USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1098 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 124 THR OG1 : rot -49:sc= 0.204 USER MOD Set 1.2: A 127 THR OG1 : rot -158:sc= 1.01 USER MOD Set 2.1: A 10 TYR OH : rot -140:sc= 0.181 USER MOD Set 2.2: A 121 GLN : amide:sc= 0.153 X(o=0.33,f=-0.022) USER MOD Set 3.1: A 103 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 107 ASN : amide:sc= -1.14 K(o=-1.1,f=-6!) USER MOD Set 4.1: A 13 SER OG : rot 100:sc= 1.08 USER MOD Set 4.2: A 90 THR OG1 : rot -136:sc= 0.37 USER MOD Set 5.1: A 1 SER OG : rot 57:sc= 0.434 USER MOD Set 5.2: A 53 THR OG1 : rot -89:sc= 1.66 USER MOD Single : A 1 SER N :NH3+ 147:sc= 0.805 (180deg=0.271!) USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -78:sc= 0.556 USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= 0.354 K(o=0.35,f=-0.26) USER MOD Single : A 25 THR OG1 : rot -72:sc= 0.923 USER MOD Single : A 26 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0434) USER MOD Single : A 27 THR OG1 : rot 72:sc= 1.02 USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 CYS SG : rot -20:sc= -0.966! USER MOD Single : A 59 MET CE :methyl 156:sc= -0.226 (180deg=-1.07) USER MOD Single : A 60 SER OG : rot 110:sc= -0.051 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 146:sc= 1.06 USER MOD Single : A 69 GLN : amide:sc= -3.97! K(o=-4!,f=-2.1) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= -0.186 USER MOD Single : A 80 ASN : amide:sc= -0.988 K(o=-0.99,f=-9.1!) USER MOD Single : A 82 LYS NZ :NH3+ 178:sc= 0.393 (180deg=0.374) USER MOD Single : A 83 GLN : amide:sc= -2.42! K(o=-2.4!,f=-0.13) USER MOD Single : A 104 LYS NZ :NH3+ -172:sc= -0.0109 (180deg=-0.105) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 29:sc= 0.988 USER MOD Single : A 120 LYS NZ :NH3+ 158:sc= -0.0831 (180deg=-0.498) USER MOD Single : A 122 THR OG1 : rot 31:sc= 0.118 USER MOD Single : A 126 ASN : amide:sc= -0.0521 K(o=-0.052,f=-1) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 CYS SG : rot -63:sc= -2.18! USER MOD Single : A 136 THR OG1 : rot 98:sc= 0.478 USER MOD Single : A 140 GLN : amide:sc= -0.0187 X(o=-0.019,f=-0.44) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 7.654 -7.944 3.611 1.00 33.35 N ATOM 2 CA SER A 1 6.292 -8.216 3.071 1.00 32.10 C ATOM 3 C SER A 1 5.318 -7.129 3.527 1.00 41.25 C ATOM 4 O SER A 1 5.695 -6.257 4.302 1.00 52.02 O ATOM 5 CB SER A 1 5.786 -9.595 3.522 1.00 55.12 C ATOM 6 OG SER A 1 4.494 -9.867 2.997 1.00 51.10 O ATOM 0 H1 SER A 1 8.138 -8.845 3.802 1.00 33.35 H new ATOM 0 H2 SER A 1 8.201 -7.398 2.915 1.00 33.35 H new ATOM 0 H3 SER A 1 7.575 -7.399 4.494 1.00 33.35 H new ATOM 0 HA SER A 1 6.352 -8.211 1.983 1.00 32.10 H new ATOM 0 HB2 SER A 1 6.484 -10.366 3.195 1.00 55.12 H new ATOM 0 HB3 SER A 1 5.754 -9.635 4.611 1.00 55.12 H new ATOM 0 HG SER A 1 4.520 -9.810 2.019 1.00 51.10 H new ATOM 14 N ILE A 2 4.073 -7.191 3.053 1.00 22.02 N ATOM 15 CA ILE A 2 3.066 -6.165 3.365 1.00 32.02 C ATOM 16 C ILE A 2 3.513 -4.772 2.889 1.00 13.11 C ATOM 17 O ILE A 2 4.203 -4.043 3.606 1.00 24.50 O ATOM 18 CB ILE A 2 2.735 -6.119 4.886 1.00 3.00 C ATOM 19 CG1 ILE A 2 2.176 -7.474 5.354 1.00 71.52 C ATOM 20 CG2 ILE A 2 1.748 -4.993 5.203 1.00 41.23 C ATOM 21 CD1 ILE A 2 0.866 -7.859 4.691 1.00 23.35 C ATOM 0 H ILE A 2 3.733 -7.941 2.450 1.00 22.02 H new ATOM 0 HA ILE A 2 2.162 -6.447 2.825 1.00 32.02 H new ATOM 0 HB ILE A 2 3.659 -5.916 5.427 1.00 3.00 H new ATOM 0 HG12 ILE A 2 2.915 -8.250 5.154 1.00 71.52 H new ATOM 0 HG13 ILE A 2 2.030 -7.443 6.434 1.00 71.52 H new ATOM 0 HG21 ILE A 2 1.536 -4.985 6.272 1.00 41.23 H new ATOM 0 HG22 ILE A 2 2.182 -4.036 4.912 1.00 41.23 H new ATOM 0 HG23 ILE A 2 0.822 -5.154 4.650 1.00 41.23 H new ATOM 0 HD11 ILE A 2 0.536 -8.825 5.072 1.00 23.35 H new ATOM 0 HD12 ILE A 2 0.111 -7.105 4.912 1.00 23.35 H new ATOM 0 HD13 ILE A 2 1.009 -7.924 3.612 1.00 23.35 H new ATOM 33 N GLY A 3 3.140 -4.423 1.664 1.00 24.52 N ATOM 34 CA GLY A 3 3.478 -3.114 1.126 1.00 65.44 C ATOM 35 C GLY A 3 2.540 -2.014 1.612 1.00 2.33 C ATOM 36 O GLY A 3 1.394 -1.924 1.164 1.00 62.35 O ATOM 0 H GLY A 3 2.609 -5.022 1.031 1.00 24.52 H new ATOM 0 HA2 GLY A 3 4.501 -2.864 1.408 1.00 65.44 H new ATOM 0 HA3 GLY A 3 3.449 -3.155 0.037 1.00 65.44 H new ATOM 40 N VAL A 4 3.015 -1.189 2.541 1.00 4.30 N ATOM 41 CA VAL A 4 2.235 -0.047 3.025 1.00 42.31 C ATOM 42 C VAL A 4 2.465 1.190 2.138 1.00 13.53 C ATOM 43 O VAL A 4 3.538 1.799 2.149 1.00 35.00 O ATOM 44 CB VAL A 4 2.551 0.283 4.512 1.00 34.50 C ATOM 45 CG1 VAL A 4 2.064 -0.841 5.427 1.00 44.42 C ATOM 46 CG2 VAL A 4 4.044 0.532 4.726 1.00 11.51 C ATOM 0 H VAL A 4 3.933 -1.287 2.974 1.00 4.30 H new ATOM 0 HA VAL A 4 1.183 -0.328 2.966 1.00 42.31 H new ATOM 0 HB VAL A 4 2.019 1.200 4.766 1.00 34.50 H new ATOM 0 HG11 VAL A 4 2.294 -0.592 6.463 1.00 44.42 H new ATOM 0 HG12 VAL A 4 0.987 -0.962 5.313 1.00 44.42 H new ATOM 0 HG13 VAL A 4 2.564 -1.772 5.158 1.00 44.42 H new ATOM 0 HG21 VAL A 4 4.228 0.760 5.776 1.00 11.51 H new ATOM 0 HG22 VAL A 4 4.606 -0.359 4.444 1.00 11.51 H new ATOM 0 HG23 VAL A 4 4.364 1.373 4.111 1.00 11.51 H new ATOM 56 N PHE A 5 1.451 1.536 1.349 1.00 32.24 N ATOM 57 CA PHE A 5 1.542 2.647 0.393 1.00 51.43 C ATOM 58 C PHE A 5 0.784 3.886 0.905 1.00 3.53 C ATOM 59 O PHE A 5 -0.434 3.842 1.096 1.00 60.13 O ATOM 60 CB PHE A 5 0.973 2.214 -0.964 1.00 45.14 C ATOM 61 CG PHE A 5 1.578 0.936 -1.500 1.00 51.31 C ATOM 62 CD1 PHE A 5 2.881 0.916 -1.982 1.00 12.35 C ATOM 63 CD2 PHE A 5 0.847 -0.247 -1.515 1.00 32.43 C ATOM 64 CE1 PHE A 5 3.438 -0.254 -2.467 1.00 41.14 C ATOM 65 CE2 PHE A 5 1.402 -1.417 -1.998 1.00 43.23 C ATOM 66 CZ PHE A 5 2.700 -1.421 -2.474 1.00 54.41 C ATOM 0 H PHE A 5 0.548 1.061 1.350 1.00 32.24 H new ATOM 0 HA PHE A 5 2.593 2.913 0.281 1.00 51.43 H new ATOM 0 HB2 PHE A 5 -0.105 2.083 -0.870 1.00 45.14 H new ATOM 0 HB3 PHE A 5 1.135 3.013 -1.687 1.00 45.14 H new ATOM 0 HD1 PHE A 5 3.466 1.824 -1.978 1.00 12.35 H new ATOM 0 HD2 PHE A 5 -0.167 -0.251 -1.144 1.00 32.43 H new ATOM 0 HE1 PHE A 5 4.451 -0.254 -2.841 1.00 41.14 H new ATOM 0 HE2 PHE A 5 0.822 -2.328 -2.004 1.00 43.23 H new ATOM 0 HZ PHE A 5 3.136 -2.335 -2.850 1.00 54.41 H new ATOM 76 N TYR A 6 1.506 4.989 1.111 1.00 72.50 N ATOM 77 CA TYR A 6 0.912 6.212 1.680 1.00 22.04 C ATOM 78 C TYR A 6 1.647 7.486 1.218 1.00 2.45 C ATOM 79 O TYR A 6 2.650 7.417 0.505 1.00 2.41 O ATOM 80 CB TYR A 6 0.948 6.133 3.216 1.00 41.00 C ATOM 81 CG TYR A 6 2.359 6.020 3.781 1.00 51.00 C ATOM 82 CD1 TYR A 6 3.007 4.788 3.851 1.00 31.33 C ATOM 83 CD2 TYR A 6 3.045 7.143 4.234 1.00 52.51 C ATOM 84 CE1 TYR A 6 4.292 4.683 4.351 1.00 35.00 C ATOM 85 CE2 TYR A 6 4.331 7.043 4.732 1.00 62.53 C ATOM 86 CZ TYR A 6 4.947 5.813 4.791 1.00 45.51 C ATOM 87 OH TYR A 6 6.225 5.717 5.291 1.00 41.21 O ATOM 0 H TYR A 6 2.500 5.066 0.895 1.00 72.50 H new ATOM 0 HA TYR A 6 -0.116 6.274 1.324 1.00 22.04 H new ATOM 0 HB2 TYR A 6 0.468 7.020 3.630 1.00 41.00 H new ATOM 0 HB3 TYR A 6 0.363 5.273 3.542 1.00 41.00 H new ATOM 0 HD1 TYR A 6 2.497 3.900 3.509 1.00 31.33 H new ATOM 0 HD2 TYR A 6 2.564 8.109 4.196 1.00 52.51 H new ATOM 0 HE1 TYR A 6 4.780 3.721 4.396 1.00 35.00 H new ATOM 0 HE2 TYR A 6 4.850 7.926 5.073 1.00 62.53 H new ATOM 0 HH TYR A 6 6.540 6.606 5.555 1.00 41.21 H new ATOM 97 N VAL A 7 1.127 8.648 1.631 1.00 34.25 N ATOM 98 CA VAL A 7 1.800 9.940 1.411 1.00 30.41 C ATOM 99 C VAL A 7 2.336 10.495 2.741 1.00 23.30 C ATOM 100 O VAL A 7 1.578 10.998 3.564 1.00 4.15 O ATOM 101 CB VAL A 7 0.851 10.988 0.773 1.00 1.02 C ATOM 102 CG1 VAL A 7 1.593 12.298 0.493 1.00 74.14 C ATOM 103 CG2 VAL A 7 0.223 10.440 -0.504 1.00 40.23 C ATOM 0 H VAL A 7 0.237 8.723 2.123 1.00 34.25 H new ATOM 0 HA VAL A 7 2.624 9.757 0.721 1.00 30.41 H new ATOM 0 HB VAL A 7 0.052 11.198 1.484 1.00 1.02 H new ATOM 0 HG11 VAL A 7 0.906 13.017 0.046 1.00 74.14 H new ATOM 0 HG12 VAL A 7 1.983 12.702 1.427 1.00 74.14 H new ATOM 0 HG13 VAL A 7 2.418 12.109 -0.194 1.00 74.14 H new ATOM 0 HG21 VAL A 7 -0.439 11.191 -0.935 1.00 40.23 H new ATOM 0 HG22 VAL A 7 1.008 10.195 -1.219 1.00 40.23 H new ATOM 0 HG23 VAL A 7 -0.350 9.542 -0.272 1.00 40.23 H new ATOM 113 N SER A 8 3.643 10.389 2.939 1.00 1.34 N ATOM 114 CA SER A 8 4.285 10.747 4.215 1.00 74.10 C ATOM 115 C SER A 8 4.069 12.216 4.617 1.00 21.33 C ATOM 116 O SER A 8 3.566 12.506 5.703 1.00 0.11 O ATOM 117 CB SER A 8 5.789 10.453 4.137 1.00 21.03 C ATOM 118 OG SER A 8 6.391 11.137 3.047 1.00 32.24 O ATOM 0 H SER A 8 4.294 10.055 2.228 1.00 1.34 H new ATOM 0 HA SER A 8 3.812 10.137 4.984 1.00 74.10 H new ATOM 0 HB2 SER A 8 6.270 10.753 5.068 1.00 21.03 H new ATOM 0 HB3 SER A 8 5.947 9.380 4.028 1.00 21.03 H new ATOM 0 HG SER A 8 6.201 10.657 2.214 1.00 32.24 H new ATOM 124 N GLU A 9 4.463 13.136 3.744 1.00 53.43 N ATOM 125 CA GLU A 9 4.417 14.577 4.041 1.00 15.03 C ATOM 126 C GLU A 9 2.996 15.082 4.371 1.00 4.35 C ATOM 127 O GLU A 9 2.805 15.868 5.308 1.00 1.45 O ATOM 128 CB GLU A 9 4.985 15.365 2.852 1.00 35.24 C ATOM 129 CG GLU A 9 4.973 16.877 3.051 1.00 54.13 C ATOM 130 CD GLU A 9 5.511 17.632 1.848 1.00 13.02 C ATOM 131 OE1 GLU A 9 4.731 17.879 0.900 1.00 65.00 O ATOM 132 OE2 GLU A 9 6.711 17.983 1.841 1.00 35.12 O ATOM 0 H GLU A 9 4.822 12.915 2.815 1.00 53.43 H new ATOM 0 HA GLU A 9 5.024 14.739 4.932 1.00 15.03 H new ATOM 0 HB2 GLU A 9 6.009 15.040 2.670 1.00 35.24 H new ATOM 0 HB3 GLU A 9 4.410 15.121 1.959 1.00 35.24 H new ATOM 0 HG2 GLU A 9 3.953 17.204 3.254 1.00 54.13 H new ATOM 0 HG3 GLU A 9 5.569 17.128 3.928 1.00 54.13 H new ATOM 139 N TYR A 10 2.003 14.639 3.602 1.00 63.13 N ATOM 140 CA TYR A 10 0.633 15.151 3.741 1.00 1.40 C ATOM 141 C TYR A 10 -0.094 14.550 4.959 1.00 12.23 C ATOM 142 O TYR A 10 -0.289 13.336 5.050 1.00 14.43 O ATOM 143 CB TYR A 10 -0.167 14.876 2.461 1.00 43.21 C ATOM 144 CG TYR A 10 -1.505 15.598 2.399 1.00 30.32 C ATOM 145 CD1 TYR A 10 -1.558 16.988 2.334 1.00 54.33 C ATOM 146 CD2 TYR A 10 -2.709 14.896 2.385 1.00 44.23 C ATOM 147 CE1 TYR A 10 -2.766 17.655 2.255 1.00 24.13 C ATOM 148 CE2 TYR A 10 -3.923 15.559 2.310 1.00 55.33 C ATOM 149 CZ TYR A 10 -3.945 16.938 2.246 1.00 1.14 C ATOM 150 OH TYR A 10 -5.149 17.607 2.156 1.00 10.22 O ATOM 0 H TYR A 10 2.116 13.930 2.878 1.00 63.13 H new ATOM 0 HA TYR A 10 0.704 16.227 3.903 1.00 1.40 H new ATOM 0 HB2 TYR A 10 0.433 15.170 1.600 1.00 43.21 H new ATOM 0 HB3 TYR A 10 -0.341 13.803 2.377 1.00 43.21 H new ATOM 0 HD1 TYR A 10 -0.639 17.555 2.346 1.00 54.33 H new ATOM 0 HD2 TYR A 10 -2.695 13.817 2.433 1.00 44.23 H new ATOM 0 HE1 TYR A 10 -2.787 18.733 2.201 1.00 24.13 H new ATOM 0 HE2 TYR A 10 -4.847 15.000 2.302 1.00 55.33 H new ATOM 0 HH TYR A 10 -5.803 17.185 2.751 1.00 10.22 H new ATOM 160 N GLY A 11 -0.525 15.425 5.869 1.00 41.33 N ATOM 161 CA GLY A 11 -1.219 14.998 7.082 1.00 44.51 C ATOM 162 C GLY A 11 -0.439 14.000 7.938 1.00 11.54 C ATOM 163 O GLY A 11 0.776 13.860 7.805 1.00 11.14 O ATOM 0 H GLY A 11 -0.405 16.435 5.788 1.00 41.33 H new ATOM 0 HA2 GLY A 11 -1.445 15.877 7.685 1.00 44.51 H new ATOM 0 HA3 GLY A 11 -2.173 14.550 6.802 1.00 44.51 H new ATOM 167 N TYR A 12 -1.148 13.319 8.836 1.00 30.10 N ATOM 168 CA TYR A 12 -0.535 12.350 9.757 1.00 1.50 C ATOM 169 C TYR A 12 -0.323 10.979 9.091 1.00 51.23 C ATOM 170 O TYR A 12 0.035 10.012 9.760 1.00 54.41 O ATOM 171 CB TYR A 12 -1.409 12.185 11.011 1.00 22.53 C ATOM 172 CG TYR A 12 -1.717 13.491 11.725 1.00 31.04 C ATOM 173 CD1 TYR A 12 -0.734 14.165 12.442 1.00 35.33 C ATOM 174 CD2 TYR A 12 -2.991 14.052 11.675 1.00 1.25 C ATOM 175 CE1 TYR A 12 -1.012 15.356 13.089 1.00 31.32 C ATOM 176 CE2 TYR A 12 -3.275 15.242 12.317 1.00 55.41 C ATOM 177 CZ TYR A 12 -2.284 15.890 13.023 1.00 34.51 C ATOM 178 OH TYR A 12 -2.567 17.079 13.662 1.00 0.31 O ATOM 0 H TYR A 12 -2.157 13.418 8.950 1.00 30.10 H new ATOM 0 HA TYR A 12 0.443 12.742 10.038 1.00 1.50 H new ATOM 0 HB2 TYR A 12 -2.347 11.708 10.728 1.00 22.53 H new ATOM 0 HB3 TYR A 12 -0.906 11.512 11.706 1.00 22.53 H new ATOM 0 HD1 TYR A 12 0.263 13.752 12.495 1.00 35.33 H new ATOM 0 HD2 TYR A 12 -3.771 13.547 11.124 1.00 1.25 H new ATOM 0 HE1 TYR A 12 -0.238 15.866 13.643 1.00 31.32 H new ATOM 0 HE2 TYR A 12 -4.268 15.662 12.266 1.00 55.41 H new ATOM 0 HH TYR A 12 -3.507 17.314 13.514 1.00 0.31 H new ATOM 188 N SER A 13 -0.559 10.906 7.780 1.00 0.41 N ATOM 189 CA SER A 13 -0.526 9.639 7.023 1.00 50.44 C ATOM 190 C SER A 13 0.676 8.741 7.376 1.00 64.22 C ATOM 191 O SER A 13 0.519 7.531 7.543 1.00 75.45 O ATOM 192 CB SER A 13 -0.520 9.931 5.518 1.00 23.10 C ATOM 193 OG SER A 13 -1.609 10.766 5.154 1.00 54.12 O ATOM 0 H SER A 13 -0.779 11.720 7.207 1.00 0.41 H new ATOM 0 HA SER A 13 -1.424 9.089 7.306 1.00 50.44 H new ATOM 0 HB2 SER A 13 0.419 10.411 5.242 1.00 23.10 H new ATOM 0 HB3 SER A 13 -0.574 8.995 4.963 1.00 23.10 H new ATOM 0 HG SER A 13 -1.297 11.691 5.066 1.00 54.12 H new ATOM 199 N ASP A 14 1.873 9.320 7.492 1.00 40.13 N ATOM 200 CA ASP A 14 3.070 8.538 7.830 1.00 54.25 C ATOM 201 C ASP A 14 3.067 8.121 9.310 1.00 52.51 C ATOM 202 O ASP A 14 3.500 7.018 9.652 1.00 0.54 O ATOM 203 CB ASP A 14 4.338 9.329 7.499 1.00 12.53 C ATOM 204 CG ASP A 14 4.507 10.569 8.356 1.00 14.03 C ATOM 205 OD1 ASP A 14 3.488 11.195 8.709 1.00 60.30 O ATOM 206 OD2 ASP A 14 5.663 10.930 8.669 1.00 25.23 O ATOM 0 H ASP A 14 2.042 10.317 7.359 1.00 40.13 H new ATOM 0 HA ASP A 14 3.056 7.630 7.227 1.00 54.25 H new ATOM 0 HB2 ASP A 14 5.206 8.683 7.630 1.00 12.53 H new ATOM 0 HB3 ASP A 14 4.313 9.621 6.449 1.00 12.53 H new ATOM 211 N ARG A 15 2.573 9.004 10.182 1.00 40.43 N ATOM 212 CA ARG A 15 2.427 8.685 11.607 1.00 32.31 C ATOM 213 C ARG A 15 1.464 7.495 11.777 1.00 32.23 C ATOM 214 O ARG A 15 1.689 6.595 12.588 1.00 2.15 O ATOM 215 CB ARG A 15 1.890 9.900 12.389 1.00 40.53 C ATOM 216 CG ARG A 15 2.619 11.222 12.121 1.00 74.11 C ATOM 217 CD ARG A 15 4.129 11.112 12.319 1.00 3.14 C ATOM 218 NE ARG A 15 4.768 12.424 12.458 1.00 14.13 N ATOM 219 CZ ARG A 15 4.921 13.293 11.489 1.00 52.44 C ATOM 220 NH1 ARG A 15 4.483 13.052 10.297 1.00 70.34 N ATOM 221 NH2 ARG A 15 5.520 14.415 11.717 1.00 21.42 N ATOM 0 H ARG A 15 2.268 9.944 9.928 1.00 40.43 H new ATOM 0 HA ARG A 15 3.408 8.424 12.004 1.00 32.31 H new ATOM 0 HB2 ARG A 15 0.835 10.030 12.148 1.00 40.53 H new ATOM 0 HB3 ARG A 15 1.949 9.681 13.455 1.00 40.53 H new ATOM 0 HG2 ARG A 15 2.413 11.546 11.101 1.00 74.11 H new ATOM 0 HG3 ARG A 15 2.225 11.991 12.785 1.00 74.11 H new ATOM 0 HD2 ARG A 15 4.334 10.514 13.207 1.00 3.14 H new ATOM 0 HD3 ARG A 15 4.567 10.585 11.472 1.00 3.14 H new ATOM 0 HE ARG A 15 5.121 12.680 13.380 1.00 14.13 H new ATOM 0 HH11 ARG A 15 4.008 12.172 10.096 1.00 70.34 H new ATOM 0 HH12 ARG A 15 4.612 13.742 9.557 1.00 70.34 H new ATOM 0 HH21 ARG A 15 5.873 14.624 12.651 1.00 21.42 H new ATOM 0 HH22 ARG A 15 5.639 15.092 10.963 1.00 21.42 H new ATOM 235 N LEU A 16 0.394 7.505 10.985 1.00 73.44 N ATOM 236 CA LEU A 16 -0.580 6.411 10.959 1.00 60.40 C ATOM 237 C LEU A 16 0.053 5.129 10.397 1.00 4.35 C ATOM 238 O LEU A 16 -0.171 4.030 10.910 1.00 20.42 O ATOM 239 CB LEU A 16 -1.794 6.814 10.112 1.00 22.13 C ATOM 240 CG LEU A 16 -2.525 8.085 10.579 1.00 3.13 C ATOM 241 CD1 LEU A 16 -3.630 8.459 9.600 1.00 34.10 C ATOM 242 CD2 LEU A 16 -3.092 7.903 11.986 1.00 31.14 C ATOM 0 H LEU A 16 0.176 8.268 10.344 1.00 73.44 H new ATOM 0 HA LEU A 16 -0.904 6.212 11.981 1.00 60.40 H new ATOM 0 HB2 LEU A 16 -1.467 6.960 9.083 1.00 22.13 H new ATOM 0 HB3 LEU A 16 -2.504 5.987 10.107 1.00 22.13 H new ATOM 0 HG LEU A 16 -1.801 8.899 10.609 1.00 3.13 H new ATOM 0 HD11 LEU A 16 -4.135 9.360 9.948 1.00 34.10 H new ATOM 0 HD12 LEU A 16 -3.198 8.642 8.616 1.00 34.10 H new ATOM 0 HD13 LEU A 16 -4.349 7.643 9.534 1.00 34.10 H new ATOM 0 HD21 LEU A 16 -3.604 8.815 12.293 1.00 31.14 H new ATOM 0 HD22 LEU A 16 -3.798 7.072 11.989 1.00 31.14 H new ATOM 0 HD23 LEU A 16 -2.280 7.691 12.681 1.00 31.14 H new ATOM 254 N ALA A 17 0.851 5.278 9.341 1.00 13.24 N ATOM 255 CA ALA A 17 1.589 4.151 8.765 1.00 54.41 C ATOM 256 C ALA A 17 2.544 3.528 9.797 1.00 50.21 C ATOM 257 O ALA A 17 2.699 2.309 9.861 1.00 75.11 O ATOM 258 CB ALA A 17 2.359 4.599 7.529 1.00 33.42 C ATOM 0 H ALA A 17 1.004 6.167 8.866 1.00 13.24 H new ATOM 0 HA ALA A 17 0.868 3.388 8.472 1.00 54.41 H new ATOM 0 HB1 ALA A 17 2.902 3.751 7.112 1.00 33.42 H new ATOM 0 HB2 ALA A 17 1.661 4.984 6.785 1.00 33.42 H new ATOM 0 HB3 ALA A 17 3.065 5.383 7.804 1.00 33.42 H new ATOM 264 N GLN A 18 3.175 4.375 10.611 1.00 70.55 N ATOM 265 CA GLN A 18 4.055 3.900 11.683 1.00 20.23 C ATOM 266 C GLN A 18 3.247 3.214 12.795 1.00 5.43 C ATOM 267 O GLN A 18 3.754 2.335 13.492 1.00 13.41 O ATOM 268 CB GLN A 18 4.891 5.056 12.252 1.00 61.41 C ATOM 269 CG GLN A 18 5.930 4.615 13.283 1.00 31.24 C ATOM 270 CD GLN A 18 6.943 5.700 13.609 1.00 30.22 C ATOM 271 OE1 GLN A 18 6.756 6.501 14.519 1.00 12.05 O ATOM 272 NE2 GLN A 18 8.028 5.732 12.863 1.00 72.33 N ATOM 0 H GLN A 18 3.095 5.390 10.550 1.00 70.55 H new ATOM 0 HA GLN A 18 4.736 3.163 11.258 1.00 20.23 H new ATOM 0 HB2 GLN A 18 5.399 5.563 11.432 1.00 61.41 H new ATOM 0 HB3 GLN A 18 4.223 5.784 12.712 1.00 61.41 H new ATOM 0 HG2 GLN A 18 5.420 4.315 14.199 1.00 31.24 H new ATOM 0 HG3 GLN A 18 6.455 3.736 12.908 1.00 31.24 H new ATOM 0 HE21 GLN A 18 8.152 5.051 12.114 1.00 72.33 H new ATOM 0 HE22 GLN A 18 8.744 6.438 13.034 1.00 72.33 H new ATOM 281 N ALA A 19 1.982 3.616 12.955 1.00 72.50 N ATOM 282 CA ALA A 19 1.058 2.917 13.856 1.00 64.10 C ATOM 283 C ALA A 19 0.805 1.485 13.357 1.00 64.51 C ATOM 284 O ALA A 19 0.697 0.547 14.146 1.00 44.04 O ATOM 285 CB ALA A 19 -0.252 3.689 13.985 1.00 1.12 C ATOM 0 H ALA A 19 1.575 4.419 12.475 1.00 72.50 H new ATOM 0 HA ALA A 19 1.513 2.858 14.845 1.00 64.10 H new ATOM 0 HB1 ALA A 19 -0.924 3.155 14.657 1.00 1.12 H new ATOM 0 HB2 ALA A 19 -0.051 4.682 14.386 1.00 1.12 H new ATOM 0 HB3 ALA A 19 -0.718 3.782 13.004 1.00 1.12 H new ATOM 291 N ILE A 20 0.720 1.327 12.035 1.00 23.34 N ATOM 292 CA ILE A 20 0.664 -0.001 11.413 1.00 71.34 C ATOM 293 C ILE A 20 1.961 -0.778 11.696 1.00 74.51 C ATOM 294 O ILE A 20 1.936 -1.906 12.195 1.00 61.14 O ATOM 295 CB ILE A 20 0.467 0.100 9.878 1.00 43.43 C ATOM 296 CG1 ILE A 20 -0.816 0.877 9.540 1.00 64.00 C ATOM 297 CG2 ILE A 20 0.438 -1.287 9.239 1.00 54.41 C ATOM 298 CD1 ILE A 20 -1.059 1.042 8.052 1.00 74.15 C ATOM 0 H ILE A 20 0.688 2.102 11.372 1.00 23.34 H new ATOM 0 HA ILE A 20 -0.188 -0.526 11.844 1.00 71.34 H new ATOM 0 HB ILE A 20 1.316 0.647 9.467 1.00 43.43 H new ATOM 0 HG12 ILE A 20 -1.669 0.362 9.983 1.00 64.00 H new ATOM 0 HG13 ILE A 20 -0.764 1.863 10.002 1.00 64.00 H new ATOM 0 HG21 ILE A 20 0.299 -1.189 8.162 1.00 54.41 H new ATOM 0 HG22 ILE A 20 1.379 -1.799 9.438 1.00 54.41 H new ATOM 0 HG23 ILE A 20 -0.385 -1.864 9.660 1.00 54.41 H new ATOM 0 HD11 ILE A 20 -1.982 1.600 7.894 1.00 74.15 H new ATOM 0 HD12 ILE A 20 -0.226 1.585 7.605 1.00 74.15 H new ATOM 0 HD13 ILE A 20 -1.144 0.060 7.586 1.00 74.15 H new ATOM 310 N ILE A 21 3.095 -0.150 11.376 1.00 15.54 N ATOM 311 CA ILE A 21 4.418 -0.730 11.633 1.00 3.12 C ATOM 312 C ILE A 21 4.585 -1.106 13.118 1.00 71.21 C ATOM 313 O ILE A 21 5.250 -2.087 13.450 1.00 34.22 O ATOM 314 CB ILE A 21 5.545 0.255 11.220 1.00 60.43 C ATOM 315 CG1 ILE A 21 5.415 0.628 9.732 1.00 75.50 C ATOM 316 CG2 ILE A 21 6.923 -0.343 11.505 1.00 4.12 C ATOM 317 CD1 ILE A 21 6.415 1.669 9.269 1.00 40.04 C ATOM 0 H ILE A 21 3.124 0.769 10.934 1.00 15.54 H new ATOM 0 HA ILE A 21 4.496 -1.635 11.031 1.00 3.12 H new ATOM 0 HB ILE A 21 5.440 1.162 11.815 1.00 60.43 H new ATOM 0 HG12 ILE A 21 5.538 -0.272 9.130 1.00 75.50 H new ATOM 0 HG13 ILE A 21 4.407 1.000 9.548 1.00 75.50 H new ATOM 0 HG21 ILE A 21 7.696 0.366 11.207 1.00 4.12 H new ATOM 0 HG22 ILE A 21 7.015 -0.554 12.570 1.00 4.12 H new ATOM 0 HG23 ILE A 21 7.042 -1.268 10.941 1.00 4.12 H new ATOM 0 HD11 ILE A 21 6.259 1.878 8.211 1.00 40.04 H new ATOM 0 HD12 ILE A 21 6.279 2.585 9.844 1.00 40.04 H new ATOM 0 HD13 ILE A 21 7.427 1.293 9.419 1.00 40.04 H new ATOM 329 N ASN A 22 3.966 -0.322 14.000 1.00 34.25 N ATOM 330 CA ASN A 22 3.975 -0.595 15.444 1.00 53.44 C ATOM 331 C ASN A 22 3.489 -2.025 15.743 1.00 3.12 C ATOM 332 O ASN A 22 4.228 -2.840 16.295 1.00 24.51 O ATOM 333 CB ASN A 22 3.086 0.431 16.165 1.00 32.45 C ATOM 334 CG ASN A 22 3.010 0.213 17.665 1.00 25.04 C ATOM 335 OD1 ASN A 22 3.969 -0.217 18.299 1.00 52.05 O ATOM 336 ND2 ASN A 22 1.860 0.495 18.241 1.00 43.53 N ATOM 0 H ASN A 22 3.446 0.516 13.740 1.00 34.25 H new ATOM 0 HA ASN A 22 4.999 -0.509 15.807 1.00 53.44 H new ATOM 0 HB2 ASN A 22 3.468 1.433 15.970 1.00 32.45 H new ATOM 0 HB3 ASN A 22 2.080 0.387 15.747 1.00 32.45 H new ATOM 0 HD21 ASN A 22 1.745 0.358 19.245 1.00 43.53 H new ATOM 0 HD22 ASN A 22 1.084 0.851 17.683 1.00 43.53 H new ATOM 343 N GLY A 23 2.251 -2.327 15.348 1.00 52.30 N ATOM 344 CA GLY A 23 1.691 -3.657 15.571 1.00 3.40 C ATOM 345 C GLY A 23 2.435 -4.754 14.813 1.00 71.55 C ATOM 346 O GLY A 23 2.658 -5.846 15.339 1.00 41.41 O ATOM 0 H GLY A 23 1.624 -1.675 14.877 1.00 52.30 H new ATOM 0 HA2 GLY A 23 1.714 -3.881 16.638 1.00 3.40 H new ATOM 0 HA3 GLY A 23 0.644 -3.660 15.268 1.00 3.40 H new ATOM 350 N ILE A 24 2.823 -4.460 13.574 1.00 51.11 N ATOM 351 CA ILE A 24 3.555 -5.416 12.734 1.00 72.43 C ATOM 352 C ILE A 24 4.907 -5.828 13.359 1.00 50.22 C ATOM 353 O ILE A 24 5.210 -7.020 13.480 1.00 73.12 O ATOM 354 CB ILE A 24 3.781 -4.837 11.311 1.00 14.31 C ATOM 355 CG1 ILE A 24 2.434 -4.656 10.587 1.00 0.35 C ATOM 356 CG2 ILE A 24 4.716 -5.727 10.493 1.00 12.12 C ATOM 357 CD1 ILE A 24 2.559 -4.132 9.170 1.00 64.53 C ATOM 0 H ILE A 24 2.643 -3.563 13.124 1.00 51.11 H new ATOM 0 HA ILE A 24 2.938 -6.312 12.663 1.00 72.43 H new ATOM 0 HB ILE A 24 4.257 -3.862 11.415 1.00 14.31 H new ATOM 0 HG12 ILE A 24 1.914 -5.614 10.564 1.00 0.35 H new ATOM 0 HG13 ILE A 24 1.813 -3.970 11.163 1.00 0.35 H new ATOM 0 HG21 ILE A 24 4.855 -5.295 9.502 1.00 12.12 H new ATOM 0 HG22 ILE A 24 5.681 -5.800 10.995 1.00 12.12 H new ATOM 0 HG23 ILE A 24 4.281 -6.722 10.398 1.00 12.12 H new ATOM 0 HD11 ILE A 24 1.567 -4.033 8.730 1.00 64.53 H new ATOM 0 HD12 ILE A 24 3.049 -3.158 9.184 1.00 64.53 H new ATOM 0 HD13 ILE A 24 3.151 -4.828 8.576 1.00 64.53 H new ATOM 369 N THR A 25 5.714 -4.846 13.762 1.00 71.13 N ATOM 370 CA THR A 25 7.008 -5.118 14.416 1.00 21.32 C ATOM 371 C THR A 25 6.811 -5.742 15.802 1.00 53.53 C ATOM 372 O THR A 25 7.566 -6.630 16.205 1.00 73.11 O ATOM 373 CB THR A 25 7.867 -3.840 14.565 1.00 75.33 C ATOM 374 OG1 THR A 25 7.172 -2.864 15.358 1.00 20.12 O ATOM 375 CG2 THR A 25 8.213 -3.253 13.200 1.00 11.44 C ATOM 0 H THR A 25 5.501 -3.855 13.650 1.00 71.13 H new ATOM 0 HA THR A 25 7.532 -5.820 13.768 1.00 21.32 H new ATOM 0 HB THR A 25 8.795 -4.112 15.067 1.00 75.33 H new ATOM 0 HG1 THR A 25 6.433 -2.486 14.837 1.00 20.12 H new ATOM 0 HG21 THR A 25 8.817 -2.355 13.332 1.00 11.44 H new ATOM 0 HG22 THR A 25 8.774 -3.986 12.620 1.00 11.44 H new ATOM 0 HG23 THR A 25 7.295 -2.998 12.671 1.00 11.44 H new ATOM 383 N LYS A 26 5.794 -5.273 16.525 1.00 21.12 N ATOM 384 CA LYS A 26 5.416 -5.859 17.815 1.00 11.13 C ATOM 385 C LYS A 26 5.059 -7.349 17.663 1.00 5.44 C ATOM 386 O LYS A 26 5.291 -8.154 18.566 1.00 73.02 O ATOM 387 CB LYS A 26 4.233 -5.081 18.416 1.00 72.11 C ATOM 388 CG LYS A 26 3.695 -5.658 19.722 1.00 71.42 C ATOM 389 CD LYS A 26 2.590 -4.787 20.312 1.00 43.22 C ATOM 390 CE LYS A 26 1.929 -5.443 21.519 1.00 44.00 C ATOM 391 NZ LYS A 26 2.899 -5.725 22.611 1.00 1.22 N ATOM 0 H LYS A 26 5.213 -4.485 16.239 1.00 21.12 H new ATOM 0 HA LYS A 26 6.269 -5.787 18.490 1.00 11.13 H new ATOM 0 HB2 LYS A 26 4.543 -4.050 18.589 1.00 72.11 H new ATOM 0 HB3 LYS A 26 3.424 -5.053 17.686 1.00 72.11 H new ATOM 0 HG2 LYS A 26 3.311 -6.663 19.545 1.00 71.42 H new ATOM 0 HG3 LYS A 26 4.509 -5.750 20.441 1.00 71.42 H new ATOM 0 HD2 LYS A 26 3.006 -3.823 20.606 1.00 43.22 H new ATOM 0 HD3 LYS A 26 1.837 -4.590 19.549 1.00 43.22 H new ATOM 0 HE2 LYS A 26 1.140 -4.793 21.896 1.00 44.00 H new ATOM 0 HE3 LYS A 26 1.454 -6.374 21.209 1.00 44.00 H new ATOM 0 HZ1 LYS A 26 2.387 -6.060 23.452 1.00 1.22 H new ATOM 0 HZ2 LYS A 26 3.569 -6.457 22.300 1.00 1.22 H new ATOM 0 HZ3 LYS A 26 3.420 -4.856 22.846 1.00 1.22 H new ATOM 405 N THR A 27 4.490 -7.707 16.512 1.00 45.34 N ATOM 406 CA THR A 27 4.191 -9.113 16.193 1.00 63.11 C ATOM 407 C THR A 27 5.453 -9.856 15.718 1.00 1.33 C ATOM 408 O THR A 27 5.641 -11.038 16.012 1.00 10.32 O ATOM 409 CB THR A 27 3.095 -9.226 15.100 1.00 62.44 C ATOM 410 OG1 THR A 27 1.901 -8.549 15.525 1.00 14.13 O ATOM 411 CG2 THR A 27 2.761 -10.684 14.791 1.00 74.11 C ATOM 0 H THR A 27 4.225 -7.046 15.781 1.00 45.34 H new ATOM 0 HA THR A 27 3.826 -9.574 17.111 1.00 63.11 H new ATOM 0 HB THR A 27 3.485 -8.760 14.195 1.00 62.44 H new ATOM 0 HG1 THR A 27 2.048 -7.580 15.502 1.00 14.13 H new ATOM 0 HG21 THR A 27 1.990 -10.725 14.022 1.00 74.11 H new ATOM 0 HG22 THR A 27 3.656 -11.195 14.436 1.00 74.11 H new ATOM 0 HG23 THR A 27 2.398 -11.174 15.695 1.00 74.11 H new ATOM 419 N GLY A 28 6.320 -9.148 14.994 1.00 64.11 N ATOM 420 CA GLY A 28 7.569 -9.741 14.504 1.00 75.52 C ATOM 421 C GLY A 28 7.567 -9.994 12.996 1.00 64.05 C ATOM 422 O GLY A 28 8.192 -10.941 12.513 1.00 63.33 O ATOM 0 H GLY A 28 6.184 -8.171 14.734 1.00 64.11 H new ATOM 0 HA2 GLY A 28 8.399 -9.080 14.754 1.00 75.52 H new ATOM 0 HA3 GLY A 28 7.744 -10.683 15.023 1.00 75.52 H new ATOM 426 N VAL A 29 6.871 -9.142 12.248 1.00 4.45 N ATOM 427 CA VAL A 29 6.769 -9.290 10.791 1.00 11.12 C ATOM 428 C VAL A 29 7.571 -8.198 10.057 1.00 41.24 C ATOM 429 O VAL A 29 7.497 -7.022 10.409 1.00 50.33 O ATOM 430 CB VAL A 29 5.289 -9.228 10.331 1.00 74.21 C ATOM 431 CG1 VAL A 29 5.161 -9.534 8.838 1.00 42.15 C ATOM 432 CG2 VAL A 29 4.423 -10.172 11.166 1.00 33.54 C ATOM 0 H VAL A 29 6.367 -8.339 12.624 1.00 4.45 H new ATOM 0 HA VAL A 29 7.187 -10.265 10.539 1.00 11.12 H new ATOM 0 HB VAL A 29 4.928 -8.212 10.489 1.00 74.21 H new ATOM 0 HG11 VAL A 29 4.112 -9.483 8.545 1.00 42.15 H new ATOM 0 HG12 VAL A 29 5.734 -8.803 8.266 1.00 42.15 H new ATOM 0 HG13 VAL A 29 5.546 -10.534 8.637 1.00 42.15 H new ATOM 0 HG21 VAL A 29 3.389 -10.113 10.827 1.00 33.54 H new ATOM 0 HG22 VAL A 29 4.784 -11.194 11.052 1.00 33.54 H new ATOM 0 HG23 VAL A 29 4.478 -9.883 12.216 1.00 33.54 H new ATOM 442 N GLY A 30 8.345 -8.599 9.047 1.00 70.41 N ATOM 443 CA GLY A 30 9.085 -7.635 8.233 1.00 60.13 C ATOM 444 C GLY A 30 8.188 -6.898 7.237 1.00 61.23 C ATOM 445 O GLY A 30 7.679 -7.502 6.288 1.00 44.20 O ATOM 0 H GLY A 30 8.475 -9.574 8.776 1.00 70.41 H new ATOM 0 HA2 GLY A 30 9.570 -6.909 8.886 1.00 60.13 H new ATOM 0 HA3 GLY A 30 9.875 -8.154 7.690 1.00 60.13 H new ATOM 449 N VAL A 31 8.007 -5.592 7.444 1.00 61.45 N ATOM 450 CA VAL A 31 7.076 -4.786 6.631 1.00 4.41 C ATOM 451 C VAL A 31 7.797 -3.991 5.523 1.00 2.44 C ATOM 452 O VAL A 31 8.890 -3.456 5.731 1.00 54.42 O ATOM 453 CB VAL A 31 6.263 -3.808 7.523 1.00 64.24 C ATOM 454 CG1 VAL A 31 7.183 -2.856 8.287 1.00 1.13 C ATOM 455 CG2 VAL A 31 5.230 -3.034 6.697 1.00 52.24 C ATOM 0 H VAL A 31 8.492 -5.063 8.169 1.00 61.45 H new ATOM 0 HA VAL A 31 6.398 -5.492 6.151 1.00 4.41 H new ATOM 0 HB VAL A 31 5.723 -4.405 8.258 1.00 64.24 H new ATOM 0 HG11 VAL A 31 6.583 -2.185 8.902 1.00 1.13 H new ATOM 0 HG12 VAL A 31 7.853 -3.432 8.926 1.00 1.13 H new ATOM 0 HG13 VAL A 31 7.771 -2.271 7.579 1.00 1.13 H new ATOM 0 HG21 VAL A 31 4.676 -2.358 7.348 1.00 52.24 H new ATOM 0 HG22 VAL A 31 5.739 -2.458 5.924 1.00 52.24 H new ATOM 0 HG23 VAL A 31 4.538 -3.735 6.230 1.00 52.24 H new ATOM 465 N ASP A 32 7.171 -3.916 4.343 1.00 31.21 N ATOM 466 CA ASP A 32 7.720 -3.159 3.212 1.00 52.23 C ATOM 467 C ASP A 32 7.098 -1.751 3.146 1.00 23.32 C ATOM 468 O ASP A 32 5.920 -1.591 2.816 1.00 21.45 O ATOM 469 CB ASP A 32 7.471 -3.906 1.892 1.00 0.14 C ATOM 470 CG ASP A 32 8.044 -5.318 1.878 1.00 30.05 C ATOM 471 OD1 ASP A 32 8.962 -5.618 2.668 1.00 54.32 O ATOM 472 OD2 ASP A 32 7.569 -6.150 1.076 1.00 71.32 O ATOM 0 H ASP A 32 6.280 -4.372 4.146 1.00 31.21 H new ATOM 0 HA ASP A 32 8.795 -3.058 3.362 1.00 52.23 H new ATOM 0 HB2 ASP A 32 6.398 -3.956 1.708 1.00 0.14 H new ATOM 0 HB3 ASP A 32 7.909 -3.336 1.072 1.00 0.14 H new ATOM 477 N VAL A 33 7.896 -0.734 3.462 1.00 21.34 N ATOM 478 CA VAL A 33 7.414 0.653 3.519 1.00 61.30 C ATOM 479 C VAL A 33 7.713 1.418 2.217 1.00 51.31 C ATOM 480 O VAL A 33 8.876 1.623 1.868 1.00 34.40 O ATOM 481 CB VAL A 33 8.059 1.408 4.710 1.00 13.52 C ATOM 482 CG1 VAL A 33 7.534 2.840 4.803 1.00 24.22 C ATOM 483 CG2 VAL A 33 7.822 0.651 6.017 1.00 74.13 C ATOM 0 H VAL A 33 8.886 -0.841 3.684 1.00 21.34 H new ATOM 0 HA VAL A 33 6.333 0.607 3.653 1.00 61.30 H new ATOM 0 HB VAL A 33 9.134 1.461 4.536 1.00 13.52 H new ATOM 0 HG11 VAL A 33 8.003 3.346 5.647 1.00 24.22 H new ATOM 0 HG12 VAL A 33 7.770 3.375 3.883 1.00 24.22 H new ATOM 0 HG13 VAL A 33 6.454 2.823 4.946 1.00 24.22 H new ATOM 0 HG21 VAL A 33 8.282 1.196 6.842 1.00 74.13 H new ATOM 0 HG22 VAL A 33 6.751 0.559 6.195 1.00 74.13 H new ATOM 0 HG23 VAL A 33 8.264 -0.343 5.947 1.00 74.13 H new ATOM 493 N VAL A 34 6.661 1.852 1.512 1.00 14.20 N ATOM 494 CA VAL A 34 6.821 2.579 0.239 1.00 41.51 C ATOM 495 C VAL A 34 5.968 3.865 0.198 1.00 13.32 C ATOM 496 O VAL A 34 4.739 3.816 0.294 1.00 54.42 O ATOM 497 CB VAL A 34 6.440 1.688 -0.976 1.00 31.34 C ATOM 498 CG1 VAL A 34 6.628 2.445 -2.293 1.00 3.53 C ATOM 499 CG2 VAL A 34 7.250 0.390 -0.979 1.00 14.22 C ATOM 0 H VAL A 34 5.691 1.715 1.797 1.00 14.20 H new ATOM 0 HA VAL A 34 7.875 2.850 0.175 1.00 41.51 H new ATOM 0 HB VAL A 34 5.385 1.430 -0.881 1.00 31.34 H new ATOM 0 HG11 VAL A 34 6.354 1.798 -3.127 1.00 3.53 H new ATOM 0 HG12 VAL A 34 5.993 3.331 -2.297 1.00 3.53 H new ATOM 0 HG13 VAL A 34 7.671 2.746 -2.394 1.00 3.53 H new ATOM 0 HG21 VAL A 34 6.964 -0.215 -1.839 1.00 14.22 H new ATOM 0 HG22 VAL A 34 8.313 0.625 -1.037 1.00 14.22 H new ATOM 0 HG23 VAL A 34 7.051 -0.165 -0.062 1.00 14.22 H new ATOM 509 N ASP A 35 6.631 5.012 0.050 1.00 23.34 N ATOM 510 CA ASP A 35 5.945 6.302 -0.072 1.00 63.23 C ATOM 511 C ASP A 35 5.544 6.585 -1.531 1.00 43.11 C ATOM 512 O ASP A 35 6.384 6.928 -2.363 1.00 73.03 O ATOM 513 CB ASP A 35 6.853 7.424 0.453 1.00 45.54 C ATOM 514 CG ASP A 35 6.261 8.807 0.233 1.00 60.02 C ATOM 515 OD1 ASP A 35 5.453 9.256 1.067 1.00 74.22 O ATOM 516 OD2 ASP A 35 6.604 9.453 -0.777 1.00 24.32 O ATOM 0 H ASP A 35 7.648 5.076 0.011 1.00 23.34 H new ATOM 0 HA ASP A 35 5.034 6.263 0.525 1.00 63.23 H new ATOM 0 HB2 ASP A 35 7.031 7.274 1.518 1.00 45.54 H new ATOM 0 HB3 ASP A 35 7.822 7.364 -0.043 1.00 45.54 H new ATOM 521 N LEU A 36 4.254 6.450 -1.839 1.00 73.11 N ATOM 522 CA LEU A 36 3.760 6.737 -3.192 1.00 3.33 C ATOM 523 C LEU A 36 3.635 8.249 -3.435 1.00 24.54 C ATOM 524 O LEU A 36 3.418 8.691 -4.563 1.00 3.24 O ATOM 525 CB LEU A 36 2.421 6.012 -3.461 1.00 33.23 C ATOM 526 CG LEU A 36 1.283 6.228 -2.434 1.00 55.31 C ATOM 527 CD1 LEU A 36 0.723 7.648 -2.491 1.00 33.40 C ATOM 528 CD2 LEU A 36 0.164 5.212 -2.655 1.00 22.31 C ATOM 0 H LEU A 36 3.537 6.147 -1.180 1.00 73.11 H new ATOM 0 HA LEU A 36 4.494 6.353 -3.900 1.00 3.33 H new ATOM 0 HB2 LEU A 36 2.057 6.325 -4.440 1.00 33.23 H new ATOM 0 HB3 LEU A 36 2.622 4.942 -3.523 1.00 33.23 H new ATOM 0 HG LEU A 36 1.710 6.081 -1.442 1.00 55.31 H new ATOM 0 HD11 LEU A 36 -0.073 7.755 -1.754 1.00 33.40 H new ATOM 0 HD12 LEU A 36 1.518 8.362 -2.273 1.00 33.40 H new ATOM 0 HD13 LEU A 36 0.324 7.842 -3.487 1.00 33.40 H new ATOM 0 HD21 LEU A 36 -0.628 5.378 -1.925 1.00 22.31 H new ATOM 0 HD22 LEU A 36 -0.240 5.329 -3.661 1.00 22.31 H new ATOM 0 HD23 LEU A 36 0.560 4.203 -2.538 1.00 22.31 H new ATOM 540 N GLY A 37 3.779 9.035 -2.366 1.00 1.04 N ATOM 541 CA GLY A 37 3.716 10.487 -2.482 1.00 4.42 C ATOM 542 C GLY A 37 4.917 11.084 -3.218 1.00 14.31 C ATOM 543 O GLY A 37 4.911 12.265 -3.572 1.00 34.53 O ATOM 0 H GLY A 37 3.939 8.691 -1.419 1.00 1.04 H new ATOM 0 HA2 GLY A 37 2.802 10.764 -3.007 1.00 4.42 H new ATOM 0 HA3 GLY A 37 3.656 10.923 -1.485 1.00 4.42 H new ATOM 547 N ALA A 38 5.955 10.272 -3.424 1.00 73.41 N ATOM 548 CA ALA A 38 7.143 10.699 -4.172 1.00 45.04 C ATOM 549 C ALA A 38 7.940 9.499 -4.710 1.00 53.12 C ATOM 550 O ALA A 38 8.303 9.457 -5.890 1.00 24.44 O ATOM 551 CB ALA A 38 8.036 11.571 -3.294 1.00 31.22 C ATOM 0 H ALA A 38 5.999 9.312 -3.083 1.00 73.41 H new ATOM 0 HA ALA A 38 6.801 11.281 -5.028 1.00 45.04 H new ATOM 0 HB1 ALA A 38 8.914 11.881 -3.862 1.00 31.22 H new ATOM 0 HB2 ALA A 38 7.481 12.453 -2.973 1.00 31.22 H new ATOM 0 HB3 ALA A 38 8.352 11.003 -2.419 1.00 31.22 H new ATOM 557 N ALA A 39 8.199 8.519 -3.843 1.00 41.40 N ATOM 558 CA ALA A 39 9.052 7.375 -4.192 1.00 74.41 C ATOM 559 C ALA A 39 8.313 6.322 -5.043 1.00 1.40 C ATOM 560 O ALA A 39 7.892 5.281 -4.544 1.00 55.31 O ATOM 561 CB ALA A 39 9.625 6.740 -2.927 1.00 12.12 C ATOM 0 H ALA A 39 7.831 8.492 -2.892 1.00 41.40 H new ATOM 0 HA ALA A 39 9.868 7.756 -4.805 1.00 74.41 H new ATOM 0 HB1 ALA A 39 10.255 5.893 -3.198 1.00 12.12 H new ATOM 0 HB2 ALA A 39 10.220 7.477 -2.387 1.00 12.12 H new ATOM 0 HB3 ALA A 39 8.809 6.396 -2.291 1.00 12.12 H new ATOM 567 N VAL A 40 8.155 6.616 -6.334 1.00 72.42 N ATOM 568 CA VAL A 40 7.546 5.674 -7.290 1.00 63.24 C ATOM 569 C VAL A 40 8.548 5.285 -8.395 1.00 32.10 C ATOM 570 O VAL A 40 8.212 5.246 -9.579 1.00 44.21 O ATOM 571 CB VAL A 40 6.263 6.282 -7.927 1.00 73.13 C ATOM 572 CG1 VAL A 40 5.164 6.448 -6.878 1.00 13.14 C ATOM 573 CG2 VAL A 40 6.571 7.619 -8.601 1.00 42.44 C ATOM 0 H VAL A 40 8.440 7.503 -6.749 1.00 72.42 H new ATOM 0 HA VAL A 40 7.270 4.775 -6.738 1.00 63.24 H new ATOM 0 HB VAL A 40 5.905 5.591 -8.690 1.00 73.13 H new ATOM 0 HG11 VAL A 40 4.276 6.875 -7.345 1.00 13.14 H new ATOM 0 HG12 VAL A 40 4.918 5.475 -6.452 1.00 13.14 H new ATOM 0 HG13 VAL A 40 5.513 7.113 -6.088 1.00 13.14 H new ATOM 0 HG21 VAL A 40 5.659 8.024 -9.039 1.00 42.44 H new ATOM 0 HG22 VAL A 40 6.960 8.318 -7.861 1.00 42.44 H new ATOM 0 HG23 VAL A 40 7.314 7.469 -9.384 1.00 42.44 H new ATOM 583 N ASP A 41 9.777 4.968 -7.989 1.00 70.42 N ATOM 584 CA ASP A 41 10.875 4.702 -8.930 1.00 44.54 C ATOM 585 C ASP A 41 10.676 3.382 -9.713 1.00 63.14 C ATOM 586 O ASP A 41 10.098 2.417 -9.204 1.00 3.42 O ATOM 587 CB ASP A 41 12.207 4.675 -8.164 1.00 40.10 C ATOM 588 CG ASP A 41 13.413 4.666 -9.086 1.00 45.32 C ATOM 589 OD1 ASP A 41 13.809 3.580 -9.546 1.00 42.35 O ATOM 590 OD2 ASP A 41 13.966 5.749 -9.363 1.00 14.24 O ATOM 0 H ASP A 41 10.043 4.888 -7.008 1.00 70.42 H new ATOM 0 HA ASP A 41 10.885 5.505 -9.667 1.00 44.54 H new ATOM 0 HB2 ASP A 41 12.262 5.544 -7.509 1.00 40.10 H new ATOM 0 HB3 ASP A 41 12.236 3.792 -7.525 1.00 40.10 H new ATOM 595 N LEU A 42 11.190 3.346 -10.948 1.00 50.52 N ATOM 596 CA LEU A 42 11.050 2.177 -11.833 1.00 42.11 C ATOM 597 C LEU A 42 11.645 0.901 -11.209 1.00 33.03 C ATOM 598 O LEU A 42 11.123 -0.200 -11.414 1.00 4.01 O ATOM 599 CB LEU A 42 11.714 2.443 -13.199 1.00 4.51 C ATOM 600 CG LEU A 42 11.021 3.486 -14.102 1.00 73.20 C ATOM 601 CD1 LEU A 42 9.554 3.127 -14.323 1.00 73.33 C ATOM 602 CD2 LEU A 42 11.161 4.896 -13.531 1.00 2.33 C ATOM 0 H LEU A 42 11.711 4.119 -11.362 1.00 50.52 H new ATOM 0 HA LEU A 42 9.981 2.016 -11.974 1.00 42.11 H new ATOM 0 HB2 LEU A 42 12.739 2.769 -13.024 1.00 4.51 H new ATOM 0 HB3 LEU A 42 11.768 1.500 -13.743 1.00 4.51 H new ATOM 0 HG LEU A 42 11.521 3.471 -15.070 1.00 73.20 H new ATOM 0 HD11 LEU A 42 9.088 3.877 -14.962 1.00 73.33 H new ATOM 0 HD12 LEU A 42 9.487 2.150 -14.802 1.00 73.33 H new ATOM 0 HD13 LEU A 42 9.038 3.097 -13.363 1.00 73.33 H new ATOM 0 HD21 LEU A 42 10.662 5.607 -14.190 1.00 2.33 H new ATOM 0 HD22 LEU A 42 10.703 4.935 -12.542 1.00 2.33 H new ATOM 0 HD23 LEU A 42 12.217 5.153 -13.452 1.00 2.33 H new ATOM 614 N GLN A 43 12.737 1.048 -10.457 1.00 1.02 N ATOM 615 CA GLN A 43 13.348 -0.088 -9.759 1.00 4.05 C ATOM 616 C GLN A 43 12.380 -0.672 -8.721 1.00 1.21 C ATOM 617 O GLN A 43 12.274 -1.891 -8.570 1.00 12.30 O ATOM 618 CB GLN A 43 14.652 0.336 -9.072 1.00 33.41 C ATOM 619 CG GLN A 43 15.726 0.834 -10.032 1.00 2.34 C ATOM 620 CD GLN A 43 17.028 1.170 -9.325 1.00 62.35 C ATOM 621 OE1 GLN A 43 17.903 0.323 -9.164 1.00 23.22 O ATOM 622 NE2 GLN A 43 17.165 2.404 -8.888 1.00 34.11 N ATOM 0 H GLN A 43 13.216 1.937 -10.315 1.00 1.02 H new ATOM 0 HA GLN A 43 13.573 -0.855 -10.500 1.00 4.05 H new ATOM 0 HB2 GLN A 43 14.431 1.123 -8.351 1.00 33.41 H new ATOM 0 HB3 GLN A 43 15.046 -0.511 -8.510 1.00 33.41 H new ATOM 0 HG2 GLN A 43 15.913 0.072 -10.789 1.00 2.34 H new ATOM 0 HG3 GLN A 43 15.361 1.719 -10.553 1.00 2.34 H new ATOM 0 HE21 GLN A 43 16.419 3.084 -9.038 1.00 34.11 H new ATOM 0 HE22 GLN A 43 18.017 2.680 -8.400 1.00 34.11 H new ATOM 631 N GLU A 44 11.666 0.211 -8.020 1.00 43.42 N ATOM 632 CA GLU A 44 10.675 -0.210 -7.024 1.00 30.34 C ATOM 633 C GLU A 44 9.457 -0.839 -7.717 1.00 24.42 C ATOM 634 O GLU A 44 8.797 -1.709 -7.165 1.00 35.25 O ATOM 635 CB GLU A 44 10.244 0.983 -6.156 1.00 74.32 C ATOM 636 CG GLU A 44 9.427 0.594 -4.924 1.00 1.10 C ATOM 637 CD GLU A 44 10.190 -0.324 -3.973 1.00 11.53 C ATOM 638 OE1 GLU A 44 11.288 0.067 -3.515 1.00 43.24 O ATOM 639 OE2 GLU A 44 9.701 -1.438 -3.682 1.00 23.30 O ATOM 0 H GLU A 44 11.754 1.222 -8.123 1.00 43.42 H new ATOM 0 HA GLU A 44 11.131 -0.959 -6.376 1.00 30.34 H new ATOM 0 HB2 GLU A 44 11.133 1.524 -5.833 1.00 74.32 H new ATOM 0 HB3 GLU A 44 9.657 1.670 -6.766 1.00 74.32 H new ATOM 0 HG2 GLU A 44 9.131 1.497 -4.390 1.00 1.10 H new ATOM 0 HG3 GLU A 44 8.511 0.098 -5.243 1.00 1.10 H new ATOM 646 N LEU A 45 9.173 -0.389 -8.940 1.00 24.41 N ATOM 647 CA LEU A 45 8.134 -1.009 -9.775 1.00 62.41 C ATOM 648 C LEU A 45 8.495 -2.484 -10.050 1.00 64.31 C ATOM 649 O LEU A 45 7.665 -3.380 -9.904 1.00 42.32 O ATOM 650 CB LEU A 45 7.977 -0.206 -11.088 1.00 14.44 C ATOM 651 CG LEU A 45 6.766 -0.554 -11.984 1.00 13.22 C ATOM 652 CD1 LEU A 45 6.978 -1.870 -12.734 1.00 20.04 C ATOM 653 CD2 LEU A 45 5.481 -0.600 -11.156 1.00 51.22 C ATOM 0 H LEU A 45 9.646 0.402 -9.377 1.00 24.41 H new ATOM 0 HA LEU A 45 7.178 -0.992 -9.252 1.00 62.41 H new ATOM 0 HB2 LEU A 45 7.916 0.852 -10.833 1.00 14.44 H new ATOM 0 HB3 LEU A 45 8.884 -0.340 -11.677 1.00 14.44 H new ATOM 0 HG LEU A 45 6.669 0.234 -12.731 1.00 13.22 H new ATOM 0 HD11 LEU A 45 6.106 -2.081 -13.353 1.00 20.04 H new ATOM 0 HD12 LEU A 45 7.862 -1.790 -13.367 1.00 20.04 H new ATOM 0 HD13 LEU A 45 7.118 -2.679 -12.017 1.00 20.04 H new ATOM 0 HD21 LEU A 45 4.640 -0.846 -11.804 1.00 51.22 H new ATOM 0 HD22 LEU A 45 5.576 -1.359 -10.379 1.00 51.22 H new ATOM 0 HD23 LEU A 45 5.311 0.373 -10.694 1.00 51.22 H new ATOM 665 N ARG A 46 9.749 -2.724 -10.434 1.00 73.40 N ATOM 666 CA ARG A 46 10.276 -4.090 -10.582 1.00 14.03 C ATOM 667 C ARG A 46 10.254 -4.832 -9.232 1.00 10.02 C ATOM 668 O ARG A 46 9.938 -6.023 -9.158 1.00 14.22 O ATOM 669 CB ARG A 46 11.714 -4.026 -11.159 1.00 1.34 C ATOM 670 CG ARG A 46 12.504 -5.346 -11.131 1.00 41.02 C ATOM 671 CD ARG A 46 13.209 -5.575 -9.791 1.00 31.43 C ATOM 672 NE ARG A 46 14.019 -6.791 -9.782 1.00 30.04 N ATOM 673 CZ ARG A 46 14.109 -7.605 -8.763 1.00 4.21 C ATOM 674 NH1 ARG A 46 13.434 -7.386 -7.681 1.00 73.21 N ATOM 675 NH2 ARG A 46 14.885 -8.639 -8.824 1.00 22.01 N ATOM 0 H ARG A 46 10.424 -1.991 -10.650 1.00 73.40 H new ATOM 0 HA ARG A 46 9.643 -4.647 -11.272 1.00 14.03 H new ATOM 0 HB2 ARG A 46 11.656 -3.680 -12.191 1.00 1.34 H new ATOM 0 HB3 ARG A 46 12.276 -3.276 -10.602 1.00 1.34 H new ATOM 0 HG2 ARG A 46 11.826 -6.176 -11.329 1.00 41.02 H new ATOM 0 HG3 ARG A 46 13.244 -5.341 -11.932 1.00 41.02 H new ATOM 0 HD2 ARG A 46 13.845 -4.718 -9.568 1.00 31.43 H new ATOM 0 HD3 ARG A 46 12.464 -5.634 -8.998 1.00 31.43 H new ATOM 0 HE ARG A 46 14.548 -7.019 -10.624 1.00 30.04 H new ATOM 0 HH11 ARG A 46 12.824 -6.571 -7.617 1.00 73.21 H new ATOM 0 HH12 ARG A 46 13.512 -8.028 -6.892 1.00 73.21 H new ATOM 0 HH21 ARG A 46 15.428 -8.820 -9.668 1.00 22.01 H new ATOM 0 HH22 ARG A 46 14.954 -9.273 -8.028 1.00 22.01 H new ATOM 689 N GLU A 47 10.599 -4.108 -8.172 1.00 63.32 N ATOM 690 CA GLU A 47 10.674 -4.664 -6.815 1.00 74.25 C ATOM 691 C GLU A 47 9.273 -4.768 -6.172 1.00 3.52 C ATOM 692 O GLU A 47 9.095 -5.401 -5.127 1.00 22.43 O ATOM 693 CB GLU A 47 11.603 -3.775 -5.967 1.00 50.11 C ATOM 694 CG GLU A 47 11.975 -4.352 -4.603 1.00 55.15 C ATOM 695 CD GLU A 47 12.698 -5.688 -4.695 1.00 62.11 C ATOM 696 OE1 GLU A 47 13.702 -5.778 -5.432 1.00 32.51 O ATOM 697 OE2 GLU A 47 12.273 -6.654 -4.019 1.00 33.00 O ATOM 0 H GLU A 47 10.836 -3.117 -8.224 1.00 63.32 H new ATOM 0 HA GLU A 47 11.078 -5.675 -6.863 1.00 74.25 H new ATOM 0 HB2 GLU A 47 12.518 -3.591 -6.529 1.00 50.11 H new ATOM 0 HB3 GLU A 47 11.121 -2.809 -5.817 1.00 50.11 H new ATOM 0 HG2 GLU A 47 12.608 -3.639 -4.074 1.00 55.15 H new ATOM 0 HG3 GLU A 47 11.070 -4.476 -4.009 1.00 55.15 H new ATOM 704 N LEU A 48 8.280 -4.157 -6.820 1.00 23.53 N ATOM 705 CA LEU A 48 6.893 -4.152 -6.334 1.00 2.03 C ATOM 706 C LEU A 48 6.335 -5.576 -6.195 1.00 11.25 C ATOM 707 O LEU A 48 5.474 -5.834 -5.354 1.00 45.34 O ATOM 708 CB LEU A 48 6.005 -3.335 -7.287 1.00 22.22 C ATOM 709 CG LEU A 48 4.535 -3.181 -6.860 1.00 30.44 C ATOM 710 CD1 LEU A 48 4.431 -2.395 -5.559 1.00 71.04 C ATOM 711 CD2 LEU A 48 3.721 -2.512 -7.966 1.00 33.12 C ATOM 0 H LEU A 48 8.411 -3.651 -7.696 1.00 23.53 H new ATOM 0 HA LEU A 48 6.890 -3.693 -5.345 1.00 2.03 H new ATOM 0 HB2 LEU A 48 6.439 -2.341 -7.396 1.00 22.22 H new ATOM 0 HB3 LEU A 48 6.031 -3.804 -8.271 1.00 22.22 H new ATOM 0 HG LEU A 48 4.122 -4.175 -6.688 1.00 30.44 H new ATOM 0 HD11 LEU A 48 3.383 -2.298 -5.275 1.00 71.04 H new ATOM 0 HD12 LEU A 48 4.973 -2.920 -4.772 1.00 71.04 H new ATOM 0 HD13 LEU A 48 4.863 -1.404 -5.697 1.00 71.04 H new ATOM 0 HD21 LEU A 48 2.684 -2.412 -7.645 1.00 33.12 H new ATOM 0 HD22 LEU A 48 4.133 -1.525 -8.175 1.00 33.12 H new ATOM 0 HD23 LEU A 48 3.764 -3.121 -8.869 1.00 33.12 H new ATOM 723 N VAL A 49 6.841 -6.496 -7.015 1.00 24.23 N ATOM 724 CA VAL A 49 6.403 -7.898 -6.983 1.00 74.13 C ATOM 725 C VAL A 49 6.639 -8.529 -5.594 1.00 41.12 C ATOM 726 O VAL A 49 5.980 -9.499 -5.218 1.00 3.42 O ATOM 727 CB VAL A 49 7.123 -8.734 -8.073 1.00 21.22 C ATOM 728 CG1 VAL A 49 6.568 -10.158 -8.135 1.00 54.23 C ATOM 729 CG2 VAL A 49 7.005 -8.050 -9.435 1.00 55.33 C ATOM 0 H VAL A 49 7.558 -6.298 -7.714 1.00 24.23 H new ATOM 0 HA VAL A 49 5.332 -7.906 -7.188 1.00 74.13 H new ATOM 0 HB VAL A 49 8.178 -8.799 -7.806 1.00 21.22 H new ATOM 0 HG11 VAL A 49 7.092 -10.720 -8.908 1.00 54.23 H new ATOM 0 HG12 VAL A 49 6.711 -10.647 -7.171 1.00 54.23 H new ATOM 0 HG13 VAL A 49 5.504 -10.124 -8.370 1.00 54.23 H new ATOM 0 HG21 VAL A 49 7.516 -8.650 -10.189 1.00 55.33 H new ATOM 0 HG22 VAL A 49 5.953 -7.950 -9.702 1.00 55.33 H new ATOM 0 HG23 VAL A 49 7.462 -7.062 -9.387 1.00 55.33 H new ATOM 739 N GLY A 50 7.585 -7.972 -4.839 1.00 61.44 N ATOM 740 CA GLY A 50 7.781 -8.388 -3.455 1.00 43.12 C ATOM 741 C GLY A 50 6.785 -7.721 -2.506 1.00 4.34 C ATOM 742 O GLY A 50 6.339 -8.322 -1.528 1.00 32.13 O ATOM 0 H GLY A 50 8.220 -7.240 -5.159 1.00 61.44 H new ATOM 0 HA2 GLY A 50 7.678 -9.471 -3.385 1.00 43.12 H new ATOM 0 HA3 GLY A 50 8.797 -8.143 -3.144 1.00 43.12 H new ATOM 746 N ARG A 51 6.440 -6.469 -2.808 1.00 15.02 N ATOM 747 CA ARG A 51 5.476 -5.698 -2.006 1.00 4.31 C ATOM 748 C ARG A 51 4.054 -6.268 -2.143 1.00 63.13 C ATOM 749 O ARG A 51 3.302 -6.329 -1.170 1.00 2.02 O ATOM 750 CB ARG A 51 5.477 -4.218 -2.443 1.00 24.35 C ATOM 751 CG ARG A 51 6.638 -3.366 -1.911 1.00 32.53 C ATOM 752 CD ARG A 51 8.014 -3.931 -2.267 1.00 72.23 C ATOM 753 NE ARG A 51 8.393 -5.038 -1.390 1.00 24.10 N ATOM 754 CZ ARG A 51 9.415 -5.822 -1.588 1.00 22.01 C ATOM 755 NH1 ARG A 51 10.138 -5.702 -2.649 1.00 33.13 N ATOM 756 NH2 ARG A 51 9.687 -6.744 -0.724 1.00 22.21 N ATOM 0 H ARG A 51 6.815 -5.959 -3.608 1.00 15.02 H new ATOM 0 HA ARG A 51 5.782 -5.772 -0.962 1.00 4.31 H new ATOM 0 HB2 ARG A 51 5.493 -4.180 -3.532 1.00 24.35 H new ATOM 0 HB3 ARG A 51 4.540 -3.763 -2.122 1.00 24.35 H new ATOM 0 HG2 ARG A 51 6.552 -2.356 -2.312 1.00 32.53 H new ATOM 0 HG3 ARG A 51 6.555 -3.286 -0.827 1.00 32.53 H new ATOM 0 HD2 ARG A 51 8.009 -4.273 -3.302 1.00 72.23 H new ATOM 0 HD3 ARG A 51 8.761 -3.140 -2.196 1.00 72.23 H new ATOM 0 HE ARG A 51 7.817 -5.208 -0.566 1.00 24.10 H new ATOM 0 HH11 ARG A 51 9.912 -4.989 -3.342 1.00 33.13 H new ATOM 0 HH12 ARG A 51 10.936 -6.320 -2.795 1.00 33.13 H new ATOM 0 HH21 ARG A 51 9.104 -6.854 0.105 1.00 22.21 H new ATOM 0 HH22 ARG A 51 10.485 -7.362 -0.872 1.00 22.21 H new ATOM 770 N CYS A 52 3.704 -6.704 -3.355 1.00 12.33 N ATOM 771 CA CYS A 52 2.337 -7.160 -3.665 1.00 12.13 C ATOM 772 C CYS A 52 1.958 -8.456 -2.929 1.00 10.35 C ATOM 773 O CYS A 52 0.830 -8.932 -3.053 1.00 61.13 O ATOM 774 CB CYS A 52 2.162 -7.349 -5.179 1.00 61.41 C ATOM 775 SG CYS A 52 3.231 -8.612 -5.907 1.00 63.44 S ATOM 0 H CYS A 52 4.348 -6.753 -4.145 1.00 12.33 H new ATOM 0 HA CYS A 52 1.663 -6.380 -3.312 1.00 12.13 H new ATOM 0 HB2 CYS A 52 1.123 -7.610 -5.382 1.00 61.41 H new ATOM 0 HB3 CYS A 52 2.355 -6.398 -5.676 1.00 61.41 H new ATOM 0 HG CYS A 52 4.236 -8.840 -5.114 1.00 63.44 H new ATOM 781 N THR A 53 2.896 -9.028 -2.171 1.00 52.40 N ATOM 782 CA THR A 53 2.591 -10.177 -1.301 1.00 12.22 C ATOM 783 C THR A 53 1.569 -9.790 -0.220 1.00 51.21 C ATOM 784 O THR A 53 0.891 -10.644 0.349 1.00 53.54 O ATOM 785 CB THR A 53 3.860 -10.741 -0.616 1.00 21.33 C ATOM 786 OG1 THR A 53 4.485 -9.729 0.197 1.00 40.21 O ATOM 787 CG2 THR A 53 4.858 -11.255 -1.650 1.00 61.31 C ATOM 0 H THR A 53 3.868 -8.721 -2.138 1.00 52.40 H new ATOM 0 HA THR A 53 2.172 -10.951 -1.944 1.00 12.22 H new ATOM 0 HB THR A 53 3.554 -11.573 0.018 1.00 21.33 H new ATOM 0 HG1 THR A 53 5.126 -9.224 -0.345 1.00 40.21 H new ATOM 0 HG21 THR A 53 5.740 -11.645 -1.142 1.00 61.31 H new ATOM 0 HG22 THR A 53 4.397 -12.049 -2.238 1.00 61.31 H new ATOM 0 HG23 THR A 53 5.151 -10.438 -2.310 1.00 61.31 H new ATOM 795 N GLY A 54 1.487 -8.491 0.060 1.00 62.44 N ATOM 796 CA GLY A 54 0.460 -7.953 0.942 1.00 52.15 C ATOM 797 C GLY A 54 0.162 -6.495 0.608 1.00 70.12 C ATOM 798 O GLY A 54 1.081 -5.715 0.372 1.00 23.11 O ATOM 0 H GLY A 54 2.125 -7.789 -0.315 1.00 62.44 H new ATOM 0 HA2 GLY A 54 -0.451 -8.545 0.849 1.00 52.15 H new ATOM 0 HA3 GLY A 54 0.787 -8.033 1.979 1.00 52.15 H new ATOM 802 N LEU A 55 -1.113 -6.114 0.595 1.00 64.31 N ATOM 803 CA LEU A 55 -1.505 -4.772 0.137 1.00 52.13 C ATOM 804 C LEU A 55 -2.151 -3.938 1.252 1.00 1.53 C ATOM 805 O LEU A 55 -3.210 -4.290 1.769 1.00 55.02 O ATOM 806 CB LEU A 55 -2.472 -4.889 -1.051 1.00 11.13 C ATOM 807 CG LEU A 55 -1.905 -5.592 -2.300 1.00 22.42 C ATOM 808 CD1 LEU A 55 -2.965 -5.699 -3.396 1.00 60.44 C ATOM 809 CD2 LEU A 55 -0.666 -4.862 -2.819 1.00 20.25 C ATOM 0 H LEU A 55 -1.890 -6.705 0.892 1.00 64.31 H new ATOM 0 HA LEU A 55 -0.595 -4.256 -0.170 1.00 52.13 H new ATOM 0 HB2 LEU A 55 -3.360 -5.429 -0.723 1.00 11.13 H new ATOM 0 HB3 LEU A 55 -2.795 -3.887 -1.334 1.00 11.13 H new ATOM 0 HG LEU A 55 -1.612 -6.602 -2.012 1.00 22.42 H new ATOM 0 HD11 LEU A 55 -2.539 -6.199 -4.266 1.00 60.44 H new ATOM 0 HD12 LEU A 55 -3.814 -6.274 -3.026 1.00 60.44 H new ATOM 0 HD13 LEU A 55 -3.299 -4.700 -3.678 1.00 60.44 H new ATOM 0 HD21 LEU A 55 -0.283 -5.376 -3.701 1.00 20.25 H new ATOM 0 HD22 LEU A 55 -0.931 -3.838 -3.083 1.00 20.25 H new ATOM 0 HD23 LEU A 55 0.101 -4.851 -2.044 1.00 20.25 H new ATOM 821 N VAL A 56 -1.500 -2.834 1.619 1.00 43.34 N ATOM 822 CA VAL A 56 -2.070 -1.864 2.561 1.00 44.42 C ATOM 823 C VAL A 56 -2.107 -0.465 1.927 1.00 24.32 C ATOM 824 O VAL A 56 -1.075 0.196 1.786 1.00 74.13 O ATOM 825 CB VAL A 56 -1.277 -1.811 3.892 1.00 4.31 C ATOM 826 CG1 VAL A 56 -1.887 -0.786 4.848 1.00 40.52 C ATOM 827 CG2 VAL A 56 -1.226 -3.193 4.544 1.00 3.43 C ATOM 0 H VAL A 56 -0.572 -2.586 1.277 1.00 43.34 H new ATOM 0 HA VAL A 56 -3.084 -2.193 2.788 1.00 44.42 H new ATOM 0 HB VAL A 56 -0.257 -1.500 3.667 1.00 4.31 H new ATOM 0 HG11 VAL A 56 -1.314 -0.767 5.775 1.00 40.52 H new ATOM 0 HG12 VAL A 56 -1.864 0.201 4.386 1.00 40.52 H new ATOM 0 HG13 VAL A 56 -2.919 -1.061 5.065 1.00 40.52 H new ATOM 0 HG21 VAL A 56 -0.665 -3.135 5.477 1.00 3.43 H new ATOM 0 HG22 VAL A 56 -2.240 -3.535 4.751 1.00 3.43 H new ATOM 0 HG23 VAL A 56 -0.736 -3.896 3.870 1.00 3.43 H new ATOM 837 N ILE A 57 -3.299 -0.024 1.533 1.00 41.30 N ATOM 838 CA ILE A 57 -3.460 1.249 0.821 1.00 62.51 C ATOM 839 C ILE A 57 -3.972 2.352 1.760 1.00 43.11 C ATOM 840 O ILE A 57 -5.057 2.240 2.334 1.00 64.41 O ATOM 841 CB ILE A 57 -4.438 1.119 -0.386 1.00 44.05 C ATOM 842 CG1 ILE A 57 -3.939 0.074 -1.406 1.00 2.43 C ATOM 843 CG2 ILE A 57 -4.633 2.476 -1.071 1.00 11.23 C ATOM 844 CD1 ILE A 57 -4.103 -1.369 -0.965 1.00 53.11 C ATOM 0 H ILE A 57 -4.171 -0.528 1.693 1.00 41.30 H new ATOM 0 HA ILE A 57 -2.472 1.519 0.447 1.00 62.51 H new ATOM 0 HB ILE A 57 -5.398 0.779 0.003 1.00 44.05 H new ATOM 0 HG12 ILE A 57 -4.475 0.216 -2.344 1.00 2.43 H new ATOM 0 HG13 ILE A 57 -2.885 0.260 -1.610 1.00 2.43 H new ATOM 0 HG21 ILE A 57 -5.319 2.364 -1.911 1.00 11.23 H new ATOM 0 HG22 ILE A 57 -5.047 3.188 -0.357 1.00 11.23 H new ATOM 0 HG23 ILE A 57 -3.672 2.842 -1.433 1.00 11.23 H new ATOM 0 HD11 ILE A 57 -3.726 -2.032 -1.743 1.00 53.11 H new ATOM 0 HD12 ILE A 57 -3.543 -1.534 -0.045 1.00 53.11 H new ATOM 0 HD13 ILE A 57 -5.158 -1.578 -0.790 1.00 53.11 H new ATOM 856 N GLY A 58 -3.187 3.417 1.911 1.00 13.11 N ATOM 857 CA GLY A 58 -3.586 4.531 2.767 1.00 54.21 C ATOM 858 C GLY A 58 -4.558 5.503 2.102 1.00 24.41 C ATOM 859 O GLY A 58 -5.142 6.350 2.776 1.00 43.33 O ATOM 0 H GLY A 58 -2.281 3.532 1.457 1.00 13.11 H new ATOM 0 HA2 GLY A 58 -4.046 4.135 3.672 1.00 54.21 H new ATOM 0 HA3 GLY A 58 -2.695 5.077 3.075 1.00 54.21 H new ATOM 863 N MET A 59 -4.730 5.376 0.781 1.00 61.45 N ATOM 864 CA MET A 59 -5.620 6.260 0.003 1.00 32.24 C ATOM 865 C MET A 59 -5.037 7.683 -0.131 1.00 21.23 C ATOM 866 O MET A 59 -4.301 8.157 0.735 1.00 55.01 O ATOM 867 CB MET A 59 -7.025 6.307 0.638 1.00 23.23 C ATOM 868 CG MET A 59 -8.030 7.180 -0.103 1.00 44.31 C ATOM 869 SD MET A 59 -9.626 7.257 0.738 1.00 54.02 S ATOM 870 CE MET A 59 -9.142 7.901 2.339 1.00 33.42 C ATOM 0 H MET A 59 -4.262 4.664 0.220 1.00 61.45 H new ATOM 0 HA MET A 59 -5.702 5.843 -1.001 1.00 32.24 H new ATOM 0 HB2 MET A 59 -7.418 5.292 0.694 1.00 23.23 H new ATOM 0 HB3 MET A 59 -6.934 6.670 1.662 1.00 23.23 H new ATOM 0 HG2 MET A 59 -7.627 8.188 -0.204 1.00 44.31 H new ATOM 0 HG3 MET A 59 -8.172 6.790 -1.111 1.00 44.31 H new ATOM 0 HE1 MET A 59 -9.994 8.396 2.805 1.00 33.42 H new ATOM 0 HE2 MET A 59 -8.807 7.081 2.975 1.00 33.42 H new ATOM 0 HE3 MET A 59 -8.330 8.618 2.213 1.00 33.42 H new ATOM 880 N SER A 60 -5.359 8.357 -1.237 1.00 65.22 N ATOM 881 CA SER A 60 -4.860 9.716 -1.492 1.00 62.31 C ATOM 882 C SER A 60 -5.844 10.513 -2.356 1.00 35.33 C ATOM 883 O SER A 60 -6.433 9.969 -3.288 1.00 75.31 O ATOM 884 CB SER A 60 -3.487 9.668 -2.184 1.00 44.42 C ATOM 885 OG SER A 60 -2.523 9.011 -1.376 1.00 5.24 O ATOM 0 H SER A 60 -5.962 7.987 -1.972 1.00 65.22 H new ATOM 0 HA SER A 60 -4.758 10.216 -0.529 1.00 62.31 H new ATOM 0 HB2 SER A 60 -3.577 9.151 -3.139 1.00 44.42 H new ATOM 0 HB3 SER A 60 -3.152 10.682 -2.401 1.00 44.42 H new ATOM 0 HG SER A 60 -2.294 8.147 -1.777 1.00 5.24 H new ATOM 891 N PRO A 61 -6.034 11.818 -2.061 1.00 64.34 N ATOM 892 CA PRO A 61 -6.970 12.677 -2.820 1.00 64.54 C ATOM 893 C PRO A 61 -6.572 12.840 -4.298 1.00 34.33 C ATOM 894 O PRO A 61 -5.415 12.612 -4.666 1.00 73.45 O ATOM 895 CB PRO A 61 -6.891 14.029 -2.089 1.00 53.01 C ATOM 896 CG PRO A 61 -5.586 14.001 -1.363 1.00 53.44 C ATOM 897 CD PRO A 61 -5.366 12.562 -0.975 1.00 22.42 C ATOM 0 HA PRO A 61 -7.971 12.248 -2.849 1.00 64.54 H new ATOM 0 HB2 PRO A 61 -6.934 14.861 -2.792 1.00 53.01 H new ATOM 0 HB3 PRO A 61 -7.725 14.153 -1.398 1.00 53.01 H new ATOM 0 HG2 PRO A 61 -4.777 14.363 -1.997 1.00 53.44 H new ATOM 0 HG3 PRO A 61 -5.614 14.644 -0.483 1.00 53.44 H new ATOM 0 HD2 PRO A 61 -4.305 12.319 -0.913 1.00 22.42 H new ATOM 0 HD3 PRO A 61 -5.803 12.335 -0.003 1.00 22.42 H new ATOM 905 N ALA A 62 -7.531 13.267 -5.131 1.00 11.33 N ATOM 906 CA ALA A 62 -7.313 13.427 -6.580 1.00 71.34 C ATOM 907 C ALA A 62 -5.986 14.139 -6.902 1.00 50.43 C ATOM 908 O ALA A 62 -5.281 13.766 -7.843 1.00 11.53 O ATOM 909 CB ALA A 62 -8.482 14.184 -7.204 1.00 32.23 C ATOM 0 H ALA A 62 -8.473 13.510 -4.825 1.00 11.33 H new ATOM 0 HA ALA A 62 -7.252 12.427 -7.010 1.00 71.34 H new ATOM 0 HB1 ALA A 62 -8.312 14.297 -8.275 1.00 32.23 H new ATOM 0 HB2 ALA A 62 -9.405 13.628 -7.040 1.00 32.23 H new ATOM 0 HB3 ALA A 62 -8.565 15.168 -6.744 1.00 32.23 H new ATOM 915 N ALA A 63 -5.650 15.153 -6.110 1.00 41.12 N ATOM 916 CA ALA A 63 -4.384 15.879 -6.265 1.00 2.31 C ATOM 917 C ALA A 63 -3.165 14.943 -6.175 1.00 31.22 C ATOM 918 O ALA A 63 -2.315 14.923 -7.066 1.00 54.51 O ATOM 919 CB ALA A 63 -4.279 16.975 -5.216 1.00 12.12 C ATOM 0 H ALA A 63 -6.237 15.495 -5.349 1.00 41.12 H new ATOM 0 HA ALA A 63 -4.382 16.324 -7.260 1.00 2.31 H new ATOM 0 HB1 ALA A 63 -3.336 17.508 -5.340 1.00 12.12 H new ATOM 0 HB2 ALA A 63 -5.108 17.673 -5.334 1.00 12.12 H new ATOM 0 HB3 ALA A 63 -4.317 16.531 -4.221 1.00 12.12 H new ATOM 925 N SER A 64 -3.100 14.156 -5.104 1.00 11.24 N ATOM 926 CA SER A 64 -1.957 13.261 -4.859 1.00 73.33 C ATOM 927 C SER A 64 -2.052 11.971 -5.687 1.00 4.51 C ATOM 928 O SER A 64 -1.054 11.284 -5.899 1.00 3.41 O ATOM 929 CB SER A 64 -1.878 12.909 -3.368 1.00 14.22 C ATOM 930 OG SER A 64 -1.855 14.079 -2.566 1.00 25.34 O ATOM 0 H SER A 64 -3.824 14.115 -4.387 1.00 11.24 H new ATOM 0 HA SER A 64 -1.055 13.790 -5.165 1.00 73.33 H new ATOM 0 HB2 SER A 64 -2.733 12.292 -3.091 1.00 14.22 H new ATOM 0 HB3 SER A 64 -0.983 12.317 -3.178 1.00 14.22 H new ATOM 0 HG SER A 64 -1.806 13.826 -1.620 1.00 25.34 H new ATOM 936 N ALA A 65 -3.255 11.655 -6.161 1.00 31.31 N ATOM 937 CA ALA A 65 -3.492 10.432 -6.942 1.00 2.33 C ATOM 938 C ALA A 65 -2.745 10.436 -8.290 1.00 43.03 C ATOM 939 O ALA A 65 -2.658 9.408 -8.963 1.00 34.42 O ATOM 940 CB ALA A 65 -4.989 10.238 -7.162 1.00 52.23 C ATOM 0 H ALA A 65 -4.087 12.228 -6.020 1.00 31.31 H new ATOM 0 HA ALA A 65 -3.096 9.596 -6.366 1.00 2.33 H new ATOM 0 HB1 ALA A 65 -5.157 9.330 -7.741 1.00 52.23 H new ATOM 0 HB2 ALA A 65 -5.490 10.151 -6.198 1.00 52.23 H new ATOM 0 HB3 ALA A 65 -5.391 11.094 -7.704 1.00 52.23 H new ATOM 946 N ALA A 66 -2.211 11.597 -8.673 1.00 0.41 N ATOM 947 CA ALA A 66 -1.437 11.736 -9.916 1.00 32.05 C ATOM 948 C ALA A 66 -0.285 10.720 -9.993 1.00 52.42 C ATOM 949 O ALA A 66 -0.124 10.020 -10.996 1.00 51.03 O ATOM 950 CB ALA A 66 -0.896 13.159 -10.035 1.00 40.31 C ATOM 0 H ALA A 66 -2.299 12.462 -8.139 1.00 0.41 H new ATOM 0 HA ALA A 66 -2.108 11.530 -10.750 1.00 32.05 H new ATOM 0 HB1 ALA A 66 -0.324 13.255 -10.958 1.00 40.31 H new ATOM 0 HB2 ALA A 66 -1.727 13.864 -10.048 1.00 40.31 H new ATOM 0 HB3 ALA A 66 -0.250 13.375 -9.184 1.00 40.31 H new ATOM 956 N SER A 67 0.507 10.637 -8.927 1.00 32.42 N ATOM 957 CA SER A 67 1.649 9.713 -8.871 1.00 22.04 C ATOM 958 C SER A 67 1.182 8.252 -8.894 1.00 35.33 C ATOM 959 O SER A 67 1.753 7.414 -9.596 1.00 24.21 O ATOM 960 CB SER A 67 2.470 9.966 -7.601 1.00 34.35 C ATOM 961 OG SER A 67 1.667 9.806 -6.442 1.00 2.44 O ATOM 0 H SER A 67 0.382 11.199 -8.085 1.00 32.42 H new ATOM 0 HA SER A 67 2.268 9.893 -9.750 1.00 22.04 H new ATOM 0 HB2 SER A 67 3.312 9.275 -7.563 1.00 34.35 H new ATOM 0 HB3 SER A 67 2.885 10.974 -7.625 1.00 34.35 H new ATOM 0 HG SER A 67 2.209 9.429 -5.718 1.00 2.44 H new ATOM 967 N ILE A 68 0.137 7.960 -8.120 1.00 33.44 N ATOM 968 CA ILE A 68 -0.446 6.613 -8.060 1.00 55.35 C ATOM 969 C ILE A 68 -0.816 6.093 -9.459 1.00 61.43 C ATOM 970 O ILE A 68 -0.350 5.031 -9.880 1.00 11.21 O ATOM 971 CB ILE A 68 -1.709 6.586 -7.160 1.00 22.13 C ATOM 972 CG1 ILE A 68 -1.373 7.100 -5.747 1.00 11.33 C ATOM 973 CG2 ILE A 68 -2.305 5.176 -7.098 1.00 34.21 C ATOM 974 CD1 ILE A 68 -2.564 7.134 -4.808 1.00 11.03 C ATOM 0 H ILE A 68 -0.328 8.641 -7.520 1.00 33.44 H new ATOM 0 HA ILE A 68 0.316 5.963 -7.631 1.00 55.35 H new ATOM 0 HB ILE A 68 -2.456 7.247 -7.598 1.00 22.13 H new ATOM 0 HG12 ILE A 68 -0.599 6.466 -5.314 1.00 11.33 H new ATOM 0 HG13 ILE A 68 -0.955 8.104 -5.826 1.00 11.33 H new ATOM 0 HG21 ILE A 68 -3.190 5.183 -6.461 1.00 34.21 H new ATOM 0 HG22 ILE A 68 -2.583 4.854 -8.102 1.00 34.21 H new ATOM 0 HG23 ILE A 68 -1.567 4.487 -6.687 1.00 34.21 H new ATOM 0 HD11 ILE A 68 -2.248 7.507 -3.833 1.00 11.03 H new ATOM 0 HD12 ILE A 68 -3.331 7.792 -5.217 1.00 11.03 H new ATOM 0 HD13 ILE A 68 -2.969 6.128 -4.698 1.00 11.03 H new ATOM 986 N GLN A 69 -1.642 6.853 -10.180 1.00 32.41 N ATOM 987 CA GLN A 69 -2.057 6.472 -11.537 1.00 34.43 C ATOM 988 C GLN A 69 -0.860 6.346 -12.497 1.00 22.42 C ATOM 989 O GLN A 69 -0.946 5.661 -13.516 1.00 13.13 O ATOM 990 CB GLN A 69 -3.093 7.465 -12.094 1.00 74.30 C ATOM 991 CG GLN A 69 -4.538 7.124 -11.721 1.00 44.12 C ATOM 992 CD GLN A 69 -4.809 7.154 -10.225 1.00 0.42 C ATOM 993 OE1 GLN A 69 -4.630 6.165 -9.525 1.00 74.32 O ATOM 994 NE2 GLN A 69 -5.269 8.283 -9.729 1.00 73.15 N ATOM 0 H GLN A 69 -2.037 7.734 -9.851 1.00 32.41 H new ATOM 0 HA GLN A 69 -2.520 5.488 -11.463 1.00 34.43 H new ATOM 0 HB2 GLN A 69 -2.859 8.464 -11.727 1.00 74.30 H new ATOM 0 HB3 GLN A 69 -3.006 7.496 -13.180 1.00 74.30 H new ATOM 0 HG2 GLN A 69 -5.207 7.828 -12.216 1.00 44.12 H new ATOM 0 HG3 GLN A 69 -4.778 6.132 -12.105 1.00 44.12 H new ATOM 0 HE21 GLN A 69 -5.407 9.089 -10.339 1.00 73.15 H new ATOM 0 HE22 GLN A 69 -5.487 8.352 -8.735 1.00 73.15 H new ATOM 1003 N GLY A 70 0.254 6.993 -12.157 1.00 75.24 N ATOM 1004 CA GLY A 70 1.468 6.872 -12.957 1.00 15.03 C ATOM 1005 C GLY A 70 2.017 5.444 -12.983 1.00 52.42 C ATOM 1006 O GLY A 70 2.326 4.901 -14.046 1.00 1.53 O ATOM 0 H GLY A 70 0.340 7.600 -11.342 1.00 75.24 H new ATOM 0 HA2 GLY A 70 1.260 7.196 -13.977 1.00 15.03 H new ATOM 0 HA3 GLY A 70 2.229 7.543 -12.559 1.00 15.03 H new ATOM 1010 N ALA A 71 2.125 4.830 -11.805 1.00 71.53 N ATOM 1011 CA ALA A 71 2.616 3.448 -11.687 1.00 25.53 C ATOM 1012 C ALA A 71 1.472 2.424 -11.780 1.00 22.23 C ATOM 1013 O ALA A 71 1.700 1.242 -12.062 1.00 32.25 O ATOM 1014 CB ALA A 71 3.376 3.279 -10.377 1.00 12.44 C ATOM 0 H ALA A 71 1.880 5.264 -10.915 1.00 71.53 H new ATOM 0 HA ALA A 71 3.289 3.259 -12.523 1.00 25.53 H new ATOM 0 HB1 ALA A 71 3.737 2.254 -10.295 1.00 12.44 H new ATOM 0 HB2 ALA A 71 4.223 3.965 -10.357 1.00 12.44 H new ATOM 0 HB3 ALA A 71 2.712 3.498 -9.540 1.00 12.44 H new ATOM 1020 N LEU A 72 0.241 2.890 -11.547 1.00 3.50 N ATOM 1021 CA LEU A 72 -0.959 2.034 -11.580 1.00 34.24 C ATOM 1022 C LEU A 72 -1.021 1.182 -12.860 1.00 53.41 C ATOM 1023 O LEU A 72 -1.478 0.035 -12.832 1.00 1.32 O ATOM 1024 CB LEU A 72 -2.218 2.914 -11.439 1.00 14.05 C ATOM 1025 CG LEU A 72 -3.583 2.185 -11.416 1.00 62.44 C ATOM 1026 CD1 LEU A 72 -4.611 2.994 -10.628 1.00 72.11 C ATOM 1027 CD2 LEU A 72 -4.102 1.932 -12.834 1.00 1.12 C ATOM 0 H LEU A 72 0.044 3.867 -11.331 1.00 3.50 H new ATOM 0 HA LEU A 72 -0.909 1.338 -10.743 1.00 34.24 H new ATOM 0 HB2 LEU A 72 -2.127 3.492 -10.519 1.00 14.05 H new ATOM 0 HB3 LEU A 72 -2.228 3.627 -12.264 1.00 14.05 H new ATOM 0 HG LEU A 72 -3.433 1.223 -10.926 1.00 62.44 H new ATOM 0 HD11 LEU A 72 -5.564 2.465 -10.623 1.00 72.11 H new ATOM 0 HD12 LEU A 72 -4.263 3.124 -9.603 1.00 72.11 H new ATOM 0 HD13 LEU A 72 -4.740 3.971 -11.094 1.00 72.11 H new ATOM 0 HD21 LEU A 72 -5.062 1.419 -12.784 1.00 1.12 H new ATOM 0 HD22 LEU A 72 -4.226 2.883 -13.351 1.00 1.12 H new ATOM 0 HD23 LEU A 72 -3.388 1.314 -13.378 1.00 1.12 H new ATOM 1039 N SER A 73 -0.543 1.751 -13.967 1.00 70.42 N ATOM 1040 CA SER A 73 -0.528 1.069 -15.272 1.00 73.15 C ATOM 1041 C SER A 73 0.032 -0.363 -15.175 1.00 15.15 C ATOM 1042 O SER A 73 -0.451 -1.274 -15.848 1.00 21.41 O ATOM 1043 CB SER A 73 0.301 1.880 -16.284 1.00 3.21 C ATOM 1044 OG SER A 73 -0.234 3.185 -16.471 1.00 34.45 O ATOM 0 H SER A 73 -0.155 2.694 -13.990 1.00 70.42 H new ATOM 0 HA SER A 73 -1.562 0.999 -15.610 1.00 73.15 H new ATOM 0 HB2 SER A 73 1.331 1.955 -15.935 1.00 3.21 H new ATOM 0 HB3 SER A 73 0.325 1.355 -17.239 1.00 3.21 H new ATOM 0 HG SER A 73 0.316 3.674 -17.118 1.00 34.45 H new ATOM 1050 N THR A 74 1.047 -0.557 -14.333 1.00 3.02 N ATOM 1051 CA THR A 74 1.650 -1.887 -14.139 1.00 42.12 C ATOM 1052 C THR A 74 1.121 -2.573 -12.868 1.00 15.11 C ATOM 1053 O THR A 74 0.928 -3.790 -12.848 1.00 25.40 O ATOM 1054 CB THR A 74 3.197 -1.810 -14.054 1.00 22.13 C ATOM 1055 OG1 THR A 74 3.729 -1.143 -15.210 1.00 61.54 O ATOM 1056 CG2 THR A 74 3.814 -3.206 -13.950 1.00 3.41 C ATOM 0 H THR A 74 1.472 0.183 -13.774 1.00 3.02 H new ATOM 0 HA THR A 74 1.366 -2.476 -15.011 1.00 42.12 H new ATOM 0 HB THR A 74 3.451 -1.245 -13.157 1.00 22.13 H new ATOM 0 HG1 THR A 74 4.706 -1.100 -15.142 1.00 61.54 H new ATOM 0 HG21 THR A 74 4.899 -3.121 -13.892 1.00 3.41 H new ATOM 0 HG22 THR A 74 3.441 -3.703 -13.055 1.00 3.41 H new ATOM 0 HG23 THR A 74 3.542 -3.790 -14.829 1.00 3.41 H new ATOM 1064 N ILE A 75 0.871 -1.781 -11.817 1.00 5.15 N ATOM 1065 CA ILE A 75 0.445 -2.311 -10.506 1.00 41.41 C ATOM 1066 C ILE A 75 -0.699 -3.335 -10.628 1.00 11.33 C ATOM 1067 O ILE A 75 -0.664 -4.393 -9.996 1.00 25.15 O ATOM 1068 CB ILE A 75 0.008 -1.167 -9.550 1.00 24.33 C ATOM 1069 CG1 ILE A 75 1.189 -0.220 -9.268 1.00 64.42 C ATOM 1070 CG2 ILE A 75 -0.551 -1.732 -8.243 1.00 32.22 C ATOM 1071 CD1 ILE A 75 0.847 0.939 -8.350 1.00 33.44 C ATOM 0 H ILE A 75 0.956 -0.765 -11.845 1.00 5.15 H new ATOM 0 HA ILE A 75 1.315 -2.820 -10.090 1.00 41.41 H new ATOM 0 HB ILE A 75 -0.783 -0.599 -10.039 1.00 24.33 H new ATOM 0 HG12 ILE A 75 2.003 -0.793 -8.824 1.00 64.42 H new ATOM 0 HG13 ILE A 75 1.557 0.176 -10.214 1.00 64.42 H new ATOM 0 HG21 ILE A 75 -0.850 -0.912 -7.590 1.00 32.22 H new ATOM 0 HG22 ILE A 75 -1.417 -2.358 -8.458 1.00 32.22 H new ATOM 0 HG23 ILE A 75 0.215 -2.329 -7.748 1.00 32.22 H new ATOM 0 HD11 ILE A 75 1.731 1.559 -8.201 1.00 33.44 H new ATOM 0 HD12 ILE A 75 0.056 1.538 -8.800 1.00 33.44 H new ATOM 0 HD13 ILE A 75 0.508 0.554 -7.388 1.00 33.44 H new ATOM 1083 N LEU A 76 -1.700 -3.023 -11.454 1.00 22.43 N ATOM 1084 CA LEU A 76 -2.850 -3.919 -11.657 1.00 21.21 C ATOM 1085 C LEU A 76 -2.410 -5.332 -12.086 1.00 43.30 C ATOM 1086 O LEU A 76 -3.016 -6.331 -11.694 1.00 15.43 O ATOM 1087 CB LEU A 76 -3.804 -3.334 -12.709 1.00 51.35 C ATOM 1088 CG LEU A 76 -4.422 -1.971 -12.357 1.00 24.11 C ATOM 1089 CD1 LEU A 76 -5.341 -1.493 -13.480 1.00 71.24 C ATOM 1090 CD2 LEU A 76 -5.180 -2.044 -11.031 1.00 13.13 C ATOM 0 H LEU A 76 -1.741 -2.159 -11.994 1.00 22.43 H new ATOM 0 HA LEU A 76 -3.366 -4.003 -10.701 1.00 21.21 H new ATOM 0 HB2 LEU A 76 -3.263 -3.236 -13.650 1.00 51.35 H new ATOM 0 HB3 LEU A 76 -4.611 -4.047 -12.878 1.00 51.35 H new ATOM 0 HG LEU A 76 -3.614 -1.248 -12.244 1.00 24.11 H new ATOM 0 HD11 LEU A 76 -5.769 -0.527 -13.213 1.00 71.24 H new ATOM 0 HD12 LEU A 76 -4.768 -1.394 -14.402 1.00 71.24 H new ATOM 0 HD13 LEU A 76 -6.142 -2.217 -13.627 1.00 71.24 H new ATOM 0 HD21 LEU A 76 -5.609 -1.068 -10.803 1.00 13.13 H new ATOM 0 HD22 LEU A 76 -5.979 -2.782 -11.109 1.00 13.13 H new ATOM 0 HD23 LEU A 76 -4.494 -2.334 -10.235 1.00 13.13 H new ATOM 1102 N GLY A 77 -1.346 -5.405 -12.885 1.00 41.44 N ATOM 1103 CA GLY A 77 -0.826 -6.693 -13.333 1.00 65.42 C ATOM 1104 C GLY A 77 0.138 -7.330 -12.335 1.00 41.11 C ATOM 1105 O GLY A 77 0.251 -8.559 -12.263 1.00 20.11 O ATOM 0 H GLY A 77 -0.832 -4.595 -13.232 1.00 41.44 H new ATOM 0 HA2 GLY A 77 -1.659 -7.373 -13.509 1.00 65.42 H new ATOM 0 HA3 GLY A 77 -0.316 -6.560 -14.287 1.00 65.42 H new ATOM 1109 N SER A 78 0.839 -6.492 -11.570 1.00 34.51 N ATOM 1110 CA SER A 78 1.797 -6.965 -10.558 1.00 54.13 C ATOM 1111 C SER A 78 1.093 -7.640 -9.368 1.00 72.22 C ATOM 1112 O SER A 78 1.653 -8.527 -8.723 1.00 52.33 O ATOM 1113 CB SER A 78 2.649 -5.795 -10.042 1.00 71.42 C ATOM 1114 OG SER A 78 3.328 -5.140 -11.103 1.00 12.41 O ATOM 0 H SER A 78 0.764 -5.477 -11.629 1.00 34.51 H new ATOM 0 HA SER A 78 2.434 -7.705 -11.042 1.00 54.13 H new ATOM 0 HB2 SER A 78 2.011 -5.081 -9.521 1.00 71.42 H new ATOM 0 HB3 SER A 78 3.374 -6.164 -9.317 1.00 71.42 H new ATOM 0 HG SER A 78 3.860 -4.400 -10.743 1.00 12.41 H new ATOM 1120 N VAL A 79 -0.130 -7.199 -9.073 1.00 34.03 N ATOM 1121 CA VAL A 79 -0.905 -7.742 -7.948 1.00 25.12 C ATOM 1122 C VAL A 79 -1.799 -8.924 -8.371 1.00 51.21 C ATOM 1123 O VAL A 79 -2.030 -9.153 -9.561 1.00 1.45 O ATOM 1124 CB VAL A 79 -1.785 -6.643 -7.298 1.00 32.44 C ATOM 1125 CG1 VAL A 79 -0.922 -5.489 -6.786 1.00 1.02 C ATOM 1126 CG2 VAL A 79 -2.844 -6.138 -8.282 1.00 34.14 C ATOM 0 H VAL A 79 -0.609 -6.466 -9.596 1.00 34.03 H new ATOM 0 HA VAL A 79 -0.179 -8.106 -7.221 1.00 25.12 H new ATOM 0 HB VAL A 79 -2.301 -7.084 -6.445 1.00 32.44 H new ATOM 0 HG11 VAL A 79 -1.560 -4.730 -6.334 1.00 1.02 H new ATOM 0 HG12 VAL A 79 -0.220 -5.863 -6.041 1.00 1.02 H new ATOM 0 HG13 VAL A 79 -0.370 -5.051 -7.617 1.00 1.02 H new ATOM 0 HG21 VAL A 79 -3.448 -5.368 -7.803 1.00 34.14 H new ATOM 0 HG22 VAL A 79 -2.354 -5.720 -9.161 1.00 34.14 H new ATOM 0 HG23 VAL A 79 -3.485 -6.967 -8.584 1.00 34.14 H new ATOM 1136 N ASN A 80 -2.292 -9.674 -7.383 1.00 50.24 N ATOM 1137 CA ASN A 80 -3.210 -10.795 -7.627 1.00 10.44 C ATOM 1138 C ASN A 80 -4.670 -10.332 -7.474 1.00 70.34 C ATOM 1139 O ASN A 80 -4.967 -9.449 -6.669 1.00 23.11 O ATOM 1140 CB ASN A 80 -2.896 -11.945 -6.650 1.00 60.22 C ATOM 1141 CG ASN A 80 -3.567 -13.263 -7.025 1.00 5.01 C ATOM 1142 OD1 ASN A 80 -4.660 -13.298 -7.580 1.00 41.14 O ATOM 1143 ND2 ASN A 80 -2.912 -14.365 -6.721 1.00 55.54 N ATOM 0 H ASN A 80 -2.070 -9.526 -6.399 1.00 50.24 H new ATOM 0 HA ASN A 80 -3.074 -11.155 -8.647 1.00 10.44 H new ATOM 0 HB2 ASN A 80 -1.817 -12.094 -6.612 1.00 60.22 H new ATOM 0 HB3 ASN A 80 -3.214 -11.657 -5.648 1.00 60.22 H new ATOM 0 HD21 ASN A 80 -3.313 -15.275 -6.947 1.00 55.54 H new ATOM 0 HD22 ASN A 80 -2.004 -14.308 -6.259 1.00 55.54 H new ATOM 1150 N GLU A 81 -5.570 -10.945 -8.240 1.00 51.13 N ATOM 1151 CA GLU A 81 -6.975 -10.520 -8.300 1.00 2.33 C ATOM 1152 C GLU A 81 -7.705 -10.664 -6.948 1.00 61.43 C ATOM 1153 O GLU A 81 -8.187 -9.683 -6.381 1.00 74.21 O ATOM 1154 CB GLU A 81 -7.716 -11.333 -9.368 1.00 51.05 C ATOM 1155 CG GLU A 81 -9.176 -10.933 -9.544 1.00 33.01 C ATOM 1156 CD GLU A 81 -9.897 -11.788 -10.568 1.00 23.50 C ATOM 1157 OE1 GLU A 81 -9.650 -11.603 -11.777 1.00 41.52 O ATOM 1158 OE2 GLU A 81 -10.713 -12.649 -10.168 1.00 63.33 O ATOM 0 H GLU A 81 -5.353 -11.745 -8.834 1.00 51.13 H new ATOM 0 HA GLU A 81 -6.975 -9.460 -8.556 1.00 2.33 H new ATOM 0 HB2 GLU A 81 -7.200 -11.218 -10.321 1.00 51.05 H new ATOM 0 HB3 GLU A 81 -7.668 -12.390 -9.105 1.00 51.05 H new ATOM 0 HG2 GLU A 81 -9.688 -11.012 -8.585 1.00 33.01 H new ATOM 0 HG3 GLU A 81 -9.228 -9.888 -9.848 1.00 33.01 H new ATOM 1165 N LYS A 82 -7.809 -11.895 -6.447 1.00 41.11 N ATOM 1166 CA LYS A 82 -8.555 -12.161 -5.210 1.00 33.12 C ATOM 1167 C LYS A 82 -7.619 -12.311 -4.000 1.00 50.24 C ATOM 1168 O LYS A 82 -6.826 -13.252 -3.915 1.00 51.15 O ATOM 1169 CB LYS A 82 -9.435 -13.409 -5.379 1.00 4.30 C ATOM 1170 CG LYS A 82 -10.340 -13.339 -6.608 1.00 75.44 C ATOM 1171 CD LYS A 82 -11.393 -14.444 -6.619 1.00 41.54 C ATOM 1172 CE LYS A 82 -12.221 -14.426 -7.901 1.00 45.51 C ATOM 1173 NZ LYS A 82 -12.773 -13.076 -8.197 1.00 5.12 N ATOM 0 H LYS A 82 -7.390 -12.721 -6.873 1.00 41.11 H new ATOM 0 HA LYS A 82 -9.197 -11.302 -5.015 1.00 33.12 H new ATOM 0 HB2 LYS A 82 -8.797 -14.289 -5.454 1.00 4.30 H new ATOM 0 HB3 LYS A 82 -10.050 -13.536 -4.488 1.00 4.30 H new ATOM 0 HG2 LYS A 82 -10.835 -12.369 -6.636 1.00 75.44 H new ATOM 0 HG3 LYS A 82 -9.731 -13.412 -7.509 1.00 75.44 H new ATOM 0 HD2 LYS A 82 -10.904 -15.413 -6.516 1.00 41.54 H new ATOM 0 HD3 LYS A 82 -12.052 -14.326 -5.759 1.00 41.54 H new ATOM 0 HE2 LYS A 82 -11.602 -14.754 -8.736 1.00 45.51 H new ATOM 0 HE3 LYS A 82 -13.040 -15.140 -7.812 1.00 45.51 H new ATOM 0 HZ1 LYS A 82 -13.299 -13.105 -9.094 1.00 5.12 H new ATOM 0 HZ2 LYS A 82 -13.412 -12.786 -7.430 1.00 5.12 H new ATOM 0 HZ3 LYS A 82 -11.994 -12.392 -8.275 1.00 5.12 H new ATOM 1187 N GLN A 83 -7.728 -11.372 -3.060 1.00 73.02 N ATOM 1188 CA GLN A 83 -6.879 -11.361 -1.865 1.00 10.13 C ATOM 1189 C GLN A 83 -7.482 -10.433 -0.789 1.00 32.13 C ATOM 1190 O GLN A 83 -8.595 -9.927 -0.948 1.00 72.20 O ATOM 1191 CB GLN A 83 -5.452 -10.905 -2.249 1.00 23.55 C ATOM 1192 CG GLN A 83 -4.351 -11.347 -1.282 1.00 13.25 C ATOM 1193 CD GLN A 83 -3.916 -12.806 -1.452 1.00 4.33 C ATOM 1194 OE1 GLN A 83 -2.776 -13.154 -1.174 1.00 41.51 O ATOM 1195 NE2 GLN A 83 -4.798 -13.669 -1.924 1.00 62.33 N ATOM 0 H GLN A 83 -8.399 -10.605 -3.102 1.00 73.02 H new ATOM 0 HA GLN A 83 -6.826 -12.367 -1.450 1.00 10.13 H new ATOM 0 HB2 GLN A 83 -5.219 -11.289 -3.242 1.00 23.55 H new ATOM 0 HB3 GLN A 83 -5.440 -9.817 -2.317 1.00 23.55 H new ATOM 0 HG2 GLN A 83 -3.483 -10.702 -1.418 1.00 13.25 H new ATOM 0 HG3 GLN A 83 -4.700 -11.200 -0.260 1.00 13.25 H new ATOM 0 HE21 GLN A 83 -5.743 -13.360 -2.150 1.00 62.33 H new ATOM 0 HE22 GLN A 83 -4.534 -14.644 -2.062 1.00 62.33 H new ATOM 1204 N ALA A 84 -6.766 -10.231 0.314 1.00 32.33 N ATOM 1205 CA ALA A 84 -7.214 -9.324 1.377 1.00 75.45 C ATOM 1206 C ALA A 84 -6.336 -8.064 1.444 1.00 74.10 C ATOM 1207 O ALA A 84 -5.108 -8.152 1.432 1.00 44.41 O ATOM 1208 CB ALA A 84 -7.208 -10.051 2.719 1.00 20.20 C ATOM 0 H ALA A 84 -5.870 -10.683 0.499 1.00 32.33 H new ATOM 0 HA ALA A 84 -8.231 -9.007 1.148 1.00 75.45 H new ATOM 0 HB1 ALA A 84 -7.542 -9.371 3.503 1.00 20.20 H new ATOM 0 HB2 ALA A 84 -7.880 -10.908 2.672 1.00 20.20 H new ATOM 0 HB3 ALA A 84 -6.198 -10.394 2.942 1.00 20.20 H new ATOM 1214 N VAL A 85 -6.970 -6.891 1.515 1.00 61.44 N ATOM 1215 CA VAL A 85 -6.238 -5.617 1.537 1.00 72.31 C ATOM 1216 C VAL A 85 -6.509 -4.805 2.819 1.00 60.31 C ATOM 1217 O VAL A 85 -7.652 -4.665 3.262 1.00 52.32 O ATOM 1218 CB VAL A 85 -6.575 -4.743 0.297 1.00 33.31 C ATOM 1219 CG1 VAL A 85 -6.132 -5.440 -0.986 1.00 53.32 C ATOM 1220 CG2 VAL A 85 -8.068 -4.405 0.242 1.00 25.11 C ATOM 0 H VAL A 85 -7.984 -6.794 1.558 1.00 61.44 H new ATOM 0 HA VAL A 85 -5.181 -5.881 1.515 1.00 72.31 H new ATOM 0 HB VAL A 85 -6.026 -3.806 0.390 1.00 33.31 H new ATOM 0 HG11 VAL A 85 -6.376 -4.813 -1.844 1.00 53.32 H new ATOM 0 HG12 VAL A 85 -5.056 -5.609 -0.955 1.00 53.32 H new ATOM 0 HG13 VAL A 85 -6.647 -6.396 -1.077 1.00 53.32 H new ATOM 0 HG21 VAL A 85 -8.270 -3.793 -0.637 1.00 25.11 H new ATOM 0 HG22 VAL A 85 -8.648 -5.326 0.184 1.00 25.11 H new ATOM 0 HG23 VAL A 85 -8.350 -3.855 1.140 1.00 25.11 H new ATOM 1230 N GLY A 86 -5.438 -4.277 3.409 1.00 73.22 N ATOM 1231 CA GLY A 86 -5.559 -3.416 4.581 1.00 71.53 C ATOM 1232 C GLY A 86 -5.804 -1.957 4.206 1.00 43.34 C ATOM 1233 O GLY A 86 -5.062 -1.380 3.410 1.00 40.13 O ATOM 0 H GLY A 86 -4.480 -4.431 3.095 1.00 73.22 H new ATOM 0 HA2 GLY A 86 -6.378 -3.770 5.206 1.00 71.53 H new ATOM 0 HA3 GLY A 86 -4.649 -3.488 5.177 1.00 71.53 H new ATOM 1237 N ILE A 87 -6.845 -1.360 4.780 1.00 74.43 N ATOM 1238 CA ILE A 87 -7.229 0.022 4.461 1.00 74.51 C ATOM 1239 C ILE A 87 -7.396 0.854 5.741 1.00 14.35 C ATOM 1240 O ILE A 87 -7.817 0.334 6.773 1.00 52.23 O ATOM 1241 CB ILE A 87 -8.565 0.056 3.661 1.00 2.24 C ATOM 1242 CG1 ILE A 87 -8.466 -0.793 2.379 1.00 63.22 C ATOM 1243 CG2 ILE A 87 -8.964 1.491 3.318 1.00 54.21 C ATOM 1244 CD1 ILE A 87 -7.438 -0.294 1.381 1.00 20.21 C ATOM 0 H ILE A 87 -7.444 -1.810 5.472 1.00 74.43 H new ATOM 0 HA ILE A 87 -6.431 0.449 3.853 1.00 74.51 H new ATOM 0 HB ILE A 87 -9.339 -0.373 4.297 1.00 2.24 H new ATOM 0 HG12 ILE A 87 -8.221 -1.819 2.654 1.00 63.22 H new ATOM 0 HG13 ILE A 87 -9.443 -0.817 1.896 1.00 63.22 H new ATOM 0 HG21 ILE A 87 -9.900 1.485 2.760 1.00 54.21 H new ATOM 0 HG22 ILE A 87 -9.094 2.062 4.237 1.00 54.21 H new ATOM 0 HG23 ILE A 87 -8.183 1.951 2.712 1.00 54.21 H new ATOM 0 HD11 ILE A 87 -7.432 -0.947 0.508 1.00 20.21 H new ATOM 0 HD12 ILE A 87 -7.692 0.721 1.074 1.00 20.21 H new ATOM 0 HD13 ILE A 87 -6.451 -0.297 1.843 1.00 20.21 H new ATOM 1256 N PHE A 88 -7.053 2.139 5.676 1.00 74.22 N ATOM 1257 CA PHE A 88 -7.287 3.061 6.795 1.00 75.23 C ATOM 1258 C PHE A 88 -7.600 4.477 6.283 1.00 30.13 C ATOM 1259 O PHE A 88 -6.942 4.982 5.375 1.00 15.32 O ATOM 1260 CB PHE A 88 -6.087 3.079 7.762 1.00 12.13 C ATOM 1261 CG PHE A 88 -4.786 3.555 7.154 1.00 5.11 C ATOM 1262 CD1 PHE A 88 -3.995 2.695 6.407 1.00 42.53 C ATOM 1263 CD2 PHE A 88 -4.348 4.860 7.350 1.00 64.13 C ATOM 1264 CE1 PHE A 88 -2.799 3.125 5.866 1.00 2.23 C ATOM 1265 CE2 PHE A 88 -3.152 5.294 6.808 1.00 4.41 C ATOM 1266 CZ PHE A 88 -2.376 4.424 6.067 1.00 62.23 C ATOM 0 H PHE A 88 -6.612 2.569 4.863 1.00 74.22 H new ATOM 0 HA PHE A 88 -8.155 2.701 7.347 1.00 75.23 H new ATOM 0 HB2 PHE A 88 -6.331 3.720 8.609 1.00 12.13 H new ATOM 0 HB3 PHE A 88 -5.941 2.073 8.155 1.00 12.13 H new ATOM 0 HD1 PHE A 88 -4.318 1.677 6.246 1.00 42.53 H new ATOM 0 HD2 PHE A 88 -4.949 5.543 7.932 1.00 64.13 H new ATOM 0 HE1 PHE A 88 -2.194 2.444 5.285 1.00 2.23 H new ATOM 0 HE2 PHE A 88 -2.825 6.312 6.964 1.00 4.41 H new ATOM 0 HZ PHE A 88 -1.440 4.759 5.646 1.00 62.23 H new ATOM 1276 N GLU A 89 -8.616 5.106 6.868 1.00 62.52 N ATOM 1277 CA GLU A 89 -9.075 6.430 6.426 1.00 44.41 C ATOM 1278 C GLU A 89 -8.173 7.568 6.943 1.00 71.23 C ATOM 1279 O GLU A 89 -8.287 8.005 8.088 1.00 64.40 O ATOM 1280 CB GLU A 89 -10.535 6.647 6.869 1.00 64.12 C ATOM 1281 CG GLU A 89 -10.779 6.400 8.359 1.00 13.43 C ATOM 1282 CD GLU A 89 -12.228 6.607 8.787 1.00 14.22 C ATOM 1283 OE1 GLU A 89 -13.041 7.096 7.972 1.00 61.41 O ATOM 1284 OE2 GLU A 89 -12.553 6.297 9.955 1.00 23.32 O ATOM 0 H GLU A 89 -9.142 4.722 7.653 1.00 62.52 H new ATOM 0 HA GLU A 89 -9.016 6.456 5.338 1.00 44.41 H new ATOM 0 HB2 GLU A 89 -10.828 7.669 6.628 1.00 64.12 H new ATOM 0 HB3 GLU A 89 -11.181 5.986 6.292 1.00 64.12 H new ATOM 0 HG2 GLU A 89 -10.480 5.381 8.603 1.00 13.43 H new ATOM 0 HG3 GLU A 89 -10.140 7.067 8.938 1.00 13.43 H new ATOM 1291 N THR A 90 -7.258 8.032 6.091 1.00 41.01 N ATOM 1292 CA THR A 90 -6.397 9.179 6.421 1.00 64.34 C ATOM 1293 C THR A 90 -6.661 10.374 5.494 1.00 2.40 C ATOM 1294 O THR A 90 -6.511 10.280 4.274 1.00 41.12 O ATOM 1295 CB THR A 90 -4.887 8.815 6.365 1.00 72.14 C ATOM 1296 OG1 THR A 90 -4.088 9.983 6.628 1.00 22.41 O ATOM 1297 CG2 THR A 90 -4.492 8.219 5.017 1.00 71.32 C ATOM 0 H THR A 90 -7.091 7.635 5.167 1.00 41.01 H new ATOM 0 HA THR A 90 -6.651 9.457 7.444 1.00 64.34 H new ATOM 0 HB THR A 90 -4.706 8.061 7.131 1.00 72.14 H new ATOM 0 HG1 THR A 90 -3.339 10.016 5.996 1.00 22.41 H new ATOM 0 HG21 THR A 90 -3.429 7.980 5.023 1.00 71.32 H new ATOM 0 HG22 THR A 90 -5.068 7.311 4.838 1.00 71.32 H new ATOM 0 HG23 THR A 90 -4.697 8.940 4.226 1.00 71.32 H new ATOM 1305 N GLY A 91 -7.078 11.495 6.081 1.00 15.55 N ATOM 1306 CA GLY A 91 -7.285 12.721 5.316 1.00 14.13 C ATOM 1307 C GLY A 91 -8.489 12.674 4.374 1.00 4.42 C ATOM 1308 O GLY A 91 -9.532 13.269 4.657 1.00 61.04 O ATOM 0 H GLY A 91 -7.278 11.578 7.078 1.00 15.55 H new ATOM 0 HA2 GLY A 91 -7.412 13.552 6.010 1.00 14.13 H new ATOM 0 HA3 GLY A 91 -6.388 12.928 4.732 1.00 14.13 H new ATOM 1312 N GLY A 92 -8.350 11.966 3.256 1.00 3.14 N ATOM 1313 CA GLY A 92 -9.400 11.943 2.244 1.00 41.33 C ATOM 1314 C GLY A 92 -9.432 13.225 1.414 1.00 21.21 C ATOM 1315 O GLY A 92 -9.026 13.231 0.251 1.00 1.45 O ATOM 0 H GLY A 92 -7.528 11.406 3.030 1.00 3.14 H new ATOM 0 HA2 GLY A 92 -9.247 11.089 1.584 1.00 41.33 H new ATOM 0 HA3 GLY A 92 -10.366 11.802 2.729 1.00 41.33 H new ATOM 1319 N GLY A 93 -9.904 14.314 2.020 1.00 10.43 N ATOM 1320 CA GLY A 93 -9.921 15.608 1.345 1.00 73.23 C ATOM 1321 C GLY A 93 -10.949 15.699 0.219 1.00 32.21 C ATOM 1322 O GLY A 93 -12.071 16.170 0.431 1.00 34.02 O ATOM 0 H GLY A 93 -10.277 14.325 2.969 1.00 10.43 H new ATOM 0 HA2 GLY A 93 -10.128 16.388 2.078 1.00 73.23 H new ATOM 0 HA3 GLY A 93 -8.930 15.809 0.938 1.00 73.23 H new ATOM 1326 N ASP A 94 -10.568 15.236 -0.975 1.00 71.13 N ATOM 1327 CA ASP A 94 -11.419 15.345 -2.168 1.00 75.10 C ATOM 1328 C ASP A 94 -10.918 14.443 -3.314 1.00 60.24 C ATOM 1329 O ASP A 94 -9.740 14.493 -3.690 1.00 10.32 O ATOM 1330 CB ASP A 94 -11.464 16.804 -2.644 1.00 1.45 C ATOM 1331 CG ASP A 94 -12.265 16.977 -3.926 1.00 42.11 C ATOM 1332 OD1 ASP A 94 -13.510 17.043 -3.854 1.00 62.25 O ATOM 1333 OD2 ASP A 94 -11.652 17.048 -5.012 1.00 63.42 O ATOM 0 H ASP A 94 -9.672 14.780 -1.143 1.00 71.13 H new ATOM 0 HA ASP A 94 -12.419 15.012 -1.892 1.00 75.10 H new ATOM 0 HB2 ASP A 94 -11.900 17.424 -1.861 1.00 1.45 H new ATOM 0 HB3 ASP A 94 -10.447 17.161 -2.804 1.00 1.45 H new ATOM 1338 N ASP A 95 -11.822 13.631 -3.867 1.00 64.32 N ATOM 1339 CA ASP A 95 -11.513 12.787 -5.029 1.00 60.41 C ATOM 1340 C ASP A 95 -12.769 12.548 -5.888 1.00 33.43 C ATOM 1341 O ASP A 95 -13.899 12.674 -5.402 1.00 23.12 O ATOM 1342 CB ASP A 95 -10.908 11.449 -4.578 1.00 1.30 C ATOM 1343 CG ASP A 95 -10.551 10.559 -5.758 1.00 41.32 C ATOM 1344 OD1 ASP A 95 -9.694 10.970 -6.573 1.00 31.32 O ATOM 1345 OD2 ASP A 95 -11.139 9.466 -5.892 1.00 54.11 O ATOM 0 H ASP A 95 -12.780 13.538 -3.528 1.00 64.32 H new ATOM 0 HA ASP A 95 -10.779 13.312 -5.641 1.00 60.41 H new ATOM 0 HB2 ASP A 95 -10.015 11.637 -3.983 1.00 1.30 H new ATOM 0 HB3 ASP A 95 -11.617 10.929 -3.933 1.00 1.30 H new ATOM 1350 N GLU A 96 -12.570 12.204 -7.164 1.00 1.31 N ATOM 1351 CA GLU A 96 -13.686 12.004 -8.101 1.00 21.11 C ATOM 1352 C GLU A 96 -14.014 10.509 -8.329 1.00 40.04 C ATOM 1353 O GLU A 96 -15.138 10.078 -8.052 1.00 70.01 O ATOM 1354 CB GLU A 96 -13.399 12.693 -9.448 1.00 73.32 C ATOM 1355 CG GLU A 96 -13.235 14.206 -9.360 1.00 14.55 C ATOM 1356 CD GLU A 96 -12.988 14.832 -10.722 1.00 60.10 C ATOM 1357 OE1 GLU A 96 -13.932 14.850 -11.545 1.00 34.42 O ATOM 1358 OE2 GLU A 96 -11.851 15.274 -10.990 1.00 25.22 O ATOM 0 H GLU A 96 -11.648 12.058 -7.574 1.00 1.31 H new ATOM 0 HA GLU A 96 -14.562 12.461 -7.641 1.00 21.11 H new ATOM 0 HB2 GLU A 96 -12.491 12.266 -9.874 1.00 73.32 H new ATOM 0 HB3 GLU A 96 -14.212 12.468 -10.138 1.00 73.32 H new ATOM 0 HG2 GLU A 96 -14.130 14.643 -8.917 1.00 14.55 H new ATOM 0 HG3 GLU A 96 -12.403 14.443 -8.696 1.00 14.55 H new ATOM 1365 N PRO A 97 -13.058 9.684 -8.827 1.00 62.03 N ATOM 1366 CA PRO A 97 -13.324 8.269 -9.145 1.00 71.45 C ATOM 1367 C PRO A 97 -13.261 7.336 -7.917 1.00 63.44 C ATOM 1368 O PRO A 97 -12.698 6.237 -7.988 1.00 3.34 O ATOM 1369 CB PRO A 97 -12.204 7.945 -10.137 1.00 51.22 C ATOM 1370 CG PRO A 97 -11.053 8.766 -9.664 1.00 34.20 C ATOM 1371 CD PRO A 97 -11.648 10.040 -9.113 1.00 21.33 C ATOM 0 HA PRO A 97 -14.333 8.117 -9.529 1.00 71.45 H new ATOM 0 HB2 PRO A 97 -11.964 6.882 -10.134 1.00 51.22 H new ATOM 0 HB3 PRO A 97 -12.487 8.205 -11.157 1.00 51.22 H new ATOM 0 HG2 PRO A 97 -10.486 8.237 -8.898 1.00 34.20 H new ATOM 0 HG3 PRO A 97 -10.364 8.979 -10.481 1.00 34.20 H new ATOM 0 HD2 PRO A 97 -11.128 10.366 -8.212 1.00 21.33 H new ATOM 0 HD3 PRO A 97 -11.581 10.856 -9.833 1.00 21.33 H new ATOM 1379 N ILE A 98 -13.876 7.757 -6.812 1.00 43.43 N ATOM 1380 CA ILE A 98 -13.907 6.956 -5.582 1.00 44.01 C ATOM 1381 C ILE A 98 -14.601 5.591 -5.791 1.00 32.31 C ATOM 1382 O ILE A 98 -14.146 4.569 -5.273 1.00 35.13 O ATOM 1383 CB ILE A 98 -14.601 7.730 -4.426 1.00 74.21 C ATOM 1384 CG1 ILE A 98 -14.611 6.888 -3.135 1.00 50.05 C ATOM 1385 CG2 ILE A 98 -16.019 8.142 -4.823 1.00 0.52 C ATOM 1386 CD1 ILE A 98 -15.241 7.587 -1.947 1.00 3.12 C ATOM 0 H ILE A 98 -14.362 8.651 -6.741 1.00 43.43 H new ATOM 0 HA ILE A 98 -12.869 6.766 -5.310 1.00 44.01 H new ATOM 0 HB ILE A 98 -14.030 8.638 -4.232 1.00 74.21 H new ATOM 0 HG12 ILE A 98 -15.149 5.959 -3.324 1.00 50.05 H new ATOM 0 HG13 ILE A 98 -13.586 6.617 -2.882 1.00 50.05 H new ATOM 0 HG21 ILE A 98 -16.485 8.682 -3.999 1.00 0.52 H new ATOM 0 HG22 ILE A 98 -15.978 8.786 -5.702 1.00 0.52 H new ATOM 0 HG23 ILE A 98 -16.606 7.252 -5.052 1.00 0.52 H new ATOM 0 HD11 ILE A 98 -15.209 6.929 -1.079 1.00 3.12 H new ATOM 0 HD12 ILE A 98 -14.690 8.502 -1.729 1.00 3.12 H new ATOM 0 HD13 ILE A 98 -16.277 7.833 -2.178 1.00 3.12 H new ATOM 1398 N ASP A 99 -15.692 5.571 -6.562 1.00 22.22 N ATOM 1399 CA ASP A 99 -16.410 4.320 -6.839 1.00 13.03 C ATOM 1400 C ASP A 99 -15.567 3.371 -7.722 1.00 4.04 C ATOM 1401 O ASP A 99 -15.382 2.209 -7.366 1.00 52.24 O ATOM 1402 CB ASP A 99 -17.779 4.595 -7.480 1.00 11.41 C ATOM 1403 CG ASP A 99 -18.652 5.483 -6.613 1.00 53.32 C ATOM 1404 OD1 ASP A 99 -19.190 4.988 -5.601 1.00 32.43 O ATOM 1405 OD2 ASP A 99 -18.798 6.681 -6.941 1.00 30.31 O ATOM 0 H ASP A 99 -16.096 6.398 -7.003 1.00 22.22 H new ATOM 0 HA ASP A 99 -16.581 3.822 -5.884 1.00 13.03 H new ATOM 0 HB2 ASP A 99 -17.635 5.068 -8.451 1.00 11.41 H new ATOM 0 HB3 ASP A 99 -18.291 3.649 -7.659 1.00 11.41 H new ATOM 1410 N PRO A 100 -15.041 3.838 -8.888 1.00 2.14 N ATOM 1411 CA PRO A 100 -14.089 3.047 -9.692 1.00 35.45 C ATOM 1412 C PRO A 100 -12.906 2.521 -8.860 1.00 43.23 C ATOM 1413 O PRO A 100 -12.419 1.410 -9.086 1.00 5.44 O ATOM 1414 CB PRO A 100 -13.603 4.045 -10.750 1.00 63.12 C ATOM 1415 CG PRO A 100 -14.729 5.008 -10.901 1.00 0.22 C ATOM 1416 CD PRO A 100 -15.355 5.130 -9.537 1.00 43.31 C ATOM 0 HA PRO A 100 -14.555 2.154 -10.110 1.00 35.45 H new ATOM 0 HB2 PRO A 100 -12.690 4.549 -10.431 1.00 63.12 H new ATOM 0 HB3 PRO A 100 -13.379 3.546 -11.693 1.00 63.12 H new ATOM 0 HG2 PRO A 100 -14.371 5.975 -11.254 1.00 0.22 H new ATOM 0 HG3 PRO A 100 -15.453 4.650 -11.632 1.00 0.22 H new ATOM 0 HD2 PRO A 100 -14.939 5.969 -8.980 1.00 43.31 H new ATOM 0 HD3 PRO A 100 -16.431 5.293 -9.604 1.00 43.31 H new ATOM 1424 N LEU A 101 -12.454 3.326 -7.895 1.00 61.25 N ATOM 1425 CA LEU A 101 -11.386 2.918 -6.973 1.00 72.43 C ATOM 1426 C LEU A 101 -11.803 1.681 -6.159 1.00 63.12 C ATOM 1427 O LEU A 101 -11.142 0.642 -6.209 1.00 43.45 O ATOM 1428 CB LEU A 101 -11.034 4.080 -6.029 1.00 43.11 C ATOM 1429 CG LEU A 101 -9.911 3.794 -5.016 1.00 32.23 C ATOM 1430 CD1 LEU A 101 -8.599 3.474 -5.734 1.00 3.11 C ATOM 1431 CD2 LEU A 101 -9.735 4.974 -4.061 1.00 5.34 C ATOM 0 H LEU A 101 -12.811 4.267 -7.730 1.00 61.25 H new ATOM 0 HA LEU A 101 -10.507 2.656 -7.562 1.00 72.43 H new ATOM 0 HB2 LEU A 101 -10.745 4.940 -6.632 1.00 43.11 H new ATOM 0 HB3 LEU A 101 -11.932 4.363 -5.479 1.00 43.11 H new ATOM 0 HG LEU A 101 -10.195 2.920 -4.429 1.00 32.23 H new ATOM 0 HD11 LEU A 101 -7.820 3.275 -4.998 1.00 3.11 H new ATOM 0 HD12 LEU A 101 -8.734 2.595 -6.365 1.00 3.11 H new ATOM 0 HD13 LEU A 101 -8.306 4.323 -6.352 1.00 3.11 H new ATOM 0 HD21 LEU A 101 -8.937 4.753 -3.353 1.00 5.34 H new ATOM 0 HD22 LEU A 101 -9.478 5.867 -4.630 1.00 5.34 H new ATOM 0 HD23 LEU A 101 -10.665 5.145 -3.518 1.00 5.34 H new ATOM 1443 N LEU A 102 -12.909 1.796 -5.419 1.00 0.01 N ATOM 1444 CA LEU A 102 -13.448 0.668 -4.643 1.00 71.21 C ATOM 1445 C LEU A 102 -13.767 -0.532 -5.553 1.00 32.32 C ATOM 1446 O LEU A 102 -13.619 -1.693 -5.156 1.00 31.31 O ATOM 1447 CB LEU A 102 -14.713 1.102 -3.886 1.00 71.11 C ATOM 1448 CG LEU A 102 -14.518 2.249 -2.879 1.00 34.35 C ATOM 1449 CD1 LEU A 102 -15.844 2.613 -2.212 1.00 61.25 C ATOM 1450 CD2 LEU A 102 -13.468 1.878 -1.831 1.00 3.23 C ATOM 0 H LEU A 102 -13.451 2.657 -5.339 1.00 0.01 H new ATOM 0 HA LEU A 102 -12.687 0.359 -3.926 1.00 71.21 H new ATOM 0 HB2 LEU A 102 -15.466 1.404 -4.614 1.00 71.11 H new ATOM 0 HB3 LEU A 102 -15.112 0.238 -3.354 1.00 71.11 H new ATOM 0 HG LEU A 102 -14.159 3.123 -3.423 1.00 34.35 H new ATOM 0 HD11 LEU A 102 -15.684 3.426 -1.504 1.00 61.25 H new ATOM 0 HD12 LEU A 102 -16.559 2.929 -2.972 1.00 61.25 H new ATOM 0 HD13 LEU A 102 -16.236 1.744 -1.684 1.00 61.25 H new ATOM 0 HD21 LEU A 102 -13.347 2.703 -1.130 1.00 3.23 H new ATOM 0 HD22 LEU A 102 -13.791 0.988 -1.291 1.00 3.23 H new ATOM 0 HD23 LEU A 102 -12.517 1.678 -2.324 1.00 3.23 H new ATOM 1462 N SER A 103 -14.200 -0.233 -6.776 1.00 44.13 N ATOM 1463 CA SER A 103 -14.494 -1.261 -7.785 1.00 3.31 C ATOM 1464 C SER A 103 -13.255 -2.106 -8.111 1.00 74.12 C ATOM 1465 O SER A 103 -13.350 -3.325 -8.266 1.00 13.25 O ATOM 1466 CB SER A 103 -15.027 -0.608 -9.067 1.00 62.35 C ATOM 1467 OG SER A 103 -15.271 -1.571 -10.082 1.00 62.02 O ATOM 0 H SER A 103 -14.358 0.722 -7.099 1.00 44.13 H new ATOM 0 HA SER A 103 -15.254 -1.922 -7.369 1.00 3.31 H new ATOM 0 HB2 SER A 103 -15.949 -0.070 -8.846 1.00 62.35 H new ATOM 0 HB3 SER A 103 -14.308 0.127 -9.428 1.00 62.35 H new ATOM 0 HG SER A 103 -15.611 -1.122 -10.884 1.00 62.02 H new ATOM 1473 N LYS A 104 -12.092 -1.456 -8.208 1.00 25.40 N ATOM 1474 CA LYS A 104 -10.830 -2.159 -8.483 1.00 31.22 C ATOM 1475 C LYS A 104 -10.495 -3.195 -7.394 1.00 44.44 C ATOM 1476 O LYS A 104 -9.736 -4.133 -7.633 1.00 63.42 O ATOM 1477 CB LYS A 104 -9.670 -1.158 -8.618 1.00 3.42 C ATOM 1478 CG LYS A 104 -9.755 -0.260 -9.850 1.00 45.23 C ATOM 1479 CD LYS A 104 -9.776 -1.070 -11.145 1.00 24.10 C ATOM 1480 CE LYS A 104 -9.729 -0.173 -12.379 1.00 63.30 C ATOM 1481 NZ LYS A 104 -10.842 0.814 -12.405 1.00 3.20 N ATOM 0 H LYS A 104 -11.995 -0.446 -8.101 1.00 25.40 H new ATOM 0 HA LYS A 104 -10.963 -2.692 -9.425 1.00 31.22 H new ATOM 0 HB2 LYS A 104 -9.641 -0.531 -7.727 1.00 3.42 H new ATOM 0 HB3 LYS A 104 -8.731 -1.710 -8.649 1.00 3.42 H new ATOM 0 HG2 LYS A 104 -10.654 0.353 -9.791 1.00 45.23 H new ATOM 0 HG3 LYS A 104 -8.904 0.422 -9.862 1.00 45.23 H new ATOM 0 HD2 LYS A 104 -8.926 -1.753 -11.160 1.00 24.10 H new ATOM 0 HD3 LYS A 104 -10.677 -1.682 -11.176 1.00 24.10 H new ATOM 0 HE2 LYS A 104 -8.777 0.357 -12.404 1.00 63.30 H new ATOM 0 HE3 LYS A 104 -9.774 -0.791 -13.276 1.00 63.30 H new ATOM 0 HZ1 LYS A 104 -10.848 1.307 -13.321 1.00 3.20 H new ATOM 0 HZ2 LYS A 104 -11.747 0.320 -12.272 1.00 3.20 H new ATOM 0 HZ3 LYS A 104 -10.710 1.506 -11.640 1.00 3.20 H new ATOM 1495 N PHE A 105 -11.058 -3.021 -6.202 1.00 14.25 N ATOM 1496 CA PHE A 105 -10.818 -3.956 -5.098 1.00 54.34 C ATOM 1497 C PHE A 105 -11.861 -5.086 -5.063 1.00 22.44 C ATOM 1498 O PHE A 105 -11.566 -6.237 -5.397 1.00 15.53 O ATOM 1499 CB PHE A 105 -10.818 -3.212 -3.753 1.00 74.15 C ATOM 1500 CG PHE A 105 -9.703 -2.206 -3.608 1.00 44.43 C ATOM 1501 CD1 PHE A 105 -8.420 -2.616 -3.276 1.00 51.04 C ATOM 1502 CD2 PHE A 105 -9.939 -0.853 -3.801 1.00 13.35 C ATOM 1503 CE1 PHE A 105 -7.396 -1.700 -3.141 1.00 14.11 C ATOM 1504 CE2 PHE A 105 -8.918 0.070 -3.667 1.00 42.51 C ATOM 1505 CZ PHE A 105 -7.646 -0.354 -3.336 1.00 54.14 C ATOM 0 H PHE A 105 -11.681 -2.247 -5.972 1.00 14.25 H new ATOM 0 HA PHE A 105 -9.840 -4.406 -5.267 1.00 54.34 H new ATOM 0 HB2 PHE A 105 -11.773 -2.700 -3.632 1.00 74.15 H new ATOM 0 HB3 PHE A 105 -10.743 -3.941 -2.946 1.00 74.15 H new ATOM 0 HD1 PHE A 105 -8.220 -3.666 -3.121 1.00 51.04 H new ATOM 0 HD2 PHE A 105 -10.932 -0.516 -4.059 1.00 13.35 H new ATOM 0 HE1 PHE A 105 -6.402 -2.034 -2.884 1.00 14.11 H new ATOM 0 HE2 PHE A 105 -9.115 1.121 -3.821 1.00 42.51 H new ATOM 0 HZ PHE A 105 -6.847 0.365 -3.230 1.00 54.14 H new ATOM 1515 N ARG A 106 -13.089 -4.739 -4.690 1.00 23.50 N ATOM 1516 CA ARG A 106 -14.124 -5.739 -4.386 1.00 2.01 C ATOM 1517 C ARG A 106 -14.647 -6.472 -5.634 1.00 32.32 C ATOM 1518 O ARG A 106 -14.969 -7.660 -5.568 1.00 55.54 O ATOM 1519 CB ARG A 106 -15.281 -5.072 -3.638 1.00 42.04 C ATOM 1520 CG ARG A 106 -14.852 -4.430 -2.322 1.00 11.44 C ATOM 1521 CD ARG A 106 -16.006 -3.729 -1.618 1.00 64.22 C ATOM 1522 NE ARG A 106 -15.573 -3.095 -0.374 1.00 42.12 N ATOM 1523 CZ ARG A 106 -16.016 -1.945 0.054 1.00 31.34 C ATOM 1524 NH1 ARG A 106 -16.938 -1.308 -0.596 1.00 63.43 N ATOM 1525 NH2 ARG A 106 -15.544 -1.439 1.147 1.00 61.24 N ATOM 0 H ARG A 106 -13.399 -3.772 -4.589 1.00 23.50 H new ATOM 0 HA ARG A 106 -13.658 -6.498 -3.758 1.00 2.01 H new ATOM 0 HB2 ARG A 106 -15.729 -4.311 -4.278 1.00 42.04 H new ATOM 0 HB3 ARG A 106 -16.053 -5.815 -3.438 1.00 42.04 H new ATOM 0 HG2 ARG A 106 -14.439 -5.195 -1.665 1.00 11.44 H new ATOM 0 HG3 ARG A 106 -14.056 -3.711 -2.514 1.00 11.44 H new ATOM 0 HD2 ARG A 106 -16.434 -2.977 -2.281 1.00 64.22 H new ATOM 0 HD3 ARG A 106 -16.794 -4.451 -1.404 1.00 64.22 H new ATOM 0 HE ARG A 106 -14.881 -3.582 0.195 1.00 42.12 H new ATOM 0 HH11 ARG A 106 -17.325 -1.705 -1.452 1.00 63.43 H new ATOM 0 HH12 ARG A 106 -17.277 -0.410 -0.252 1.00 63.43 H new ATOM 0 HH21 ARG A 106 -14.827 -1.939 1.672 1.00 61.24 H new ATOM 0 HH22 ARG A 106 -15.889 -0.540 1.483 1.00 61.24 H new ATOM 1539 N ASN A 107 -14.738 -5.771 -6.765 1.00 25.15 N ATOM 1540 CA ASN A 107 -15.256 -6.378 -8.002 1.00 5.25 C ATOM 1541 C ASN A 107 -14.275 -7.423 -8.566 1.00 40.43 C ATOM 1542 O ASN A 107 -14.671 -8.339 -9.290 1.00 2.24 O ATOM 1543 CB ASN A 107 -15.545 -5.298 -9.053 1.00 52.11 C ATOM 1544 CG ASN A 107 -16.505 -4.233 -8.546 1.00 62.23 C ATOM 1545 OD1 ASN A 107 -16.518 -3.896 -7.366 1.00 32.41 O ATOM 1546 ND2 ASN A 107 -17.319 -3.693 -9.430 1.00 33.31 N ATOM 0 H ASN A 107 -14.464 -4.793 -6.855 1.00 25.15 H new ATOM 0 HA ASN A 107 -16.188 -6.888 -7.757 1.00 5.25 H new ATOM 0 HB2 ASN A 107 -14.609 -4.826 -9.351 1.00 52.11 H new ATOM 0 HB3 ASN A 107 -15.964 -5.766 -9.944 1.00 52.11 H new ATOM 0 HD21 ASN A 107 -17.983 -2.975 -9.140 1.00 33.31 H new ATOM 0 HD22 ASN A 107 -17.285 -3.993 -10.404 1.00 33.31 H new ATOM 1553 N LEU A 108 -12.994 -7.272 -8.232 1.00 62.43 N ATOM 1554 CA LEU A 108 -11.967 -8.243 -8.624 1.00 54.25 C ATOM 1555 C LEU A 108 -11.867 -9.383 -7.596 1.00 41.22 C ATOM 1556 O LEU A 108 -11.989 -10.562 -7.941 1.00 63.43 O ATOM 1557 CB LEU A 108 -10.596 -7.555 -8.777 1.00 51.35 C ATOM 1558 CG LEU A 108 -10.420 -6.678 -10.035 1.00 73.51 C ATOM 1559 CD1 LEU A 108 -11.393 -5.503 -10.039 1.00 12.33 C ATOM 1560 CD2 LEU A 108 -8.980 -6.185 -10.146 1.00 24.21 C ATOM 0 H LEU A 108 -12.639 -6.485 -7.689 1.00 62.43 H new ATOM 0 HA LEU A 108 -12.259 -8.665 -9.585 1.00 54.25 H new ATOM 0 HB2 LEU A 108 -10.422 -6.935 -7.898 1.00 51.35 H new ATOM 0 HB3 LEU A 108 -9.824 -8.324 -8.783 1.00 51.35 H new ATOM 0 HG LEU A 108 -10.645 -7.295 -10.905 1.00 73.51 H new ATOM 0 HD11 LEU A 108 -11.241 -4.907 -10.939 1.00 12.33 H new ATOM 0 HD12 LEU A 108 -12.416 -5.878 -10.021 1.00 12.33 H new ATOM 0 HD13 LEU A 108 -11.218 -4.883 -9.160 1.00 12.33 H new ATOM 0 HD21 LEU A 108 -8.874 -5.568 -11.039 1.00 24.21 H new ATOM 0 HD22 LEU A 108 -8.729 -5.594 -9.265 1.00 24.21 H new ATOM 0 HD23 LEU A 108 -8.307 -7.040 -10.214 1.00 24.21 H new ATOM 1572 N GLY A 109 -11.646 -9.022 -6.332 1.00 51.43 N ATOM 1573 CA GLY A 109 -11.518 -10.025 -5.278 1.00 44.34 C ATOM 1574 C GLY A 109 -10.788 -9.521 -4.034 1.00 75.21 C ATOM 1575 O GLY A 109 -10.679 -10.240 -3.038 1.00 41.21 O ATOM 0 H GLY A 109 -11.553 -8.056 -6.017 1.00 51.43 H new ATOM 0 HA2 GLY A 109 -12.513 -10.366 -4.991 1.00 44.34 H new ATOM 0 HA3 GLY A 109 -10.986 -10.890 -5.675 1.00 44.34 H new ATOM 1579 N LEU A 110 -10.275 -8.299 -4.091 1.00 42.42 N ATOM 1580 CA LEU A 110 -9.571 -7.702 -2.953 1.00 64.14 C ATOM 1581 C LEU A 110 -10.560 -7.202 -1.886 1.00 43.25 C ATOM 1582 O LEU A 110 -11.137 -6.121 -2.019 1.00 43.34 O ATOM 1583 CB LEU A 110 -8.685 -6.543 -3.429 1.00 62.54 C ATOM 1584 CG LEU A 110 -7.637 -6.902 -4.499 1.00 51.50 C ATOM 1585 CD1 LEU A 110 -6.882 -5.656 -4.962 1.00 32.55 C ATOM 1586 CD2 LEU A 110 -6.666 -7.957 -3.971 1.00 73.02 C ATOM 0 H LEU A 110 -10.331 -7.697 -4.913 1.00 42.42 H new ATOM 0 HA LEU A 110 -8.946 -8.473 -2.503 1.00 64.14 H new ATOM 0 HB2 LEU A 110 -9.328 -5.757 -3.825 1.00 62.54 H new ATOM 0 HB3 LEU A 110 -8.168 -6.126 -2.565 1.00 62.54 H new ATOM 0 HG LEU A 110 -8.161 -7.319 -5.359 1.00 51.50 H new ATOM 0 HD11 LEU A 110 -6.148 -5.935 -5.717 1.00 32.55 H new ATOM 0 HD12 LEU A 110 -7.586 -4.941 -5.387 1.00 32.55 H new ATOM 0 HD13 LEU A 110 -6.373 -5.202 -4.112 1.00 32.55 H new ATOM 0 HD21 LEU A 110 -5.934 -8.196 -4.742 1.00 73.02 H new ATOM 0 HD22 LEU A 110 -6.152 -7.571 -3.091 1.00 73.02 H new ATOM 0 HD23 LEU A 110 -7.218 -8.858 -3.703 1.00 73.02 H new ATOM 1598 N THR A 111 -10.759 -7.995 -0.832 1.00 44.15 N ATOM 1599 CA THR A 111 -11.678 -7.618 0.256 1.00 42.13 C ATOM 1600 C THR A 111 -11.067 -6.536 1.156 1.00 51.13 C ATOM 1601 O THR A 111 -9.931 -6.660 1.621 1.00 41.00 O ATOM 1602 CB THR A 111 -12.089 -8.836 1.128 1.00 53.03 C ATOM 1603 OG1 THR A 111 -12.949 -8.410 2.200 1.00 72.53 O ATOM 1604 CG2 THR A 111 -10.871 -9.551 1.706 1.00 1.54 C ATOM 0 H THR A 111 -10.302 -8.898 -0.704 1.00 44.15 H new ATOM 0 HA THR A 111 -12.572 -7.223 -0.227 1.00 42.13 H new ATOM 0 HB THR A 111 -12.621 -9.536 0.484 1.00 53.03 H new ATOM 0 HG1 THR A 111 -13.204 -9.185 2.743 1.00 72.53 H new ATOM 0 HG21 THR A 111 -11.198 -10.397 2.310 1.00 1.54 H new ATOM 0 HG22 THR A 111 -10.239 -9.908 0.893 1.00 1.54 H new ATOM 0 HG23 THR A 111 -10.304 -8.859 2.329 1.00 1.54 H new ATOM 1612 N THR A 112 -11.828 -5.470 1.392 1.00 33.02 N ATOM 1613 CA THR A 112 -11.353 -4.341 2.204 1.00 12.05 C ATOM 1614 C THR A 112 -11.480 -4.630 3.707 1.00 75.04 C ATOM 1615 O THR A 112 -12.588 -4.708 4.239 1.00 31.12 O ATOM 1616 CB THR A 112 -12.125 -3.036 1.866 1.00 72.41 C ATOM 1617 OG1 THR A 112 -13.540 -3.212 2.071 1.00 54.40 O ATOM 1618 CG2 THR A 112 -11.875 -2.609 0.421 1.00 51.44 C ATOM 0 H THR A 112 -12.777 -5.360 1.035 1.00 33.02 H new ATOM 0 HA THR A 112 -10.299 -4.205 1.961 1.00 12.05 H new ATOM 0 HB THR A 112 -11.758 -2.257 2.535 1.00 72.41 H new ATOM 0 HG1 THR A 112 -13.688 -3.883 2.770 1.00 54.40 H new ATOM 0 HG21 THR A 112 -12.427 -1.693 0.212 1.00 51.44 H new ATOM 0 HG22 THR A 112 -10.810 -2.432 0.273 1.00 51.44 H new ATOM 0 HG23 THR A 112 -12.209 -3.397 -0.254 1.00 51.44 H new ATOM 1626 N ALA A 113 -10.341 -4.800 4.385 1.00 23.51 N ATOM 1627 CA ALA A 113 -10.323 -5.041 5.839 1.00 33.44 C ATOM 1628 C ALA A 113 -11.080 -3.943 6.607 1.00 45.25 C ATOM 1629 O ALA A 113 -11.763 -4.211 7.597 1.00 2.15 O ATOM 1630 CB ALA A 113 -8.884 -5.142 6.338 1.00 3.40 C ATOM 0 H ALA A 113 -9.417 -4.776 3.954 1.00 23.51 H new ATOM 0 HA ALA A 113 -10.834 -5.985 6.026 1.00 33.44 H new ATOM 0 HB1 ALA A 113 -8.883 -5.320 7.413 1.00 3.40 H new ATOM 0 HB2 ALA A 113 -8.381 -5.967 5.833 1.00 3.40 H new ATOM 0 HB3 ALA A 113 -8.359 -4.211 6.124 1.00 3.40 H new ATOM 1636 N PHE A 114 -10.947 -2.707 6.138 1.00 55.45 N ATOM 1637 CA PHE A 114 -11.693 -1.573 6.687 1.00 31.43 C ATOM 1638 C PHE A 114 -12.591 -0.970 5.590 1.00 21.35 C ATOM 1639 O PHE A 114 -12.170 -0.091 4.838 1.00 75.02 O ATOM 1640 CB PHE A 114 -10.715 -0.529 7.243 1.00 25.31 C ATOM 1641 CG PHE A 114 -11.366 0.589 8.021 1.00 11.43 C ATOM 1642 CD1 PHE A 114 -12.177 0.311 9.114 1.00 5.42 C ATOM 1643 CD2 PHE A 114 -11.153 1.916 7.674 1.00 11.04 C ATOM 1644 CE1 PHE A 114 -12.763 1.330 9.838 1.00 72.32 C ATOM 1645 CE2 PHE A 114 -11.738 2.937 8.397 1.00 33.41 C ATOM 1646 CZ PHE A 114 -12.543 2.645 9.480 1.00 61.45 C ATOM 0 H PHE A 114 -10.323 -2.460 5.370 1.00 55.45 H new ATOM 0 HA PHE A 114 -12.330 -1.909 7.506 1.00 31.43 H new ATOM 0 HB2 PHE A 114 -9.995 -1.032 7.888 1.00 25.31 H new ATOM 0 HB3 PHE A 114 -10.153 -0.098 6.414 1.00 25.31 H new ATOM 0 HD1 PHE A 114 -12.351 -0.715 9.401 1.00 5.42 H new ATOM 0 HD2 PHE A 114 -10.523 2.153 6.829 1.00 11.04 H new ATOM 0 HE1 PHE A 114 -13.393 1.099 10.684 1.00 72.32 H new ATOM 0 HE2 PHE A 114 -11.566 3.965 8.115 1.00 33.41 H new ATOM 0 HZ PHE A 114 -13.000 3.444 10.046 1.00 61.45 H new ATOM 1656 N PRO A 115 -13.840 -1.458 5.471 1.00 31.34 N ATOM 1657 CA PRO A 115 -14.717 -1.155 4.327 1.00 33.24 C ATOM 1658 C PRO A 115 -15.492 0.171 4.442 1.00 55.31 C ATOM 1659 O PRO A 115 -16.606 0.283 3.925 1.00 63.44 O ATOM 1660 CB PRO A 115 -15.681 -2.345 4.347 1.00 43.11 C ATOM 1661 CG PRO A 115 -15.828 -2.680 5.795 1.00 24.35 C ATOM 1662 CD PRO A 115 -14.502 -2.352 6.445 1.00 34.03 C ATOM 0 HA PRO A 115 -14.146 -1.026 3.408 1.00 33.24 H new ATOM 0 HB2 PRO A 115 -16.641 -2.086 3.900 1.00 43.11 H new ATOM 0 HB3 PRO A 115 -15.283 -3.188 3.783 1.00 43.11 H new ATOM 0 HG2 PRO A 115 -16.635 -2.104 6.247 1.00 24.35 H new ATOM 0 HG3 PRO A 115 -16.075 -3.733 5.927 1.00 24.35 H new ATOM 0 HD2 PRO A 115 -14.640 -1.861 7.408 1.00 34.03 H new ATOM 0 HD3 PRO A 115 -13.913 -3.251 6.627 1.00 34.03 H new ATOM 1670 N ALA A 116 -14.898 1.181 5.075 1.00 53.54 N ATOM 1671 CA ALA A 116 -15.577 2.472 5.250 1.00 43.42 C ATOM 1672 C ALA A 116 -14.589 3.624 5.496 1.00 31.22 C ATOM 1673 O ALA A 116 -13.800 3.588 6.434 1.00 53.14 O ATOM 1674 CB ALA A 116 -16.579 2.380 6.396 1.00 43.34 C ATOM 0 H ALA A 116 -13.960 1.136 5.472 1.00 53.54 H new ATOM 0 HA ALA A 116 -16.102 2.695 4.321 1.00 43.42 H new ATOM 0 HB1 ALA A 116 -17.079 3.341 6.520 1.00 43.34 H new ATOM 0 HB2 ALA A 116 -17.319 1.612 6.171 1.00 43.34 H new ATOM 0 HB3 ALA A 116 -16.056 2.121 7.317 1.00 43.34 H new ATOM 1680 N ILE A 117 -14.649 4.645 4.643 1.00 61.33 N ATOM 1681 CA ILE A 117 -13.827 5.854 4.797 1.00 45.54 C ATOM 1682 C ILE A 117 -14.703 7.118 4.704 1.00 44.43 C ATOM 1683 O ILE A 117 -15.423 7.315 3.723 1.00 65.12 O ATOM 1684 CB ILE A 117 -12.676 5.930 3.741 1.00 52.52 C ATOM 1685 CG1 ILE A 117 -13.213 5.964 2.292 1.00 1.35 C ATOM 1686 CG2 ILE A 117 -11.704 4.765 3.921 1.00 51.21 C ATOM 1687 CD1 ILE A 117 -13.814 4.658 1.799 1.00 22.13 C ATOM 0 H ILE A 117 -15.263 4.663 3.829 1.00 61.33 H new ATOM 0 HA ILE A 117 -13.367 5.799 5.784 1.00 45.54 H new ATOM 0 HB ILE A 117 -12.145 6.866 3.912 1.00 52.52 H new ATOM 0 HG12 ILE A 117 -13.970 6.745 2.219 1.00 1.35 H new ATOM 0 HG13 ILE A 117 -12.398 6.246 1.625 1.00 1.35 H new ATOM 0 HG21 ILE A 117 -10.910 4.835 3.177 1.00 51.21 H new ATOM 0 HG22 ILE A 117 -11.270 4.804 4.920 1.00 51.21 H new ATOM 0 HG23 ILE A 117 -12.238 3.823 3.794 1.00 51.21 H new ATOM 0 HD11 ILE A 117 -14.162 4.782 0.774 1.00 22.13 H new ATOM 0 HD12 ILE A 117 -13.058 3.874 1.833 1.00 22.13 H new ATOM 0 HD13 ILE A 117 -14.654 4.380 2.436 1.00 22.13 H new ATOM 1699 N ARG A 118 -14.662 7.965 5.736 1.00 64.55 N ATOM 1700 CA ARG A 118 -15.529 9.154 5.781 1.00 54.53 C ATOM 1701 C ARG A 118 -14.877 10.330 6.545 1.00 62.23 C ATOM 1702 O ARG A 118 -15.571 11.187 7.102 1.00 32.11 O ATOM 1703 CB ARG A 118 -16.879 8.770 6.419 1.00 63.40 C ATOM 1704 CG ARG A 118 -18.001 9.775 6.161 1.00 64.12 C ATOM 1705 CD ARG A 118 -19.308 9.341 6.817 1.00 61.45 C ATOM 1706 NE ARG A 118 -20.420 10.232 6.487 1.00 12.44 N ATOM 1707 CZ ARG A 118 -21.569 10.231 7.108 1.00 33.32 C ATOM 1708 NH1 ARG A 118 -21.772 9.460 8.128 1.00 72.23 N ATOM 1709 NH2 ARG A 118 -22.512 11.021 6.717 1.00 34.42 N ATOM 0 H ARG A 118 -14.048 7.856 6.543 1.00 64.55 H new ATOM 0 HA ARG A 118 -15.686 9.499 4.759 1.00 54.53 H new ATOM 0 HB2 ARG A 118 -17.184 7.796 6.038 1.00 63.40 H new ATOM 0 HB3 ARG A 118 -16.742 8.663 7.495 1.00 63.40 H new ATOM 0 HG2 ARG A 118 -17.709 10.753 6.544 1.00 64.12 H new ATOM 0 HG3 ARG A 118 -18.152 9.885 5.087 1.00 64.12 H new ATOM 0 HD2 ARG A 118 -19.552 8.327 6.499 1.00 61.45 H new ATOM 0 HD3 ARG A 118 -19.177 9.313 7.899 1.00 61.45 H new ATOM 0 HE ARG A 118 -20.290 10.896 5.724 1.00 12.44 H new ATOM 0 HH11 ARG A 118 -21.029 8.843 8.456 1.00 72.23 H new ATOM 0 HH12 ARG A 118 -22.675 9.470 8.603 1.00 72.23 H new ATOM 0 HH21 ARG A 118 -22.359 11.645 5.924 1.00 34.42 H new ATOM 0 HH22 ARG A 118 -23.410 11.022 7.201 1.00 34.42 H new ATOM 1723 N ILE A 119 -13.545 10.390 6.539 1.00 1.12 N ATOM 1724 CA ILE A 119 -12.818 11.498 7.180 1.00 55.35 C ATOM 1725 C ILE A 119 -13.028 12.819 6.420 1.00 31.41 C ATOM 1726 O ILE A 119 -13.096 12.841 5.190 1.00 1.25 O ATOM 1727 CB ILE A 119 -11.296 11.196 7.288 1.00 71.51 C ATOM 1728 CG1 ILE A 119 -11.050 10.028 8.257 1.00 64.25 C ATOM 1729 CG2 ILE A 119 -10.513 12.433 7.733 1.00 1.34 C ATOM 1730 CD1 ILE A 119 -11.535 10.290 9.673 1.00 74.32 C ATOM 0 H ILE A 119 -12.946 9.691 6.101 1.00 1.12 H new ATOM 0 HA ILE A 119 -13.225 11.601 8.186 1.00 55.35 H new ATOM 0 HB ILE A 119 -10.939 10.914 6.298 1.00 71.51 H new ATOM 0 HG12 ILE A 119 -11.548 9.138 7.872 1.00 64.25 H new ATOM 0 HG13 ILE A 119 -9.982 9.810 8.284 1.00 64.25 H new ATOM 0 HG21 ILE A 119 -9.453 12.188 7.799 1.00 1.34 H new ATOM 0 HG22 ILE A 119 -10.656 13.234 7.008 1.00 1.34 H new ATOM 0 HG23 ILE A 119 -10.871 12.759 8.710 1.00 1.34 H new ATOM 0 HD11 ILE A 119 -11.326 9.420 10.296 1.00 74.32 H new ATOM 0 HD12 ILE A 119 -11.019 11.160 10.079 1.00 74.32 H new ATOM 0 HD13 ILE A 119 -12.609 10.478 9.661 1.00 74.32 H new ATOM 1742 N LYS A 120 -13.137 13.914 7.168 1.00 4.22 N ATOM 1743 CA LYS A 120 -13.431 15.227 6.591 1.00 44.12 C ATOM 1744 C LYS A 120 -12.202 15.822 5.884 1.00 1.24 C ATOM 1745 O LYS A 120 -12.282 16.251 4.731 1.00 0.11 O ATOM 1746 CB LYS A 120 -13.917 16.176 7.695 1.00 71.14 C ATOM 1747 CG LYS A 120 -14.601 17.436 7.176 1.00 64.21 C ATOM 1748 CD LYS A 120 -15.082 18.333 8.317 1.00 52.10 C ATOM 1749 CE LYS A 120 -16.112 19.352 7.841 1.00 62.12 C ATOM 1750 NZ LYS A 120 -17.363 18.691 7.382 1.00 53.22 N ATOM 0 H LYS A 120 -13.026 13.919 8.182 1.00 4.22 H new ATOM 0 HA LYS A 120 -14.214 15.103 5.843 1.00 44.12 H new ATOM 0 HB2 LYS A 120 -14.611 15.639 8.342 1.00 71.14 H new ATOM 0 HB3 LYS A 120 -13.066 16.465 8.311 1.00 71.14 H new ATOM 0 HG2 LYS A 120 -13.908 17.992 6.544 1.00 64.21 H new ATOM 0 HG3 LYS A 120 -15.449 17.158 6.550 1.00 64.21 H new ATOM 0 HD2 LYS A 120 -15.517 17.718 9.105 1.00 52.10 H new ATOM 0 HD3 LYS A 120 -14.230 18.854 8.753 1.00 52.10 H new ATOM 0 HE2 LYS A 120 -16.341 20.044 8.651 1.00 62.12 H new ATOM 0 HE3 LYS A 120 -15.692 19.942 7.027 1.00 62.12 H new ATOM 0 HZ1 LYS A 120 -18.149 19.371 7.421 1.00 53.22 H new ATOM 0 HZ2 LYS A 120 -17.241 18.358 6.404 1.00 53.22 H new ATOM 0 HZ3 LYS A 120 -17.574 17.881 7.999 1.00 53.22 H new ATOM 1764 N GLN A 121 -11.072 15.850 6.588 1.00 52.23 N ATOM 1765 CA GLN A 121 -9.826 16.408 6.038 1.00 1.44 C ATOM 1766 C GLN A 121 -8.613 16.018 6.901 1.00 12.41 C ATOM 1767 O GLN A 121 -7.537 15.715 6.386 1.00 71.34 O ATOM 1768 CB GLN A 121 -9.934 17.941 5.943 1.00 54.20 C ATOM 1769 CG GLN A 121 -8.739 18.626 5.277 1.00 53.45 C ATOM 1770 CD GLN A 121 -8.569 18.241 3.815 1.00 13.43 C ATOM 1771 OE1 GLN A 121 -7.844 17.309 3.478 1.00 4.01 O ATOM 1772 NE2 GLN A 121 -9.248 18.950 2.935 1.00 2.32 N ATOM 0 H GLN A 121 -10.988 15.494 7.540 1.00 52.23 H new ATOM 0 HA GLN A 121 -9.679 15.993 5.041 1.00 1.44 H new ATOM 0 HB2 GLN A 121 -10.837 18.194 5.387 1.00 54.20 H new ATOM 0 HB3 GLN A 121 -10.054 18.346 6.948 1.00 54.20 H new ATOM 0 HG2 GLN A 121 -8.860 19.707 5.350 1.00 53.45 H new ATOM 0 HG3 GLN A 121 -7.831 18.369 5.822 1.00 53.45 H new ATOM 0 HE21 GLN A 121 -9.842 19.718 3.248 1.00 2.32 H new ATOM 0 HE22 GLN A 121 -9.180 18.730 1.941 1.00 2.32 H new ATOM 1781 N THR A 122 -8.792 16.028 8.221 1.00 14.30 N ATOM 1782 CA THR A 122 -7.702 15.709 9.157 1.00 71.21 C ATOM 1783 C THR A 122 -7.979 14.412 9.939 1.00 43.23 C ATOM 1784 O THR A 122 -9.067 14.235 10.496 1.00 35.15 O ATOM 1785 CB THR A 122 -7.476 16.853 10.176 1.00 15.41 C ATOM 1786 OG1 THR A 122 -8.614 16.978 11.046 1.00 41.14 O ATOM 1787 CG2 THR A 122 -7.228 18.179 9.462 1.00 24.13 C ATOM 0 H THR A 122 -9.679 16.253 8.672 1.00 14.30 H new ATOM 0 HA THR A 122 -6.809 15.579 8.546 1.00 71.21 H new ATOM 0 HB THR A 122 -6.595 16.606 10.768 1.00 15.41 H new ATOM 0 HG1 THR A 122 -9.030 16.099 11.168 1.00 41.14 H new ATOM 0 HG21 THR A 122 -7.072 18.966 10.200 1.00 24.13 H new ATOM 0 HG22 THR A 122 -6.343 18.093 8.831 1.00 24.13 H new ATOM 0 HG23 THR A 122 -8.091 18.427 8.844 1.00 24.13 H new ATOM 1795 N PRO A 123 -7.003 13.479 9.983 1.00 42.13 N ATOM 1796 CA PRO A 123 -7.108 12.253 10.801 1.00 51.03 C ATOM 1797 C PRO A 123 -7.168 12.551 12.311 1.00 53.14 C ATOM 1798 O PRO A 123 -6.695 13.597 12.769 1.00 3.05 O ATOM 1799 CB PRO A 123 -5.821 11.475 10.456 1.00 13.32 C ATOM 1800 CG PRO A 123 -5.330 12.079 9.181 1.00 42.44 C ATOM 1801 CD PRO A 123 -5.740 13.524 9.229 1.00 32.35 C ATOM 0 HA PRO A 123 -8.025 11.704 10.586 1.00 51.03 H new ATOM 0 HB2 PRO A 123 -5.079 11.570 11.249 1.00 13.32 H new ATOM 0 HB3 PRO A 123 -6.024 10.411 10.335 1.00 13.32 H new ATOM 0 HG2 PRO A 123 -4.248 11.982 9.094 1.00 42.44 H new ATOM 0 HG3 PRO A 123 -5.766 11.577 8.317 1.00 42.44 H new ATOM 0 HD2 PRO A 123 -4.992 14.140 9.728 1.00 32.35 H new ATOM 0 HD3 PRO A 123 -5.879 13.938 8.231 1.00 32.35 H new ATOM 1809 N THR A 124 -7.743 11.631 13.083 1.00 24.01 N ATOM 1810 CA THR A 124 -7.889 11.818 14.537 1.00 23.13 C ATOM 1811 C THR A 124 -6.900 10.948 15.321 1.00 71.11 C ATOM 1812 O THR A 124 -6.245 10.067 14.761 1.00 72.22 O ATOM 1813 CB THR A 124 -9.315 11.461 15.027 1.00 64.34 C ATOM 1814 OG1 THR A 124 -9.493 10.033 15.022 1.00 43.04 O ATOM 1815 CG2 THR A 124 -10.381 12.115 14.153 1.00 25.43 C ATOM 0 H THR A 124 -8.117 10.749 12.733 1.00 24.01 H new ATOM 0 HA THR A 124 -7.688 12.874 14.719 1.00 23.13 H new ATOM 0 HB THR A 124 -9.426 11.840 16.043 1.00 64.34 H new ATOM 0 HG1 THR A 124 -9.203 9.670 14.159 1.00 43.04 H new ATOM 0 HG21 THR A 124 -11.370 11.845 14.523 1.00 25.43 H new ATOM 0 HG22 THR A 124 -10.264 13.198 14.186 1.00 25.43 H new ATOM 0 HG23 THR A 124 -10.271 11.769 13.125 1.00 25.43 H new ATOM 1823 N GLU A 125 -6.809 11.193 16.628 1.00 65.43 N ATOM 1824 CA GLU A 125 -6.010 10.350 17.528 1.00 63.22 C ATOM 1825 C GLU A 125 -6.479 8.883 17.494 1.00 62.15 C ATOM 1826 O GLU A 125 -5.714 7.967 17.795 1.00 42.41 O ATOM 1827 CB GLU A 125 -6.094 10.885 18.967 1.00 43.12 C ATOM 1828 CG GLU A 125 -7.507 10.872 19.548 1.00 23.13 C ATOM 1829 CD GLU A 125 -7.569 11.412 20.968 1.00 24.31 C ATOM 1830 OE1 GLU A 125 -7.764 12.635 21.135 1.00 12.44 O ATOM 1831 OE2 GLU A 125 -7.426 10.621 21.921 1.00 61.42 O ATOM 0 H GLU A 125 -7.279 11.970 17.092 1.00 65.43 H new ATOM 0 HA GLU A 125 -4.977 10.385 17.183 1.00 63.22 H new ATOM 0 HB2 GLU A 125 -5.443 10.288 19.605 1.00 43.12 H new ATOM 0 HB3 GLU A 125 -5.712 11.906 18.988 1.00 43.12 H new ATOM 0 HG2 GLU A 125 -8.162 11.466 18.910 1.00 23.13 H new ATOM 0 HG3 GLU A 125 -7.890 9.851 19.536 1.00 23.13 H new ATOM 1838 N ASN A 126 -7.743 8.667 17.130 1.00 71.24 N ATOM 1839 CA ASN A 126 -8.318 7.319 17.077 1.00 15.33 C ATOM 1840 C ASN A 126 -8.006 6.624 15.742 1.00 30.53 C ATOM 1841 O ASN A 126 -7.982 5.393 15.661 1.00 20.55 O ATOM 1842 CB ASN A 126 -9.831 7.387 17.300 1.00 10.01 C ATOM 1843 CG ASN A 126 -10.190 8.008 18.639 1.00 15.44 C ATOM 1844 OD1 ASN A 126 -9.443 7.904 19.608 1.00 3.11 O ATOM 1845 ND2 ASN A 126 -11.334 8.660 18.708 1.00 61.21 N ATOM 0 H ASN A 126 -8.391 9.409 16.866 1.00 71.24 H new ATOM 0 HA ASN A 126 -7.863 6.727 17.871 1.00 15.33 H new ATOM 0 HB2 ASN A 126 -10.288 7.968 16.499 1.00 10.01 H new ATOM 0 HB3 ASN A 126 -10.250 6.382 17.244 1.00 10.01 H new ATOM 0 HD21 ASN A 126 -11.620 9.096 19.585 1.00 61.21 H new ATOM 0 HD22 ASN A 126 -11.932 8.728 17.885 1.00 61.21 H new ATOM 1852 N THR A 127 -7.750 7.418 14.702 1.00 62.23 N ATOM 1853 CA THR A 127 -7.395 6.881 13.380 1.00 14.35 C ATOM 1854 C THR A 127 -6.178 5.945 13.467 1.00 75.35 C ATOM 1855 O THR A 127 -6.064 4.977 12.710 1.00 74.40 O ATOM 1856 CB THR A 127 -7.089 8.018 12.371 1.00 41.43 C ATOM 1857 OG1 THR A 127 -8.176 8.958 12.337 1.00 4.45 O ATOM 1858 CG2 THR A 127 -6.862 7.463 10.966 1.00 21.42 C ATOM 0 H THR A 127 -7.781 8.437 14.746 1.00 62.23 H new ATOM 0 HA THR A 127 -8.258 6.316 13.028 1.00 14.35 H new ATOM 0 HB THR A 127 -6.179 8.518 12.702 1.00 41.43 H new ATOM 0 HG1 THR A 127 -8.154 9.453 11.491 1.00 4.45 H new ATOM 0 HG21 THR A 127 -6.650 8.284 10.281 1.00 21.42 H new ATOM 0 HG22 THR A 127 -6.018 6.773 10.979 1.00 21.42 H new ATOM 0 HG23 THR A 127 -7.756 6.935 10.634 1.00 21.42 H new ATOM 1866 N TYR A 128 -5.273 6.241 14.405 1.00 35.20 N ATOM 1867 CA TYR A 128 -4.105 5.385 14.662 1.00 24.35 C ATOM 1868 C TYR A 128 -4.534 3.943 14.995 1.00 75.31 C ATOM 1869 O TYR A 128 -3.983 2.983 14.458 1.00 4.42 O ATOM 1870 CB TYR A 128 -3.266 5.951 15.819 1.00 31.11 C ATOM 1871 CG TYR A 128 -2.669 7.326 15.550 1.00 52.43 C ATOM 1872 CD1 TYR A 128 -3.440 8.475 15.677 1.00 45.52 C ATOM 1873 CD2 TYR A 128 -1.334 7.473 15.182 1.00 52.52 C ATOM 1874 CE1 TYR A 128 -2.904 9.729 15.445 1.00 52.35 C ATOM 1875 CE2 TYR A 128 -0.789 8.725 14.952 1.00 54.44 C ATOM 1876 CZ TYR A 128 -1.578 9.849 15.085 1.00 34.20 C ATOM 1877 OH TYR A 128 -1.040 11.098 14.860 1.00 42.11 O ATOM 0 H TYR A 128 -5.325 7.067 15.001 1.00 35.20 H new ATOM 0 HA TYR A 128 -3.502 5.369 13.754 1.00 24.35 H new ATOM 0 HB2 TYR A 128 -3.890 6.008 16.711 1.00 31.11 H new ATOM 0 HB3 TYR A 128 -2.457 5.254 16.040 1.00 31.11 H new ATOM 0 HD1 TYR A 128 -4.478 8.387 15.962 1.00 45.52 H new ATOM 0 HD2 TYR A 128 -0.713 6.596 15.074 1.00 52.52 H new ATOM 0 HE1 TYR A 128 -3.521 10.610 15.545 1.00 52.35 H new ATOM 0 HE2 TYR A 128 0.249 8.821 14.670 1.00 54.44 H new ATOM 0 HH TYR A 128 -0.095 11.008 14.616 1.00 42.11 H new ATOM 1887 N LYS A 129 -5.537 3.812 15.871 1.00 70.13 N ATOM 1888 CA LYS A 129 -6.070 2.499 16.281 1.00 13.04 C ATOM 1889 C LYS A 129 -6.563 1.692 15.069 1.00 13.34 C ATOM 1890 O LYS A 129 -6.265 0.504 14.934 1.00 5.11 O ATOM 1891 CB LYS A 129 -7.219 2.692 17.282 1.00 73.21 C ATOM 1892 CG LYS A 129 -6.812 3.461 18.537 1.00 61.11 C ATOM 1893 CD LYS A 129 -8.013 3.808 19.417 1.00 25.03 C ATOM 1894 CE LYS A 129 -8.762 2.565 19.880 1.00 65.01 C ATOM 1895 NZ LYS A 129 -9.919 2.908 20.748 1.00 45.35 N ATOM 0 H LYS A 129 -6.002 4.604 16.315 1.00 70.13 H new ATOM 0 HA LYS A 129 -5.263 1.939 16.754 1.00 13.04 H new ATOM 0 HB2 LYS A 129 -8.034 3.222 16.789 1.00 73.21 H new ATOM 0 HB3 LYS A 129 -7.604 1.715 17.573 1.00 73.21 H new ATOM 0 HG2 LYS A 129 -6.103 2.866 19.112 1.00 61.11 H new ATOM 0 HG3 LYS A 129 -6.298 4.378 18.248 1.00 61.11 H new ATOM 0 HD2 LYS A 129 -7.674 4.371 20.286 1.00 25.03 H new ATOM 0 HD3 LYS A 129 -8.693 4.455 18.863 1.00 25.03 H new ATOM 0 HE2 LYS A 129 -9.112 2.007 19.011 1.00 65.01 H new ATOM 0 HE3 LYS A 129 -8.080 1.912 20.425 1.00 65.01 H new ATOM 0 HZ1 LYS A 129 -10.403 2.036 21.042 1.00 45.35 H new ATOM 0 HZ2 LYS A 129 -9.582 3.418 21.589 1.00 45.35 H new ATOM 0 HZ3 LYS A 129 -10.582 3.510 20.220 1.00 45.35 H new ATOM 1909 N LEU A 130 -7.321 2.352 14.192 1.00 53.40 N ATOM 1910 CA LEU A 130 -7.797 1.735 12.947 1.00 44.31 C ATOM 1911 C LEU A 130 -6.626 1.163 12.133 1.00 42.25 C ATOM 1912 O LEU A 130 -6.674 0.027 11.660 1.00 33.21 O ATOM 1913 CB LEU A 130 -8.559 2.767 12.103 1.00 12.32 C ATOM 1914 CG LEU A 130 -9.794 3.386 12.776 1.00 34.03 C ATOM 1915 CD1 LEU A 130 -10.395 4.477 11.896 1.00 35.42 C ATOM 1916 CD2 LEU A 130 -10.832 2.312 13.084 1.00 14.22 C ATOM 0 H LEU A 130 -7.621 3.318 14.319 1.00 53.40 H new ATOM 0 HA LEU A 130 -8.467 0.917 13.210 1.00 44.31 H new ATOM 0 HB2 LEU A 130 -7.872 3.570 11.834 1.00 12.32 H new ATOM 0 HB3 LEU A 130 -8.873 2.291 11.174 1.00 12.32 H new ATOM 0 HG LEU A 130 -9.480 3.839 13.716 1.00 34.03 H new ATOM 0 HD11 LEU A 130 -11.268 4.903 12.390 1.00 35.42 H new ATOM 0 HD12 LEU A 130 -9.655 5.259 11.730 1.00 35.42 H new ATOM 0 HD13 LEU A 130 -10.692 4.049 10.938 1.00 35.42 H new ATOM 0 HD21 LEU A 130 -11.699 2.770 13.560 1.00 14.22 H new ATOM 0 HD22 LEU A 130 -11.140 1.828 12.157 1.00 14.22 H new ATOM 0 HD23 LEU A 130 -10.399 1.570 13.755 1.00 14.22 H new ATOM 1928 N CYS A 131 -5.575 1.969 11.987 1.00 52.14 N ATOM 1929 CA CYS A 131 -4.357 1.555 11.279 1.00 2.40 C ATOM 1930 C CYS A 131 -3.737 0.301 11.918 1.00 75.24 C ATOM 1931 O CYS A 131 -3.408 -0.665 11.223 1.00 11.34 O ATOM 1932 CB CYS A 131 -3.334 2.698 11.285 1.00 31.11 C ATOM 1933 SG CYS A 131 -3.934 4.232 10.536 1.00 44.14 S ATOM 0 H CYS A 131 -5.540 2.921 12.352 1.00 52.14 H new ATOM 0 HA CYS A 131 -4.631 1.314 10.252 1.00 2.40 H new ATOM 0 HB2 CYS A 131 -3.038 2.901 12.314 1.00 31.11 H new ATOM 0 HB3 CYS A 131 -2.439 2.373 10.754 1.00 31.11 H new ATOM 0 HG CYS A 131 -4.203 4.026 9.281 1.00 44.14 H new ATOM 1939 N GLU A 132 -3.590 0.324 13.246 1.00 64.03 N ATOM 1940 CA GLU A 132 -3.013 -0.803 13.991 1.00 2.43 C ATOM 1941 C GLU A 132 -3.817 -2.100 13.771 1.00 13.03 C ATOM 1942 O GLU A 132 -3.248 -3.147 13.452 1.00 63.34 O ATOM 1943 CB GLU A 132 -2.947 -0.474 15.496 1.00 22.21 C ATOM 1944 CG GLU A 132 -2.121 0.769 15.823 1.00 12.43 C ATOM 1945 CD GLU A 132 -2.075 1.085 17.315 1.00 4.24 C ATOM 1946 OE1 GLU A 132 -3.146 1.362 17.902 1.00 63.22 O ATOM 1947 OE2 GLU A 132 -0.971 1.058 17.905 1.00 64.54 O ATOM 0 H GLU A 132 -3.863 1.114 13.831 1.00 64.03 H new ATOM 0 HA GLU A 132 -2.003 -0.964 13.613 1.00 2.43 H new ATOM 0 HB2 GLU A 132 -3.960 -0.334 15.872 1.00 22.21 H new ATOM 0 HB3 GLU A 132 -2.526 -1.328 16.026 1.00 22.21 H new ATOM 0 HG2 GLU A 132 -1.104 0.628 15.457 1.00 12.43 H new ATOM 0 HG3 GLU A 132 -2.537 1.624 15.290 1.00 12.43 H new ATOM 1954 N GLU A 133 -5.139 -2.023 13.931 1.00 12.53 N ATOM 1955 CA GLU A 133 -6.018 -3.197 13.789 1.00 4.02 C ATOM 1956 C GLU A 133 -6.119 -3.685 12.329 1.00 4.03 C ATOM 1957 O GLU A 133 -6.273 -4.882 12.074 1.00 62.43 O ATOM 1958 CB GLU A 133 -7.424 -2.878 14.327 1.00 14.52 C ATOM 1959 CG GLU A 133 -7.465 -2.593 15.826 1.00 71.21 C ATOM 1960 CD GLU A 133 -8.876 -2.335 16.338 1.00 74.01 C ATOM 1961 OE1 GLU A 133 -9.708 -3.263 16.284 1.00 4.44 O ATOM 1962 OE2 GLU A 133 -9.155 -1.211 16.811 1.00 0.33 O ATOM 0 H GLU A 133 -5.631 -1.159 14.160 1.00 12.53 H new ATOM 0 HA GLU A 133 -5.571 -4.001 14.374 1.00 4.02 H new ATOM 0 HB2 GLU A 133 -7.819 -2.014 13.792 1.00 14.52 H new ATOM 0 HB3 GLU A 133 -8.084 -3.717 14.109 1.00 14.52 H new ATOM 0 HG2 GLU A 133 -7.037 -3.439 16.364 1.00 71.21 H new ATOM 0 HG3 GLU A 133 -6.840 -1.727 16.044 1.00 71.21 H new ATOM 1969 N ALA A 134 -6.043 -2.759 11.377 1.00 41.01 N ATOM 1970 CA ALA A 134 -6.164 -3.106 9.955 1.00 11.43 C ATOM 1971 C ALA A 134 -4.870 -3.723 9.395 1.00 22.04 C ATOM 1972 O ALA A 134 -4.863 -4.868 8.940 1.00 70.43 O ATOM 1973 CB ALA A 134 -6.559 -1.876 9.143 1.00 44.23 C ATOM 0 H ALA A 134 -5.899 -1.766 11.558 1.00 41.01 H new ATOM 0 HA ALA A 134 -6.946 -3.861 9.870 1.00 11.43 H new ATOM 0 HB1 ALA A 134 -6.645 -2.147 8.091 1.00 44.23 H new ATOM 0 HB2 ALA A 134 -7.517 -1.497 9.500 1.00 44.23 H new ATOM 0 HB3 ALA A 134 -5.798 -1.104 9.258 1.00 44.23 H new ATOM 1979 N GLY A 135 -3.776 -2.963 9.445 1.00 73.51 N ATOM 1980 CA GLY A 135 -2.520 -3.404 8.838 1.00 25.33 C ATOM 1981 C GLY A 135 -1.908 -4.640 9.502 1.00 52.20 C ATOM 1982 O GLY A 135 -1.443 -5.556 8.819 1.00 72.35 O ATOM 0 H GLY A 135 -3.733 -2.048 9.895 1.00 73.51 H new ATOM 0 HA2 GLY A 135 -2.694 -3.619 7.784 1.00 25.33 H new ATOM 0 HA3 GLY A 135 -1.800 -2.587 8.882 1.00 25.33 H new ATOM 1986 N THR A 136 -1.913 -4.673 10.836 1.00 33.21 N ATOM 1987 CA THR A 136 -1.288 -5.776 11.585 1.00 1.40 C ATOM 1988 C THR A 136 -1.935 -7.134 11.264 1.00 34.23 C ATOM 1989 O THR A 136 -1.242 -8.143 11.155 1.00 13.23 O ATOM 1990 CB THR A 136 -1.350 -5.541 13.115 1.00 74.10 C ATOM 1991 OG1 THR A 136 -0.725 -4.292 13.442 1.00 5.11 O ATOM 1992 CG2 THR A 136 -0.657 -6.667 13.886 1.00 44.25 C ATOM 0 H THR A 136 -2.339 -3.955 11.422 1.00 33.21 H new ATOM 0 HA THR A 136 -0.246 -5.797 11.267 1.00 1.40 H new ATOM 0 HB THR A 136 -2.401 -5.522 13.405 1.00 74.10 H new ATOM 0 HG1 THR A 136 -1.411 -3.599 13.541 1.00 5.11 H new ATOM 0 HG21 THR A 136 -0.720 -6.468 14.956 1.00 44.25 H new ATOM 0 HG22 THR A 136 -1.146 -7.615 13.664 1.00 44.25 H new ATOM 0 HG23 THR A 136 0.390 -6.721 13.588 1.00 44.25 H new ATOM 2000 N ASP A 137 -3.260 -7.149 11.105 1.00 11.31 N ATOM 2001 CA ASP A 137 -3.988 -8.384 10.778 1.00 41.45 C ATOM 2002 C ASP A 137 -3.442 -9.020 9.487 1.00 33.10 C ATOM 2003 O ASP A 137 -3.125 -10.212 9.452 1.00 41.43 O ATOM 2004 CB ASP A 137 -5.486 -8.086 10.641 1.00 12.34 C ATOM 2005 CG ASP A 137 -6.315 -9.340 10.406 1.00 11.44 C ATOM 2006 OD1 ASP A 137 -6.631 -10.048 11.389 1.00 11.22 O ATOM 2007 OD2 ASP A 137 -6.660 -9.624 9.241 1.00 73.04 O ATOM 0 H ASP A 137 -3.853 -6.324 11.196 1.00 11.31 H new ATOM 0 HA ASP A 137 -3.842 -9.098 11.589 1.00 41.45 H new ATOM 0 HB2 ASP A 137 -5.837 -7.587 11.544 1.00 12.34 H new ATOM 0 HB3 ASP A 137 -5.640 -7.393 9.814 1.00 12.34 H new ATOM 2012 N LEU A 138 -3.319 -8.210 8.435 1.00 3.33 N ATOM 2013 CA LEU A 138 -2.740 -8.671 7.167 1.00 25.32 C ATOM 2014 C LEU A 138 -1.288 -9.133 7.361 1.00 64.42 C ATOM 2015 O LEU A 138 -0.863 -10.140 6.789 1.00 11.53 O ATOM 2016 CB LEU A 138 -2.810 -7.565 6.096 1.00 42.32 C ATOM 2017 CG LEU A 138 -4.202 -7.319 5.480 1.00 75.42 C ATOM 2018 CD1 LEU A 138 -4.741 -8.597 4.845 1.00 51.43 C ATOM 2019 CD2 LEU A 138 -5.182 -6.773 6.517 1.00 5.51 C ATOM 0 H LEU A 138 -3.611 -7.233 8.433 1.00 3.33 H new ATOM 0 HA LEU A 138 -3.328 -9.522 6.824 1.00 25.32 H new ATOM 0 HB2 LEU A 138 -2.459 -6.633 6.539 1.00 42.32 H new ATOM 0 HB3 LEU A 138 -2.117 -7.817 5.293 1.00 42.32 H new ATOM 0 HG LEU A 138 -4.094 -6.565 4.700 1.00 75.42 H new ATOM 0 HD11 LEU A 138 -5.724 -8.403 4.416 1.00 51.43 H new ATOM 0 HD12 LEU A 138 -4.061 -8.928 4.060 1.00 51.43 H new ATOM 0 HD13 LEU A 138 -4.824 -9.374 5.605 1.00 51.43 H new ATOM 0 HD21 LEU A 138 -6.153 -6.611 6.050 1.00 5.51 H new ATOM 0 HD22 LEU A 138 -5.286 -7.490 7.332 1.00 5.51 H new ATOM 0 HD23 LEU A 138 -4.806 -5.828 6.911 1.00 5.51 H new ATOM 2031 N GLY A 139 -0.534 -8.394 8.176 1.00 62.42 N ATOM 2032 CA GLY A 139 0.841 -8.777 8.486 1.00 0.20 C ATOM 2033 C GLY A 139 0.938 -10.152 9.137 1.00 25.44 C ATOM 2034 O GLY A 139 1.769 -10.978 8.752 1.00 13.42 O ATOM 0 H GLY A 139 -0.849 -7.536 8.628 1.00 62.42 H new ATOM 0 HA2 GLY A 139 1.430 -8.772 7.569 1.00 0.20 H new ATOM 0 HA3 GLY A 139 1.279 -8.033 9.151 1.00 0.20 H new ATOM 2038 N GLN A 140 0.070 -10.399 10.119 1.00 2.02 N ATOM 2039 CA GLN A 140 0.020 -11.687 10.822 1.00 72.04 C ATOM 2040 C GLN A 140 -0.386 -12.826 9.871 1.00 14.13 C ATOM 2041 O GLN A 140 0.141 -13.937 9.949 1.00 52.01 O ATOM 2042 CB GLN A 140 -0.972 -11.610 11.997 1.00 70.32 C ATOM 2043 CG GLN A 140 -0.594 -10.584 13.065 1.00 0.21 C ATOM 2044 CD GLN A 140 -1.627 -10.467 14.178 1.00 24.10 C ATOM 2045 OE1 GLN A 140 -2.554 -9.663 14.108 1.00 1.10 O ATOM 2046 NE2 GLN A 140 -1.479 -11.265 15.216 1.00 75.40 N ATOM 0 H GLN A 140 -0.615 -9.719 10.450 1.00 2.02 H new ATOM 0 HA GLN A 140 1.019 -11.900 11.203 1.00 72.04 H new ATOM 0 HB2 GLN A 140 -1.961 -11.367 11.609 1.00 70.32 H new ATOM 0 HB3 GLN A 140 -1.045 -12.593 12.462 1.00 70.32 H new ATOM 0 HG2 GLN A 140 0.368 -10.858 13.498 1.00 0.21 H new ATOM 0 HG3 GLN A 140 -0.465 -9.610 12.594 1.00 0.21 H new ATOM 0 HE21 GLN A 140 -0.700 -11.923 15.247 1.00 75.40 H new ATOM 0 HE22 GLN A 140 -2.144 -11.225 15.989 1.00 75.40 H new ATOM 2055 N TRP A 141 -1.327 -12.535 8.972 1.00 43.22 N ATOM 2056 CA TRP A 141 -1.829 -13.525 8.013 1.00 63.21 C ATOM 2057 C TRP A 141 -0.738 -13.964 7.017 1.00 15.34 C ATOM 2058 O TRP A 141 -0.409 -15.150 6.927 1.00 23.22 O ATOM 2059 CB TRP A 141 -3.041 -12.951 7.260 1.00 62.34 C ATOM 2060 CG TRP A 141 -3.602 -13.871 6.210 1.00 42.12 C ATOM 2061 CD1 TRP A 141 -4.193 -15.087 6.411 1.00 21.34 C ATOM 2062 CD2 TRP A 141 -3.635 -13.639 4.796 1.00 32.43 C ATOM 2063 NE1 TRP A 141 -4.583 -15.627 5.210 1.00 55.45 N ATOM 2064 CE2 TRP A 141 -4.252 -14.758 4.203 1.00 73.15 C ATOM 2065 CE3 TRP A 141 -3.201 -12.594 3.973 1.00 33.14 C ATOM 2066 CZ2 TRP A 141 -4.446 -14.859 2.827 1.00 3.42 C ATOM 2067 CZ3 TRP A 141 -3.393 -12.697 2.608 1.00 72.22 C ATOM 2068 CH2 TRP A 141 -4.010 -13.822 2.047 1.00 41.34 C ATOM 0 H TRP A 141 -1.761 -11.616 8.886 1.00 43.22 H new ATOM 0 HA TRP A 141 -2.133 -14.410 8.572 1.00 63.21 H new ATOM 0 HB2 TRP A 141 -3.825 -12.717 7.980 1.00 62.34 H new ATOM 0 HB3 TRP A 141 -2.751 -12.012 6.788 1.00 62.34 H new ATOM 0 HD1 TRP A 141 -4.333 -15.555 7.374 1.00 21.34 H new ATOM 0 HE1 TRP A 141 -5.044 -16.528 5.087 1.00 55.45 H new ATOM 0 HE3 TRP A 141 -2.724 -11.722 4.397 1.00 33.14 H new ATOM 0 HZ2 TRP A 141 -4.923 -15.724 2.391 1.00 3.42 H new ATOM 0 HZ3 TRP A 141 -3.062 -11.896 1.963 1.00 72.22 H new ATOM 0 HH2 TRP A 141 -4.145 -13.873 0.977 1.00 41.34 H new ATOM 2079 N VAL A 142 -0.174 -13.005 6.285 1.00 21.02 N ATOM 2080 CA VAL A 142 0.831 -13.303 5.253 1.00 64.32 C ATOM 2081 C VAL A 142 2.045 -14.066 5.819 1.00 11.14 C ATOM 2082 O VAL A 142 2.435 -15.107 5.284 1.00 24.02 O ATOM 2083 CB VAL A 142 1.324 -12.010 4.549 1.00 43.13 C ATOM 2084 CG1 VAL A 142 2.415 -12.317 3.518 1.00 15.14 C ATOM 2085 CG2 VAL A 142 0.157 -11.274 3.892 1.00 11.22 C ATOM 0 H VAL A 142 -0.392 -12.014 6.384 1.00 21.02 H new ATOM 0 HA VAL A 142 0.332 -13.942 4.525 1.00 64.32 H new ATOM 0 HB VAL A 142 1.757 -11.363 5.311 1.00 43.13 H new ATOM 0 HG11 VAL A 142 2.738 -11.391 3.043 1.00 15.14 H new ATOM 0 HG12 VAL A 142 3.264 -12.785 4.015 1.00 15.14 H new ATOM 0 HG13 VAL A 142 2.020 -12.994 2.761 1.00 15.14 H new ATOM 0 HG21 VAL A 142 0.525 -10.371 3.404 1.00 11.22 H new ATOM 0 HG22 VAL A 142 -0.311 -11.922 3.151 1.00 11.22 H new ATOM 0 HG23 VAL A 142 -0.576 -11.003 4.652 1.00 11.22 H new ATOM 2095 N THR A 143 2.637 -13.557 6.904 1.00 4.14 N ATOM 2096 CA THR A 143 3.844 -14.179 7.480 1.00 11.40 C ATOM 2097 C THR A 143 3.575 -15.607 7.977 1.00 10.24 C ATOM 2098 O THR A 143 4.421 -16.491 7.846 1.00 14.11 O ATOM 2099 CB THR A 143 4.430 -13.349 8.651 1.00 23.21 C ATOM 2100 OG1 THR A 143 5.700 -13.892 9.055 1.00 21.24 O ATOM 2101 CG2 THR A 143 3.486 -13.333 9.852 1.00 34.35 C ATOM 0 H THR A 143 2.309 -12.727 7.399 1.00 4.14 H new ATOM 0 HA THR A 143 4.570 -14.211 6.668 1.00 11.40 H new ATOM 0 HB THR A 143 4.559 -12.326 8.298 1.00 23.21 H new ATOM 0 HG1 THR A 143 6.063 -13.360 9.794 1.00 21.24 H new ATOM 0 HG21 THR A 143 3.928 -12.742 10.654 1.00 34.35 H new ATOM 0 HG22 THR A 143 2.533 -12.892 9.560 1.00 34.35 H new ATOM 0 HG23 THR A 143 3.323 -14.353 10.200 1.00 34.35 H new ATOM 2109 N ARG A 144 2.384 -15.830 8.538 1.00 73.12 N ATOM 2110 CA ARG A 144 2.034 -17.132 9.114 1.00 51.12 C ATOM 2111 C ARG A 144 1.570 -18.119 8.030 1.00 21.41 C ATOM 2112 O ARG A 144 1.634 -19.337 8.217 1.00 12.51 O ATOM 2113 CB ARG A 144 0.950 -16.963 10.190 1.00 25.24 C ATOM 2114 CG ARG A 144 0.800 -18.178 11.102 1.00 71.51 C ATOM 2115 CD ARG A 144 -0.195 -17.929 12.232 1.00 63.42 C ATOM 2116 NE ARG A 144 -0.175 -19.002 13.223 1.00 25.44 N ATOM 2117 CZ ARG A 144 -1.031 -19.118 14.203 1.00 44.31 C ATOM 2118 NH1 ARG A 144 -2.008 -18.277 14.336 1.00 64.02 N ATOM 2119 NH2 ARG A 144 -0.904 -20.081 15.051 1.00 21.50 N ATOM 0 H ARG A 144 1.647 -15.128 8.606 1.00 73.12 H new ATOM 0 HA ARG A 144 2.929 -17.547 9.577 1.00 51.12 H new ATOM 0 HB2 ARG A 144 1.186 -16.090 10.798 1.00 25.24 H new ATOM 0 HB3 ARG A 144 -0.005 -16.764 9.704 1.00 25.24 H new ATOM 0 HG2 ARG A 144 0.472 -19.034 10.513 1.00 71.51 H new ATOM 0 HG3 ARG A 144 1.771 -18.435 11.525 1.00 71.51 H new ATOM 0 HD2 ARG A 144 0.038 -16.982 12.718 1.00 63.42 H new ATOM 0 HD3 ARG A 144 -1.199 -17.836 11.818 1.00 63.42 H new ATOM 0 HE ARG A 144 0.557 -19.708 13.145 1.00 25.44 H new ATOM 0 HH11 ARG A 144 -2.116 -17.512 13.670 1.00 64.02 H new ATOM 0 HH12 ARG A 144 -2.669 -18.380 15.106 1.00 64.02 H new ATOM 0 HH21 ARG A 144 -0.138 -20.748 14.955 1.00 21.50 H new ATOM 0 HH22 ARG A 144 -1.570 -20.176 15.818 1.00 21.50 H new ATOM 2133 N ASP A 145 1.096 -17.594 6.900 1.00 74.31 N ATOM 2134 CA ASP A 145 0.713 -18.436 5.762 1.00 44.44 C ATOM 2135 C ASP A 145 1.961 -18.882 4.976 1.00 54.03 C ATOM 2136 O ASP A 145 2.130 -20.065 4.669 1.00 3.11 O ATOM 2137 CB ASP A 145 -0.258 -17.684 4.842 1.00 51.22 C ATOM 2138 CG ASP A 145 -0.863 -18.588 3.775 1.00 12.51 C ATOM 2139 OD1 ASP A 145 -0.194 -18.850 2.757 1.00 75.13 O ATOM 2140 OD2 ASP A 145 -2.005 -19.056 3.960 1.00 3.24 O ATOM 0 H ASP A 145 0.968 -16.594 6.746 1.00 74.31 H new ATOM 0 HA ASP A 145 0.210 -19.324 6.145 1.00 44.44 H new ATOM 0 HB2 ASP A 145 -1.057 -17.247 5.441 1.00 51.22 H new ATOM 0 HB3 ASP A 145 0.267 -16.859 4.361 1.00 51.22 H new ATOM 2145 N ARG A 146 2.845 -17.927 4.670 1.00 0.41 N ATOM 2146 CA ARG A 146 4.110 -18.221 3.976 1.00 72.22 C ATOM 2147 C ARG A 146 5.178 -18.778 4.941 1.00 62.43 C ATOM 2148 O ARG A 146 6.335 -18.965 4.556 1.00 52.41 O ATOM 2149 CB ARG A 146 4.656 -16.968 3.265 1.00 11.03 C ATOM 2150 CG ARG A 146 3.952 -16.603 1.952 1.00 44.32 C ATOM 2151 CD ARG A 146 2.583 -15.951 2.160 1.00 51.52 C ATOM 2152 NE ARG A 146 1.476 -16.820 1.759 1.00 33.30 N ATOM 2153 CZ ARG A 146 0.682 -16.585 0.746 1.00 12.01 C ATOM 2154 NH1 ARG A 146 0.907 -15.600 -0.063 1.00 25.14 N ATOM 2155 NH2 ARG A 146 -0.324 -17.364 0.530 1.00 21.15 N ATOM 0 H ARG A 146 2.710 -16.940 4.891 1.00 0.41 H new ATOM 0 HA ARG A 146 3.890 -18.986 3.231 1.00 72.22 H new ATOM 0 HB2 ARG A 146 4.580 -16.121 3.947 1.00 11.03 H new ATOM 0 HB3 ARG A 146 5.716 -17.119 3.061 1.00 11.03 H new ATOM 0 HG2 ARG A 146 4.588 -15.924 1.384 1.00 44.32 H new ATOM 0 HG3 ARG A 146 3.830 -17.504 1.351 1.00 44.32 H new ATOM 0 HD2 ARG A 146 2.468 -15.685 3.211 1.00 51.52 H new ATOM 0 HD3 ARG A 146 2.536 -15.024 1.589 1.00 51.52 H new ATOM 0 HE ARG A 146 1.312 -17.665 2.306 1.00 33.30 H new ATOM 0 HH11 ARG A 146 1.713 -14.993 0.084 1.00 25.14 H new ATOM 0 HH12 ARG A 146 0.278 -15.431 -0.848 1.00 25.14 H new ATOM 0 HH21 ARG A 146 -0.496 -18.157 1.147 1.00 21.15 H new ATOM 0 HH22 ARG A 146 -0.947 -17.186 -0.258 1.00 21.15 H new ATOM 2169 N LEU A 147 4.780 -19.041 6.190 1.00 21.15 N ATOM 2170 CA LEU A 147 5.688 -19.566 7.227 1.00 54.50 C ATOM 2171 C LEU A 147 6.322 -20.915 6.805 1.00 23.01 C ATOM 2172 O LEU A 147 7.246 -21.407 7.453 1.00 34.14 O ATOM 2173 CB LEU A 147 4.907 -19.704 8.555 1.00 60.45 C ATOM 2174 CG LEU A 147 5.721 -19.607 9.870 1.00 62.02 C ATOM 2175 CD1 LEU A 147 6.467 -20.905 10.183 1.00 40.02 C ATOM 2176 CD2 LEU A 147 6.694 -18.429 9.818 1.00 3.22 C ATOM 0 H LEU A 147 3.824 -18.898 6.514 1.00 21.15 H new ATOM 0 HA LEU A 147 6.512 -18.866 7.363 1.00 54.50 H new ATOM 0 HB2 LEU A 147 4.138 -18.932 8.576 1.00 60.45 H new ATOM 0 HB3 LEU A 147 4.393 -20.665 8.546 1.00 60.45 H new ATOM 0 HG LEU A 147 5.008 -19.439 10.677 1.00 62.02 H new ATOM 0 HD11 LEU A 147 7.023 -20.790 11.113 1.00 40.02 H new ATOM 0 HD12 LEU A 147 5.751 -21.720 10.287 1.00 40.02 H new ATOM 0 HD13 LEU A 147 7.159 -21.131 9.372 1.00 40.02 H new ATOM 0 HD21 LEU A 147 7.255 -18.379 10.751 1.00 3.22 H new ATOM 0 HD22 LEU A 147 7.385 -18.564 8.986 1.00 3.22 H new ATOM 0 HD23 LEU A 147 6.137 -17.503 9.680 1.00 3.22 H new