PHE A 33 -8.330 8.045 -0.772 1.00 1.21 C ATOM 0 H PHE A 33 -7.144 11.020 -4.816 1.00 1.87 H new ATOM 0 HA PHE A 33 -7.850 12.681 -2.500 1.00 2.16 H new ATOM 0 HB2 PHE A 33 -5.408 11.020 -3.181 1.00 1.88 H new ATOM 0 HB3 PHE A 33 -5.622 11.927 -1.696 1.00 1.88 H new ATOM 0 HD1 PHE A 33 -7.851 11.397 -0.334 1.00 2.11 H new ATOM 0 HD2 PHE A 33 -6.096 8.761 -3.254 1.00 2.26 H new ATOM 0 HE1 PHE A 33 -9.115 9.487 0.630 1.00 2.00 H new ATOM 0 HE2 PHE A 33 -7.375 6.856 -2.301 1.00 2.07 H new ATOM 0 HZ PHE A 33 -8.882 7.215 -0.355 1.00 1.21 H new ATOM 515 N GLN A 34 -5.394 13.482 -4.456 1.00 1.66 N ATOM 516 CA GLN A 34 -4.537 14.456 -5.152 1.00 2.14 C ATOM 517 C GLN A 34 -4.230 15.738 -4.352 1.00 2.55 C ATOM 518 O GLN A 34 -4.565 16.854 -4.733 1.00 4.32 O ATOM 519 CB GLN A 34 -5.112 14.676 -6.570 1.00 2.40 C ATOM 520 CG GLN A 34 -4.062 14.605 -7.687 1.00 1.97 C ATOM 521 CD GLN A 34 -3.540 15.977 -8.119 1.00 1.84 C ATOM 522 OE1 GLN A 34 -3.977 16.557 -9.102 1.00 2.50 O ATOM 523 NE2 GLN A 34 -2.571 16.533 -7.427 1.00 2.50 N ATOM 0 H GLN A 34 -5.109 12.530 -4.687 1.00 1.66 H new ATOM 0 HA GLN A 34 -3.534 14.041 -5.251 1.00 2.14 H new ATOM 0 HB2 GLN A 34 -5.881 13.927 -6.760 1.00 2.40 H new ATOM 0 HB3 GLN A 34 -5.600 15.650 -6.606 1.00 2.40 H new ATOM 0 HG2 GLN A 34 -3.224 13.996 -7.349 1.00 1.97 H new ATOM 0 HG3 GLN A 34 -4.495 14.101 -8.551 1.00 1.97 H new ATOM 0 HE21 GLN A 34 -2.196 16.061 -6.604 1.00 2.50 H new ATOM 0 HE22 GLN A 34 -2.194 17.437 -7.713 1.00 2.50 H new ATOM 532 N ASP A 35 -3.552 15.523 -3.224 1.00 1.29 N ATOM 533 CA ASP A 35 -3.350 16.463 -2.110 1.00 1.56 C ATOM 534 C ASP A 35 -2.418 15.796 -1.089 1.00 1.50 C ATOM 535 O ASP A 35 -1.335 16.278 -0.758 1.00 1.75 O ATOM 536 CB ASP A 35 -4.729 16.808 -1.483 1.00 1.90 C ATOM 537 CG ASP A 35 -4.701 17.486 -0.101 1.00 2.28 C ATOM 538 OD1 ASP A 35 -3.735 18.207 0.220 1.00 2.55 O ATOM 539 OD2 ASP A 35 -5.633 17.238 0.703 1.00 3.63 O ATOM 0 H ASP A 35 -3.096 14.627 -3.048 1.00 1.29 H new ATOM 0 HA ASP A 35 -2.894 17.393 -2.450 1.00 1.56 H new ATOM 0 HB2 ASP A 35 -5.265 17.460 -2.173 1.00 1.90 H new ATOM 0 HB3 ASP A 35 -5.307 15.888 -1.401 1.00 1.90 H new ATOM 544 N LYS A 36 -2.832 14.616 -0.620 1.00 1.31 N ATOM 545 CA LYS A 36 -2.285 14.035 0.614 1.00 1.23 C ATOM 546 C LYS A 36 -1.153 13.019 0.369 1.00 1.36 C ATOM 547 O LYS A 36 -0.518 12.998 -0.688 1.00 1.50 O ATOM 548 CB LYS A 36 -3.443 13.569 1.514 1.00 1.40 C ATOM 549 CG LYS A 36 -4.273 14.791 1.880 1.00 1.76 C ATOM 550 CD LYS A 36 -4.702 14.722 3.331 1.00 1.72 C ATOM 551 CE LYS A 36 -5.814 15.726 3.525 1.00 2.09 C ATOM 552 NZ LYS A 36 -5.304 17.117 3.456 1.00 2.31 N ATOM 0 H LYS A 36 -3.543 14.043 -1.074 1.00 1.31 H new ATOM 0 HA LYS A 36 -1.756 14.805 1.176 1.00 1.23 H new ATOM 0 HB2 LYS A 36 -4.057 12.833 0.995 1.00 1.40 H new ATOM 0 HB3 LYS A 36 -3.058 13.087 2.412 1.00 1.40 H new ATOM 0 HG2 LYS A 36 -3.693 15.698 1.708 1.00 1.76 H new ATOM 0 HG3 LYS A 36 -5.151 14.848 1.237 1.00 1.76 H new ATOM 0 HD2 LYS A 36 -5.044 13.718 3.582 1.00 1.72 H new ATOM 0 HD3 LYS A 36 -3.863 14.947 3.990 1.00 1.72 H new ATOM 0 HE2 LYS A 36 -6.577 15.578 2.761 1.00 2.09 H new ATOM 0 HE3 LYS A 36 -6.293 15.560 4.490 1.00 2.09 H new ATOM 0 HZ1 LYS A 36 -5.939 17.746 3.987 1.00 2.31 H new ATOM 0 HZ2 LYS A 36 -4.350 17.158 3.869 1.00 2.31 H new ATOM 0 HZ3 LYS A 36 -5.264 17.423 2.463 1.00 2.31 H new ATOM 566 N VAL A 37 -0.867 12.194 1.376 1.00 1.27 N ATOM 567 CA VAL A 37 0.110 11.101 1.309 1.00 1.33 C ATOM 568 C VAL A 37 -0.686 9.813 1.401 1.00 1.69 C ATOM 569 O VAL A 37 -1.602 9.719 2.219 1.00 2.12 O ATOM 570 CB VAL A 37 1.149 11.132 2.454 1.00 1.31 C ATOM 571 CG1 VAL A 37 2.243 10.064 2.274 1.00 1.55 C ATOM 572 CG2 VAL A 37 1.835 12.500 2.583 1.00 1.38 C ATOM 0 H VAL A 37 -1.320 12.267 2.287 1.00 1.27 H new ATOM 0 HA VAL A 37 0.677 11.193 0.383 1.00 1.33 H new ATOM 0 HB VAL A 37 0.580 10.925 3.360 1.00 1.31 H new ATOM 0 HG11 VAL A 37 2.950 10.124 3.102 1.00 1.55 H new ATOM 0 HG12 VAL A 37 1.786 9.074 2.258 1.00 1.55 H new ATOM 0 HG13 VAL A 37 2.769 10.236 1.335 1.00 1.55 H new ATOM 0 HG21 VAL A 37 2.555 12.470 3.401 1.00 1.38 H new ATOM 0 HG22 VAL A 37 2.351 12.737 1.653 1.00 1.38 H new ATOM 0 HG23 VAL A 37 1.086 13.265 2.787 1.00 1.38 H new ATOM 582 N VAL A 38 -0.334 8.830 0.581 1.00 1.03 N ATOM 583 CA VAL A 38 -0.848 7.473 0.731 1.00 0.87 C ATOM 584 C VAL A 38 0.284 6.453 0.687 1.00 0.95 C ATOM 585 O VAL A 38 1.285 6.643 -0.014 1.00 0.84 O ATOM 586 CB VAL A 38 -1.966 7.129 -0.272 1.00 1.22 C ATOM 587 CG1 VAL A 38 -3.241 7.949 -0.015 1.00 2.21 C ATOM 588 CG2 VAL A 38 -1.539 7.316 -1.731 1.00 2.19 C ATOM 0 H VAL A 38 0.310 8.949 -0.201 1.00 1.03 H new ATOM 0 HA VAL A 38 -1.313 7.425 1.716 1.00 0.87 H new ATOM 0 HB VAL A 38 -2.177 6.072 -0.110 1.00 1.22 H new ATOM 0 HG11 VAL A 38 -4.003 7.675 -0.745 1.00 2.21 H new ATOM 0 HG12 VAL A 38 -3.610 7.743 0.990 1.00 2.21 H new ATOM 0 HG13 VAL A 38 -3.015 9.011 -0.108 1.00 2.21 H new ATOM 0 HG21 VAL A 38 -2.369 7.058 -2.389 1.00 2.19 H new ATOM 0 HG22 VAL A 38 -1.254 8.355 -1.896 1.00 2.19 H new ATOM 0 HG23 VAL A 38 -0.690 6.668 -1.947 1.00 2.19 H new ATOM 598 N LEU A 39 0.107 5.393 1.476 1.00 0.70 N ATOM 599 CA LEU A 39 1.003 4.242 1.549 1.00 0.60 C ATOM 600 C LEU A 39 0.266 3.046 0.952 1.00 1.09 C ATOM 601 O LEU A 39 -0.751 2.594 1.481 1.00 1.23 O ATOM 602 CB LEU A 39 1.426 4.008 3.009 1.00 0.64 C ATOM 603 CG LEU A 39 2.311 5.150 3.554 1.00 1.09 C ATOM 604 CD1 LEU A 39 2.348 5.114 5.087 1.00 1.64 C ATOM 605 CD2 LEU A 39 3.737 5.083 2.992 1.00 1.73 C ATOM 0 H LEU A 39 -0.693 5.311 2.103 1.00 0.70 H new ATOM 0 HA LEU A 39 1.919 4.407 0.982 1.00 0.60 H new ATOM 0 HB2 LEU A 39 0.536 3.912 3.632 1.00 0.64 H new ATOM 0 HB3 LEU A 39 1.968 3.065 3.081 1.00 0.64 H new ATOM 0 HG LEU A 39 1.867 6.091 3.227 1.00 1.09 H new ATOM 0 HD11 LEU A 39 2.976 5.925 5.455 1.00 1.64 H new ATOM 0 HD12 LEU A 39 1.337 5.231 5.478 1.00 1.64 H new ATOM 0 HD13 LEU A 39 2.757 4.160 5.419 1.00 1.64 H new ATOM 0 HD21 LEU A 39 4.328 5.903 3.400 1.00 1.73 H new ATOM 0 HD22 LEU A 39 4.194 4.133 3.271 1.00 1.73 H new ATOM 0 HD23 LEU A 39 3.704 5.165 1.906 1.00 1.73 H new ATOM 617 N LEU A 40 0.766 2.593 -0.193 1.00 0.55 N ATOM 618 CA LEU A 40 0.127 1.571 -1.025 1.00 0.50 C ATOM 619 C LEU A 40 0.823 0.221 -0.837 1.00 0.91 C ATOM 620 O LEU A 40 2.049 0.157 -0.936 1.00 1.04 O ATOM 621 CB LEU A 40 0.187 2.039 -2.489 1.00 0.57 C ATOM 622 CG LEU A 40 -0.775 1.294 -3.431 1.00 1.17 C ATOM 623 CD1 LEU A 40 -2.222 1.716 -3.153 1.00 1.70 C ATOM 624 CD2 LEU A 40 -0.439 1.629 -4.884 1.00 2.41 C ATOM 0 H LEU A 40 1.647 2.932 -0.580 1.00 0.55 H new ATOM 0 HA LEU A 40 -0.914 1.437 -0.733 1.00 0.50 H new ATOM 0 HB2 LEU A 40 -0.038 3.105 -2.527 1.00 0.57 H new ATOM 0 HB3 LEU A 40 1.206 1.915 -2.857 1.00 0.57 H new ATOM 0 HG LEU A 40 -0.667 0.223 -3.259 1.00 1.17 H new ATOM 0 HD11 LEU A 40 -2.893 1.182 -3.826 1.00 1.70 H new ATOM 0 HD12 LEU A 40 -2.479 1.478 -2.121 1.00 1.70 H new ATOM 0 HD13 LEU A 40 -2.325 2.789 -3.314 1.00 1.70 H new ATOM 0 HD21 LEU A 40 -1.123 1.099 -5.547 1.00 2.41 H new ATOM 0 HD22 LEU A 40 -0.539 2.703 -5.042 1.00 2.41 H new ATOM 0 HD23 LEU A 40 0.585 1.324 -5.100 1.00 2.41 H new ATOM 636 N PHE A 41 0.048 -0.837 -0.590 1.00 0.51 N ATOM 637 CA PHE A 41 0.541 -2.188 -0.294 1.00 0.50 C ATOM 638 C PHE A 41 -0.314 -3.237 -1.016 1.00 1.34 C ATOM 639 O PHE A 41 -1.546 -3.156 -0.974 1.00 1.67 O ATOM 640 CB PHE A 41 0.492 -2.380 1.235 1.00 0.51 C ATOM 641 CG PHE A 41 0.992 -3.702 1.806 1.00 0.73 C ATOM 642 CD1 PHE A 41 2.090 -4.385 1.240 1.00 1.72 C ATOM 643 CD2 PHE A 41 0.395 -4.211 2.976 1.00 2.08 C ATOM 644 CE1 PHE A 41 2.584 -5.557 1.844 1.00 1.72 C ATOM 645 CE2 PHE A 41 0.885 -5.385 3.576 1.00 2.04 C ATOM 646 CZ PHE A 41 1.982 -6.057 3.010 1.00 1.07 C ATOM 0 H PHE A 41 -0.970 -0.778 -0.590 1.00 0.51 H new ATOM 0 HA PHE A 41 1.565 -2.312 -0.647 1.00 0.50 H new ATOM 0 HB2 PHE A 41 1.073 -1.578 1.691 1.00 0.51 H new ATOM 0 HB3 PHE A 41 -0.541 -2.247 1.555 1.00 0.51 H new ATOM 0 HD1 PHE A 41 2.553 -4.007 0.340 1.00 1.72 H new ATOM 0 HD2 PHE A 41 -0.446 -3.696 3.416 1.00 2.08 H new ATOM 0 HE1 PHE A 41 3.428 -6.073 1.410 1.00 1.72 H new ATOM 0 HE2 PHE A 41 0.419 -5.770 4.471 1.00 2.04 H new ATOM 0 HZ PHE A 41 2.361 -6.957 3.471 1.00 1.07 H new ATOM 656 N PHE A 42 0.321 -4.206 -1.681 1.00 0.60 N ATOM 657 CA PHE A 42 -0.355 -5.235 -2.480 1.00 0.62 C ATOM 658 C PHE A 42 -0.374 -6.585 -1.745 1.00 1.88 C ATOM 659 O PHE A 42 0.680 -7.097 -1.356 1.00 2.31 O ATOM 660 CB PHE A 42 0.323 -5.333 -3.856 1.00 0.69 C ATOM 661 CG PHE A 42 0.046 -4.137 -4.753 1.00 0.72 C ATOM 662 CD1 PHE A 42 0.723 -2.922 -4.544 1.00 2.11 C ATOM 663 CD2 PHE A 42 -0.898 -4.235 -5.795 1.00 2.02 C ATOM 664 CE1 PHE A 42 0.447 -1.810 -5.357 1.00 1.97 C ATOM 665 CE2 PHE A 42 -1.160 -3.128 -6.621 1.00 2.01 C ATOM 666 CZ PHE A 42 -0.494 -1.909 -6.397 1.00 0.87 C ATOM 0 H PHE A 42 1.337 -4.300 -1.680 1.00 0.60 H new ATOM 0 HA PHE A 42 -1.397 -4.953 -2.629 1.00 0.62 H new ATOM 0 HB2 PHE A 42 1.400 -5.431 -3.716 1.00 0.69 H new ATOM 0 HB3 PHE A 42 -0.017 -6.240 -4.357 1.00 0.69 H new ATOM 0 HD1 PHE A 42 1.457 -2.844 -3.756 1.00 2.11 H new ATOM 0 HD2 PHE A 42 -1.422 -5.165 -5.960 1.00 2.02 H new ATOM 0 HE1 PHE A 42 0.960 -0.876 -5.182 1.00 1.97 H new ATOM 0 HE2 PHE A 42 -1.873 -3.213 -7.428 1.00 2.01 H new ATOM 0 HZ PHE A 42 -0.705 -1.053 -7.021 1.00 0.87 H new ATOM 676 N GLY A 43 -1.574 -7.140 -1.529 1.00 0.69 N ATOM 677 CA GLY A 43 -1.779 -8.434 -0.873 1.00 0.81 C ATOM 678 C GLY A 43 -2.945 -9.288 -1.386 1.00 0.94 C ATOM 679 O GLY A 43 -3.878 -8.829 -2.047 1.00 1.02 O ATOM 0 H GLY A 43 -2.445 -6.691 -1.812 1.00 0.69 H new ATOM 0 HA2 GLY A 43 -0.862 -9.015 -0.972 1.00 0.81 H new ATOM 0 HA3 GLY A 43 -1.930 -8.256 0.192 1.00 0.81 H new ATOM 683 N PHE A 44 -2.884 -10.557 -0.965 1.00 1.03 N ATOM 684 CA PHE A 44 -3.898 -11.606 -1.159 1.00 1.25 C ATOM 685 C PHE A 44 -4.467 -12.143 0.162 1.00 1.82 C ATOM 686 O PHE A 44 -5.195 -13.133 0.154 1.00 3.08 O ATOM 687 CB PHE A 44 -3.207 -12.708 -1.991 1.00 1.41 C ATOM 688 CG PHE A 44 -4.060 -13.848 -2.522 1.00 1.78 C ATOM 689 CD1 PHE A 44 -5.040 -13.605 -3.501 1.00 3.30 C ATOM 690 CD2 PHE A 44 -3.806 -15.171 -2.104 1.00 2.46 C ATOM 691 CE1 PHE A 44 -5.749 -14.681 -4.067 1.00 4.23 C ATOM 692 CE2 PHE A 44 -4.537 -16.241 -2.652 1.00 3.31 C ATOM 693 CZ PHE A 44 -5.502 -15.995 -3.641 1.00 3.96 C ATOM 0 H PHE A 44 -2.076 -10.902 -0.447 1.00 1.03 H new ATOM 0 HA PHE A 44 -4.771 -11.206 -1.676 1.00 1.25 H new ATOM 0 HB2 PHE A 44 -2.724 -12.229 -2.843 1.00 1.41 H new ATOM 0 HB3 PHE A 44 -2.416 -13.141 -1.378 1.00 1.41 H new ATOM 0 HD1 PHE A 44 -5.248 -12.594 -3.818 1.00 3.30 H new ATOM 0 HD2 PHE A 44 -3.047 -15.363 -1.360 1.00 2.46 H new ATOM 0 HE1 PHE A 44 -6.487 -14.494 -4.833 1.00 4.23 H new ATOM 0 HE2 PHE A 44 -4.356 -17.250 -2.312 1.00 3.31 H new ATOM 0 HZ PHE A 44 -6.054 -16.816 -4.074 1.00 3.96 H new ATOM 703 N THR A 45 -4.092 -11.519 1.296 1.00 1.65 N ATOM 704 CA THR A 45 -4.743 -11.591 2.628 1.00 1.50 C ATOM 705 C THR A 45 -4.475 -12.907 3.375 1.00 1.77 C ATOM 706 O THR A 45 -4.106 -12.890 4.547 1.00 2.35 O ATOM 707 CB THR A 45 -6.233 -11.235 2.467 1.00 1.61 C ATOM 708 OG1 THR A 45 -6.273 -10.008 1.788 1.00 2.70 O ATOM 709 CG2 THR A 45 -6.936 -10.943 3.774 1.00 1.86 C ATOM 0 H THR A 45 -3.274 -10.911 1.312 1.00 1.65 H new ATOM 0 HA THR A 45 -4.289 -10.852 3.289 1.00 1.50 H new ATOM 0 HB THR A 45 -6.713 -12.082 1.976 1.00 1.61 H new ATOM 0 HG1 THR A 45 -6.402 -10.168 0.830 1.00 2.70 H new ATOM 0 HG21 THR A 45 -7.981 -10.701 3.579 1.00 1.86 H new ATOM 0 HG22 THR A 45 -6.881 -11.819 4.420 1.00 1.86 H new ATOM 0 HG23 THR A 45 -6.453 -10.098 4.266 1.00 1.86 H new ATOM 717 N ARG A 46 -4.538 -14.025 2.642 1.00 1.71 N ATOM 718 CA ARG A 46 -4.098 -15.416 2.868 1.00 1.96 C ATOM 719 C ARG A 46 -2.587 -15.535 3.184 1.00 1.99 C ATOM 720 O ARG A 46 -1.850 -16.291 2.555 1.00 2.83 O ATOM 721 CB ARG A 46 -4.563 -16.182 1.593 1.00 2.35 C ATOM 722 CG ARG A 46 -4.281 -17.692 1.408 1.00 3.47 C ATOM 723 CD ARG A 46 -2.987 -17.998 0.620 1.00 4.80 C ATOM 724 NE ARG A 46 -3.164 -18.966 -0.482 1.00 5.91 N ATOM 725 CZ ARG A 46 -2.275 -19.241 -1.433 1.00 7.24 C ATOM 726 NH1 ARG A 46 -1.141 -18.564 -1.551 1.00 7.75 N ATOM 727 NH2 ARG A 46 -2.531 -20.217 -2.274 1.00 8.31 N ATOM 0 H ARG A 46 -4.972 -13.965 1.721 1.00 1.71 H new ATOM 0 HA ARG A 46 -4.541 -15.852 3.763 1.00 1.96 H new ATOM 0 HB2 ARG A 46 -5.643 -16.050 1.521 1.00 2.35 H new ATOM 0 HB3 ARG A 46 -4.122 -15.670 0.738 1.00 2.35 H new ATOM 0 HG2 ARG A 46 -4.216 -18.162 2.389 1.00 3.47 H new ATOM 0 HG3 ARG A 46 -5.125 -18.148 0.891 1.00 3.47 H new ATOM 0 HD2 ARG A 46 -2.595 -17.067 0.211 1.00 4.80 H new ATOM 0 HD3 ARG A 46 -2.237 -18.384 1.311 1.00 4.80 H new ATOM 0 HE ARG A 46 -4.050 -19.470 -0.517 1.00 5.91 H new ATOM 0 HH11 ARG A 46 -0.929 -17.807 -0.901 1.00 7.75 H new ATOM 0 HH12 ARG A 46 -0.481 -18.800 -2.292 1.00 7.75 H new ATOM 0 HH21 ARG A 46 -3.398 -20.748 -2.191 1.00 8.31 H new ATOM 0 HH22 ARG A 46 -1.863 -20.444 -3.010 1.00 8.31 H new ATOM 741 N CYS A 47 -2.082 -14.746 4.128 1.00 1.74 N ATOM 742 CA CYS A 47 -0.679 -14.734 4.553 1.00 2.00 C ATOM 743 C CYS A 47 -0.452 -15.587 5.820 1.00 2.27 C ATOM 744 O CYS A 47 -1.423 -15.955 6.480 1.00 2.64 O ATOM 745 CB CYS A 47 -0.291 -13.260 4.775 1.00 2.33 C ATOM 746 SG CYS A 47 -0.138 -12.461 3.152 1.00 3.20 S ATOM 0 H CYS A 47 -2.655 -14.073 4.638 1.00 1.74 H new ATOM 0 HA CYS A 47 -0.046 -15.183 3.788 1.00 2.00 H new ATOM 0 HB2 CYS A 47 -1.046 -12.755 5.377 1.00 2.33 H new ATOM 0 HB3 CYS A 47 0.650 -13.193 5.322 1.00 2.33 H new ATOM 0 HG CYS A 47 0.645 -11.428 3.249 1.00 3.20 H new ATOM 752 N PRO A 48 0.819 -15.822 6.210 1.00 2.29 N ATOM 753 CA PRO A 48 1.198 -15.907 7.606 1.00 2.70 C ATOM 754 C PRO A 48 1.202 -14.465 8.153 1.00 2.34 C ATOM 755 O PRO A 48 0.188 -13.780 8.041 1.00 2.60 O ATOM 756 CB PRO A 48 2.536 -16.653 7.607 1.00 3.52 C ATOM 757 CG PRO A 48 3.179 -16.275 6.273 1.00 3.26 C ATOM 758 CD PRO A 48 2.028 -15.761 5.398 1.00 2.71 C ATOM 0 HA PRO A 48 0.530 -16.458 8.267 1.00 2.70 H new ATOM 0 HB2 PRO A 48 3.159 -16.351 8.449 1.00 3.52 H new ATOM 0 HB3 PRO A 48 2.391 -17.730 7.688 1.00 3.52 H new ATOM 0 HG2 PRO A 48 3.943 -15.509 6.408 1.00 3.26 H new ATOM 0 HG3 PRO A 48 3.668 -17.135 5.815 1.00 3.26 H new ATOM 0 HD2 PRO A 48 2.220 -14.740 5.068 1.00 2.71 H new ATOM 0 HD3 PRO A 48 1.922 -16.372 4.501 1.00 2.71 H new ATOM 766 N ASP A 49 2.309 -13.945 8.689 1.00 2.24 N ATOM 767 CA ASP A 49 2.236 -12.785 9.613 1.00 2.19 C ATOM 768 C ASP A 49 2.476 -11.456 8.881 1.00 1.80 C ATOM 769 O ASP A 49 2.366 -10.354 9.397 1.00 1.91 O ATOM 770 CB ASP A 49 3.215 -12.988 10.778 1.00 3.02 C ATOM 771 CG ASP A 49 2.608 -12.442 12.074 1.00 4.36 C ATOM 772 OD1 ASP A 49 2.618 -11.205 12.248 1.00 5.13 O ATOM 773 OD2 ASP A 49 2.098 -13.276 12.855 1.00 5.26 O ATOM 0 H ASP A 49 3.252 -14.291 8.511 1.00 2.24 H new ATOM 0 HA ASP A 49 1.227 -12.727 10.020 1.00 2.19 H new ATOM 0 HB2 ASP A 49 3.443 -14.048 10.892 1.00 3.02 H new ATOM 0 HB3 ASP A 49 4.156 -12.481 10.566 1.00 3.02 H new ATOM 778 N VAL A 50 2.780 -11.603 7.606 1.00 1.65 N ATOM 779 CA VAL A 50 3.342 -10.604 6.706 1.00 1.30 C ATOM 780 C VAL A 50 2.324 -9.521 6.314 1.00 1.25 C ATOM 781 O VAL A 50 2.704 -8.439 5.881 1.00 1.31 O ATOM 782 CB VAL A 50 3.943 -11.333 5.480 1.00 1.53 C ATOM 783 CG1 VAL A 50 4.919 -10.449 4.713 1.00 2.15 C ATOM 784 CG2 VAL A 50 4.726 -12.610 5.858 1.00 3.33 C ATOM 0 H VAL A 50 2.630 -12.493 7.131 1.00 1.65 H new ATOM 0 HA VAL A 50 4.134 -10.061 7.222 1.00 1.30 H new ATOM 0 HB VAL A 50 3.076 -11.589 4.871 1.00 1.53 H new ATOM 0 HG11 VAL A 50 5.317 -11.000 3.861 1.00 2.15 H new ATOM 0 HG12 VAL A 50 4.401 -9.558 4.359 1.00 2.15 H new ATOM 0 HG13 VAL A 50 5.738 -10.156 5.370 1.00 2.15 H new ATOM 0 HG21 VAL A 50 5.122 -13.075 4.955 1.00 3.33 H new ATOM 0 HG22 VAL A 50 5.549 -12.349 6.523 1.00 3.33 H new ATOM 0 HG23 VAL A 50 4.060 -13.309 6.363 1.00 3.33 H new ATOM 794 N CYS A 51 1.017 -9.784 6.469 1.00 1.33 N ATOM 795 CA CYS A 51 0.017 -8.716 6.591 1.00 1.43 C ATOM 796 C CYS A 51 0.031 -8.052 7.991 1.00 1.65 C ATOM 797 O CYS A 51 0.280 -6.847 8.043 1.00 1.77 O ATOM 798 CB CYS A 51 -1.366 -9.218 6.136 1.00 1.76 C ATOM 799 SG CYS A 51 -1.332 -9.433 4.336 1.00 1.63 S ATOM 0 H CYS A 51 0.630 -10.727 6.513 1.00 1.33 H new ATOM 0 HA CYS A 51 0.286 -7.907 5.912 1.00 1.43 H new ATOM 0 HB2 CYS A 51 -1.607 -10.161 6.626 1.00 1.76 H new ATOM 0 HB3 CYS A 51 -2.140 -8.505 6.418 1.00 1.76 H new ATOM 0 HG CYS A 51 -0.920 -10.632 4.050 1.00 1.63 H new ATOM 805 N PRO A 52 -0.258 -8.771 9.098 1.00 1.43 N ATOM 806 CA PRO A 52 -0.487 -8.140 10.392 1.00 1.54 C ATOM 807 C PRO A 52 0.738 -7.427 10.974 1.00 1.70 C ATOM 808 O PRO A 52 0.551 -6.346 11.522 1.00 1.60 O ATOM 809 CB PRO A 52 -1.041 -9.224 11.327 1.00 1.81 C ATOM 810 CG PRO A 52 -0.672 -10.536 10.648 1.00 1.80 C ATOM 811 CD PRO A 52 -0.684 -10.164 9.168 1.00 1.58 C ATOM 0 HA PRO A 52 -1.204 -7.329 10.270 1.00 1.54 H new ATOM 0 HB2 PRO A 52 -0.600 -9.154 12.321 1.00 1.81 H new ATOM 0 HB3 PRO A 52 -2.120 -9.130 11.449 1.00 1.81 H new ATOM 0 HG2 PRO A 52 0.306 -10.896 10.967 1.00 1.80 H new ATOM 0 HG3 PRO A 52 -1.390 -11.324 10.873 1.00 1.80 H new ATOM 0 HD2 PRO A 52 -0.012 -10.806 8.599 1.00 1.58 H new ATOM 0 HD3 PRO A 52 -1.680 -10.289 8.743 1.00 1.58 H new ATOM 819 N THR A 53 1.966 -7.954 10.844 1.00 1.44 N ATOM 820 CA THR A 53 3.179 -7.280 11.345 1.00 1.45 C ATOM 821 C THR A 53 3.549 -6.056 10.509 1.00 1.39 C ATOM 822 O THR A 53 3.711 -4.982 11.092 1.00 1.34 O ATOM 823 CB THR A 53 4.319 -8.288 11.534 1.00 1.72 C ATOM 824 OG1 THR A 53 3.994 -9.017 12.697 1.00 2.95 O ATOM 825 CG2 THR A 53 5.664 -7.625 11.832 1.00 2.22 C ATOM 0 H THR A 53 2.148 -8.851 10.393 1.00 1.44 H new ATOM 0 HA THR A 53 2.967 -6.874 12.334 1.00 1.45 H new ATOM 0 HB THR A 53 4.415 -8.874 10.620 1.00 1.72 H new ATOM 0 HG1 THR A 53 3.581 -9.869 12.444 1.00 2.95 H new ATOM 0 HG21 THR A 53 6.428 -8.392 11.955 1.00 2.22 H new ATOM 0 HG22 THR A 53 5.938 -6.969 11.005 1.00 2.22 H new ATOM 0 HG23 THR A 53 5.586 -7.040 12.748 1.00 2.22 H new ATOM 833 N THR A 54 3.565 -6.140 9.169 1.00 1.08 N ATOM 834 CA THR A 54 3.681 -4.968 8.271 1.00 0.91 C ATOM 835 C THR A 54 2.630 -3.910 8.596 1.00 1.07 C ATOM 836 O THR A 54 2.977 -2.744 8.774 1.00 1.04 O ATOM 837 CB THR A 54 3.610 -5.398 6.799 1.00 0.96 C ATOM 838 OG1 THR A 54 4.814 -6.025 6.434 1.00 1.18 O ATOM 839 CG2 THR A 54 3.462 -4.219 5.832 1.00 1.06 C ATOM 0 H THR A 54 3.498 -7.027 8.670 1.00 1.08 H new ATOM 0 HA THR A 54 4.658 -4.514 8.439 1.00 0.91 H new ATOM 0 HB THR A 54 2.739 -6.050 6.726 1.00 0.96 H new ATOM 0 HG1 THR A 54 5.216 -6.446 7.223 1.00 1.18 H new ATOM 0 HG21 THR A 54 3.418 -4.591 4.808 1.00 1.06 H new ATOM 0 HG22 THR A 54 2.546 -3.674 6.060 1.00 1.06 H new ATOM 0 HG23 THR A 54 4.317 -3.551 5.939 1.00 1.06 H new ATOM 847 N LEU A 55 1.357 -4.290 8.748 1.00 0.94 N ATOM 848 CA LEU A 55 0.291 -3.360 9.130 1.00 0.93 C ATOM 849 C LEU A 55 0.490 -2.819 10.555 1.00 1.39 C ATOM 850 O LEU A 55 0.146 -1.664 10.799 1.00 1.59 O ATOM 851 CB LEU A 55 -1.090 -4.032 8.975 1.00 0.99 C ATOM 852 CG LEU A 55 -1.545 -4.293 7.522 1.00 0.95 C ATOM 853 CD1 LEU A 55 -2.748 -5.254 7.507 1.00 1.63 C ATOM 854 CD2 LEU A 55 -1.955 -2.999 6.801 1.00 1.34 C ATOM 0 H LEU A 55 1.038 -5.249 8.610 1.00 0.94 H new ATOM 0 HA LEU A 55 0.336 -2.505 8.456 1.00 0.93 H new ATOM 0 HB2 LEU A 55 -1.074 -4.983 9.508 1.00 0.99 H new ATOM 0 HB3 LEU A 55 -1.836 -3.405 9.464 1.00 0.99 H new ATOM 0 HG LEU A 55 -0.694 -4.730 7.000 1.00 0.95 H new ATOM 0 HD11 LEU A 55 -3.060 -5.430 6.478 1.00 1.63 H new ATOM 0 HD12 LEU A 55 -2.464 -6.200 7.967 1.00 1.63 H new ATOM 0 HD13 LEU A 55 -3.573 -4.812 8.066 1.00 1.63 H new ATOM 0 HD21 LEU A 55 -2.267 -3.233 5.783 1.00 1.34 H new ATOM 0 HD22 LEU A 55 -2.782 -2.531 7.336 1.00 1.34 H new ATOM 0 HD23 LEU A 55 -1.107 -2.314 6.772 1.00 1.34 H new ATOM 866 N LEU A 56 1.073 -3.586 11.488 1.00 1.00 N ATOM 867 CA LEU A 56 1.412 -3.110 12.831 1.00 1.03 C ATOM 868 C LEU A 56 2.588 -2.125 12.803 1.00 1.30 C ATOM 869 O LEU A 56 2.575 -1.176 13.580 1.00 1.42 O ATOM 870 CB LEU A 56 1.671 -4.292 13.780 1.00 1.16 C ATOM 871 CG LEU A 56 1.715 -3.854 15.263 1.00 1.53 C ATOM 872 CD1 LEU A 56 1.009 -4.887 16.153 1.00 1.77 C ATOM 873 CD2 LEU A 56 3.159 -3.686 15.768 1.00 1.82 C ATOM 0 H LEU A 56 1.323 -4.562 11.327 1.00 1.00 H new ATOM 0 HA LEU A 56 0.555 -2.560 13.219 1.00 1.03 H new ATOM 0 HB2 LEU A 56 0.889 -5.040 13.647 1.00 1.16 H new ATOM 0 HB3 LEU A 56 2.615 -4.768 13.515 1.00 1.16 H new ATOM 0 HG LEU A 56 1.204 -2.893 15.321 1.00 1.53 H new ATOM 0 HD11 LEU A 56 1.051 -4.561 17.192 1.00 1.77 H new ATOM 0 HD12 LEU A 56 -0.032 -4.983 15.844 1.00 1.77 H new ATOM 0 HD13 LEU A 56 1.506 -5.852 16.055 1.00 1.77 H new ATOM 0 HD21 LEU A 56 3.145 -3.378 16.813 1.00 1.82 H new ATOM 0 HD22 LEU A 56 3.689 -4.634 15.676 1.00 1.82 H new ATOM 0 HD23 LEU A 56 3.667 -2.927 15.173 1.00 1.82 H new ATOM 885 N ALA A 57 3.570 -2.294 11.916 1.00 0.98 N ATOM 886 CA ALA A 57 4.656 -1.337 11.701 1.00 0.97 C ATOM 887 C ALA A 57 4.147 -0.044 11.042 1.00 1.09 C ATOM 888 O ALA A 57 4.479 1.048 11.505 1.00 1.31 O ATOM 889 CB ALA A 57 5.746 -2.019 10.873 1.00 0.98 C ATOM 0 H ALA A 57 3.634 -3.116 11.315 1.00 0.98 H new ATOM 0 HA ALA A 57 5.076 -1.035 12.660 1.00 0.97 H new ATOM 0 HB1 ALA A 57 6.565 -1.320 10.703 1.00 0.98 H new ATOM 0 HB2 ALA A 57 6.119 -2.891 11.410 1.00 0.98 H new ATOM 0 HB3 ALA A 57 5.332 -2.333 9.915 1.00 0.98 H new ATOM 895 N LEU A 58 3.273 -0.149 10.032 1.00 0.92 N ATOM 896 CA LEU A 58 2.597 0.992 9.395 1.00 0.94 C ATOM 897 C LEU A 58 1.750 1.777 10.409 1.00 1.37 C ATOM 898 O LEU A 58 1.848 2.998 10.489 1.00 1.53 O ATOM 899 CB LEU A 58 1.740 0.477 8.220 1.00 0.95 C ATOM 900 CG LEU A 58 2.552 -0.018 7.003 1.00 1.00 C ATOM 901 CD1 LEU A 58 1.653 -0.831 6.060 1.00 1.19 C ATOM 902 CD2 LEU A 58 3.156 1.153 6.217 1.00 1.45 C ATOM 0 H LEU A 58 3.010 -1.047 9.626 1.00 0.92 H new ATOM 0 HA LEU A 58 3.346 1.685 9.012 1.00 0.94 H new ATOM 0 HB2 LEU A 58 1.110 -0.338 8.576 1.00 0.95 H new ATOM 0 HB3 LEU A 58 1.074 1.276 7.895 1.00 0.95 H new ATOM 0 HG LEU A 58 3.360 -0.642 7.384 1.00 1.00 H new ATOM 0 HD11 LEU A 58 2.237 -1.174 5.206 1.00 1.19 H new ATOM 0 HD12 LEU A 58 1.250 -1.692 6.594 1.00 1.19 H new ATOM 0 HD13 LEU A 58 0.832 -0.205 5.710 1.00 1.19 H new ATOM 0 HD21 LEU A 58 3.721 0.768 5.368 1.00 1.45 H new ATOM 0 HD22 LEU A 58 2.357 1.801 5.858 1.00 1.45 H new ATOM 0 HD23 LEU A 58 3.821 1.723 6.866 1.00 1.45 H new ATOM 914 N LYS A 59 0.998 1.070 11.256 1.00 0.92 N ATOM 915 CA LYS A 59 0.421 1.578 12.508 1.00 1.04 C ATOM 916 C LYS A 59 1.451 2.331 13.375 1.00 1.15 C ATOM 917 O LYS A 59 1.223 3.496 13.708 1.00 1.20 O ATOM 918 CB LYS A 59 -0.247 0.407 13.228 1.00 1.51 C ATOM 919 CG LYS A 59 -0.366 0.651 14.732 1.00 2.17 C ATOM 920 CD LYS A 59 -1.092 -0.485 15.415 1.00 1.52 C ATOM 921 CE LYS A 59 -2.604 -0.375 15.266 1.00 1.43 C ATOM 922 NZ LYS A 59 -3.172 0.738 16.070 1.00 1.92 N ATOM 0 H LYS A 59 0.764 0.092 11.085 1.00 0.92 H new ATOM 0 HA LYS A 59 -0.334 2.333 12.289 1.00 1.04 H new ATOM 0 HB2 LYS A 59 -1.239 0.242 12.808 1.00 1.51 H new ATOM 0 HB3 LYS A 59 0.329 -0.502 13.053 1.00 1.51 H new ATOM 0 HG2 LYS A 59 0.628 0.763 15.165 1.00 2.17 H new ATOM 0 HG3 LYS A 59 -0.898 1.585 14.910 1.00 2.17 H new ATOM 0 HD2 LYS A 59 -0.755 -1.433 14.996 1.00 1.52 H new ATOM 0 HD3 LYS A 59 -0.833 -0.495 16.474 1.00 1.52 H new ATOM 0 HE2 LYS A 59 -2.853 -0.225 14.216 1.00 1.43 H new ATOM 0 HE3 LYS A 59 -3.066 -1.314 15.572 1.00 1.43 H new ATOM 0 HZ1 LYS A 59 -4.189 0.578 16.215 1.00 1.92 H new ATOM 0 HZ2 LYS A 59 -2.693 0.780 16.992 1.00 1.92 H new ATOM 0 HZ3 LYS A 59 -3.032 1.637 15.566 1.00 1.92 H new ATOM 936 N ARG A 60 2.549 1.669 13.760 1.00 0.99 N ATOM 937 CA ARG A 60 3.531 2.211 14.706 1.00 1.05 C ATOM 938 C ARG A 60 4.213 3.464 14.152 1.00 1.35 C ATOM 939 O ARG A 60 4.528 4.351 14.938 1.00 1.40 O ATOM 940 CB ARG A 60 4.583 1.150 15.061 1.00 1.11 C ATOM 941 CG ARG A 60 4.104 0.040 16.012 1.00 1.21 C ATOM 942 CD ARG A 60 4.251 0.409 17.491 1.00 1.60 C ATOM 943 NE ARG A 60 3.949 -0.759 18.343 1.00 2.28 N ATOM 944 CZ ARG A 60 4.494 -1.069 19.516 1.00 3.26 C ATOM 945 NH1 ARG A 60 5.384 -0.297 20.105 1.00 3.44 N ATOM 946 NH2 ARG A 60 4.150 -2.188 20.122 1.00 4.63 N ATOM 0 H ARG A 60 2.782 0.736 13.421 1.00 0.99 H new ATOM 0 HA ARG A 60 2.993 2.493 15.611 1.00 1.05 H new ATOM 0 HB2 ARG A 60 4.935 0.688 14.138 1.00 1.11 H new ATOM 0 HB3 ARG A 60 5.440 1.649 15.514 1.00 1.11 H new ATOM 0 HG2 ARG A 60 3.058 -0.183 15.802 1.00 1.21 H new ATOM 0 HG3 ARG A 60 4.670 -0.870 15.813 1.00 1.21 H new ATOM 0 HD2 ARG A 60 5.265 0.758 17.687 1.00 1.60 H new ATOM 0 HD3 ARG A 60 3.578 1.231 17.737 1.00 1.60 H new ATOM 0 HE ARG A 60 3.240 -1.403 17.991 1.00 2.28 H new ATOM 0 HH11 ARG A 60 5.678 0.573 19.661 1.00 3.44 H new ATOM 0 HH12 ARG A 60 5.779 -0.569 21.005 1.00 3.44 H new ATOM 0 HH21 ARG A 60 3.468 -2.812 19.691 1.00 4.63 H new ATOM 0 HH22 ARG A 60 4.566 -2.429 21.022 1.00 4.63 H new ATOM 960 N ALA A 61 4.404 3.553 12.833 1.00 0.89 N ATOM 961 CA ALA A 61 4.868 4.757 12.156 1.00 0.86 C ATOM 962 C ALA A 61 3.811 5.874 12.230 1.00 0.98 C ATOM 963 O ALA A 61 4.125 6.957 12.714 1.00 1.05 O ATOM 964 CB ALA A 61 5.246 4.388 10.715 1.00 0.84 C ATOM 0 H ALA A 61 4.236 2.773 12.198 1.00 0.89 H new ATOM 0 HA ALA A 61 5.753 5.155 12.653 1.00 0.86 H new ATOM 0 HB1 ALA A 61 5.596 5.278 10.192 1.00 0.84 H new ATOM 0 HB2 ALA A 61 6.038 3.639 10.727 1.00 0.84 H new ATOM 0 HB3 ALA A 61 4.373 3.985 10.202 1.00 0.84 H new ATOM 970 N TYR A 62 2.562 5.608 11.817 1.00 0.83 N ATOM 971 CA TYR A 62 1.476 6.599 11.840 1.00 0.93 C ATOM 972 C TYR A 62 1.201 7.161 13.245 1.00 1.24 C ATOM 973 O TYR A 62 1.118 8.375 13.412 1.00 1.44 O ATOM 974 CB TYR A 62 0.189 5.989 11.255 1.00 1.01 C ATOM 975 CG TYR A 62 -0.972 6.974 11.209 1.00 1.58 C ATOM 976 CD1 TYR A 62 -1.782 7.177 12.345 1.00 2.84 C ATOM 977 CD2 TYR A 62 -1.208 7.733 10.048 1.00 2.66 C ATOM 978 CE1 TYR A 62 -2.778 8.176 12.345 1.00 3.31 C ATOM 979 CE2 TYR A 62 -2.219 8.715 10.033 1.00 3.09 C ATOM 980 CZ TYR A 62 -2.988 8.958 11.191 1.00 2.82 C ATOM 981 OH TYR A 62 -3.923 9.946 11.195 1.00 3.50 O ATOM 0 H TYR A 62 2.277 4.697 11.457 1.00 0.83 H new ATOM 0 HA TYR A 62 1.804 7.437 11.224 1.00 0.93 H new ATOM 0 HB2 TYR A 62 0.391 5.628 10.247 1.00 1.01 H new ATOM 0 HB3 TYR A 62 -0.100 5.124 11.852 1.00 1.01 H new ATOM 0 HD1 TYR A 62 -1.639 6.563 13.222 1.00 2.84 H new ATOM 0 HD2 TYR A 62 -0.612 7.562 9.164 1.00 2.66 H new ATOM 0 HE1 TYR A 62 -3.378 8.341 13.227 1.00 3.31 H new ATOM 0 HE2 TYR A 62 -2.406 9.283 9.133 1.00 3.09 H new ATOM 0 HH TYR A 62 -3.681 10.628 10.534 1.00 3.50 H new ATOM 991 N GLU A 63 1.070 6.288 14.246 1.00 0.98 N ATOM 992 CA GLU A 63 0.764 6.657 15.635 1.00 1.17 C ATOM 993 C GLU A 63 1.951 7.395 16.298 1.00 1.35 C ATOM 994 O GLU A 63 1.785 8.084 17.299 1.00 1.68 O ATOM 995 CB GLU A 63 0.252 5.405 16.391 1.00 1.36 C ATOM 996 CG GLU A 63 -1.133 5.006 15.831 1.00 1.76 C ATOM 997 CD GLU A 63 -1.736 3.670 16.291 1.00 2.29 C ATOM 998 OE1 GLU A 63 -1.082 2.830 16.952 1.00 2.28 O ATOM 999 OE2 GLU A 63 -2.865 3.376 15.842 1.00 3.41 O ATOM 0 H GLU A 63 1.175 5.282 14.113 1.00 0.98 H new ATOM 0 HA GLU A 63 -0.045 7.387 15.671 1.00 1.17 H new ATOM 0 HB2 GLU A 63 0.956 4.581 16.274 1.00 1.36 H new ATOM 0 HB3 GLU A 63 0.180 5.614 17.458 1.00 1.36 H new ATOM 0 HG2 GLU A 63 -1.838 5.797 16.087 1.00 1.76 H new ATOM 0 HG3 GLU A 63 -1.060 4.984 14.744 1.00 1.76 H new ATOM 1006 N LYS A 64 3.150 7.306 15.709 1.00 0.92 N ATOM 1007 CA LYS A 64 4.349 8.076 16.070 1.00 0.97 C ATOM 1008 C LYS A 64 4.536 9.389 15.266 1.00 1.18 C ATOM 1009 O LYS A 64 5.466 10.151 15.552 1.00 1.48 O ATOM 1010 CB LYS A 64 5.528 7.101 15.931 1.00 0.95 C ATOM 1011 CG LYS A 64 6.883 7.678 16.345 1.00 1.75 C ATOM 1012 CD LYS A 64 7.896 6.555 16.564 1.00 2.24 C ATOM 1013 CE LYS A 64 9.251 7.205 16.833 1.00 3.37 C ATOM 1014 NZ LYS A 64 10.254 6.213 17.272 1.00 4.09 N ATOM 0 H LYS A 64 3.319 6.667 14.933 1.00 0.92 H new ATOM 0 HA LYS A 64 4.263 8.449 17.091 1.00 0.97 H new ATOM 0 HB2 LYS A 64 5.324 6.217 16.535 1.00 0.95 H new ATOM 0 HB3 LYS A 64 5.590 6.771 14.894 1.00 0.95 H new ATOM 0 HG2 LYS A 64 7.246 8.359 15.575 1.00 1.75 H new ATOM 0 HG3 LYS A 64 6.773 8.261 17.260 1.00 1.75 H new ATOM 0 HD2 LYS A 64 7.598 5.928 17.405 1.00 2.24 H new ATOM 0 HD3 LYS A 64 7.948 5.909 15.687 1.00 2.24 H new ATOM 0 HE2 LYS A 64 9.602 7.702 15.929 1.00 3.37 H new ATOM 0 HE3 LYS A 64 9.141 7.974 17.597 1.00 3.37 H new ATOM 0 HZ1 LYS A 64 11.142 6.364 16.752 1.00 4.09 H new ATOM 0 HZ2 LYS A 64 10.427 6.322 18.292 1.00 4.09 H new ATOM 0 HZ3 LYS A 64 9.900 5.254 17.081 1.00 4.09 H new ATOM 1028 N LEU A 65 3.702 9.699 14.264 1.00 1.03 N ATOM 1029 CA LEU A 65 3.787 10.967 13.518 1.00 1.17 C ATOM 1030 C LEU A 65 3.209 12.142 14.335 1.00 1.59 C ATOM 1031 O LEU A 65 2.302 11.938 15.139 1.00 1.82 O ATOM 1032 CB LEU A 65 3.079 10.859 12.151 1.00 1.17 C ATOM 1033 CG LEU A 65 3.864 10.087 11.071 1.00 1.40 C ATOM 1034 CD1 LEU A 65 2.981 9.923 9.831 1.00 1.76 C ATOM 1035 CD2 LEU A 65 5.163 10.797 10.656 1.00 1.80 C ATOM 0 H LEU A 65 2.953 9.084 13.947 1.00 1.03 H new ATOM 0 HA LEU A 65 4.844 11.168 13.340 1.00 1.17 H new ATOM 0 HB2 LEU A 65 2.114 10.372 12.296 1.00 1.17 H new ATOM 0 HB3 LEU A 65 2.877 11.865 11.783 1.00 1.17 H new ATOM 0 HG LEU A 65 4.136 9.122 11.499 1.00 1.40 H new ATOM 0 HD11 LEU A 65 3.530 9.378 9.063 1.00 1.76 H new ATOM 0 HD12 LEU A 65 2.081 9.369 10.096 1.00 1.76 H new ATOM 0 HD13 LEU A 65 2.703 10.906 9.450 1.00 1.76 H new ATOM 0 HD21 LEU A 65 5.672 10.207 9.894 1.00 1.80 H new ATOM 0 HD22 LEU A 65 4.927 11.782 10.255 1.00 1.80 H new ATOM 0 HD23 LEU A 65 5.812 10.905 11.525 1.00 1.80 H new ATOM 1047 N PRO A 66 3.684 13.388 14.113 1.00 1.62 N ATOM 1048 CA PRO A 66 3.150 14.562 14.790 1.00 1.88 C ATOM 1049 C PRO A 66 1.722 14.866 14.322 1.00 1.81 C ATOM 1050 O PRO A 66 1.397 14.607 13.155 1.00 1.58 O ATOM 1051 CB PRO A 66 4.098 15.717 14.448 1.00 2.21 C ATOM 1052 CG PRO A 66 4.696 15.303 13.106 1.00 2.08 C ATOM 1053 CD PRO A 66 4.744 13.777 13.195 1.00 1.78 C ATOM 0 HA PRO A 66 3.092 14.404 15.867 1.00 1.88 H new ATOM 0 HB2 PRO A 66 3.565 16.665 14.374 1.00 2.21 H new ATOM 0 HB3 PRO A 66 4.868 15.843 15.209 1.00 2.21 H new ATOM 0 HG2 PRO A 66 4.080 15.638 12.271 1.00 2.08 H new ATOM 0 HG3 PRO A 66 5.689 15.728 12.960 1.00 2.08 H new ATOM 0 HD2 PRO A 66 4.594 13.325 12.214 1.00 1.78 H new ATOM 0 HD3 PRO A 66 5.715 13.439 13.557 1.00 1.78 H new ATOM 1061 N PRO A 67 0.892 15.501 15.171 1.00 1.91 N ATOM 1062 CA PRO A 67 -0.512 15.773 14.881 1.00 1.89 C ATOM 1063 C PRO A 67 -0.743 16.793 13.751 1.00 1.92 C ATOM 1064 O PRO A 67 -1.889 17.106 13.443 1.00 2.04 O ATOM 1065 CB PRO A 67 -1.124 16.223 16.214 1.00 2.13 C ATOM 1066 CG PRO A 67 0.060 16.827 16.961 1.00 2.31 C ATOM 1067 CD PRO A 67 1.213 15.929 16.526 1.00 2.23 C ATOM 0 HA PRO A 67 -0.994 14.876 14.492 1.00 1.89 H new ATOM 0 HB2 PRO A 67 -1.920 16.953 16.065 1.00 2.13 H new ATOM 0 HB3 PRO A 67 -1.558 15.385 16.760 1.00 2.13 H new ATOM 0 HG2 PRO A 67 0.228 17.867 16.683 1.00 2.31 H new ATOM 0 HG3 PRO A 67 -0.087 16.805 18.041 1.00 2.31 H new ATOM 0 HD2 PRO A 67 2.160 16.468 16.552 1.00 2.23 H new ATOM 0 HD3 PRO A 67 1.315 15.073 17.193 1.00 2.23 H new ATOM 1075 N LYS A 68 0.311 17.321 13.112 1.00 1.77 N ATOM 1076 CA LYS A 68 0.170 18.085 11.863 1.00 1.71 C ATOM 1077 C LYS A 68 0.483 17.253 10.604 1.00 1.73 C ATOM 1078 O LYS A 68 -0.035 17.558 9.535 1.00 1.70 O ATOM 1079 CB LYS A 68 1.029 19.361 11.962 1.00 2.01 C ATOM 1080 CG LYS A 68 0.249 20.569 12.511 1.00 2.15 C ATOM 1081 CD LYS A 68 -0.365 20.385 13.913 1.00 2.65 C ATOM 1082 CE LYS A 68 -1.252 21.568 14.323 1.00 3.38 C ATOM 1083 NZ LYS A 68 -0.482 22.819 14.523 1.00 4.87 N ATOM 0 H LYS A 68 1.273 17.233 13.440 1.00 1.77 H new ATOM 0 HA LYS A 68 -0.876 18.368 11.745 1.00 1.71 H new ATOM 0 HB2 LYS A 68 1.887 19.166 12.606 1.00 2.01 H new ATOM 0 HB3 LYS A 68 1.421 19.606 10.975 1.00 2.01 H new ATOM 0 HG2 LYS A 68 0.918 21.429 12.537 1.00 2.15 H new ATOM 0 HG3 LYS A 68 -0.552 20.809 11.812 1.00 2.15 H new ATOM 0 HD2 LYS A 68 -0.955 19.469 13.931 1.00 2.65 H new ATOM 0 HD3 LYS A 68 0.435 20.264 14.644 1.00 2.65 H new ATOM 0 HE2 LYS A 68 -2.010 21.731 13.557 1.00 3.38 H new ATOM 0 HE3 LYS A 68 -1.779 21.319 15.244 1.00 3.38 H new ATOM 0 HZ1 LYS A 68 -1.129 23.585 14.798 1.00 4.87 H new ATOM 0 HZ2 LYS A 68 0.224 22.676 15.273 1.00 4.87 H new ATOM 0 HZ3 LYS A 68 0.000 23.075 13.638 1.00 4.87 H new ATOM 1097 N ALA A 69 1.309 16.208 10.708 1.00 1.44 N ATOM 1098 CA ALA A 69 1.454 15.217 9.647 1.00 1.28 C ATOM 1099 C ALA A 69 0.303 14.209 9.575 1.00 1.15 C ATOM 1100 O ALA A 69 0.007 13.747 8.481 1.00 1.18 O ATOM 1101 CB ALA A 69 2.815 14.527 9.784 1.00 1.49 C ATOM 0 H ALA A 69 1.891 16.029 11.526 1.00 1.44 H new ATOM 0 HA ALA A 69 1.408 15.747 8.696 1.00 1.28 H new ATOM 0 HB1 ALA A 69 2.928 13.785 8.993 1.00 1.49 H new ATOM 0 HB2 ALA A 69 3.609 15.269 9.702 1.00 1.49 H new ATOM 0 HB3 ALA A 69 2.877 14.035 10.755 1.00 1.49 H new ATOM 1107 N GLN A 70 -0.353 13.877 10.693 1.00 1.01 N ATOM 1108 CA GLN A 70 -1.331 12.780 10.737 1.00 0.99 C ATOM 1109 C GLN A 70 -2.517 12.911 9.778 1.00 1.03 C ATOM 1110 O GLN A 70 -3.117 11.907 9.407 1.00 1.48 O ATOM 1111 CB GLN A 70 -1.815 12.599 12.186 1.00 1.38 C ATOM 1112 CG GLN A 70 -2.863 13.645 12.612 1.00 2.16 C ATOM 1113 CD GLN A 70 -3.463 13.366 13.983 1.00 2.65 C ATOM 1114 OE1 GLN A 70 -3.279 14.102 14.936 1.00 3.80 O ATOM 1115 NE2 GLN A 70 -4.202 12.290 14.137 1.00 2.79 N ATOM 0 H GLN A 70 -0.224 14.355 11.585 1.00 1.01 H new ATOM 0 HA GLN A 70 -0.805 11.894 10.383 1.00 0.99 H new ATOM 0 HB2 GLN A 70 -2.240 11.602 12.298 1.00 1.38 H new ATOM 0 HB3 GLN A 70 -0.959 12.658 12.858 1.00 1.38 H new ATOM 0 HG2 GLN A 70 -2.400 14.632 12.619 1.00 2.16 H new ATOM 0 HG3 GLN A 70 -3.662 13.672 11.871 1.00 2.16 H new ATOM 0 HE21 GLN A 70 -4.364 11.665 13.347 1.00 2.79 H new ATOM 0 HE22 GLN A 70 -4.613 12.080 15.046 1.00 2.79 H new ATOM 1124 N GLU A 71 -2.844 14.140 9.385 1.00 1.00 N ATOM 1125 CA GLU A 71 -3.896 14.443 8.415 1.00 1.23 C ATOM 1126 C GLU A 71 -3.484 13.995 7.000 1.00 1.45 C ATOM 1127 O GLU A 71 -4.228 13.296 6.311 1.00 2.14 O ATOM 1128 CB GLU A 71 -4.282 15.926 8.570 1.00 1.52 C ATOM 1129 CG GLU A 71 -3.479 16.963 7.787 1.00 2.42 C ATOM 1130 CD GLU A 71 -4.016 17.171 6.373 1.00 3.98 C ATOM 1131 OE1 GLU A 71 -5.198 17.531 6.212 1.00 4.74 O ATOM 1132 OE2 GLU A 71 -3.255 16.956 5.411 1.00 5.29 O ATOM 0 H GLU A 71 -2.374 14.973 9.740 1.00 1.00 H new ATOM 0 HA GLU A 71 -4.803 13.870 8.606 1.00 1.23 H new ATOM 0 HB2 GLU A 71 -5.329 16.030 8.285 1.00 1.52 H new ATOM 0 HB3 GLU A 71 -4.213 16.180 9.628 1.00 1.52 H new ATOM 0 HG2 GLU A 71 -3.497 17.912 8.323 1.00 2.42 H new ATOM 0 HG3 GLU A 71 -2.437 16.647 7.734 1.00 2.42 H new ATOM 1139 N ARG A 72 -2.229 14.247 6.619 1.00 0.91 N ATOM 1140 CA ARG A 72 -1.657 13.816 5.351 1.00 0.94 C ATOM 1141 C ARG A 72 -0.984 12.465 5.507 1.00 1.22 C ATOM 1142 O ARG A 72 0.212 12.343 5.279 1.00 2.08 O ATOM 1143 CB ARG A 72 -0.894 14.938 4.627 1.00 1.46 C ATOM 1144 CG ARG A 72 0.130 15.754 5.422 1.00 1.24 C ATOM 1145 CD ARG A 72 1.478 15.041 5.526 1.00 1.93 C ATOM 1146 NE ARG A 72 2.591 15.996 5.381 1.00 2.54 N ATOM 1147 CZ ARG A 72 3.757 15.748 4.795 1.00 3.98 C ATOM 1148 NH1 ARG A 72 4.136 14.541 4.441 1.00 5.25 N ATOM 1149 NH2 ARG A 72 4.595 16.724 4.527 1.00 4.55 N ATOM 0 H ARG A 72 -1.572 14.768 7.200 1.00 0.91 H new ATOM 0 HA ARG A 72 -2.446 13.621 4.625 1.00 0.94 H new ATOM 0 HB2 ARG A 72 -0.376 14.493 3.778 1.00 1.46 H new ATOM 0 HB3 ARG A 72 -1.630 15.633 4.223 1.00 1.46 H new ATOM 0 HG2 ARG A 72 0.269 16.724 4.945 1.00 1.24 H new ATOM 0 HG3 ARG A 72 -0.257 15.944 6.423 1.00 1.24 H new ATOM 0 HD2 ARG A 72 1.552 14.533 6.488 1.00 1.93 H new ATOM 0 HD3 ARG A 72 1.549 14.274 4.755 1.00 1.93 H new ATOM 0 HE ARG A 72 2.454 16.931 5.765 1.00 2.54 H new ATOM 0 HH11 ARG A 72 3.524 13.743 4.614 1.00 5.25 H new ATOM 0 HH12 ARG A 72 5.042 14.402 3.993 1.00 5.25 H new ATOM 0 HH21 ARG A 72 4.353 17.685 4.769 1.00 4.55 H new ATOM 0 HH22 ARG A 72 5.487 16.521 4.077 1.00 4.55 H new ATOM 1163 N VAL A 73 -1.791 11.458 5.849 1.00 0.98 N ATOM 1164 CA VAL A 73 -1.509 10.028 5.632 1.00 1.04 C ATOM 1165 C VAL A 73 -2.789 9.181 5.704 1.00 1.26 C ATOM 1166 O VAL A 73 -3.513 9.220 6.701 1.00 1.47 O ATOM 1167 CB VAL A 73 -0.434 9.415 6.576 1.00 1.20 C ATOM 1168 CG1 VAL A 73 0.821 8.997 5.793 1.00 1.88 C ATOM 1169 CG2 VAL A 73 -0.023 10.274 7.785 1.00 1.93 C ATOM 0 H VAL A 73 -2.692 11.616 6.301 1.00 0.98 H new ATOM 0 HA VAL A 73 -1.090 9.996 4.626 1.00 1.04 H new ATOM 0 HB VAL A 73 -0.937 8.545 6.999 1.00 1.20 H new ATOM 0 HG11 VAL A 73 1.554 8.572 6.479 1.00 1.88 H new ATOM 0 HG12 VAL A 73 0.551 8.252 5.044 1.00 1.88 H new ATOM 0 HG13 VAL A 73 1.249 9.869 5.299 1.00 1.88 H new ATOM 0 HG21 VAL A 73 0.730 9.744 8.369 1.00 1.93 H new ATOM 0 HG22 VAL A 73 0.389 11.221 7.435 1.00 1.93 H new ATOM 0 HG23 VAL A 73 -0.896 10.466 8.409 1.00 1.93 H new ATOM 1179 N GLN A 74 -3.020 8.364 4.669 1.00 1.01 N ATOM 1180 CA GLN A 74 -4.005 7.280 4.655 1.00 0.98 C ATOM 1181 C GLN A 74 -3.319 6.006 4.129 1.00 1.18 C ATOM 1182 O GLN A 74 -2.464 6.089 3.249 1.00 1.37 O ATOM 1183 CB GLN A 74 -5.226 7.627 3.773 1.00 1.23 C ATOM 1184 CG GLN A 74 -5.790 9.059 3.914 1.00 1.39 C ATOM 1185 CD GLN A 74 -5.137 10.061 2.952 1.00 2.61 C ATOM 1186 OE1 GLN A 74 -4.241 10.819 3.293 1.00 3.44 O ATOM 1187 NE2 GLN A 74 -5.548 10.105 1.699 1.00 4.05 N ATOM 0 H GLN A 74 -2.509 8.444 3.790 1.00 1.01 H new ATOM 0 HA GLN A 74 -4.374 7.126 5.669 1.00 0.98 H new ATOM 0 HB2 GLN A 74 -4.950 7.469 2.730 1.00 1.23 H new ATOM 0 HB3 GLN A 74 -6.024 6.921 4.002 1.00 1.23 H new ATOM 0 HG2 GLN A 74 -6.865 9.039 3.734 1.00 1.39 H new ATOM 0 HG3 GLN A 74 -5.645 9.401 4.939 1.00 1.39 H new ATOM 0 HE21 GLN A 74 -6.294 9.484 1.385 1.00 4.05 H new ATOM 0 HE22 GLN A 74 -5.120 10.759 1.044 1.00 4.05 H new ATOM 1196 N VAL A 75 -3.696 4.828 4.634 1.00 0.85 N ATOM 1197 CA VAL A 75 -3.101 3.546 4.186 1.00 0.78 C ATOM 1198 C VAL A 75 -4.074 2.812 3.270 1.00 0.85 C ATOM 1199 O VAL A 75 -5.256 2.678 3.583 1.00 1.17 O ATOM 1200 CB VAL A 75 -2.668 2.655 5.365 1.00 0.86 C ATOM 1201 CG1 VAL A 75 -2.117 1.287 4.923 1.00 1.04 C ATOM 1202 CG2 VAL A 75 -1.585 3.372 6.197 1.00 1.02 C ATOM 0 H VAL A 75 -4.411 4.726 5.355 1.00 0.85 H new ATOM 0 HA VAL A 75 -2.194 3.780 3.628 1.00 0.78 H new ATOM 0 HB VAL A 75 -3.566 2.476 5.957 1.00 0.86 H new ATOM 0 HG11 VAL A 75 -1.830 0.709 5.802 1.00 1.04 H new ATOM 0 HG12 VAL A 75 -2.885 0.747 4.368 1.00 1.04 H new ATOM 0 HG13 VAL A 75 -1.245 1.435 4.286 1.00 1.04 H new ATOM 0 HG21 VAL A 75 -1.284 2.735 7.029 1.00 1.02 H new ATOM 0 HG22 VAL A 75 -0.720 3.579 5.567 1.00 1.02 H new ATOM 0 HG23 VAL A 75 -1.985 4.309 6.584 1.00 1.02 H new ATOM 1212 N ILE A 76 -3.575 2.347 2.126 1.00 0.63 N ATOM 1213 CA ILE A 76 -4.389 1.809 1.034 1.00 0.53 C ATOM 1214 C ILE A 76 -3.908 0.387 0.726 1.00 0.73 C ATOM 1215 O ILE A 76 -2.812 0.186 0.199 1.00 1.03 O ATOM 1216 CB ILE A 76 -4.294 2.773 -0.177 1.00 0.58 C ATOM 1217 CG1 ILE A 76 -4.736 4.226 0.148 1.00 0.98 C ATOM 1218 CG2 ILE A 76 -5.098 2.253 -1.377 1.00 0.73 C ATOM 1219 CD1 ILE A 76 -6.196 4.428 0.570 1.00 1.37 C ATOM 0 H ILE A 76 -2.575 2.333 1.927 1.00 0.63 H new ATOM 0 HA ILE A 76 -5.443 1.740 1.302 1.00 0.53 H new ATOM 0 HB ILE A 76 -3.234 2.803 -0.431 1.00 0.58 H new ATOM 0 HG12 ILE A 76 -4.097 4.605 0.945 1.00 0.98 H new ATOM 0 HG13 ILE A 76 -4.548 4.843 -0.731 1.00 0.98 H new ATOM 0 HG21 ILE A 76 -5.008 2.954 -2.207 1.00 0.73 H new ATOM 0 HG22 ILE A 76 -4.711 1.280 -1.680 1.00 0.73 H new ATOM 0 HG23 ILE A 76 -6.147 2.155 -1.097 1.00 0.73 H new ATOM 0 HD11 ILE A 76 -6.375 5.485 0.768 1.00 1.37 H new ATOM 0 HD12 ILE A 76 -6.856 4.092 -0.230 1.00 1.37 H new ATOM 0 HD13 ILE A 76 -6.397 3.851 1.473 1.00 1.37 H new ATOM 1231 N PHE A 77 -4.730 -0.610 1.051 1.00 0.53 N ATOM 1232 CA PHE A 77 -4.417 -2.010 0.791 1.00 0.50 C ATOM 1233 C PHE A 77 -5.079 -2.419 -0.523 1.00 1.37 C ATOM 1234 O PHE A 77 -6.298 -2.322 -0.662 1.00 1.77 O ATOM 1235 CB PHE A 77 -4.891 -2.877 1.963 1.00 0.55 C ATOM 1236 CG PHE A 77 -4.694 -4.364 1.732 1.00 0.74 C ATOM 1237 CD1 PHE A 77 -3.438 -4.962 1.950 1.00 1.82 C ATOM 1238 CD2 PHE A 77 -5.768 -5.147 1.270 1.00 1.83 C ATOM 1239 CE1 PHE A 77 -3.266 -6.343 1.732 1.00 1.65 C ATOM 1240 CE2 PHE A 77 -5.593 -6.523 1.042 1.00 1.93 C ATOM 1241 CZ PHE A 77 -4.346 -7.123 1.280 1.00 0.92 C ATOM 0 H PHE A 77 -5.633 -0.467 1.503 1.00 0.53 H new ATOM 0 HA PHE A 77 -3.340 -2.153 0.698 1.00 0.50 H new ATOM 0 HB2 PHE A 77 -4.353 -2.583 2.864 1.00 0.55 H new ATOM 0 HB3 PHE A 77 -5.948 -2.682 2.145 1.00 0.55 H new ATOM 0 HD1 PHE A 77 -2.605 -4.361 2.285 1.00 1.82 H new ATOM 0 HD2 PHE A 77 -6.730 -4.689 1.090 1.00 1.83 H new ATOM 0 HE1 PHE A 77 -2.305 -6.803 1.912 1.00 1.65 H new ATOM 0 HE2 PHE A 77 -6.419 -7.119 0.683 1.00 1.93 H new ATOM 0 HZ PHE A 77 -4.216 -8.183 1.116 1.00 0.92 H new ATOM 1251 N VAL A 78 -4.267 -2.870 -1.475 1.00 0.46 N ATOM 1252 CA VAL A 78 -4.710 -3.327 -2.792 1.00 0.50 C ATOM 1253 C VAL A 78 -4.803 -4.849 -2.777 1.00 0.78 C ATOM 1254 O VAL A 78 -3.809 -5.566 -2.650 1.00 1.07 O ATOM 1255 CB VAL A 78 -3.790 -2.853 -3.936 1.00 0.71 C ATOM 1256 CG1 VAL A 78 -4.420 -3.216 -5.294 1.00 1.05 C ATOM 1257 CG2 VAL A 78 -3.570 -1.333 -3.887 1.00 1.13 C ATOM 0 H VAL A 78 -3.256 -2.930 -1.350 1.00 0.46 H new ATOM 0 HA VAL A 78 -5.687 -2.886 -2.989 1.00 0.50 H new ATOM 0 HB VAL A 78 -2.828 -3.351 -3.815 1.00 0.71 H new ATOM 0 HG11 VAL A 78 -3.767 -2.880 -6.099 1.00 1.05 H new ATOM 0 HG12 VAL A 78 -4.548 -4.296 -5.358 1.00 1.05 H new ATOM 0 HG13 VAL A 78 -5.391 -2.729 -5.386 1.00 1.05 H new ATOM 0 HG21 VAL A 78 -2.917 -1.033 -4.707 1.00 1.13 H new ATOM 0 HG22 VAL A 78 -4.529 -0.823 -3.982 1.00 1.13 H new ATOM 0 HG23 VAL A 78 -3.108 -1.063 -2.938 1.00 1.13 H new ATOM 1267 N SER A 79 -6.031 -5.323 -2.921 1.00 0.49 N ATOM 1268 CA SER A 79 -6.359 -6.740 -3.066 1.00 0.67 C ATOM 1269 C SER A 79 -5.998 -7.222 -4.474 1.00 0.86 C ATOM 1270 O SER A 79 -6.473 -6.643 -5.453 1.00 1.32 O ATOM 1271 CB SER A 79 -7.853 -6.941 -2.848 1.00 1.08 C ATOM 1272 OG SER A 79 -8.287 -6.270 -1.678 1.00 2.54 O ATOM 0 H SER A 79 -6.852 -4.719 -2.941 1.00 0.49 H new ATOM 0 HA SER A 79 -5.792 -7.309 -2.329 1.00 0.67 H new ATOM 0 HB2 SER A 79 -8.404 -6.569 -3.711 1.00 1.08 H new ATOM 0 HB3 SER A 79 -8.073 -8.005 -2.765 1.00 1.08 H new ATOM 0 HG SER A 79 -8.468 -5.330 -1.888 1.00 2.54 H new ATOM 1278 N VAL A 80 -5.165 -8.255 -4.595 1.00 0.67 N ATOM 1279 CA VAL A 80 -4.523 -8.578 -5.903 1.00 0.78 C ATOM 1280 C VAL A 80 -5.397 -9.389 -6.879 1.00 1.55 C ATOM 1281 O VAL A 80 -5.098 -9.429 -8.072 1.00 1.83 O ATOM 1282 CB VAL A 80 -3.150 -9.274 -5.767 1.00 0.82 C ATOM 1283 CG1 VAL A 80 -2.126 -8.347 -5.092 1.00 1.85 C ATOM 1284 CG2 VAL A 80 -3.238 -10.612 -5.025 1.00 2.24 C ATOM 0 H VAL A 80 -4.912 -8.881 -3.830 1.00 0.67 H new ATOM 0 HA VAL A 80 -4.381 -7.587 -6.334 1.00 0.78 H new ATOM 0 HB VAL A 80 -2.811 -9.493 -6.780 1.00 0.82 H new ATOM 0 HG11 VAL A 80 -1.169 -8.862 -5.009 1.00 1.85 H new ATOM 0 HG12 VAL A 80 -2.002 -7.445 -5.691 1.00 1.85 H new ATOM 0 HG13 VAL A 80 -2.480 -8.077 -4.097 1.00 1.85 H new ATOM 0 HG21 VAL A 80 -2.245 -11.057 -4.958 1.00 2.24 H new ATOM 0 HG22 VAL A 80 -3.630 -10.446 -4.021 1.00 2.24 H new ATOM 0 HG23 VAL A 80 -3.902 -11.286 -5.567 1.00 2.24 H new ATOM 1294 N ASP A 81 -6.459 -10.035 -6.387 1.00 1.28 N ATOM 1295 CA ASP A 81 -7.301 -10.974 -7.141 1.00 1.58 C ATOM 1296 C ASP A 81 -8.766 -10.865 -6.669 1.00 1.42 C ATOM 1297 O ASP A 81 -9.112 -11.394 -5.608 1.00 1.42 O ATOM 1298 CB ASP A 81 -6.808 -12.422 -6.952 1.00 1.96 C ATOM 1299 CG ASP A 81 -5.687 -12.840 -7.906 1.00 3.05 C ATOM 1300 OD1 ASP A 81 -5.945 -12.986 -9.127 1.00 4.23 O ATOM 1301 OD2 ASP A 81 -4.567 -13.138 -7.434 1.00 3.70 O ATOM 0 H ASP A 81 -6.768 -9.916 -5.422 1.00 1.28 H new ATOM 0 HA ASP A 81 -7.238 -10.716 -8.198 1.00 1.58 H new ATOM 0 HB2 ASP A 81 -6.459 -12.543 -5.926 1.00 1.96 H new ATOM 0 HB3 ASP A 81 -7.651 -13.100 -7.084 1.00 1.96 H new ATOM 1306 N PRO A 82 -9.651 -10.216 -7.447 1.00 1.37 N ATOM 1307 CA PRO A 82 -11.045 -9.999 -7.063 1.00 1.36 C ATOM 1308 C PRO A 82 -11.930 -11.247 -7.202 1.00 1.46 C ATOM 1309 O PRO A 82 -13.097 -11.189 -6.831 1.00 1.79 O ATOM 1310 CB PRO A 82 -11.527 -8.863 -7.966 1.00 1.90 C ATOM 1311 CG PRO A 82 -10.725 -9.093 -9.244 1.00 2.11 C ATOM 1312 CD PRO A 82 -9.371 -9.547 -8.710 1.00 1.81 C ATOM 0 HA PRO A 82 -11.115 -9.754 -6.003 1.00 1.36 H new ATOM 0 HB2 PRO A 82 -12.601 -8.916 -8.146 1.00 1.90 H new ATOM 0 HB3 PRO A 82 -11.324 -7.885 -7.530 1.00 1.90 H new ATOM 0 HG2 PRO A 82 -11.184 -9.850 -9.880 1.00 2.11 H new ATOM 0 HG3 PRO A 82 -10.642 -8.184 -9.839 1.00 2.11 H new ATOM 0 HD2 PRO A 82 -8.880 -10.222 -9.411 1.00 1.81 H new ATOM 0 HD3 PRO A 82 -8.703 -8.698 -8.564 1.00 1.81 H new ATOM 1320 N GLU A 83 -11.397 -12.376 -7.691 1.00 1.11 N ATOM 1321 CA GLU A 83 -12.041 -13.690 -7.555 1.00 1.13 C ATOM 1322 C GLU A 83 -12.027 -14.177 -6.095 1.00 1.25 C ATOM 1323 O GLU A 83 -12.910 -14.940 -5.698 1.00 1.72 O ATOM 1324 CB GLU A 83 -11.315 -14.686 -8.483 1.00 1.21 C ATOM 1325 CG GLU A 83 -12.002 -16.056 -8.665 1.00 2.32 C ATOM 1326 CD GLU A 83 -11.717 -17.089 -7.568 1.00 3.74 C ATOM 1327 OE1 GLU A 83 -10.578 -17.131 -7.048 1.00 4.14 O ATOM 1328 OE2 GLU A 83 -12.617 -17.893 -7.243 1.00 5.20 O ATOM 0 H GLU A 83 -10.509 -12.404 -8.191 1.00 1.11 H new ATOM 0 HA GLU A 83 -13.089 -13.613 -7.846 1.00 1.13 H new ATOM 0 HB2 GLU A 83 -11.202 -14.224 -9.464 1.00 1.21 H new ATOM 0 HB3 GLU A 83 -10.311 -14.853 -8.092 1.00 1.21 H new ATOM 0 HG2 GLU A 83 -13.079 -15.898 -8.720 1.00 2.32 H new ATOM 0 HG3 GLU A 83 -11.692 -16.474 -9.623 1.00 2.32 H new ATOM 1335 N ARG A 84 -11.040 -13.726 -5.305 1.00 0.96 N ATOM 1336 CA ARG A 84 -10.732 -14.279 -3.987 1.00 1.10 C ATOM 1337 C ARG A 84 -10.897 -13.277 -2.846 1.00 1.21 C ATOM 1338 O ARG A 84 -11.497 -13.626 -1.830 1.00 1.44 O ATOM 1339 CB ARG A 84 -9.304 -14.852 -4.010 1.00 1.59 C ATOM 1340 CG ARG A 84 -9.121 -16.016 -3.018 1.00 2.03 C ATOM 1341 CD ARG A 84 -9.384 -17.403 -3.636 1.00 2.18 C ATOM 1342 NE ARG A 84 -10.696 -17.542 -4.290 1.00 2.82 N ATOM 1343 CZ ARG A 84 -11.894 -17.509 -3.733 1.00 3.63 C ATOM 1344 NH1 ARG A 84 -12.079 -17.252 -2.452 1.00 4.20 N ATOM 1345 NH2 ARG A 84 -12.948 -17.686 -4.489 1.00 4.92 N ATOM 0 H ARG A 84 -10.428 -12.955 -5.573 1.00 0.96 H new ATOM 0 HA ARG A 84 -11.457 -15.067 -3.785 1.00 1.10 H new ATOM 0 HB2 ARG A 84 -9.070 -15.197 -5.017 1.00 1.59 H new ATOM 0 HB3 ARG A 84 -8.594 -14.060 -3.771 1.00 1.59 H new ATOM 0 HG2 ARG A 84 -8.105 -15.990 -2.624 1.00 2.03 H new ATOM 0 HG3 ARG A 84 -9.794 -15.871 -2.173 1.00 2.03 H new ATOM 0 HD2 ARG A 84 -8.604 -17.615 -4.367 1.00 2.18 H new ATOM 0 HD3 ARG A 84 -9.301 -18.157 -2.853 1.00 2.18 H new ATOM 0 HE ARG A 84 -10.678 -17.681 -5.300 1.00 2.82 H new ATOM 0 HH11 ARG A 84 -11.278 -17.068 -1.848 1.00 4.20 H new ATOM 0 HH12 ARG A 84 -13.023 -17.237 -2.066 1.00 4.20 H new ATOM 0 HH21 ARG A 84 -12.836 -17.846 -5.490 1.00 4.92 H new ATOM 0 HH22 ARG A 84 -13.881 -17.664 -4.077 1.00 4.92 H new ATOM 1359 N ASP A 85 -10.384 -12.062 -3.012 1.00 0.76 N ATOM 1360 CA ASP A 85 -10.388 -11.014 -1.991 1.00 0.72 C ATOM 1361 C ASP A 85 -11.443 -9.961 -2.368 1.00 1.00 C ATOM 1362 O ASP A 85 -11.115 -9.024 -3.094 1.00 1.27 O ATOM 1363 CB ASP A 85 -8.971 -10.396 -1.890 1.00 0.88 C ATOM 1364 CG ASP A 85 -8.030 -11.052 -0.876 1.00 1.23 C ATOM 1365 OD1 ASP A 85 -8.377 -12.101 -0.295 1.00 2.56 O ATOM 1366 OD2 ASP A 85 -6.951 -10.457 -0.657 1.00 2.05 O ATOM 0 H ASP A 85 -9.942 -11.769 -3.883 1.00 0.76 H new ATOM 0 HA ASP A 85 -10.645 -11.423 -1.014 1.00 0.72 H new ATOM 0 HB2 ASP A 85 -8.504 -10.442 -2.874 1.00 0.88 H new ATOM 0 HB3 ASP A 85 -9.072 -9.341 -1.634 1.00 0.88 H new ATOM 1371 N PRO A 86 -12.713 -10.081 -1.929 1.00 0.62 N ATOM 1372 CA PRO A 86 -13.730 -9.062 -2.171 1.00 0.76 C ATOM 1373 C PRO A 86 -13.507 -7.862 -1.231 1.00 0.91 C ATOM 1374 O PRO A 86 -12.943 -8.030 -0.142 1.00 0.72 O ATOM 1375 CB PRO A 86 -15.065 -9.773 -1.944 1.00 0.82 C ATOM 1376 CG PRO A 86 -14.723 -10.775 -0.848 1.00 0.75 C ATOM 1377 CD PRO A 86 -13.304 -11.207 -1.219 1.00 0.62 C ATOM 0 HA PRO A 86 -13.696 -8.644 -3.177 1.00 0.76 H new ATOM 0 HB2 PRO A 86 -15.846 -9.080 -1.631 1.00 0.82 H new ATOM 0 HB3 PRO A 86 -15.421 -10.267 -2.848 1.00 0.82 H new ATOM 0 HG2 PRO A 86 -14.762 -10.321 0.142 1.00 0.75 H new ATOM 0 HG3 PRO A 86 -15.414 -11.618 -0.840 1.00 0.75 H new ATOM 0 HD2 PRO A 86 -12.726 -11.453 -0.328 1.00 0.62 H new ATOM 0 HD3 PRO A 86 -13.319 -12.099 -1.846 1.00 0.62 H new ATOM 1385 N PRO A 87 -13.926 -6.644 -1.624 1.00 0.57 N ATOM 1386 CA PRO A 87 -13.491 -5.409 -0.975 1.00 0.70 C ATOM 1387 C PRO A 87 -13.910 -5.325 0.492 1.00 0.99 C ATOM 1388 O PRO A 87 -13.156 -4.797 1.303 1.00 0.88 O ATOM 1389 CB PRO A 87 -14.087 -4.271 -1.801 1.00 0.75 C ATOM 1390 CG PRO A 87 -15.253 -4.906 -2.557 1.00 0.73 C ATOM 1391 CD PRO A 87 -14.797 -6.349 -2.757 1.00 0.65 C ATOM 0 HA PRO A 87 -12.403 -5.358 -0.947 1.00 0.70 H new ATOM 0 HB2 PRO A 87 -14.427 -3.455 -1.163 1.00 0.75 H new ATOM 0 HB3 PRO A 87 -13.351 -3.853 -2.488 1.00 0.75 H new ATOM 0 HG2 PRO A 87 -16.180 -4.852 -1.986 1.00 0.73 H new ATOM 0 HG3 PRO A 87 -15.436 -4.406 -3.508 1.00 0.73 H new ATOM 0 HD2 PRO A 87 -15.648 -7.029 -2.785 1.00 0.65 H new ATOM 0 HD3 PRO A 87 -14.265 -6.465 -3.701 1.00 0.65 H new ATOM 1399 N GLU A 88 -15.068 -5.883 0.853 1.00 0.58 N ATOM 1400 CA GLU A 88 -15.554 -5.927 2.229 1.00 0.66 C ATOM 1401 C GLU A 88 -14.617 -6.727 3.139 1.00 0.99 C ATOM 1402 O GLU A 88 -14.406 -6.326 4.282 1.00 1.19 O ATOM 1403 CB GLU A 88 -16.966 -6.539 2.302 1.00 0.83 C ATOM 1404 CG GLU A 88 -17.995 -5.964 1.311 1.00 1.37 C ATOM 1405 CD GLU A 88 -18.059 -6.736 -0.012 1.00 3.25 C ATOM 1406 OE1 GLU A 88 -17.004 -7.252 -0.447 1.00 4.27 O ATOM 1407 OE2 GLU A 88 -19.165 -6.802 -0.581 1.00 4.36 O ATOM 0 H GLU A 88 -15.702 -6.323 0.186 1.00 0.58 H new ATOM 0 HA GLU A 88 -15.587 -4.895 2.578 1.00 0.66 H new ATOM 0 HB2 GLU A 88 -16.886 -7.613 2.132 1.00 0.83 H new ATOM 0 HB3 GLU A 88 -17.349 -6.404 3.314 1.00 0.83 H new ATOM 0 HG2 GLU A 88 -18.981 -5.971 1.776 1.00 1.37 H new ATOM 0 HG3 GLU A 88 -17.748 -4.923 1.105 1.00 1.37 H new ATOM 1414 N VAL A 89 -14.055 -7.839 2.641 1.00 0.59 N ATOM 1415 CA VAL A 89 -13.121 -8.722 3.374 1.00 0.59 C ATOM 1416 C VAL A 89 -11.753 -8.056 3.540 1.00 0.84 C ATOM 1417 O VAL A 89 -11.204 -8.030 4.643 1.00 0.75 O ATOM 1418 CB VAL A 89 -12.981 -10.100 2.681 1.00 0.60 C ATOM 1419 CG1 VAL A 89 -11.842 -10.963 3.257 1.00 0.76 C ATOM 1420 CG2 VAL A 89 -14.300 -10.884 2.825 1.00 0.94 C ATOM 0 H VAL A 89 -14.240 -8.162 1.691 1.00 0.59 H new ATOM 0 HA VAL A 89 -13.541 -8.891 4.366 1.00 0.59 H new ATOM 0 HB VAL A 89 -12.745 -9.896 1.637 1.00 0.60 H new ATOM 0 HG11 VAL A 89 -11.801 -11.914 2.725 1.00 0.76 H new ATOM 0 HG12 VAL A 89 -10.893 -10.440 3.138 1.00 0.76 H new ATOM 0 HG13 VAL A 89 -12.025 -11.147 4.316 1.00 0.76 H new ATOM 0 HG21 VAL A 89 -14.202 -11.854 2.337 1.00 0.94 H new ATOM 0 HG22 VAL A 89 -14.523 -11.030 3.882 1.00 0.94 H new ATOM 0 HG23 VAL A 89 -15.109 -10.323 2.358 1.00 0.94 H new ATOM 1430 N ALA A 90 -11.225 -7.481 2.451 1.00 0.58 N ATOM 1431 CA ALA A 90 -9.972 -6.728 2.460 1.00 0.61 C ATOM 1432 C ALA A 90 -10.020 -5.521 3.412 1.00 0.83 C ATOM 1433 O ALA A 90 -9.054 -5.243 4.126 1.00 0.91 O ATOM 1434 CB ALA A 90 -9.709 -6.289 1.019 1.00 0.64 C ATOM 0 H ALA A 90 -11.664 -7.528 1.531 1.00 0.58 H new ATOM 0 HA ALA A 90 -9.163 -7.357 2.832 1.00 0.61 H new ATOM 0 HB1 ALA A 90 -8.780 -5.721 0.976 1.00 0.64 H new ATOM 0 HB2 ALA A 90 -9.627 -7.168 0.380 1.00 0.64 H new ATOM 0 HB3 ALA A 90 -10.533 -5.665 0.673 1.00 0.64 H new ATOM 1440 N ASP A 91 -11.165 -4.835 3.481 1.00 0.60 N ATOM 1441 CA ASP A 91 -11.366 -3.701 4.386 1.00 0.64 C ATOM 1442 C ASP A 91 -11.400 -4.133 5.851 1.00 1.05 C ATOM 1443 O ASP A 91 -10.907 -3.390 6.696 1.00 1.06 O ATOM 1444 CB ASP A 91 -12.645 -2.946 4.009 1.00 0.71 C ATOM 1445 CG ASP A 91 -12.694 -1.540 4.618 1.00 0.74 C ATOM 1446 OD1 ASP A 91 -11.921 -0.651 4.176 1.00 1.64 O ATOM 1447 OD2 ASP A 91 -13.491 -1.313 5.552 1.00 1.95 O ATOM 0 H ASP A 91 -11.981 -5.052 2.908 1.00 0.60 H new ATOM 0 HA ASP A 91 -10.513 -3.032 4.273 1.00 0.64 H new ATOM 0 HB2 ASP A 91 -12.713 -2.872 2.924 1.00 0.71 H new ATOM 0 HB3 ASP A 91 -13.512 -3.515 4.345 1.00 0.71 H new ATOM 1452 N ARG A 92 -11.887 -5.347 6.168 1.00 0.76 N ATOM 1453 CA ARG A 92 -11.775 -5.882 7.530 1.00 0.89 C ATOM 1454 C ARG A 92 -10.318 -5.958 7.984 1.00 1.27 C ATOM 1455 O ARG A 92 -10.023 -5.513 9.092 1.00 1.53 O ATOM 1456 CB ARG A 92 -12.398 -7.277 7.698 1.00 1.21 C ATOM 1457 CG ARG A 92 -13.808 -7.495 7.148 1.00 1.25 C ATOM 1458 CD ARG A 92 -14.842 -6.381 7.398 1.00 1.43 C ATOM 1459 NE ARG A 92 -15.606 -6.573 8.651 1.00 2.25 N ATOM 1460 CZ ARG A 92 -15.240 -6.287 9.897 1.00 3.68 C ATOM 1461 NH1 ARG A 92 -14.071 -5.762 10.181 1.00 4.71 N ATOM 1462 NH2 ARG A 92 -16.068 -6.534 10.893 1.00 4.91 N ATOM 0 H ARG A 92 -12.355 -5.966 5.506 1.00 0.76 H new ATOM 0 HA ARG A 92 -12.334 -5.180 8.148 1.00 0.89 H new ATOM 0 HB2 ARG A 92 -11.736 -8.000 7.221 1.00 1.21 H new ATOM 0 HB3 ARG A 92 -12.413 -7.512 8.762 1.00 1.21 H new ATOM 0 HG2 ARG A 92 -13.731 -7.648 6.072 1.00 1.25 H new ATOM 0 HG3 ARG A 92 -14.198 -8.419 7.575 1.00 1.25 H new ATOM 0 HD2 ARG A 92 -14.330 -5.419 7.434 1.00 1.43 H new ATOM 0 HD3 ARG A 92 -15.536 -6.341 6.558 1.00 1.43 H new ATOM 0 HE ARG A 92 -16.536 -6.978 8.545 1.00 2.25 H new ATOM 0 HH11 ARG A 92 -13.408 -5.560 9.433 1.00 4.71 H new ATOM 0 HH12 ARG A 92 -13.826 -5.556 11.150 1.00 4.71 H new ATOM 0 HH21 ARG A 92 -16.984 -6.942 10.706 1.00 4.91 H new ATOM 0 HH22 ARG A 92 -15.793 -6.317 11.851 1.00 4.91 H new ATOM 1476 N TYR A 93 -9.419 -6.505 7.162 1.00 0.77 N ATOM 1477 CA TYR A 93 -8.003 -6.618 7.526 1.00 0.82 C ATOM 1478 C TYR A 93 -7.296 -5.254 7.595 1.00 1.11 C ATOM 1479 O TYR A 93 -6.483 -5.023 8.487 1.00 1.42 O ATOM 1480 CB TYR A 93 -7.296 -7.585 6.559 1.00 0.96 C ATOM 1481 CG TYR A 93 -6.384 -8.584 7.250 1.00 1.16 C ATOM 1482 CD1 TYR A 93 -5.305 -8.139 8.042 1.00 2.45 C ATOM 1483 CD2 TYR A 93 -6.634 -9.966 7.121 1.00 2.09 C ATOM 1484 CE1 TYR A 93 -4.466 -9.071 8.683 1.00 2.62 C ATOM 1485 CE2 TYR A 93 -5.791 -10.904 7.747 1.00 2.34 C ATOM 1486 CZ TYR A 93 -4.703 -10.456 8.527 1.00 1.83 C ATOM 1487 OH TYR A 93 -3.884 -11.353 9.138 1.00 2.36 O ATOM 0 H TYR A 93 -9.646 -6.877 6.240 1.00 0.77 H new ATOM 0 HA TYR A 93 -7.946 -7.026 8.535 1.00 0.82 H new ATOM 0 HB2 TYR A 93 -8.049 -8.129 5.988 1.00 0.96 H new ATOM 0 HB3 TYR A 93 -6.711 -7.006 5.844 1.00 0.96 H new ATOM 0 HD1 TYR A 93 -5.122 -7.081 8.157 1.00 2.45 H new ATOM 0 HD2 TYR A 93 -7.477 -10.307 6.539 1.00 2.09 H new ATOM 0 HE1 TYR A 93 -3.643 -8.728 9.293 1.00 2.62 H new ATOM 0 HE2 TYR A 93 -5.976 -11.962 7.631 1.00 2.34 H new ATOM 0 HH TYR A 93 -4.184 -12.263 8.932 1.00 2.36 H new ATOM 1497 N ALA A 94 -7.635 -4.310 6.710 1.00 0.61 N ATOM 1498 CA ALA A 94 -7.097 -2.949 6.768 1.00 0.73 C ATOM 1499 C ALA A 94 -7.568 -2.197 8.029 1.00 0.88 C ATOM 1500 O ALA A 94 -6.766 -1.764 8.856 1.00 0.93 O ATOM 1501 CB ALA A 94 -7.490 -2.255 5.452 1.00 0.84 C ATOM 0 H ALA A 94 -8.285 -4.467 5.940 1.00 0.61 H new ATOM 0 HA ALA A 94 -6.011 -2.960 6.858 1.00 0.73 H new ATOM 0 HB1 ALA A 94 -7.108 -1.234 5.451 1.00 0.84 H new ATOM 0 HB2 ALA A 94 -7.064 -2.802 4.611 1.00 0.84 H new ATOM 0 HB3 ALA A 94 -8.576 -2.237 5.361 1.00 0.84 H new ATOM 1507 N LYS A 95 -8.883 -2.089 8.219 1.00 0.67 N ATOM 1508 CA LYS A 95 -9.519 -1.343 9.317 1.00 0.75 C ATOM 1509 C LYS A 95 -9.271 -1.954 10.712 1.00 0.94 C ATOM 1510 O LYS A 95 -9.462 -1.265 11.713 1.00 1.18 O ATOM 1511 CB LYS A 95 -11.028 -1.228 9.027 1.00 0.89 C ATOM 1512 CG LYS A 95 -11.684 0.040 9.615 1.00 1.56 C ATOM 1513 CD LYS A 95 -11.654 1.217 8.626 1.00 1.24 C ATOM 1514 CE LYS A 95 -12.599 0.934 7.446 1.00 1.24 C ATOM 1515 NZ LYS A 95 -11.991 1.272 6.143 1.00 1.38 N ATOM 0 H LYS A 95 -9.560 -2.530 7.597 1.00 0.67 H new ATOM 0 HA LYS A 95 -9.058 -0.356 9.353 1.00 0.75 H new ATOM 0 HB2 LYS A 95 -11.182 -1.238 7.948 1.00 0.89 H new ATOM 0 HB3 LYS A 95 -11.533 -2.106 9.429 1.00 0.89 H new ATOM 0 HG2 LYS A 95 -12.717 -0.179 9.886 1.00 1.56 H new ATOM 0 HG3 LYS A 95 -11.167 0.324 10.532 1.00 1.56 H new ATOM 0 HD2 LYS A 95 -11.954 2.135 9.131 1.00 1.24 H new ATOM 0 HD3 LYS A 95 -10.638 1.371 8.261 1.00 1.24 H new ATOM 0 HE2 LYS A 95 -12.877 -0.120 7.452 1.00 1.24 H new ATOM 0 HE3 LYS A 95 -13.518 1.507 7.575 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 -12.634 1.891 5.610 1.00 1.38 H new ATOM 0 HZ2 LYS A 95 -11.087 1.763 6.298 1.00 1.38 H new ATOM 0 HZ3 LYS A 95 -11.823 0.400 5.602 1.00 1.38 H new ATOM 1529 N ALA A 96 -8.852 -3.225 10.796 1.00 0.74 N ATOM 1530 CA ALA A 96 -8.488 -3.885 12.053 1.00 0.82 C ATOM 1531 C ALA A 96 -7.304 -3.198 12.747 1.00 1.19 C ATOM 1532 O ALA A 96 -7.224 -3.207 13.973 1.00 1.38 O ATOM 1533 CB ALA A 96 -8.160 -5.356 11.766 1.00 0.97 C ATOM 0 H ALA A 96 -8.756 -3.830 9.980 1.00 0.74 H new ATOM 0 HA ALA A 96 -9.336 -3.815 12.735 1.00 0.82 H new ATOM 0 HB1 ALA A 96 -7.888 -5.856 12.695 1.00 0.97 H new ATOM 0 HB2 ALA A 96 -9.032 -5.845 11.333 1.00 0.97 H new ATOM 0 HB3 ALA A 96 -7.327 -5.413 11.066 1.00 0.97 H new ATOM 1539 N PHE A 97 -6.407 -2.588 11.966 1.00 1.15 N ATOM 1540 CA PHE A 97 -5.264 -1.860 12.516 1.00 1.29 C ATOM 1541 C PHE A 97 -5.580 -0.413 12.877 1.00 2.33 C ATOM 1542 O PHE A 97 -5.090 0.066 13.900 1.00 2.71 O ATOM 1543 CB PHE A 97 -4.086 -1.975 11.546 1.00 1.31 C ATOM 1544 CG PHE A 97 -3.462 -3.341 11.683 1.00 1.38 C ATOM 1545 CD1 PHE A 97 -2.497 -3.551 12.683 1.00 2.27 C ATOM 1546 CD2 PHE A 97 -3.959 -4.426 10.940 1.00 2.11 C ATOM 1547 CE1 PHE A 97 -2.054 -4.853 12.957 1.00 2.35 C ATOM 1548 CE2 PHE A 97 -3.496 -5.724 11.202 1.00 1.91 C ATOM 1549 CZ PHE A 97 -2.557 -5.939 12.223 1.00 1.54 C ATOM 0 H PHE A 97 -6.453 -2.585 10.947 1.00 1.15 H new ATOM 0 HA PHE A 97 -4.995 -2.322 13.466 1.00 1.29 H new ATOM 0 HB2 PHE A 97 -4.426 -1.818 10.522 1.00 1.31 H new ATOM 0 HB3 PHE A 97 -3.348 -1.202 11.759 1.00 1.31 H new ATOM 0 HD1 PHE A 97 -2.099 -2.714 13.237 1.00 2.27 H new ATOM 0 HD2 PHE A 97 -4.696 -4.260 10.168 1.00 2.11 H new ATOM 0 HE1 PHE A 97 -1.324 -5.021 13.735 1.00 2.35 H new ATOM 0 HE2 PHE A 97 -3.861 -6.557 10.619 1.00 1.91 H new ATOM 0 HZ PHE A 97 -2.221 -6.941 12.444 1.00 1.54 H new ATOM 1559 N HIS A 98 -6.381 0.296 12.082 1.00 1.27 N ATOM 1560 CA HIS A 98 -6.586 1.740 12.254 1.00 1.32 C ATOM 1561 C HIS A 98 -7.696 2.267 11.308 1.00 1.49 C ATOM 1562 O HIS A 98 -7.765 1.791 10.175 1.00 1.49 O ATOM 1563 CB HIS A 98 -5.226 2.429 11.993 1.00 1.31 C ATOM 1564 CG HIS A 98 -5.241 3.926 12.058 1.00 2.04 C ATOM 1565 ND1 HIS A 98 -4.904 4.785 11.041 1.00 2.41 N ATOM 1566 CD2 HIS A 98 -5.516 4.689 13.159 1.00 2.91 C ATOM 1567 CE1 HIS A 98 -5.018 6.038 11.513 1.00 3.25 C ATOM 1568 NE2 HIS A 98 -5.443 6.028 12.784 1.00 3.60 N ATOM 0 H HIS A 98 -6.904 -0.108 11.305 1.00 1.27 H new ATOM 0 HA HIS A 98 -6.928 1.963 13.265 1.00 1.32 H new ATOM 0 HB2 HIS A 98 -4.504 2.058 12.721 1.00 1.31 H new ATOM 0 HB3 HIS A 98 -4.869 2.129 11.008 1.00 1.31 H new ATOM 0 HD1 HIS A 98 -4.619 4.520 10.098 1.00 2.41 H new ATOM 0 HD2 HIS A 98 -5.749 4.318 14.146 1.00 2.91 H new ATOM 0 HE1 HIS A 98 -4.797 6.930 10.946 1.00 3.25 H new ATOM 1577 N PRO A 99 -8.552 3.235 11.707 1.00 1.42 N ATOM 1578 CA PRO A 99 -9.622 3.754 10.850 1.00 1.56 C ATOM 1579 C PRO A 99 -9.154 4.495 9.587 1.00 1.71 C ATOM 1580 O PRO A 99 -9.877 4.472 8.596 1.00 1.66 O ATOM 1581 CB PRO A 99 -10.488 4.652 11.746 1.00 1.96 C ATOM 1582 CG PRO A 99 -9.574 4.997 12.917 1.00 1.87 C ATOM 1583 CD PRO A 99 -8.751 3.724 13.064 1.00 1.59 C ATOM 0 HA PRO A 99 -10.179 2.911 10.440 1.00 1.56 H new ATOM 0 HB2 PRO A 99 -10.814 5.548 11.217 1.00 1.96 H new ATOM 0 HB3 PRO A 99 -11.387 4.134 12.080 1.00 1.96 H new ATOM 0 HG2 PRO A 99 -8.949 5.864 12.705 1.00 1.87 H new ATOM 0 HG3 PRO A 99 -10.138 5.224 13.821 1.00 1.87 H new ATOM 0 HD2 PRO A 99 -7.798 3.926 13.553 1.00 1.59 H new ATOM 0 HD3 PRO A 99 -9.272 2.987 13.675 1.00 1.59 H new ATOM 1591 N SER A 100 -7.964 5.117 9.564 1.00 1.52 N ATOM 1592 CA SER A 100 -7.413 5.741 8.331 1.00 1.57 C ATOM 1593 C SER A 100 -6.812 4.718 7.330 1.00 1.36 C ATOM 1594 O SER A 100 -5.988 5.064 6.471 1.00 1.50 O ATOM 1595 CB SER A 100 -6.403 6.850 8.694 1.00 1.98 C ATOM 1596 OG SER A 100 -6.330 7.855 7.699 1.00 3.13 O ATOM 0 H SER A 100 -7.359 5.206 10.380 1.00 1.52 H new ATOM 0 HA SER A 100 -8.255 6.192 7.805 1.00 1.57 H new ATOM 0 HB2 SER A 100 -6.688 7.302 9.644 1.00 1.98 H new ATOM 0 HB3 SER A 100 -5.416 6.408 8.835 1.00 1.98 H new ATOM 0 HG SER A 100 -5.396 8.125 7.575 1.00 3.13 H new ATOM 1602 N PHE A 101 -7.161 3.429 7.479 1.00 0.99 N ATOM 1603 CA PHE A 101 -6.787 2.350 6.563 1.00 0.79 C ATOM 1604 C PHE A 101 -8.017 1.945 5.719 1.00 1.79 C ATOM 1605 O PHE A 101 -9.162 1.997 6.180 1.00 2.27 O ATOM 1606 CB PHE A 101 -6.211 1.137 7.325 1.00 0.87 C ATOM 1607 CG PHE A 101 -4.848 1.235 8.013 1.00 1.29 C ATOM 1608 CD1 PHE A 101 -4.285 2.451 8.456 1.00 2.54 C ATOM 1609 CD2 PHE A 101 -4.118 0.045 8.207 1.00 1.97 C ATOM 1610 CE1 PHE A 101 -3.026 2.472 9.087 1.00 2.84 C ATOM 1611 CE2 PHE A 101 -2.861 0.062 8.839 1.00 2.07 C ATOM 1612 CZ PHE A 101 -2.317 1.276 9.283 1.00 2.19 C ATOM 0 H PHE A 101 -7.727 3.105 8.263 1.00 0.99 H new ATOM 0 HA PHE A 101 -6.001 2.710 5.899 1.00 0.79 H new ATOM 0 HB2 PHE A 101 -6.939 0.860 8.088 1.00 0.87 H new ATOM 0 HB3 PHE A 101 -6.158 0.308 6.619 1.00 0.87 H new ATOM 0 HD1 PHE A 101 -4.825 3.375 8.310 1.00 2.54 H new ATOM 0 HD2 PHE A 101 -4.529 -0.893 7.866 1.00 1.97 H new ATOM 0 HE1 PHE A 101 -2.605 3.409 9.421 1.00 2.84 H new ATOM 0 HE2 PHE A 101 -2.316 -0.859 8.982 1.00 2.07 H new ATOM 0 HZ PHE A 101 -1.355 1.291 9.774 1.00 2.19 H new ATOM 1622 N LEU A 102 -7.778 1.522 4.476 1.00 0.73 N ATOM 1623 CA LEU A 102 -8.806 1.280 3.453 1.00 0.61 C ATOM 1624 C LEU A 102 -8.553 -0.033 2.688 1.00 0.93 C ATOM 1625 O LEU A 102 -7.427 -0.257 2.238 1.00 1.24 O ATOM 1626 CB LEU A 102 -8.777 2.482 2.480 1.00 0.70 C ATOM 1627 CG LEU A 102 -10.107 3.189 2.173 1.00 0.92 C ATOM 1628 CD1 LEU A 102 -11.219 2.245 1.695 1.00 0.99 C ATOM 1629 CD2 LEU A 102 -10.591 3.979 3.400 1.00 2.25 C ATOM 0 H LEU A 102 -6.834 1.331 4.140 1.00 0.73 H new ATOM 0 HA LEU A 102 -9.782 1.181 3.929 1.00 0.61 H new ATOM 0 HB2 LEU A 102 -8.089 3.224 2.885 1.00 0.70 H new ATOM 0 HB3 LEU A 102 -8.355 2.138 1.536 1.00 0.70 H new ATOM 0 HG LEU A 102 -9.897 3.866 1.345 1.00 0.92 H new ATOM 0 HD11 LEU A 102 -12.125 2.819 1.499 1.00 0.99 H new ATOM 0 HD12 LEU A 102 -10.902 1.744 0.780 1.00 0.99 H new ATOM 0 HD13 LEU A 102 -11.421 1.501 2.465 1.00 0.99 H new ATOM 0 HD21 LEU A 102 -11.534 4.473 3.166 1.00 2.25 H new ATOM 0 HD22 LEU A 102 -10.737 3.297 4.237 1.00 2.25 H new ATOM 0 HD23 LEU A 102 -9.845 4.728 3.668 1.00 2.25 H new ATOM 1641 N GLY A 103 -9.593 -0.850 2.474 1.00 0.60 N ATOM 1642 CA GLY A 103 -9.527 -2.058 1.641 1.00 0.70 C ATOM 1643 C GLY A 103 -10.057 -1.801 0.232 1.00 0.67 C ATOM 1644 O GLY A 103 -11.246 -1.548 0.037 1.00 0.83 O ATOM 0 H GLY A 103 -10.515 -0.689 2.879 1.00 0.60 H new ATOM 0 HA2 GLY A 103 -8.495 -2.405 1.584 1.00 0.70 H new ATOM 0 HA3 GLY A 103 -10.106 -2.855 2.108 1.00 0.70 H new ATOM 1648 N LEU A 104 -9.166 -1.879 -0.757 1.00 0.42 N ATOM 1649 CA LEU A 104 -9.495 -1.716 -2.167 1.00 0.47 C ATOM 1650 C LEU A 104 -9.486 -3.102 -2.819 1.00 1.04 C ATOM 1651 O LEU A 104 -8.486 -3.821 -2.792 1.00 1.31 O ATOM 1652 CB LEU A 104 -8.492 -0.757 -2.843 1.00 0.64 C ATOM 1653 CG LEU A 104 -8.558 0.750 -2.498 1.00 0.78 C ATOM 1654 CD1 LEU A 104 -9.778 1.454 -3.110 1.00 1.63 C ATOM 1655 CD2 LEU A 104 -8.524 1.056 -0.999 1.00 2.25 C ATOM 0 H LEU A 104 -8.176 -2.061 -0.593 1.00 0.42 H new ATOM 0 HA LEU A 104 -10.484 -1.272 -2.284 1.00 0.47 H new ATOM 0 HB2 LEU A 104 -7.488 -1.107 -2.605 1.00 0.64 H new ATOM 0 HB3 LEU A 104 -8.616 -0.855 -3.921 1.00 0.64 H new ATOM 0 HG LEU A 104 -7.646 1.145 -2.946 1.00 0.78 H new ATOM 0 HD11 LEU A 104 -9.767 2.508 -2.832 1.00 1.63 H new ATOM 0 HD12 LEU A 104 -9.743 1.365 -4.196 1.00 1.63 H new ATOM 0 HD13 LEU A 104 -10.691 0.990 -2.737 1.00 1.63 H new ATOM 0 HD21 LEU A 104 -8.574 2.134 -0.847 1.00 2.25 H new ATOM 0 HD22 LEU A 104 -9.375 0.580 -0.511 1.00 2.25 H new ATOM 0 HD23 LEU A 104 -7.599 0.672 -0.570 1.00 2.25 H new ATOM 1667 N SER A 105 -10.613 -3.497 -3.395 1.00 0.50 N ATOM 1668 CA SER A 105 -10.699 -4.608 -4.341 1.00 0.54 C ATOM 1669 C SER A 105 -11.770 -4.291 -5.374 1.00 0.87 C ATOM 1670 O SER A 105 -12.831 -3.785 -5.015 1.00 1.16 O ATOM 1671 CB SER A 105 -11.072 -5.916 -3.665 1.00 0.73 C ATOM 1672 OG SER A 105 -10.793 -6.966 -4.566 1.00 0.96 O ATOM 0 H SER A 105 -11.511 -3.048 -3.217 1.00 0.50 H new ATOM 0 HA SER A 105 -9.716 -4.726 -4.797 1.00 0.54 H new ATOM 0 HB2 SER A 105 -10.505 -6.044 -2.743 1.00 0.73 H new ATOM 0 HB3 SER A 105 -12.128 -5.917 -3.393 1.00 0.73 H new ATOM 0 HG SER A 105 -10.617 -7.789 -4.064 1.00 0.96 H new ATOM 1678 N GLY A 106 -11.517 -4.595 -6.642 1.00 0.74 N ATOM 1679 CA GLY A 106 -12.421 -4.250 -7.733 1.00 0.94 C ATOM 1680 C GLY A 106 -12.121 -4.995 -9.016 1.00 1.05 C ATOM 1681 O GLY A 106 -11.313 -5.917 -9.026 1.00 1.25 O ATOM 0 H GLY A 106 -10.677 -5.089 -6.943 1.00 0.74 H new ATOM 0 HA2 GLY A 106 -13.446 -4.463 -7.428 1.00 0.94 H new ATOM 0 HA3 GLY A 106 -12.361 -3.178 -7.921 1.00 0.94 H new ATOM 1685 N SER A 107 -12.777 -4.583 -10.089 1.00 0.84 N ATOM 1686 CA SER A 107 -12.590 -5.081 -11.455 1.00 0.96 C ATOM 1687 C SER A 107 -11.114 -5.421 -11.792 1.00 0.98 C ATOM 1688 O SER A 107 -10.225 -4.585 -11.573 1.00 1.03 O ATOM 1689 CB SER A 107 -13.204 -4.059 -12.425 1.00 1.18 C ATOM 1690 OG SER A 107 -12.762 -2.727 -12.205 1.00 2.29 O ATOM 0 H SER A 107 -13.491 -3.857 -10.035 1.00 0.84 H new ATOM 0 HA SER A 107 -13.106 -6.036 -11.557 1.00 0.96 H new ATOM 0 HB2 SER A 107 -12.960 -4.349 -13.447 1.00 1.18 H new ATOM 0 HB3 SER A 107 -14.290 -4.092 -12.334 1.00 1.18 H new ATOM 0 HG SER A 107 -13.005 -2.447 -11.298 1.00 2.29 H new ATOM 1696 N PRO A 108 -10.811 -6.648 -12.278 1.00 0.90 N ATOM 1697 CA PRO A 108 -9.435 -7.146 -12.368 1.00 1.02 C ATOM 1698 C PRO A 108 -8.574 -6.357 -13.359 1.00 1.19 C ATOM 1699 O PRO A 108 -7.358 -6.287 -13.188 1.00 1.03 O ATOM 1700 CB PRO A 108 -9.535 -8.629 -12.742 1.00 1.19 C ATOM 1701 CG PRO A 108 -10.927 -8.781 -13.348 1.00 1.11 C ATOM 1702 CD PRO A 108 -11.751 -7.692 -12.664 1.00 0.99 C ATOM 0 HA PRO A 108 -8.926 -7.016 -11.413 1.00 1.02 H new ATOM 0 HB2 PRO A 108 -8.760 -8.911 -13.454 1.00 1.19 H new ATOM 0 HB3 PRO A 108 -9.412 -9.267 -11.867 1.00 1.19 H new ATOM 0 HG2 PRO A 108 -10.908 -8.647 -14.430 1.00 1.11 H new ATOM 0 HG3 PRO A 108 -11.339 -9.772 -13.157 1.00 1.11 H new ATOM 0 HD2 PRO A 108 -12.512 -7.300 -13.338 1.00 0.99 H new ATOM 0 HD3 PRO A 108 -12.271 -8.088 -11.792 1.00 0.99 H new ATOM 1710 N GLU A 109 -9.198 -5.720 -14.350 1.00 0.82 N ATOM 1711 CA GLU A 109 -8.579 -4.771 -15.273 1.00 0.85 C ATOM 1712 C GLU A 109 -8.137 -3.503 -14.528 1.00 1.07 C ATOM 1713 O GLU A 109 -7.026 -3.023 -14.734 1.00 1.33 O ATOM 1714 CB GLU A 109 -9.574 -4.404 -16.394 1.00 0.99 C ATOM 1715 CG GLU A 109 -10.002 -5.574 -17.306 1.00 1.38 C ATOM 1716 CD GLU A 109 -10.794 -6.667 -16.579 1.00 2.12 C ATOM 1717 OE1 GLU A 109 -11.554 -6.319 -15.643 1.00 2.72 O ATOM 1718 OE2 GLU A 109 -10.559 -7.851 -16.895 1.00 3.28 O ATOM 0 H GLU A 109 -10.191 -5.858 -14.539 1.00 0.82 H new ATOM 0 HA GLU A 109 -7.698 -5.238 -15.713 1.00 0.85 H new ATOM 0 HB2 GLU A 109 -10.466 -3.975 -15.939 1.00 0.99 H new ATOM 0 HB3 GLU A 109 -9.127 -3.627 -17.014 1.00 0.99 H new ATOM 0 HG2 GLU A 109 -10.607 -5.183 -18.124 1.00 1.38 H new ATOM 0 HG3 GLU A 109 -9.113 -6.019 -17.752 1.00 1.38 H new ATOM 1725 N ALA A 110 -8.968 -2.984 -13.617 1.00 0.80 N ATOM 1726 CA ALA A 110 -8.669 -1.825 -12.770 1.00 0.81 C ATOM 1727 C ALA A 110 -7.621 -2.163 -11.691 1.00 0.88 C ATOM 1728 O ALA A 110 -6.626 -1.448 -11.552 1.00 0.92 O ATOM 1729 CB ALA A 110 -10.001 -1.319 -12.208 1.00 1.00 C ATOM 0 H ALA A 110 -9.896 -3.371 -13.444 1.00 0.80 H new ATOM 0 HA ALA A 110 -8.205 -1.025 -13.346 1.00 0.81 H new ATOM 0 HB1 ALA A 110 -9.821 -0.454 -11.570 1.00 1.00 H new ATOM 0 HB2 ALA A 110 -10.658 -1.034 -13.030 1.00 1.00 H new ATOM 0 HB3 ALA A 110 -10.473 -2.109 -11.624 1.00 1.00 H new ATOM 1735 N VAL A 111 -7.738 -3.328 -11.040 1.00 0.64 N ATOM 1736 CA VAL A 111 -6.637 -3.910 -10.237 1.00 0.60 C ATOM 1737 C VAL A 111 -5.340 -3.995 -11.065 1.00 1.02 C ATOM 1738 O VAL A 111 -4.260 -3.687 -10.553 1.00 0.85 O ATOM 1739 CB VAL A 111 -7.023 -5.294 -9.657 1.00 0.64 C ATOM 1740 CG1 VAL A 111 -5.839 -6.027 -9.005 1.00 1.02 C ATOM 1741 CG2 VAL A 111 -8.142 -5.148 -8.613 1.00 1.13 C ATOM 0 H VAL A 111 -8.586 -3.894 -11.050 1.00 0.64 H new ATOM 0 HA VAL A 111 -6.457 -3.245 -9.393 1.00 0.60 H new ATOM 0 HB VAL A 111 -7.362 -5.889 -10.505 1.00 0.64 H new ATOM 0 HG11 VAL A 111 -6.175 -6.989 -8.619 1.00 1.02 H new ATOM 0 HG12 VAL A 111 -5.057 -6.187 -9.747 1.00 1.02 H new ATOM 0 HG13 VAL A 111 -5.445 -5.425 -8.186 1.00 1.02 H new ATOM 0 HG21 VAL A 111 -8.400 -6.130 -8.217 1.00 1.13 H new ATOM 0 HG22 VAL A 111 -7.800 -4.507 -7.800 1.00 1.13 H new ATOM 0 HG23 VAL A 111 -9.020 -4.703 -9.081 1.00 1.13 H new ATOM 1751 N ARG A 112 -5.428 -4.352 -12.357 1.00 0.61 N ATOM 1752 CA ARG A 112 -4.270 -4.347 -13.252 1.00 0.64 C ATOM 1753 C ARG A 112 -3.775 -2.938 -13.635 1.00 0.96 C ATOM 1754 O ARG A 112 -2.560 -2.798 -13.755 1.00 1.08 O ATOM 1755 CB ARG A 112 -4.499 -5.258 -14.466 1.00 0.75 C ATOM 1756 CG ARG A 112 -3.161 -5.469 -15.187 1.00 1.54 C ATOM 1757 CD ARG A 112 -3.128 -6.712 -16.067 1.00 2.05 C ATOM 1758 NE ARG A 112 -1.754 -6.920 -16.560 1.00 3.15 N ATOM 1759 CZ ARG A 112 -1.266 -7.957 -17.221 1.00 4.20 C ATOM 1760 NH1 ARG A 112 -2.011 -8.985 -17.584 1.00 4.68 N ATOM 1761 NH2 ARG A 112 0.014 -7.946 -17.511 1.00 5.44 N ATOM 0 H ARG A 112 -6.296 -4.649 -12.802 1.00 0.61 H new ATOM 0 HA ARG A 112 -3.443 -4.770 -12.681 1.00 0.64 H new ATOM 0 HB2 ARG A 112 -4.910 -6.216 -14.147 1.00 0.75 H new ATOM 0 HB3 ARG A 112 -5.226 -4.809 -15.143 1.00 0.75 H new ATOM 0 HG2 ARG A 112 -2.948 -4.594 -15.801 1.00 1.54 H new ATOM 0 HG3 ARG A 112 -2.366 -5.539 -14.445 1.00 1.54 H new ATOM 0 HD2 ARG A 112 -3.460 -7.582 -15.501 1.00 2.05 H new ATOM 0 HD3 ARG A 112 -3.815 -6.597 -16.906 1.00 2.05 H new ATOM 0 HE ARG A 112 -1.094 -6.167 -16.366 1.00 3.15 H new ATOM 0 HH11 ARG A 112 -3.005 -9.000 -17.356 1.00 4.68 H new ATOM 0 HH12 ARG A 112 -1.592 -9.764 -18.093 1.00 4.68 H new ATOM 0 HH21 ARG A 112 0.594 -7.156 -17.228 1.00 5.44 H new ATOM 0 HH22 ARG A 112 0.428 -8.727 -18.020 1.00 5.44 H new ATOM 1775 N GLU A 113 -4.621 -1.912 -13.748 1.00 0.62 N ATOM 1776 CA GLU A 113 -4.175 -0.512 -13.905 1.00 0.67 C ATOM 1777 C GLU A 113 -3.251 -0.106 -12.744 1.00 1.06 C ATOM 1778 O GLU A 113 -2.116 0.324 -12.962 1.00 1.12 O ATOM 1779 CB GLU A 113 -5.355 0.456 -14.002 1.00 0.82 C ATOM 1780 CG GLU A 113 -6.014 0.372 -15.378 1.00 1.03 C ATOM 1781 CD GLU A 113 -5.235 1.138 -16.441 1.00 1.85 C ATOM 1782 OE1 GLU A 113 -5.453 2.367 -16.537 1.00 3.01 O ATOM 1783 OE2 GLU A 113 -4.435 0.476 -17.136 1.00 2.58 O ATOM 0 H GLU A 113 -5.635 -2.020 -13.734 1.00 0.62 H new ATOM 0 HA GLU A 113 -3.620 -0.453 -14.841 1.00 0.67 H new ATOM 0 HB2 GLU A 113 -6.087 0.223 -13.229 1.00 0.82 H new ATOM 0 HB3 GLU A 113 -5.012 1.474 -13.820 1.00 0.82 H new ATOM 0 HG2 GLU A 113 -6.098 -0.673 -15.675 1.00 1.03 H new ATOM 0 HG3 GLU A 113 -7.028 0.768 -15.318 1.00 1.03 H new ATOM 1790 N ALA A 114 -3.691 -0.358 -11.502 1.00 0.58 N ATOM 1791 CA ALA A 114 -2.890 -0.117 -10.296 1.00 0.63 C ATOM 1792 C ALA A 114 -1.541 -0.844 -10.343 1.00 0.90 C ATOM 1793 O ALA A 114 -0.493 -0.231 -10.140 1.00 0.99 O ATOM 1794 CB ALA A 114 -3.717 -0.509 -9.060 1.00 0.71 C ATOM 0 H ALA A 114 -4.618 -0.737 -11.307 1.00 0.58 H new ATOM 0 HA ALA A 114 -2.648 0.944 -10.238 1.00 0.63 H new ATOM 0 HB1 ALA A 114 -3.130 -0.333 -8.159 1.00 0.71 H new ATOM 0 HB2 ALA A 114 -4.625 0.092 -9.024 1.00 0.71 H new ATOM 0 HB3 ALA A 114 -3.983 -1.564 -9.120 1.00 0.71 H new ATOM 1800 N ALA A 115 -1.550 -2.138 -10.668 1.00 0.56 N ATOM 1801 CA ALA A 115 -0.336 -2.929 -10.818 1.00 0.62 C ATOM 1802 C ALA A 115 0.603 -2.390 -11.910 1.00 0.81 C ATOM 1803 O ALA A 115 1.784 -2.163 -11.647 1.00 0.92 O ATOM 1804 CB ALA A 115 -0.759 -4.368 -11.119 1.00 0.69 C ATOM 0 H ALA A 115 -2.407 -2.666 -10.835 1.00 0.56 H new ATOM 0 HA ALA A 115 0.238 -2.875 -9.893 1.00 0.62 H new ATOM 0 HB1 ALA A 115 0.128 -4.991 -11.238 1.00 0.69 H new ATOM 0 HB2 ALA A 115 -1.363 -4.750 -10.296 1.00 0.69 H new ATOM 0 HB3 ALA A 115 -1.344 -4.391 -12.038 1.00 0.69 H new ATOM 1810 N GLN A 116 0.106 -2.184 -13.131 1.00 0.59 N ATOM 1811 CA GLN A 116 0.923 -1.819 -14.293 1.00 0.67 C ATOM 1812 C GLN A 116 1.545 -0.433 -14.164 1.00 1.11 C ATOM 1813 O GLN A 116 2.678 -0.253 -14.611 1.00 1.23 O ATOM 1814 CB GLN A 116 0.081 -1.870 -15.580 1.00 0.78 C ATOM 1815 CG GLN A 116 -0.284 -3.291 -16.037 1.00 1.20 C ATOM 1816 CD GLN A 116 0.880 -4.191 -16.455 1.00 2.12 C ATOM 1817 OE1 GLN A 116 0.737 -5.407 -16.511 1.00 2.32 O ATOM 1818 NE2 GLN A 116 2.054 -3.678 -16.761 1.00 3.36 N ATOM 0 H GLN A 116 -0.888 -2.267 -13.345 1.00 0.59 H new ATOM 0 HA GLN A 116 1.732 -2.548 -14.340 1.00 0.67 H new ATOM 0 HB2 GLN A 116 -0.837 -1.304 -15.423 1.00 0.78 H new ATOM 0 HB3 GLN A 116 0.630 -1.373 -16.380 1.00 0.78 H new ATOM 0 HG2 GLN A 116 -0.822 -3.783 -15.227 1.00 1.20 H new ATOM 0 HG3 GLN A 116 -0.974 -3.213 -16.877 1.00 1.20 H new ATOM 0 HE21 GLN A 116 2.196 -2.669 -16.721 1.00 3.36 H new ATOM 0 HE22 GLN A 116 2.822 -4.290 -17.038 1.00 3.36 H new ATOM 1827 N THR A 117 0.835 0.516 -13.540 1.00 0.66 N ATOM 1828 CA THR A 117 1.332 1.888 -13.338 1.00 0.73 C ATOM 1829 C THR A 117 2.460 1.911 -12.317 1.00 1.05 C ATOM 1830 O THR A 117 3.485 2.555 -12.544 1.00 1.03 O ATOM 1831 CB THR A 117 0.174 2.809 -12.932 1.00 0.84 C ATOM 1832 OG1 THR A 117 -0.622 2.970 -14.075 1.00 1.22 O ATOM 1833 CG2 THR A 117 0.621 4.209 -12.507 1.00 1.00 C ATOM 0 H THR A 117 -0.098 0.357 -13.161 1.00 0.66 H new ATOM 0 HA THR A 117 1.744 2.259 -14.276 1.00 0.73 H new ATOM 0 HB THR A 117 -0.334 2.354 -12.082 1.00 0.84 H new ATOM 0 HG1 THR A 117 -1.381 3.553 -13.865 1.00 1.22 H new ATOM 0 HG21 THR A 117 -0.252 4.802 -12.234 1.00 1.00 H new ATOM 0 HG22 THR A 117 1.290 4.133 -11.650 1.00 1.00 H new ATOM 0 HG23 THR A 117 1.144 4.691 -13.333 1.00 1.00 H new ATOM 1841 N PHE A 118 2.261 1.249 -11.178 1.00 0.65 N ATOM 1842 CA PHE A 118 3.233 1.185 -10.084 1.00 0.67 C ATOM 1843 C PHE A 118 4.421 0.238 -10.369 1.00 1.74 C ATOM 1844 O PHE A 118 5.502 0.449 -9.821 1.00 2.06 O ATOM 1845 CB PHE A 118 2.479 0.881 -8.777 1.00 0.72 C ATOM 1846 CG PHE A 118 1.719 2.079 -8.216 1.00 0.89 C ATOM 1847 CD1 PHE A 118 0.650 2.668 -8.924 1.00 2.15 C ATOM 1848 CD2 PHE A 118 2.117 2.653 -6.994 1.00 1.83 C ATOM 1849 CE1 PHE A 118 0.033 3.838 -8.448 1.00 2.23 C ATOM 1850 CE2 PHE A 118 1.470 3.798 -6.493 1.00 1.70 C ATOM 1851 CZ PHE A 118 0.436 4.400 -7.228 1.00 1.17 C ATOM 0 H PHE A 118 1.403 0.732 -10.985 1.00 0.65 H new ATOM 0 HA PHE A 118 3.720 2.155 -9.980 1.00 0.67 H new ATOM 0 HB2 PHE A 118 1.777 0.066 -8.954 1.00 0.72 H new ATOM 0 HB3 PHE A 118 3.191 0.531 -8.030 1.00 0.72 H new ATOM 0 HD1 PHE A 118 0.302 2.215 -9.841 1.00 2.15 H new ATOM 0 HD2 PHE A 118 2.928 2.210 -6.435 1.00 1.83 H new ATOM 0 HE1 PHE A 118 -0.753 4.305 -9.023 1.00 2.23 H new ATOM 0 HE2 PHE A 118 1.769 4.214 -5.542 1.00 1.70 H new ATOM 0 HZ PHE A 118 -0.047 5.292 -6.856 1.00 1.17 H new ATOM 1861 N GLY A 119 4.251 -0.762 -11.253 1.00 0.66 N ATOM 1862 CA GLY A 119 5.277 -1.761 -11.626 1.00 0.68 C ATOM 1863 C GLY A 119 5.135 -3.121 -10.938 1.00 0.75 C ATOM 1864 O GLY A 119 6.115 -3.851 -10.825 1.00 0.86 O ATOM 0 H GLY A 119 3.369 -0.904 -11.745 1.00 0.66 H new ATOM 0 HA2 GLY A 119 5.241 -1.911 -12.705 1.00 0.68 H new ATOM 0 HA3 GLY A 119 6.261 -1.354 -11.393 1.00 0.68 H new ATOM 1868 N VAL A 120 3.937 -3.447 -10.467 1.00 0.54 N ATOM 1869 CA VAL A 120 3.614 -4.630 -9.653 1.00 0.51 C ATOM 1870 C VAL A 120 3.140 -5.780 -10.544 1.00 0.73 C ATOM 1871 O VAL A 120 2.604 -5.553 -11.635 1.00 0.99 O ATOM 1872 CB VAL A 120 2.531 -4.319 -8.590 1.00 0.60 C ATOM 1873 CG1 VAL A 120 2.641 -5.249 -7.370 1.00 1.37 C ATOM 1874 CG2 VAL A 120 2.597 -2.861 -8.116 1.00 1.52 C ATOM 0 H VAL A 120 3.117 -2.868 -10.648 1.00 0.54 H new ATOM 0 HA VAL A 120 4.527 -4.922 -9.134 1.00 0.51 H new ATOM 0 HB VAL A 120 1.572 -4.489 -9.080 1.00 0.60 H new ATOM 0 HG11 VAL A 120 1.863 -4.997 -6.649 1.00 1.37 H new ATOM 0 HG12 VAL A 120 2.518 -6.284 -7.689 1.00 1.37 H new ATOM 0 HG13 VAL A 120 3.620 -5.126 -6.906 1.00 1.37 H new ATOM 0 HG21 VAL A 120 1.821 -2.685 -7.371 1.00 1.52 H new ATOM 0 HG22 VAL A 120 3.574 -2.666 -7.675 1.00 1.52 H new ATOM 0 HG23 VAL A 120 2.443 -2.195 -8.965 1.00 1.52 H new ATOM 1884 N PHE A 121 3.307 -7.013 -10.058 1.00 0.81 N ATOM 1885 CA PHE A 121 3.011 -8.237 -10.794 1.00 0.89 C ATOM 1886 C PHE A 121 2.573 -9.382 -9.867 1.00 1.68 C ATOM 1887 O PHE A 121 3.222 -9.699 -8.869 1.00 1.66 O ATOM 1888 CB PHE A 121 4.230 -8.622 -11.653 1.00 0.93 C ATOM 1889 CG PHE A 121 5.565 -8.661 -10.925 1.00 0.96 C ATOM 1890 CD1 PHE A 121 6.347 -7.491 -10.820 1.00 1.80 C ATOM 1891 CD2 PHE A 121 6.034 -9.863 -10.358 1.00 2.22 C ATOM 1892 CE1 PHE A 121 7.590 -7.529 -10.163 1.00 1.87 C ATOM 1893 CE2 PHE A 121 7.279 -9.899 -9.702 1.00 2.00 C ATOM 1894 CZ PHE A 121 8.060 -8.734 -9.612 1.00 1.08 C ATOM 0 H PHE A 121 3.661 -7.188 -9.118 1.00 0.81 H new ATOM 0 HA PHE A 121 2.162 -8.051 -11.452 1.00 0.89 H new ATOM 0 HB2 PHE A 121 4.047 -9.603 -12.091 1.00 0.93 H new ATOM 0 HB3 PHE A 121 4.308 -7.914 -12.478 1.00 0.93 H new ATOM 0 HD1 PHE A 121 5.990 -6.564 -11.245 1.00 1.80 H new ATOM 0 HD2 PHE A 121 5.436 -10.760 -10.427 1.00 2.22 H new ATOM 0 HE1 PHE A 121 8.184 -6.631 -10.082 1.00 1.87 H new ATOM 0 HE2 PHE A 121 7.634 -10.822 -9.268 1.00 2.00 H new ATOM 0 HZ PHE A 121 9.021 -8.764 -9.120 1.00 1.08 H new ATOM 1904 N TYR A 122 1.476 -10.034 -10.249 1.00 1.00 N ATOM 1905 CA TYR A 122 1.042 -11.316 -9.699 1.00 0.94 C ATOM 1906 C TYR A 122 1.139 -12.411 -10.771 1.00 1.31 C ATOM 1907 O TYR A 122 0.856 -12.173 -11.947 1.00 1.37 O ATOM 1908 CB TYR A 122 -0.372 -11.194 -9.097 1.00 1.01 C ATOM 1909 CG TYR A 122 -1.363 -10.360 -9.895 1.00 0.92 C ATOM 1910 CD1 TYR A 122 -1.940 -10.868 -11.078 1.00 2.08 C ATOM 1911 CD2 TYR A 122 -1.699 -9.062 -9.460 1.00 1.85 C ATOM 1912 CE1 TYR A 122 -2.841 -10.081 -11.822 1.00 2.07 C ATOM 1913 CE2 TYR A 122 -2.613 -8.277 -10.188 1.00 2.03 C ATOM 1914 CZ TYR A 122 -3.186 -8.787 -11.375 1.00 1.27 C ATOM 1915 OH TYR A 122 -4.074 -8.041 -12.088 1.00 1.65 O ATOM 0 H TYR A 122 0.848 -9.675 -10.969 1.00 1.00 H new ATOM 0 HA TYR A 122 1.705 -11.606 -8.884 1.00 0.94 H new ATOM 0 HB2 TYR A 122 -0.783 -12.196 -8.978 1.00 1.01 H new ATOM 0 HB3 TYR A 122 -0.285 -10.764 -8.099 1.00 1.01 H new ATOM 0 HD1 TYR A 122 -1.690 -11.863 -11.414 1.00 2.08 H new ATOM 0 HD2 TYR A 122 -1.251 -8.666 -8.560 1.00 1.85 H new ATOM 0 HE1 TYR A 122 -3.268 -10.468 -12.735 1.00 2.07 H new ATOM 0 HE2 TYR A 122 -2.875 -7.289 -9.841 1.00 2.03 H new ATOM 0 HH TYR A 122 -4.204 -7.176 -11.646 1.00 1.65 H new ATOM 1925 N GLN A 123 1.544 -13.612 -10.374 1.00 1.15 N ATOM 1926 CA GLN A 123 1.747 -14.769 -11.245 1.00 1.56 C ATOM 1927 C GLN A 123 0.927 -15.929 -10.674 1.00 1.49 C ATOM 1928 O GLN A 123 0.759 -16.003 -9.465 1.00 1.55 O ATOM 1929 CB GLN A 123 3.243 -15.140 -11.288 1.00 2.06 C ATOM 1930 CG GLN A 123 4.170 -13.967 -11.646 1.00 3.13 C ATOM 1931 CD GLN A 123 5.620 -14.423 -11.788 1.00 3.87 C ATOM 1932 OE1 GLN A 123 6.132 -14.583 -12.884 1.00 4.07 O ATOM 1933 NE2 GLN A 123 6.323 -14.658 -10.703 1.00 4.65 N ATOM 0 H GLN A 123 1.749 -13.817 -9.396 1.00 1.15 H new ATOM 0 HA GLN A 123 1.427 -14.545 -12.263 1.00 1.56 H new ATOM 0 HB2 GLN A 123 3.536 -15.537 -10.316 1.00 2.06 H new ATOM 0 HB3 GLN A 123 3.388 -15.939 -12.016 1.00 2.06 H new ATOM 0 HG2 GLN A 123 3.838 -13.511 -12.579 1.00 3.13 H new ATOM 0 HG3 GLN A 123 4.103 -13.200 -10.874 1.00 3.13 H new ATOM 0 HE21 GLN A 123 5.901 -14.526 -9.784 1.00 4.65 H new ATOM 0 HE22 GLN A 123 7.290 -14.972 -10.780 1.00 4.65 H new ATOM 1942 N LYS A 124 0.378 -16.832 -11.493 1.00 1.59 N ATOM 1943 CA LYS A 124 -0.301 -18.026 -10.961 1.00 1.50 C ATOM 1944 C LYS A 124 -0.155 -19.276 -11.842 1.00 1.58 C ATOM 1945 O LYS A 124 -0.340 -19.218 -13.055 1.00 1.84 O ATOM 1946 CB LYS A 124 -1.754 -17.711 -10.531 1.00 1.54 C ATOM 1947 CG LYS A 124 -2.576 -16.833 -11.491 1.00 1.91 C ATOM 1948 CD LYS A 124 -4.014 -16.604 -10.992 1.00 2.04 C ATOM 1949 CE LYS A 124 -4.143 -15.960 -9.598 1.00 3.13 C ATOM 1950 NZ LYS A 124 -3.716 -14.541 -9.553 1.00 4.63 N ATOM 0 H LYS A 124 0.387 -16.765 -12.511 1.00 1.59 H new ATOM 0 HA LYS A 124 0.230 -18.304 -10.050 1.00 1.50 H new ATOM 0 HB2 LYS A 124 -2.282 -18.655 -10.394 1.00 1.54 H new ATOM 0 HB3 LYS A 124 -1.724 -17.219 -9.559 1.00 1.54 H new ATOM 0 HG2 LYS A 124 -2.079 -15.870 -11.614 1.00 1.91 H new ATOM 0 HG3 LYS A 124 -2.606 -17.304 -12.474 1.00 1.91 H new ATOM 0 HD2 LYS A 124 -4.533 -15.973 -11.713 1.00 2.04 H new ATOM 0 HD3 LYS A 124 -4.531 -17.563 -10.978 1.00 2.04 H new ATOM 0 HE2 LYS A 124 -5.181 -16.028 -9.271 1.00 3.13 H new ATOM 0 HE3 LYS A 124 -3.547 -16.532 -8.887 1.00 3.13 H new ATOM 0 HZ1 LYS A 124 -3.668 -14.224 -8.564 1.00 4.63 H new ATOM 0 HZ2 LYS A 124 -2.778 -14.447 -9.993 1.00 4.63 H new ATOM 0 HZ3 LYS A 124 -4.402 -13.956 -10.071 1.00 4.63 H new ATOM 1964 N SER A 125 0.150 -20.414 -11.221 1.00 1.52 N ATOM 1965 CA SER A 125 0.082 -21.754 -11.821 1.00 1.75 C ATOM 1966 C SER A 125 -1.156 -22.508 -11.302 1.00 1.88 C ATOM 1967 O SER A 125 -1.680 -22.170 -10.243 1.00 2.16 O ATOM 1968 CB SER A 125 1.349 -22.546 -11.466 1.00 2.57 C ATOM 1969 OG SER A 125 2.485 -21.976 -12.089 1.00 2.89 O ATOM 0 H SER A 125 0.463 -20.434 -10.250 1.00 1.52 H new ATOM 0 HA SER A 125 0.008 -21.650 -12.903 1.00 1.75 H new ATOM 0 HB2 SER A 125 1.487 -22.556 -10.385 1.00 2.57 H new ATOM 0 HB3 SER A 125 1.236 -23.583 -11.782 1.00 2.57 H new ATOM 0 HG SER A 125 3.283 -22.493 -11.850 1.00 2.89 H new ATOM 1975 N GLN A 126 -1.640 -23.538 -12.013 1.00 2.36 N ATOM 1976 CA GLN A 126 -2.743 -24.391 -11.565 1.00 2.70 C ATOM 1977 C GLN A 126 -4.089 -23.643 -11.438 1.00 3.01 C ATOM 1978 O GLN A 126 -4.968 -24.068 -10.692 1.00 3.50 O ATOM 1979 CB GLN A 126 -2.339 -25.114 -10.264 1.00 2.84 C ATOM 1980 CG GLN A 126 -3.012 -26.484 -10.192 1.00 4.66 C ATOM 1981 CD GLN A 126 -2.952 -27.098 -8.795 1.00 5.13 C ATOM 1982 OE1 GLN A 126 -2.179 -28.002 -8.545 1.00 5.28 O ATOM 1983 NE2 GLN A 126 -3.738 -26.664 -7.834 1.00 6.34 N ATOM 0 H GLN A 126 -1.269 -23.802 -12.926 1.00 2.36 H new ATOM 0 HA GLN A 126 -2.923 -25.137 -12.339 1.00 2.70 H new ATOM 0 HB2 GLN A 126 -1.256 -25.230 -10.225 1.00 2.84 H new ATOM 0 HB3 GLN A 126 -2.627 -24.513 -9.401 1.00 2.84 H new ATOM 0 HG2 GLN A 126 -4.054 -26.389 -10.498 1.00 4.66 H new ATOM 0 HG3 GLN A 126 -2.532 -27.158 -10.901 1.00 4.66 H new ATOM 0 HE21 GLN A 126 -4.396 -25.906 -8.016 1.00 6.34 H new ATOM 0 HE22 GLN A 126 -3.689 -27.085 -6.906 1.00 6.34 H new ATOM 1992 N TYR A 127 -4.276 -22.517 -12.141 1.00 2.72 N ATOM 1993 CA TYR A 127 -5.498 -21.703 -12.082 1.00 3.27 C ATOM 1994 C TYR A 127 -6.699 -22.401 -12.760 1.00 4.20 C ATOM 1995 O TYR A 127 -7.004 -22.150 -13.923 1.00 5.10 O ATOM 1996 CB TYR A 127 -5.197 -20.298 -12.634 1.00 3.77 C ATOM 1997 CG TYR A 127 -6.315 -19.281 -12.467 1.00 4.83 C ATOM 1998 CD1 TYR A 127 -6.861 -19.026 -11.191 1.00 6.17 C ATOM 1999 CD2 TYR A 127 -6.770 -18.539 -13.575 1.00 5.44 C ATOM 2000 CE1 TYR A 127 -7.854 -18.042 -11.022 1.00 7.78 C ATOM 2001 CE2 TYR A 127 -7.762 -17.550 -13.415 1.00 6.84 C ATOM 2002 CZ TYR A 127 -8.305 -17.299 -12.135 1.00 7.92 C ATOM 2003 OH TYR A 127 -9.258 -16.342 -11.968 1.00 9.58 O ATOM 0 H TYR A 127 -3.572 -22.141 -12.776 1.00 2.72 H new ATOM 0 HA TYR A 127 -5.808 -21.588 -11.043 1.00 3.27 H new ATOM 0 HB2 TYR A 127 -4.304 -19.915 -12.141 1.00 3.77 H new ATOM 0 HB3 TYR A 127 -4.963 -20.385 -13.695 1.00 3.77 H new ATOM 0 HD1 TYR A 127 -6.515 -19.590 -10.337 1.00 6.17 H new ATOM 0 HD2 TYR A 127 -6.356 -18.729 -14.554 1.00 5.44 H new ATOM 0 HE1 TYR A 127 -8.270 -17.856 -10.043 1.00 7.78 H new ATOM 0 HE2 TYR A 127 -8.106 -16.985 -14.269 1.00 6.84 H new ATOM 0 HH TYR A 127 -9.456 -15.923 -12.832 1.00 9.58 H new ATOM 2013 N ARG A 128 -7.328 -23.294 -11.973 1.00 4.29 N ATOM 2014 CA ARG A 128 -8.452 -24.242 -12.197 1.00 5.12 C ATOM 2015 C ARG A 128 -8.125 -25.688 -11.745 1.00 4.21 C ATOM 2016 O ARG A 128 -8.710 -26.646 -12.238 1.00 4.73 O ATOM 2017 CB ARG A 128 -9.075 -24.192 -13.614 1.00 6.99 C ATOM 2018 CG ARG A 128 -10.009 -22.986 -13.822 1.00 8.99 C ATOM 2019 CD ARG A 128 -11.349 -23.171 -13.088 1.00 10.02 C ATOM 2020 NE ARG A 128 -12.187 -21.961 -13.166 1.00 11.90 N ATOM 2021 CZ ARG A 128 -13.012 -21.612 -14.150 1.00 13.33 C ATOM 2022 NH1 ARG A 128 -13.157 -22.345 -15.233 1.00 13.40 N ATOM 2023 NH2 ARG A 128 -13.708 -20.499 -14.050 1.00 15.03 N ATOM 0 H ARG A 128 -7.010 -23.384 -11.008 1.00 4.29 H new ATOM 0 HA ARG A 128 -9.239 -23.875 -11.538 1.00 5.12 H new ATOM 0 HB2 ARG A 128 -8.276 -24.157 -14.354 1.00 6.99 H new ATOM 0 HB3 ARG A 128 -9.634 -25.111 -13.791 1.00 6.99 H new ATOM 0 HG2 ARG A 128 -9.520 -22.080 -13.463 1.00 8.99 H new ATOM 0 HG3 ARG A 128 -10.194 -22.848 -14.887 1.00 8.99 H new ATOM 0 HD2 ARG A 128 -11.887 -24.014 -13.521 1.00 10.02 H new ATOM 0 HD3 ARG A 128 -11.160 -23.416 -12.043 1.00 10.02 H new ATOM 0 HE ARG A 128 -12.128 -21.318 -12.376 1.00 11.90 H new ATOM 0 HH11 ARG A 128 -12.628 -23.211 -15.337 1.00 13.40 H new ATOM 0 HH12 ARG A 128 -13.798 -22.047 -15.968 1.00 13.40 H new ATOM 0 HH21 ARG A 128 -13.613 -19.911 -13.222 1.00 15.03 H new ATOM 0 HH22 ARG A 128 -14.342 -20.225 -14.800 1.00 15.03 H new ATOM 2037 N GLY A 129 -7.211 -25.851 -10.778 1.00 3.12 N ATOM 2038 CA GLY A 129 -6.983 -27.098 -10.036 1.00 3.55 C ATOM 2039 C GLY A 129 -8.141 -27.466 -9.087 1.00 3.48 C ATOM 2040 O GLY A 129 -9.190 -26.821 -9.123 1.00 3.47 O ATOM 0 H GLY A 129 -6.592 -25.096 -10.482 1.00 3.12 H new ATOM 0 HA2 GLY A 129 -6.832 -27.912 -10.745 1.00 3.55 H new ATOM 0 HA3 GLY A 129 -6.064 -27.005 -9.457 1.00 3.55 H new ATOM 2044 N PRO A 130 -7.978 -28.512 -8.253 1.00 4.40 N ATOM 2045 CA PRO A 130 -9.084 -29.152 -7.535 1.00 5.09 C ATOM 2046 C PRO A 130 -9.597 -28.383 -6.306 1.00 4.55 C ATOM 2047 O PRO A 130 -10.695 -28.682 -5.844 1.00 4.91 O ATOM 2048 CB PRO A 130 -8.547 -30.532 -7.139 1.00 6.57 C ATOM 2049 CG PRO A 130 -7.045 -30.297 -6.985 1.00 6.65 C ATOM 2050 CD PRO A 130 -6.753 -29.284 -8.090 1.00 5.59 C ATOM 0 HA PRO A 130 -9.961 -29.193 -8.181 1.00 5.09 H new ATOM 0 HB2 PRO A 130 -8.995 -30.886 -6.211 1.00 6.57 H new ATOM 0 HB3 PRO A 130 -8.760 -31.280 -7.902 1.00 6.57 H new ATOM 0 HG2 PRO A 130 -6.795 -29.905 -5.999 1.00 6.65 H new ATOM 0 HG3 PRO A 130 -6.475 -31.217 -7.117 1.00 6.65 H new ATOM 0 HD2 PRO A 130 -5.917 -28.639 -7.819 1.00 5.59 H new ATOM 0 HD3 PRO A 130 -6.480 -29.786 -9.018 1.00 5.59 H new ATOM 2058 N GLY A 131 -8.839 -27.419 -5.762 1.00 4.21 N ATOM 2059 CA GLY A 131 -9.236 -26.702 -4.539 1.00 4.14 C ATOM 2060 C GLY A 131 -8.202 -25.720 -3.996 1.00 3.61 C ATOM 2061 O GLY A 131 -8.087 -25.578 -2.786 1.00 4.20 O ATOM 0 H GLY A 131 -7.945 -27.117 -6.150 1.00 4.21 H new ATOM 0 HA2 GLY A 131 -10.159 -26.158 -4.739 1.00 4.14 H new ATOM 0 HA3 GLY A 131 -9.459 -27.435 -3.764 1.00 4.14 H new ATOM 2065 N GLU A 132 -7.436 -25.091 -4.891 1.00 2.88 N ATOM 2066 CA GLU A 132 -6.251 -24.256 -4.649 1.00 2.97 C ATOM 2067 C GLU A 132 -5.623 -23.959 -6.019 1.00 2.53 C ATOM 2068 O GLU A 132 -5.664 -24.788 -6.935 1.00 2.78 O ATOM 2069 CB GLU A 132 -5.270 -24.926 -3.650 1.00 4.08 C ATOM 2070 CG GLU A 132 -3.792 -24.488 -3.657 1.00 5.38 C ATOM 2071 CD GLU A 132 -3.505 -23.024 -3.300 1.00 6.89 C ATOM 2072 OE1 GLU A 132 -4.250 -22.394 -2.513 1.00 7.48 O ATOM 2073 OE2 GLU A 132 -2.490 -22.507 -3.815 1.00 8.04 O ATOM 0 H GLU A 132 -7.644 -25.157 -5.887 1.00 2.88 H new ATOM 0 HA GLU A 132 -6.524 -23.317 -4.168 1.00 2.97 H new ATOM 0 HB2 GLU A 132 -5.659 -24.762 -2.645 1.00 4.08 H new ATOM 0 HB3 GLU A 132 -5.297 -26.001 -3.831 1.00 4.08 H new ATOM 0 HG2 GLU A 132 -3.246 -25.122 -2.958 1.00 5.38 H new ATOM 0 HG3 GLU A 132 -3.384 -24.682 -4.649 1.00 5.38 H new ATOM 2080 N TYR A 133 -5.042 -22.770 -6.163 1.00 2.03 N ATOM 2081 CA TYR A 133 -4.248 -22.371 -7.320 1.00 1.67 C ATOM 2082 C TYR A 133 -3.008 -21.598 -6.865 1.00 1.80 C ATOM 2083 O TYR A 133 -3.082 -20.682 -6.042 1.00 2.25 O ATOM 2084 CB TYR A 133 -5.097 -21.587 -8.332 1.00 1.57 C ATOM 2085 CG TYR A 133 -5.845 -20.358 -7.828 1.00 1.76 C ATOM 2086 CD1 TYR A 133 -5.173 -19.126 -7.681 1.00 2.76 C ATOM 2087 CD2 TYR A 133 -7.236 -20.420 -7.609 1.00 2.41 C ATOM 2088 CE1 TYR A 133 -5.882 -17.969 -7.306 1.00 3.30 C ATOM 2089 CE2 TYR A 133 -7.958 -19.257 -7.277 1.00 2.69 C ATOM 2090 CZ TYR A 133 -7.282 -18.023 -7.130 1.00 2.80 C ATOM 2091 OH TYR A 133 -7.970 -16.884 -6.846 1.00 3.50 O ATOM 0 H TYR A 133 -5.113 -22.037 -5.457 1.00 2.03 H new ATOM 0 HA TYR A 133 -3.903 -23.265 -7.840 1.00 1.67 H new ATOM 0 HB2 TYR A 133 -4.443 -21.272 -9.145 1.00 1.57 H new ATOM 0 HB3 TYR A 133 -5.828 -22.273 -8.759 1.00 1.57 H new ATOM 0 HD1 TYR A 133 -4.109 -19.070 -7.857 1.00 2.76 H new ATOM 0 HD2 TYR A 133 -7.751 -21.365 -7.696 1.00 2.41 H new ATOM 0 HE1 TYR A 133 -5.355 -17.039 -7.153 1.00 3.30 H new ATOM 0 HE2 TYR A 133 -9.027 -19.307 -7.135 1.00 2.69 H new ATOM 0 HH TYR A 133 -8.892 -16.970 -7.167 1.00 3.50 H new ATOM 2101 N LEU A 134 -1.850 -21.919 -7.438 1.00 1.66 N ATOM 2102 CA LEU A 134 -0.563 -21.625 -6.823 1.00 2.06 C ATOM 2103 C LEU A 134 -0.153 -20.247 -7.337 1.00 1.97 C ATOM 2104 O LEU A 134 0.484 -20.110 -8.381 1.00 2.37 O ATOM 2105 CB LEU A 134 0.467 -22.721 -7.164 1.00 2.70 C ATOM 2106 CG LEU A 134 0.357 -24.008 -6.317 1.00 2.90 C ATOM 2107 CD1 LEU A 134 -0.903 -24.835 -6.615 1.00 4.24 C ATOM 2108 CD2 LEU A 134 1.589 -24.887 -6.575 1.00 3.67 C ATOM 0 H LEU A 134 -1.780 -22.389 -8.340 1.00 1.66 H new ATOM 0 HA LEU A 134 -0.622 -21.614 -5.735 1.00 2.06 H new ATOM 0 HB2 LEU A 134 0.358 -22.986 -8.216 1.00 2.70 H new ATOM 0 HB3 LEU A 134 1.468 -22.308 -7.041 1.00 2.70 H new ATOM 0 HG LEU A 134 0.296 -23.691 -5.276 1.00 2.90 H new ATOM 0 HD11 LEU A 134 -0.913 -25.723 -5.984 1.00 4.24 H new ATOM 0 HD12 LEU A 134 -1.789 -24.234 -6.410 1.00 4.24 H new ATOM 0 HD13 LEU A 134 -0.902 -25.135 -7.663 1.00 4.24 H new ATOM 0 HD21 LEU A 134 1.518 -25.797 -5.980 1.00 3.67 H new ATOM 0 HD22 LEU A 134 1.635 -25.147 -7.632 1.00 3.67 H new ATOM 0 HD23 LEU A 134 2.490 -24.341 -6.296 1.00 3.67 H new ATOM 2120 N VAL A 135 -0.633 -19.247 -6.601 1.00 1.64 N ATOM 2121 CA VAL A 135 -0.493 -17.810 -6.865 1.00 1.38 C ATOM 2122 C VAL A 135 0.665 -17.188 -6.076 1.00 1.58 C ATOM 2123 O VAL A 135 0.917 -17.540 -4.923 1.00 1.71 O ATOM 2124 CB VAL A 135 -1.822 -17.072 -6.570 1.00 1.57 C ATOM 2125 CG1 VAL A 135 -2.308 -17.233 -5.120 1.00 2.51 C ATOM 2126 CG2 VAL A 135 -1.789 -15.576 -6.931 1.00 1.84 C ATOM 0 H VAL A 135 -1.165 -19.426 -5.749 1.00 1.64 H new ATOM 0 HA VAL A 135 -0.256 -17.694 -7.923 1.00 1.38 H new ATOM 0 HB VAL A 135 -2.537 -17.567 -7.227 1.00 1.57 H new ATOM 0 HG11 VAL A 135 -3.243 -16.689 -4.987 1.00 2.51 H new ATOM 0 HG12 VAL A 135 -2.469 -18.290 -4.905 1.00 2.51 H new ATOM 0 HG13 VAL A 135 -1.557 -16.834 -4.438 1.00 2.51 H new ATOM 0 HG21 VAL A 135 -2.753 -15.124 -6.698 1.00 1.84 H new ATOM 0 HG22 VAL A 135 -1.007 -15.080 -6.356 1.00 1.84 H new ATOM 0 HG23 VAL A 135 -1.584 -15.463 -7.995 1.00 1.84 H new ATOM 2136 N ASP A 136 1.325 -16.238 -6.734 1.00 1.09 N ATOM 2137 CA ASP A 136 2.473 -15.441 -6.313 1.00 1.19 C ATOM 2138 C ASP A 136 2.207 -13.939 -6.571 1.00 1.20 C ATOM 2139 O ASP A 136 1.483 -13.569 -7.498 1.00 1.40 O ATOM 2140 CB ASP A 136 3.691 -15.934 -7.110 1.00 1.57 C ATOM 2141 CG ASP A 136 4.871 -14.974 -7.020 1.00 3.07 C ATOM 2142 OD1 ASP A 136 5.254 -14.656 -5.876 1.00 4.57 O ATOM 2143 OD2 ASP A 136 5.333 -14.521 -8.097 1.00 3.63 O ATOM 0 H ASP A 136 1.036 -15.981 -7.678 1.00 1.09 H new ATOM 0 HA ASP A 136 2.655 -15.555 -5.244 1.00 1.19 H new ATOM 0 HB2 ASP A 136 3.993 -16.913 -6.738 1.00 1.57 H new ATOM 0 HB3 ASP A 136 3.410 -16.063 -8.155 1.00 1.57 H new ATOM 2148 N HIS A 137 2.748 -13.064 -5.722 1.00 0.90 N ATOM 2149 CA HIS A 137 2.591 -11.608 -5.823 1.00 0.84 C ATOM 2150 C HIS A 137 3.799 -10.814 -5.281 1.00 1.08 C ATOM 2151 O HIS A 137 4.320 -11.131 -4.203 1.00 1.26 O ATOM 2152 CB HIS A 137 1.279 -11.202 -5.128 1.00 0.98 C ATOM 2153 CG HIS A 137 1.129 -11.727 -3.719 1.00 1.46 C ATOM 2154 ND1 HIS A 137 2.019 -11.556 -2.683 1.00 2.50 N ATOM 2155 CD2 HIS A 137 0.134 -12.540 -3.253 1.00 1.93 C ATOM 2156 CE1 HIS A 137 1.560 -12.233 -1.620 1.00 2.79 C ATOM 2157 NE2 HIS A 137 0.401 -12.849 -1.912 1.00 2.38 N ATOM 0 H HIS A 137 3.320 -13.351 -4.928 1.00 0.90 H new ATOM 0 HA HIS A 137 2.546 -11.348 -6.881 1.00 0.84 H new ATOM 0 HB2 HIS A 137 1.216 -10.114 -5.106 1.00 0.98 H new ATOM 0 HB3 HIS A 137 0.440 -11.558 -5.726 1.00 0.98 H new ATOM 0 HD1 HIS A 137 2.879 -11.009 -2.718 1.00 2.50 H new ATOM 0 HD2 HIS A 137 -0.716 -12.886 -3.823 1.00 1.93 H new ATOM 0 HE1 HIS A 137 2.054 -12.277 -0.661 1.00 2.79 H new ATOM 2166 N THR A 138 4.164 -9.696 -5.933 1.00 0.76 N ATOM 2167 CA THR A 138 5.136 -8.733 -5.377 1.00 0.83 C ATOM 2168 C THR A 138 4.585 -8.155 -4.075 1.00 1.23 C ATOM 2169 O THR A 138 3.653 -7.354 -4.084 1.00 1.99 O ATOM 2170 CB THR A 138 5.504 -7.590 -6.350 1.00 0.93 C ATOM 2171 OG1 THR A 138 4.930 -7.744 -7.626 1.00 1.66 O ATOM 2172 CG2 THR A 138 7.016 -7.507 -6.528 1.00 1.40 C ATOM 0 H THR A 138 3.800 -9.435 -6.849 1.00 0.76 H new ATOM 0 HA THR A 138 6.059 -9.284 -5.195 1.00 0.83 H new ATOM 0 HB THR A 138 5.108 -6.680 -5.899 1.00 0.93 H new ATOM 0 HG1 THR A 138 5.619 -7.619 -8.312 1.00 1.66 H new ATOM 0 HG21 THR A 138 7.257 -6.697 -7.216 1.00 1.40 H new ATOM 0 HG22 THR A 138 7.486 -7.316 -5.563 1.00 1.40 H new ATOM 0 HG23 THR A 138 7.387 -8.449 -6.932 1.00 1.40 H new ATOM 2180 N ALA A 139 5.185 -8.524 -2.941 1.00 0.93 N ATOM 2181 CA ALA A 139 4.827 -8.042 -1.599 1.00 0.92 C ATOM 2182 C ALA A 139 5.328 -6.600 -1.327 1.00 0.92 C ATOM 2183 O ALA A 139 5.850 -6.288 -0.253 1.00 1.50 O ATOM 2184 CB ALA A 139 5.343 -9.068 -0.578 1.00 1.16 C ATOM 0 H ALA A 139 5.959 -9.188 -2.928 1.00 0.93 H new ATOM 0 HA ALA A 139 3.743 -7.963 -1.511 1.00 0.92 H new ATOM 0 HB1 ALA A 139 5.092 -8.737 0.430 1.00 1.16 H new ATOM 0 HB2 ALA A 139 4.879 -10.036 -0.768 1.00 1.16 H new ATOM 0 HB3 ALA A 139 6.425 -9.160 -0.670 1.00 1.16 H new ATOM 2190 N THR A 140 5.240 -5.724 -2.329 1.00 0.60 N ATOM 2191 CA THR A 140 5.941 -4.434 -2.352 1.00 0.52 C ATOM 2192 C THR A 140 5.020 -3.320 -1.875 1.00 0.70 C ATOM 2193 O THR A 140 3.791 -3.399 -1.982 1.00 1.03 O ATOM 2194 CB THR A 140 6.540 -4.183 -3.742 1.00 0.58 C ATOM 2195 OG1 THR A 140 7.422 -5.250 -3.993 1.00 0.99 O ATOM 2196 CG2 THR A 140 7.384 -2.916 -3.868 1.00 0.62 C ATOM 0 H THR A 140 4.673 -5.891 -3.160 1.00 0.60 H new ATOM 0 HA THR A 140 6.778 -4.454 -1.654 1.00 0.52 H new ATOM 0 HB THR A 140 5.700 -4.084 -4.429 1.00 0.58 H new ATOM 0 HG1 THR A 140 7.831 -5.135 -4.876 1.00 0.99 H new ATOM 0 HG21 THR A 140 7.761 -2.830 -4.887 1.00 0.62 H new ATOM 0 HG22 THR A 140 6.771 -2.046 -3.633 1.00 0.62 H new ATOM 0 HG23 THR A 140 8.223 -2.967 -3.174 1.00 0.62 H new ATOM 2204 N THR A 141 5.659 -2.304 -1.294 1.00 0.46 N ATOM 2205 CA THR A 141 5.054 -1.099 -0.733 1.00 0.46 C ATOM 2206 C THR A 141 5.575 0.106 -1.508 1.00 0.82 C ATOM 2207 O THR A 141 6.735 0.140 -1.918 1.00 0.91 O ATOM 2208 CB THR A 141 5.329 -0.948 0.777 1.00 0.54 C ATOM 2209 OG1 THR A 141 6.221 -1.932 1.255 1.00 1.31 O ATOM 2210 CG2 THR A 141 4.055 -1.082 1.608 1.00 1.45 C ATOM 0 H THR A 141 6.674 -2.302 -1.197 1.00 0.46 H new ATOM 0 HA THR A 141 3.971 -1.172 -0.833 1.00 0.46 H new ATOM 0 HB THR A 141 5.758 0.048 0.886 1.00 0.54 H new ATOM 0 HG1 THR A 141 6.129 -2.012 2.227 1.00 1.31 H new ATOM 0 HG21 THR A 141 4.296 -0.969 2.665 1.00 1.45 H new ATOM 0 HG22 THR A 141 3.345 -0.309 1.313 1.00 1.45 H new ATOM 0 HG23 THR A 141 3.613 -2.064 1.440 1.00 1.45 H new ATOM 2218 N PHE A 142 4.702 1.090 -1.723 1.00 0.50 N ATOM 2219 CA PHE A 142 4.940 2.229 -2.611 1.00 0.50 C ATOM 2220 C PHE A 142 4.440 3.521 -1.955 1.00 1.75 C ATOM 2221 O PHE A 142 3.310 3.569 -1.467 1.00 2.07 O ATOM 2222 CB PHE A 142 4.207 2.009 -3.949 1.00 0.52 C ATOM 2223 CG PHE A 142 4.520 0.722 -4.688 1.00 0.68 C ATOM 2224 CD1 PHE A 142 3.922 -0.494 -4.297 1.00 2.16 C ATOM 2225 CD2 PHE A 142 5.387 0.741 -5.797 1.00 1.95 C ATOM 2226 CE1 PHE A 142 4.242 -1.686 -4.969 1.00 2.08 C ATOM 2227 CE2 PHE A 142 5.712 -0.452 -6.464 1.00 1.94 C ATOM 2228 CZ PHE A 142 5.154 -1.667 -6.037 1.00 0.79 C ATOM 0 H PHE A 142 3.787 1.118 -1.274 1.00 0.50 H new ATOM 0 HA PHE A 142 6.011 2.316 -2.796 1.00 0.50 H new ATOM 0 HB2 PHE A 142 3.134 2.041 -3.760 1.00 0.52 H new ATOM 0 HB3 PHE A 142 4.440 2.846 -4.607 1.00 0.52 H new ATOM 0 HD1 PHE A 142 3.217 -0.509 -3.479 1.00 2.16 H new ATOM 0 HD2 PHE A 142 5.804 1.677 -6.137 1.00 1.95 H new ATOM 0 HE1 PHE A 142 3.787 -2.617 -4.664 1.00 2.08 H new ATOM 0 HE2 PHE A 142 6.390 -0.434 -7.304 1.00 1.94 H new ATOM 0 HZ PHE A 142 5.426 -2.588 -6.530 1.00 0.79 H new ATOM 2238 N VAL A 143 5.266 4.573 -1.975 1.00 0.50 N ATOM 2239 CA VAL A 143 4.917 5.898 -1.429 1.00 0.56 C ATOM 2240 C VAL A 143 4.519 6.866 -2.541 1.00 0.92 C ATOM 2241 O VAL A 143 5.203 6.994 -3.561 1.00 1.26 O ATOM 2242 CB VAL A 143 6.047 6.535 -0.588 1.00 0.71 C ATOM 2243 CG1 VAL A 143 5.530 7.752 0.200 1.00 0.79 C ATOM 2244 CG2 VAL A 143 6.610 5.526 0.419 1.00 0.96 C ATOM 0 H VAL A 143 6.204 4.533 -2.373 1.00 0.50 H new ATOM 0 HA VAL A 143 4.071 5.721 -0.765 1.00 0.56 H new ATOM 0 HB VAL A 143 6.826 6.847 -1.284 1.00 0.71 H new ATOM 0 HG11 VAL A 143 6.345 8.181 0.783 1.00 0.79 H new ATOM 0 HG12 VAL A 143 5.148 8.500 -0.495 1.00 0.79 H new ATOM 0 HG13 VAL A 143 4.730 7.438 0.871 1.00 0.79 H new ATOM 0 HG21 VAL A 143 7.404 5.996 1.000 1.00 0.96 H new ATOM 0 HG22 VAL A 143 5.815 5.199 1.089 1.00 0.96 H new ATOM 0 HG23 VAL A 143 7.012 4.665 -0.115 1.00 0.96 H new ATOM 2254 N VAL A 144 3.439 7.594 -2.270 1.00 0.57 N ATOM 2255 CA VAL A 144 2.927 8.713 -3.067 1.00 0.62 C ATOM 2256 C VAL A 144 2.658 9.910 -2.151 1.00 0.96 C ATOM 2257 O VAL A 144 1.883 9.791 -1.202 1.00 0.96 O ATOM 2258 CB VAL A 144 1.624 8.321 -3.807 1.00 0.74 C ATOM 2259 CG1 VAL A 144 0.895 9.512 -4.453 1.00 1.77 C ATOM 2260 CG2 VAL A 144 1.897 7.273 -4.897 1.00 1.50 C ATOM 0 H VAL A 144 2.865 7.412 -1.446 1.00 0.57 H new ATOM 0 HA VAL A 144 3.677 8.976 -3.813 1.00 0.62 H new ATOM 0 HB VAL A 144 0.976 7.911 -3.033 1.00 0.74 H new ATOM 0 HG11 VAL A 144 -0.007 9.159 -4.952 1.00 1.77 H new ATOM 0 HG12 VAL A 144 0.625 10.234 -3.683 1.00 1.77 H new ATOM 0 HG13 VAL A 144 1.551 9.988 -5.182 1.00 1.77 H new ATOM 0 HG21 VAL A 144 0.963 7.018 -5.399 1.00 1.50 H new ATOM 0 HG22 VAL A 144 2.600 7.679 -5.624 1.00 1.50 H new ATOM 0 HG23 VAL A 144 2.321 6.378 -4.443 1.00 1.50 H new ATOM 2270 N LYS A 145 3.257 11.062 -2.478 1.00 0.68 N ATOM 2271 CA LYS A 145 2.792 12.401 -2.071 1.00 0.78 C ATOM 2272 C LYS A 145 2.079 13.055 -3.280 1.00 1.16 C ATOM 2273 O LYS A 145 2.471 12.779 -4.409 1.00 1.55 O ATOM 2274 CB LYS A 145 4.026 13.225 -1.624 1.00 0.86 C ATOM 2275 CG LYS A 145 3.671 14.441 -0.745 1.00 1.11 C ATOM 2276 CD LYS A 145 4.842 15.418 -0.519 1.00 1.48 C ATOM 2277 CE LYS A 145 6.039 14.773 0.200 1.00 2.31 C ATOM 2278 NZ LYS A 145 7.115 15.745 0.509 1.00 2.73 N ATOM 0 H LYS A 145 4.102 11.093 -3.049 1.00 0.68 H new ATOM 0 HA LYS A 145 2.088 12.351 -1.240 1.00 0.78 H new ATOM 0 HB2 LYS A 145 4.706 12.575 -1.073 1.00 0.86 H new ATOM 0 HB3 LYS A 145 4.561 13.570 -2.508 1.00 0.86 H new ATOM 0 HG2 LYS A 145 2.845 14.981 -1.208 1.00 1.11 H new ATOM 0 HG3 LYS A 145 3.317 14.085 0.223 1.00 1.11 H new ATOM 0 HD2 LYS A 145 5.172 15.808 -1.482 1.00 1.48 H new ATOM 0 HD3 LYS A 145 4.490 16.268 0.066 1.00 1.48 H new ATOM 0 HE2 LYS A 145 5.695 14.312 1.126 1.00 2.31 H new ATOM 0 HE3 LYS A 145 6.444 13.975 -0.422 1.00 2.31 H new ATOM 0 HZ1 LYS A 145 7.981 15.232 0.771 1.00 2.73 H new ATOM 0 HZ2 LYS A 145 7.301 16.335 -0.327 1.00 2.73 H new ATOM 0 HZ3 LYS A 145 6.819 16.351 1.301 1.00 2.73 H new ATOM 2292 N GLU A 146 1.027 13.865 -3.099 1.00 1.23 N ATOM 2293 CA GLU A 146 0.394 14.722 -4.135 1.00 1.58 C ATOM 2294 C GLU A 146 -0.433 13.968 -5.202 1.00 2.09 C ATOM 2295 O GLU A 146 -1.307 14.569 -5.815 1.00 3.07 O ATOM 2296 CB GLU A 146 1.431 15.556 -4.926 1.00 1.69 C ATOM 2297 CG GLU A 146 2.452 16.368 -4.119 1.00 1.63 C ATOM 2298 CD GLU A 146 3.656 16.679 -5.004 1.00 1.84 C ATOM 2299 OE1 GLU A 146 3.560 17.571 -5.874 1.00 2.33 O ATOM 2300 OE2 GLU A 146 4.669 15.953 -4.903 1.00 2.42 O ATOM 0 H GLU A 146 0.568 13.951 -2.192 1.00 1.23 H new ATOM 0 HA GLU A 146 -0.271 15.345 -3.537 1.00 1.58 H new ATOM 0 HB2 GLU A 146 1.981 14.878 -5.578 1.00 1.69 H new ATOM 0 HB3 GLU A 146 0.886 16.246 -5.570 1.00 1.69 H new ATOM 0 HG2 GLU A 146 1.999 17.293 -3.762 1.00 1.63 H new ATOM 0 HG3 GLU A 146 2.767 15.807 -3.239 1.00 1.63 H new ATOM 2307 N GLY A 147 -0.142 12.694 -5.485 1.00 1.29 N ATOM 2308 CA GLY A 147 -0.493 11.998 -6.733 1.00 1.25 C ATOM 2309 C GLY A 147 0.712 11.618 -7.615 1.00 1.07 C ATOM 2310 O GLY A 147 0.494 11.189 -8.748 1.00 1.22 O ATOM 0 H GLY A 147 0.362 12.096 -4.830 1.00 1.29 H new ATOM 0 HA2 GLY A 147 -1.046 11.092 -6.485 1.00 1.25 H new ATOM 0 HA3 GLY A 147 -1.164 12.633 -7.311 1.00 1.25 H new ATOM 2314 N ARG A 148 1.963 11.743 -7.131 1.00 0.93 N ATOM 2315 CA ARG A 148 3.174 11.226 -7.805 1.00 0.90 C ATOM 2316 C ARG A 148 3.997 10.224 -6.975 1.00 1.18 C ATOM 2317 O ARG A 148 4.105 10.326 -5.754 1.00 1.33 O ATOM 2318 CB ARG A 148 4.083 12.344 -8.344 1.00 1.01 C ATOM 2319 CG ARG A 148 4.232 13.604 -7.487 1.00 1.41 C ATOM 2320 CD ARG A 148 5.380 14.450 -8.055 1.00 1.37 C ATOM 2321 NE ARG A 148 5.270 15.862 -7.668 1.00 1.76 N ATOM 2322 CZ ARG A 148 5.496 16.927 -8.426 1.00 2.29 C ATOM 2323 NH1 ARG A 148 6.047 16.839 -9.620 1.00 3.12 N ATOM 2324 NH2 ARG A 148 5.148 18.108 -7.977 1.00 2.68 N ATOM 0 H ARG A 148 2.166 12.212 -6.248 1.00 0.93 H new ATOM 0 HA ARG A 148 2.772 10.668 -8.650 1.00 0.90 H new ATOM 0 HB2 ARG A 148 5.076 11.924 -8.502 1.00 1.01 H new ATOM 0 HB3 ARG A 148 3.705 12.644 -9.321 1.00 1.01 H new ATOM 0 HG2 ARG A 148 3.304 14.175 -7.490 1.00 1.41 H new ATOM 0 HG3 ARG A 148 4.437 13.335 -6.451 1.00 1.41 H new ATOM 0 HD2 ARG A 148 6.332 14.051 -7.703 1.00 1.37 H new ATOM 0 HD3 ARG A 148 5.384 14.372 -9.142 1.00 1.37 H new ATOM 0 HE ARG A 148 4.987 16.045 -6.705 1.00 1.76 H new ATOM 0 HH11 ARG A 148 6.316 15.928 -9.992 1.00 3.12 H new ATOM 0 HH12 ARG A 148 6.204 17.682 -10.172 1.00 3.12 H new ATOM 0 HH21 ARG A 148 4.712 18.196 -7.059 1.00 2.68 H new ATOM 0 HH22 ARG A 148 5.314 18.939 -8.545 1.00 2.68 H new ATOM 2338 N LEU A 149 4.591 9.244 -7.669 1.00 0.82 N ATOM 2339 CA LEU A 149 5.313 8.099 -7.108 1.00 0.87 C ATOM 2340 C LEU A 149 6.699 8.546 -6.622 1.00 1.05 C ATOM 2341 O LEU A 149 7.582 8.797 -7.436 1.00 1.26 O ATOM 2342 CB LEU A 149 5.387 7.011 -8.205 1.00 1.08 C ATOM 2343 CG LEU A 149 5.612 5.558 -7.741 1.00 1.16 C ATOM 2344 CD1 LEU A 149 6.862 5.349 -6.885 1.00 1.67 C ATOM 2345 CD2 LEU A 149 4.398 5.034 -6.977 1.00 2.41 C ATOM 0 H LEU A 149 4.579 9.230 -8.689 1.00 0.82 H new ATOM 0 HA LEU A 149 4.800 7.686 -6.240 1.00 0.87 H new ATOM 0 HB2 LEU A 149 4.459 7.044 -8.776 1.00 1.08 H new ATOM 0 HB3 LEU A 149 6.193 7.276 -8.890 1.00 1.08 H new ATOM 0 HG LEU A 149 5.762 4.996 -8.663 1.00 1.16 H new ATOM 0 HD11 LEU A 149 6.940 4.299 -6.605 1.00 1.67 H new ATOM 0 HD12 LEU A 149 7.745 5.639 -7.454 1.00 1.67 H new ATOM 0 HD13 LEU A 149 6.793 5.960 -5.985 1.00 1.67 H new ATOM 0 HD21 LEU A 149 4.582 4.007 -6.661 1.00 2.41 H new ATOM 0 HD22 LEU A 149 4.223 5.658 -6.100 1.00 2.41 H new ATOM 0 HD23 LEU A 149 3.521 5.063 -7.624 1.00 2.41 H new ATOM 2357 N VAL A 150 6.869 8.655 -5.302 1.00 0.85 N ATOM 2358 CA VAL A 150 8.001 9.380 -4.691 1.00 0.94 C ATOM 2359 C VAL A 150 9.046 8.470 -4.017 1.00 1.10 C ATOM 2360 O VAL A 150 10.210 8.866 -3.918 1.00 1.23 O ATOM 2361 CB VAL A 150 7.458 10.483 -3.745 1.00 1.13 C ATOM 2362 CG1 VAL A 150 6.886 9.945 -2.426 1.00 2.55 C ATOM 2363 CG2 VAL A 150 8.484 11.588 -3.475 1.00 2.09 C ATOM 0 H VAL A 150 6.229 8.245 -4.621 1.00 0.85 H new ATOM 0 HA VAL A 150 8.560 9.852 -5.499 1.00 0.94 H new ATOM 0 HB VAL A 150 6.624 10.921 -4.293 1.00 1.13 H new ATOM 0 HG11 VAL A 150 6.527 10.776 -1.819 1.00 2.55 H new ATOM 0 HG12 VAL A 150 6.060 9.266 -2.638 1.00 2.55 H new ATOM 0 HG13 VAL A 150 7.665 9.410 -1.883 1.00 2.55 H new ATOM 0 HG21 VAL A 150 8.050 12.332 -2.807 1.00 2.09 H new ATOM 0 HG22 VAL A 150 9.370 11.156 -3.010 1.00 2.09 H new ATOM 0 HG23 VAL A 150 8.763 12.063 -4.416 1.00 2.09 H new ATOM 2373 N LEU A 151 8.677 7.244 -3.604 1.00 0.74 N ATOM 2374 CA LEU A 151 9.603 6.335 -2.909 1.00 0.70 C ATOM 2375 C LEU A 151 9.161 4.862 -2.973 1.00 1.09 C ATOM 2376 O LEU A 151 7.980 4.559 -2.776 1.00 1.20 O ATOM 2377 CB LEU A 151 9.816 6.851 -1.461 1.00 0.71 C ATOM 2378 CG LEU A 151 11.286 6.763 -1.011 1.00 0.81 C ATOM 2379 CD1 LEU A 151 11.721 7.896 -0.083 1.00 0.99 C ATOM 2380 CD2 LEU A 151 11.596 5.439 -0.331 1.00 0.89 C ATOM 0 H LEU A 151 7.742 6.860 -3.741 1.00 0.74 H new ATOM 0 HA LEU A 151 10.563 6.344 -3.426 1.00 0.70 H new ATOM 0 HB2 LEU A 151 9.481 7.886 -1.395 1.00 0.71 H new ATOM 0 HB3 LEU A 151 9.195 6.271 -0.778 1.00 0.71 H new ATOM 0 HG LEU A 151 11.853 6.851 -1.938 1.00 0.81 H new ATOM 0 HD11 LEU A 151 12.768 7.762 0.189 1.00 0.99 H new ATOM 0 HD12 LEU A 151 11.598 8.852 -0.593 1.00 0.99 H new ATOM 0 HD13 LEU A 151 11.108 7.884 0.818 1.00 0.99 H new ATOM 0 HD21 LEU A 151 12.644 5.421 -0.030 1.00 0.89 H new ATOM 0 HD22 LEU A 151 10.964 5.325 0.550 1.00 0.89 H new ATOM 0 HD23 LEU A 151 11.403 4.620 -1.024 1.00 0.89 H new ATOM 2392 N LEU A 152 10.099 3.946 -3.256 1.00 0.77 N ATOM 2393 CA LEU A 152 9.847 2.498 -3.332 1.00 0.80 C ATOM 2394 C LEU A 152 10.312 1.779 -2.061 1.00 1.14 C ATOM 2395 O LEU A 152 11.470 1.901 -1.660 1.00 1.23 O ATOM 2396 CB LEU A 152 10.546 1.901 -4.568 1.00 0.91 C ATOM 2397 CG LEU A 152 9.964 2.348 -5.923 1.00 0.96 C ATOM 2398 CD1 LEU A 152 10.845 1.816 -7.061 1.00 1.13 C ATOM 2399 CD2 LEU A 152 8.531 1.840 -6.109 1.00 0.92 C ATOM 0 H LEU A 152 11.071 4.194 -3.442 1.00 0.77 H new ATOM 0 HA LEU A 152 8.771 2.351 -3.423 1.00 0.80 H new ATOM 0 HB2 LEU A 152 11.602 2.171 -4.536 1.00 0.91 H new ATOM 0 HB3 LEU A 152 10.493 0.814 -4.507 1.00 0.91 H new ATOM 0 HG LEU A 152 9.946 3.438 -5.941 1.00 0.96 H new ATOM 0 HD11 LEU A 152 10.433 2.133 -8.019 1.00 1.13 H new ATOM 0 HD12 LEU A 152 11.856 2.210 -6.953 1.00 1.13 H new ATOM 0 HD13 LEU A 152 10.874 0.727 -7.020 1.00 1.13 H new ATOM 0 HD21 LEU A 152 8.150 2.172 -7.074 1.00 0.92 H new ATOM 0 HD22 LEU A 152 8.523 0.751 -6.071 1.00 0.92 H new ATOM 0 HD23 LEU A 152 7.899 2.235 -5.314 1.00 0.92 H new ATOM 2411 N TYR A 153 9.408 1.012 -1.455 1.00 0.80 N ATOM 2412 CA TYR A 153 9.591 0.198 -0.247 1.00 0.80 C ATOM 2413 C TYR A 153 9.557 -1.318 -0.583 1.00 1.21 C ATOM 2414 O TYR A 153 9.830 -1.714 -1.713 1.00 2.14 O ATOM 2415 CB TYR A 153 8.511 0.638 0.768 1.00 1.00 C ATOM 2416 CG TYR A 153 8.947 1.702 1.744 1.00 1.10 C ATOM 2417 CD1 TYR A 153 9.051 3.044 1.336 1.00 2.57 C ATOM 2418 CD2 TYR A 153 9.200 1.344 3.079 1.00 1.68 C ATOM 2419 CE1 TYR A 153 9.368 4.035 2.281 1.00 2.69 C ATOM 2420 CE2 TYR A 153 9.564 2.326 4.012 1.00 1.94 C ATOM 2421 CZ TYR A 153 9.616 3.678 3.622 1.00 1.73 C ATOM 2422 OH TYR A 153 9.904 4.628 4.543 1.00 2.20 O ATOM 0 H TYR A 153 8.458 0.935 -1.819 1.00 0.80 H new ATOM 0 HA TYR A 153 10.573 0.357 0.198 1.00 0.80 H new ATOM 0 HB2 TYR A 153 7.645 1.005 0.217 1.00 1.00 H new ATOM 0 HB3 TYR A 153 8.184 -0.237 1.330 1.00 1.00 H new ATOM 0 HD1 TYR A 153 8.888 3.312 0.302 1.00 2.57 H new ATOM 0 HD2 TYR A 153 9.114 0.312 3.387 1.00 1.68 H new ATOM 0 HE1 TYR A 153 9.422 5.071 1.980 1.00 2.69 H new ATOM 0 HE2 TYR A 153 9.804 2.046 5.027 1.00 1.94 H new ATOM 0 HH TYR A 153 10.029 5.491 4.095 1.00 2.20 H new ATOM 2432 N SER A 154 9.271 -2.175 0.399 1.00 1.26 N ATOM 2433 CA SER A 154 9.307 -3.653 0.474 1.00 1.02 C ATOM 2434 C SER A 154 9.217 -4.032 1.970 1.00 1.04 C ATOM 2435 O SER A 154 9.305 -3.111 2.794 1.00 1.29 O ATOM 2436 CB SER A 154 10.528 -4.231 -0.273 1.00 1.29 C ATOM 2437 OG SER A 154 10.209 -4.320 -1.653 1.00 2.52 O ATOM 0 H SER A 154 8.962 -1.800 1.296 1.00 1.26 H new ATOM 0 HA SER A 154 8.461 -4.105 -0.043 1.00 1.02 H new ATOM 0 HB2 SER A 154 11.399 -3.593 -0.126 1.00 1.29 H new ATOM 0 HB3 SER A 154 10.783 -5.215 0.121 1.00 1.29 H new ATOM 0 HG SER A 154 10.219 -3.424 -2.049 1.00 2.52 H new ATOM 2443 N PRO A 155 8.956 -5.298 2.366 1.00 0.72 N ATOM 2444 CA PRO A 155 8.640 -5.606 3.759 1.00 0.94 C ATOM 2445 C PRO A 155 9.825 -5.334 4.686 1.00 1.29 C ATOM 2446 O PRO A 155 9.640 -4.756 5.748 1.00 1.19 O ATOM 2447 CB PRO A 155 8.181 -7.069 3.790 1.00 1.29 C ATOM 2448 CG PRO A 155 8.804 -7.668 2.532 1.00 1.23 C ATOM 2449 CD PRO A 155 8.799 -6.495 1.552 1.00 0.89 C ATOM 0 HA PRO A 155 7.847 -4.958 4.133 1.00 0.94 H new ATOM 0 HB2 PRO A 155 8.526 -7.578 4.690 1.00 1.29 H new ATOM 0 HB3 PRO A 155 7.094 -7.148 3.776 1.00 1.29 H new ATOM 0 HG2 PRO A 155 9.814 -8.035 2.717 1.00 1.23 H new ATOM 0 HG3 PRO A 155 8.223 -8.510 2.156 1.00 1.23 H new ATOM 0 HD2 PRO A 155 9.610 -6.586 0.829 1.00 0.89 H new ATOM 0 HD3 PRO A 155 7.869 -6.463 0.985 1.00 0.89 H new ATOM 2457 N ASP A 156 11.052 -5.620 4.261 1.00 1.22 N ATOM 2458 CA ASP A 156 12.275 -5.318 5.016 1.00 1.59 C ATOM 2459 C ASP A 156 12.414 -3.834 5.398 1.00 1.82 C ATOM 2460 O ASP A 156 12.957 -3.467 6.444 1.00 2.40 O ATOM 2461 CB ASP A 156 13.464 -5.758 4.146 1.00 2.13 C ATOM 2462 CG ASP A 156 13.640 -4.873 2.901 1.00 2.57 C ATOM 2463 OD1 ASP A 156 12.694 -4.781 2.079 1.00 2.98 O ATOM 2464 OD2 ASP A 156 14.713 -4.242 2.786 1.00 3.28 O ATOM 0 H ASP A 156 11.233 -6.076 3.367 1.00 1.22 H new ATOM 0 HA ASP A 156 12.240 -5.856 5.963 1.00 1.59 H new ATOM 0 HB2 ASP A 156 14.377 -5.728 4.741 1.00 2.13 H new ATOM 0 HB3 ASP A 156 13.320 -6.793 3.835 1.00 2.13 H new ATOM 2469 N LYS A 157 11.871 -2.987 4.530 1.00 1.40 N ATOM 2470 CA LYS A 157 11.824 -1.538 4.678 1.00 1.58 C ATOM 2471 C LYS A 157 10.620 -1.088 5.508 1.00 1.68 C ATOM 2472 O LYS A 157 10.748 -0.142 6.281 1.00 2.01 O ATOM 2473 CB LYS A 157 11.868 -0.898 3.285 1.00 1.67 C ATOM 2474 CG LYS A 157 13.292 -1.050 2.754 1.00 1.97 C ATOM 2475 CD LYS A 157 13.376 -1.389 1.266 1.00 2.91 C ATOM 2476 CE LYS A 157 14.830 -1.774 0.997 1.00 3.24 C ATOM 2477 NZ LYS A 157 15.726 -0.598 0.927 1.00 4.88 N ATOM 0 H LYS A 157 11.433 -3.307 3.666 1.00 1.40 H new ATOM 0 HA LYS A 157 12.695 -1.199 5.239 1.00 1.58 H new ATOM 0 HB2 LYS A 157 11.156 -1.384 2.617 1.00 1.67 H new ATOM 0 HB3 LYS A 157 11.589 0.154 3.338 1.00 1.67 H new ATOM 0 HG2 LYS A 157 13.835 -0.123 2.935 1.00 1.97 H new ATOM 0 HG3 LYS A 157 13.797 -1.831 3.322 1.00 1.97 H new ATOM 0 HD2 LYS A 157 12.704 -2.209 1.015 1.00 2.91 H new ATOM 0 HD3 LYS A 157 13.080 -0.536 0.655 1.00 2.91 H new ATOM 0 HE2 LYS A 157 15.176 -2.444 1.784 1.00 3.24 H new ATOM 0 HE3 LYS A 157 14.888 -2.327 0.059 1.00 3.24 H new ATOM 0 HZ1 LYS A 157 16.702 -0.915 0.760 1.00 4.88 H new ATOM 0 HZ2 LYS A 157 15.425 0.022 0.148 1.00 4.88 H new ATOM 0 HZ3 LYS A 157 15.681 -0.073 1.824 1.00 4.88 H new ATOM 2491 N ALA A 158 9.479 -1.762 5.346 1.00 1.04 N ATOM 2492 CA ALA A 158 8.210 -1.455 6.005 1.00 0.99 C ATOM 2493 C ALA A 158 8.177 -1.894 7.477 1.00 1.07 C ATOM 2494 O ALA A 158 7.754 -1.114 8.322 1.00 1.10 O ATOM 2495 CB ALA A 158 7.074 -2.103 5.200 1.00 0.95 C ATOM 0 H ALA A 158 9.413 -2.570 4.726 1.00 1.04 H new ATOM 0 HA ALA A 158 8.084 -0.372 6.025 1.00 0.99 H new ATOM 0 HB1 ALA A 158 6.119 -1.884 5.678 1.00 0.95 H new ATOM 0 HB2 ALA A 158 7.073 -1.703 4.186 1.00 0.95 H new ATOM 0 HB3 ALA A 158 7.223 -3.182 5.164 1.00 0.95 H new ATOM 2501 N GLU A 159 8.639 -3.106 7.802 1.00 0.77 N ATOM 2502 CA GLU A 159 8.531 -3.653 9.162 1.00 0.75 C ATOM 2503 C GLU A 159 9.535 -2.989 10.121 1.00 1.04 C ATOM 2504 O GLU A 159 9.273 -2.868 11.319 1.00 1.28 O ATOM 2505 CB GLU A 159 8.630 -5.191 9.149 1.00 0.91 C ATOM 2506 CG GLU A 159 7.612 -5.802 8.168 1.00 1.24 C ATOM 2507 CD GLU A 159 7.167 -7.222 8.503 1.00 1.73 C ATOM 2508 OE1 GLU A 159 8.000 -8.001 9.013 1.00 2.23 O ATOM 2509 OE2 GLU A 159 5.978 -7.515 8.223 1.00 3.03 O ATOM 0 H GLU A 159 9.095 -3.732 7.138 1.00 0.77 H new ATOM 0 HA GLU A 159 7.542 -3.410 9.551 1.00 0.75 H new ATOM 0 HB2 GLU A 159 9.639 -5.492 8.866 1.00 0.91 H new ATOM 0 HB3 GLU A 159 8.452 -5.579 10.152 1.00 0.91 H new ATOM 0 HG2 GLU A 159 6.732 -5.160 8.134 1.00 1.24 H new ATOM 0 HG3 GLU A 159 8.047 -5.800 7.168 1.00 1.24 H new ATOM 2516 N ALA A 160 10.649 -2.458 9.597 1.00 0.69 N ATOM 2517 CA ALA A 160 11.626 -1.654 10.328 1.00 0.75 C ATOM 2518 C ALA A 160 11.062 -0.256 10.667 1.00 0.94 C ATOM 2519 O ALA A 160 11.549 0.750 10.150 1.00 0.94 O ATOM 2520 CB ALA A 160 12.929 -1.606 9.507 1.00 0.88 C ATOM 0 H ALA A 160 10.899 -2.584 8.616 1.00 0.69 H new ATOM 0 HA ALA A 160 11.849 -2.111 11.292 1.00 0.75 H new ATOM 0 HB1 ALA A 160 13.671 -1.009 10.037 1.00 0.88 H new ATOM 0 HB2 ALA A 160 13.309 -2.618 9.368 1.00 0.88 H new ATOM 0 HB3 ALA A 160 12.730 -1.156 8.534 1.00 0.88 H new ATOM 2526 N THR A 161 10.047 -0.186 11.543 1.00 0.77 N ATOM 2527 CA THR A 161 9.272 1.022 11.927 1.00 0.85 C ATOM 2528 C THR A 161 10.087 2.312 11.953 1.00 1.07 C ATOM 2529 O THR A 161 9.809 3.229 11.192 1.00 1.34 O ATOM 2530 CB THR A 161 8.614 0.806 13.296 1.00 0.94 C ATOM 2531 OG1 THR A 161 7.671 -0.234 13.205 1.00 1.04 O ATOM 2532 CG2 THR A 161 7.855 2.039 13.799 1.00 1.11 C ATOM 0 H THR A 161 9.720 -1.017 12.036 1.00 0.77 H new ATOM 0 HA THR A 161 8.521 1.152 11.147 1.00 0.85 H new ATOM 0 HB THR A 161 9.425 0.579 13.988 1.00 0.94 H new ATOM 0 HG1 THR A 161 7.252 -0.373 14.080 1.00 1.04 H new ATOM 0 HG21 THR A 161 7.413 1.822 14.771 1.00 1.11 H new ATOM 0 HG22 THR A 161 8.545 2.878 13.893 1.00 1.11 H new ATOM 0 HG23 THR A 161 7.067 2.295 13.091 1.00 1.11 H new ATOM 2540 N ASP A 162 11.111 2.417 12.797 1.00 0.96 N ATOM 2541 CA ASP A 162 11.883 3.661 12.944 1.00 1.08 C ATOM 2542 C ASP A 162 12.766 3.980 11.723 1.00 1.44 C ATOM 2543 O ASP A 162 13.105 5.140 11.493 1.00 1.61 O ATOM 2544 CB ASP A 162 12.662 3.635 14.268 1.00 1.12 C ATOM 2545 CG ASP A 162 11.889 4.381 15.364 1.00 1.87 C ATOM 2546 OD1 ASP A 162 10.764 3.964 15.726 1.00 2.31 O ATOM 2547 OD2 ASP A 162 12.382 5.431 15.835 1.00 3.26 O ATOM 0 H ASP A 162 11.431 1.655 13.395 1.00 0.96 H new ATOM 0 HA ASP A 162 11.178 4.492 12.983 1.00 1.08 H new ATOM 0 HB2 ASP A 162 12.834 2.603 14.575 1.00 1.12 H new ATOM 0 HB3 ASP A 162 13.641 4.094 14.129 1.00 1.12 H new ATOM 2552 N ARG A 163 13.061 2.980 10.881 1.00 1.09 N ATOM 2553 CA ARG A 163 13.590 3.214 9.536 1.00 1.18 C ATOM 2554 C ARG A 163 12.527 3.818 8.614 1.00 1.28 C ATOM 2555 O ARG A 163 12.860 4.766 7.906 1.00 1.60 O ATOM 2556 CB ARG A 163 14.158 1.934 8.908 1.00 1.19 C ATOM 2557 CG ARG A 163 15.161 1.159 9.772 1.00 1.42 C ATOM 2558 CD ARG A 163 16.383 2.017 10.056 1.00 1.63 C ATOM 2559 NE ARG A 163 17.401 1.277 10.814 1.00 1.90 N ATOM 2560 CZ ARG A 163 18.505 1.790 11.350 1.00 2.62 C ATOM 2561 NH1 ARG A 163 18.818 3.063 11.219 1.00 3.38 N ATOM 2562 NH2 ARG A 163 19.320 1.015 12.035 1.00 3.34 N ATOM 0 H ARG A 163 12.940 1.994 11.113 1.00 1.09 H new ATOM 0 HA ARG A 163 14.406 3.928 9.646 1.00 1.18 H new ATOM 0 HB2 ARG A 163 13.328 1.271 8.664 1.00 1.19 H new ATOM 0 HB3 ARG A 163 14.643 2.197 7.968 1.00 1.19 H new ATOM 0 HG2 ARG A 163 14.691 0.862 10.709 1.00 1.42 H new ATOM 0 HG3 ARG A 163 15.461 0.244 9.261 1.00 1.42 H new ATOM 0 HD2 ARG A 163 16.810 2.364 9.115 1.00 1.63 H new ATOM 0 HD3 ARG A 163 16.084 2.903 10.617 1.00 1.63 H new ATOM 0 HE ARG A 163 17.247 0.277 10.941 1.00 1.90 H new ATOM 0 HH11 ARG A 163 18.206 3.687 10.694 1.00 3.38 H new ATOM 0 HH12 ARG A 163 19.673 3.424 11.643 1.00 3.38 H new ATOM 0 HH21 ARG A 163 19.104 0.025 12.153 1.00 3.34 H new ATOM 0 HH22 ARG A 163 20.168 1.404 12.448 1.00 3.34 H new ATOM 2576 N VAL A 164 11.276 3.338 8.671 1.00 1.03 N ATOM 2577 CA VAL A 164 10.144 3.973 7.962 1.00 1.00 C ATOM 2578 C VAL A 164 10.056 5.446 8.369 1.00 1.41 C ATOM 2579 O VAL A 164 10.143 6.326 7.521 1.00 1.68 O ATOM 2580 CB VAL A 164 8.760 3.314 8.216 1.00 0.88 C ATOM 2581 CG1 VAL A 164 7.645 3.918 7.347 1.00 0.95 C ATOM 2582 CG2 VAL A 164 8.754 1.802 8.012 1.00 1.17 C ATOM 0 H VAL A 164 11.017 2.507 9.203 1.00 1.03 H new ATOM 0 HA VAL A 164 10.358 3.846 6.901 1.00 1.00 H new ATOM 0 HB VAL A 164 8.563 3.526 9.267 1.00 0.88 H new ATOM 0 HG11 VAL A 164 6.701 3.419 7.567 1.00 0.95 H new ATOM 0 HG12 VAL A 164 7.552 4.982 7.563 1.00 0.95 H new ATOM 0 HG13 VAL A 164 7.890 3.782 6.294 1.00 0.95 H new ATOM 0 HG21 VAL A 164 7.755 1.412 8.207 1.00 1.17 H new ATOM 0 HG22 VAL A 164 9.039 1.572 6.985 1.00 1.17 H new ATOM 0 HG23 VAL A 164 9.464 1.340 8.698 1.00 1.17 H new ATOM 2592 N VAL A 165 9.936 5.720 9.673 1.00 1.16 N ATOM 2593 CA VAL A 165 9.729 7.086 10.191 1.00 1.22 C ATOM 2594 C VAL A 165 10.867 8.058 9.813 1.00 1.51 C ATOM 2595 O VAL A 165 10.604 9.237 9.563 1.00 1.70 O ATOM 2596 CB VAL A 165 9.543 7.057 11.728 1.00 1.07 C ATOM 2597 CG1 VAL A 165 9.440 8.451 12.373 1.00 1.16 C ATOM 2598 CG2 VAL A 165 8.276 6.270 12.101 1.00 1.26 C ATOM 0 H VAL A 165 9.979 5.007 10.401 1.00 1.16 H new ATOM 0 HA VAL A 165 8.823 7.463 9.716 1.00 1.22 H new ATOM 0 HB VAL A 165 10.442 6.576 12.114 1.00 1.07 H new ATOM 0 HG11 VAL A 165 9.311 8.345 13.450 1.00 1.16 H new ATOM 0 HG12 VAL A 165 10.351 9.014 12.170 1.00 1.16 H new ATOM 0 HG13 VAL A 165 8.585 8.983 11.956 1.00 1.16 H new ATOM 0 HG21 VAL A 165 8.160 6.259 13.185 1.00 1.26 H new ATOM 0 HG22 VAL A 165 7.406 6.745 11.648 1.00 1.26 H new ATOM 0 HG23 VAL A 165 8.362 5.247 11.735 1.00 1.26 H new ATOM 2608 N ALA A 166 12.125 7.603 9.768 1.00 1.32 N ATOM 2609 CA ALA A 166 13.260 8.421 9.311 1.00 1.47 C ATOM 2610 C ALA A 166 13.273 8.678 7.790 1.00 1.62 C ATOM 2611 O ALA A 166 13.535 9.810 7.380 1.00 1.73 O ATOM 2612 CB ALA A 166 14.558 7.751 9.781 1.00 1.47 C ATOM 0 H ALA A 166 12.387 6.658 10.047 1.00 1.32 H new ATOM 0 HA ALA A 166 13.160 9.412 9.754 1.00 1.47 H new ATOM 0 HB1 ALA A 166 15.412 8.342 9.452 1.00 1.47 H new ATOM 0 HB2 ALA A 166 14.560 7.685 10.869 1.00 1.47 H new ATOM 0 HB3 ALA A 166 14.625 6.749 9.356 1.00 1.47 H new ATOM 2618 N ASP A 167 12.922 7.690 6.964 1.00 1.46 N ATOM 2619 CA ASP A 167 12.730 7.862 5.518 1.00 1.49 C ATOM 2620 C ASP A 167 11.566 8.813 5.184 1.00 1.67 C ATOM 2621 O ASP A 167 11.722 9.688 4.326 1.00 1.74 O ATOM 2622 CB ASP A 167 12.576 6.451 4.933 1.00 1.48 C ATOM 2623 CG ASP A 167 12.268 6.389 3.438 1.00 1.44 C ATOM 2624 OD1 ASP A 167 11.103 6.663 3.076 1.00 2.36 O ATOM 2625 OD2 ASP A 167 13.180 5.961 2.686 1.00 2.31 O ATOM 0 H ASP A 167 12.760 6.735 7.283 1.00 1.46 H new ATOM 0 HA ASP A 167 13.587 8.357 5.061 1.00 1.49 H new ATOM 0 HB2 ASP A 167 13.496 5.897 5.120 1.00 1.48 H new ATOM 0 HB3 ASP A 167 11.779 5.938 5.472 1.00 1.48 H new ATOM 2630 N LEU A 168 10.468 8.756 5.944 1.00 1.48 N ATOM 2631 CA LEU A 168 9.402 9.763 5.886 1.00 1.65 C ATOM 2632 C LEU A 168 9.901 11.162 6.285 1.00 2.22 C ATOM 2633 O LEU A 168 9.407 12.147 5.749 1.00 2.39 O ATOM 2634 CB LEU A 168 8.191 9.333 6.748 1.00 1.64 C ATOM 2635 CG LEU A 168 7.102 8.514 6.021 1.00 1.50 C ATOM 2636 CD1 LEU A 168 6.396 9.319 4.918 1.00 3.20 C ATOM 2637 CD2 LEU A 168 7.629 7.191 5.462 1.00 2.42 C ATOM 0 H LEU A 168 10.292 8.010 6.617 1.00 1.48 H new ATOM 0 HA LEU A 168 9.077 9.829 4.848 1.00 1.65 H new ATOM 0 HB2 LEU A 168 8.559 8.746 7.589 1.00 1.64 H new ATOM 0 HB3 LEU A 168 7.728 10.229 7.163 1.00 1.64 H new ATOM 0 HG LEU A 168 6.363 8.277 6.787 1.00 1.50 H new ATOM 0 HD11 LEU A 168 5.640 8.696 4.440 1.00 3.20 H new ATOM 0 HD12 LEU A 168 5.919 10.196 5.356 1.00 3.20 H new ATOM 0 HD13 LEU A 168 7.127 9.637 4.175 1.00 3.20 H new ATOM 0 HD21 LEU A 168 6.819 6.659 4.962 1.00 2.42 H new ATOM 0 HD22 LEU A 168 8.428 7.390 4.748 1.00 2.42 H new ATOM 0 HD23 LEU A 168 8.016 6.580 6.277 1.00 2.42 H new ATOM 2649 N GLN A 169 10.872 11.279 7.196 1.00 2.04 N ATOM 2650 CA GLN A 169 11.530 12.550 7.513 1.00 2.37 C ATOM 2651 C GLN A 169 12.494 13.047 6.423 1.00 2.81 C ATOM 2652 O GLN A 169 12.619 14.257 6.262 1.00 3.13 O ATOM 2653 CB GLN A 169 12.205 12.462 8.894 1.00 2.28 C ATOM 2654 CG GLN A 169 11.221 12.810 10.022 1.00 2.31 C ATOM 2655 CD GLN A 169 11.909 13.352 11.279 1.00 2.77 C ATOM 2656 OE1 GLN A 169 12.021 14.550 11.510 1.00 3.77 O ATOM 2657 NE2 GLN A 169 12.391 12.502 12.159 1.00 2.83 N ATOM 0 H GLN A 169 11.225 10.490 7.737 1.00 2.04 H new ATOM 0 HA GLN A 169 10.750 13.310 7.549 1.00 2.37 H new ATOM 0 HB2 GLN A 169 12.595 11.456 9.047 1.00 2.28 H new ATOM 0 HB3 GLN A 169 13.056 13.142 8.929 1.00 2.28 H new ATOM 0 HG2 GLN A 169 10.509 13.550 9.658 1.00 2.31 H new ATOM 0 HG3 GLN A 169 10.649 11.920 10.284 1.00 2.31 H new ATOM 0 HE21 GLN A 169 12.313 11.498 11.995 1.00 2.83 H new ATOM 0 HE22 GLN A 169 12.843 12.846 13.006 1.00 2.83 H new ATOM 2666 N ALA A 170 13.148 12.160 5.665 1.00 2.54 N ATOM 2667 CA ALA A 170 13.896 12.505 4.449 1.00 2.81 C ATOM 2668 C ALA A 170 13.008 12.867 3.236 1.00 2.86 C ATOM 2669 O ALA A 170 13.494 13.465 2.272 1.00 3.17 O ATOM 2670 CB ALA A 170 14.838 11.345 4.130 1.00 2.78 C ATOM 0 H ALA A 170 13.173 11.164 5.883 1.00 2.54 H new ATOM 0 HA ALA A 170 14.457 13.418 4.648 1.00 2.81 H new ATOM 0 HB1 ALA A 170 15.407 11.575 3.229 1.00 2.78 H new ATOM 0 HB2 ALA A 170 15.524 11.193 4.964 1.00 2.78 H new ATOM 0 HB3 ALA A 170 14.256 10.437 3.969 1.00 2.78 H new ATOM 2676 N LEU A 171 11.727 12.480 3.271 1.00 2.67 N ATOM 2677 CA LEU A 171 10.705 12.802 2.271 1.00 2.57 C ATOM 2678 C LEU A 171 9.960 14.112 2.525 1.00 3.03 C ATOM 2679 O LEU A 171 9.414 14.648 1.561 1.00 3.36 O ATOM 2680 CB LEU A 171 9.644 11.680 2.294 1.00 1.96 C ATOM 2681 CG LEU A 171 9.899 10.515 1.336 1.00 1.69 C ATOM 2682 CD1 LEU A 171 8.882 9.406 1.642 1.00 1.49 C ATOM 2683 CD2 LEU A 171 9.741 10.990 -0.115 1.00 1.73 C ATOM 0 H LEU A 171 11.360 11.908 4.032 1.00 2.67 H new ATOM 0 HA LEU A 171 11.230 12.900 1.321 1.00 2.57 H new ATOM 0 HB2 LEU A 171 9.578 11.286 3.308 1.00 1.96 H new ATOM 0 HB3 LEU A 171 8.673 12.116 2.058 1.00 1.96 H new ATOM 0 HG LEU A 171 10.913 10.136 1.466 1.00 1.69 H new ATOM 0 HD11 LEU A 171 9.047 8.565 0.969 1.00 1.49 H new ATOM 0 HD12 LEU A 171 9.004 9.075 2.673 1.00 1.49 H new ATOM 0 HD13 LEU A 171 7.872 9.790 1.502 1.00 1.49 H new ATOM 0 HD21 LEU A 171 9.924 10.156 -0.793 1.00 1.73 H new ATOM 0 HD22 LEU A 171 8.729 11.366 -0.267 1.00 1.73 H new ATOM 0 HD23 LEU A 171 10.458 11.786 -0.317 1.00 1.73 H new ATOM 2695 N LEU A 172 9.845 14.523 3.797 1.00 2.98 N ATOM 2696 CA LEU A 172 8.628 15.074 4.417 1.00 2.96 C ATOM 2697 C LEU A 172 7.575 15.713 3.503 1.00 2.83 C ATOM 2698 O LEU A 172 6.516 15.081 3.303 1.00 3.07 O ATOM 2699 CB LEU A 172 9.027 15.934 5.640 1.00 3.23 C ATOM 2700 CG LEU A 172 8.451 15.385 6.951 1.00 2.70 C ATOM 2701 CD1 LEU A 172 9.021 16.174 8.124 1.00 3.40 C ATOM 2702 CD2 LEU A 172 6.926 15.464 6.973 1.00 2.46 C ATOM 2703 OXT LEU A 172 7.719 16.852 3.024 1.00 3.20 O ATOM 0 H LEU A 172 10.628 14.479 4.449 1.00 2.98 H new ATOM 0 HA LEU A 172 8.053 14.208 4.745 1.00 2.96 H new ATOM 0 HB2 LEU A 172 10.114 15.976 5.713 1.00 3.23 H new ATOM 0 HB3 LEU A 172 8.678 16.956 5.492 1.00 3.23 H new ATOM 0 HG LEU A 172 8.733 14.335 7.031 1.00 2.70 H new ATOM 0 HD11 LEU A 172 8.613 15.785 9.057 1.00 3.40 H new ATOM 0 HD12 LEU A 172 10.107 16.077 8.135 1.00 3.40 H new ATOM 0 HD13 LEU A 172 8.752 17.225 8.020 1.00 3.40 H new ATOM 0 HD21 LEU A 172 6.555 15.066 7.917 1.00 2.46 H new ATOM 0 HD22 LEU A 172 6.614 16.503 6.869 1.00 2.46 H new ATOM 0 HD23 LEU A 172 6.519 14.879 6.148 1.00 2.46 H new TER 2715 LEU A 172