USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 811 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 Single : A 1 GLY N :NH3+ -129:sc= 0.0635 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.0348 X(o=-0.035,f=-0.34) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 7 TYR OH : rot 60:sc= -2.14 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 158:sc= -0.0286 (180deg=-0.211) USER MOD Single : A 15 HIS : no HD1:sc= -0.337 X(o=-0.34,f=-0.8) USER MOD Single : A 17 THR OG1 : rot 92:sc= 0.964 USER MOD Single : A 24 GLN : amide:sc= -0.701 K(o=-0.7,f=-1.4) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0.0197 USER MOD Single : A 42 SER OG : rot 120:sc= 0.77 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -2.33 K(o=-2.3,f=-8.1!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=0.4) USER MOD Single : A 61 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.22) USER MOD Single : A 62 SER OG : rot 180:sc= 0.185 USER MOD Single : A 73 SER OG : rot -164:sc= 0.39 USER MOD Single : A 77 SER OG : rot 180:sc= 0.0324 USER MOD Single : A 79 HIS : no HD1:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 89 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 101 ASN : amide:sc= -1.21 K(o=-1.2,f=-2.2) USER MOD Single : A 103 ASN : amide:sc= -0.0839 X(o=-0.084,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.205 0.724 0.191 1.00 43.04 N ATOM 2 CA GLY A 1 1.367 0.360 0.981 1.00 51.42 C ATOM 3 C GLY A 1 2.656 0.439 0.187 1.00 11.41 C ATOM 4 O GLY A 1 2.714 1.097 -0.851 1.00 10.22 O ATOM 0 H1 GLY A 1 -0.351 1.440 0.701 1.00 43.04 H new ATOM 0 H2 GLY A 1 0.514 1.112 -0.723 1.00 43.04 H new ATOM 0 H3 GLY A 1 -0.382 -0.119 0.028 1.00 43.04 H new ATOM 0 HA2 GLY A 1 1.436 1.020 1.846 1.00 51.42 H new ATOM 0 HA3 GLY A 1 1.240 -0.653 1.362 1.00 51.42 H new ATOM 8 N ASN A 2 3.693 -0.232 0.677 1.00 11.02 N ATOM 9 CA ASN A 2 4.988 -0.233 0.007 1.00 24.04 C ATOM 10 C ASN A 2 5.044 -1.315 -1.067 1.00 4.20 C ATOM 11 O ASN A 2 4.246 -2.251 -1.062 1.00 34.33 O ATOM 12 CB ASN A 2 6.111 -0.449 1.024 1.00 63.31 C ATOM 13 CG ASN A 2 6.817 0.842 1.389 1.00 44.11 C ATOM 14 OD1 ASN A 2 7.175 1.635 0.517 1.00 33.05 O ATOM 15 ND2 ASN A 2 7.022 1.059 2.683 1.00 62.01 N ATOM 0 H ASN A 2 3.662 -0.782 1.535 1.00 11.02 H new ATOM 0 HA ASN A 2 5.122 0.737 -0.472 1.00 24.04 H new ATOM 0 HB2 ASN A 2 5.699 -0.902 1.926 1.00 63.31 H new ATOM 0 HB3 ASN A 2 6.836 -1.154 0.616 1.00 63.31 H new ATOM 0 HD21 ASN A 2 7.493 1.910 2.989 1.00 62.01 H new ATOM 0 HD22 ASN A 2 6.708 0.374 3.371 1.00 62.01 H new ATOM 22 N SER A 3 5.994 -1.179 -1.987 1.00 1.10 N ATOM 23 CA SER A 3 6.153 -2.143 -3.070 1.00 0.43 C ATOM 24 C SER A 3 7.627 -2.331 -3.417 1.00 74.22 C ATOM 25 O SER A 3 8.087 -3.453 -3.625 1.00 31.41 O ATOM 26 CB SER A 3 5.380 -1.683 -4.307 1.00 42.15 C ATOM 27 OG SER A 3 3.993 -1.581 -4.034 1.00 64.12 O ATOM 0 H SER A 3 6.665 -0.411 -2.004 1.00 1.10 H new ATOM 0 HA SER A 3 5.752 -3.100 -2.735 1.00 0.43 H new ATOM 0 HB2 SER A 3 5.760 -0.717 -4.639 1.00 42.15 H new ATOM 0 HB3 SER A 3 5.542 -2.387 -5.123 1.00 42.15 H new ATOM 0 HG SER A 3 3.522 -1.284 -4.840 1.00 64.12 H new ATOM 33 N GLN A 4 8.360 -1.224 -3.478 1.00 71.44 N ATOM 34 CA GLN A 4 9.781 -1.267 -3.801 1.00 61.24 C ATOM 35 C GLN A 4 10.611 -1.593 -2.564 1.00 60.31 C ATOM 36 O GLN A 4 10.764 -0.760 -1.671 1.00 4.13 O ATOM 37 CB GLN A 4 10.231 0.069 -4.394 1.00 44.05 C ATOM 38 CG GLN A 4 9.341 0.565 -5.522 1.00 14.31 C ATOM 39 CD GLN A 4 9.771 1.918 -6.053 1.00 51.32 C ATOM 40 OE1 GLN A 4 10.306 2.746 -5.315 1.00 53.44 O ATOM 41 NE2 GLN A 4 9.539 2.150 -7.340 1.00 45.11 N ATOM 0 H GLN A 4 7.994 -0.287 -3.308 1.00 71.44 H new ATOM 0 HA GLN A 4 9.937 -2.055 -4.538 1.00 61.24 H new ATOM 0 HB2 GLN A 4 10.253 0.819 -3.603 1.00 44.05 H new ATOM 0 HB3 GLN A 4 11.251 -0.033 -4.765 1.00 44.05 H new ATOM 0 HG2 GLN A 4 9.353 -0.161 -6.335 1.00 14.31 H new ATOM 0 HG3 GLN A 4 8.312 0.629 -5.167 1.00 14.31 H new ATOM 0 HE21 GLN A 4 9.093 1.435 -7.915 1.00 45.11 H new ATOM 0 HE22 GLN A 4 9.807 3.043 -7.754 1.00 45.11 H new ATOM 50 N ILE A 5 11.143 -2.810 -2.519 1.00 4.23 N ATOM 51 CA ILE A 5 11.958 -3.245 -1.391 1.00 41.10 C ATOM 52 C ILE A 5 13.272 -3.856 -1.866 1.00 2.14 C ATOM 53 O ILE A 5 13.312 -4.563 -2.873 1.00 25.32 O ATOM 54 CB ILE A 5 11.212 -4.273 -0.521 1.00 35.22 C ATOM 55 CG1 ILE A 5 9.749 -3.859 -0.345 1.00 61.00 C ATOM 56 CG2 ILE A 5 11.893 -4.417 0.832 1.00 43.23 C ATOM 57 CD1 ILE A 5 9.579 -2.508 0.313 1.00 13.22 C ATOM 0 H ILE A 5 11.024 -3.512 -3.250 1.00 4.23 H new ATOM 0 HA ILE A 5 12.167 -2.359 -0.792 1.00 41.10 H new ATOM 0 HB ILE A 5 11.239 -5.240 -1.024 1.00 35.22 H new ATOM 0 HG12 ILE A 5 9.265 -3.842 -1.321 1.00 61.00 H new ATOM 0 HG13 ILE A 5 9.236 -4.612 0.253 1.00 61.00 H new ATOM 0 HG21 ILE A 5 11.353 -5.147 1.435 1.00 43.23 H new ATOM 0 HG22 ILE A 5 12.920 -4.753 0.689 1.00 43.23 H new ATOM 0 HG23 ILE A 5 11.894 -3.454 1.343 1.00 43.23 H new ATOM 0 HD11 ILE A 5 8.517 -2.279 0.406 1.00 13.22 H new ATOM 0 HD12 ILE A 5 10.034 -2.526 1.303 1.00 13.22 H new ATOM 0 HD13 ILE A 5 10.063 -1.744 -0.295 1.00 13.22 H new ATOM 69 N HIS A 6 14.346 -3.580 -1.132 1.00 51.43 N ATOM 70 CA HIS A 6 15.663 -4.104 -1.477 1.00 34.23 C ATOM 71 C HIS A 6 16.416 -4.546 -0.226 1.00 34.24 C ATOM 72 O HIS A 6 16.208 -4.004 0.860 1.00 1.30 O ATOM 73 CB HIS A 6 16.474 -3.049 -2.229 1.00 25.23 C ATOM 74 CG HIS A 6 16.516 -1.721 -1.538 1.00 51.21 C ATOM 75 ND1 HIS A 6 17.484 -1.382 -0.616 1.00 53.43 N ATOM 76 CD2 HIS A 6 15.702 -0.644 -1.641 1.00 1.05 C ATOM 77 CE1 HIS A 6 17.262 -0.154 -0.180 1.00 65.43 C ATOM 78 NE2 HIS A 6 16.187 0.316 -0.787 1.00 23.23 N ATOM 0 H HIS A 6 14.330 -2.997 -0.295 1.00 51.43 H new ATOM 0 HA HIS A 6 15.524 -4.972 -2.122 1.00 34.23 H new ATOM 0 HB2 HIS A 6 17.493 -3.413 -2.362 1.00 25.23 H new ATOM 0 HB3 HIS A 6 16.050 -2.918 -3.225 1.00 25.23 H new ATOM 0 HD2 HIS A 6 14.833 -0.556 -2.276 1.00 1.05 H new ATOM 0 HE1 HIS A 6 17.858 0.375 0.549 1.00 65.43 H new ATOM 0 HE2 HIS A 6 15.783 1.242 -0.645 1.00 23.23 H new ATOM 86 N TYR A 7 17.289 -5.534 -0.385 1.00 62.10 N ATOM 87 CA TYR A 7 18.071 -6.051 0.732 1.00 35.22 C ATOM 88 C TYR A 7 19.565 -5.968 0.437 1.00 50.33 C ATOM 89 O TYR A 7 19.971 -5.662 -0.684 1.00 64.54 O ATOM 90 CB TYR A 7 17.678 -7.499 1.029 1.00 22.51 C ATOM 91 CG TYR A 7 16.189 -7.750 0.960 1.00 14.53 C ATOM 92 CD1 TYR A 7 15.286 -6.838 1.494 1.00 33.40 C ATOM 93 CD2 TYR A 7 15.684 -8.897 0.360 1.00 1.14 C ATOM 94 CE1 TYR A 7 13.924 -7.063 1.434 1.00 21.40 C ATOM 95 CE2 TYR A 7 14.324 -9.129 0.295 1.00 71.45 C ATOM 96 CZ TYR A 7 13.448 -8.210 0.833 1.00 21.12 C ATOM 97 OH TYR A 7 12.092 -8.437 0.770 1.00 23.11 O ATOM 0 H TYR A 7 17.473 -5.993 -1.277 1.00 62.10 H new ATOM 0 HA TYR A 7 17.858 -5.436 1.607 1.00 35.22 H new ATOM 0 HB2 TYR A 7 18.182 -8.156 0.320 1.00 22.51 H new ATOM 0 HB3 TYR A 7 18.037 -7.767 2.022 1.00 22.51 H new ATOM 0 HD1 TYR A 7 15.655 -5.938 1.964 1.00 33.40 H new ATOM 0 HD2 TYR A 7 16.367 -9.619 -0.063 1.00 1.14 H new ATOM 0 HE1 TYR A 7 13.236 -6.345 1.855 1.00 21.40 H new ATOM 0 HE2 TYR A 7 13.948 -10.026 -0.175 1.00 71.45 H new ATOM 0 HH TYR A 7 11.661 -7.710 0.273 1.00 23.11 H new ATOM 107 N SER A 8 20.378 -6.242 1.452 1.00 64.05 N ATOM 108 CA SER A 8 21.828 -6.195 1.303 1.00 23.22 C ATOM 109 C SER A 8 22.468 -7.487 1.804 1.00 15.21 C ATOM 110 O SER A 8 22.129 -7.983 2.879 1.00 60.41 O ATOM 111 CB SER A 8 22.402 -5.000 2.066 1.00 12.33 C ATOM 112 OG SER A 8 22.038 -5.046 3.435 1.00 23.31 O ATOM 0 H SER A 8 20.058 -6.499 2.386 1.00 64.05 H new ATOM 0 HA SER A 8 22.056 -6.084 0.243 1.00 23.22 H new ATOM 0 HB2 SER A 8 23.488 -4.994 1.975 1.00 12.33 H new ATOM 0 HB3 SER A 8 22.040 -4.073 1.621 1.00 12.33 H new ATOM 0 HG SER A 8 22.419 -4.272 3.901 1.00 23.31 H new ATOM 118 N ILE A 9 23.393 -8.025 1.017 1.00 21.14 N ATOM 119 CA ILE A 9 24.081 -9.258 1.381 1.00 51.23 C ATOM 120 C ILE A 9 25.466 -9.322 0.745 1.00 33.54 C ATOM 121 O ILE A 9 25.622 -9.234 -0.473 1.00 31.34 O ATOM 122 CB ILE A 9 23.275 -10.499 0.955 1.00 54.13 C ATOM 123 CG1 ILE A 9 24.104 -11.768 1.160 1.00 31.25 C ATOM 124 CG2 ILE A 9 22.838 -10.374 -0.497 1.00 63.34 C ATOM 125 CD1 ILE A 9 23.329 -13.043 0.911 1.00 21.25 C ATOM 0 H ILE A 9 23.683 -7.627 0.124 1.00 21.14 H new ATOM 0 HA ILE A 9 24.181 -9.255 2.466 1.00 51.23 H new ATOM 0 HB ILE A 9 22.383 -10.566 1.578 1.00 54.13 H new ATOM 0 HG12 ILE A 9 24.966 -11.741 0.494 1.00 31.25 H new ATOM 0 HG13 ILE A 9 24.489 -11.780 2.180 1.00 31.25 H new ATOM 0 HG21 ILE A 9 22.269 -11.259 -0.783 1.00 63.34 H new ATOM 0 HG22 ILE A 9 22.214 -9.488 -0.614 1.00 63.34 H new ATOM 0 HG23 ILE A 9 23.717 -10.286 -1.135 1.00 63.34 H new ATOM 0 HD11 ILE A 9 23.979 -13.902 1.075 1.00 21.25 H new ATOM 0 HD12 ILE A 9 22.482 -13.093 1.595 1.00 21.25 H new ATOM 0 HD13 ILE A 9 22.966 -13.054 -0.117 1.00 21.25 H new ATOM 137 N PRO A 10 26.497 -9.482 1.589 1.00 54.14 N ATOM 138 CA PRO A 10 27.887 -9.565 1.132 1.00 1.31 C ATOM 139 C PRO A 10 28.174 -10.860 0.381 1.00 64.05 C ATOM 140 O PRO A 10 27.754 -11.938 0.801 1.00 45.43 O ATOM 141 CB PRO A 10 28.691 -9.512 2.433 1.00 4.24 C ATOM 142 CG PRO A 10 27.760 -10.028 3.475 1.00 3.04 C ATOM 143 CD PRO A 10 26.384 -9.594 3.053 1.00 70.35 C ATOM 0 HA PRO A 10 28.133 -8.769 0.429 1.00 1.31 H new ATOM 0 HB2 PRO A 10 29.591 -10.124 2.368 1.00 4.24 H new ATOM 0 HB3 PRO A 10 29.013 -8.495 2.658 1.00 4.24 H new ATOM 0 HG2 PRO A 10 27.821 -11.114 3.549 1.00 3.04 H new ATOM 0 HG3 PRO A 10 28.012 -9.627 4.457 1.00 3.04 H new ATOM 0 HD2 PRO A 10 25.626 -10.322 3.343 1.00 70.35 H new ATOM 0 HD3 PRO A 10 26.105 -8.644 3.509 1.00 70.35 H new ATOM 151 N GLU A 11 28.893 -10.746 -0.732 1.00 73.43 N ATOM 152 CA GLU A 11 29.235 -11.910 -1.542 1.00 2.03 C ATOM 153 C GLU A 11 29.787 -13.035 -0.671 1.00 21.10 C ATOM 154 O GLU A 11 30.180 -12.812 0.474 1.00 52.45 O ATOM 155 CB GLU A 11 30.259 -11.530 -2.613 1.00 65.11 C ATOM 156 CG GLU A 11 29.636 -10.970 -3.880 1.00 54.50 C ATOM 157 CD GLU A 11 30.463 -11.262 -5.117 1.00 3.35 C ATOM 158 OE1 GLU A 11 31.706 -11.176 -5.033 1.00 22.30 O ATOM 159 OE2 GLU A 11 29.867 -11.576 -6.168 1.00 62.10 O ATOM 0 H GLU A 11 29.249 -9.861 -1.093 1.00 73.43 H new ATOM 0 HA GLU A 11 28.326 -12.263 -2.028 1.00 2.03 H new ATOM 0 HB2 GLU A 11 30.947 -10.792 -2.200 1.00 65.11 H new ATOM 0 HB3 GLU A 11 30.850 -12.410 -2.867 1.00 65.11 H new ATOM 0 HG2 GLU A 11 28.639 -11.392 -4.007 1.00 54.50 H new ATOM 0 HG3 GLU A 11 29.515 -9.892 -3.775 1.00 54.50 H new ATOM 166 N GLU A 12 29.813 -14.244 -1.223 1.00 35.43 N ATOM 167 CA GLU A 12 30.315 -15.404 -0.496 1.00 32.42 C ATOM 168 C GLU A 12 29.437 -15.710 0.715 1.00 43.33 C ATOM 169 O GLU A 12 29.874 -16.363 1.662 1.00 12.52 O ATOM 170 CB GLU A 12 31.758 -15.167 -0.046 1.00 50.14 C ATOM 171 CG GLU A 12 32.555 -16.447 0.142 1.00 2.42 C ATOM 172 CD GLU A 12 33.356 -16.450 1.430 1.00 63.43 C ATOM 173 OE1 GLU A 12 34.257 -15.597 1.571 1.00 31.33 O ATOM 174 OE2 GLU A 12 33.082 -17.307 2.296 1.00 73.31 O ATOM 0 H GLU A 12 29.493 -14.445 -2.170 1.00 35.43 H new ATOM 0 HA GLU A 12 30.288 -16.261 -1.169 1.00 32.42 H new ATOM 0 HB2 GLU A 12 32.261 -14.541 -0.783 1.00 50.14 H new ATOM 0 HB3 GLU A 12 31.751 -14.612 0.892 1.00 50.14 H new ATOM 0 HG2 GLU A 12 31.874 -17.298 0.140 1.00 2.42 H new ATOM 0 HG3 GLU A 12 33.231 -16.577 -0.703 1.00 2.42 H new ATOM 181 N ALA A 13 28.198 -15.232 0.675 1.00 12.13 N ATOM 182 CA ALA A 13 27.258 -15.454 1.767 1.00 22.32 C ATOM 183 C ALA A 13 26.821 -16.914 1.827 1.00 63.13 C ATOM 184 O ALA A 13 26.063 -17.381 0.976 1.00 23.45 O ATOM 185 CB ALA A 13 26.048 -14.545 1.615 1.00 11.15 C ATOM 0 H ALA A 13 27.822 -14.688 -0.102 1.00 12.13 H new ATOM 0 HA ALA A 13 27.763 -15.214 2.703 1.00 22.32 H new ATOM 0 HB1 ALA A 13 25.355 -14.722 2.437 1.00 11.15 H new ATOM 0 HB2 ALA A 13 26.371 -13.504 1.630 1.00 11.15 H new ATOM 0 HB3 ALA A 13 25.550 -14.757 0.669 1.00 11.15 H new ATOM 191 N LYS A 14 27.305 -17.631 2.836 1.00 54.23 N ATOM 192 CA LYS A 14 26.964 -19.038 3.007 1.00 21.14 C ATOM 193 C LYS A 14 25.470 -19.209 3.263 1.00 60.22 C ATOM 194 O LYS A 14 24.816 -18.317 3.803 1.00 2.54 O ATOM 195 CB LYS A 14 27.763 -19.640 4.166 1.00 15.41 C ATOM 196 CG LYS A 14 27.594 -18.888 5.475 1.00 22.34 C ATOM 197 CD LYS A 14 28.904 -18.271 5.936 1.00 12.22 C ATOM 198 CE LYS A 14 29.010 -18.256 7.454 1.00 55.25 C ATOM 199 NZ LYS A 14 29.180 -19.626 8.011 1.00 23.11 N ATOM 0 H LYS A 14 27.935 -17.260 3.548 1.00 54.23 H new ATOM 0 HA LYS A 14 27.219 -19.562 2.086 1.00 21.14 H new ATOM 0 HB2 LYS A 14 27.455 -20.676 4.309 1.00 15.41 H new ATOM 0 HB3 LYS A 14 28.820 -19.655 3.899 1.00 15.41 H new ATOM 0 HG2 LYS A 14 26.845 -18.105 5.352 1.00 22.34 H new ATOM 0 HG3 LYS A 14 27.221 -19.568 6.241 1.00 22.34 H new ATOM 0 HD2 LYS A 14 29.739 -18.833 5.518 1.00 12.22 H new ATOM 0 HD3 LYS A 14 28.982 -17.253 5.555 1.00 12.22 H new ATOM 0 HE2 LYS A 14 29.854 -17.635 7.753 1.00 55.25 H new ATOM 0 HE3 LYS A 14 28.114 -17.801 7.876 1.00 55.25 H new ATOM 0 HZ1 LYS A 14 29.611 -19.566 8.956 1.00 23.11 H new ATOM 0 HZ2 LYS A 14 28.252 -20.089 8.083 1.00 23.11 H new ATOM 0 HZ3 LYS A 14 29.796 -20.182 7.384 1.00 23.11 H new ATOM 213 N HIS A 15 24.936 -20.362 2.872 1.00 15.10 N ATOM 214 CA HIS A 15 23.518 -20.650 3.061 1.00 23.40 C ATOM 215 C HIS A 15 23.103 -20.408 4.509 1.00 52.31 C ATOM 216 O HIS A 15 23.679 -20.978 5.434 1.00 35.43 O ATOM 217 CB HIS A 15 23.213 -22.096 2.666 1.00 4.31 C ATOM 218 CG HIS A 15 23.611 -22.429 1.261 1.00 33.21 C ATOM 219 ND1 HIS A 15 24.873 -22.866 0.920 1.00 62.43 N ATOM 220 CD2 HIS A 15 22.903 -22.389 0.108 1.00 63.32 C ATOM 221 CE1 HIS A 15 24.926 -23.079 -0.383 1.00 73.11 C ATOM 222 NE2 HIS A 15 23.743 -22.798 -0.899 1.00 51.52 N ATOM 0 H HIS A 15 25.463 -21.111 2.423 1.00 15.10 H new ATOM 0 HA HIS A 15 22.947 -19.978 2.421 1.00 23.40 H new ATOM 0 HB2 HIS A 15 23.731 -22.768 3.351 1.00 4.31 H new ATOM 0 HB3 HIS A 15 22.145 -22.279 2.786 1.00 4.31 H new ATOM 0 HD2 HIS A 15 21.871 -22.091 -0.000 1.00 63.32 H new ATOM 0 HE1 HIS A 15 25.789 -23.424 -0.932 1.00 73.11 H new ATOM 0 HE2 HIS A 15 23.494 -22.873 -1.885 1.00 51.52 H new ATOM 230 N GLY A 16 22.099 -19.556 4.697 1.00 43.11 N ATOM 231 CA GLY A 16 21.625 -19.252 6.034 1.00 32.24 C ATOM 232 C GLY A 16 22.063 -17.880 6.508 1.00 63.55 C ATOM 233 O GLY A 16 21.858 -17.520 7.667 1.00 3.21 O ATOM 0 H GLY A 16 21.606 -19.071 3.947 1.00 43.11 H new ATOM 0 HA2 GLY A 16 20.537 -19.308 6.052 1.00 32.24 H new ATOM 0 HA3 GLY A 16 21.995 -20.007 6.727 1.00 32.24 H new ATOM 237 N THR A 17 22.671 -17.112 5.609 1.00 72.25 N ATOM 238 CA THR A 17 23.142 -15.774 5.941 1.00 42.33 C ATOM 239 C THR A 17 22.011 -14.755 5.855 1.00 61.35 C ATOM 240 O THR A 17 21.140 -14.851 4.989 1.00 23.44 O ATOM 241 CB THR A 17 24.286 -15.333 5.008 1.00 62.40 C ATOM 242 OG1 THR A 17 25.411 -16.205 5.167 1.00 71.31 O ATOM 243 CG2 THR A 17 24.703 -13.900 5.302 1.00 24.44 C ATOM 0 H THR A 17 22.849 -17.394 4.645 1.00 72.25 H new ATOM 0 HA THR A 17 23.513 -15.816 6.965 1.00 42.33 H new ATOM 0 HB THR A 17 23.928 -15.386 3.980 1.00 62.40 H new ATOM 0 HG1 THR A 17 25.352 -16.937 4.518 1.00 71.31 H new ATOM 0 HG21 THR A 17 25.512 -13.611 4.631 1.00 24.44 H new ATOM 0 HG22 THR A 17 23.852 -13.235 5.152 1.00 24.44 H new ATOM 0 HG23 THR A 17 25.044 -13.825 6.335 1.00 24.44 H new ATOM 251 N PHE A 18 22.030 -13.779 6.756 1.00 30.32 N ATOM 252 CA PHE A 18 21.005 -12.742 6.782 1.00 70.31 C ATOM 253 C PHE A 18 21.144 -11.811 5.582 1.00 52.54 C ATOM 254 O PHE A 18 22.234 -11.322 5.283 1.00 32.22 O ATOM 255 CB PHE A 18 21.096 -11.937 8.080 1.00 62.41 C ATOM 256 CG PHE A 18 20.413 -10.602 8.006 1.00 1.23 C ATOM 257 CD1 PHE A 18 19.103 -10.502 7.566 1.00 61.30 C ATOM 258 CD2 PHE A 18 21.081 -9.446 8.378 1.00 54.00 C ATOM 259 CE1 PHE A 18 18.473 -9.274 7.497 1.00 74.44 C ATOM 260 CE2 PHE A 18 20.455 -8.215 8.311 1.00 20.21 C ATOM 261 CZ PHE A 18 19.149 -8.130 7.871 1.00 51.42 C ATOM 0 H PHE A 18 22.744 -13.684 7.478 1.00 30.32 H new ATOM 0 HA PHE A 18 20.031 -13.228 6.732 1.00 70.31 H new ATOM 0 HB2 PHE A 18 20.655 -12.518 8.890 1.00 62.41 H new ATOM 0 HB3 PHE A 18 22.146 -11.786 8.332 1.00 62.41 H new ATOM 0 HD1 PHE A 18 18.568 -11.394 7.274 1.00 61.30 H new ATOM 0 HD2 PHE A 18 22.102 -9.507 8.724 1.00 54.00 H new ATOM 0 HE1 PHE A 18 17.452 -9.209 7.151 1.00 74.44 H new ATOM 0 HE2 PHE A 18 20.987 -7.321 8.602 1.00 20.21 H new ATOM 0 HZ PHE A 18 18.657 -7.170 7.820 1.00 51.42 H new ATOM 271 N VAL A 19 20.031 -11.569 4.896 1.00 41.23 N ATOM 272 CA VAL A 19 20.027 -10.696 3.728 1.00 1.41 C ATOM 273 C VAL A 19 19.215 -9.432 3.989 1.00 33.34 C ATOM 274 O VAL A 19 19.709 -8.318 3.824 1.00 64.22 O ATOM 275 CB VAL A 19 19.455 -11.414 2.492 1.00 72.22 C ATOM 276 CG1 VAL A 19 19.624 -10.555 1.248 1.00 1.34 C ATOM 277 CG2 VAL A 19 20.121 -12.769 2.308 1.00 70.41 C ATOM 0 H VAL A 19 19.121 -11.965 5.129 1.00 41.23 H new ATOM 0 HA VAL A 19 21.064 -10.424 3.533 1.00 1.41 H new ATOM 0 HB VAL A 19 18.389 -11.576 2.649 1.00 72.22 H new ATOM 0 HG11 VAL A 19 19.214 -11.080 0.385 1.00 1.34 H new ATOM 0 HG12 VAL A 19 19.096 -9.611 1.383 1.00 1.34 H new ATOM 0 HG13 VAL A 19 20.683 -10.358 1.083 1.00 1.34 H new ATOM 0 HG21 VAL A 19 19.705 -13.263 1.430 1.00 70.41 H new ATOM 0 HG22 VAL A 19 21.194 -12.632 2.173 1.00 70.41 H new ATOM 0 HG23 VAL A 19 19.942 -13.385 3.189 1.00 70.41 H new ATOM 287 N GLY A 20 17.963 -9.614 4.400 1.00 61.22 N ATOM 288 CA GLY A 20 17.101 -8.480 4.678 1.00 24.22 C ATOM 289 C GLY A 20 15.776 -8.894 5.286 1.00 70.51 C ATOM 290 O GLY A 20 15.469 -10.084 5.371 1.00 5.35 O ATOM 0 H GLY A 20 17.531 -10.526 4.545 1.00 61.22 H new ATOM 0 HA2 GLY A 20 17.612 -7.798 5.358 1.00 24.22 H new ATOM 0 HA3 GLY A 20 16.918 -7.932 3.754 1.00 24.22 H new ATOM 294 N ARG A 21 14.989 -7.912 5.710 1.00 15.34 N ATOM 295 CA ARG A 21 13.690 -8.181 6.316 1.00 11.31 C ATOM 296 C ARG A 21 12.565 -7.965 5.308 1.00 12.12 C ATOM 297 O ARG A 21 12.014 -6.868 5.203 1.00 22.53 O ATOM 298 CB ARG A 21 13.476 -7.282 7.535 1.00 21.05 C ATOM 299 CG ARG A 21 14.694 -7.183 8.440 1.00 35.01 C ATOM 300 CD ARG A 21 15.266 -5.774 8.451 1.00 22.33 C ATOM 301 NE ARG A 21 16.219 -5.562 7.365 1.00 22.32 N ATOM 302 CZ ARG A 21 16.559 -4.362 6.909 1.00 12.33 C ATOM 303 NH1 ARG A 21 16.026 -3.271 7.443 1.00 70.30 N ATOM 304 NH2 ARG A 21 17.433 -4.250 5.918 1.00 64.23 N ATOM 0 H ARG A 21 15.227 -6.922 5.645 1.00 15.34 H new ATOM 0 HA ARG A 21 13.675 -9.223 6.635 1.00 11.31 H new ATOM 0 HB2 ARG A 21 13.204 -6.283 7.196 1.00 21.05 H new ATOM 0 HB3 ARG A 21 12.634 -7.663 8.113 1.00 21.05 H new ATOM 0 HG2 ARG A 21 14.420 -7.474 9.454 1.00 35.01 H new ATOM 0 HG3 ARG A 21 15.457 -7.884 8.103 1.00 35.01 H new ATOM 0 HD2 ARG A 21 14.454 -5.052 8.366 1.00 22.33 H new ATOM 0 HD3 ARG A 21 15.758 -5.590 9.406 1.00 22.33 H new ATOM 0 HE ARG A 21 16.647 -6.381 6.933 1.00 22.32 H new ATOM 0 HH11 ARG A 21 15.353 -3.353 8.206 1.00 70.30 H new ATOM 0 HH12 ARG A 21 16.289 -2.350 7.091 1.00 70.30 H new ATOM 0 HH21 ARG A 21 17.845 -5.086 5.505 1.00 64.23 H new ATOM 0 HH22 ARG A 21 17.693 -3.327 5.569 1.00 64.23 H new ATOM 318 N ILE A 22 12.229 -9.017 4.569 1.00 24.15 N ATOM 319 CA ILE A 22 11.170 -8.942 3.571 1.00 21.50 C ATOM 320 C ILE A 22 9.817 -8.678 4.223 1.00 24.25 C ATOM 321 O ILE A 22 9.035 -7.858 3.744 1.00 62.21 O ATOM 322 CB ILE A 22 11.084 -10.239 2.744 1.00 51.43 C ATOM 323 CG1 ILE A 22 9.952 -10.141 1.718 1.00 3.25 C ATOM 324 CG2 ILE A 22 10.876 -11.437 3.657 1.00 22.33 C ATOM 325 CD1 ILE A 22 10.175 -10.994 0.489 1.00 3.52 C ATOM 0 H ILE A 22 12.675 -9.931 4.643 1.00 24.15 H new ATOM 0 HA ILE A 22 11.419 -8.113 2.908 1.00 21.50 H new ATOM 0 HB ILE A 22 12.024 -10.374 2.209 1.00 51.43 H new ATOM 0 HG12 ILE A 22 9.016 -10.438 2.192 1.00 3.25 H new ATOM 0 HG13 ILE A 22 9.838 -9.101 1.413 1.00 3.25 H new ATOM 0 HG21 ILE A 22 10.817 -12.345 3.058 1.00 22.33 H new ATOM 0 HG22 ILE A 22 11.712 -11.514 4.352 1.00 22.33 H new ATOM 0 HG23 ILE A 22 9.949 -11.311 4.217 1.00 22.33 H new ATOM 0 HD11 ILE A 22 9.334 -10.875 -0.194 1.00 3.52 H new ATOM 0 HD12 ILE A 22 11.093 -10.682 -0.009 1.00 3.52 H new ATOM 0 HD13 ILE A 22 10.259 -12.040 0.783 1.00 3.52 H new ATOM 337 N ALA A 23 9.549 -9.378 5.321 1.00 4.33 N ATOM 338 CA ALA A 23 8.293 -9.216 6.042 1.00 0.04 C ATOM 339 C ALA A 23 8.224 -7.855 6.727 1.00 24.34 C ATOM 340 O ALA A 23 7.183 -7.200 6.721 1.00 10.40 O ATOM 341 CB ALA A 23 8.123 -10.332 7.063 1.00 53.24 C ATOM 0 H ALA A 23 10.185 -10.062 5.730 1.00 4.33 H new ATOM 0 HA ALA A 23 7.479 -9.271 5.320 1.00 0.04 H new ATOM 0 HB1 ALA A 23 7.181 -10.199 7.594 1.00 53.24 H new ATOM 0 HB2 ALA A 23 8.118 -11.295 6.552 1.00 53.24 H new ATOM 0 HB3 ALA A 23 8.948 -10.303 7.775 1.00 53.24 H new ATOM 347 N GLN A 24 9.340 -7.438 7.317 1.00 31.04 N ATOM 348 CA GLN A 24 9.404 -6.155 8.008 1.00 64.40 C ATOM 349 C GLN A 24 9.148 -5.004 7.042 1.00 42.52 C ATOM 350 O GLN A 24 8.430 -4.057 7.365 1.00 31.32 O ATOM 351 CB GLN A 24 10.769 -5.981 8.678 1.00 75.12 C ATOM 352 CG GLN A 24 10.768 -4.957 9.801 1.00 21.14 C ATOM 353 CD GLN A 24 10.818 -3.531 9.291 1.00 54.51 C ATOM 354 OE1 GLN A 24 9.808 -2.825 9.286 1.00 61.42 O ATOM 355 NE2 GLN A 24 11.996 -3.097 8.858 1.00 54.01 N ATOM 0 H GLN A 24 10.211 -7.969 7.330 1.00 31.04 H new ATOM 0 HA GLN A 24 8.627 -6.143 8.773 1.00 64.40 H new ATOM 0 HB2 GLN A 24 11.095 -6.943 9.074 1.00 75.12 H new ATOM 0 HB3 GLN A 24 11.499 -5.682 7.925 1.00 75.12 H new ATOM 0 HG2 GLN A 24 9.873 -5.090 10.408 1.00 21.14 H new ATOM 0 HG3 GLN A 24 11.624 -5.136 10.452 1.00 21.14 H new ATOM 0 HE21 GLN A 24 12.807 -3.715 8.880 1.00 54.01 H new ATOM 0 HE22 GLN A 24 12.090 -2.145 8.503 1.00 54.01 H new ATOM 364 N ASP A 25 9.740 -5.090 5.856 1.00 62.02 N ATOM 365 CA ASP A 25 9.576 -4.055 4.842 1.00 74.03 C ATOM 366 C ASP A 25 8.207 -4.159 4.176 1.00 31.31 C ATOM 367 O ASP A 25 7.756 -3.226 3.510 1.00 33.24 O ATOM 368 CB ASP A 25 10.679 -4.164 3.788 1.00 53.51 C ATOM 369 CG ASP A 25 11.937 -3.420 4.189 1.00 44.34 C ATOM 370 OD1 ASP A 25 11.837 -2.220 4.523 1.00 22.53 O ATOM 371 OD2 ASP A 25 13.023 -4.037 4.168 1.00 14.14 O ATOM 0 H ASP A 25 10.338 -5.866 5.573 1.00 62.02 H new ATOM 0 HA ASP A 25 9.649 -3.085 5.333 1.00 74.03 H new ATOM 0 HB2 ASP A 25 10.918 -5.215 3.624 1.00 53.51 H new ATOM 0 HB3 ASP A 25 10.313 -3.769 2.841 1.00 53.51 H new ATOM 376 N LEU A 26 7.551 -5.300 4.359 1.00 63.00 N ATOM 377 CA LEU A 26 6.234 -5.527 3.775 1.00 33.34 C ATOM 378 C LEU A 26 5.131 -5.065 4.723 1.00 24.40 C ATOM 379 O LEU A 26 4.139 -4.476 4.297 1.00 2.10 O ATOM 380 CB LEU A 26 6.050 -7.009 3.444 1.00 34.44 C ATOM 381 CG LEU A 26 6.236 -7.398 1.977 1.00 5.33 C ATOM 382 CD1 LEU A 26 7.579 -6.903 1.461 1.00 54.21 C ATOM 383 CD2 LEU A 26 6.120 -8.905 1.806 1.00 71.24 C ATOM 0 H LEU A 26 7.910 -6.082 4.907 1.00 63.00 H new ATOM 0 HA LEU A 26 6.166 -4.945 2.856 1.00 33.34 H new ATOM 0 HB2 LEU A 26 6.755 -7.585 4.044 1.00 34.44 H new ATOM 0 HB3 LEU A 26 5.049 -7.308 3.754 1.00 34.44 H new ATOM 0 HG LEU A 26 5.447 -6.925 1.392 1.00 5.33 H new ATOM 0 HD11 LEU A 26 7.695 -7.189 0.415 1.00 54.21 H new ATOM 0 HD12 LEU A 26 7.624 -5.817 1.548 1.00 54.21 H new ATOM 0 HD13 LEU A 26 8.381 -7.348 2.050 1.00 54.21 H new ATOM 0 HD21 LEU A 26 6.255 -9.163 0.756 1.00 71.24 H new ATOM 0 HD22 LEU A 26 6.887 -9.399 2.403 1.00 71.24 H new ATOM 0 HD23 LEU A 26 5.135 -9.234 2.137 1.00 71.24 H new ATOM 395 N GLY A 27 5.314 -5.336 6.012 1.00 0.00 N ATOM 396 CA GLY A 27 4.328 -4.939 7.000 1.00 21.22 C ATOM 397 C GLY A 27 3.299 -6.021 7.259 1.00 75.20 C ATOM 398 O GLY A 27 2.107 -5.737 7.388 1.00 50.11 O ATOM 0 H GLY A 27 6.127 -5.823 6.389 1.00 0.00 H new ATOM 0 HA2 GLY A 27 4.833 -4.691 7.934 1.00 21.22 H new ATOM 0 HA3 GLY A 27 3.822 -4.035 6.661 1.00 21.22 H new ATOM 402 N LEU A 28 3.757 -7.266 7.334 1.00 52.23 N ATOM 403 CA LEU A 28 2.867 -8.396 7.577 1.00 14.40 C ATOM 404 C LEU A 28 3.444 -9.325 8.640 1.00 12.42 C ATOM 405 O LEU A 28 4.653 -9.548 8.692 1.00 12.10 O ATOM 406 CB LEU A 28 2.629 -9.171 6.280 1.00 33.43 C ATOM 407 CG LEU A 28 3.550 -8.823 5.111 1.00 43.20 C ATOM 408 CD1 LEU A 28 4.971 -9.284 5.395 1.00 23.04 C ATOM 409 CD2 LEU A 28 3.034 -9.444 3.821 1.00 20.24 C ATOM 0 H LEU A 28 4.740 -7.518 7.230 1.00 52.23 H new ATOM 0 HA LEU A 28 1.916 -8.006 7.940 1.00 14.40 H new ATOM 0 HB2 LEU A 28 2.731 -10.235 6.492 1.00 33.43 H new ATOM 0 HB3 LEU A 28 1.598 -9.006 5.966 1.00 33.43 H new ATOM 0 HG LEU A 28 3.558 -7.740 4.991 1.00 43.20 H new ATOM 0 HD11 LEU A 28 5.612 -9.028 4.552 1.00 23.04 H new ATOM 0 HD12 LEU A 28 5.340 -8.791 6.294 1.00 23.04 H new ATOM 0 HD13 LEU A 28 4.980 -10.364 5.543 1.00 23.04 H new ATOM 0 HD21 LEU A 28 3.703 -9.185 3.000 1.00 20.24 H new ATOM 0 HD22 LEU A 28 2.995 -10.528 3.929 1.00 20.24 H new ATOM 0 HD23 LEU A 28 2.035 -9.064 3.609 1.00 20.24 H new ATOM 421 N GLU A 29 2.570 -9.864 9.485 1.00 64.44 N ATOM 422 CA GLU A 29 2.994 -10.770 10.546 1.00 64.55 C ATOM 423 C GLU A 29 3.441 -12.111 9.970 1.00 70.23 C ATOM 424 O GLU A 29 2.836 -12.628 9.029 1.00 24.32 O ATOM 425 CB GLU A 29 1.858 -10.986 11.547 1.00 72.21 C ATOM 426 CG GLU A 29 2.222 -10.607 12.972 1.00 2.24 C ATOM 427 CD GLU A 29 1.041 -10.060 13.751 1.00 43.24 C ATOM 428 OE1 GLU A 29 -0.003 -10.742 13.803 1.00 61.31 O ATOM 429 OE2 GLU A 29 1.162 -8.948 14.308 1.00 63.54 O ATOM 0 H GLU A 29 1.566 -9.689 9.455 1.00 64.44 H new ATOM 0 HA GLU A 29 3.840 -10.315 11.061 1.00 64.55 H new ATOM 0 HB2 GLU A 29 0.993 -10.401 11.234 1.00 72.21 H new ATOM 0 HB3 GLU A 29 1.559 -12.034 11.524 1.00 72.21 H new ATOM 0 HG2 GLU A 29 2.618 -11.482 13.487 1.00 2.24 H new ATOM 0 HG3 GLU A 29 3.017 -9.861 12.954 1.00 2.24 H new ATOM 436 N LEU A 30 4.503 -12.669 10.540 1.00 3.21 N ATOM 437 CA LEU A 30 5.033 -13.950 10.084 1.00 14.52 C ATOM 438 C LEU A 30 3.978 -15.046 10.198 1.00 25.14 C ATOM 439 O LEU A 30 4.070 -16.082 9.539 1.00 23.44 O ATOM 440 CB LEU A 30 6.271 -14.330 10.897 1.00 21.32 C ATOM 441 CG LEU A 30 7.268 -13.203 11.170 1.00 72.14 C ATOM 442 CD1 LEU A 30 8.539 -13.755 11.795 1.00 5.43 C ATOM 443 CD2 LEU A 30 7.586 -12.451 9.886 1.00 51.43 C ATOM 0 H LEU A 30 5.015 -12.255 11.319 1.00 3.21 H new ATOM 0 HA LEU A 30 5.313 -13.848 9.035 1.00 14.52 H new ATOM 0 HB2 LEU A 30 5.942 -14.736 11.853 1.00 21.32 H new ATOM 0 HB3 LEU A 30 6.793 -15.131 10.373 1.00 21.32 H new ATOM 0 HG LEU A 30 6.815 -12.505 11.874 1.00 72.14 H new ATOM 0 HD11 LEU A 30 9.237 -12.939 11.982 1.00 5.43 H new ATOM 0 HD12 LEU A 30 8.297 -14.248 12.736 1.00 5.43 H new ATOM 0 HD13 LEU A 30 8.996 -14.474 11.115 1.00 5.43 H new ATOM 0 HD21 LEU A 30 8.297 -11.653 10.099 1.00 51.43 H new ATOM 0 HD22 LEU A 30 8.019 -13.139 9.159 1.00 51.43 H new ATOM 0 HD23 LEU A 30 6.670 -12.023 9.479 1.00 51.43 H new ATOM 455 N THR A 31 2.975 -14.810 11.038 1.00 71.21 N ATOM 456 CA THR A 31 1.903 -15.777 11.238 1.00 55.41 C ATOM 457 C THR A 31 0.771 -15.556 10.241 1.00 54.01 C ATOM 458 O THR A 31 -0.256 -16.232 10.294 1.00 22.55 O ATOM 459 CB THR A 31 1.335 -15.698 12.668 1.00 53.14 C ATOM 460 OG1 THR A 31 1.134 -14.330 13.040 1.00 12.03 O ATOM 461 CG2 THR A 31 2.274 -16.367 13.660 1.00 15.33 C ATOM 0 H THR A 31 2.883 -13.958 11.591 1.00 71.21 H new ATOM 0 HA THR A 31 2.335 -16.765 11.081 1.00 55.41 H new ATOM 0 HB THR A 31 0.380 -16.222 12.686 1.00 53.14 H new ATOM 0 HG1 THR A 31 0.771 -14.288 13.949 1.00 12.03 H new ATOM 0 HG21 THR A 31 1.852 -16.299 14.663 1.00 15.33 H new ATOM 0 HG22 THR A 31 2.401 -17.415 13.390 1.00 15.33 H new ATOM 0 HG23 THR A 31 3.242 -15.867 13.639 1.00 15.33 H new ATOM 469 N GLU A 32 0.966 -14.606 9.332 1.00 54.31 N ATOM 470 CA GLU A 32 -0.041 -14.297 8.323 1.00 44.03 C ATOM 471 C GLU A 32 0.448 -14.685 6.930 1.00 23.33 C ATOM 472 O GLU A 32 -0.343 -14.811 5.995 1.00 61.24 O ATOM 473 CB GLU A 32 -0.388 -12.807 8.356 1.00 32.21 C ATOM 474 CG GLU A 32 -1.877 -12.527 8.244 1.00 13.03 C ATOM 475 CD GLU A 32 -2.686 -13.232 9.316 1.00 23.11 C ATOM 476 OE1 GLU A 32 -2.820 -12.669 10.423 1.00 75.40 O ATOM 477 OE2 GLU A 32 -3.183 -14.346 9.049 1.00 51.34 O ATOM 0 H GLU A 32 1.811 -14.038 9.273 1.00 54.31 H new ATOM 0 HA GLU A 32 -0.936 -14.876 8.550 1.00 44.03 H new ATOM 0 HB2 GLU A 32 -0.015 -12.376 9.285 1.00 32.21 H new ATOM 0 HB3 GLU A 32 0.130 -12.304 7.540 1.00 32.21 H new ATOM 0 HG2 GLU A 32 -2.047 -11.453 8.314 1.00 13.03 H new ATOM 0 HG3 GLU A 32 -2.229 -12.843 7.262 1.00 13.03 H new ATOM 484 N LEU A 33 1.757 -14.873 6.800 1.00 30.14 N ATOM 485 CA LEU A 33 2.353 -15.246 5.522 1.00 22.55 C ATOM 486 C LEU A 33 1.915 -16.646 5.105 1.00 35.52 C ATOM 487 O LEU A 33 1.598 -16.888 3.940 1.00 10.03 O ATOM 488 CB LEU A 33 3.879 -15.183 5.611 1.00 20.03 C ATOM 489 CG LEU A 33 4.508 -13.808 5.385 1.00 51.20 C ATOM 490 CD1 LEU A 33 4.041 -12.826 6.448 1.00 54.31 C ATOM 491 CD2 LEU A 33 6.026 -13.910 5.381 1.00 2.20 C ATOM 0 H LEU A 33 2.426 -14.773 7.564 1.00 30.14 H new ATOM 0 HA LEU A 33 2.009 -14.538 4.768 1.00 22.55 H new ATOM 0 HB2 LEU A 33 4.181 -15.541 6.595 1.00 20.03 H new ATOM 0 HB3 LEU A 33 4.295 -15.875 4.879 1.00 20.03 H new ATOM 0 HG LEU A 33 4.186 -13.438 4.411 1.00 51.20 H new ATOM 0 HD11 LEU A 33 4.499 -11.853 6.271 1.00 54.31 H new ATOM 0 HD12 LEU A 33 2.956 -12.730 6.403 1.00 54.31 H new ATOM 0 HD13 LEU A 33 4.333 -13.190 7.433 1.00 54.31 H new ATOM 0 HD21 LEU A 33 6.457 -12.922 5.219 1.00 2.20 H new ATOM 0 HD22 LEU A 33 6.367 -14.302 6.339 1.00 2.20 H new ATOM 0 HD23 LEU A 33 6.344 -14.580 4.582 1.00 2.20 H new ATOM 503 N VAL A 34 1.896 -17.566 6.065 1.00 1.00 N ATOM 504 CA VAL A 34 1.493 -18.941 5.798 1.00 33.54 C ATOM 505 C VAL A 34 0.130 -18.992 5.116 1.00 22.23 C ATOM 506 O VAL A 34 -0.022 -19.527 4.018 1.00 34.31 O ATOM 507 CB VAL A 34 1.437 -19.771 7.095 1.00 72.32 C ATOM 508 CG1 VAL A 34 0.375 -20.855 6.990 1.00 71.33 C ATOM 509 CG2 VAL A 34 2.799 -20.376 7.399 1.00 2.21 C ATOM 0 H VAL A 34 2.155 -17.383 7.034 1.00 1.00 H new ATOM 0 HA VAL A 34 2.244 -19.368 5.134 1.00 33.54 H new ATOM 0 HB VAL A 34 1.167 -19.109 7.918 1.00 72.32 H new ATOM 0 HG11 VAL A 34 0.350 -21.431 7.915 1.00 71.33 H new ATOM 0 HG12 VAL A 34 -0.599 -20.395 6.822 1.00 71.33 H new ATOM 0 HG13 VAL A 34 0.612 -21.517 6.157 1.00 71.33 H new ATOM 0 HG21 VAL A 34 2.741 -20.959 8.318 1.00 2.21 H new ATOM 0 HG22 VAL A 34 3.101 -21.024 6.577 1.00 2.21 H new ATOM 0 HG23 VAL A 34 3.532 -19.579 7.520 1.00 2.21 H new ATOM 519 N PRO A 35 -0.886 -18.422 5.781 1.00 43.43 N ATOM 520 CA PRO A 35 -2.254 -18.388 5.257 1.00 53.41 C ATOM 521 C PRO A 35 -2.392 -17.461 4.054 1.00 43.31 C ATOM 522 O PRO A 35 -3.379 -17.522 3.321 1.00 11.41 O ATOM 523 CB PRO A 35 -3.073 -17.857 6.437 1.00 63.23 C ATOM 524 CG PRO A 35 -2.102 -17.072 7.249 1.00 45.44 C ATOM 525 CD PRO A 35 -0.776 -17.765 7.094 1.00 33.24 C ATOM 0 HA PRO A 35 -2.578 -19.366 4.901 1.00 53.41 H new ATOM 0 HB2 PRO A 35 -3.900 -17.233 6.096 1.00 63.23 H new ATOM 0 HB3 PRO A 35 -3.506 -18.672 7.017 1.00 63.23 H new ATOM 0 HG2 PRO A 35 -2.046 -16.041 6.901 1.00 45.44 H new ATOM 0 HG3 PRO A 35 -2.405 -17.039 8.295 1.00 45.44 H new ATOM 0 HD2 PRO A 35 0.053 -17.058 7.121 1.00 33.24 H new ATOM 0 HD3 PRO A 35 -0.605 -18.488 7.892 1.00 33.24 H new ATOM 533 N ARG A 36 -1.395 -16.604 3.856 1.00 13.21 N ATOM 534 CA ARG A 36 -1.406 -15.664 2.742 1.00 40.41 C ATOM 535 C ARG A 36 -0.773 -16.285 1.500 1.00 11.12 C ATOM 536 O ARG A 36 -0.498 -15.594 0.518 1.00 0.34 O ATOM 537 CB ARG A 36 -0.661 -14.383 3.121 1.00 45.54 C ATOM 538 CG ARG A 36 -1.534 -13.354 3.821 1.00 63.13 C ATOM 539 CD ARG A 36 -0.737 -12.119 4.209 1.00 2.42 C ATOM 540 NE ARG A 36 -1.374 -11.375 5.293 1.00 42.34 N ATOM 541 CZ ARG A 36 -2.504 -10.691 5.149 1.00 22.35 C ATOM 542 NH1 ARG A 36 -3.118 -10.658 3.975 1.00 33.11 N ATOM 543 NH2 ARG A 36 -3.022 -10.040 6.183 1.00 42.52 N ATOM 0 H ARG A 36 -0.570 -16.542 4.453 1.00 13.21 H new ATOM 0 HA ARG A 36 -2.444 -15.419 2.516 1.00 40.41 H new ATOM 0 HB2 ARG A 36 0.176 -14.639 3.770 1.00 45.54 H new ATOM 0 HB3 ARG A 36 -0.241 -13.937 2.220 1.00 45.54 H new ATOM 0 HG2 ARG A 36 -2.356 -13.067 3.166 1.00 63.13 H new ATOM 0 HG3 ARG A 36 -1.977 -13.797 4.713 1.00 63.13 H new ATOM 0 HD2 ARG A 36 0.266 -12.416 4.514 1.00 2.42 H new ATOM 0 HD3 ARG A 36 -0.627 -11.471 3.340 1.00 2.42 H new ATOM 0 HE ARG A 36 -0.927 -11.381 6.210 1.00 42.34 H new ATOM 0 HH11 ARG A 36 -2.723 -11.159 3.179 1.00 33.11 H new ATOM 0 HH12 ARG A 36 -3.985 -10.132 3.868 1.00 33.11 H new ATOM 0 HH21 ARG A 36 -2.553 -10.065 7.088 1.00 42.52 H new ATOM 0 HH22 ARG A 36 -3.889 -9.515 6.072 1.00 42.52 H new ATOM 557 N LEU A 37 -0.544 -17.592 1.551 1.00 73.54 N ATOM 558 CA LEU A 37 0.057 -18.308 0.430 1.00 12.22 C ATOM 559 C LEU A 37 1.315 -17.597 -0.057 1.00 62.05 C ATOM 560 O LEU A 37 1.430 -17.252 -1.234 1.00 14.12 O ATOM 561 CB LEU A 37 -0.947 -18.435 -0.717 1.00 35.54 C ATOM 562 CG LEU A 37 -1.922 -19.611 -0.628 1.00 1.53 C ATOM 563 CD1 LEU A 37 -1.173 -20.932 -0.704 1.00 50.12 C ATOM 564 CD2 LEU A 37 -2.738 -19.531 0.654 1.00 23.14 C ATOM 0 H LEU A 37 -0.765 -18.178 2.356 1.00 73.54 H new ATOM 0 HA LEU A 37 0.334 -19.305 0.774 1.00 12.22 H new ATOM 0 HB2 LEU A 37 -1.525 -17.513 -0.771 1.00 35.54 H new ATOM 0 HB3 LEU A 37 -0.392 -18.519 -1.652 1.00 35.54 H new ATOM 0 HG LEU A 37 -2.606 -19.556 -1.475 1.00 1.53 H new ATOM 0 HD11 LEU A 37 -1.883 -21.757 -0.639 1.00 50.12 H new ATOM 0 HD12 LEU A 37 -0.634 -20.991 -1.649 1.00 50.12 H new ATOM 0 HD13 LEU A 37 -0.465 -20.997 0.122 1.00 50.12 H new ATOM 0 HD21 LEU A 37 -3.426 -20.375 0.701 1.00 23.14 H new ATOM 0 HD22 LEU A 37 -2.069 -19.561 1.514 1.00 23.14 H new ATOM 0 HD23 LEU A 37 -3.305 -18.600 0.667 1.00 23.14 H new ATOM 576 N PHE A 38 2.258 -17.383 0.854 1.00 64.02 N ATOM 577 CA PHE A 38 3.510 -16.715 0.516 1.00 12.35 C ATOM 578 C PHE A 38 4.378 -17.602 -0.371 1.00 40.41 C ATOM 579 O PHE A 38 4.447 -18.815 -0.176 1.00 74.35 O ATOM 580 CB PHE A 38 4.274 -16.344 1.789 1.00 12.22 C ATOM 581 CG PHE A 38 4.950 -15.005 1.714 1.00 43.14 C ATOM 582 CD1 PHE A 38 4.221 -13.836 1.859 1.00 34.15 C ATOM 583 CD2 PHE A 38 6.316 -14.915 1.497 1.00 31.14 C ATOM 584 CE1 PHE A 38 4.841 -12.603 1.790 1.00 54.15 C ATOM 585 CE2 PHE A 38 6.942 -13.685 1.427 1.00 54.41 C ATOM 586 CZ PHE A 38 6.203 -12.527 1.574 1.00 31.02 C ATOM 0 H PHE A 38 2.180 -17.662 1.832 1.00 64.02 H new ATOM 0 HA PHE A 38 3.270 -15.805 -0.034 1.00 12.35 H new ATOM 0 HB2 PHE A 38 3.583 -16.346 2.632 1.00 12.22 H new ATOM 0 HB3 PHE A 38 5.023 -17.110 1.989 1.00 12.22 H new ATOM 0 HD1 PHE A 38 3.156 -13.889 2.028 1.00 34.15 H new ATOM 0 HD2 PHE A 38 6.898 -15.817 1.381 1.00 31.14 H new ATOM 0 HE1 PHE A 38 4.261 -11.699 1.905 1.00 54.15 H new ATOM 0 HE2 PHE A 38 8.007 -13.629 1.258 1.00 54.41 H new ATOM 0 HZ PHE A 38 6.689 -11.564 1.520 1.00 31.02 H new ATOM 596 N ARG A 39 5.039 -16.986 -1.346 1.00 71.54 N ATOM 597 CA ARG A 39 5.901 -17.719 -2.265 1.00 62.44 C ATOM 598 C ARG A 39 6.993 -16.813 -2.826 1.00 40.23 C ATOM 599 O ARG A 39 6.842 -15.592 -2.864 1.00 3.44 O ATOM 600 CB ARG A 39 5.077 -18.311 -3.410 1.00 54.22 C ATOM 601 CG ARG A 39 5.250 -19.812 -3.573 1.00 70.03 C ATOM 602 CD ARG A 39 4.144 -20.581 -2.866 1.00 45.53 C ATOM 603 NE ARG A 39 3.861 -21.856 -3.519 1.00 21.14 N ATOM 604 CZ ARG A 39 3.136 -22.821 -2.963 1.00 2.40 C ATOM 605 NH1 ARG A 39 2.624 -22.655 -1.751 1.00 72.04 N ATOM 606 NH2 ARG A 39 2.922 -23.953 -3.620 1.00 21.52 N ATOM 0 H ARG A 39 4.994 -15.982 -1.520 1.00 71.54 H new ATOM 0 HA ARG A 39 6.374 -18.529 -1.710 1.00 62.44 H new ATOM 0 HB2 ARG A 39 4.023 -18.092 -3.239 1.00 54.22 H new ATOM 0 HB3 ARG A 39 5.358 -17.818 -4.341 1.00 54.22 H new ATOM 0 HG2 ARG A 39 5.251 -20.066 -4.633 1.00 70.03 H new ATOM 0 HG3 ARG A 39 6.218 -20.113 -3.172 1.00 70.03 H new ATOM 0 HD2 ARG A 39 4.432 -20.760 -1.830 1.00 45.53 H new ATOM 0 HD3 ARG A 39 3.238 -19.976 -2.845 1.00 45.53 H new ATOM 0 HE ARG A 39 4.240 -22.015 -4.452 1.00 21.14 H new ATOM 0 HH11 ARG A 39 2.786 -21.785 -1.244 1.00 72.04 H new ATOM 0 HH12 ARG A 39 2.068 -23.397 -1.326 1.00 72.04 H new ATOM 0 HH21 ARG A 39 3.314 -24.083 -4.553 1.00 21.52 H new ATOM 0 HH22 ARG A 39 2.365 -24.693 -3.193 1.00 21.52 H new ATOM 620 N VAL A 40 8.093 -17.419 -3.261 1.00 61.33 N ATOM 621 CA VAL A 40 9.210 -16.668 -3.821 1.00 1.54 C ATOM 622 C VAL A 40 9.627 -17.229 -5.175 1.00 70.03 C ATOM 623 O VAL A 40 9.637 -18.443 -5.379 1.00 43.40 O ATOM 624 CB VAL A 40 10.426 -16.682 -2.875 1.00 71.01 C ATOM 625 CG1 VAL A 40 11.609 -15.973 -3.516 1.00 2.44 C ATOM 626 CG2 VAL A 40 10.070 -16.044 -1.541 1.00 21.44 C ATOM 0 H VAL A 40 8.234 -18.429 -3.236 1.00 61.33 H new ATOM 0 HA VAL A 40 8.868 -15.641 -3.947 1.00 1.54 H new ATOM 0 HB VAL A 40 10.710 -17.718 -2.692 1.00 71.01 H new ATOM 0 HG11 VAL A 40 12.459 -15.993 -2.833 1.00 2.44 H new ATOM 0 HG12 VAL A 40 11.877 -16.479 -4.444 1.00 2.44 H new ATOM 0 HG13 VAL A 40 11.340 -14.939 -3.731 1.00 2.44 H new ATOM 0 HG21 VAL A 40 10.940 -16.062 -0.885 1.00 21.44 H new ATOM 0 HG22 VAL A 40 9.759 -15.012 -1.703 1.00 21.44 H new ATOM 0 HG23 VAL A 40 9.255 -16.600 -1.078 1.00 21.44 H new ATOM 636 N ALA A 41 9.971 -16.337 -6.099 1.00 33.31 N ATOM 637 CA ALA A 41 10.391 -16.744 -7.434 1.00 41.30 C ATOM 638 C ALA A 41 11.266 -15.676 -8.083 1.00 21.53 C ATOM 639 O ALA A 41 11.148 -14.491 -7.773 1.00 24.14 O ATOM 640 CB ALA A 41 9.177 -17.034 -8.304 1.00 62.11 C ATOM 0 H ALA A 41 9.967 -15.328 -5.947 1.00 33.31 H new ATOM 0 HA ALA A 41 10.983 -17.655 -7.340 1.00 41.30 H new ATOM 0 HB1 ALA A 41 9.506 -17.337 -9.298 1.00 62.11 H new ATOM 0 HB2 ALA A 41 8.591 -17.836 -7.855 1.00 62.11 H new ATOM 0 HB3 ALA A 41 8.563 -16.137 -8.383 1.00 62.11 H new ATOM 646 N SER A 42 12.144 -16.105 -8.984 1.00 60.00 N ATOM 647 CA SER A 42 13.042 -15.186 -9.673 1.00 63.12 C ATOM 648 C SER A 42 13.141 -15.533 -11.156 1.00 5.24 C ATOM 649 O SER A 42 12.868 -16.663 -11.561 1.00 51.31 O ATOM 650 CB SER A 42 14.432 -15.224 -9.035 1.00 3.50 C ATOM 651 OG SER A 42 15.448 -15.193 -10.023 1.00 30.33 O ATOM 0 H SER A 42 12.253 -17.083 -9.254 1.00 60.00 H new ATOM 0 HA SER A 42 12.634 -14.179 -9.579 1.00 63.12 H new ATOM 0 HB2 SER A 42 14.550 -14.375 -8.361 1.00 3.50 H new ATOM 0 HB3 SER A 42 14.534 -16.126 -8.432 1.00 3.50 H new ATOM 0 HG SER A 42 16.011 -14.402 -9.889 1.00 30.33 H new ATOM 657 N LYS A 43 13.535 -14.552 -11.961 1.00 70.00 N ATOM 658 CA LYS A 43 13.672 -14.751 -13.399 1.00 4.21 C ATOM 659 C LYS A 43 14.984 -15.457 -13.728 1.00 10.23 C ATOM 660 O LYS A 43 15.266 -15.753 -14.889 1.00 23.01 O ATOM 661 CB LYS A 43 13.607 -13.407 -14.129 1.00 23.22 C ATOM 662 CG LYS A 43 14.745 -12.466 -13.773 1.00 12.23 C ATOM 663 CD LYS A 43 15.819 -12.457 -14.848 1.00 33.14 C ATOM 664 CE LYS A 43 15.326 -11.788 -16.122 1.00 24.41 C ATOM 665 NZ LYS A 43 16.420 -11.621 -17.119 1.00 1.14 N ATOM 0 H LYS A 43 13.765 -13.611 -11.642 1.00 70.00 H new ATOM 0 HA LYS A 43 12.847 -15.380 -13.734 1.00 4.21 H new ATOM 0 HB2 LYS A 43 13.618 -13.586 -15.204 1.00 23.22 H new ATOM 0 HB3 LYS A 43 12.659 -12.922 -13.896 1.00 23.22 H new ATOM 0 HG2 LYS A 43 14.355 -11.457 -13.639 1.00 12.23 H new ATOM 0 HG3 LYS A 43 15.184 -12.768 -12.822 1.00 12.23 H new ATOM 0 HD2 LYS A 43 16.701 -11.934 -14.479 1.00 33.14 H new ATOM 0 HD3 LYS A 43 16.124 -13.480 -15.068 1.00 33.14 H new ATOM 0 HE2 LYS A 43 14.524 -12.384 -16.559 1.00 24.41 H new ATOM 0 HE3 LYS A 43 14.903 -10.813 -15.880 1.00 24.41 H new ATOM 0 HZ1 LYS A 43 16.044 -11.162 -17.973 1.00 1.14 H new ATOM 0 HZ2 LYS A 43 17.174 -11.031 -16.712 1.00 1.14 H new ATOM 0 HZ3 LYS A 43 16.807 -12.553 -17.369 1.00 1.14 H new ATOM 679 N ASP A 44 15.780 -15.725 -12.699 1.00 3.42 N ATOM 680 CA ASP A 44 17.061 -16.399 -12.878 1.00 40.34 C ATOM 681 C ASP A 44 16.925 -17.898 -12.632 1.00 61.15 C ATOM 682 O ASP A 44 16.834 -18.686 -13.574 1.00 43.33 O ATOM 683 CB ASP A 44 18.109 -15.807 -11.935 1.00 24.44 C ATOM 684 CG ASP A 44 18.957 -14.743 -12.604 1.00 72.52 C ATOM 685 OD1 ASP A 44 18.526 -14.212 -13.649 1.00 60.24 O ATOM 686 OD2 ASP A 44 20.050 -14.441 -12.083 1.00 22.33 O ATOM 0 H ASP A 44 15.561 -15.486 -11.732 1.00 3.42 H new ATOM 0 HA ASP A 44 17.384 -16.246 -13.908 1.00 40.34 H new ATOM 0 HB2 ASP A 44 17.610 -15.377 -11.067 1.00 24.44 H new ATOM 0 HB3 ASP A 44 18.755 -16.605 -11.568 1.00 24.44 H new ATOM 691 N ARG A 45 16.913 -18.285 -11.361 1.00 61.42 N ATOM 692 CA ARG A 45 16.791 -19.690 -10.992 1.00 32.43 C ATOM 693 C ARG A 45 15.597 -19.907 -10.066 1.00 24.21 C ATOM 694 O ARG A 45 15.115 -21.028 -9.911 1.00 32.14 O ATOM 695 CB ARG A 45 18.073 -20.174 -10.311 1.00 35.11 C ATOM 696 CG ARG A 45 18.981 -20.980 -11.225 1.00 33.30 C ATOM 697 CD ARG A 45 20.274 -21.367 -10.525 1.00 30.41 C ATOM 698 NE ARG A 45 21.153 -22.149 -11.391 1.00 55.11 N ATOM 699 CZ ARG A 45 22.244 -22.772 -10.961 1.00 43.41 C ATOM 700 NH1 ARG A 45 22.589 -22.705 -9.683 1.00 4.23 N ATOM 701 NH2 ARG A 45 22.993 -23.463 -11.811 1.00 30.45 N ATOM 0 H ARG A 45 16.986 -17.646 -10.570 1.00 61.42 H new ATOM 0 HA ARG A 45 16.632 -20.267 -11.903 1.00 32.43 H new ATOM 0 HB2 ARG A 45 18.623 -19.311 -9.936 1.00 35.11 H new ATOM 0 HB3 ARG A 45 17.808 -20.783 -9.447 1.00 35.11 H new ATOM 0 HG2 ARG A 45 18.461 -21.880 -11.555 1.00 33.30 H new ATOM 0 HG3 ARG A 45 19.209 -20.398 -12.118 1.00 33.30 H new ATOM 0 HD2 ARG A 45 20.794 -20.466 -10.200 1.00 30.41 H new ATOM 0 HD3 ARG A 45 20.043 -21.943 -9.629 1.00 30.41 H new ATOM 0 HE ARG A 45 20.916 -22.220 -12.380 1.00 55.11 H new ATOM 0 HH11 ARG A 45 22.016 -22.174 -9.027 1.00 4.23 H new ATOM 0 HH12 ARG A 45 23.428 -23.184 -9.355 1.00 4.23 H new ATOM 0 HH21 ARG A 45 22.731 -23.516 -12.795 1.00 30.45 H new ATOM 0 HH22 ARG A 45 23.831 -23.941 -11.480 1.00 30.45 H new ATOM 715 N GLY A 46 15.127 -18.826 -9.452 1.00 55.43 N ATOM 716 CA GLY A 46 13.994 -18.919 -8.549 1.00 44.12 C ATOM 717 C GLY A 46 14.327 -19.676 -7.279 1.00 2.43 C ATOM 718 O GLY A 46 13.439 -19.996 -6.488 1.00 62.14 O ATOM 0 H GLY A 46 15.510 -17.887 -9.563 1.00 55.43 H new ATOM 0 HA2 GLY A 46 13.655 -17.916 -8.292 1.00 44.12 H new ATOM 0 HA3 GLY A 46 13.167 -19.415 -9.058 1.00 44.12 H new ATOM 722 N ASP A 47 15.609 -19.963 -7.082 1.00 20.40 N ATOM 723 CA ASP A 47 16.057 -20.688 -5.899 1.00 21.25 C ATOM 724 C ASP A 47 17.311 -20.048 -5.312 1.00 2.03 C ATOM 725 O ASP A 47 18.099 -20.708 -4.632 1.00 74.25 O ATOM 726 CB ASP A 47 16.331 -22.153 -6.244 1.00 41.45 C ATOM 727 CG ASP A 47 15.988 -23.091 -5.104 1.00 4.20 C ATOM 728 OD1 ASP A 47 14.920 -22.906 -4.485 1.00 2.44 O ATOM 729 OD2 ASP A 47 16.789 -24.010 -4.830 1.00 52.23 O ATOM 0 H ASP A 47 16.356 -19.705 -7.726 1.00 20.40 H new ATOM 0 HA ASP A 47 15.263 -20.641 -5.153 1.00 21.25 H new ATOM 0 HB2 ASP A 47 15.752 -22.430 -7.125 1.00 41.45 H new ATOM 0 HB3 ASP A 47 17.383 -22.271 -6.504 1.00 41.45 H new ATOM 734 N LEU A 48 17.492 -18.759 -5.579 1.00 34.23 N ATOM 735 CA LEU A 48 18.651 -18.029 -5.078 1.00 61.11 C ATOM 736 C LEU A 48 18.592 -17.887 -3.561 1.00 35.04 C ATOM 737 O LEU A 48 19.587 -18.099 -2.867 1.00 30.12 O ATOM 738 CB LEU A 48 18.728 -16.647 -5.729 1.00 12.24 C ATOM 739 CG LEU A 48 18.918 -16.628 -7.246 1.00 21.53 C ATOM 740 CD1 LEU A 48 17.584 -16.431 -7.949 1.00 21.13 C ATOM 741 CD2 LEU A 48 19.901 -15.538 -7.647 1.00 31.02 C ATOM 0 H LEU A 48 16.851 -18.198 -6.140 1.00 34.23 H new ATOM 0 HA LEU A 48 19.546 -18.596 -5.336 1.00 61.11 H new ATOM 0 HB2 LEU A 48 17.813 -16.104 -5.491 1.00 12.24 H new ATOM 0 HB3 LEU A 48 19.552 -16.098 -5.273 1.00 12.24 H new ATOM 0 HG LEU A 48 19.328 -17.590 -7.553 1.00 21.53 H new ATOM 0 HD11 LEU A 48 17.739 -16.420 -9.028 1.00 21.13 H new ATOM 0 HD12 LEU A 48 16.911 -17.247 -7.688 1.00 21.13 H new ATOM 0 HD13 LEU A 48 17.144 -15.484 -7.636 1.00 21.13 H new ATOM 0 HD21 LEU A 48 20.024 -15.539 -8.730 1.00 31.02 H new ATOM 0 HD22 LEU A 48 19.520 -14.568 -7.326 1.00 31.02 H new ATOM 0 HD23 LEU A 48 20.864 -15.724 -7.172 1.00 31.02 H new ATOM 753 N LEU A 49 17.418 -17.529 -3.051 1.00 22.01 N ATOM 754 CA LEU A 49 17.227 -17.361 -1.614 1.00 43.24 C ATOM 755 C LEU A 49 15.773 -17.609 -1.226 1.00 4.45 C ATOM 756 O LEU A 49 14.899 -17.706 -2.086 1.00 63.11 O ATOM 757 CB LEU A 49 17.649 -15.955 -1.185 1.00 45.41 C ATOM 758 CG LEU A 49 19.141 -15.636 -1.302 1.00 35.41 C ATOM 759 CD1 LEU A 49 19.457 -15.056 -2.672 1.00 32.53 C ATOM 760 CD2 LEU A 49 19.569 -14.676 -0.202 1.00 54.32 C ATOM 0 H LEU A 49 16.585 -17.350 -3.611 1.00 22.01 H new ATOM 0 HA LEU A 49 17.851 -18.093 -1.101 1.00 43.24 H new ATOM 0 HB2 LEU A 49 17.095 -15.232 -1.785 1.00 45.41 H new ATOM 0 HB3 LEU A 49 17.347 -15.807 -0.148 1.00 45.41 H new ATOM 0 HG LEU A 49 19.702 -16.563 -1.185 1.00 35.41 H new ATOM 0 HD11 LEU A 49 20.522 -14.835 -2.737 1.00 32.53 H new ATOM 0 HD12 LEU A 49 19.188 -15.778 -3.443 1.00 32.53 H new ATOM 0 HD13 LEU A 49 18.887 -14.139 -2.819 1.00 32.53 H new ATOM 0 HD21 LEU A 49 20.633 -14.460 -0.301 1.00 54.32 H new ATOM 0 HD22 LEU A 49 19.002 -13.749 -0.287 1.00 54.32 H new ATOM 0 HD23 LEU A 49 19.380 -15.130 0.771 1.00 54.32 H new ATOM 772 N GLU A 50 15.523 -17.707 0.076 1.00 32.23 N ATOM 773 CA GLU A 50 14.174 -17.942 0.578 1.00 10.13 C ATOM 774 C GLU A 50 13.962 -17.241 1.917 1.00 50.20 C ATOM 775 O GLU A 50 14.901 -17.061 2.692 1.00 23.53 O ATOM 776 CB GLU A 50 13.916 -19.443 0.730 1.00 41.55 C ATOM 777 CG GLU A 50 12.939 -19.998 -0.293 1.00 32.24 C ATOM 778 CD GLU A 50 12.634 -21.467 -0.070 1.00 11.22 C ATOM 779 OE1 GLU A 50 13.587 -22.243 0.149 1.00 22.45 O ATOM 780 OE2 GLU A 50 11.443 -21.840 -0.115 1.00 0.41 O ATOM 0 H GLU A 50 16.236 -17.627 0.801 1.00 32.23 H new ATOM 0 HA GLU A 50 13.469 -17.531 -0.144 1.00 10.13 H new ATOM 0 HB2 GLU A 50 14.862 -19.977 0.643 1.00 41.55 H new ATOM 0 HB3 GLU A 50 13.531 -19.638 1.731 1.00 41.55 H new ATOM 0 HG2 GLU A 50 12.011 -19.427 -0.251 1.00 32.24 H new ATOM 0 HG3 GLU A 50 13.351 -19.864 -1.293 1.00 32.24 H new ATOM 787 N VAL A 51 12.721 -16.846 2.181 1.00 14.43 N ATOM 788 CA VAL A 51 12.384 -16.165 3.426 1.00 52.43 C ATOM 789 C VAL A 51 11.913 -17.155 4.484 1.00 30.44 C ATOM 790 O VAL A 51 11.235 -18.134 4.175 1.00 13.01 O ATOM 791 CB VAL A 51 11.288 -15.105 3.207 1.00 52.33 C ATOM 792 CG1 VAL A 51 10.086 -15.716 2.502 1.00 23.55 C ATOM 793 CG2 VAL A 51 10.878 -14.480 4.532 1.00 25.41 C ATOM 0 H VAL A 51 11.932 -16.986 1.550 1.00 14.43 H new ATOM 0 HA VAL A 51 13.292 -15.672 3.773 1.00 52.43 H new ATOM 0 HB VAL A 51 11.691 -14.318 2.570 1.00 52.33 H new ATOM 0 HG11 VAL A 51 9.323 -14.952 2.356 1.00 23.55 H new ATOM 0 HG12 VAL A 51 10.394 -16.111 1.534 1.00 23.55 H new ATOM 0 HG13 VAL A 51 9.679 -16.524 3.110 1.00 23.55 H new ATOM 0 HG21 VAL A 51 10.103 -13.734 4.358 1.00 25.41 H new ATOM 0 HG22 VAL A 51 10.493 -15.254 5.196 1.00 25.41 H new ATOM 0 HG23 VAL A 51 11.743 -14.004 4.993 1.00 25.41 H new ATOM 803 N ASN A 52 12.278 -16.894 5.735 1.00 15.15 N ATOM 804 CA ASN A 52 11.892 -17.763 6.841 1.00 21.14 C ATOM 805 C ASN A 52 10.805 -17.112 7.692 1.00 63.14 C ATOM 806 O ASN A 52 10.949 -15.972 8.136 1.00 32.43 O ATOM 807 CB ASN A 52 13.109 -18.088 7.710 1.00 10.22 C ATOM 808 CG ASN A 52 13.437 -16.974 8.685 1.00 1.42 C ATOM 809 OD1 ASN A 52 13.496 -15.803 8.310 1.00 41.41 O ATOM 810 ND2 ASN A 52 13.653 -17.334 9.945 1.00 73.41 N ATOM 0 H ASN A 52 12.840 -16.088 6.008 1.00 15.15 H new ATOM 0 HA ASN A 52 11.495 -18.688 6.422 1.00 21.14 H new ATOM 0 HB2 ASN A 52 12.922 -19.008 8.263 1.00 10.22 H new ATOM 0 HB3 ASN A 52 13.971 -18.272 7.069 1.00 10.22 H new ATOM 0 HD21 ASN A 52 13.878 -16.628 10.646 1.00 73.41 H new ATOM 0 HD22 ASN A 52 13.594 -18.317 10.212 1.00 73.41 H new ATOM 817 N LEU A 53 9.719 -17.843 7.914 1.00 31.43 N ATOM 818 CA LEU A 53 8.607 -17.338 8.712 1.00 30.32 C ATOM 819 C LEU A 53 8.976 -17.290 10.191 1.00 32.55 C ATOM 820 O LEU A 53 8.215 -16.782 11.014 1.00 53.31 O ATOM 821 CB LEU A 53 7.370 -18.215 8.511 1.00 33.24 C ATOM 822 CG LEU A 53 6.973 -18.495 7.061 1.00 4.23 C ATOM 823 CD1 LEU A 53 7.116 -19.975 6.745 1.00 64.50 C ATOM 824 CD2 LEU A 53 5.550 -18.026 6.798 1.00 72.33 C ATOM 0 H LEU A 53 9.584 -18.787 7.553 1.00 31.43 H new ATOM 0 HA LEU A 53 8.384 -16.324 8.379 1.00 30.32 H new ATOM 0 HB2 LEU A 53 7.541 -19.169 9.010 1.00 33.24 H new ATOM 0 HB3 LEU A 53 6.527 -17.739 9.012 1.00 33.24 H new ATOM 0 HG LEU A 53 7.644 -17.939 6.406 1.00 4.23 H new ATOM 0 HD11 LEU A 53 6.829 -20.155 5.709 1.00 64.50 H new ATOM 0 HD12 LEU A 53 8.152 -20.280 6.893 1.00 64.50 H new ATOM 0 HD13 LEU A 53 6.470 -20.552 7.406 1.00 64.50 H new ATOM 0 HD21 LEU A 53 5.284 -18.233 5.761 1.00 72.33 H new ATOM 0 HD22 LEU A 53 4.864 -18.554 7.461 1.00 72.33 H new ATOM 0 HD23 LEU A 53 5.480 -16.954 6.983 1.00 72.33 H new ATOM 836 N GLN A 54 10.149 -17.822 10.521 1.00 13.31 N ATOM 837 CA GLN A 54 10.619 -17.838 11.901 1.00 14.23 C ATOM 838 C GLN A 54 10.883 -16.422 12.403 1.00 53.10 C ATOM 839 O GLN A 54 10.461 -16.053 13.498 1.00 5.41 O ATOM 840 CB GLN A 54 11.891 -18.679 12.019 1.00 33.04 C ATOM 841 CG GLN A 54 11.828 -19.725 13.121 1.00 43.02 C ATOM 842 CD GLN A 54 12.998 -20.689 13.077 1.00 55.00 C ATOM 843 OE1 GLN A 54 14.077 -20.397 13.592 1.00 23.20 O ATOM 844 NE2 GLN A 54 12.788 -21.846 12.460 1.00 22.22 N ATOM 0 H GLN A 54 10.791 -18.247 9.852 1.00 13.31 H new ATOM 0 HA GLN A 54 9.839 -18.283 12.519 1.00 14.23 H new ATOM 0 HB2 GLN A 54 12.077 -19.177 11.067 1.00 33.04 H new ATOM 0 HB3 GLN A 54 12.738 -18.018 12.204 1.00 33.04 H new ATOM 0 HG2 GLN A 54 11.809 -19.226 14.090 1.00 43.02 H new ATOM 0 HG3 GLN A 54 10.897 -20.285 13.033 1.00 43.02 H new ATOM 0 HE21 GLN A 54 11.877 -22.046 12.047 1.00 22.22 H new ATOM 0 HE22 GLN A 54 13.538 -22.535 12.399 1.00 22.22 H new ATOM 853 N ASN A 55 11.583 -15.634 11.594 1.00 44.11 N ATOM 854 CA ASN A 55 11.905 -14.258 11.956 1.00 34.35 C ATOM 855 C ASN A 55 11.641 -13.312 10.789 1.00 71.20 C ATOM 856 O ASN A 55 12.073 -12.160 10.800 1.00 35.20 O ATOM 857 CB ASN A 55 13.367 -14.152 12.393 1.00 22.21 C ATOM 858 CG ASN A 55 13.551 -13.221 13.576 1.00 64.30 C ATOM 859 OD1 ASN A 55 13.242 -12.032 13.498 1.00 21.34 O ATOM 860 ND2 ASN A 55 14.058 -13.760 14.679 1.00 10.21 N ATOM 0 H ASN A 55 11.938 -15.924 10.683 1.00 44.11 H new ATOM 0 HA ASN A 55 11.263 -13.968 12.788 1.00 34.35 H new ATOM 0 HB2 ASN A 55 13.738 -15.143 12.653 1.00 22.21 H new ATOM 0 HB3 ASN A 55 13.968 -13.796 11.557 1.00 22.21 H new ATOM 0 HD21 ASN A 55 14.206 -13.183 15.507 1.00 10.21 H new ATOM 0 HD22 ASN A 55 14.300 -14.751 14.698 1.00 10.21 H new ATOM 867 N GLY A 56 10.928 -13.808 9.782 1.00 51.20 N ATOM 868 CA GLY A 56 10.618 -12.994 8.621 1.00 3.11 C ATOM 869 C GLY A 56 11.860 -12.425 7.964 1.00 2.32 C ATOM 870 O GLY A 56 11.836 -11.314 7.434 1.00 51.42 O ATOM 0 H GLY A 56 10.560 -14.759 9.750 1.00 51.20 H new ATOM 0 HA2 GLY A 56 10.070 -13.595 7.896 1.00 3.11 H new ATOM 0 HA3 GLY A 56 9.961 -12.177 8.919 1.00 3.11 H new ATOM 874 N ILE A 57 12.949 -13.186 8.001 1.00 55.05 N ATOM 875 CA ILE A 57 14.205 -12.750 7.405 1.00 63.14 C ATOM 876 C ILE A 57 14.535 -13.566 6.159 1.00 25.15 C ATOM 877 O ILE A 57 13.973 -14.639 5.940 1.00 75.52 O ATOM 878 CB ILE A 57 15.372 -12.864 8.404 1.00 73.51 C ATOM 879 CG1 ILE A 57 16.233 -11.601 8.362 1.00 3.22 C ATOM 880 CG2 ILE A 57 16.212 -14.095 8.098 1.00 30.44 C ATOM 881 CD1 ILE A 57 15.496 -10.352 8.794 1.00 23.40 C ATOM 0 H ILE A 57 12.986 -14.107 8.437 1.00 55.05 H new ATOM 0 HA ILE A 57 14.076 -11.704 7.128 1.00 63.14 H new ATOM 0 HB ILE A 57 14.962 -12.968 9.409 1.00 73.51 H new ATOM 0 HG12 ILE A 57 17.101 -11.742 9.006 1.00 3.22 H new ATOM 0 HG13 ILE A 57 16.607 -11.460 7.348 1.00 3.22 H new ATOM 0 HG21 ILE A 57 17.033 -14.162 8.812 1.00 30.44 H new ATOM 0 HG22 ILE A 57 15.591 -14.987 8.174 1.00 30.44 H new ATOM 0 HG23 ILE A 57 16.615 -14.019 7.088 1.00 30.44 H new ATOM 0 HD11 ILE A 57 16.168 -9.496 8.739 1.00 23.40 H new ATOM 0 HD12 ILE A 57 14.643 -10.187 8.136 1.00 23.40 H new ATOM 0 HD13 ILE A 57 15.145 -10.473 9.819 1.00 23.40 H new ATOM 893 N LEU A 58 15.453 -13.052 5.348 1.00 53.41 N ATOM 894 CA LEU A 58 15.861 -13.733 4.124 1.00 35.33 C ATOM 895 C LEU A 58 17.166 -14.493 4.334 1.00 63.42 C ATOM 896 O LEU A 58 18.221 -13.892 4.538 1.00 10.13 O ATOM 897 CB LEU A 58 16.021 -12.725 2.985 1.00 71.52 C ATOM 898 CG LEU A 58 14.946 -12.765 1.898 1.00 42.32 C ATOM 899 CD1 LEU A 58 14.840 -14.160 1.302 1.00 32.05 C ATOM 900 CD2 LEU A 58 13.604 -12.318 2.459 1.00 71.34 C ATOM 0 H LEU A 58 15.929 -12.166 5.516 1.00 53.41 H new ATOM 0 HA LEU A 58 15.083 -14.450 3.859 1.00 35.33 H new ATOM 0 HB2 LEU A 58 16.039 -11.723 3.413 1.00 71.52 H new ATOM 0 HB3 LEU A 58 16.991 -12.889 2.515 1.00 71.52 H new ATOM 0 HG LEU A 58 15.233 -12.075 1.104 1.00 42.32 H new ATOM 0 HD11 LEU A 58 14.070 -14.169 0.531 1.00 32.05 H new ATOM 0 HD12 LEU A 58 15.797 -14.442 0.863 1.00 32.05 H new ATOM 0 HD13 LEU A 58 14.577 -14.871 2.085 1.00 32.05 H new ATOM 0 HD21 LEU A 58 12.851 -12.353 1.672 1.00 71.34 H new ATOM 0 HD22 LEU A 58 13.310 -12.982 3.272 1.00 71.34 H new ATOM 0 HD23 LEU A 58 13.688 -11.299 2.836 1.00 71.34 H new ATOM 912 N PHE A 59 17.089 -15.819 4.279 1.00 14.14 N ATOM 913 CA PHE A 59 18.265 -16.662 4.462 1.00 54.31 C ATOM 914 C PHE A 59 18.762 -17.198 3.123 1.00 45.11 C ATOM 915 O PHE A 59 17.982 -17.697 2.312 1.00 30.12 O ATOM 916 CB PHE A 59 17.943 -17.825 5.402 1.00 24.23 C ATOM 917 CG PHE A 59 17.042 -18.859 4.790 1.00 22.34 C ATOM 918 CD1 PHE A 59 17.572 -19.935 4.096 1.00 33.45 C ATOM 919 CD2 PHE A 59 15.666 -18.756 4.910 1.00 53.23 C ATOM 920 CE1 PHE A 59 16.745 -20.888 3.532 1.00 54.11 C ATOM 921 CE2 PHE A 59 14.834 -19.706 4.348 1.00 55.55 C ATOM 922 CZ PHE A 59 15.374 -20.774 3.659 1.00 50.54 C ATOM 0 H PHE A 59 16.224 -16.333 4.109 1.00 14.14 H new ATOM 0 HA PHE A 59 19.053 -16.053 4.905 1.00 54.31 H new ATOM 0 HB2 PHE A 59 18.874 -18.302 5.709 1.00 24.23 H new ATOM 0 HB3 PHE A 59 17.473 -17.433 6.304 1.00 24.23 H new ATOM 0 HD1 PHE A 59 18.643 -20.030 3.995 1.00 33.45 H new ATOM 0 HD2 PHE A 59 15.238 -17.924 5.449 1.00 53.23 H new ATOM 0 HE1 PHE A 59 17.170 -21.721 2.992 1.00 54.11 H new ATOM 0 HE2 PHE A 59 13.763 -19.613 4.448 1.00 55.55 H new ATOM 0 HZ PHE A 59 14.726 -21.518 3.220 1.00 50.54 H new ATOM 932 N VAL A 60 20.068 -17.090 2.898 1.00 61.33 N ATOM 933 CA VAL A 60 20.672 -17.564 1.658 1.00 73.30 C ATOM 934 C VAL A 60 20.259 -19.001 1.360 1.00 75.12 C ATOM 935 O VAL A 60 20.146 -19.826 2.266 1.00 51.14 O ATOM 936 CB VAL A 60 22.209 -17.485 1.716 1.00 31.31 C ATOM 937 CG1 VAL A 60 22.823 -18.106 0.471 1.00 61.41 C ATOM 938 CG2 VAL A 60 22.662 -16.043 1.881 1.00 11.53 C ATOM 0 H VAL A 60 20.728 -16.679 3.558 1.00 61.33 H new ATOM 0 HA VAL A 60 20.312 -16.913 0.862 1.00 73.30 H new ATOM 0 HB VAL A 60 22.552 -18.051 2.582 1.00 31.31 H new ATOM 0 HG11 VAL A 60 23.909 -18.041 0.530 1.00 61.41 H new ATOM 0 HG12 VAL A 60 22.525 -19.152 0.402 1.00 61.41 H new ATOM 0 HG13 VAL A 60 22.475 -17.570 -0.412 1.00 61.41 H new ATOM 0 HG21 VAL A 60 23.751 -16.006 1.920 1.00 11.53 H new ATOM 0 HG22 VAL A 60 22.309 -15.452 1.036 1.00 11.53 H new ATOM 0 HG23 VAL A 60 22.252 -15.636 2.805 1.00 11.53 H new ATOM 948 N ASN A 61 20.034 -19.294 0.083 1.00 42.41 N ATOM 949 CA ASN A 61 19.633 -20.632 -0.336 1.00 1.14 C ATOM 950 C ASN A 61 20.224 -20.975 -1.699 1.00 64.45 C ATOM 951 O ASN A 61 19.583 -21.635 -2.517 1.00 61.41 O ATOM 952 CB ASN A 61 18.108 -20.737 -0.387 1.00 54.04 C ATOM 953 CG ASN A 61 17.625 -22.174 -0.332 1.00 12.50 C ATOM 954 OD1 ASN A 61 17.984 -22.926 0.574 1.00 73.23 O ATOM 955 ND2 ASN A 61 16.806 -22.560 -1.304 1.00 25.43 N ATOM 0 H ASN A 61 20.123 -18.622 -0.680 1.00 42.41 H new ATOM 0 HA ASN A 61 20.015 -21.345 0.395 1.00 1.14 H new ATOM 0 HB2 ASN A 61 17.680 -20.181 0.447 1.00 54.04 H new ATOM 0 HB3 ASN A 61 17.745 -20.269 -1.302 1.00 54.04 H new ATOM 0 HD21 ASN A 61 16.448 -23.515 -1.320 1.00 25.43 H new ATOM 0 HD22 ASN A 61 16.535 -21.902 -2.035 1.00 25.43 H new ATOM 962 N SER A 62 21.451 -20.523 -1.937 1.00 65.43 N ATOM 963 CA SER A 62 22.129 -20.780 -3.203 1.00 13.20 C ATOM 964 C SER A 62 23.563 -20.260 -3.167 1.00 54.00 C ATOM 965 O SER A 62 24.074 -19.890 -2.110 1.00 52.41 O ATOM 966 CB SER A 62 21.365 -20.125 -4.356 1.00 5.32 C ATOM 967 OG SER A 62 21.706 -20.720 -5.596 1.00 40.41 O ATOM 0 H SER A 62 21.996 -19.977 -1.270 1.00 65.43 H new ATOM 0 HA SER A 62 22.156 -21.858 -3.360 1.00 13.20 H new ATOM 0 HB2 SER A 62 20.292 -20.220 -4.186 1.00 5.32 H new ATOM 0 HB3 SER A 62 21.590 -19.059 -4.386 1.00 5.32 H new ATOM 0 HG SER A 62 21.204 -20.285 -6.317 1.00 40.41 H new ATOM 973 N ARG A 63 24.206 -20.236 -4.330 1.00 11.23 N ATOM 974 CA ARG A 63 25.581 -19.763 -4.432 1.00 62.03 C ATOM 975 C ARG A 63 25.635 -18.238 -4.404 1.00 64.44 C ATOM 976 O ARG A 63 25.078 -17.572 -5.277 1.00 12.33 O ATOM 977 CB ARG A 63 26.227 -20.284 -5.717 1.00 44.55 C ATOM 978 CG ARG A 63 26.131 -21.792 -5.880 1.00 41.30 C ATOM 979 CD ARG A 63 27.488 -22.458 -5.714 1.00 41.44 C ATOM 980 NE ARG A 63 27.512 -23.801 -6.287 1.00 43.23 N ATOM 981 CZ ARG A 63 27.025 -24.872 -5.671 1.00 14.43 C ATOM 982 NH1 ARG A 63 26.477 -24.757 -4.468 1.00 44.45 N ATOM 983 NH2 ARG A 63 27.083 -26.060 -6.257 1.00 23.50 N ATOM 0 H ARG A 63 23.797 -20.538 -5.214 1.00 11.23 H new ATOM 0 HA ARG A 63 26.135 -20.144 -3.574 1.00 62.03 H new ATOM 0 HB2 ARG A 63 25.752 -19.804 -6.573 1.00 44.55 H new ATOM 0 HB3 ARG A 63 27.277 -19.992 -5.730 1.00 44.55 H new ATOM 0 HG2 ARG A 63 25.434 -22.195 -5.145 1.00 41.30 H new ATOM 0 HG3 ARG A 63 25.727 -22.028 -6.865 1.00 41.30 H new ATOM 0 HD2 ARG A 63 28.253 -21.846 -6.192 1.00 41.44 H new ATOM 0 HD3 ARG A 63 27.739 -22.511 -4.655 1.00 41.44 H new ATOM 0 HE ARG A 63 27.926 -23.923 -7.211 1.00 43.23 H new ATOM 0 HH11 ARG A 63 26.429 -23.845 -4.014 1.00 44.45 H new ATOM 0 HH12 ARG A 63 26.104 -25.581 -3.997 1.00 44.45 H new ATOM 0 HH21 ARG A 63 27.502 -26.152 -7.182 1.00 23.50 H new ATOM 0 HH22 ARG A 63 26.709 -26.882 -5.782 1.00 23.50 H new ATOM 997 N ILE A 64 26.310 -17.694 -3.397 1.00 55.11 N ATOM 998 CA ILE A 64 26.437 -16.249 -3.256 1.00 53.34 C ATOM 999 C ILE A 64 27.856 -15.789 -3.570 1.00 43.41 C ATOM 1000 O ILE A 64 28.098 -14.605 -3.808 1.00 21.11 O ATOM 1001 CB ILE A 64 26.061 -15.786 -1.836 1.00 63.12 C ATOM 1002 CG1 ILE A 64 24.710 -16.375 -1.425 1.00 23.11 C ATOM 1003 CG2 ILE A 64 26.026 -14.267 -1.766 1.00 43.30 C ATOM 1004 CD1 ILE A 64 23.582 -16.014 -2.366 1.00 22.41 C ATOM 0 H ILE A 64 26.777 -18.232 -2.667 1.00 55.11 H new ATOM 0 HA ILE A 64 25.746 -15.801 -3.970 1.00 53.34 H new ATOM 0 HB ILE A 64 26.819 -16.145 -1.140 1.00 63.12 H new ATOM 0 HG12 ILE A 64 24.796 -17.460 -1.374 1.00 23.11 H new ATOM 0 HG13 ILE A 64 24.461 -16.027 -0.422 1.00 23.11 H new ATOM 0 HG21 ILE A 64 25.759 -13.955 -0.756 1.00 43.30 H new ATOM 0 HG22 ILE A 64 27.008 -13.868 -2.021 1.00 43.30 H new ATOM 0 HG23 ILE A 64 25.286 -13.887 -2.471 1.00 43.30 H new ATOM 0 HD11 ILE A 64 22.655 -16.465 -2.013 1.00 22.41 H new ATOM 0 HD12 ILE A 64 23.468 -14.930 -2.399 1.00 22.41 H new ATOM 0 HD13 ILE A 64 23.809 -16.386 -3.365 1.00 22.41 H new ATOM 1016 N ASP A 65 28.791 -16.732 -3.571 1.00 24.24 N ATOM 1017 CA ASP A 65 30.188 -16.425 -3.858 1.00 54.24 C ATOM 1018 C ASP A 65 30.334 -15.815 -5.249 1.00 63.11 C ATOM 1019 O ASP A 65 29.564 -16.126 -6.158 1.00 44.21 O ATOM 1020 CB ASP A 65 31.043 -17.688 -3.749 1.00 2.11 C ATOM 1021 CG ASP A 65 32.460 -17.390 -3.299 1.00 70.31 C ATOM 1022 OD1 ASP A 65 32.899 -16.230 -3.448 1.00 71.41 O ATOM 1023 OD2 ASP A 65 33.130 -18.317 -2.797 1.00 54.12 O ATOM 0 H ASP A 65 28.607 -17.716 -3.376 1.00 24.24 H new ATOM 0 HA ASP A 65 30.534 -15.698 -3.123 1.00 54.24 H new ATOM 0 HB2 ASP A 65 30.579 -18.378 -3.045 1.00 2.11 H new ATOM 0 HB3 ASP A 65 31.070 -18.190 -4.716 1.00 2.11 H new ATOM 1028 N ARG A 66 31.327 -14.945 -5.407 1.00 33.35 N ATOM 1029 CA ARG A 66 31.573 -14.290 -6.686 1.00 32.25 C ATOM 1030 C ARG A 66 31.585 -15.307 -7.824 1.00 12.35 C ATOM 1031 O ARG A 66 31.240 -14.984 -8.960 1.00 34.03 O ATOM 1032 CB ARG A 66 32.902 -13.535 -6.648 1.00 44.43 C ATOM 1033 CG ARG A 66 34.120 -14.439 -6.750 1.00 52.11 C ATOM 1034 CD ARG A 66 35.388 -13.716 -6.324 1.00 40.33 C ATOM 1035 NE ARG A 66 36.411 -13.746 -7.366 1.00 3.11 N ATOM 1036 CZ ARG A 66 37.535 -13.040 -7.312 1.00 64.25 C ATOM 1037 NH1 ARG A 66 37.780 -12.254 -6.273 1.00 55.34 N ATOM 1038 NH2 ARG A 66 38.418 -13.121 -8.300 1.00 4.13 N ATOM 0 H ARG A 66 31.974 -14.678 -4.665 1.00 33.35 H new ATOM 0 HA ARG A 66 30.765 -13.581 -6.865 1.00 32.25 H new ATOM 0 HB2 ARG A 66 32.925 -12.815 -7.466 1.00 44.43 H new ATOM 0 HB3 ARG A 66 32.960 -12.965 -5.721 1.00 44.43 H new ATOM 0 HG2 ARG A 66 33.974 -15.319 -6.124 1.00 52.11 H new ATOM 0 HG3 ARG A 66 34.228 -14.791 -7.776 1.00 52.11 H new ATOM 0 HD2 ARG A 66 35.150 -12.681 -6.079 1.00 40.33 H new ATOM 0 HD3 ARG A 66 35.780 -14.176 -5.417 1.00 40.33 H new ATOM 0 HE ARG A 66 36.254 -14.341 -8.179 1.00 3.11 H new ATOM 0 HH11 ARG A 66 37.104 -12.190 -5.512 1.00 55.34 H new ATOM 0 HH12 ARG A 66 38.644 -11.713 -6.235 1.00 55.34 H new ATOM 0 HH21 ARG A 66 38.233 -13.725 -9.101 1.00 4.13 H new ATOM 0 HH22 ARG A 66 39.281 -12.579 -8.258 1.00 4.13 H new ATOM 1052 N GLU A 67 31.985 -16.535 -7.509 1.00 41.21 N ATOM 1053 CA GLU A 67 32.043 -17.597 -8.506 1.00 62.21 C ATOM 1054 C GLU A 67 30.729 -17.693 -9.276 1.00 61.31 C ATOM 1055 O GLU A 67 30.674 -17.397 -10.469 1.00 4.40 O ATOM 1056 CB GLU A 67 32.354 -18.938 -7.838 1.00 4.14 C ATOM 1057 CG GLU A 67 33.736 -18.998 -7.208 1.00 12.23 C ATOM 1058 CD GLU A 67 34.527 -20.213 -7.651 1.00 42.24 C ATOM 1059 OE1 GLU A 67 33.907 -21.269 -7.896 1.00 40.40 O ATOM 1060 OE2 GLU A 67 35.767 -20.107 -7.754 1.00 64.02 O ATOM 0 H GLU A 67 32.273 -16.819 -6.573 1.00 41.21 H new ATOM 0 HA GLU A 67 32.840 -17.356 -9.210 1.00 62.21 H new ATOM 0 HB2 GLU A 67 31.605 -19.134 -7.071 1.00 4.14 H new ATOM 0 HB3 GLU A 67 32.267 -19.732 -8.579 1.00 4.14 H new ATOM 0 HG2 GLU A 67 34.289 -18.095 -7.467 1.00 12.23 H new ATOM 0 HG3 GLU A 67 33.636 -19.010 -6.123 1.00 12.23 H new ATOM 1067 N GLU A 68 29.674 -18.111 -8.584 1.00 14.40 N ATOM 1068 CA GLU A 68 28.360 -18.247 -9.203 1.00 65.31 C ATOM 1069 C GLU A 68 27.633 -16.906 -9.237 1.00 72.42 C ATOM 1070 O GLU A 68 26.947 -16.584 -10.208 1.00 41.32 O ATOM 1071 CB GLU A 68 27.520 -19.277 -8.446 1.00 33.23 C ATOM 1072 CG GLU A 68 27.208 -20.524 -9.257 1.00 11.50 C ATOM 1073 CD GLU A 68 26.018 -20.337 -10.179 1.00 23.23 C ATOM 1074 OE1 GLU A 68 26.169 -19.648 -11.209 1.00 43.31 O ATOM 1075 OE2 GLU A 68 24.937 -20.880 -9.870 1.00 0.10 O ATOM 0 H GLU A 68 29.703 -18.361 -7.596 1.00 14.40 H new ATOM 0 HA GLU A 68 28.503 -18.588 -10.228 1.00 65.31 H new ATOM 0 HB2 GLU A 68 28.048 -19.567 -7.538 1.00 33.23 H new ATOM 0 HB3 GLU A 68 26.584 -18.812 -8.135 1.00 33.23 H new ATOM 0 HG2 GLU A 68 28.082 -20.796 -9.849 1.00 11.50 H new ATOM 0 HG3 GLU A 68 27.011 -21.354 -8.579 1.00 11.50 H new ATOM 1082 N LEU A 69 27.786 -16.130 -8.171 1.00 4.44 N ATOM 1083 CA LEU A 69 27.144 -14.823 -8.077 1.00 20.23 C ATOM 1084 C LEU A 69 27.336 -14.028 -9.364 1.00 62.11 C ATOM 1085 O LEU A 69 26.393 -13.831 -10.131 1.00 44.33 O ATOM 1086 CB LEU A 69 27.709 -14.039 -6.891 1.00 33.44 C ATOM 1087 CG LEU A 69 26.901 -12.819 -6.447 1.00 32.44 C ATOM 1088 CD1 LEU A 69 27.063 -11.681 -7.442 1.00 13.12 C ATOM 1089 CD2 LEU A 69 25.432 -13.183 -6.283 1.00 42.15 C ATOM 0 H LEU A 69 28.349 -16.382 -7.359 1.00 4.44 H new ATOM 0 HA LEU A 69 26.076 -14.981 -7.925 1.00 20.23 H new ATOM 0 HB2 LEU A 69 27.800 -14.718 -6.043 1.00 33.44 H new ATOM 0 HB3 LEU A 69 28.716 -13.710 -7.146 1.00 33.44 H new ATOM 0 HG LEU A 69 27.282 -12.486 -5.481 1.00 32.44 H new ATOM 0 HD11 LEU A 69 26.481 -10.821 -7.110 1.00 13.12 H new ATOM 0 HD12 LEU A 69 28.115 -11.403 -7.509 1.00 13.12 H new ATOM 0 HD13 LEU A 69 26.709 -12.001 -8.422 1.00 13.12 H new ATOM 0 HD21 LEU A 69 24.872 -12.303 -5.967 1.00 42.15 H new ATOM 0 HD22 LEU A 69 25.038 -13.542 -7.234 1.00 42.15 H new ATOM 0 HD23 LEU A 69 25.333 -13.966 -5.531 1.00 42.15 H new ATOM 1101 N CYS A 70 28.564 -13.575 -9.596 1.00 72.42 N ATOM 1102 CA CYS A 70 28.881 -12.803 -10.791 1.00 64.33 C ATOM 1103 C CYS A 70 30.366 -12.908 -11.128 1.00 3.34 C ATOM 1104 O CYS A 70 30.737 -13.277 -12.241 1.00 50.41 O ATOM 1105 CB CYS A 70 28.494 -11.336 -10.594 1.00 72.42 C ATOM 1106 SG CYS A 70 26.794 -10.940 -11.115 1.00 34.31 S ATOM 0 H CYS A 70 29.356 -13.730 -8.972 1.00 72.42 H new ATOM 0 HA CYS A 70 28.308 -13.214 -11.622 1.00 64.33 H new ATOM 0 HB2 CYS A 70 28.609 -11.079 -9.541 1.00 72.42 H new ATOM 0 HB3 CYS A 70 29.189 -10.710 -11.153 1.00 72.42 H new ATOM 1111 N GLY A 71 31.212 -12.580 -10.155 1.00 42.25 N ATOM 1112 CA GLY A 71 32.646 -12.643 -10.367 1.00 64.35 C ATOM 1113 C GLY A 71 33.231 -11.308 -10.783 1.00 53.21 C ATOM 1114 O GLY A 71 33.540 -10.468 -9.938 1.00 21.03 O ATOM 0 H GLY A 71 30.929 -12.272 -9.225 1.00 42.25 H new ATOM 0 HA2 GLY A 71 33.131 -12.979 -9.450 1.00 64.35 H new ATOM 0 HA3 GLY A 71 32.864 -13.386 -11.134 1.00 64.35 H new ATOM 1118 N ARG A 72 33.384 -11.111 -12.088 1.00 72.25 N ATOM 1119 CA ARG A 72 33.938 -9.869 -12.614 1.00 71.43 C ATOM 1120 C ARG A 72 32.898 -8.754 -12.583 1.00 15.53 C ATOM 1121 O ARG A 72 32.492 -8.239 -13.625 1.00 63.42 O ATOM 1122 CB ARG A 72 34.438 -10.075 -14.045 1.00 51.34 C ATOM 1123 CG ARG A 72 35.392 -8.990 -14.519 1.00 34.12 C ATOM 1124 CD ARG A 72 36.822 -9.282 -14.095 1.00 24.43 C ATOM 1125 NE ARG A 72 37.542 -8.067 -13.724 1.00 24.25 N ATOM 1126 CZ ARG A 72 38.858 -8.018 -13.546 1.00 11.24 C ATOM 1127 NH1 ARG A 72 39.593 -9.109 -13.705 1.00 22.53 N ATOM 1128 NH2 ARG A 72 39.440 -6.874 -13.208 1.00 65.34 N ATOM 0 H ARG A 72 33.132 -11.796 -12.801 1.00 72.25 H new ATOM 0 HA ARG A 72 34.777 -9.578 -11.982 1.00 71.43 H new ATOM 0 HB2 ARG A 72 34.939 -11.041 -14.110 1.00 51.34 H new ATOM 0 HB3 ARG A 72 33.582 -10.113 -14.718 1.00 51.34 H new ATOM 0 HG2 ARG A 72 35.343 -8.909 -15.605 1.00 34.12 H new ATOM 0 HG3 ARG A 72 35.080 -8.027 -14.113 1.00 34.12 H new ATOM 0 HD2 ARG A 72 36.816 -9.972 -13.251 1.00 24.43 H new ATOM 0 HD3 ARG A 72 37.347 -9.780 -14.910 1.00 24.43 H new ATOM 0 HE ARG A 72 37.006 -7.209 -13.594 1.00 24.25 H new ATOM 0 HH11 ARG A 72 39.149 -9.990 -13.965 1.00 22.53 H new ATOM 0 HH12 ARG A 72 40.603 -9.068 -13.568 1.00 22.53 H new ATOM 0 HH21 ARG A 72 38.877 -6.032 -13.085 1.00 65.34 H new ATOM 0 HH22 ARG A 72 40.450 -6.837 -13.071 1.00 65.34 H new ATOM 1142 N SER A 73 32.469 -8.385 -11.380 1.00 2.43 N ATOM 1143 CA SER A 73 31.473 -7.333 -11.212 1.00 70.03 C ATOM 1144 C SER A 73 31.574 -6.705 -9.826 1.00 12.04 C ATOM 1145 O SER A 73 31.114 -7.277 -8.838 1.00 71.41 O ATOM 1146 CB SER A 73 30.066 -7.895 -11.429 1.00 45.53 C ATOM 1147 OG SER A 73 29.282 -7.015 -12.216 1.00 40.02 O ATOM 0 H SER A 73 32.796 -8.799 -10.507 1.00 2.43 H new ATOM 0 HA SER A 73 31.667 -6.561 -11.956 1.00 70.03 H new ATOM 0 HB2 SER A 73 30.130 -8.867 -11.919 1.00 45.53 H new ATOM 0 HB3 SER A 73 29.582 -8.055 -10.465 1.00 45.53 H new ATOM 0 HG SER A 73 28.336 -7.258 -12.134 1.00 40.02 H new ATOM 1153 N ALA A 74 32.179 -5.524 -9.761 1.00 2.34 N ATOM 1154 CA ALA A 74 32.339 -4.816 -8.496 1.00 42.24 C ATOM 1155 C ALA A 74 31.003 -4.670 -7.776 1.00 41.00 C ATOM 1156 O ALA A 74 30.954 -4.601 -6.548 1.00 64.45 O ATOM 1157 CB ALA A 74 32.966 -3.450 -8.732 1.00 52.42 C ATOM 0 H ALA A 74 32.567 -5.037 -10.569 1.00 2.34 H new ATOM 0 HA ALA A 74 33.002 -5.403 -7.860 1.00 42.24 H new ATOM 0 HB1 ALA A 74 33.080 -2.932 -7.780 1.00 52.42 H new ATOM 0 HB2 ALA A 74 33.944 -3.574 -9.197 1.00 52.42 H new ATOM 0 HB3 ALA A 74 32.324 -2.864 -9.389 1.00 52.42 H new ATOM 1163 N GLU A 75 29.922 -4.622 -8.548 1.00 32.51 N ATOM 1164 CA GLU A 75 28.585 -4.483 -7.982 1.00 4.14 C ATOM 1165 C GLU A 75 27.540 -5.122 -8.891 1.00 33.22 C ATOM 1166 O GLU A 75 27.274 -4.634 -9.990 1.00 23.32 O ATOM 1167 CB GLU A 75 28.252 -3.006 -7.763 1.00 11.35 C ATOM 1168 CG GLU A 75 28.487 -2.140 -8.989 1.00 74.32 C ATOM 1169 CD GLU A 75 27.296 -1.261 -9.319 1.00 42.21 C ATOM 1170 OE1 GLU A 75 26.708 -0.681 -8.382 1.00 64.14 O ATOM 1171 OE2 GLU A 75 26.953 -1.152 -10.515 1.00 70.41 O ATOM 0 H GLU A 75 29.946 -4.677 -9.566 1.00 32.51 H new ATOM 0 HA GLU A 75 28.569 -4.998 -7.022 1.00 4.14 H new ATOM 0 HB2 GLU A 75 27.208 -2.919 -7.462 1.00 11.35 H new ATOM 0 HB3 GLU A 75 28.855 -2.625 -6.939 1.00 11.35 H new ATOM 0 HG2 GLU A 75 29.362 -1.512 -8.823 1.00 74.32 H new ATOM 0 HG3 GLU A 75 28.710 -2.779 -9.843 1.00 74.32 H new ATOM 1178 N CYS A 76 26.949 -6.218 -8.425 1.00 4.43 N ATOM 1179 CA CYS A 76 25.934 -6.926 -9.194 1.00 53.11 C ATOM 1180 C CYS A 76 24.565 -6.804 -8.530 1.00 41.02 C ATOM 1181 O CYS A 76 24.425 -7.027 -7.328 1.00 32.21 O ATOM 1182 CB CYS A 76 26.312 -8.401 -9.341 1.00 72.11 C ATOM 1183 SG CYS A 76 26.816 -8.875 -11.026 1.00 51.03 S ATOM 0 H CYS A 76 27.157 -6.635 -7.517 1.00 4.43 H new ATOM 0 HA CYS A 76 25.881 -6.471 -10.183 1.00 53.11 H new ATOM 0 HB2 CYS A 76 27.126 -8.627 -8.653 1.00 72.11 H new ATOM 0 HB3 CYS A 76 25.462 -9.014 -9.041 1.00 72.11 H new ATOM 1188 N SER A 77 23.559 -6.448 -9.323 1.00 32.54 N ATOM 1189 CA SER A 77 22.202 -6.293 -8.812 1.00 32.32 C ATOM 1190 C SER A 77 21.359 -7.525 -9.127 1.00 34.35 C ATOM 1191 O SER A 77 21.562 -8.186 -10.146 1.00 13.23 O ATOM 1192 CB SER A 77 21.548 -5.047 -9.412 1.00 11.04 C ATOM 1193 OG SER A 77 22.270 -4.585 -10.540 1.00 70.21 O ATOM 0 H SER A 77 23.658 -6.262 -10.321 1.00 32.54 H new ATOM 0 HA SER A 77 22.258 -6.180 -7.729 1.00 32.32 H new ATOM 0 HB2 SER A 77 20.522 -5.275 -9.701 1.00 11.04 H new ATOM 0 HB3 SER A 77 21.500 -4.260 -8.660 1.00 11.04 H new ATOM 0 HG SER A 77 21.831 -3.789 -10.906 1.00 70.21 H new ATOM 1199 N ILE A 78 20.412 -7.828 -8.244 1.00 45.11 N ATOM 1200 CA ILE A 78 19.538 -8.979 -8.428 1.00 34.24 C ATOM 1201 C ILE A 78 18.075 -8.595 -8.234 1.00 12.43 C ATOM 1202 O ILE A 78 17.739 -7.822 -7.336 1.00 14.32 O ATOM 1203 CB ILE A 78 19.892 -10.116 -7.451 1.00 75.52 C ATOM 1204 CG1 ILE A 78 21.350 -10.540 -7.635 1.00 22.41 C ATOM 1205 CG2 ILE A 78 18.960 -11.301 -7.658 1.00 32.30 C ATOM 1206 CD1 ILE A 78 22.268 -10.035 -6.544 1.00 43.01 C ATOM 0 H ILE A 78 20.231 -7.292 -7.395 1.00 45.11 H new ATOM 0 HA ILE A 78 19.687 -9.328 -9.450 1.00 34.24 H new ATOM 0 HB ILE A 78 19.765 -9.752 -6.431 1.00 75.52 H new ATOM 0 HG12 ILE A 78 21.402 -11.628 -7.668 1.00 22.41 H new ATOM 0 HG13 ILE A 78 21.708 -10.175 -8.598 1.00 22.41 H new ATOM 0 HG21 ILE A 78 19.222 -12.096 -6.961 1.00 32.30 H new ATOM 0 HG22 ILE A 78 17.930 -10.989 -7.482 1.00 32.30 H new ATOM 0 HG23 ILE A 78 19.059 -11.667 -8.680 1.00 32.30 H new ATOM 0 HD11 ILE A 78 23.286 -10.374 -6.739 1.00 43.01 H new ATOM 0 HD12 ILE A 78 22.245 -8.945 -6.525 1.00 43.01 H new ATOM 0 HD13 ILE A 78 21.935 -10.422 -5.581 1.00 43.01 H new ATOM 1218 N HIS A 79 17.208 -9.141 -9.081 1.00 13.55 N ATOM 1219 CA HIS A 79 15.779 -8.856 -9.001 1.00 63.41 C ATOM 1220 C HIS A 79 14.995 -10.112 -8.632 1.00 23.13 C ATOM 1221 O HIS A 79 15.316 -11.212 -9.084 1.00 32.22 O ATOM 1222 CB HIS A 79 15.274 -8.299 -10.332 1.00 11.30 C ATOM 1223 CG HIS A 79 16.151 -7.229 -10.905 1.00 4.52 C ATOM 1224 ND1 HIS A 79 16.326 -7.044 -12.260 1.00 64.10 N ATOM 1225 CD2 HIS A 79 16.904 -6.282 -10.297 1.00 42.34 C ATOM 1226 CE1 HIS A 79 17.150 -6.031 -12.462 1.00 24.45 C ATOM 1227 NE2 HIS A 79 17.515 -5.551 -11.287 1.00 1.25 N ATOM 0 H HIS A 79 17.469 -9.782 -9.830 1.00 13.55 H new ATOM 0 HA HIS A 79 15.625 -8.110 -8.221 1.00 63.41 H new ATOM 0 HB2 HIS A 79 15.193 -9.115 -11.051 1.00 11.30 H new ATOM 0 HB3 HIS A 79 14.270 -7.898 -10.191 1.00 11.30 H new ATOM 0 HD2 HIS A 79 17.005 -6.130 -9.233 1.00 42.34 H new ATOM 0 HE1 HIS A 79 17.470 -5.659 -13.424 1.00 24.45 H new ATOM 0 HE2 HIS A 79 18.148 -4.765 -11.139 1.00 1.25 H new ATOM 1235 N LEU A 80 13.968 -9.941 -7.807 1.00 52.04 N ATOM 1236 CA LEU A 80 13.138 -11.061 -7.376 1.00 51.34 C ATOM 1237 C LEU A 80 11.679 -10.637 -7.242 1.00 73.14 C ATOM 1238 O LEU A 80 11.381 -9.460 -7.041 1.00 74.34 O ATOM 1239 CB LEU A 80 13.645 -11.613 -6.043 1.00 71.32 C ATOM 1240 CG LEU A 80 12.833 -12.760 -5.440 1.00 1.14 C ATOM 1241 CD1 LEU A 80 13.737 -13.698 -4.655 1.00 35.32 C ATOM 1242 CD2 LEU A 80 11.723 -12.218 -4.551 1.00 4.52 C ATOM 0 H LEU A 80 13.690 -9.038 -7.423 1.00 52.04 H new ATOM 0 HA LEU A 80 13.202 -11.842 -8.134 1.00 51.34 H new ATOM 0 HB2 LEU A 80 14.671 -11.954 -6.180 1.00 71.32 H new ATOM 0 HB3 LEU A 80 13.674 -10.796 -5.322 1.00 71.32 H new ATOM 0 HG LEU A 80 12.377 -13.324 -6.253 1.00 1.14 H new ATOM 0 HD11 LEU A 80 13.142 -14.508 -4.233 1.00 35.32 H new ATOM 0 HD12 LEU A 80 14.496 -14.113 -5.319 1.00 35.32 H new ATOM 0 HD13 LEU A 80 14.222 -13.146 -3.850 1.00 35.32 H new ATOM 0 HD21 LEU A 80 11.156 -13.048 -4.131 1.00 4.52 H new ATOM 0 HD22 LEU A 80 12.158 -11.630 -3.743 1.00 4.52 H new ATOM 0 HD23 LEU A 80 11.059 -11.587 -5.142 1.00 4.52 H new ATOM 1254 N GLU A 81 10.774 -11.605 -7.353 1.00 62.02 N ATOM 1255 CA GLU A 81 9.346 -11.331 -7.243 1.00 22.43 C ATOM 1256 C GLU A 81 8.690 -12.266 -6.231 1.00 32.32 C ATOM 1257 O GLU A 81 8.733 -13.488 -6.378 1.00 3.21 O ATOM 1258 CB GLU A 81 8.669 -11.481 -8.606 1.00 74.44 C ATOM 1259 CG GLU A 81 8.693 -10.212 -9.441 1.00 13.11 C ATOM 1260 CD GLU A 81 9.992 -10.040 -10.204 1.00 11.34 C ATOM 1261 OE1 GLU A 81 10.091 -10.562 -11.333 1.00 41.14 O ATOM 1262 OE2 GLU A 81 10.910 -9.382 -9.670 1.00 13.12 O ATOM 0 H GLU A 81 11.004 -12.585 -7.519 1.00 62.02 H new ATOM 0 HA GLU A 81 9.224 -10.305 -6.896 1.00 22.43 H new ATOM 0 HB2 GLU A 81 9.161 -12.280 -9.161 1.00 74.44 H new ATOM 0 HB3 GLU A 81 7.634 -11.788 -8.456 1.00 74.44 H new ATOM 0 HG2 GLU A 81 7.862 -10.230 -10.146 1.00 13.11 H new ATOM 0 HG3 GLU A 81 8.541 -9.351 -8.791 1.00 13.11 H new ATOM 1269 N VAL A 82 8.082 -11.683 -5.202 1.00 43.14 N ATOM 1270 CA VAL A 82 7.416 -12.462 -4.166 1.00 21.33 C ATOM 1271 C VAL A 82 5.946 -12.683 -4.503 1.00 51.23 C ATOM 1272 O VAL A 82 5.139 -11.755 -4.442 1.00 13.02 O ATOM 1273 CB VAL A 82 7.518 -11.773 -2.792 1.00 43.43 C ATOM 1274 CG1 VAL A 82 7.377 -12.791 -1.671 1.00 63.24 C ATOM 1275 CG2 VAL A 82 8.832 -11.015 -2.673 1.00 61.13 C ATOM 0 H VAL A 82 8.037 -10.673 -5.064 1.00 43.14 H new ATOM 0 HA VAL A 82 7.924 -13.425 -4.120 1.00 21.33 H new ATOM 0 HB VAL A 82 6.702 -11.056 -2.703 1.00 43.43 H new ATOM 0 HG11 VAL A 82 7.452 -12.285 -0.708 1.00 63.24 H new ATOM 0 HG12 VAL A 82 6.408 -13.284 -1.747 1.00 63.24 H new ATOM 0 HG13 VAL A 82 8.170 -13.534 -1.753 1.00 63.24 H new ATOM 0 HG21 VAL A 82 8.888 -10.534 -1.696 1.00 61.13 H new ATOM 0 HG22 VAL A 82 9.664 -11.710 -2.783 1.00 61.13 H new ATOM 0 HG23 VAL A 82 8.887 -10.257 -3.454 1.00 61.13 H new ATOM 1285 N ILE A 83 5.605 -13.917 -4.860 1.00 0.45 N ATOM 1286 CA ILE A 83 4.231 -14.259 -5.205 1.00 61.33 C ATOM 1287 C ILE A 83 3.395 -14.509 -3.955 1.00 3.35 C ATOM 1288 O ILE A 83 3.623 -15.474 -3.225 1.00 14.10 O ATOM 1289 CB ILE A 83 4.172 -15.507 -6.106 1.00 32.31 C ATOM 1290 CG1 ILE A 83 5.052 -15.313 -7.343 1.00 13.15 C ATOM 1291 CG2 ILE A 83 2.735 -15.799 -6.512 1.00 61.51 C ATOM 1292 CD1 ILE A 83 6.474 -15.793 -7.154 1.00 13.13 C ATOM 0 H ILE A 83 6.261 -14.696 -4.918 1.00 0.45 H new ATOM 0 HA ILE A 83 3.821 -13.408 -5.748 1.00 61.33 H new ATOM 0 HB ILE A 83 4.551 -16.361 -5.544 1.00 32.31 H new ATOM 0 HG12 ILE A 83 4.606 -15.845 -8.183 1.00 13.15 H new ATOM 0 HG13 ILE A 83 5.066 -14.255 -7.607 1.00 13.15 H new ATOM 0 HG21 ILE A 83 2.709 -16.684 -7.148 1.00 61.51 H new ATOM 0 HG22 ILE A 83 2.134 -15.976 -5.620 1.00 61.51 H new ATOM 0 HG23 ILE A 83 2.331 -14.947 -7.059 1.00 61.51 H new ATOM 0 HD11 ILE A 83 7.040 -15.624 -8.070 1.00 13.13 H new ATOM 0 HD12 ILE A 83 6.938 -15.243 -6.335 1.00 13.13 H new ATOM 0 HD13 ILE A 83 6.471 -16.858 -6.920 1.00 13.13 H new ATOM 1304 N VAL A 84 2.425 -13.632 -3.713 1.00 63.42 N ATOM 1305 CA VAL A 84 1.552 -13.759 -2.552 1.00 45.41 C ATOM 1306 C VAL A 84 0.093 -13.888 -2.973 1.00 51.42 C ATOM 1307 O VAL A 84 -0.412 -13.080 -3.753 1.00 75.43 O ATOM 1308 CB VAL A 84 1.698 -12.551 -1.607 1.00 32.32 C ATOM 1309 CG1 VAL A 84 3.017 -12.619 -0.853 1.00 31.35 C ATOM 1310 CG2 VAL A 84 1.586 -11.249 -2.385 1.00 73.22 C ATOM 0 H VAL A 84 2.224 -12.826 -4.305 1.00 63.42 H new ATOM 0 HA VAL A 84 1.855 -14.663 -2.024 1.00 45.41 H new ATOM 0 HB VAL A 84 0.888 -12.583 -0.878 1.00 32.32 H new ATOM 0 HG11 VAL A 84 3.102 -11.758 -0.191 1.00 31.35 H new ATOM 0 HG12 VAL A 84 3.052 -13.535 -0.263 1.00 31.35 H new ATOM 0 HG13 VAL A 84 3.843 -12.613 -1.564 1.00 31.35 H new ATOM 0 HG21 VAL A 84 1.691 -10.407 -1.701 1.00 73.22 H new ATOM 0 HG22 VAL A 84 2.373 -11.206 -3.138 1.00 73.22 H new ATOM 0 HG23 VAL A 84 0.613 -11.200 -2.874 1.00 73.22 H new ATOM 1320 N ASP A 85 -0.579 -14.908 -2.452 1.00 15.45 N ATOM 1321 CA ASP A 85 -1.983 -15.142 -2.772 1.00 22.12 C ATOM 1322 C ASP A 85 -2.885 -14.680 -1.632 1.00 1.32 C ATOM 1323 O ASP A 85 -2.806 -15.195 -0.517 1.00 21.05 O ATOM 1324 CB ASP A 85 -2.222 -16.625 -3.058 1.00 64.42 C ATOM 1325 CG ASP A 85 -2.998 -16.850 -4.341 1.00 11.32 C ATOM 1326 OD1 ASP A 85 -4.165 -16.410 -4.412 1.00 45.02 O ATOM 1327 OD2 ASP A 85 -2.440 -17.466 -5.273 1.00 3.31 O ATOM 0 H ASP A 85 -0.175 -15.586 -1.806 1.00 15.45 H new ATOM 0 HA ASP A 85 -2.228 -14.563 -3.663 1.00 22.12 H new ATOM 0 HB2 ASP A 85 -1.263 -17.139 -3.122 1.00 64.42 H new ATOM 0 HB3 ASP A 85 -2.766 -17.069 -2.225 1.00 64.42 H new ATOM 1332 N ARG A 86 -3.741 -13.704 -1.920 1.00 24.44 N ATOM 1333 CA ARG A 86 -4.656 -13.171 -0.918 1.00 41.10 C ATOM 1334 C ARG A 86 -3.897 -12.393 0.153 1.00 64.11 C ATOM 1335 O ARG A 86 -3.541 -12.924 1.206 1.00 51.45 O ATOM 1336 CB ARG A 86 -5.454 -14.304 -0.271 1.00 14.12 C ATOM 1337 CG ARG A 86 -6.905 -13.945 0.007 1.00 71.43 C ATOM 1338 CD ARG A 86 -7.798 -15.176 -0.023 1.00 14.34 C ATOM 1339 NE ARG A 86 -9.201 -14.829 -0.239 1.00 5.14 N ATOM 1340 CZ ARG A 86 -9.706 -14.516 -1.427 1.00 5.23 C ATOM 1341 NH1 ARG A 86 -8.927 -14.506 -2.500 1.00 31.41 N ATOM 1342 NH2 ARG A 86 -10.992 -14.212 -1.543 1.00 1.31 N ATOM 0 H ARG A 86 -3.820 -13.267 -2.838 1.00 24.44 H new ATOM 0 HA ARG A 86 -5.345 -12.490 -1.418 1.00 41.10 H new ATOM 0 HB2 ARG A 86 -5.423 -15.177 -0.923 1.00 14.12 H new ATOM 0 HB3 ARG A 86 -4.973 -14.588 0.665 1.00 14.12 H new ATOM 0 HG2 ARG A 86 -6.981 -13.462 0.981 1.00 71.43 H new ATOM 0 HG3 ARG A 86 -7.251 -13.225 -0.734 1.00 71.43 H new ATOM 0 HD2 ARG A 86 -7.464 -15.847 -0.815 1.00 14.34 H new ATOM 0 HD3 ARG A 86 -7.699 -15.719 0.917 1.00 14.34 H new ATOM 0 HE ARG A 86 -9.827 -14.827 0.567 1.00 5.14 H new ATOM 0 HH11 ARG A 86 -7.938 -14.739 -2.414 1.00 31.41 H new ATOM 0 HH12 ARG A 86 -9.317 -14.265 -3.411 1.00 31.41 H new ATOM 0 HH21 ARG A 86 -11.594 -14.218 -0.720 1.00 1.31 H new ATOM 0 HH22 ARG A 86 -11.379 -13.972 -2.456 1.00 1.31 H new ATOM 1356 N PRO A 87 -3.641 -11.105 -0.120 1.00 70.03 N ATOM 1357 CA PRO A 87 -4.059 -10.463 -1.370 1.00 43.11 C ATOM 1358 C PRO A 87 -3.277 -10.975 -2.575 1.00 25.23 C ATOM 1359 O PRO A 87 -2.181 -11.520 -2.431 1.00 0.54 O ATOM 1360 CB PRO A 87 -3.756 -8.982 -1.127 1.00 33.35 C ATOM 1361 CG PRO A 87 -2.671 -8.980 -0.106 1.00 32.23 C ATOM 1362 CD PRO A 87 -2.924 -10.176 0.770 1.00 70.43 C ATOM 0 HA PRO A 87 -5.104 -10.666 -1.602 1.00 43.11 H new ATOM 0 HB2 PRO A 87 -3.437 -8.487 -2.045 1.00 33.35 H new ATOM 0 HB3 PRO A 87 -4.638 -8.451 -0.769 1.00 33.35 H new ATOM 0 HG2 PRO A 87 -1.691 -9.043 -0.578 1.00 32.23 H new ATOM 0 HG3 PRO A 87 -2.686 -8.059 0.477 1.00 32.23 H new ATOM 0 HD2 PRO A 87 -1.994 -10.609 1.137 1.00 70.43 H new ATOM 0 HD3 PRO A 87 -3.521 -9.915 1.644 1.00 70.43 H new ATOM 1370 N LEU A 88 -3.845 -10.798 -3.762 1.00 41.32 N ATOM 1371 CA LEU A 88 -3.200 -11.242 -4.993 1.00 50.21 C ATOM 1372 C LEU A 88 -2.315 -10.142 -5.572 1.00 34.23 C ATOM 1373 O LEU A 88 -2.810 -9.181 -6.160 1.00 43.01 O ATOM 1374 CB LEU A 88 -4.253 -11.659 -6.021 1.00 64.55 C ATOM 1375 CG LEU A 88 -4.871 -13.044 -5.825 1.00 23.22 C ATOM 1376 CD1 LEU A 88 -6.102 -12.958 -4.936 1.00 3.10 C ATOM 1377 CD2 LEU A 88 -5.223 -13.667 -7.168 1.00 10.40 C ATOM 0 H LEU A 88 -4.751 -10.350 -3.899 1.00 41.32 H new ATOM 0 HA LEU A 88 -2.572 -12.101 -4.756 1.00 50.21 H new ATOM 0 HB2 LEU A 88 -5.055 -10.921 -6.010 1.00 64.55 H new ATOM 0 HB3 LEU A 88 -3.799 -11.622 -7.011 1.00 64.55 H new ATOM 0 HG LEU A 88 -4.137 -13.682 -5.333 1.00 23.22 H new ATOM 0 HD11 LEU A 88 -6.528 -13.953 -4.808 1.00 3.10 H new ATOM 0 HD12 LEU A 88 -5.821 -12.556 -3.963 1.00 3.10 H new ATOM 0 HD13 LEU A 88 -6.840 -12.304 -5.399 1.00 3.10 H new ATOM 0 HD21 LEU A 88 -5.661 -14.652 -7.008 1.00 10.40 H new ATOM 0 HD22 LEU A 88 -5.939 -13.031 -7.688 1.00 10.40 H new ATOM 0 HD23 LEU A 88 -4.321 -13.765 -7.771 1.00 10.40 H new ATOM 1389 N GLN A 89 -1.006 -10.293 -5.402 1.00 2.41 N ATOM 1390 CA GLN A 89 -0.053 -9.313 -5.909 1.00 43.41 C ATOM 1391 C GLN A 89 1.380 -9.802 -5.728 1.00 22.42 C ATOM 1392 O GLN A 89 1.612 -10.921 -5.269 1.00 75.21 O ATOM 1393 CB GLN A 89 -0.240 -7.972 -5.197 1.00 1.11 C ATOM 1394 CG GLN A 89 -0.702 -6.853 -6.117 1.00 62.51 C ATOM 1395 CD GLN A 89 0.454 -6.110 -6.757 1.00 53.15 C ATOM 1396 OE1 GLN A 89 0.794 -6.348 -7.916 1.00 65.55 O ATOM 1397 NE2 GLN A 89 1.064 -5.202 -6.005 1.00 31.14 N ATOM 0 H GLN A 89 -0.581 -11.084 -4.918 1.00 2.41 H new ATOM 0 HA GLN A 89 -0.240 -9.180 -6.975 1.00 43.41 H new ATOM 0 HB2 GLN A 89 -0.967 -8.095 -4.394 1.00 1.11 H new ATOM 0 HB3 GLN A 89 0.702 -7.683 -4.732 1.00 1.11 H new ATOM 0 HG2 GLN A 89 -1.339 -7.269 -6.898 1.00 62.51 H new ATOM 0 HG3 GLN A 89 -1.312 -6.150 -5.550 1.00 62.51 H new ATOM 0 HE21 GLN A 89 0.749 -5.037 -5.049 1.00 31.14 H new ATOM 0 HE22 GLN A 89 1.847 -4.670 -6.383 1.00 31.14 H new ATOM 1406 N VAL A 90 2.340 -8.957 -6.091 1.00 72.43 N ATOM 1407 CA VAL A 90 3.751 -9.304 -5.968 1.00 13.21 C ATOM 1408 C VAL A 90 4.523 -8.211 -5.238 1.00 42.31 C ATOM 1409 O VAL A 90 4.117 -7.049 -5.229 1.00 14.41 O ATOM 1410 CB VAL A 90 4.394 -9.538 -7.348 1.00 12.22 C ATOM 1411 CG1 VAL A 90 5.763 -10.183 -7.196 1.00 40.24 C ATOM 1412 CG2 VAL A 90 3.486 -10.392 -8.220 1.00 64.11 C ATOM 0 H VAL A 90 2.166 -8.027 -6.473 1.00 72.43 H new ATOM 0 HA VAL A 90 3.801 -10.228 -5.391 1.00 13.21 H new ATOM 0 HB VAL A 90 4.526 -8.573 -7.837 1.00 12.22 H new ATOM 0 HG11 VAL A 90 6.202 -10.341 -8.181 1.00 40.24 H new ATOM 0 HG12 VAL A 90 6.410 -9.530 -6.611 1.00 40.24 H new ATOM 0 HG13 VAL A 90 5.659 -11.141 -6.687 1.00 40.24 H new ATOM 0 HG21 VAL A 90 3.956 -10.548 -9.191 1.00 64.11 H new ATOM 0 HG22 VAL A 90 3.320 -11.356 -7.738 1.00 64.11 H new ATOM 0 HG23 VAL A 90 2.530 -9.885 -8.356 1.00 64.11 H new ATOM 1422 N PHE A 91 5.640 -8.591 -4.627 1.00 44.21 N ATOM 1423 CA PHE A 91 6.471 -7.643 -3.893 1.00 51.25 C ATOM 1424 C PHE A 91 7.819 -7.454 -4.583 1.00 22.14 C ATOM 1425 O PHE A 91 8.538 -8.420 -4.840 1.00 23.11 O ATOM 1426 CB PHE A 91 6.683 -8.124 -2.456 1.00 51.44 C ATOM 1427 CG PHE A 91 5.432 -8.098 -1.625 1.00 61.22 C ATOM 1428 CD1 PHE A 91 4.813 -6.897 -1.318 1.00 20.42 C ATOM 1429 CD2 PHE A 91 4.876 -9.275 -1.151 1.00 31.24 C ATOM 1430 CE1 PHE A 91 3.662 -6.871 -0.553 1.00 53.54 C ATOM 1431 CE2 PHE A 91 3.725 -9.255 -0.386 1.00 54.53 C ATOM 1432 CZ PHE A 91 3.117 -8.051 -0.086 1.00 45.32 C ATOM 0 H PHE A 91 5.991 -9.549 -4.625 1.00 44.21 H new ATOM 0 HA PHE A 91 5.955 -6.683 -3.875 1.00 51.25 H new ATOM 0 HB2 PHE A 91 7.076 -9.141 -2.476 1.00 51.44 H new ATOM 0 HB3 PHE A 91 7.439 -7.500 -1.980 1.00 51.44 H new ATOM 0 HD1 PHE A 91 5.234 -5.971 -1.680 1.00 20.42 H new ATOM 0 HD2 PHE A 91 5.347 -10.219 -1.382 1.00 31.24 H new ATOM 0 HE1 PHE A 91 3.189 -5.928 -0.321 1.00 53.54 H new ATOM 0 HE2 PHE A 91 3.301 -10.180 -0.023 1.00 54.53 H new ATOM 0 HZ PHE A 91 2.218 -8.033 0.512 1.00 45.32 H new ATOM 1442 N HIS A 92 8.155 -6.203 -4.880 1.00 2.34 N ATOM 1443 CA HIS A 92 9.417 -5.886 -5.539 1.00 50.03 C ATOM 1444 C HIS A 92 10.596 -6.126 -4.601 1.00 32.11 C ATOM 1445 O HIS A 92 10.729 -5.463 -3.572 1.00 52.13 O ATOM 1446 CB HIS A 92 9.417 -4.433 -6.016 1.00 20.13 C ATOM 1447 CG HIS A 92 9.759 -4.278 -7.466 1.00 24.35 C ATOM 1448 ND1 HIS A 92 10.981 -4.639 -7.993 1.00 4.31 N ATOM 1449 CD2 HIS A 92 9.031 -3.800 -8.501 1.00 52.11 C ATOM 1450 CE1 HIS A 92 10.990 -4.387 -9.290 1.00 23.22 C ATOM 1451 NE2 HIS A 92 9.818 -3.878 -9.623 1.00 61.15 N ATOM 0 H HIS A 92 7.571 -5.392 -4.675 1.00 2.34 H new ATOM 0 HA HIS A 92 9.523 -6.544 -6.402 1.00 50.03 H new ATOM 0 HB2 HIS A 92 8.433 -4.000 -5.835 1.00 20.13 H new ATOM 0 HB3 HIS A 92 10.130 -3.864 -5.420 1.00 20.13 H new ATOM 0 HD2 HIS A 92 8.019 -3.426 -8.453 1.00 52.11 H new ATOM 0 HE1 HIS A 92 11.815 -4.567 -9.963 1.00 23.22 H new ATOM 0 HE2 HIS A 92 9.542 -3.590 -10.562 1.00 61.15 H new ATOM 1459 N VAL A 93 11.449 -7.079 -4.962 1.00 70.31 N ATOM 1460 CA VAL A 93 12.617 -7.407 -4.153 1.00 12.20 C ATOM 1461 C VAL A 93 13.903 -7.257 -4.958 1.00 13.20 C ATOM 1462 O VAL A 93 14.028 -7.805 -6.052 1.00 64.14 O ATOM 1463 CB VAL A 93 12.533 -8.843 -3.602 1.00 43.14 C ATOM 1464 CG1 VAL A 93 13.810 -9.205 -2.859 1.00 12.13 C ATOM 1465 CG2 VAL A 93 11.319 -8.997 -2.700 1.00 35.21 C ATOM 0 H VAL A 93 11.353 -7.638 -5.810 1.00 70.31 H new ATOM 0 HA VAL A 93 12.631 -6.706 -3.318 1.00 12.20 H new ATOM 0 HB VAL A 93 12.422 -9.530 -4.441 1.00 43.14 H new ATOM 0 HG11 VAL A 93 13.732 -10.223 -2.477 1.00 12.13 H new ATOM 0 HG12 VAL A 93 14.659 -9.137 -3.539 1.00 12.13 H new ATOM 0 HG13 VAL A 93 13.955 -8.515 -2.028 1.00 12.13 H new ATOM 0 HG21 VAL A 93 11.275 -10.018 -2.320 1.00 35.21 H new ATOM 0 HG22 VAL A 93 11.396 -8.301 -1.864 1.00 35.21 H new ATOM 0 HG23 VAL A 93 10.414 -8.783 -3.268 1.00 35.21 H new ATOM 1475 N GLU A 94 14.855 -6.511 -4.408 1.00 4.24 N ATOM 1476 CA GLU A 94 16.132 -6.289 -5.076 1.00 5.24 C ATOM 1477 C GLU A 94 17.292 -6.425 -4.093 1.00 14.05 C ATOM 1478 O GLU A 94 17.449 -5.609 -3.184 1.00 62.21 O ATOM 1479 CB GLU A 94 16.160 -4.903 -5.724 1.00 72.34 C ATOM 1480 CG GLU A 94 17.425 -4.628 -6.519 1.00 63.32 C ATOM 1481 CD GLU A 94 17.288 -3.431 -7.439 1.00 74.05 C ATOM 1482 OE1 GLU A 94 16.373 -2.611 -7.212 1.00 44.12 O ATOM 1483 OE2 GLU A 94 18.093 -3.314 -8.386 1.00 71.15 O ATOM 0 H GLU A 94 14.767 -6.050 -3.502 1.00 4.24 H new ATOM 0 HA GLU A 94 16.243 -7.048 -5.851 1.00 5.24 H new ATOM 0 HB2 GLU A 94 15.298 -4.802 -6.383 1.00 72.34 H new ATOM 0 HB3 GLU A 94 16.058 -4.146 -4.947 1.00 72.34 H new ATOM 0 HG2 GLU A 94 18.253 -4.459 -5.830 1.00 63.32 H new ATOM 0 HG3 GLU A 94 17.677 -5.509 -7.110 1.00 63.32 H new ATOM 1490 N VAL A 95 18.101 -7.463 -4.281 1.00 13.22 N ATOM 1491 CA VAL A 95 19.246 -7.707 -3.412 1.00 51.21 C ATOM 1492 C VAL A 95 20.557 -7.443 -4.144 1.00 10.52 C ATOM 1493 O VAL A 95 20.769 -7.931 -5.253 1.00 21.42 O ATOM 1494 CB VAL A 95 19.250 -9.153 -2.881 1.00 55.40 C ATOM 1495 CG1 VAL A 95 18.066 -9.384 -1.954 1.00 73.24 C ATOM 1496 CG2 VAL A 95 19.236 -10.144 -4.035 1.00 52.40 C ATOM 0 H VAL A 95 17.984 -8.148 -5.027 1.00 13.22 H new ATOM 0 HA VAL A 95 19.157 -7.019 -2.571 1.00 51.21 H new ATOM 0 HB VAL A 95 20.165 -9.310 -2.309 1.00 55.40 H new ATOM 0 HG11 VAL A 95 18.085 -10.411 -1.588 1.00 73.24 H new ATOM 0 HG12 VAL A 95 18.125 -8.697 -1.110 1.00 73.24 H new ATOM 0 HG13 VAL A 95 17.138 -9.210 -2.499 1.00 73.24 H new ATOM 0 HG21 VAL A 95 19.239 -11.161 -3.642 1.00 52.40 H new ATOM 0 HG22 VAL A 95 18.340 -9.990 -4.636 1.00 52.40 H new ATOM 0 HG23 VAL A 95 20.119 -9.992 -4.655 1.00 52.40 H new ATOM 1506 N GLU A 96 21.434 -6.666 -3.514 1.00 74.05 N ATOM 1507 CA GLU A 96 22.725 -6.337 -4.107 1.00 14.40 C ATOM 1508 C GLU A 96 23.858 -7.047 -3.372 1.00 74.43 C ATOM 1509 O GLU A 96 23.756 -7.333 -2.179 1.00 60.01 O ATOM 1510 CB GLU A 96 22.953 -4.824 -4.078 1.00 0.02 C ATOM 1511 CG GLU A 96 23.280 -4.231 -5.438 1.00 64.52 C ATOM 1512 CD GLU A 96 22.486 -2.974 -5.733 1.00 43.21 C ATOM 1513 OE1 GLU A 96 22.899 -1.889 -5.273 1.00 24.02 O ATOM 1514 OE2 GLU A 96 21.451 -3.075 -6.425 1.00 4.11 O ATOM 0 H GLU A 96 21.274 -6.254 -2.595 1.00 74.05 H new ATOM 0 HA GLU A 96 22.718 -6.677 -5.143 1.00 14.40 H new ATOM 0 HB2 GLU A 96 22.060 -4.338 -3.684 1.00 0.02 H new ATOM 0 HB3 GLU A 96 23.767 -4.601 -3.389 1.00 0.02 H new ATOM 0 HG2 GLU A 96 24.345 -4.003 -5.484 1.00 64.52 H new ATOM 0 HG3 GLU A 96 23.079 -4.973 -6.211 1.00 64.52 H new ATOM 1521 N VAL A 97 24.937 -7.331 -4.094 1.00 41.14 N ATOM 1522 CA VAL A 97 26.090 -8.008 -3.512 1.00 41.45 C ATOM 1523 C VAL A 97 27.178 -7.010 -3.131 1.00 62.15 C ATOM 1524 O VAL A 97 27.606 -6.199 -3.953 1.00 24.21 O ATOM 1525 CB VAL A 97 26.680 -9.048 -4.484 1.00 14.44 C ATOM 1526 CG1 VAL A 97 25.805 -10.291 -4.530 1.00 21.33 C ATOM 1527 CG2 VAL A 97 26.841 -8.448 -5.872 1.00 42.32 C ATOM 0 H VAL A 97 25.037 -7.103 -5.083 1.00 41.14 H new ATOM 0 HA VAL A 97 25.738 -8.518 -2.615 1.00 41.45 H new ATOM 0 HB VAL A 97 27.666 -9.340 -4.123 1.00 14.44 H new ATOM 0 HG11 VAL A 97 26.237 -11.015 -5.221 1.00 21.33 H new ATOM 0 HG12 VAL A 97 25.745 -10.731 -3.535 1.00 21.33 H new ATOM 0 HG13 VAL A 97 24.805 -10.019 -4.867 1.00 21.33 H new ATOM 0 HG21 VAL A 97 27.259 -9.196 -6.546 1.00 42.32 H new ATOM 0 HG22 VAL A 97 25.868 -8.127 -6.245 1.00 42.32 H new ATOM 0 HG23 VAL A 97 27.511 -7.590 -5.822 1.00 42.32 H new ATOM 1537 N ARG A 98 27.622 -7.076 -1.880 1.00 51.14 N ATOM 1538 CA ARG A 98 28.660 -6.178 -1.390 1.00 2.22 C ATOM 1539 C ARG A 98 30.002 -6.898 -1.296 1.00 42.13 C ATOM 1540 O ARG A 98 30.163 -7.833 -0.512 1.00 31.11 O ATOM 1541 CB ARG A 98 28.274 -5.617 -0.020 1.00 13.00 C ATOM 1542 CG ARG A 98 29.277 -4.619 0.534 1.00 13.54 C ATOM 1543 CD ARG A 98 29.348 -4.685 2.052 1.00 41.10 C ATOM 1544 NE ARG A 98 30.369 -5.622 2.511 1.00 24.53 N ATOM 1545 CZ ARG A 98 30.497 -6.009 3.776 1.00 52.11 C ATOM 1546 NH1 ARG A 98 29.671 -5.541 4.702 1.00 63.11 N ATOM 1547 NH2 ARG A 98 31.451 -6.865 4.116 1.00 24.41 N ATOM 0 H ARG A 98 27.279 -7.742 -1.188 1.00 51.14 H new ATOM 0 HA ARG A 98 28.757 -5.355 -2.098 1.00 2.22 H new ATOM 0 HB2 ARG A 98 27.299 -5.135 -0.096 1.00 13.00 H new ATOM 0 HB3 ARG A 98 28.168 -6.442 0.684 1.00 13.00 H new ATOM 0 HG2 ARG A 98 30.262 -4.820 0.113 1.00 13.54 H new ATOM 0 HG3 ARG A 98 28.998 -3.612 0.225 1.00 13.54 H new ATOM 0 HD2 ARG A 98 29.562 -3.693 2.448 1.00 41.10 H new ATOM 0 HD3 ARG A 98 28.377 -4.984 2.448 1.00 41.10 H new ATOM 0 HE ARG A 98 31.020 -6.001 1.823 1.00 24.53 H new ATOM 0 HH11 ARG A 98 28.936 -4.883 4.444 1.00 63.11 H new ATOM 0 HH12 ARG A 98 29.771 -5.839 5.672 1.00 63.11 H new ATOM 0 HH21 ARG A 98 32.088 -7.227 3.406 1.00 24.41 H new ATOM 0 HH22 ARG A 98 31.548 -7.161 5.087 1.00 24.41 H new ATOM 1561 N ASP A 99 30.962 -6.456 -2.101 1.00 60.14 N ATOM 1562 CA ASP A 99 32.290 -7.058 -2.109 1.00 45.45 C ATOM 1563 C ASP A 99 33.199 -6.355 -3.113 1.00 41.13 C ATOM 1564 O ASP A 99 32.853 -5.301 -3.647 1.00 15.42 O ATOM 1565 CB ASP A 99 32.197 -8.547 -2.443 1.00 60.40 C ATOM 1566 CG ASP A 99 32.864 -9.418 -1.397 1.00 3.15 C ATOM 1567 OD1 ASP A 99 32.391 -9.424 -0.241 1.00 71.42 O ATOM 1568 OD2 ASP A 99 33.861 -10.092 -1.733 1.00 34.24 O ATOM 0 H ASP A 99 30.845 -5.683 -2.756 1.00 60.14 H new ATOM 0 HA ASP A 99 32.720 -6.943 -1.114 1.00 45.45 H new ATOM 0 HB2 ASP A 99 31.149 -8.831 -2.533 1.00 60.40 H new ATOM 0 HB3 ASP A 99 32.661 -8.729 -3.412 1.00 60.40 H new ATOM 1573 N ILE A 100 34.363 -6.945 -3.365 1.00 33.25 N ATOM 1574 CA ILE A 100 35.321 -6.375 -4.304 1.00 34.51 C ATOM 1575 C ILE A 100 35.623 -7.349 -5.438 1.00 43.43 C ATOM 1576 O ILE A 100 35.461 -8.559 -5.291 1.00 74.02 O ATOM 1577 CB ILE A 100 36.638 -5.995 -3.603 1.00 64.43 C ATOM 1578 CG1 ILE A 100 36.351 -5.286 -2.278 1.00 72.52 C ATOM 1579 CG2 ILE A 100 37.485 -5.114 -4.509 1.00 52.32 C ATOM 1580 CD1 ILE A 100 35.561 -4.006 -2.437 1.00 23.01 C ATOM 0 H ILE A 100 34.665 -7.818 -2.932 1.00 33.25 H new ATOM 0 HA ILE A 100 34.865 -5.474 -4.714 1.00 34.51 H new ATOM 0 HB ILE A 100 37.196 -6.907 -3.391 1.00 64.43 H new ATOM 0 HG12 ILE A 100 35.802 -5.964 -1.624 1.00 72.52 H new ATOM 0 HG13 ILE A 100 37.296 -5.061 -1.783 1.00 72.52 H new ATOM 0 HG21 ILE A 100 38.413 -4.854 -3.999 1.00 52.32 H new ATOM 0 HG22 ILE A 100 37.715 -5.652 -5.429 1.00 52.32 H new ATOM 0 HG23 ILE A 100 36.935 -4.204 -4.749 1.00 52.32 H new ATOM 0 HD11 ILE A 100 35.394 -3.557 -1.458 1.00 23.01 H new ATOM 0 HD12 ILE A 100 36.118 -3.310 -3.065 1.00 23.01 H new ATOM 0 HD13 ILE A 100 34.601 -4.227 -2.903 1.00 23.01 H new ATOM 1592 N ASN A 101 36.067 -6.810 -6.570 1.00 35.31 N ATOM 1593 CA ASN A 101 36.394 -7.631 -7.730 1.00 32.41 C ATOM 1594 C ASN A 101 37.748 -8.310 -7.551 1.00 62.41 C ATOM 1595 O ASN A 101 37.892 -9.507 -7.802 1.00 62.11 O ATOM 1596 CB ASN A 101 36.403 -6.777 -8.999 1.00 74.12 C ATOM 1597 CG ASN A 101 37.322 -5.577 -8.882 1.00 42.10 C ATOM 1598 OD1 ASN A 101 38.514 -5.663 -9.178 1.00 1.01 O ATOM 1599 ND2 ASN A 101 36.771 -4.449 -8.448 1.00 72.51 N ATOM 0 H ASN A 101 36.208 -5.809 -6.708 1.00 35.31 H new ATOM 0 HA ASN A 101 35.630 -8.403 -7.825 1.00 32.41 H new ATOM 0 HB2 ASN A 101 36.716 -7.390 -9.844 1.00 74.12 H new ATOM 0 HB3 ASN A 101 35.390 -6.436 -9.211 1.00 74.12 H new ATOM 0 HD21 ASN A 101 37.340 -3.609 -8.349 1.00 72.51 H new ATOM 0 HD22 ASN A 101 35.779 -4.423 -8.214 1.00 72.51 H new ATOM 1606 N ASP A 102 38.738 -7.539 -7.115 1.00 53.44 N ATOM 1607 CA ASP A 102 40.081 -8.065 -6.901 1.00 34.31 C ATOM 1608 C ASP A 102 40.307 -8.393 -5.428 1.00 50.13 C ATOM 1609 O ASP A 102 41.433 -8.340 -4.937 1.00 4.44 O ATOM 1610 CB ASP A 102 41.129 -7.059 -7.379 1.00 75.23 C ATOM 1611 CG ASP A 102 41.235 -7.008 -8.891 1.00 33.33 C ATOM 1612 OD1 ASP A 102 40.997 -8.050 -9.538 1.00 14.30 O ATOM 1613 OD2 ASP A 102 41.555 -5.927 -9.426 1.00 40.15 O ATOM 0 H ASP A 102 38.636 -6.547 -6.903 1.00 53.44 H new ATOM 0 HA ASP A 102 40.181 -8.983 -7.479 1.00 34.31 H new ATOM 0 HB2 ASP A 102 40.876 -6.068 -7.002 1.00 75.23 H new ATOM 0 HB3 ASP A 102 42.099 -7.322 -6.958 1.00 75.23 H new ATOM 1618 N ASN A 103 39.228 -8.731 -4.730 1.00 11.12 N ATOM 1619 CA ASN A 103 39.309 -9.066 -3.313 1.00 14.54 C ATOM 1620 C ASN A 103 39.947 -7.928 -2.521 1.00 34.23 C ATOM 1621 O ASN A 103 39.347 -6.868 -2.346 1.00 51.35 O ATOM 1622 CB ASN A 103 40.112 -10.352 -3.116 1.00 65.41 C ATOM 1623 CG ASN A 103 39.260 -11.492 -2.591 1.00 44.14 C ATOM 1624 OD1 ASN A 103 38.432 -11.303 -1.700 1.00 63.22 O ATOM 1625 ND2 ASN A 103 39.461 -12.683 -3.143 1.00 55.04 N ATOM 0 H ASN A 103 38.288 -8.780 -5.122 1.00 11.12 H new ATOM 0 HA ASN A 103 38.295 -9.219 -2.943 1.00 14.54 H new ATOM 0 HB2 ASN A 103 40.561 -10.645 -4.065 1.00 65.41 H new ATOM 0 HB3 ASN A 103 40.930 -10.163 -2.421 1.00 65.41 H new ATOM 0 HD21 ASN A 103 38.918 -13.488 -2.831 1.00 55.04 H new ATOM 0 HD22 ASN A 103 40.158 -12.793 -3.879 1.00 55.04 H new TER 1632 ASN A 103