USER MOD reduce.3.24.130724 H: found=0, std=0, add=906, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 905 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 SER OG : rot 180:sc= 0.811 USER MOD Set 1.2: A 107 THR OG1 : rot -80:sc= 1.34 USER MOD Set 1.3: A 132 GLN : amide:sc= 0.68 K(o=2.8,f=1.6) USER MOD Set 2.1: A 78 THR OG1 : rot 177:sc= 1.01 USER MOD Set 2.2: A 93 THR OG1 : rot -65:sc= 1.19 USER MOD Set 3.1: A 37 HIS : no HE2:sc= 0.765 K(o=0.96,f=-8.9!) USER MOD Set 3.2: A 59 GLN : amide:sc= 0.199 K(o=0.96,f=-2) USER MOD Set 4.1: A 27 GLN : amide:sc= 1.44 K(o=2.6,f=-1.9) USER MOD Set 4.2: A 48 GLN : amide:sc= 1.13 K(o=2.6,f=-0.4) USER MOD Single : A 5 SER OG : rot -40:sc= 0.0138 USER MOD Single : A 8 SER OG : rot -165:sc= 1.15 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0.666 K(o=0.67,f=-0.0022) USER MOD Single : A 24 SER OG : rot -29:sc= 0.731 USER MOD Single : A 26 TYR OH : rot 165:sc= 1.24 USER MOD Single : A 28 THR OG1 : rot -74:sc= 0.75 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot -62:sc= 1.09 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 175:sc= 0.121 USER MOD Single : A 42 GLN : amide:sc= 0.567 K(o=0.57,f=0) USER MOD Single : A 52 THR OG1 : rot 82:sc= 1.96 USER MOD Single : A 55 THR OG1 : rot 43:sc= 1.25 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 1.02 (180deg=1.02) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 HIS : no HD1:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -0.194 K(o=-0.19,f=-1.4!) USER MOD Single : A 86 SER OG : rot -150:sc= 0.631 USER MOD Single : A 87 SER OG : rot 59:sc= 0.246 USER MOD Single : A 91 ASN : amide:sc= -0.168 K(o=-0.17,f=-1.5) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -120:sc= 1.26 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.526 K(o=-0.53,f=-6!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0352 USER MOD Single : A 138 ASN : amide:sc= 0.246 K(o=0.25,f=-1.5!) USER MOD Single : A 140 LYS NZ :NH3+ -117:sc= 0.108 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 HIS : no HE2:sc= -0.37 X(o=-0.37,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 60 N SER A 5 9.103 1.145 5.722 1.00 0.00 N ATOM 61 CA SER A 5 10.315 1.116 6.532 1.00 0.00 C ATOM 62 C SER A 5 10.432 -0.194 7.300 1.00 0.00 C ATOM 63 O SER A 5 9.467 -0.951 7.408 1.00 0.00 O ATOM 64 CB SER A 5 10.324 2.283 7.501 1.00 0.00 C ATOM 65 OG SER A 5 9.312 2.146 8.461 1.00 0.00 O ATOM 0 HA SER A 5 11.170 1.197 5.861 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.294 2.342 7.995 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.187 3.216 6.954 1.00 0.00 H new ATOM 0 HG SER A 5 8.499 1.806 8.033 1.00 0.00 H new ATOM 71 N ALA A 6 11.621 -0.457 7.832 1.00 0.00 N ATOM 72 CA ALA A 6 11.833 -1.609 8.701 1.00 0.00 C ATOM 73 C ALA A 6 12.879 -1.309 9.767 1.00 0.00 C ATOM 74 O ALA A 6 13.863 -0.616 9.508 1.00 0.00 O ATOM 75 CB ALA A 6 12.246 -2.822 7.882 1.00 0.00 C ATOM 0 H ALA A 6 12.453 0.112 7.677 1.00 0.00 H new ATOM 0 HA ALA A 6 10.891 -1.828 9.204 1.00 0.00 H new ATOM 0 HB1 ALA A 6 12.400 -3.673 8.545 1.00 0.00 H new ATOM 0 HB2 ALA A 6 11.462 -3.060 7.163 1.00 0.00 H new ATOM 0 HB3 ALA A 6 13.172 -2.604 7.350 1.00 0.00 H new ATOM 81 N VAL A 7 12.661 -1.835 10.968 1.00 0.00 N ATOM 82 CA VAL A 7 13.543 -1.561 12.096 1.00 0.00 C ATOM 83 C VAL A 7 13.997 -2.851 12.766 1.00 0.00 C ATOM 84 O VAL A 7 13.378 -3.901 12.596 1.00 0.00 O ATOM 85 CB VAL A 7 12.826 -0.673 13.131 1.00 0.00 C ATOM 86 CG1 VAL A 7 12.430 0.657 12.508 1.00 0.00 C ATOM 87 CG2 VAL A 7 11.606 -1.397 13.678 1.00 0.00 C ATOM 0 H VAL A 7 11.880 -2.454 11.185 1.00 0.00 H new ATOM 0 HA VAL A 7 14.420 -1.040 11.712 1.00 0.00 H new ATOM 0 HB VAL A 7 13.509 -0.469 13.956 1.00 0.00 H new ATOM 0 HG11 VAL A 7 11.925 1.272 13.253 1.00 0.00 H new ATOM 0 HG12 VAL A 7 13.323 1.174 12.156 1.00 0.00 H new ATOM 0 HG13 VAL A 7 11.758 0.480 11.668 1.00 0.00 H new ATOM 0 HG21 VAL A 7 11.104 -0.763 14.409 1.00 0.00 H new ATOM 0 HG22 VAL A 7 10.920 -1.622 12.861 1.00 0.00 H new ATOM 0 HG23 VAL A 7 11.918 -2.325 14.156 1.00 0.00 H new ATOM 97 N SER A 8 15.082 -2.765 13.529 1.00 0.00 N ATOM 98 CA SER A 8 15.548 -3.893 14.327 1.00 0.00 C ATOM 99 C SER A 8 16.562 -3.446 15.372 1.00 0.00 C ATOM 100 O SER A 8 17.451 -2.643 15.086 1.00 0.00 O ATOM 101 CB SER A 8 16.165 -4.948 13.430 1.00 0.00 C ATOM 102 OG SER A 8 16.604 -6.049 14.178 1.00 0.00 O ATOM 0 H SER A 8 15.655 -1.925 13.611 1.00 0.00 H new ATOM 0 HA SER A 8 14.687 -4.317 14.844 1.00 0.00 H new ATOM 0 HB2 SER A 8 15.434 -5.275 12.690 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.003 -4.519 12.881 1.00 0.00 H new ATOM 0 HG SER A 8 17.197 -6.603 13.628 1.00 0.00 H new ATOM 108 N THR A 9 16.424 -3.970 16.586 1.00 0.00 N ATOM 109 CA THR A 9 17.289 -3.580 17.692 1.00 0.00 C ATOM 110 C THR A 9 18.156 -4.745 18.150 1.00 0.00 C ATOM 111 O THR A 9 17.658 -5.845 18.391 1.00 0.00 O ATOM 112 CB THR A 9 16.466 -3.049 18.880 1.00 0.00 C ATOM 113 OG1 THR A 9 15.708 -1.905 18.466 1.00 0.00 O ATOM 114 CG2 THR A 9 17.381 -2.658 20.031 1.00 0.00 C ATOM 0 H THR A 9 15.720 -4.667 16.828 1.00 0.00 H new ATOM 0 HA THR A 9 17.937 -2.782 17.329 1.00 0.00 H new ATOM 0 HB THR A 9 15.792 -3.837 19.217 1.00 0.00 H new ATOM 0 HG1 THR A 9 15.183 -1.569 19.223 1.00 0.00 H new ATOM 0 HG21 THR A 9 16.782 -2.285 20.862 1.00 0.00 H new ATOM 0 HG22 THR A 9 17.949 -3.529 20.356 1.00 0.00 H new ATOM 0 HG23 THR A 9 18.068 -1.879 19.701 1.00 0.00 H new ATOM 122 N VAL A 10 19.456 -4.498 18.269 1.00 0.00 N ATOM 123 CA VAL A 10 20.382 -5.499 18.787 1.00 0.00 C ATOM 124 C VAL A 10 21.084 -5.001 20.044 1.00 0.00 C ATOM 125 O VAL A 10 21.616 -3.891 20.071 1.00 0.00 O ATOM 126 CB VAL A 10 21.435 -5.855 17.721 1.00 0.00 C ATOM 127 CG1 VAL A 10 22.494 -6.777 18.306 1.00 0.00 C ATOM 128 CG2 VAL A 10 20.760 -6.501 16.521 1.00 0.00 C ATOM 0 H VAL A 10 19.893 -3.612 18.014 1.00 0.00 H new ATOM 0 HA VAL A 10 19.803 -6.387 19.039 1.00 0.00 H new ATOM 0 HB VAL A 10 21.928 -4.940 17.392 1.00 0.00 H new ATOM 0 HG11 VAL A 10 23.230 -7.018 17.539 1.00 0.00 H new ATOM 0 HG12 VAL A 10 22.989 -6.280 19.140 1.00 0.00 H new ATOM 0 HG13 VAL A 10 22.023 -7.695 18.659 1.00 0.00 H new ATOM 0 HG21 VAL A 10 21.511 -6.750 15.771 1.00 0.00 H new ATOM 0 HG22 VAL A 10 20.248 -7.410 16.837 1.00 0.00 H new ATOM 0 HG23 VAL A 10 20.037 -5.807 16.093 1.00 0.00 H new ATOM 138 N LEU A 11 21.082 -5.828 21.083 1.00 0.00 N ATOM 139 CA LEU A 11 21.705 -5.467 22.351 1.00 0.00 C ATOM 140 C LEU A 11 23.219 -5.621 22.284 1.00 0.00 C ATOM 141 O LEU A 11 23.730 -6.653 21.850 1.00 0.00 O ATOM 142 CB LEU A 11 21.146 -6.338 23.483 1.00 0.00 C ATOM 143 CG LEU A 11 19.640 -6.206 23.744 1.00 0.00 C ATOM 144 CD1 LEU A 11 19.221 -7.199 24.818 1.00 0.00 C ATOM 145 CD2 LEU A 11 19.322 -4.779 24.164 1.00 0.00 C ATOM 0 H LEU A 11 20.655 -6.754 21.072 1.00 0.00 H new ATOM 0 HA LEU A 11 21.474 -4.421 22.551 1.00 0.00 H new ATOM 0 HB2 LEU A 11 21.366 -7.381 23.256 1.00 0.00 H new ATOM 0 HB3 LEU A 11 21.678 -6.092 24.402 1.00 0.00 H new ATOM 0 HG LEU A 11 19.083 -6.430 22.834 1.00 0.00 H new ATOM 0 HD11 LEU A 11 18.151 -7.105 25.003 1.00 0.00 H new ATOM 0 HD12 LEU A 11 19.444 -8.212 24.483 1.00 0.00 H new ATOM 0 HD13 LEU A 11 19.768 -6.992 25.738 1.00 0.00 H new ATOM 0 HD21 LEU A 11 18.252 -4.684 24.350 1.00 0.00 H new ATOM 0 HD22 LEU A 11 19.871 -4.537 25.074 1.00 0.00 H new ATOM 0 HD23 LEU A 11 19.615 -4.092 23.370 1.00 0.00 H new ATOM 157 N ILE A 12 23.933 -4.587 22.717 1.00 0.00 N ATOM 158 CA ILE A 12 25.391 -4.612 22.725 1.00 0.00 C ATOM 159 C ILE A 12 25.943 -4.102 24.050 1.00 0.00 C ATOM 160 O ILE A 12 25.614 -2.999 24.487 1.00 0.00 O ATOM 161 CB ILE A 12 25.961 -3.769 21.571 1.00 0.00 C ATOM 162 CG1 ILE A 12 25.466 -4.303 20.224 1.00 0.00 C ATOM 163 CG2 ILE A 12 27.482 -3.761 21.618 1.00 0.00 C ATOM 164 CD1 ILE A 12 25.884 -3.458 19.042 1.00 0.00 C ATOM 0 H ILE A 12 23.525 -3.720 23.067 1.00 0.00 H new ATOM 0 HA ILE A 12 25.699 -5.649 22.593 1.00 0.00 H new ATOM 0 HB ILE A 12 25.609 -2.744 21.685 1.00 0.00 H new ATOM 0 HG12 ILE A 12 25.842 -5.317 20.085 1.00 0.00 H new ATOM 0 HG13 ILE A 12 24.378 -4.367 20.247 1.00 0.00 H new ATOM 0 HG21 ILE A 12 27.868 -3.160 20.795 1.00 0.00 H new ATOM 0 HG22 ILE A 12 27.815 -3.336 22.565 1.00 0.00 H new ATOM 0 HG23 ILE A 12 27.854 -4.782 21.528 1.00 0.00 H new ATOM 0 HD11 ILE A 12 25.496 -3.899 18.124 1.00 0.00 H new ATOM 0 HD12 ILE A 12 25.485 -2.450 19.156 1.00 0.00 H new ATOM 0 HD13 ILE A 12 26.972 -3.415 18.992 1.00 0.00 H new ATOM 176 N ASN A 13 26.785 -4.910 24.685 1.00 0.00 N ATOM 177 CA ASN A 13 27.358 -4.556 25.978 1.00 0.00 C ATOM 178 C ASN A 13 28.551 -3.622 25.815 1.00 0.00 C ATOM 179 O ASN A 13 29.694 -4.014 26.047 1.00 0.00 O ATOM 180 CB ASN A 13 27.758 -5.804 26.744 1.00 0.00 C ATOM 181 CG ASN A 13 26.580 -6.672 27.089 1.00 0.00 C ATOM 182 OD1 ASN A 13 25.628 -6.221 27.736 1.00 0.00 O ATOM 183 ND2 ASN A 13 26.626 -7.911 26.669 1.00 0.00 N ATOM 0 H ASN A 13 27.086 -5.816 24.325 1.00 0.00 H new ATOM 0 HA ASN A 13 26.595 -4.028 26.550 1.00 0.00 H new ATOM 0 HB2 ASN A 13 28.467 -6.380 26.149 1.00 0.00 H new ATOM 0 HB3 ASN A 13 28.272 -5.514 27.660 1.00 0.00 H new ATOM 0 HD21 ASN A 13 25.855 -8.548 26.873 1.00 0.00 H new ATOM 0 HD22 ASN A 13 27.432 -8.240 26.138 1.00 0.00 H new ATOM 190 N ALA A 14 28.276 -2.385 25.414 1.00 0.00 N ATOM 191 CA ALA A 14 29.329 -1.400 25.194 1.00 0.00 C ATOM 192 C ALA A 14 28.790 0.019 25.323 1.00 0.00 C ATOM 193 O ALA A 14 27.604 0.266 25.104 1.00 0.00 O ATOM 194 CB ALA A 14 29.966 -1.602 23.827 1.00 0.00 C ATOM 0 H ALA A 14 27.333 -2.041 25.235 1.00 0.00 H new ATOM 0 HA ALA A 14 30.090 -1.543 25.961 1.00 0.00 H new ATOM 0 HB1 ALA A 14 30.750 -0.859 23.678 1.00 0.00 H new ATOM 0 HB2 ALA A 14 30.397 -2.601 23.771 1.00 0.00 H new ATOM 0 HB3 ALA A 14 29.208 -1.490 23.052 1.00 0.00 H new ATOM 200 N GLU A 15 29.669 0.949 25.681 1.00 0.00 N ATOM 201 CA GLU A 15 29.278 2.342 25.864 1.00 0.00 C ATOM 202 C GLU A 15 28.613 2.897 24.611 1.00 0.00 C ATOM 203 O GLU A 15 29.174 2.828 23.517 1.00 0.00 O ATOM 204 CB GLU A 15 30.496 3.194 26.228 1.00 0.00 C ATOM 205 CG GLU A 15 30.177 4.652 26.525 1.00 0.00 C ATOM 206 CD GLU A 15 31.385 5.442 26.945 1.00 0.00 C ATOM 207 OE1 GLU A 15 32.443 4.867 27.040 1.00 0.00 O ATOM 208 OE2 GLU A 15 31.250 6.621 27.173 1.00 0.00 O ATOM 0 H GLU A 15 30.658 0.763 25.850 1.00 0.00 H new ATOM 0 HA GLU A 15 28.557 2.381 26.680 1.00 0.00 H new ATOM 0 HB2 GLU A 15 30.983 2.756 27.100 1.00 0.00 H new ATOM 0 HB3 GLU A 15 31.212 3.151 25.408 1.00 0.00 H new ATOM 0 HG2 GLU A 15 29.740 5.111 25.638 1.00 0.00 H new ATOM 0 HG3 GLU A 15 29.425 4.701 27.313 1.00 0.00 H new ATOM 215 N PRO A 16 27.416 3.448 24.777 1.00 0.00 N ATOM 216 CA PRO A 16 26.666 4.004 23.657 1.00 0.00 C ATOM 217 C PRO A 16 27.508 5.003 22.873 1.00 0.00 C ATOM 218 O PRO A 16 27.479 5.022 21.642 1.00 0.00 O ATOM 219 CB PRO A 16 25.477 4.684 24.343 1.00 0.00 C ATOM 220 CG PRO A 16 25.249 3.871 25.571 1.00 0.00 C ATOM 221 CD PRO A 16 26.632 3.514 26.046 1.00 0.00 C ATOM 0 HA PRO A 16 26.363 3.255 22.926 1.00 0.00 H new ATOM 0 HB2 PRO A 16 25.700 5.722 24.589 1.00 0.00 H new ATOM 0 HB3 PRO A 16 24.597 4.690 23.700 1.00 0.00 H new ATOM 0 HG2 PRO A 16 24.703 4.437 26.326 1.00 0.00 H new ATOM 0 HG3 PRO A 16 24.661 2.979 25.354 1.00 0.00 H new ATOM 0 HD2 PRO A 16 27.031 4.265 26.728 1.00 0.00 H new ATOM 0 HD3 PRO A 16 26.643 2.562 26.577 1.00 0.00 H new ATOM 229 N ALA A 17 28.259 5.830 23.592 1.00 0.00 N ATOM 230 CA ALA A 17 29.095 6.847 22.965 1.00 0.00 C ATOM 231 C ALA A 17 30.210 6.212 22.144 1.00 0.00 C ATOM 232 O ALA A 17 30.526 6.674 21.047 1.00 0.00 O ATOM 233 CB ALA A 17 29.678 7.777 24.019 1.00 0.00 C ATOM 0 H ALA A 17 28.306 5.816 24.611 1.00 0.00 H new ATOM 0 HA ALA A 17 28.468 7.429 22.290 1.00 0.00 H new ATOM 0 HB1 ALA A 17 30.300 8.531 23.536 1.00 0.00 H new ATOM 0 HB2 ALA A 17 28.868 8.267 24.560 1.00 0.00 H new ATOM 0 HB3 ALA A 17 30.284 7.200 24.718 1.00 0.00 H new ATOM 239 N ALA A 18 30.804 5.152 22.681 1.00 0.00 N ATOM 240 CA ALA A 18 31.852 4.422 21.977 1.00 0.00 C ATOM 241 C ALA A 18 31.311 3.762 20.715 1.00 0.00 C ATOM 242 O ALA A 18 31.966 3.764 19.673 1.00 0.00 O ATOM 243 CB ALA A 18 32.478 3.380 22.892 1.00 0.00 C ATOM 0 H ALA A 18 30.577 4.779 23.603 1.00 0.00 H new ATOM 0 HA ALA A 18 32.619 5.137 21.681 1.00 0.00 H new ATOM 0 HB1 ALA A 18 33.258 2.844 22.352 1.00 0.00 H new ATOM 0 HB2 ALA A 18 32.912 3.873 23.762 1.00 0.00 H new ATOM 0 HB3 ALA A 18 31.713 2.676 23.218 1.00 0.00 H new ATOM 249 N VAL A 19 30.112 3.198 20.816 1.00 0.00 N ATOM 250 CA VAL A 19 29.454 2.588 19.667 1.00 0.00 C ATOM 251 C VAL A 19 29.079 3.635 18.626 1.00 0.00 C ATOM 252 O VAL A 19 29.234 3.414 17.425 1.00 0.00 O ATOM 253 CB VAL A 19 28.187 1.836 20.114 1.00 0.00 C ATOM 254 CG1 VAL A 19 27.396 1.358 18.905 1.00 0.00 C ATOM 255 CG2 VAL A 19 28.567 0.665 21.007 1.00 0.00 C ATOM 0 H VAL A 19 29.576 3.151 21.683 1.00 0.00 H new ATOM 0 HA VAL A 19 30.156 1.886 19.218 1.00 0.00 H new ATOM 0 HB VAL A 19 27.555 2.517 20.683 1.00 0.00 H new ATOM 0 HG11 VAL A 19 26.504 0.829 19.240 1.00 0.00 H new ATOM 0 HG12 VAL A 19 27.103 2.216 18.300 1.00 0.00 H new ATOM 0 HG13 VAL A 19 28.014 0.687 18.308 1.00 0.00 H new ATOM 0 HG21 VAL A 19 27.665 0.138 21.319 1.00 0.00 H new ATOM 0 HG22 VAL A 19 29.214 -0.018 20.456 1.00 0.00 H new ATOM 0 HG23 VAL A 19 29.094 1.034 21.887 1.00 0.00 H new ATOM 265 N LEU A 20 28.585 4.776 19.094 1.00 0.00 N ATOM 266 CA LEU A 20 28.252 5.886 18.209 1.00 0.00 C ATOM 267 C LEU A 20 29.455 6.305 17.374 1.00 0.00 C ATOM 268 O LEU A 20 29.353 6.464 16.157 1.00 0.00 O ATOM 269 CB LEU A 20 27.748 7.083 19.027 1.00 0.00 C ATOM 270 CG LEU A 20 27.335 8.317 18.215 1.00 0.00 C ATOM 271 CD1 LEU A 20 26.167 7.960 17.306 1.00 0.00 C ATOM 272 CD2 LEU A 20 26.965 9.448 19.162 1.00 0.00 C ATOM 0 H LEU A 20 28.406 4.956 20.082 1.00 0.00 H new ATOM 0 HA LEU A 20 27.465 5.551 17.534 1.00 0.00 H new ATOM 0 HB2 LEU A 20 26.894 6.759 19.621 1.00 0.00 H new ATOM 0 HB3 LEU A 20 28.530 7.377 19.727 1.00 0.00 H new ATOM 0 HG LEU A 20 28.166 8.648 17.593 1.00 0.00 H new ATOM 0 HD11 LEU A 20 25.874 8.837 16.729 1.00 0.00 H new ATOM 0 HD12 LEU A 20 26.466 7.162 16.626 1.00 0.00 H new ATOM 0 HD13 LEU A 20 25.324 7.625 17.911 1.00 0.00 H new ATOM 0 HD21 LEU A 20 26.672 10.325 18.585 1.00 0.00 H new ATOM 0 HD22 LEU A 20 26.134 9.136 19.795 1.00 0.00 H new ATOM 0 HD23 LEU A 20 27.824 9.695 19.786 1.00 0.00 H new ATOM 284 N ALA A 21 30.594 6.483 18.033 1.00 0.00 N ATOM 285 CA ALA A 21 31.837 6.807 17.343 1.00 0.00 C ATOM 286 C ALA A 21 32.229 5.705 16.367 1.00 0.00 C ATOM 287 O ALA A 21 32.668 5.979 15.250 1.00 0.00 O ATOM 288 CB ALA A 21 32.954 7.047 18.348 1.00 0.00 C ATOM 0 H ALA A 21 30.682 6.408 19.046 1.00 0.00 H new ATOM 0 HA ALA A 21 31.676 7.721 16.771 1.00 0.00 H new ATOM 0 HB1 ALA A 21 33.875 7.288 17.817 1.00 0.00 H new ATOM 0 HB2 ALA A 21 32.684 7.877 19.001 1.00 0.00 H new ATOM 0 HB3 ALA A 21 33.104 6.148 18.947 1.00 0.00 H new ATOM 294 N ALA A 22 32.069 4.458 16.796 1.00 0.00 N ATOM 295 CA ALA A 22 32.347 3.311 15.939 1.00 0.00 C ATOM 296 C ALA A 22 31.489 3.343 14.681 1.00 0.00 C ATOM 297 O ALA A 22 31.962 3.030 13.588 1.00 0.00 O ATOM 298 CB ALA A 22 32.122 2.014 16.701 1.00 0.00 C ATOM 0 H ALA A 22 31.748 4.215 17.733 1.00 0.00 H new ATOM 0 HA ALA A 22 33.392 3.364 15.635 1.00 0.00 H new ATOM 0 HB1 ALA A 22 32.333 1.167 16.048 1.00 0.00 H new ATOM 0 HB2 ALA A 22 32.785 1.980 17.566 1.00 0.00 H new ATOM 0 HB3 ALA A 22 31.086 1.964 17.036 1.00 0.00 H new ATOM 304 N ILE A 23 30.226 3.723 14.842 1.00 0.00 N ATOM 305 CA ILE A 23 29.315 3.849 13.711 1.00 0.00 C ATOM 306 C ILE A 23 29.752 4.967 12.773 1.00 0.00 C ATOM 307 O ILE A 23 29.685 4.828 11.552 1.00 0.00 O ATOM 308 CB ILE A 23 27.877 4.115 14.192 1.00 0.00 C ATOM 309 CG1 ILE A 23 27.322 2.889 14.921 1.00 0.00 C ATOM 310 CG2 ILE A 23 26.984 4.490 13.018 1.00 0.00 C ATOM 311 CD1 ILE A 23 26.054 3.162 15.697 1.00 0.00 C ATOM 0 H ILE A 23 29.810 3.949 15.745 1.00 0.00 H new ATOM 0 HA ILE A 23 29.341 2.905 13.167 1.00 0.00 H new ATOM 0 HB ILE A 23 27.895 4.951 14.891 1.00 0.00 H new ATOM 0 HG12 ILE A 23 27.128 2.102 14.193 1.00 0.00 H new ATOM 0 HG13 ILE A 23 28.081 2.510 15.605 1.00 0.00 H new ATOM 0 HG21 ILE A 23 25.971 4.675 13.376 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.370 5.391 12.540 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.971 3.674 12.296 1.00 0.00 H new ATOM 0 HD11 ILE A 23 25.722 2.246 16.186 1.00 0.00 H new ATOM 0 HD12 ILE A 23 26.246 3.926 16.450 1.00 0.00 H new ATOM 0 HD13 ILE A 23 25.278 3.511 15.015 1.00 0.00 H new ATOM 323 N SER A 24 30.201 6.076 13.351 1.00 0.00 N ATOM 324 CA SER A 24 30.564 7.253 12.572 1.00 0.00 C ATOM 325 C SER A 24 31.951 7.104 11.961 1.00 0.00 C ATOM 326 O SER A 24 32.356 7.900 11.113 1.00 0.00 O ATOM 327 CB SER A 24 30.517 8.492 13.445 1.00 0.00 C ATOM 328 OG SER A 24 31.562 8.488 14.379 1.00 0.00 O ATOM 0 H SER A 24 30.322 6.184 14.358 1.00 0.00 H new ATOM 0 HA SER A 24 29.843 7.354 11.761 1.00 0.00 H new ATOM 0 HB2 SER A 24 30.585 9.383 12.821 1.00 0.00 H new ATOM 0 HB3 SER A 24 29.560 8.539 13.965 1.00 0.00 H new ATOM 0 HG SER A 24 31.803 7.563 14.596 1.00 0.00 H new ATOM 334 N ASP A 25 32.677 6.080 12.396 1.00 0.00 N ATOM 335 CA ASP A 25 33.972 5.755 11.812 1.00 0.00 C ATOM 336 C ASP A 25 33.815 4.886 10.571 1.00 0.00 C ATOM 337 O ASP A 25 33.549 3.689 10.670 1.00 0.00 O ATOM 338 CB ASP A 25 34.858 5.039 12.835 1.00 0.00 C ATOM 339 CG ASP A 25 36.196 4.600 12.256 1.00 0.00 C ATOM 340 OD1 ASP A 25 36.226 4.202 11.115 1.00 0.00 O ATOM 341 OD2 ASP A 25 37.176 4.667 12.959 1.00 0.00 O ATOM 0 H ASP A 25 32.389 5.460 13.153 1.00 0.00 H new ATOM 0 HA ASP A 25 34.447 6.692 11.520 1.00 0.00 H new ATOM 0 HB2 ASP A 25 35.034 5.702 13.682 1.00 0.00 H new ATOM 0 HB3 ASP A 25 34.330 4.166 13.218 1.00 0.00 H new ATOM 346 N TYR A 26 33.982 5.497 9.403 1.00 0.00 N ATOM 347 CA TYR A 26 33.777 4.800 8.138 1.00 0.00 C ATOM 348 C TYR A 26 35.106 4.421 7.497 1.00 0.00 C ATOM 349 O TYR A 26 35.175 4.164 6.295 1.00 0.00 O ATOM 350 CB TYR A 26 32.952 5.662 7.180 1.00 0.00 C ATOM 351 CG TYR A 26 31.502 5.810 7.585 1.00 0.00 C ATOM 352 CD1 TYR A 26 31.126 6.820 8.458 1.00 0.00 C ATOM 353 CD2 TYR A 26 30.550 4.935 7.085 1.00 0.00 C ATOM 354 CE1 TYR A 26 29.802 6.955 8.829 1.00 0.00 C ATOM 355 CE2 TYR A 26 29.226 5.070 7.455 1.00 0.00 C ATOM 356 CZ TYR A 26 28.851 6.075 8.323 1.00 0.00 C ATOM 357 OH TYR A 26 27.532 6.209 8.692 1.00 0.00 O ATOM 0 H TYR A 26 34.259 6.474 9.306 1.00 0.00 H new ATOM 0 HA TYR A 26 33.228 3.882 8.346 1.00 0.00 H new ATOM 0 HB2 TYR A 26 33.404 6.652 7.116 1.00 0.00 H new ATOM 0 HB3 TYR A 26 32.998 5.225 6.182 1.00 0.00 H new ATOM 0 HD1 TYR A 26 31.868 7.501 8.848 1.00 0.00 H new ATOM 0 HD2 TYR A 26 30.844 4.148 6.406 1.00 0.00 H new ATOM 0 HE1 TYR A 26 29.507 7.740 9.509 1.00 0.00 H new ATOM 0 HE2 TYR A 26 28.484 4.389 7.065 1.00 0.00 H new ATOM 0 HH TYR A 26 26.968 5.688 8.084 1.00 0.00 H new ATOM 367 N GLN A 27 36.159 4.387 8.306 1.00 0.00 N ATOM 368 CA GLN A 27 37.514 4.227 7.793 1.00 0.00 C ATOM 369 C GLN A 27 38.162 2.959 8.333 1.00 0.00 C ATOM 370 O GLN A 27 38.784 2.202 7.587 1.00 0.00 O ATOM 371 CB GLN A 27 38.370 5.445 8.152 1.00 0.00 C ATOM 372 CG GLN A 27 37.947 6.729 7.460 1.00 0.00 C ATOM 373 CD GLN A 27 38.797 7.916 7.873 1.00 0.00 C ATOM 374 OE1 GLN A 27 39.593 7.831 8.812 1.00 0.00 O ATOM 375 NE2 GLN A 27 38.632 9.033 7.172 1.00 0.00 N ATOM 0 H GLN A 27 36.100 4.468 9.321 1.00 0.00 H new ATOM 0 HA GLN A 27 37.451 4.143 6.708 1.00 0.00 H new ATOM 0 HB2 GLN A 27 38.331 5.597 9.231 1.00 0.00 H new ATOM 0 HB3 GLN A 27 39.408 5.233 7.897 1.00 0.00 H new ATOM 0 HG2 GLN A 27 38.014 6.596 6.380 1.00 0.00 H new ATOM 0 HG3 GLN A 27 36.902 6.936 7.691 1.00 0.00 H new ATOM 0 HE21 GLN A 27 37.962 9.058 6.403 1.00 0.00 H new ATOM 0 HE22 GLN A 27 39.175 9.865 7.403 1.00 0.00 H new ATOM 384 N THR A 28 38.013 2.732 9.634 1.00 0.00 N ATOM 385 CA THR A 28 38.690 1.627 10.301 1.00 0.00 C ATOM 386 C THR A 28 37.689 0.639 10.886 1.00 0.00 C ATOM 387 O THR A 28 37.964 -0.557 10.980 1.00 0.00 O ATOM 388 CB THR A 28 39.622 2.140 11.415 1.00 0.00 C ATOM 389 OG1 THR A 28 38.840 2.746 12.454 1.00 0.00 O ATOM 390 CG2 THR A 28 40.602 3.163 10.862 1.00 0.00 C ATOM 0 H THR A 28 37.429 3.300 10.248 1.00 0.00 H new ATOM 0 HA THR A 28 39.289 1.114 9.548 1.00 0.00 H new ATOM 0 HB THR A 28 40.182 1.296 11.817 1.00 0.00 H new ATOM 0 HG1 THR A 28 38.513 3.619 12.151 1.00 0.00 H new ATOM 0 HG21 THR A 28 41.252 3.514 11.663 1.00 0.00 H new ATOM 0 HG22 THR A 28 41.206 2.703 10.080 1.00 0.00 H new ATOM 0 HG23 THR A 28 40.051 4.006 10.446 1.00 0.00 H new ATOM 398 N VAL A 29 36.525 1.147 11.279 1.00 0.00 N ATOM 399 CA VAL A 29 35.521 0.330 11.950 1.00 0.00 C ATOM 400 C VAL A 29 34.526 -0.249 10.952 1.00 0.00 C ATOM 401 O VAL A 29 34.493 -1.459 10.726 1.00 0.00 O ATOM 402 CB VAL A 29 34.764 1.168 12.997 1.00 0.00 C ATOM 403 CG1 VAL A 29 33.603 0.374 13.577 1.00 0.00 C ATOM 404 CG2 VAL A 29 35.719 1.608 14.097 1.00 0.00 C ATOM 0 H VAL A 29 36.254 2.121 11.144 1.00 0.00 H new ATOM 0 HA VAL A 29 36.039 -0.492 12.444 1.00 0.00 H new ATOM 0 HB VAL A 29 34.357 2.056 12.512 1.00 0.00 H new ATOM 0 HG11 VAL A 29 33.079 0.982 14.315 1.00 0.00 H new ATOM 0 HG12 VAL A 29 32.914 0.100 12.778 1.00 0.00 H new ATOM 0 HG13 VAL A 29 33.983 -0.529 14.054 1.00 0.00 H new ATOM 0 HG21 VAL A 29 35.177 2.200 14.834 1.00 0.00 H new ATOM 0 HG22 VAL A 29 36.146 0.730 14.581 1.00 0.00 H new ATOM 0 HG23 VAL A 29 36.519 2.210 13.665 1.00 0.00 H new ATOM 414 N ARG A 30 33.716 0.621 10.358 1.00 0.00 N ATOM 415 CA ARG A 30 32.557 0.187 9.588 1.00 0.00 C ATOM 416 C ARG A 30 32.969 -0.726 8.440 1.00 0.00 C ATOM 417 O ARG A 30 32.329 -1.746 8.185 1.00 0.00 O ATOM 418 CB ARG A 30 31.803 1.386 9.033 1.00 0.00 C ATOM 419 CG ARG A 30 31.012 2.177 10.063 1.00 0.00 C ATOM 420 CD ARG A 30 29.799 1.443 10.506 1.00 0.00 C ATOM 421 NE ARG A 30 28.875 1.209 9.408 1.00 0.00 N ATOM 422 CZ ARG A 30 27.930 2.081 9.006 1.00 0.00 C ATOM 423 NH1 ARG A 30 27.796 3.235 9.619 1.00 0.00 N ATOM 424 NH2 ARG A 30 27.136 1.774 7.994 1.00 0.00 N ATOM 0 H ARG A 30 33.842 1.633 10.396 1.00 0.00 H new ATOM 0 HA ARG A 30 31.906 -0.369 10.262 1.00 0.00 H new ATOM 0 HB2 ARG A 30 32.517 2.055 8.552 1.00 0.00 H new ATOM 0 HB3 ARG A 30 31.119 1.040 8.258 1.00 0.00 H new ATOM 0 HG2 ARG A 30 31.645 2.387 10.925 1.00 0.00 H new ATOM 0 HG3 ARG A 30 30.721 3.138 9.639 1.00 0.00 H new ATOM 0 HD2 ARG A 30 30.092 0.489 10.944 1.00 0.00 H new ATOM 0 HD3 ARG A 30 29.296 2.011 11.288 1.00 0.00 H new ATOM 0 HE ARG A 30 28.947 0.323 8.907 1.00 0.00 H new ATOM 0 HH11 ARG A 30 28.408 3.472 10.400 1.00 0.00 H new ATOM 0 HH12 ARG A 30 27.080 3.894 9.314 1.00 0.00 H new ATOM 0 HH21 ARG A 30 27.239 0.878 7.518 1.00 0.00 H new ATOM 0 HH22 ARG A 30 26.420 2.434 7.689 1.00 0.00 H new ATOM 438 N PRO A 31 34.042 -0.353 7.750 1.00 0.00 N ATOM 439 CA PRO A 31 34.526 -1.123 6.611 1.00 0.00 C ATOM 440 C PRO A 31 34.786 -2.574 6.997 1.00 0.00 C ATOM 441 O PRO A 31 34.631 -3.481 6.180 1.00 0.00 O ATOM 442 CB PRO A 31 35.821 -0.399 6.231 1.00 0.00 C ATOM 443 CG PRO A 31 35.584 1.014 6.640 1.00 0.00 C ATOM 444 CD PRO A 31 34.840 0.906 7.945 1.00 0.00 C ATOM 0 HA PRO A 31 33.811 -1.174 5.789 1.00 0.00 H new ATOM 0 HB2 PRO A 31 36.681 -0.824 6.748 1.00 0.00 H new ATOM 0 HB3 PRO A 31 36.021 -0.476 5.162 1.00 0.00 H new ATOM 0 HG2 PRO A 31 36.522 1.555 6.761 1.00 0.00 H new ATOM 0 HG3 PRO A 31 35.000 1.551 5.893 1.00 0.00 H new ATOM 0 HD2 PRO A 31 35.518 0.831 8.795 1.00 0.00 H new ATOM 0 HD3 PRO A 31 34.200 1.771 8.122 1.00 0.00 H new ATOM 452 N LYS A 32 35.181 -2.786 8.248 1.00 0.00 N ATOM 453 CA LYS A 32 35.689 -4.082 8.682 1.00 0.00 C ATOM 454 C LYS A 32 34.581 -4.935 9.286 1.00 0.00 C ATOM 455 O LYS A 32 34.801 -6.092 9.645 1.00 0.00 O ATOM 456 CB LYS A 32 36.824 -3.901 9.692 1.00 0.00 C ATOM 457 CG LYS A 32 38.013 -3.107 9.167 1.00 0.00 C ATOM 458 CD LYS A 32 38.676 -3.814 7.995 1.00 0.00 C ATOM 459 CE LYS A 32 39.914 -3.065 7.523 1.00 0.00 C ATOM 460 NZ LYS A 32 40.556 -3.730 6.357 1.00 0.00 N ATOM 0 H LYS A 32 35.159 -2.076 8.980 1.00 0.00 H new ATOM 0 HA LYS A 32 36.075 -4.599 7.804 1.00 0.00 H new ATOM 0 HB2 LYS A 32 36.430 -3.400 10.577 1.00 0.00 H new ATOM 0 HB3 LYS A 32 37.171 -4.884 10.010 1.00 0.00 H new ATOM 0 HG2 LYS A 32 37.682 -2.116 8.857 1.00 0.00 H new ATOM 0 HG3 LYS A 32 38.740 -2.965 9.967 1.00 0.00 H new ATOM 0 HD2 LYS A 32 38.951 -4.827 8.288 1.00 0.00 H new ATOM 0 HD3 LYS A 32 37.966 -3.902 7.172 1.00 0.00 H new ATOM 0 HE2 LYS A 32 39.640 -2.045 7.253 1.00 0.00 H new ATOM 0 HE3 LYS A 32 40.631 -2.997 8.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 41.395 -3.188 6.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 40.841 -4.695 6.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 39.881 -3.773 5.567 1.00 0.00 H new ATOM 474 N ILE A 33 33.390 -4.357 9.395 1.00 0.00 N ATOM 475 CA ILE A 33 32.240 -5.070 9.939 1.00 0.00 C ATOM 476 C ILE A 33 31.115 -5.164 8.916 1.00 0.00 C ATOM 477 O ILE A 33 29.969 -5.446 9.264 1.00 0.00 O ATOM 478 CB ILE A 33 31.720 -4.380 11.214 1.00 0.00 C ATOM 479 CG1 ILE A 33 31.275 -2.948 10.902 1.00 0.00 C ATOM 480 CG2 ILE A 33 32.788 -4.385 12.296 1.00 0.00 C ATOM 481 CD1 ILE A 33 30.511 -2.288 12.027 1.00 0.00 C ATOM 0 H ILE A 33 33.195 -3.396 9.114 1.00 0.00 H new ATOM 0 HA ILE A 33 32.571 -6.078 10.189 1.00 0.00 H new ATOM 0 HB ILE A 33 30.858 -4.936 11.582 1.00 0.00 H new ATOM 0 HG12 ILE A 33 32.154 -2.347 10.670 1.00 0.00 H new ATOM 0 HG13 ILE A 33 30.651 -2.958 10.008 1.00 0.00 H new ATOM 0 HG21 ILE A 33 32.403 -3.893 13.189 1.00 0.00 H new ATOM 0 HG22 ILE A 33 33.058 -5.413 12.536 1.00 0.00 H new ATOM 0 HG23 ILE A 33 33.669 -3.852 11.940 1.00 0.00 H new ATOM 0 HD11 ILE A 33 30.230 -1.277 11.732 1.00 0.00 H new ATOM 0 HD12 ILE A 33 29.613 -2.866 12.245 1.00 0.00 H new ATOM 0 HD13 ILE A 33 31.139 -2.245 12.917 1.00 0.00 H new ATOM 493 N LEU A 34 31.450 -4.925 7.653 1.00 0.00 N ATOM 494 CA LEU A 34 30.474 -5.008 6.573 1.00 0.00 C ATOM 495 C LEU A 34 30.135 -6.457 6.248 1.00 0.00 C ATOM 496 O LEU A 34 30.985 -7.342 6.351 1.00 0.00 O ATOM 497 CB LEU A 34 31.011 -4.308 5.318 1.00 0.00 C ATOM 498 CG LEU A 34 31.290 -2.806 5.462 1.00 0.00 C ATOM 499 CD1 LEU A 34 31.820 -2.259 4.143 1.00 0.00 C ATOM 500 CD2 LEU A 34 30.014 -2.090 5.878 1.00 0.00 C ATOM 0 H LEU A 34 32.391 -4.672 7.352 1.00 0.00 H new ATOM 0 HA LEU A 34 29.564 -4.508 6.905 1.00 0.00 H new ATOM 0 HB2 LEU A 34 31.934 -4.803 5.015 1.00 0.00 H new ATOM 0 HB3 LEU A 34 30.293 -4.450 4.510 1.00 0.00 H new ATOM 0 HG LEU A 34 32.044 -2.639 6.231 1.00 0.00 H new ATOM 0 HD11 LEU A 34 32.018 -1.192 4.245 1.00 0.00 H new ATOM 0 HD12 LEU A 34 32.743 -2.776 3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 34 31.079 -2.417 3.360 1.00 0.00 H new ATOM 0 HD21 LEU A 34 30.212 -1.023 5.980 1.00 0.00 H new ATOM 0 HD22 LEU A 34 29.246 -2.245 5.120 1.00 0.00 H new ATOM 0 HD23 LEU A 34 29.668 -2.488 6.832 1.00 0.00 H new ATOM 512 N SER A 35 28.888 -6.693 5.855 1.00 0.00 N ATOM 513 CA SER A 35 28.457 -8.020 5.430 1.00 0.00 C ATOM 514 C SER A 35 28.838 -8.283 3.979 1.00 0.00 C ATOM 515 O SER A 35 29.475 -7.451 3.333 1.00 0.00 O ATOM 516 CB SER A 35 26.957 -8.161 5.602 1.00 0.00 C ATOM 517 OG SER A 35 26.269 -7.500 4.576 1.00 0.00 O ATOM 0 H SER A 35 28.157 -5.982 5.822 1.00 0.00 H new ATOM 0 HA SER A 35 28.963 -8.755 6.055 1.00 0.00 H new ATOM 0 HB2 SER A 35 26.686 -9.217 5.605 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.658 -7.752 6.567 1.00 0.00 H new ATOM 0 HG SER A 35 26.477 -6.543 4.606 1.00 0.00 H new ATOM 523 N SER A 36 28.444 -9.447 3.471 1.00 0.00 N ATOM 524 CA SER A 36 28.782 -9.841 2.109 1.00 0.00 C ATOM 525 C SER A 36 27.981 -9.043 1.089 1.00 0.00 C ATOM 526 O SER A 36 28.210 -9.148 -0.116 1.00 0.00 O ATOM 527 CB SER A 36 28.527 -11.324 1.917 1.00 0.00 C ATOM 528 OG SER A 36 27.159 -11.614 2.009 1.00 0.00 O ATOM 0 H SER A 36 27.890 -10.134 3.983 1.00 0.00 H new ATOM 0 HA SER A 36 29.840 -9.632 1.951 1.00 0.00 H new ATOM 0 HB2 SER A 36 28.905 -11.639 0.944 1.00 0.00 H new ATOM 0 HB3 SER A 36 29.074 -11.891 2.670 1.00 0.00 H new ATOM 0 HG SER A 36 27.019 -12.575 1.880 1.00 0.00 H new ATOM 534 N HIS A 37 27.039 -8.243 1.579 1.00 0.00 N ATOM 535 CA HIS A 37 26.169 -7.461 0.708 1.00 0.00 C ATOM 536 C HIS A 37 26.673 -6.031 0.568 1.00 0.00 C ATOM 537 O HIS A 37 25.923 -5.133 0.184 1.00 0.00 O ATOM 538 CB HIS A 37 24.734 -7.453 1.244 1.00 0.00 C ATOM 539 CG HIS A 37 24.114 -8.813 1.325 1.00 0.00 C ATOM 540 ND1 HIS A 37 24.117 -9.697 0.266 1.00 0.00 N ATOM 541 CD2 HIS A 37 23.471 -9.442 2.337 1.00 0.00 C ATOM 542 CE1 HIS A 37 23.503 -10.811 0.624 1.00 0.00 C ATOM 543 NE2 HIS A 37 23.102 -10.681 1.876 1.00 0.00 N ATOM 0 H HIS A 37 26.859 -8.119 2.575 1.00 0.00 H new ATOM 0 HA HIS A 37 26.180 -7.930 -0.276 1.00 0.00 H new ATOM 0 HB2 HIS A 37 24.729 -7.001 2.236 1.00 0.00 H new ATOM 0 HB3 HIS A 37 24.120 -6.821 0.603 1.00 0.00 H new ATOM 0 HD1 HIS A 37 24.529 -9.519 -0.650 1.00 0.00 H new ATOM 0 HD2 HIS A 37 23.283 -9.043 3.323 1.00 0.00 H new ATOM 0 HE1 HIS A 37 23.354 -11.680 -0.000 1.00 0.00 H new ATOM 551 N TYR A 38 27.947 -5.824 0.881 1.00 0.00 N ATOM 552 CA TYR A 38 28.581 -4.525 0.694 1.00 0.00 C ATOM 553 C TYR A 38 29.756 -4.619 -0.271 1.00 0.00 C ATOM 554 O TYR A 38 30.910 -4.718 0.148 1.00 0.00 O ATOM 555 CB TYR A 38 29.043 -3.956 2.038 1.00 0.00 C ATOM 556 CG TYR A 38 27.907 -3.584 2.965 1.00 0.00 C ATOM 557 CD1 TYR A 38 27.314 -4.555 3.759 1.00 0.00 C ATOM 558 CD2 TYR A 38 27.459 -2.273 3.022 1.00 0.00 C ATOM 559 CE1 TYR A 38 26.277 -4.215 4.606 1.00 0.00 C ATOM 560 CE2 TYR A 38 26.422 -1.933 3.869 1.00 0.00 C ATOM 561 CZ TYR A 38 25.832 -2.899 4.659 1.00 0.00 C ATOM 562 OH TYR A 38 24.799 -2.561 5.503 1.00 0.00 O ATOM 0 H TYR A 38 28.562 -6.541 1.266 1.00 0.00 H new ATOM 0 HA TYR A 38 27.841 -3.851 0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 38 29.679 -4.690 2.534 1.00 0.00 H new ATOM 0 HB3 TYR A 38 29.656 -3.073 1.857 1.00 0.00 H new ATOM 0 HD1 TYR A 38 27.663 -5.576 3.715 1.00 0.00 H new ATOM 0 HD2 TYR A 38 27.921 -1.517 2.404 1.00 0.00 H new ATOM 0 HE1 TYR A 38 25.814 -4.969 5.225 1.00 0.00 H new ATOM 0 HE2 TYR A 38 26.073 -0.912 3.913 1.00 0.00 H new ATOM 0 HH TYR A 38 24.610 -1.603 5.421 1.00 0.00 H new ATOM 572 N SER A 39 29.457 -4.586 -1.565 1.00 0.00 N ATOM 573 CA SER A 39 30.481 -4.730 -2.592 1.00 0.00 C ATOM 574 C SER A 39 30.959 -3.371 -3.087 1.00 0.00 C ATOM 575 O SER A 39 30.154 -2.482 -3.366 1.00 0.00 O ATOM 576 CB SER A 39 29.945 -5.541 -3.755 1.00 0.00 C ATOM 577 OG SER A 39 30.874 -5.594 -4.802 1.00 0.00 O ATOM 0 H SER A 39 28.512 -4.461 -1.928 1.00 0.00 H new ATOM 0 HA SER A 39 31.330 -5.251 -2.149 1.00 0.00 H new ATOM 0 HB2 SER A 39 29.711 -6.552 -3.421 1.00 0.00 H new ATOM 0 HB3 SER A 39 29.014 -5.100 -4.112 1.00 0.00 H new ATOM 0 HG SER A 39 30.506 -6.124 -5.540 1.00 0.00 H new ATOM 583 N GLY A 40 32.274 -3.215 -3.195 1.00 0.00 N ATOM 584 CA GLY A 40 32.858 -2.016 -3.784 1.00 0.00 C ATOM 585 C GLY A 40 32.706 -0.817 -2.857 1.00 0.00 C ATOM 586 O GLY A 40 32.451 0.300 -3.308 1.00 0.00 O ATOM 0 H GLY A 40 32.956 -3.905 -2.882 1.00 0.00 H new ATOM 0 HA2 GLY A 40 33.914 -2.187 -3.991 1.00 0.00 H new ATOM 0 HA3 GLY A 40 32.376 -1.805 -4.738 1.00 0.00 H new ATOM 590 N TYR A 41 32.865 -1.055 -1.560 1.00 0.00 N ATOM 591 CA TYR A 41 32.789 0.013 -0.570 1.00 0.00 C ATOM 592 C TYR A 41 33.926 1.011 -0.749 1.00 0.00 C ATOM 593 O TYR A 41 35.096 0.631 -0.796 1.00 0.00 O ATOM 594 CB TYR A 41 32.810 -0.567 0.846 1.00 0.00 C ATOM 595 CG TYR A 41 32.830 0.483 1.935 1.00 0.00 C ATOM 596 CD1 TYR A 41 31.639 1.024 2.399 1.00 0.00 C ATOM 597 CD2 TYR A 41 34.038 0.904 2.471 1.00 0.00 C ATOM 598 CE1 TYR A 41 31.657 1.982 3.393 1.00 0.00 C ATOM 599 CE2 TYR A 41 34.056 1.862 3.465 1.00 0.00 C ATOM 600 CZ TYR A 41 32.872 2.401 3.926 1.00 0.00 C ATOM 601 OH TYR A 41 32.889 3.355 4.917 1.00 0.00 O ATOM 0 H TYR A 41 33.048 -1.979 -1.169 1.00 0.00 H new ATOM 0 HA TYR A 41 31.848 0.542 -0.719 1.00 0.00 H new ATOM 0 HB2 TYR A 41 31.934 -1.201 0.982 1.00 0.00 H new ATOM 0 HB3 TYR A 41 33.686 -1.206 0.954 1.00 0.00 H new ATOM 0 HD1 TYR A 41 30.698 0.696 1.983 1.00 0.00 H new ATOM 0 HD2 TYR A 41 34.965 0.482 2.111 1.00 0.00 H new ATOM 0 HE1 TYR A 41 30.732 2.405 3.755 1.00 0.00 H new ATOM 0 HE2 TYR A 41 34.997 2.190 3.882 1.00 0.00 H new ATOM 0 HH TYR A 41 33.807 3.477 5.238 1.00 0.00 H new ATOM 611 N GLN A 42 33.575 2.289 -0.847 1.00 0.00 N ATOM 612 CA GLN A 42 34.569 3.348 -0.983 1.00 0.00 C ATOM 613 C GLN A 42 34.103 4.630 -0.305 1.00 0.00 C ATOM 614 O GLN A 42 33.026 5.146 -0.605 1.00 0.00 O ATOM 615 CB GLN A 42 34.867 3.616 -2.460 1.00 0.00 C ATOM 616 CG GLN A 42 35.844 4.755 -2.701 1.00 0.00 C ATOM 617 CD GLN A 42 37.247 4.422 -2.231 1.00 0.00 C ATOM 618 OE1 GLN A 42 37.848 3.438 -2.671 1.00 0.00 O ATOM 619 NE2 GLN A 42 37.779 5.242 -1.331 1.00 0.00 N ATOM 0 H GLN A 42 32.609 2.617 -0.835 1.00 0.00 H new ATOM 0 HA GLN A 42 35.482 3.013 -0.491 1.00 0.00 H new ATOM 0 HB2 GLN A 42 35.268 2.707 -2.909 1.00 0.00 H new ATOM 0 HB3 GLN A 42 33.932 3.840 -2.973 1.00 0.00 H new ATOM 0 HG2 GLN A 42 35.867 4.992 -3.765 1.00 0.00 H new ATOM 0 HG3 GLN A 42 35.492 5.647 -2.183 1.00 0.00 H new ATOM 0 HE21 GLN A 42 37.247 6.044 -0.994 1.00 0.00 H new ATOM 0 HE22 GLN A 42 38.720 5.069 -0.977 1.00 0.00 H new ATOM 628 N VAL A 43 34.920 5.139 0.611 1.00 0.00 N ATOM 629 CA VAL A 43 34.696 6.459 1.188 1.00 0.00 C ATOM 630 C VAL A 43 35.060 7.561 0.200 1.00 0.00 C ATOM 631 O VAL A 43 36.163 7.579 -0.345 1.00 0.00 O ATOM 632 CB VAL A 43 35.529 6.630 2.472 1.00 0.00 C ATOM 633 CG1 VAL A 43 35.399 8.048 3.007 1.00 0.00 C ATOM 634 CG2 VAL A 43 35.083 5.617 3.516 1.00 0.00 C ATOM 0 H VAL A 43 35.744 4.657 0.970 1.00 0.00 H new ATOM 0 HA VAL A 43 33.636 6.540 1.427 1.00 0.00 H new ATOM 0 HB VAL A 43 36.579 6.453 2.239 1.00 0.00 H new ATOM 0 HG11 VAL A 43 35.994 8.151 3.914 1.00 0.00 H new ATOM 0 HG12 VAL A 43 35.756 8.754 2.257 1.00 0.00 H new ATOM 0 HG13 VAL A 43 34.353 8.257 3.233 1.00 0.00 H new ATOM 0 HG21 VAL A 43 35.676 5.743 4.422 1.00 0.00 H new ATOM 0 HG22 VAL A 43 34.029 5.773 3.747 1.00 0.00 H new ATOM 0 HG23 VAL A 43 35.224 4.608 3.128 1.00 0.00 H new ATOM 644 N LEU A 44 34.125 8.479 -0.025 1.00 0.00 N ATOM 645 CA LEU A 44 34.316 9.542 -1.004 1.00 0.00 C ATOM 646 C LEU A 44 34.725 10.845 -0.329 1.00 0.00 C ATOM 647 O LEU A 44 35.479 11.638 -0.895 1.00 0.00 O ATOM 648 CB LEU A 44 33.029 9.758 -1.809 1.00 0.00 C ATOM 649 CG LEU A 44 32.515 8.537 -2.582 1.00 0.00 C ATOM 650 CD1 LEU A 44 31.207 8.889 -3.277 1.00 0.00 C ATOM 651 CD2 LEU A 44 33.566 8.092 -3.587 1.00 0.00 C ATOM 0 H LEU A 44 33.227 8.508 0.458 1.00 0.00 H new ATOM 0 HA LEU A 44 35.117 9.237 -1.677 1.00 0.00 H new ATOM 0 HB2 LEU A 44 32.246 10.088 -1.126 1.00 0.00 H new ATOM 0 HB3 LEU A 44 33.197 10.569 -2.517 1.00 0.00 H new ATOM 0 HG LEU A 44 32.328 7.713 -1.894 1.00 0.00 H new ATOM 0 HD11 LEU A 44 30.842 8.021 -3.826 1.00 0.00 H new ATOM 0 HD12 LEU A 44 30.468 9.185 -2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 44 31.374 9.713 -3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 44 33.200 7.224 -4.136 1.00 0.00 H new ATOM 0 HD22 LEU A 44 33.769 8.904 -4.285 1.00 0.00 H new ATOM 0 HD23 LEU A 44 34.484 7.828 -3.061 1.00 0.00 H new ATOM 663 N GLU A 45 34.225 11.061 0.882 1.00 0.00 N ATOM 664 CA GLU A 45 34.548 12.263 1.642 1.00 0.00 C ATOM 665 C GLU A 45 34.558 11.982 3.139 1.00 0.00 C ATOM 666 O GLU A 45 33.664 11.317 3.662 1.00 0.00 O ATOM 667 CB GLU A 45 33.546 13.377 1.329 1.00 0.00 C ATOM 668 CG GLU A 45 33.833 14.696 2.032 1.00 0.00 C ATOM 669 CD GLU A 45 32.889 15.793 1.625 1.00 0.00 C ATOM 670 OE1 GLU A 45 32.053 15.552 0.788 1.00 0.00 O ATOM 671 OE2 GLU A 45 33.004 16.874 2.153 1.00 0.00 O ATOM 0 H GLU A 45 33.593 10.418 1.360 1.00 0.00 H new ATOM 0 HA GLU A 45 35.546 12.586 1.347 1.00 0.00 H new ATOM 0 HB2 GLU A 45 33.535 13.548 0.253 1.00 0.00 H new ATOM 0 HB3 GLU A 45 32.548 13.040 1.608 1.00 0.00 H new ATOM 0 HG2 GLU A 45 33.768 14.549 3.110 1.00 0.00 H new ATOM 0 HG3 GLU A 45 34.856 15.004 1.813 1.00 0.00 H new ATOM 678 N GLY A 46 35.574 12.494 3.825 1.00 0.00 N ATOM 679 CA GLY A 46 35.638 12.406 5.279 1.00 0.00 C ATOM 680 C GLY A 46 35.870 10.971 5.735 1.00 0.00 C ATOM 681 O GLY A 46 36.880 10.356 5.392 1.00 0.00 O ATOM 0 H GLY A 46 36.365 12.975 3.397 1.00 0.00 H new ATOM 0 HA2 GLY A 46 36.442 13.042 5.649 1.00 0.00 H new ATOM 0 HA3 GLY A 46 34.710 12.782 5.710 1.00 0.00 H new ATOM 685 N GLY A 47 34.929 10.443 6.509 1.00 0.00 N ATOM 686 CA GLY A 47 35.048 9.093 7.048 1.00 0.00 C ATOM 687 C GLY A 47 34.992 9.101 8.570 1.00 0.00 C ATOM 688 O GLY A 47 35.066 8.051 9.209 1.00 0.00 O ATOM 0 H GLY A 47 34.074 10.930 6.778 1.00 0.00 H new ATOM 0 HA2 GLY A 47 34.245 8.470 6.655 1.00 0.00 H new ATOM 0 HA3 GLY A 47 35.987 8.648 6.718 1.00 0.00 H new ATOM 692 N GLN A 48 34.859 10.291 9.146 1.00 0.00 N ATOM 693 CA GLN A 48 34.840 10.442 10.596 1.00 0.00 C ATOM 694 C GLN A 48 33.815 11.483 11.028 1.00 0.00 C ATOM 695 O GLN A 48 34.161 12.632 11.303 1.00 0.00 O ATOM 696 CB GLN A 48 36.227 10.830 11.114 1.00 0.00 C ATOM 697 CG GLN A 48 37.280 9.747 10.944 1.00 0.00 C ATOM 698 CD GLN A 48 38.610 10.130 11.564 1.00 0.00 C ATOM 699 OE1 GLN A 48 38.664 10.913 12.517 1.00 0.00 O ATOM 700 NE2 GLN A 48 39.692 9.580 11.027 1.00 0.00 N ATOM 0 H GLN A 48 34.763 11.166 8.630 1.00 0.00 H new ATOM 0 HA GLN A 48 34.556 9.481 11.026 1.00 0.00 H new ATOM 0 HB2 GLN A 48 36.559 11.729 10.594 1.00 0.00 H new ATOM 0 HB3 GLN A 48 36.150 11.084 12.171 1.00 0.00 H new ATOM 0 HG2 GLN A 48 36.923 8.823 11.399 1.00 0.00 H new ATOM 0 HG3 GLN A 48 37.422 9.546 9.882 1.00 0.00 H new ATOM 0 HE21 GLN A 48 39.600 8.938 10.240 1.00 0.00 H new ATOM 0 HE22 GLN A 48 40.615 9.799 11.402 1.00 0.00 H new ATOM 709 N GLY A 49 32.552 11.075 11.084 1.00 0.00 N ATOM 710 CA GLY A 49 31.498 11.917 11.638 1.00 0.00 C ATOM 711 C GLY A 49 30.678 12.571 10.533 1.00 0.00 C ATOM 712 O GLY A 49 30.697 12.124 9.386 1.00 0.00 O ATOM 0 H GLY A 49 32.233 10.165 10.752 1.00 0.00 H new ATOM 0 HA2 GLY A 49 30.845 11.317 12.272 1.00 0.00 H new ATOM 0 HA3 GLY A 49 31.939 12.687 12.272 1.00 0.00 H new ATOM 716 N ALA A 50 29.959 13.631 10.885 1.00 0.00 N ATOM 717 CA ALA A 50 29.039 14.276 9.956 1.00 0.00 C ATOM 718 C ALA A 50 29.785 14.897 8.783 1.00 0.00 C ATOM 719 O ALA A 50 30.879 15.439 8.947 1.00 0.00 O ATOM 720 CB ALA A 50 28.212 15.332 10.676 1.00 0.00 C ATOM 0 H ALA A 50 29.996 14.062 11.809 1.00 0.00 H new ATOM 0 HA ALA A 50 28.369 13.512 9.562 1.00 0.00 H new ATOM 0 HB1 ALA A 50 27.530 15.804 9.969 1.00 0.00 H new ATOM 0 HB2 ALA A 50 27.638 14.862 11.475 1.00 0.00 H new ATOM 0 HB3 ALA A 50 28.875 16.086 11.100 1.00 0.00 H new ATOM 726 N GLY A 51 29.189 14.816 7.599 1.00 0.00 N ATOM 727 CA GLY A 51 29.819 15.326 6.387 1.00 0.00 C ATOM 728 C GLY A 51 30.469 14.202 5.589 1.00 0.00 C ATOM 729 O GLY A 51 30.850 14.389 4.434 1.00 0.00 O ATOM 0 H GLY A 51 28.269 14.401 7.452 1.00 0.00 H new ATOM 0 HA2 GLY A 51 29.074 15.829 5.771 1.00 0.00 H new ATOM 0 HA3 GLY A 51 30.570 16.070 6.650 1.00 0.00 H new ATOM 733 N THR A 52 30.592 13.036 6.213 1.00 0.00 N ATOM 734 CA THR A 52 31.159 11.868 5.549 1.00 0.00 C ATOM 735 C THR A 52 30.279 11.410 4.393 1.00 0.00 C ATOM 736 O THR A 52 29.056 11.338 4.522 1.00 0.00 O ATOM 737 CB THR A 52 31.356 10.707 6.541 1.00 0.00 C ATOM 738 OG1 THR A 52 32.340 11.072 7.518 1.00 0.00 O ATOM 739 CG2 THR A 52 31.814 9.454 5.811 1.00 0.00 C ATOM 0 H THR A 52 30.306 12.874 7.179 1.00 0.00 H new ATOM 0 HA THR A 52 32.131 12.162 5.154 1.00 0.00 H new ATOM 0 HB THR A 52 30.404 10.503 7.031 1.00 0.00 H new ATOM 0 HG1 THR A 52 31.919 11.610 8.221 1.00 0.00 H new ATOM 0 HG21 THR A 52 31.948 8.644 6.528 1.00 0.00 H new ATOM 0 HG22 THR A 52 31.063 9.167 5.075 1.00 0.00 H new ATOM 0 HG23 THR A 52 32.760 9.652 5.306 1.00 0.00 H new ATOM 747 N VAL A 53 30.907 11.099 3.264 1.00 0.00 N ATOM 748 CA VAL A 53 30.207 10.485 2.142 1.00 0.00 C ATOM 749 C VAL A 53 30.873 9.180 1.726 1.00 0.00 C ATOM 750 O VAL A 53 32.090 9.121 1.552 1.00 0.00 O ATOM 751 CB VAL A 53 30.175 11.449 0.941 1.00 0.00 C ATOM 752 CG1 VAL A 53 29.478 10.798 -0.245 1.00 0.00 C ATOM 753 CG2 VAL A 53 29.479 12.743 1.333 1.00 0.00 C ATOM 0 H VAL A 53 31.901 11.262 3.102 1.00 0.00 H new ATOM 0 HA VAL A 53 29.188 10.269 2.464 1.00 0.00 H new ATOM 0 HB VAL A 53 31.198 11.681 0.646 1.00 0.00 H new ATOM 0 HG11 VAL A 53 29.464 11.493 -1.085 1.00 0.00 H new ATOM 0 HG12 VAL A 53 30.015 9.894 -0.531 1.00 0.00 H new ATOM 0 HG13 VAL A 53 28.455 10.541 0.030 1.00 0.00 H new ATOM 0 HG21 VAL A 53 29.460 13.419 0.478 1.00 0.00 H new ATOM 0 HG22 VAL A 53 28.458 12.526 1.647 1.00 0.00 H new ATOM 0 HG23 VAL A 53 30.019 13.212 2.155 1.00 0.00 H new ATOM 763 N ALA A 54 30.067 8.136 1.566 1.00 0.00 N ATOM 764 CA ALA A 54 30.578 6.826 1.179 1.00 0.00 C ATOM 765 C ALA A 54 29.607 6.109 0.250 1.00 0.00 C ATOM 766 O ALA A 54 28.399 6.342 0.299 1.00 0.00 O ATOM 767 CB ALA A 54 30.854 5.979 2.412 1.00 0.00 C ATOM 0 H ALA A 54 29.056 8.172 1.698 1.00 0.00 H new ATOM 0 HA ALA A 54 31.513 6.976 0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 54 31.235 5.005 2.106 1.00 0.00 H new ATOM 0 HB2 ALA A 54 31.594 6.478 3.038 1.00 0.00 H new ATOM 0 HB3 ALA A 54 29.931 5.847 2.977 1.00 0.00 H new ATOM 773 N THR A 55 30.141 5.234 -0.596 1.00 0.00 N ATOM 774 CA THR A 55 29.341 4.567 -1.616 1.00 0.00 C ATOM 775 C THR A 55 29.640 3.075 -1.662 1.00 0.00 C ATOM 776 O THR A 55 30.765 2.649 -1.399 1.00 0.00 O ATOM 777 CB THR A 55 29.584 5.187 -3.004 1.00 0.00 C ATOM 778 OG1 THR A 55 28.717 4.570 -3.964 1.00 0.00 O ATOM 779 CG2 THR A 55 31.030 4.988 -3.431 1.00 0.00 C ATOM 0 H THR A 55 31.126 4.970 -0.595 1.00 0.00 H new ATOM 0 HA THR A 55 28.294 4.706 -1.347 1.00 0.00 H new ATOM 0 HB THR A 55 29.376 6.256 -2.950 1.00 0.00 H new ATOM 0 HG1 THR A 55 27.819 4.477 -3.582 1.00 0.00 H new ATOM 0 HG21 THR A 55 31.183 5.433 -4.414 1.00 0.00 H new ATOM 0 HG22 THR A 55 31.692 5.467 -2.709 1.00 0.00 H new ATOM 0 HG23 THR A 55 31.253 3.922 -3.476 1.00 0.00 H new ATOM 787 N TRP A 56 28.627 2.283 -1.998 1.00 0.00 N ATOM 788 CA TRP A 56 28.791 0.839 -2.119 1.00 0.00 C ATOM 789 C TRP A 56 27.605 0.210 -2.839 1.00 0.00 C ATOM 790 O TRP A 56 26.553 0.832 -2.985 1.00 0.00 O ATOM 791 CB TRP A 56 28.950 0.202 -0.738 1.00 0.00 C ATOM 792 CG TRP A 56 27.770 0.418 0.160 1.00 0.00 C ATOM 793 CD1 TRP A 56 26.633 -0.333 0.206 1.00 0.00 C ATOM 794 CD2 TRP A 56 27.603 1.459 1.152 1.00 0.00 C ATOM 795 NE1 TRP A 56 25.774 0.167 1.153 1.00 0.00 N ATOM 796 CE2 TRP A 56 26.351 1.263 1.743 1.00 0.00 C ATOM 797 CE3 TRP A 56 28.403 2.526 1.580 1.00 0.00 C ATOM 798 CZ2 TRP A 56 25.873 2.096 2.742 1.00 0.00 C ATOM 799 CZ3 TRP A 56 27.924 3.360 2.584 1.00 0.00 C ATOM 800 CH2 TRP A 56 26.692 3.149 3.149 1.00 0.00 C ATOM 0 H TRP A 56 27.683 2.617 -2.191 1.00 0.00 H new ATOM 0 HA TRP A 56 29.691 0.655 -2.706 1.00 0.00 H new ATOM 0 HB2 TRP A 56 29.114 -0.869 -0.857 1.00 0.00 H new ATOM 0 HB3 TRP A 56 29.840 0.610 -0.259 1.00 0.00 H new ATOM 0 HD1 TRP A 56 26.437 -1.196 -0.413 1.00 0.00 H new ATOM 0 HE1 TRP A 56 24.856 -0.214 1.381 1.00 0.00 H new ATOM 0 HE3 TRP A 56 29.374 2.698 1.138 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 24.903 1.936 3.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 28.531 4.186 2.924 1.00 0.00 H new ATOM 0 HH2 TRP A 56 26.348 3.814 3.927 1.00 0.00 H new ATOM 811 N LYS A 57 27.782 -1.028 -3.288 1.00 0.00 N ATOM 812 CA LYS A 57 26.698 -1.779 -3.911 1.00 0.00 C ATOM 813 C LYS A 57 25.999 -2.679 -2.900 1.00 0.00 C ATOM 814 O LYS A 57 26.502 -3.748 -2.554 1.00 0.00 O ATOM 815 CB LYS A 57 27.227 -2.613 -5.080 1.00 0.00 C ATOM 816 CG LYS A 57 27.716 -1.793 -6.266 1.00 0.00 C ATOM 817 CD LYS A 57 28.146 -2.690 -7.418 1.00 0.00 C ATOM 818 CE LYS A 57 28.522 -1.873 -8.645 1.00 0.00 C ATOM 819 NZ LYS A 57 27.328 -1.287 -9.312 1.00 0.00 N ATOM 0 H LYS A 57 28.666 -1.533 -3.232 1.00 0.00 H new ATOM 0 HA LYS A 57 25.970 -1.061 -4.289 1.00 0.00 H new ATOM 0 HB2 LYS A 57 28.046 -3.238 -4.724 1.00 0.00 H new ATOM 0 HB3 LYS A 57 26.438 -3.284 -5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 57 26.923 -1.124 -6.600 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.553 -1.167 -5.958 1.00 0.00 H new ATOM 0 HD2 LYS A 57 28.996 -3.299 -7.110 1.00 0.00 H new ATOM 0 HD3 LYS A 57 27.337 -3.376 -7.669 1.00 0.00 H new ATOM 0 HE2 LYS A 57 29.203 -1.074 -8.353 1.00 0.00 H new ATOM 0 HE3 LYS A 57 29.058 -2.506 -9.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 27.629 -0.738 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 26.689 -2.050 -9.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 26.830 -0.662 -8.646 1.00 0.00 H new ATOM 833 N LEU A 58 24.837 -2.240 -2.428 1.00 0.00 N ATOM 834 CA LEU A 58 24.095 -2.976 -1.413 1.00 0.00 C ATOM 835 C LEU A 58 23.288 -4.109 -2.033 1.00 0.00 C ATOM 836 O LEU A 58 22.357 -3.872 -2.803 1.00 0.00 O ATOM 837 CB LEU A 58 23.158 -2.031 -0.651 1.00 0.00 C ATOM 838 CG LEU A 58 22.360 -2.665 0.495 1.00 0.00 C ATOM 839 CD1 LEU A 58 23.320 -3.182 1.559 1.00 0.00 C ATOM 840 CD2 LEU A 58 21.402 -1.637 1.077 1.00 0.00 C ATOM 0 H LEU A 58 24.389 -1.376 -2.733 1.00 0.00 H new ATOM 0 HA LEU A 58 24.817 -3.407 -0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 58 23.751 -1.211 -0.246 1.00 0.00 H new ATOM 0 HB3 LEU A 58 22.455 -1.596 -1.361 1.00 0.00 H new ATOM 0 HG LEU A 58 21.776 -3.506 0.121 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.752 -3.632 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 58 23.981 -3.930 1.120 1.00 0.00 H new ATOM 0 HD13 LEU A 58 23.915 -2.354 1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 58 20.835 -2.088 1.891 1.00 0.00 H new ATOM 0 HD22 LEU A 58 21.968 -0.786 1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 58 20.715 -1.299 0.301 1.00 0.00 H new ATOM 852 N GLN A 59 23.650 -5.342 -1.694 1.00 0.00 N ATOM 853 CA GLN A 59 23.074 -6.515 -2.342 1.00 0.00 C ATOM 854 C GLN A 59 21.935 -7.096 -1.515 1.00 0.00 C ATOM 855 O GLN A 59 22.034 -7.204 -0.293 1.00 0.00 O ATOM 856 CB GLN A 59 24.149 -7.581 -2.573 1.00 0.00 C ATOM 857 CG GLN A 59 23.655 -8.813 -3.312 1.00 0.00 C ATOM 858 CD GLN A 59 24.731 -9.871 -3.457 1.00 0.00 C ATOM 859 OE1 GLN A 59 25.376 -10.260 -2.479 1.00 0.00 O ATOM 860 NE2 GLN A 59 24.933 -10.344 -4.682 1.00 0.00 N ATOM 0 H GLN A 59 24.340 -5.555 -0.974 1.00 0.00 H new ATOM 0 HA GLN A 59 22.672 -6.200 -3.305 1.00 0.00 H new ATOM 0 HB2 GLN A 59 24.970 -7.137 -3.137 1.00 0.00 H new ATOM 0 HB3 GLN A 59 24.554 -7.888 -1.609 1.00 0.00 H new ATOM 0 HG2 GLN A 59 22.803 -9.236 -2.779 1.00 0.00 H new ATOM 0 HG3 GLN A 59 23.300 -8.522 -4.301 1.00 0.00 H new ATOM 0 HE21 GLN A 59 24.377 -9.994 -5.462 1.00 0.00 H new ATOM 0 HE22 GLN A 59 25.644 -11.057 -4.842 1.00 0.00 H new ATOM 950 N VAL A 65 20.878 -6.228 -6.610 1.00 0.00 N ATOM 951 CA VAL A 65 21.799 -5.292 -5.977 1.00 0.00 C ATOM 952 C VAL A 65 21.499 -3.858 -6.393 1.00 0.00 C ATOM 953 O VAL A 65 21.142 -3.596 -7.541 1.00 0.00 O ATOM 954 CB VAL A 65 23.253 -5.638 -6.350 1.00 0.00 C ATOM 955 CG1 VAL A 65 23.464 -5.505 -7.851 1.00 0.00 C ATOM 956 CG2 VAL A 65 24.212 -4.736 -5.588 1.00 0.00 C ATOM 0 HA VAL A 65 21.668 -5.377 -4.898 1.00 0.00 H new ATOM 0 HB VAL A 65 23.453 -6.673 -6.072 1.00 0.00 H new ATOM 0 HG11 VAL A 65 24.497 -5.753 -8.097 1.00 0.00 H new ATOM 0 HG12 VAL A 65 22.793 -6.186 -8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 65 23.254 -4.481 -8.159 1.00 0.00 H new ATOM 0 HG21 VAL A 65 25.238 -4.986 -5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 65 24.014 -3.695 -5.844 1.00 0.00 H new ATOM 0 HG23 VAL A 65 24.072 -4.879 -4.516 1.00 0.00 H new ATOM 966 N ARG A 66 21.647 -2.931 -5.452 1.00 0.00 N ATOM 967 CA ARG A 66 21.396 -1.520 -5.721 1.00 0.00 C ATOM 968 C ARG A 66 22.609 -0.669 -5.367 1.00 0.00 C ATOM 969 O ARG A 66 23.332 -0.966 -4.416 1.00 0.00 O ATOM 970 CB ARG A 66 20.190 -1.031 -4.933 1.00 0.00 C ATOM 971 CG ARG A 66 18.877 -1.711 -5.287 1.00 0.00 C ATOM 972 CD ARG A 66 17.770 -1.262 -4.403 1.00 0.00 C ATOM 973 NE ARG A 66 17.404 0.122 -4.653 1.00 0.00 N ATOM 974 CZ ARG A 66 16.555 0.527 -5.618 1.00 0.00 C ATOM 975 NH1 ARG A 66 15.995 -0.357 -6.414 1.00 0.00 N ATOM 976 NH2 ARG A 66 16.286 1.812 -5.765 1.00 0.00 N ATOM 0 H ARG A 66 21.940 -3.132 -4.496 1.00 0.00 H new ATOM 0 HA ARG A 66 21.196 -1.420 -6.788 1.00 0.00 H new ATOM 0 HB2 ARG A 66 20.384 -1.178 -3.871 1.00 0.00 H new ATOM 0 HB3 ARG A 66 20.081 0.042 -5.091 1.00 0.00 H new ATOM 0 HG2 ARG A 66 18.624 -1.496 -6.325 1.00 0.00 H new ATOM 0 HG3 ARG A 66 18.993 -2.792 -5.205 1.00 0.00 H new ATOM 0 HD2 ARG A 66 16.900 -1.901 -4.557 1.00 0.00 H new ATOM 0 HD3 ARG A 66 18.069 -1.376 -3.361 1.00 0.00 H new ATOM 0 HE ARG A 66 17.819 0.837 -4.056 1.00 0.00 H new ATOM 0 HH11 ARG A 66 16.203 -1.349 -6.301 1.00 0.00 H new ATOM 0 HH12 ARG A 66 15.352 -0.051 -7.144 1.00 0.00 H new ATOM 0 HH21 ARG A 66 16.721 2.498 -5.148 1.00 0.00 H new ATOM 0 HH22 ARG A 66 15.643 2.118 -6.496 1.00 0.00 H new ATOM 990 N ASP A 67 22.826 0.392 -6.138 1.00 0.00 N ATOM 991 CA ASP A 67 23.903 1.334 -5.858 1.00 0.00 C ATOM 992 C ASP A 67 23.523 2.286 -4.731 1.00 0.00 C ATOM 993 O ASP A 67 22.422 2.836 -4.715 1.00 0.00 O ATOM 994 CB ASP A 67 24.254 2.135 -7.114 1.00 0.00 C ATOM 995 CG ASP A 67 24.947 1.295 -8.179 1.00 0.00 C ATOM 996 OD1 ASP A 67 25.465 0.257 -7.844 1.00 0.00 O ATOM 997 OD2 ASP A 67 24.951 1.700 -9.317 1.00 0.00 O ATOM 0 H ASP A 67 22.270 0.621 -6.962 1.00 0.00 H new ATOM 0 HA ASP A 67 24.774 0.758 -5.545 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.343 2.563 -7.532 1.00 0.00 H new ATOM 0 HB3 ASP A 67 24.900 2.968 -6.838 1.00 0.00 H new ATOM 1002 N VAL A 68 24.442 2.476 -3.790 1.00 0.00 N ATOM 1003 CA VAL A 68 24.197 3.345 -2.645 1.00 0.00 C ATOM 1004 C VAL A 68 25.262 4.429 -2.538 1.00 0.00 C ATOM 1005 O VAL A 68 26.458 4.146 -2.614 1.00 0.00 O ATOM 1006 CB VAL A 68 24.174 2.522 -1.344 1.00 0.00 C ATOM 1007 CG1 VAL A 68 23.971 3.431 -0.141 1.00 0.00 C ATOM 1008 CG2 VAL A 68 23.078 1.470 -1.416 1.00 0.00 C ATOM 0 H VAL A 68 25.364 2.039 -3.798 1.00 0.00 H new ATOM 0 HA VAL A 68 23.228 3.821 -2.793 1.00 0.00 H new ATOM 0 HB VAL A 68 25.134 2.018 -1.228 1.00 0.00 H new ATOM 0 HG11 VAL A 68 23.957 2.832 0.770 1.00 0.00 H new ATOM 0 HG12 VAL A 68 24.786 4.153 -0.088 1.00 0.00 H new ATOM 0 HG13 VAL A 68 23.024 3.961 -0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 68 23.068 0.892 -0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 68 22.113 1.959 -1.549 1.00 0.00 H new ATOM 0 HG23 VAL A 68 23.267 0.805 -2.259 1.00 0.00 H new ATOM 1018 N LYS A 69 24.822 5.670 -2.362 1.00 0.00 N ATOM 1019 CA LYS A 69 25.730 6.770 -2.062 1.00 0.00 C ATOM 1020 C LYS A 69 25.296 7.517 -0.807 1.00 0.00 C ATOM 1021 O LYS A 69 24.540 8.485 -0.880 1.00 0.00 O ATOM 1022 CB LYS A 69 25.812 7.735 -3.246 1.00 0.00 C ATOM 1023 CG LYS A 69 26.788 8.888 -3.052 1.00 0.00 C ATOM 1024 CD LYS A 69 26.867 9.760 -4.296 1.00 0.00 C ATOM 1025 CE LYS A 69 27.800 10.943 -4.084 1.00 0.00 C ATOM 1026 NZ LYS A 69 27.888 11.805 -5.294 1.00 0.00 N ATOM 0 H LYS A 69 23.840 5.939 -2.422 1.00 0.00 H new ATOM 0 HA LYS A 69 26.718 6.346 -1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 69 26.102 7.176 -4.135 1.00 0.00 H new ATOM 0 HB3 LYS A 69 24.819 8.143 -3.436 1.00 0.00 H new ATOM 0 HG2 LYS A 69 26.475 9.493 -2.201 1.00 0.00 H new ATOM 0 HG3 LYS A 69 27.777 8.495 -2.818 1.00 0.00 H new ATOM 0 HD2 LYS A 69 27.218 9.164 -5.139 1.00 0.00 H new ATOM 0 HD3 LYS A 69 25.871 10.121 -4.553 1.00 0.00 H new ATOM 0 HE2 LYS A 69 27.448 11.537 -3.240 1.00 0.00 H new ATOM 0 HE3 LYS A 69 28.794 10.579 -3.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 28.533 12.599 -5.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 28.249 11.246 -6.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 26.944 12.173 -5.527 1.00 0.00 H new ATOM 1040 N ALA A 70 25.778 7.060 0.343 1.00 0.00 N ATOM 1041 CA ALA A 70 25.262 7.521 1.627 1.00 0.00 C ATOM 1042 C ALA A 70 25.909 8.836 2.041 1.00 0.00 C ATOM 1043 O ALA A 70 27.133 8.941 2.114 1.00 0.00 O ATOM 1044 CB ALA A 70 25.483 6.462 2.697 1.00 0.00 C ATOM 0 H ALA A 70 26.526 6.370 0.413 1.00 0.00 H new ATOM 0 HA ALA A 70 24.191 7.693 1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 70 25.093 6.820 3.650 1.00 0.00 H new ATOM 0 HB2 ALA A 70 24.965 5.546 2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 70 26.550 6.260 2.795 1.00 0.00 H new ATOM 1050 N THR A 71 25.079 9.838 2.312 1.00 0.00 N ATOM 1051 CA THR A 71 25.540 11.059 2.963 1.00 0.00 C ATOM 1052 C THR A 71 25.310 11.000 4.468 1.00 0.00 C ATOM 1053 O THR A 71 24.180 10.834 4.927 1.00 0.00 O ATOM 1054 CB THR A 71 24.835 12.297 2.380 1.00 0.00 C ATOM 1055 OG1 THR A 71 25.133 12.407 0.982 1.00 0.00 O ATOM 1056 CG2 THR A 71 25.297 13.559 3.093 1.00 0.00 C ATOM 0 H THR A 71 24.083 9.828 2.091 1.00 0.00 H new ATOM 0 HA THR A 71 26.610 11.142 2.775 1.00 0.00 H new ATOM 0 HB THR A 71 23.760 12.184 2.522 1.00 0.00 H new ATOM 0 HG1 THR A 71 24.682 13.195 0.612 1.00 0.00 H new ATOM 0 HG21 THR A 71 24.788 14.424 2.668 1.00 0.00 H new ATOM 0 HG22 THR A 71 25.061 13.484 4.154 1.00 0.00 H new ATOM 0 HG23 THR A 71 26.374 13.674 2.968 1.00 0.00 H new ATOM 1064 N VAL A 72 26.389 11.138 5.232 1.00 0.00 N ATOM 1065 CA VAL A 72 26.345 10.903 6.670 1.00 0.00 C ATOM 1066 C VAL A 72 26.012 12.182 7.427 1.00 0.00 C ATOM 1067 O VAL A 72 26.701 13.193 7.290 1.00 0.00 O ATOM 1068 CB VAL A 72 27.697 10.355 7.163 1.00 0.00 C ATOM 1069 CG1 VAL A 72 27.680 10.179 8.675 1.00 0.00 C ATOM 1070 CG2 VAL A 72 28.005 9.036 6.470 1.00 0.00 C ATOM 0 H VAL A 72 27.306 11.412 4.878 1.00 0.00 H new ATOM 0 HA VAL A 72 25.562 10.170 6.862 1.00 0.00 H new ATOM 0 HB VAL A 72 28.481 11.070 6.915 1.00 0.00 H new ATOM 0 HG11 VAL A 72 28.643 9.791 9.007 1.00 0.00 H new ATOM 0 HG12 VAL A 72 27.493 11.141 9.151 1.00 0.00 H new ATOM 0 HG13 VAL A 72 26.892 9.478 8.951 1.00 0.00 H new ATOM 0 HG21 VAL A 72 28.963 8.654 6.824 1.00 0.00 H new ATOM 0 HG22 VAL A 72 27.221 8.314 6.697 1.00 0.00 H new ATOM 0 HG23 VAL A 72 28.053 9.194 5.392 1.00 0.00 H new ATOM 1080 N ASP A 73 24.952 12.132 8.226 1.00 0.00 N ATOM 1081 CA ASP A 73 24.588 13.250 9.088 1.00 0.00 C ATOM 1082 C ASP A 73 24.490 12.815 10.544 1.00 0.00 C ATOM 1083 O ASP A 73 23.470 12.275 10.974 1.00 0.00 O ATOM 1084 CB ASP A 73 23.257 13.861 8.641 1.00 0.00 C ATOM 1085 CG ASP A 73 22.857 15.078 9.464 1.00 0.00 C ATOM 1086 OD1 ASP A 73 23.491 15.331 10.461 1.00 0.00 O ATOM 1087 OD2 ASP A 73 21.922 15.743 9.087 1.00 0.00 O ATOM 0 H ASP A 73 24.329 11.327 8.295 1.00 0.00 H new ATOM 0 HA ASP A 73 25.374 14.001 9.004 1.00 0.00 H new ATOM 0 HB2 ASP A 73 23.328 14.146 7.591 1.00 0.00 H new ATOM 0 HB3 ASP A 73 22.474 13.106 8.714 1.00 0.00 H new ATOM 1092 N VAL A 74 25.556 13.053 11.300 1.00 0.00 N ATOM 1093 CA VAL A 74 25.605 12.656 12.702 1.00 0.00 C ATOM 1094 C VAL A 74 25.000 13.729 13.600 1.00 0.00 C ATOM 1095 O VAL A 74 25.467 14.868 13.622 1.00 0.00 O ATOM 1096 CB VAL A 74 27.060 12.391 13.133 1.00 0.00 C ATOM 1097 CG1 VAL A 74 27.116 11.984 14.597 1.00 0.00 C ATOM 1098 CG2 VAL A 74 27.673 11.316 12.249 1.00 0.00 C ATOM 0 H VAL A 74 26.399 13.520 10.965 1.00 0.00 H new ATOM 0 HA VAL A 74 25.021 11.742 12.807 1.00 0.00 H new ATOM 0 HB VAL A 74 27.637 13.308 13.017 1.00 0.00 H new ATOM 0 HG11 VAL A 74 28.151 11.801 14.884 1.00 0.00 H new ATOM 0 HG12 VAL A 74 26.705 12.784 15.213 1.00 0.00 H new ATOM 0 HG13 VAL A 74 26.532 11.075 14.745 1.00 0.00 H new ATOM 0 HG21 VAL A 74 28.702 11.133 12.559 1.00 0.00 H new ATOM 0 HG22 VAL A 74 27.097 10.396 12.343 1.00 0.00 H new ATOM 0 HG23 VAL A 74 27.660 11.648 11.211 1.00 0.00 H new ATOM 1108 N ALA A 75 23.960 13.358 14.338 1.00 0.00 N ATOM 1109 CA ALA A 75 23.298 14.284 15.249 1.00 0.00 C ATOM 1110 C ALA A 75 22.795 13.566 16.495 1.00 0.00 C ATOM 1111 O ALA A 75 22.068 12.577 16.402 1.00 0.00 O ATOM 1112 CB ALA A 75 22.148 14.989 14.545 1.00 0.00 C ATOM 0 H ALA A 75 23.557 12.421 14.323 1.00 0.00 H new ATOM 0 HA ALA A 75 24.030 15.029 15.561 1.00 0.00 H new ATOM 0 HB1 ALA A 75 21.664 15.677 15.238 1.00 0.00 H new ATOM 0 HB2 ALA A 75 22.531 15.546 13.690 1.00 0.00 H new ATOM 0 HB3 ALA A 75 21.424 14.250 14.202 1.00 0.00 H new ATOM 1118 N GLY A 76 23.187 14.069 17.661 1.00 0.00 N ATOM 1119 CA GLY A 76 22.804 13.457 18.927 1.00 0.00 C ATOM 1120 C GLY A 76 23.449 12.087 19.094 1.00 0.00 C ATOM 1121 O GLY A 76 24.666 11.977 19.243 1.00 0.00 O ATOM 0 H GLY A 76 23.771 14.900 17.755 1.00 0.00 H new ATOM 0 HA2 GLY A 76 23.101 14.105 19.752 1.00 0.00 H new ATOM 0 HA3 GLY A 76 21.719 13.359 18.973 1.00 0.00 H new ATOM 1125 N HIS A 77 22.625 11.044 19.068 1.00 0.00 N ATOM 1126 CA HIS A 77 23.122 9.675 19.126 1.00 0.00 C ATOM 1127 C HIS A 77 22.642 8.864 17.928 1.00 0.00 C ATOM 1128 O HIS A 77 22.601 7.635 17.975 1.00 0.00 O ATOM 1129 CB HIS A 77 22.677 8.992 20.423 1.00 0.00 C ATOM 1130 CG HIS A 77 23.227 9.633 21.659 1.00 0.00 C ATOM 1131 ND1 HIS A 77 24.551 9.523 22.028 1.00 0.00 N ATOM 1132 CD2 HIS A 77 22.633 10.389 22.612 1.00 0.00 C ATOM 1133 CE1 HIS A 77 24.748 10.186 23.154 1.00 0.00 C ATOM 1134 NE2 HIS A 77 23.600 10.720 23.529 1.00 0.00 N ATOM 0 H HIS A 77 21.610 11.122 19.007 1.00 0.00 H new ATOM 0 HA HIS A 77 24.211 9.720 19.102 1.00 0.00 H new ATOM 0 HB2 HIS A 77 21.588 9.001 20.473 1.00 0.00 H new ATOM 0 HB3 HIS A 77 22.986 7.947 20.398 1.00 0.00 H new ATOM 0 HD2 HIS A 77 21.593 10.678 22.645 1.00 0.00 H new ATOM 0 HE1 HIS A 77 25.688 10.276 23.678 1.00 0.00 H new ATOM 0 HE2 HIS A 77 23.455 11.287 24.365 1.00 0.00 H new ATOM 1142 N THR A 78 22.280 9.560 16.856 1.00 0.00 N ATOM 1143 CA THR A 78 21.843 8.905 15.629 1.00 0.00 C ATOM 1144 C THR A 78 22.708 9.318 14.446 1.00 0.00 C ATOM 1145 O THR A 78 22.884 10.507 14.178 1.00 0.00 O ATOM 1146 CB THR A 78 20.367 9.222 15.326 1.00 0.00 C ATOM 1147 OG1 THR A 78 19.543 8.743 16.398 1.00 0.00 O ATOM 1148 CG2 THR A 78 19.935 8.562 14.026 1.00 0.00 C ATOM 0 H THR A 78 22.281 10.579 16.812 1.00 0.00 H new ATOM 0 HA THR A 78 21.948 7.831 15.782 1.00 0.00 H new ATOM 0 HB THR A 78 20.256 10.302 15.227 1.00 0.00 H new ATOM 0 HG1 THR A 78 18.610 8.989 16.228 1.00 0.00 H new ATOM 0 HG21 THR A 78 18.889 8.797 13.829 1.00 0.00 H new ATOM 0 HG22 THR A 78 20.551 8.933 13.207 1.00 0.00 H new ATOM 0 HG23 THR A 78 20.054 7.482 14.109 1.00 0.00 H new ATOM 1156 N VAL A 79 23.247 8.330 13.739 1.00 0.00 N ATOM 1157 CA VAL A 79 23.966 8.580 12.496 1.00 0.00 C ATOM 1158 C VAL A 79 23.087 8.296 11.284 1.00 0.00 C ATOM 1159 O VAL A 79 22.700 7.153 11.041 1.00 0.00 O ATOM 1160 CB VAL A 79 25.232 7.706 12.425 1.00 0.00 C ATOM 1161 CG1 VAL A 79 25.979 7.956 11.124 1.00 0.00 C ATOM 1162 CG2 VAL A 79 26.125 7.990 13.623 1.00 0.00 C ATOM 0 H VAL A 79 23.199 7.347 14.007 1.00 0.00 H new ATOM 0 HA VAL A 79 24.248 9.633 12.483 1.00 0.00 H new ATOM 0 HB VAL A 79 24.939 6.656 12.450 1.00 0.00 H new ATOM 0 HG11 VAL A 79 26.871 7.330 11.091 1.00 0.00 H new ATOM 0 HG12 VAL A 79 25.333 7.712 10.281 1.00 0.00 H new ATOM 0 HG13 VAL A 79 26.269 9.005 11.067 1.00 0.00 H new ATOM 0 HG21 VAL A 79 27.019 7.368 13.566 1.00 0.00 H new ATOM 0 HG22 VAL A 79 26.414 9.041 13.621 1.00 0.00 H new ATOM 0 HG23 VAL A 79 25.584 7.764 14.542 1.00 0.00 H new ATOM 1172 N ILE A 80 22.775 9.342 10.527 1.00 0.00 N ATOM 1173 CA ILE A 80 21.825 9.235 9.426 1.00 0.00 C ATOM 1174 C ILE A 80 22.543 9.044 8.096 1.00 0.00 C ATOM 1175 O ILE A 80 23.432 9.819 7.743 1.00 0.00 O ATOM 1176 CB ILE A 80 20.928 10.483 9.351 1.00 0.00 C ATOM 1177 CG1 ILE A 80 20.131 10.646 10.648 1.00 0.00 C ATOM 1178 CG2 ILE A 80 19.992 10.395 8.155 1.00 0.00 C ATOM 1179 CD1 ILE A 80 19.426 11.978 10.769 1.00 0.00 C ATOM 0 H ILE A 80 23.167 10.275 10.656 1.00 0.00 H new ATOM 0 HA ILE A 80 21.203 8.361 9.618 1.00 0.00 H new ATOM 0 HB ILE A 80 21.564 11.359 9.225 1.00 0.00 H new ATOM 0 HG12 ILE A 80 19.392 9.847 10.712 1.00 0.00 H new ATOM 0 HG13 ILE A 80 20.806 10.524 11.495 1.00 0.00 H new ATOM 0 HG21 ILE A 80 19.365 11.286 8.117 1.00 0.00 H new ATOM 0 HG22 ILE A 80 20.578 10.325 7.239 1.00 0.00 H new ATOM 0 HG23 ILE A 80 19.361 9.511 8.251 1.00 0.00 H new ATOM 0 HD11 ILE A 80 18.883 12.018 11.713 1.00 0.00 H new ATOM 0 HD12 ILE A 80 20.161 12.783 10.738 1.00 0.00 H new ATOM 0 HD13 ILE A 80 18.725 12.095 9.943 1.00 0.00 H new ATOM 1191 N GLU A 81 22.152 8.008 7.362 1.00 0.00 N ATOM 1192 CA GLU A 81 22.745 7.725 6.060 1.00 0.00 C ATOM 1193 C GLU A 81 21.729 7.913 4.940 1.00 0.00 C ATOM 1194 O GLU A 81 20.838 7.085 4.752 1.00 0.00 O ATOM 1195 CB GLU A 81 23.299 6.299 6.025 1.00 0.00 C ATOM 1196 CG GLU A 81 24.449 6.048 6.991 1.00 0.00 C ATOM 1197 CD GLU A 81 24.914 4.618 6.987 1.00 0.00 C ATOM 1198 OE1 GLU A 81 24.287 3.811 6.344 1.00 0.00 O ATOM 1199 OE2 GLU A 81 25.898 4.333 7.629 1.00 0.00 O ATOM 0 H GLU A 81 21.427 7.350 7.647 1.00 0.00 H new ATOM 0 HA GLU A 81 23.561 8.430 5.905 1.00 0.00 H new ATOM 0 HB2 GLU A 81 22.492 5.603 6.251 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.636 6.078 5.012 1.00 0.00 H new ATOM 0 HG2 GLU A 81 25.285 6.697 6.730 1.00 0.00 H new ATOM 0 HG3 GLU A 81 24.136 6.320 7.999 1.00 0.00 H new ATOM 1206 N LYS A 82 21.870 9.006 4.198 1.00 0.00 N ATOM 1207 CA LYS A 82 20.935 9.330 3.127 1.00 0.00 C ATOM 1208 C LYS A 82 21.500 8.945 1.766 1.00 0.00 C ATOM 1209 O LYS A 82 22.509 9.495 1.324 1.00 0.00 O ATOM 1210 CB LYS A 82 20.590 10.820 3.151 1.00 0.00 C ATOM 1211 CG LYS A 82 19.848 11.275 4.402 1.00 0.00 C ATOM 1212 CD LYS A 82 19.493 12.752 4.327 1.00 0.00 C ATOM 1213 CE LYS A 82 18.750 13.207 5.574 1.00 0.00 C ATOM 1214 NZ LYS A 82 18.401 14.652 5.518 1.00 0.00 N ATOM 0 H LYS A 82 22.623 9.683 4.319 1.00 0.00 H new ATOM 0 HA LYS A 82 20.025 8.753 3.293 1.00 0.00 H new ATOM 0 HB2 LYS A 82 21.511 11.395 3.061 1.00 0.00 H new ATOM 0 HB3 LYS A 82 19.981 11.054 2.277 1.00 0.00 H new ATOM 0 HG2 LYS A 82 18.939 10.686 4.523 1.00 0.00 H new ATOM 0 HG3 LYS A 82 20.466 11.091 5.281 1.00 0.00 H new ATOM 0 HD2 LYS A 82 20.402 13.341 4.208 1.00 0.00 H new ATOM 0 HD3 LYS A 82 18.877 12.936 3.447 1.00 0.00 H new ATOM 0 HE2 LYS A 82 17.840 12.618 5.689 1.00 0.00 H new ATOM 0 HE3 LYS A 82 19.366 13.016 6.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 17.896 14.921 6.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.271 15.216 5.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.792 14.830 4.694 1.00 0.00 H new ATOM 1228 N ASP A 83 20.844 7.997 1.106 1.00 0.00 N ATOM 1229 CA ASP A 83 21.295 7.518 -0.195 1.00 0.00 C ATOM 1230 C ASP A 83 20.984 8.527 -1.293 1.00 0.00 C ATOM 1231 O ASP A 83 19.828 8.897 -1.499 1.00 0.00 O ATOM 1232 CB ASP A 83 20.641 6.175 -0.528 1.00 0.00 C ATOM 1233 CG ASP A 83 21.226 5.524 -1.775 1.00 0.00 C ATOM 1234 OD1 ASP A 83 22.010 6.158 -2.440 1.00 0.00 O ATOM 1235 OD2 ASP A 83 20.884 4.398 -2.049 1.00 0.00 O ATOM 0 H ASP A 83 19.997 7.545 1.451 1.00 0.00 H new ATOM 0 HA ASP A 83 22.376 7.388 -0.142 1.00 0.00 H new ATOM 0 HB2 ASP A 83 20.760 5.499 0.319 1.00 0.00 H new ATOM 0 HB3 ASP A 83 19.570 6.323 -0.670 1.00 0.00 H new ATOM 1240 N ALA A 84 22.022 8.970 -1.994 1.00 0.00 N ATOM 1241 CA ALA A 84 21.864 9.953 -3.059 1.00 0.00 C ATOM 1242 C ALA A 84 21.480 9.285 -4.373 1.00 0.00 C ATOM 1243 O ALA A 84 21.033 9.946 -5.310 1.00 0.00 O ATOM 1244 CB ALA A 84 23.142 10.760 -3.230 1.00 0.00 C ATOM 0 H ALA A 84 22.983 8.663 -1.843 1.00 0.00 H new ATOM 0 HA ALA A 84 21.057 10.628 -2.775 1.00 0.00 H new ATOM 0 HB1 ALA A 84 23.008 11.489 -4.029 1.00 0.00 H new ATOM 0 HB2 ALA A 84 23.372 11.279 -2.300 1.00 0.00 H new ATOM 0 HB3 ALA A 84 23.964 10.091 -3.484 1.00 0.00 H new ATOM 1250 N ASN A 85 21.657 7.969 -4.436 1.00 0.00 N ATOM 1251 CA ASN A 85 21.387 7.217 -5.655 1.00 0.00 C ATOM 1252 C ASN A 85 19.984 6.624 -5.637 1.00 0.00 C ATOM 1253 O ASN A 85 19.510 6.095 -6.643 1.00 0.00 O ATOM 1254 CB ASN A 85 22.425 6.127 -5.851 1.00 0.00 C ATOM 1255 CG ASN A 85 23.776 6.675 -6.218 1.00 0.00 C ATOM 1256 OD1 ASN A 85 23.888 7.800 -6.718 1.00 0.00 O ATOM 1257 ND2 ASN A 85 24.804 5.902 -5.979 1.00 0.00 N ATOM 0 H ASN A 85 21.987 7.401 -3.655 1.00 0.00 H new ATOM 0 HA ASN A 85 21.448 7.908 -6.495 1.00 0.00 H new ATOM 0 HB2 ASN A 85 22.511 5.543 -4.935 1.00 0.00 H new ATOM 0 HB3 ASN A 85 22.088 5.446 -6.633 1.00 0.00 H new ATOM 0 HD21 ASN A 85 25.746 6.221 -6.207 1.00 0.00 H new ATOM 0 HD22 ASN A 85 24.664 4.980 -5.565 1.00 0.00 H new ATOM 1264 N SER A 86 19.322 6.717 -4.489 1.00 0.00 N ATOM 1265 CA SER A 86 18.004 6.120 -4.314 1.00 0.00 C ATOM 1266 C SER A 86 17.264 6.752 -3.142 1.00 0.00 C ATOM 1267 O SER A 86 17.882 7.237 -2.194 1.00 0.00 O ATOM 1268 CB SER A 86 18.132 4.625 -4.095 1.00 0.00 C ATOM 1269 OG SER A 86 16.872 4.026 -3.966 1.00 0.00 O ATOM 0 H SER A 86 19.678 7.201 -3.665 1.00 0.00 H new ATOM 0 HA SER A 86 17.429 6.305 -5.221 1.00 0.00 H new ATOM 0 HB2 SER A 86 18.668 4.176 -4.931 1.00 0.00 H new ATOM 0 HB3 SER A 86 18.722 4.435 -3.199 1.00 0.00 H new ATOM 0 HG SER A 86 16.942 3.240 -3.385 1.00 0.00 H new ATOM 1275 N SER A 87 15.937 6.744 -3.213 1.00 0.00 N ATOM 1276 CA SER A 87 15.112 7.418 -2.218 1.00 0.00 C ATOM 1277 C SER A 87 14.995 6.588 -0.946 1.00 0.00 C ATOM 1278 O SER A 87 13.896 6.216 -0.535 1.00 0.00 O ATOM 1279 CB SER A 87 13.732 7.693 -2.782 1.00 0.00 C ATOM 1280 OG SER A 87 13.102 6.503 -3.168 1.00 0.00 O ATOM 0 H SER A 87 15.410 6.277 -3.951 1.00 0.00 H new ATOM 0 HA SER A 87 15.594 8.363 -1.967 1.00 0.00 H new ATOM 0 HB2 SER A 87 13.125 8.204 -2.035 1.00 0.00 H new ATOM 0 HB3 SER A 87 13.812 8.361 -3.639 1.00 0.00 H new ATOM 0 HG SER A 87 13.031 5.905 -2.395 1.00 0.00 H new ATOM 1286 N LEU A 88 16.134 6.300 -0.326 1.00 0.00 N ATOM 1287 CA LEU A 88 16.169 5.450 0.858 1.00 0.00 C ATOM 1288 C LEU A 88 17.133 5.998 1.902 1.00 0.00 C ATOM 1289 O LEU A 88 18.256 6.387 1.580 1.00 0.00 O ATOM 1290 CB LEU A 88 16.578 4.023 0.474 1.00 0.00 C ATOM 1291 CG LEU A 88 16.667 3.021 1.632 1.00 0.00 C ATOM 1292 CD1 LEU A 88 16.276 1.635 1.138 1.00 0.00 C ATOM 1293 CD2 LEU A 88 18.080 3.021 2.196 1.00 0.00 C ATOM 0 H LEU A 88 17.047 6.644 -0.625 1.00 0.00 H new ATOM 0 HA LEU A 88 15.168 5.436 1.289 1.00 0.00 H new ATOM 0 HB2 LEU A 88 15.863 3.644 -0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 88 17.548 4.064 -0.022 1.00 0.00 H new ATOM 0 HG LEU A 88 15.979 3.309 2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 88 16.340 0.924 1.962 1.00 0.00 H new ATOM 0 HD12 LEU A 88 15.255 1.659 0.757 1.00 0.00 H new ATOM 0 HD13 LEU A 88 16.953 1.328 0.341 1.00 0.00 H new ATOM 0 HD21 LEU A 88 18.143 2.309 3.019 1.00 0.00 H new ATOM 0 HD22 LEU A 88 18.784 2.736 1.414 1.00 0.00 H new ATOM 0 HD23 LEU A 88 18.327 4.019 2.560 1.00 0.00 H new ATOM 1305 N VAL A 89 16.689 6.026 3.154 1.00 0.00 N ATOM 1306 CA VAL A 89 17.507 6.540 4.246 1.00 0.00 C ATOM 1307 C VAL A 89 17.572 5.548 5.400 1.00 0.00 C ATOM 1308 O VAL A 89 16.554 4.993 5.812 1.00 0.00 O ATOM 1309 CB VAL A 89 16.938 7.879 4.754 1.00 0.00 C ATOM 1310 CG1 VAL A 89 17.766 8.401 5.919 1.00 0.00 C ATOM 1311 CG2 VAL A 89 16.905 8.891 3.620 1.00 0.00 C ATOM 0 H VAL A 89 15.766 5.698 3.438 1.00 0.00 H new ATOM 0 HA VAL A 89 18.515 6.693 3.862 1.00 0.00 H new ATOM 0 HB VAL A 89 15.920 7.719 5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 89 17.350 9.347 6.266 1.00 0.00 H new ATOM 0 HG12 VAL A 89 17.746 7.676 6.733 1.00 0.00 H new ATOM 0 HG13 VAL A 89 18.795 8.554 5.594 1.00 0.00 H new ATOM 0 HG21 VAL A 89 16.502 9.835 3.986 1.00 0.00 H new ATOM 0 HG22 VAL A 89 17.916 9.050 3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 89 16.274 8.515 2.815 1.00 0.00 H new ATOM 1321 N SER A 90 18.776 5.330 5.918 1.00 0.00 N ATOM 1322 CA SER A 90 18.970 4.436 7.053 1.00 0.00 C ATOM 1323 C SER A 90 19.487 5.193 8.269 1.00 0.00 C ATOM 1324 O SER A 90 20.442 5.964 8.173 1.00 0.00 O ATOM 1325 CB SER A 90 19.940 3.330 6.686 1.00 0.00 C ATOM 1326 OG SER A 90 19.396 2.490 5.705 1.00 0.00 O ATOM 0 H SER A 90 19.632 5.761 5.569 1.00 0.00 H new ATOM 0 HA SER A 90 18.003 4.001 7.307 1.00 0.00 H new ATOM 0 HB2 SER A 90 20.871 3.764 6.322 1.00 0.00 H new ATOM 0 HB3 SER A 90 20.185 2.747 7.574 1.00 0.00 H new ATOM 0 HG SER A 90 20.040 1.786 5.484 1.00 0.00 H new ATOM 1332 N ASN A 91 18.850 4.970 9.414 1.00 0.00 N ATOM 1333 CA ASN A 91 19.248 5.627 10.653 1.00 0.00 C ATOM 1334 C ASN A 91 19.988 4.664 11.573 1.00 0.00 C ATOM 1335 O ASN A 91 19.592 3.509 11.726 1.00 0.00 O ATOM 1336 CB ASN A 91 18.040 6.216 11.357 1.00 0.00 C ATOM 1337 CG ASN A 91 17.336 7.253 10.527 1.00 0.00 C ATOM 1338 OD1 ASN A 91 17.977 8.066 9.851 1.00 0.00 O ATOM 1339 ND2 ASN A 91 16.028 7.240 10.563 1.00 0.00 N ATOM 0 H ASN A 91 18.055 4.338 9.509 1.00 0.00 H new ATOM 0 HA ASN A 91 19.930 6.438 10.398 1.00 0.00 H new ATOM 0 HB2 ASN A 91 17.341 5.416 11.602 1.00 0.00 H new ATOM 0 HB3 ASN A 91 18.356 6.663 12.300 1.00 0.00 H new ATOM 0 HD21 ASN A 91 15.496 7.919 10.019 1.00 0.00 H new ATOM 0 HD22 ASN A 91 15.540 6.551 11.135 1.00 0.00 H new ATOM 1346 N TRP A 92 21.065 5.147 12.184 1.00 0.00 N ATOM 1347 CA TRP A 92 21.819 4.356 13.148 1.00 0.00 C ATOM 1348 C TRP A 92 21.714 4.947 14.548 1.00 0.00 C ATOM 1349 O TRP A 92 22.557 5.744 14.961 1.00 0.00 O ATOM 1350 CB TRP A 92 23.289 4.271 12.735 1.00 0.00 C ATOM 1351 CG TRP A 92 23.529 3.381 11.553 1.00 0.00 C ATOM 1352 CD1 TRP A 92 23.134 3.608 10.269 1.00 0.00 C ATOM 1353 CD2 TRP A 92 24.223 2.110 11.541 1.00 0.00 C ATOM 1354 NE1 TRP A 92 23.532 2.572 9.461 1.00 0.00 N ATOM 1355 CE2 TRP A 92 24.201 1.647 10.223 1.00 0.00 C ATOM 1356 CE3 TRP A 92 24.853 1.341 12.527 1.00 0.00 C ATOM 1357 CZ2 TRP A 92 24.783 0.443 9.858 1.00 0.00 C ATOM 1358 CZ3 TRP A 92 25.438 0.135 12.162 1.00 0.00 C ATOM 1359 CH2 TRP A 92 25.405 -0.302 10.861 1.00 0.00 C ATOM 0 H TRP A 92 21.435 6.084 12.028 1.00 0.00 H new ATOM 0 HA TRP A 92 21.390 3.354 13.162 1.00 0.00 H new ATOM 0 HB2 TRP A 92 23.652 5.273 12.505 1.00 0.00 H new ATOM 0 HB3 TRP A 92 23.874 3.906 13.579 1.00 0.00 H new ATOM 0 HD1 TRP A 92 22.587 4.477 9.935 1.00 0.00 H new ATOM 0 HE1 TRP A 92 23.359 2.501 8.458 1.00 0.00 H new ATOM 0 HE3 TRP A 92 24.884 1.679 13.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 24.756 0.095 8.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 25.926 -0.468 12.913 1.00 0.00 H new ATOM 0 HH2 TRP A 92 25.871 -1.243 10.608 1.00 0.00 H new ATOM 1370 N THR A 93 20.674 4.552 15.275 1.00 0.00 N ATOM 1371 CA THR A 93 20.426 5.086 16.609 1.00 0.00 C ATOM 1372 C THR A 93 20.990 4.166 17.684 1.00 0.00 C ATOM 1373 O THR A 93 20.696 2.971 17.710 1.00 0.00 O ATOM 1374 CB THR A 93 18.919 5.298 16.849 1.00 0.00 C ATOM 1375 OG1 THR A 93 18.413 6.255 15.910 1.00 0.00 O ATOM 1376 CG2 THR A 93 18.670 5.801 18.263 1.00 0.00 C ATOM 0 H THR A 93 19.989 3.864 14.963 1.00 0.00 H new ATOM 0 HA THR A 93 20.932 6.049 16.671 1.00 0.00 H new ATOM 0 HB THR A 93 18.408 4.344 16.718 1.00 0.00 H new ATOM 0 HG1 THR A 93 18.826 7.128 16.078 1.00 0.00 H new ATOM 0 HG21 THR A 93 17.600 5.945 18.415 1.00 0.00 H new ATOM 0 HG22 THR A 93 19.043 5.070 18.980 1.00 0.00 H new ATOM 0 HG23 THR A 93 19.188 6.749 18.408 1.00 0.00 H new ATOM 1384 N VAL A 94 21.803 4.731 18.571 1.00 0.00 N ATOM 1385 CA VAL A 94 22.347 3.982 19.697 1.00 0.00 C ATOM 1386 C VAL A 94 22.009 4.654 21.021 1.00 0.00 C ATOM 1387 O VAL A 94 22.064 5.878 21.139 1.00 0.00 O ATOM 1388 CB VAL A 94 23.877 3.854 19.565 1.00 0.00 C ATOM 1389 CG1 VAL A 94 24.523 5.230 19.515 1.00 0.00 C ATOM 1390 CG2 VAL A 94 24.431 3.040 20.724 1.00 0.00 C ATOM 0 H VAL A 94 22.100 5.706 18.531 1.00 0.00 H new ATOM 0 HA VAL A 94 21.895 2.990 19.684 1.00 0.00 H new ATOM 0 HB VAL A 94 24.110 3.337 18.634 1.00 0.00 H new ATOM 0 HG11 VAL A 94 25.604 5.121 19.422 1.00 0.00 H new ATOM 0 HG12 VAL A 94 24.138 5.782 18.657 1.00 0.00 H new ATOM 0 HG13 VAL A 94 24.291 5.774 20.430 1.00 0.00 H new ATOM 0 HG21 VAL A 94 25.513 2.954 20.624 1.00 0.00 H new ATOM 0 HG22 VAL A 94 24.192 3.537 21.664 1.00 0.00 H new ATOM 0 HG23 VAL A 94 23.986 2.045 20.716 1.00 0.00 H new ATOM 1400 N ALA A 95 21.660 3.847 22.017 1.00 0.00 N ATOM 1401 CA ALA A 95 21.224 4.366 23.308 1.00 0.00 C ATOM 1402 C ALA A 95 21.503 3.369 24.425 1.00 0.00 C ATOM 1403 O ALA A 95 21.638 2.170 24.181 1.00 0.00 O ATOM 1404 CB ALA A 95 19.743 4.714 23.266 1.00 0.00 C ATOM 0 H ALA A 95 21.671 2.829 21.955 1.00 0.00 H new ATOM 0 HA ALA A 95 21.793 5.272 23.516 1.00 0.00 H new ATOM 0 HB1 ALA A 95 19.432 5.100 24.237 1.00 0.00 H new ATOM 0 HB2 ALA A 95 19.569 5.471 22.502 1.00 0.00 H new ATOM 0 HB3 ALA A 95 19.166 3.820 23.029 1.00 0.00 H new ATOM 1410 N PRO A 96 21.588 3.872 25.652 1.00 0.00 N ATOM 1411 CA PRO A 96 21.793 3.020 26.817 1.00 0.00 C ATOM 1412 C PRO A 96 20.695 1.969 26.931 1.00 0.00 C ATOM 1413 O PRO A 96 19.566 2.188 26.493 1.00 0.00 O ATOM 1414 CB PRO A 96 21.747 4.013 27.983 1.00 0.00 C ATOM 1415 CG PRO A 96 22.146 5.312 27.372 1.00 0.00 C ATOM 1416 CD PRO A 96 21.521 5.290 26.003 1.00 0.00 C ATOM 0 HA PRO A 96 22.723 2.453 26.779 1.00 0.00 H new ATOM 0 HB2 PRO A 96 20.750 4.068 28.420 1.00 0.00 H new ATOM 0 HB3 PRO A 96 22.430 3.722 28.781 1.00 0.00 H new ATOM 0 HG2 PRO A 96 21.784 6.155 27.960 1.00 0.00 H new ATOM 0 HG3 PRO A 96 23.230 5.407 27.312 1.00 0.00 H new ATOM 0 HD2 PRO A 96 20.495 5.657 26.019 1.00 0.00 H new ATOM 0 HD3 PRO A 96 22.071 5.910 25.295 1.00 0.00 H new ATOM 1424 N ALA A 97 21.035 0.828 27.521 1.00 0.00 N ATOM 1425 CA ALA A 97 20.069 -0.245 27.725 1.00 0.00 C ATOM 1426 C ALA A 97 20.385 -1.038 28.987 1.00 0.00 C ATOM 1427 O ALA A 97 20.895 -2.156 28.917 1.00 0.00 O ATOM 1428 CB ALA A 97 20.039 -1.167 26.515 1.00 0.00 C ATOM 0 H ALA A 97 21.973 0.623 27.866 1.00 0.00 H new ATOM 0 HA ALA A 97 19.085 0.207 27.849 1.00 0.00 H new ATOM 0 HB1 ALA A 97 19.313 -1.963 26.682 1.00 0.00 H new ATOM 0 HB2 ALA A 97 19.755 -0.597 25.630 1.00 0.00 H new ATOM 0 HB3 ALA A 97 21.027 -1.602 26.365 1.00 0.00 H new ATOM 1434 N GLY A 98 20.080 -0.452 30.139 1.00 0.00 N ATOM 1435 CA GLY A 98 20.267 -1.130 31.417 1.00 0.00 C ATOM 1436 C GLY A 98 21.721 -1.068 31.866 1.00 0.00 C ATOM 1437 O GLY A 98 22.204 -0.020 32.294 1.00 0.00 O ATOM 0 H GLY A 98 19.702 0.492 30.215 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.630 -0.669 32.173 1.00 0.00 H new ATOM 0 HA3 GLY A 98 19.955 -2.171 31.329 1.00 0.00 H new ATOM 1441 N THR A 99 22.415 -2.197 31.764 1.00 0.00 N ATOM 1442 CA THR A 99 23.827 -2.262 32.121 1.00 0.00 C ATOM 1443 C THR A 99 24.714 -2.109 30.892 1.00 0.00 C ATOM 1444 O THR A 99 25.921 -1.899 31.007 1.00 0.00 O ATOM 1445 CB THR A 99 24.158 -3.586 32.835 1.00 0.00 C ATOM 1446 OG1 THR A 99 23.895 -4.686 31.954 1.00 0.00 O ATOM 1447 CG2 THR A 99 23.317 -3.738 34.093 1.00 0.00 C ATOM 0 H THR A 99 22.022 -3.080 31.437 1.00 0.00 H new ATOM 0 HA THR A 99 24.025 -1.434 32.802 1.00 0.00 H new ATOM 0 HB THR A 99 25.212 -3.578 33.113 1.00 0.00 H new ATOM 0 HG1 THR A 99 24.108 -5.528 32.409 1.00 0.00 H new ATOM 0 HG21 THR A 99 23.564 -4.679 34.584 1.00 0.00 H new ATOM 0 HG22 THR A 99 23.523 -2.910 34.771 1.00 0.00 H new ATOM 0 HG23 THR A 99 22.260 -3.735 33.827 1.00 0.00 H new ATOM 1455 N GLY A 100 24.107 -2.215 29.714 1.00 0.00 N ATOM 1456 CA GLY A 100 24.839 -2.083 28.460 1.00 0.00 C ATOM 1457 C GLY A 100 24.193 -1.045 27.552 1.00 0.00 C ATOM 1458 O GLY A 100 23.790 0.026 28.005 1.00 0.00 O ATOM 0 H GLY A 100 23.109 -2.392 29.602 1.00 0.00 H new ATOM 0 HA2 GLY A 100 25.871 -1.798 28.666 1.00 0.00 H new ATOM 0 HA3 GLY A 100 24.870 -3.046 27.951 1.00 0.00 H new ATOM 1462 N SER A 101 24.098 -1.369 26.267 1.00 0.00 N ATOM 1463 CA SER A 101 23.484 -0.473 25.294 1.00 0.00 C ATOM 1464 C SER A 101 22.743 -1.253 24.216 1.00 0.00 C ATOM 1465 O SER A 101 22.719 -2.484 24.234 1.00 0.00 O ATOM 1466 CB SER A 101 24.540 0.409 24.657 1.00 0.00 C ATOM 1467 OG SER A 101 25.387 -0.341 23.829 1.00 0.00 O ATOM 0 H SER A 101 24.439 -2.247 25.875 1.00 0.00 H new ATOM 0 HA SER A 101 22.762 0.150 25.821 1.00 0.00 H new ATOM 0 HB2 SER A 101 24.060 1.196 24.075 1.00 0.00 H new ATOM 0 HB3 SER A 101 25.126 0.900 25.434 1.00 0.00 H new ATOM 0 HG SER A 101 26.310 -0.264 24.150 1.00 0.00 H new ATOM 1473 N SER A 102 22.139 -0.531 23.279 1.00 0.00 N ATOM 1474 CA SER A 102 21.471 -1.154 22.143 1.00 0.00 C ATOM 1475 C SER A 102 21.520 -0.256 20.914 1.00 0.00 C ATOM 1476 O SER A 102 21.595 0.967 21.030 1.00 0.00 O ATOM 1477 CB SER A 102 20.029 -1.468 22.493 1.00 0.00 C ATOM 1478 OG SER A 102 19.282 -0.292 22.646 1.00 0.00 O ATOM 0 H SER A 102 22.098 0.488 23.284 1.00 0.00 H new ATOM 0 HA SER A 102 21.997 -2.080 21.911 1.00 0.00 H new ATOM 0 HB2 SER A 102 19.587 -2.085 21.710 1.00 0.00 H new ATOM 0 HB3 SER A 102 19.993 -2.049 23.415 1.00 0.00 H new ATOM 0 HG SER A 102 18.355 -0.520 22.870 1.00 0.00 H new ATOM 1484 N VAL A 103 21.478 -0.870 19.736 1.00 0.00 N ATOM 1485 CA VAL A 103 21.442 -0.125 18.484 1.00 0.00 C ATOM 1486 C VAL A 103 20.189 -0.454 17.683 1.00 0.00 C ATOM 1487 O VAL A 103 19.967 -1.604 17.303 1.00 0.00 O ATOM 1488 CB VAL A 103 22.688 -0.443 17.636 1.00 0.00 C ATOM 1489 CG1 VAL A 103 22.649 0.326 16.324 1.00 0.00 C ATOM 1490 CG2 VAL A 103 23.947 -0.108 18.421 1.00 0.00 C ATOM 0 H VAL A 103 21.468 -1.884 19.623 1.00 0.00 H new ATOM 0 HA VAL A 103 21.430 0.937 18.731 1.00 0.00 H new ATOM 0 HB VAL A 103 22.696 -1.508 17.403 1.00 0.00 H new ATOM 0 HG11 VAL A 103 23.537 0.090 15.737 1.00 0.00 H new ATOM 0 HG12 VAL A 103 21.758 0.044 15.763 1.00 0.00 H new ATOM 0 HG13 VAL A 103 22.625 1.396 16.530 1.00 0.00 H new ATOM 0 HG21 VAL A 103 24.824 -0.335 17.816 1.00 0.00 H new ATOM 0 HG22 VAL A 103 23.946 0.952 18.675 1.00 0.00 H new ATOM 0 HG23 VAL A 103 23.974 -0.700 19.336 1.00 0.00 H new ATOM 1500 N ASN A 104 19.371 0.562 17.430 1.00 0.00 N ATOM 1501 CA ASN A 104 18.144 0.385 16.663 1.00 0.00 C ATOM 1502 C ASN A 104 18.258 1.026 15.286 1.00 0.00 C ATOM 1503 O ASN A 104 18.302 2.250 15.162 1.00 0.00 O ATOM 1504 CB ASN A 104 16.955 0.950 17.418 1.00 0.00 C ATOM 1505 CG ASN A 104 15.651 0.701 16.713 1.00 0.00 C ATOM 1506 OD1 ASN A 104 15.626 0.167 15.597 1.00 0.00 O ATOM 1507 ND2 ASN A 104 14.566 1.077 17.341 1.00 0.00 N ATOM 0 H ASN A 104 19.536 1.518 17.746 1.00 0.00 H new ATOM 0 HA ASN A 104 17.988 -0.685 16.523 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.917 0.506 18.413 1.00 0.00 H new ATOM 0 HB3 ASN A 104 17.092 2.023 17.553 1.00 0.00 H new ATOM 0 HD21 ASN A 104 13.652 0.933 16.911 1.00 0.00 H new ATOM 0 HD22 ASN A 104 14.634 1.514 18.260 1.00 0.00 H new ATOM 1514 N LEU A 105 18.305 0.192 14.252 1.00 0.00 N ATOM 1515 CA LEU A 105 18.405 0.677 12.881 1.00 0.00 C ATOM 1516 C LEU A 105 17.026 0.912 12.278 1.00 0.00 C ATOM 1517 O LEU A 105 16.091 0.150 12.528 1.00 0.00 O ATOM 1518 CB LEU A 105 19.182 -0.326 12.019 1.00 0.00 C ATOM 1519 CG LEU A 105 20.624 -0.607 12.462 1.00 0.00 C ATOM 1520 CD1 LEU A 105 21.305 -1.503 11.437 1.00 0.00 C ATOM 1521 CD2 LEU A 105 21.371 0.708 12.622 1.00 0.00 C ATOM 0 H LEU A 105 18.275 -0.824 14.338 1.00 0.00 H new ATOM 0 HA LEU A 105 18.939 1.627 12.901 1.00 0.00 H new ATOM 0 HB2 LEU A 105 18.635 -1.268 12.008 1.00 0.00 H new ATOM 0 HB3 LEU A 105 19.202 0.043 10.994 1.00 0.00 H new ATOM 0 HG LEU A 105 20.625 -1.122 13.423 1.00 0.00 H new ATOM 0 HD11 LEU A 105 22.329 -1.703 11.752 1.00 0.00 H new ATOM 0 HD12 LEU A 105 20.760 -2.444 11.357 1.00 0.00 H new ATOM 0 HD13 LEU A 105 21.314 -1.005 10.467 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.395 0.509 12.937 1.00 0.00 H new ATOM 0 HD22 LEU A 105 21.381 1.239 11.670 1.00 0.00 H new ATOM 0 HD23 LEU A 105 20.873 1.320 13.374 1.00 0.00 H new ATOM 1533 N LYS A 106 16.905 1.970 11.483 1.00 0.00 N ATOM 1534 CA LYS A 106 15.648 2.287 10.815 1.00 0.00 C ATOM 1535 C LYS A 106 15.877 2.642 9.352 1.00 0.00 C ATOM 1536 O LYS A 106 16.441 3.690 9.038 1.00 0.00 O ATOM 1537 CB LYS A 106 14.937 3.436 11.530 1.00 0.00 C ATOM 1538 CG LYS A 106 13.603 3.832 10.912 1.00 0.00 C ATOM 1539 CD LYS A 106 12.923 4.929 11.718 1.00 0.00 C ATOM 1540 CE LYS A 106 11.600 5.341 11.089 1.00 0.00 C ATOM 1541 NZ LYS A 106 10.921 6.410 11.871 1.00 0.00 N ATOM 0 H LYS A 106 17.663 2.623 11.285 1.00 0.00 H new ATOM 0 HA LYS A 106 15.016 1.400 10.855 1.00 0.00 H new ATOM 0 HB2 LYS A 106 14.772 3.154 12.570 1.00 0.00 H new ATOM 0 HB3 LYS A 106 15.594 4.306 11.536 1.00 0.00 H new ATOM 0 HG2 LYS A 106 13.761 4.174 9.889 1.00 0.00 H new ATOM 0 HG3 LYS A 106 12.951 2.960 10.859 1.00 0.00 H new ATOM 0 HD2 LYS A 106 12.751 4.581 12.736 1.00 0.00 H new ATOM 0 HD3 LYS A 106 13.581 5.795 11.784 1.00 0.00 H new ATOM 0 HE2 LYS A 106 11.775 5.691 10.072 1.00 0.00 H new ATOM 0 HE3 LYS A 106 10.946 4.472 11.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 10.024 6.662 11.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 10.730 6.067 12.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 11.534 7.249 11.917 1.00 0.00 H new ATOM 1555 N THR A 107 15.435 1.762 8.459 1.00 0.00 N ATOM 1556 CA THR A 107 15.555 2.000 7.025 1.00 0.00 C ATOM 1557 C THR A 107 14.193 2.259 6.395 1.00 0.00 C ATOM 1558 O THR A 107 13.262 1.471 6.558 1.00 0.00 O ATOM 1559 CB THR A 107 16.233 0.810 6.321 1.00 0.00 C ATOM 1560 OG1 THR A 107 17.558 0.635 6.840 1.00 0.00 O ATOM 1561 CG2 THR A 107 16.307 1.050 4.821 1.00 0.00 C ATOM 0 H THR A 107 14.990 0.877 8.703 1.00 0.00 H new ATOM 0 HA THR A 107 16.176 2.886 6.895 1.00 0.00 H new ATOM 0 HB THR A 107 15.642 -0.087 6.506 1.00 0.00 H new ATOM 0 HG1 THR A 107 18.164 1.277 6.414 1.00 0.00 H new ATOM 0 HG21 THR A 107 16.789 0.199 4.340 1.00 0.00 H new ATOM 0 HG22 THR A 107 15.300 1.170 4.422 1.00 0.00 H new ATOM 0 HG23 THR A 107 16.885 1.953 4.625 1.00 0.00 H new ATOM 1569 N THR A 108 14.083 3.369 5.673 1.00 0.00 N ATOM 1570 CA THR A 108 12.819 3.766 5.064 1.00 0.00 C ATOM 1571 C THR A 108 13.032 4.316 3.660 1.00 0.00 C ATOM 1572 O THR A 108 14.076 4.896 3.362 1.00 0.00 O ATOM 1573 CB THR A 108 12.093 4.815 5.927 1.00 0.00 C ATOM 1574 OG1 THR A 108 10.794 5.071 5.379 1.00 0.00 O ATOM 1575 CG2 THR A 108 12.887 6.112 5.969 1.00 0.00 C ATOM 0 H THR A 108 14.856 4.011 5.495 1.00 0.00 H new ATOM 0 HA THR A 108 12.198 2.873 4.999 1.00 0.00 H new ATOM 0 HB THR A 108 11.997 4.427 6.941 1.00 0.00 H new ATOM 0 HG1 THR A 108 10.332 5.737 5.930 1.00 0.00 H new ATOM 0 HG21 THR A 108 12.359 6.842 6.583 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.872 5.922 6.396 1.00 0.00 H new ATOM 0 HG23 THR A 108 13.000 6.503 4.958 1.00 0.00 H new ATOM 1818 N PRO A 125 11.159 -5.359 2.820 1.00 0.00 N ATOM 1819 CA PRO A 125 11.615 -4.856 4.111 1.00 0.00 C ATOM 1820 C PRO A 125 12.330 -5.943 4.904 1.00 0.00 C ATOM 1821 O PRO A 125 13.287 -5.668 5.627 1.00 0.00 O ATOM 1822 CB PRO A 125 10.313 -4.424 4.792 1.00 0.00 C ATOM 1823 CG PRO A 125 9.411 -4.063 3.661 1.00 0.00 C ATOM 1824 CD PRO A 125 9.724 -5.079 2.595 1.00 0.00 C ATOM 0 HA PRO A 125 12.339 -4.046 4.027 1.00 0.00 H new ATOM 0 HB2 PRO A 125 9.893 -5.229 5.395 1.00 0.00 H new ATOM 0 HB3 PRO A 125 10.474 -3.577 5.459 1.00 0.00 H new ATOM 0 HG2 PRO A 125 8.363 -4.108 3.958 1.00 0.00 H new ATOM 0 HG3 PRO A 125 9.599 -3.048 3.311 1.00 0.00 H new ATOM 0 HD2 PRO A 125 9.115 -5.977 2.701 1.00 0.00 H new ATOM 0 HD3 PRO A 125 9.541 -4.686 1.595 1.00 0.00 H new ATOM 1832 N LEU A 126 11.859 -7.177 4.763 1.00 0.00 N ATOM 1833 CA LEU A 126 12.418 -8.299 5.508 1.00 0.00 C ATOM 1834 C LEU A 126 13.850 -8.588 5.078 1.00 0.00 C ATOM 1835 O LEU A 126 14.693 -8.956 5.896 1.00 0.00 O ATOM 1836 CB LEU A 126 11.555 -9.551 5.307 1.00 0.00 C ATOM 1837 CG LEU A 126 10.152 -9.499 5.924 1.00 0.00 C ATOM 1838 CD1 LEU A 126 9.369 -10.739 5.514 1.00 0.00 C ATOM 1839 CD2 LEU A 126 10.266 -9.400 7.438 1.00 0.00 C ATOM 0 H LEU A 126 11.091 -7.426 4.139 1.00 0.00 H new ATOM 0 HA LEU A 126 12.424 -8.029 6.564 1.00 0.00 H new ATOM 0 HB2 LEU A 126 11.455 -9.732 4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 126 12.085 -10.406 5.727 1.00 0.00 H new ATOM 0 HG LEU A 126 9.618 -8.620 5.561 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.372 -10.701 5.953 1.00 0.00 H new ATOM 0 HD12 LEU A 126 9.286 -10.774 4.428 1.00 0.00 H new ATOM 0 HD13 LEU A 126 9.888 -11.630 5.868 1.00 0.00 H new ATOM 0 HD21 LEU A 126 9.269 -9.363 7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 126 10.798 -10.271 7.820 1.00 0.00 H new ATOM 0 HD23 LEU A 126 10.813 -8.495 7.703 1.00 0.00 H new ATOM 1851 N GLY A 127 14.121 -8.419 3.788 1.00 0.00 N ATOM 1852 CA GLY A 127 15.466 -8.603 3.256 1.00 0.00 C ATOM 1853 C GLY A 127 16.428 -7.565 3.820 1.00 0.00 C ATOM 1854 O GLY A 127 17.552 -7.890 4.203 1.00 0.00 O ATOM 0 H GLY A 127 13.425 -8.154 3.091 1.00 0.00 H new ATOM 0 HA2 GLY A 127 15.823 -9.604 3.500 1.00 0.00 H new ATOM 0 HA3 GLY A 127 15.443 -8.529 2.169 1.00 0.00 H new ATOM 1858 N LEU A 128 15.980 -6.315 3.870 1.00 0.00 N ATOM 1859 CA LEU A 128 16.779 -5.237 4.439 1.00 0.00 C ATOM 1860 C LEU A 128 16.941 -5.407 5.944 1.00 0.00 C ATOM 1861 O LEU A 128 17.987 -5.082 6.506 1.00 0.00 O ATOM 1862 CB LEU A 128 16.129 -3.880 4.139 1.00 0.00 C ATOM 1863 CG LEU A 128 16.161 -3.438 2.670 1.00 0.00 C ATOM 1864 CD1 LEU A 128 15.305 -2.190 2.496 1.00 0.00 C ATOM 1865 CD2 LEU A 128 17.599 -3.178 2.249 1.00 0.00 C ATOM 0 H LEU A 128 15.066 -6.024 3.523 1.00 0.00 H new ATOM 0 HA LEU A 128 17.767 -5.275 3.980 1.00 0.00 H new ATOM 0 HB2 LEU A 128 15.090 -3.915 4.466 1.00 0.00 H new ATOM 0 HB3 LEU A 128 16.627 -3.119 4.739 1.00 0.00 H new ATOM 0 HG LEU A 128 15.754 -4.225 2.035 1.00 0.00 H new ATOM 0 HD11 LEU A 128 15.328 -1.876 1.452 1.00 0.00 H new ATOM 0 HD12 LEU A 128 14.278 -2.410 2.787 1.00 0.00 H new ATOM 0 HD13 LEU A 128 15.696 -1.390 3.124 1.00 0.00 H new ATOM 0 HD21 LEU A 128 17.621 -2.864 1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 128 18.025 -2.393 2.874 1.00 0.00 H new ATOM 0 HD23 LEU A 128 18.183 -4.091 2.366 1.00 0.00 H new ATOM 1877 N ARG A 129 15.900 -5.918 6.593 1.00 0.00 N ATOM 1878 CA ARG A 129 15.957 -6.217 8.018 1.00 0.00 C ATOM 1879 C ARG A 129 17.061 -7.220 8.328 1.00 0.00 C ATOM 1880 O ARG A 129 17.817 -7.050 9.284 1.00 0.00 O ATOM 1881 CB ARG A 129 14.624 -6.769 8.503 1.00 0.00 C ATOM 1882 CG ARG A 129 14.554 -7.053 9.995 1.00 0.00 C ATOM 1883 CD ARG A 129 13.299 -7.758 10.362 1.00 0.00 C ATOM 1884 NE ARG A 129 13.210 -9.068 9.739 1.00 0.00 N ATOM 1885 CZ ARG A 129 13.886 -10.159 10.151 1.00 0.00 C ATOM 1886 NH1 ARG A 129 14.693 -10.080 11.186 1.00 0.00 N ATOM 1887 NH2 ARG A 129 13.736 -11.308 9.516 1.00 0.00 N ATOM 0 H ARG A 129 15.005 -6.134 6.153 1.00 0.00 H new ATOM 0 HA ARG A 129 16.174 -5.285 8.539 1.00 0.00 H new ATOM 0 HB2 ARG A 129 13.838 -6.059 8.246 1.00 0.00 H new ATOM 0 HB3 ARG A 129 14.410 -7.691 7.962 1.00 0.00 H new ATOM 0 HG2 ARG A 129 15.411 -7.658 10.291 1.00 0.00 H new ATOM 0 HG3 ARG A 129 14.620 -6.116 10.547 1.00 0.00 H new ATOM 0 HD2 ARG A 129 13.248 -7.867 11.445 1.00 0.00 H new ATOM 0 HD3 ARG A 129 12.443 -7.154 10.062 1.00 0.00 H new ATOM 0 HE ARG A 129 12.593 -9.169 8.933 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.807 -9.193 11.677 1.00 0.00 H new ATOM 0 HH12 ARG A 129 15.205 -10.905 11.498 1.00 0.00 H new ATOM 0 HH21 ARG A 129 13.109 -11.369 8.714 1.00 0.00 H new ATOM 0 HH22 ARG A 129 14.248 -12.134 9.828 1.00 0.00 H new ATOM 1901 N ARG A 130 17.148 -8.265 7.513 1.00 0.00 N ATOM 1902 CA ARG A 130 18.219 -9.247 7.638 1.00 0.00 C ATOM 1903 C ARG A 130 19.587 -8.583 7.557 1.00 0.00 C ATOM 1904 O ARG A 130 20.474 -8.867 8.363 1.00 0.00 O ATOM 1905 CB ARG A 130 18.106 -10.304 6.550 1.00 0.00 C ATOM 1906 CG ARG A 130 19.201 -11.360 6.567 1.00 0.00 C ATOM 1907 CD ARG A 130 18.994 -12.383 5.511 1.00 0.00 C ATOM 1908 NE ARG A 130 19.032 -11.802 4.178 1.00 0.00 N ATOM 1909 CZ ARG A 130 20.161 -11.506 3.505 1.00 0.00 C ATOM 1910 NH1 ARG A 130 21.333 -11.742 4.051 1.00 0.00 N ATOM 1911 NH2 ARG A 130 20.090 -10.979 2.295 1.00 0.00 N ATOM 0 H ARG A 130 16.489 -8.454 6.758 1.00 0.00 H new ATOM 0 HA ARG A 130 18.116 -9.721 8.614 1.00 0.00 H new ATOM 0 HB2 ARG A 130 17.141 -10.801 6.645 1.00 0.00 H new ATOM 0 HB3 ARG A 130 18.115 -9.808 5.579 1.00 0.00 H new ATOM 0 HG2 ARG A 130 20.170 -10.882 6.425 1.00 0.00 H new ATOM 0 HG3 ARG A 130 19.224 -11.844 7.543 1.00 0.00 H new ATOM 0 HD2 ARG A 130 19.763 -13.151 5.594 1.00 0.00 H new ATOM 0 HD3 ARG A 130 18.034 -12.875 5.665 1.00 0.00 H new ATOM 0 HE ARG A 130 18.142 -11.605 3.721 1.00 0.00 H new ATOM 0 HH11 ARG A 130 21.388 -12.149 4.984 1.00 0.00 H new ATOM 0 HH12 ARG A 130 22.188 -11.518 3.541 1.00 0.00 H new ATOM 0 HH21 ARG A 130 19.181 -10.796 1.871 1.00 0.00 H new ATOM 0 HH22 ARG A 130 20.945 -10.755 1.785 1.00 0.00 H new ATOM 1925 N ILE A 131 19.753 -7.698 6.580 1.00 0.00 N ATOM 1926 CA ILE A 131 20.999 -6.958 6.421 1.00 0.00 C ATOM 1927 C ILE A 131 21.314 -6.136 7.664 1.00 0.00 C ATOM 1928 O ILE A 131 22.460 -6.083 8.111 1.00 0.00 O ATOM 1929 CB ILE A 131 20.933 -6.030 5.194 1.00 0.00 C ATOM 1930 CG1 ILE A 131 20.900 -6.852 3.903 1.00 0.00 C ATOM 1931 CG2 ILE A 131 22.114 -5.071 5.188 1.00 0.00 C ATOM 1932 CD1 ILE A 131 20.553 -6.045 2.673 1.00 0.00 C ATOM 0 H ILE A 131 19.039 -7.476 5.886 1.00 0.00 H new ATOM 0 HA ILE A 131 21.794 -7.689 6.273 1.00 0.00 H new ATOM 0 HB ILE A 131 20.016 -5.444 5.252 1.00 0.00 H new ATOM 0 HG12 ILE A 131 21.874 -7.319 3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 131 20.174 -7.657 4.015 1.00 0.00 H new ATOM 0 HG21 ILE A 131 22.052 -4.423 4.314 1.00 0.00 H new ATOM 0 HG22 ILE A 131 22.094 -4.464 6.093 1.00 0.00 H new ATOM 0 HG23 ILE A 131 23.044 -5.639 5.153 1.00 0.00 H new ATOM 0 HD11 ILE A 131 20.550 -6.697 1.799 1.00 0.00 H new ATOM 0 HD12 ILE A 131 19.566 -5.599 2.797 1.00 0.00 H new ATOM 0 HD13 ILE A 131 21.293 -5.256 2.535 1.00 0.00 H new ATOM 1944 N GLN A 132 20.291 -5.495 8.219 1.00 0.00 N ATOM 1945 CA GLN A 132 20.439 -4.745 9.460 1.00 0.00 C ATOM 1946 C GLN A 132 20.990 -5.626 10.574 1.00 0.00 C ATOM 1947 O GLN A 132 21.943 -5.254 11.259 1.00 0.00 O ATOM 1948 CB GLN A 132 19.097 -4.143 9.886 1.00 0.00 C ATOM 1949 CG GLN A 132 18.622 -2.998 9.007 1.00 0.00 C ATOM 1950 CD GLN A 132 17.231 -2.523 9.379 1.00 0.00 C ATOM 1951 OE1 GLN A 132 16.516 -3.183 10.138 1.00 0.00 O ATOM 1952 NE2 GLN A 132 16.837 -1.372 8.845 1.00 0.00 N ATOM 0 H GLN A 132 19.349 -5.480 7.828 1.00 0.00 H new ATOM 0 HA GLN A 132 21.149 -3.938 9.278 1.00 0.00 H new ATOM 0 HB2 GLN A 132 18.341 -4.928 9.881 1.00 0.00 H new ATOM 0 HB3 GLN A 132 19.180 -3.788 10.913 1.00 0.00 H new ATOM 0 HG2 GLN A 132 19.321 -2.166 9.089 1.00 0.00 H new ATOM 0 HG3 GLN A 132 18.628 -3.317 7.965 1.00 0.00 H new ATOM 0 HE21 GLN A 132 17.461 -0.859 8.222 1.00 0.00 H new ATOM 0 HE22 GLN A 132 15.911 -1.002 9.058 1.00 0.00 H new ATOM 1961 N ASP A 133 20.386 -6.796 10.750 1.00 0.00 N ATOM 1962 CA ASP A 133 20.781 -7.710 11.815 1.00 0.00 C ATOM 1963 C ASP A 133 22.227 -8.158 11.649 1.00 0.00 C ATOM 1964 O ASP A 133 22.977 -8.242 12.621 1.00 0.00 O ATOM 1965 CB ASP A 133 19.861 -8.933 11.841 1.00 0.00 C ATOM 1966 CG ASP A 133 18.464 -8.613 12.358 1.00 0.00 C ATOM 1967 OD1 ASP A 133 18.286 -7.557 12.917 1.00 0.00 O ATOM 1968 OD2 ASP A 133 17.589 -9.428 12.189 1.00 0.00 O ATOM 0 H ASP A 133 19.620 -7.134 10.168 1.00 0.00 H new ATOM 0 HA ASP A 133 20.692 -7.174 12.760 1.00 0.00 H new ATOM 0 HB2 ASP A 133 19.785 -9.346 10.835 1.00 0.00 H new ATOM 0 HB3 ASP A 133 20.308 -9.704 12.469 1.00 0.00 H new ATOM 1973 N GLU A 134 22.613 -8.445 10.410 1.00 0.00 N ATOM 1974 CA GLU A 134 23.930 -9.004 10.128 1.00 0.00 C ATOM 1975 C GLU A 134 25.033 -8.008 10.463 1.00 0.00 C ATOM 1976 O GLU A 134 26.032 -8.362 11.089 1.00 0.00 O ATOM 1977 CB GLU A 134 24.031 -9.417 8.658 1.00 0.00 C ATOM 1978 CG GLU A 134 23.211 -10.647 8.293 1.00 0.00 C ATOM 1979 CD GLU A 134 23.216 -10.936 6.818 1.00 0.00 C ATOM 1980 OE1 GLU A 134 23.775 -10.159 6.081 1.00 0.00 O ATOM 1981 OE2 GLU A 134 22.659 -11.935 6.427 1.00 0.00 O ATOM 0 H GLU A 134 22.032 -8.299 9.585 1.00 0.00 H new ATOM 0 HA GLU A 134 24.060 -9.885 10.757 1.00 0.00 H new ATOM 0 HB2 GLU A 134 23.708 -8.582 8.036 1.00 0.00 H new ATOM 0 HB3 GLU A 134 25.077 -9.608 8.418 1.00 0.00 H new ATOM 0 HG2 GLU A 134 23.603 -11.511 8.829 1.00 0.00 H new ATOM 0 HG3 GLU A 134 22.183 -10.505 8.627 1.00 0.00 H new ATOM 1988 N VAL A 135 24.847 -6.762 10.041 1.00 0.00 N ATOM 1989 CA VAL A 135 25.856 -5.728 10.236 1.00 0.00 C ATOM 1990 C VAL A 135 25.916 -5.284 11.692 1.00 0.00 C ATOM 1991 O VAL A 135 26.962 -4.851 12.176 1.00 0.00 O ATOM 1992 CB VAL A 135 25.553 -4.511 9.343 1.00 0.00 C ATOM 1993 CG1 VAL A 135 24.381 -3.719 9.902 1.00 0.00 C ATOM 1994 CG2 VAL A 135 26.790 -3.633 9.227 1.00 0.00 C ATOM 0 H VAL A 135 24.005 -6.444 9.561 1.00 0.00 H new ATOM 0 HA VAL A 135 26.822 -6.152 9.961 1.00 0.00 H new ATOM 0 HB VAL A 135 25.280 -4.862 8.348 1.00 0.00 H new ATOM 0 HG11 VAL A 135 24.181 -2.862 9.258 1.00 0.00 H new ATOM 0 HG12 VAL A 135 23.498 -4.356 9.943 1.00 0.00 H new ATOM 0 HG13 VAL A 135 24.624 -3.370 10.906 1.00 0.00 H new ATOM 0 HG21 VAL A 135 26.568 -2.774 8.594 1.00 0.00 H new ATOM 0 HG22 VAL A 135 27.085 -3.287 10.218 1.00 0.00 H new ATOM 0 HG23 VAL A 135 27.604 -4.208 8.786 1.00 0.00 H new ATOM 2004 N LEU A 136 24.788 -5.395 12.385 1.00 0.00 N ATOM 2005 CA LEU A 136 24.738 -5.116 13.815 1.00 0.00 C ATOM 2006 C LEU A 136 25.466 -6.191 14.613 1.00 0.00 C ATOM 2007 O LEU A 136 26.088 -5.904 15.636 1.00 0.00 O ATOM 2008 CB LEU A 136 23.281 -5.020 14.286 1.00 0.00 C ATOM 2009 CG LEU A 136 22.521 -3.764 13.843 1.00 0.00 C ATOM 2010 CD1 LEU A 136 21.060 -3.882 14.256 1.00 0.00 C ATOM 2011 CD2 LEU A 136 23.166 -2.534 14.464 1.00 0.00 C ATOM 0 H LEU A 136 23.896 -5.676 11.979 1.00 0.00 H new ATOM 0 HA LEU A 136 25.238 -4.163 13.987 1.00 0.00 H new ATOM 0 HB2 LEU A 136 22.742 -5.895 13.923 1.00 0.00 H new ATOM 0 HB3 LEU A 136 23.267 -5.066 15.375 1.00 0.00 H new ATOM 0 HG LEU A 136 22.566 -3.665 12.758 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.520 -2.989 13.941 1.00 0.00 H new ATOM 0 HD12 LEU A 136 20.618 -4.759 13.783 1.00 0.00 H new ATOM 0 HD13 LEU A 136 20.995 -3.982 15.339 1.00 0.00 H new ATOM 0 HD21 LEU A 136 22.626 -1.641 14.149 1.00 0.00 H new ATOM 0 HD22 LEU A 136 23.132 -2.614 15.550 1.00 0.00 H new ATOM 0 HD23 LEU A 136 24.204 -2.464 14.138 1.00 0.00 H new ATOM 2023 N GLU A 137 25.385 -7.429 14.138 1.00 0.00 N ATOM 2024 CA GLU A 137 26.115 -8.533 14.748 1.00 0.00 C ATOM 2025 C GLU A 137 27.620 -8.350 14.595 1.00 0.00 C ATOM 2026 O GLU A 137 28.382 -8.583 15.533 1.00 0.00 O ATOM 2027 CB GLU A 137 25.688 -9.864 14.127 1.00 0.00 C ATOM 2028 CG GLU A 137 26.351 -11.088 14.743 1.00 0.00 C ATOM 2029 CD GLU A 137 25.949 -11.313 16.174 1.00 0.00 C ATOM 2030 OE1 GLU A 137 24.932 -10.798 16.573 1.00 0.00 O ATOM 2031 OE2 GLU A 137 26.659 -12.002 16.868 1.00 0.00 O ATOM 0 H GLU A 137 24.820 -7.693 13.331 1.00 0.00 H new ATOM 0 HA GLU A 137 25.876 -8.542 15.812 1.00 0.00 H new ATOM 0 HB2 GLU A 137 24.607 -9.965 14.222 1.00 0.00 H new ATOM 0 HB3 GLU A 137 25.913 -9.842 13.061 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.093 -11.969 14.156 1.00 0.00 H new ATOM 0 HG3 GLU A 137 27.434 -10.975 14.689 1.00 0.00 H new ATOM 2038 N ASN A 138 28.041 -7.931 13.406 1.00 0.00 N ATOM 2039 CA ASN A 138 29.446 -7.636 13.152 1.00 0.00 C ATOM 2040 C ASN A 138 29.922 -6.456 13.989 1.00 0.00 C ATOM 2041 O ASN A 138 31.036 -6.464 14.514 1.00 0.00 O ATOM 2042 CB ASN A 138 29.678 -7.372 11.675 1.00 0.00 C ATOM 2043 CG ASN A 138 29.550 -8.614 10.839 1.00 0.00 C ATOM 2044 OD1 ASN A 138 29.561 -9.734 11.363 1.00 0.00 O ATOM 2045 ND2 ASN A 138 29.429 -8.439 9.547 1.00 0.00 N ATOM 0 H ASN A 138 27.429 -7.788 12.603 1.00 0.00 H new ATOM 0 HA ASN A 138 30.029 -8.509 13.443 1.00 0.00 H new ATOM 0 HB2 ASN A 138 28.962 -6.628 11.326 1.00 0.00 H new ATOM 0 HB3 ASN A 138 30.672 -6.947 11.537 1.00 0.00 H new ATOM 0 HD21 ASN A 138 29.339 -9.246 8.929 1.00 0.00 H new ATOM 0 HD22 ASN A 138 29.425 -7.496 9.158 1.00 0.00 H new ATOM 2052 N LEU A 139 29.072 -5.442 14.110 1.00 0.00 N ATOM 2053 CA LEU A 139 29.357 -4.302 14.973 1.00 0.00 C ATOM 2054 C LEU A 139 29.593 -4.744 16.411 1.00 0.00 C ATOM 2055 O LEU A 139 30.590 -4.373 17.030 1.00 0.00 O ATOM 2056 CB LEU A 139 28.199 -3.297 14.923 1.00 0.00 C ATOM 2057 CG LEU A 139 28.325 -2.091 15.863 1.00 0.00 C ATOM 2058 CD1 LEU A 139 29.553 -1.276 15.483 1.00 0.00 C ATOM 2059 CD2 LEU A 139 27.061 -1.248 15.778 1.00 0.00 C ATOM 0 H LEU A 139 28.179 -5.387 13.620 1.00 0.00 H new ATOM 0 HA LEU A 139 30.266 -3.825 14.607 1.00 0.00 H new ATOM 0 HB2 LEU A 139 28.105 -2.930 13.901 1.00 0.00 H new ATOM 0 HB3 LEU A 139 27.274 -3.824 15.159 1.00 0.00 H new ATOM 0 HG LEU A 139 28.444 -2.431 16.892 1.00 0.00 H new ATOM 0 HD11 LEU A 139 29.642 -0.419 16.151 1.00 0.00 H new ATOM 0 HD12 LEU A 139 30.444 -1.898 15.570 1.00 0.00 H new ATOM 0 HD13 LEU A 139 29.454 -0.926 14.455 1.00 0.00 H new ATOM 0 HD21 LEU A 139 27.150 -0.391 16.446 1.00 0.00 H new ATOM 0 HD22 LEU A 139 26.925 -0.898 14.755 1.00 0.00 H new ATOM 0 HD23 LEU A 139 26.202 -1.850 16.073 1.00 0.00 H new ATOM 2071 N LYS A 140 28.669 -5.540 16.939 1.00 0.00 N ATOM 2072 CA LYS A 140 28.795 -6.069 18.292 1.00 0.00 C ATOM 2073 C LYS A 140 30.127 -6.782 18.482 1.00 0.00 C ATOM 2074 O LYS A 140 30.811 -6.582 19.486 1.00 0.00 O ATOM 2075 CB LYS A 140 27.639 -7.020 18.605 1.00 0.00 C ATOM 2076 CG LYS A 140 27.662 -7.596 20.015 1.00 0.00 C ATOM 2077 CD LYS A 140 26.510 -8.564 20.236 1.00 0.00 C ATOM 2078 CE LYS A 140 26.696 -9.840 19.429 1.00 0.00 C ATOM 2079 NZ LYS A 140 25.602 -10.819 19.674 1.00 0.00 N ATOM 0 H LYS A 140 27.824 -5.833 16.450 1.00 0.00 H new ATOM 0 HA LYS A 140 28.757 -5.228 18.984 1.00 0.00 H new ATOM 0 HB2 LYS A 140 26.698 -6.490 18.458 1.00 0.00 H new ATOM 0 HB3 LYS A 140 27.657 -7.842 17.889 1.00 0.00 H new ATOM 0 HG2 LYS A 140 28.609 -8.109 20.185 1.00 0.00 H new ATOM 0 HG3 LYS A 140 27.604 -6.786 20.742 1.00 0.00 H new ATOM 0 HD2 LYS A 140 26.437 -8.809 21.296 1.00 0.00 H new ATOM 0 HD3 LYS A 140 25.572 -8.086 19.954 1.00 0.00 H new ATOM 0 HE2 LYS A 140 26.733 -9.595 18.367 1.00 0.00 H new ATOM 0 HE3 LYS A 140 27.653 -10.294 19.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 25.996 -11.680 20.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 24.900 -10.401 20.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 25.144 -11.061 18.772 1.00 0.00 H new ATOM 2093 N LYS A 141 30.491 -7.615 17.513 1.00 0.00 N ATOM 2094 CA LYS A 141 31.707 -8.413 17.605 1.00 0.00 C ATOM 2095 C LYS A 141 32.949 -7.533 17.555 1.00 0.00 C ATOM 2096 O LYS A 141 34.057 -7.990 17.835 1.00 0.00 O ATOM 2097 CB LYS A 141 31.753 -9.451 16.483 1.00 0.00 C ATOM 2098 CG LYS A 141 30.744 -10.582 16.630 1.00 0.00 C ATOM 2099 CD LYS A 141 30.839 -11.563 15.471 1.00 0.00 C ATOM 2100 CE LYS A 141 29.872 -12.724 15.645 1.00 0.00 C ATOM 2101 NZ LYS A 141 29.949 -13.688 14.515 1.00 0.00 N ATOM 0 H LYS A 141 29.960 -7.755 16.654 1.00 0.00 H new ATOM 0 HA LYS A 141 31.694 -8.930 18.565 1.00 0.00 H new ATOM 0 HB2 LYS A 141 31.580 -8.948 15.532 1.00 0.00 H new ATOM 0 HB3 LYS A 141 32.755 -9.878 16.440 1.00 0.00 H new ATOM 0 HG2 LYS A 141 30.918 -11.107 17.569 1.00 0.00 H new ATOM 0 HG3 LYS A 141 29.736 -10.169 16.678 1.00 0.00 H new ATOM 0 HD2 LYS A 141 30.624 -11.046 14.536 1.00 0.00 H new ATOM 0 HD3 LYS A 141 31.858 -11.944 15.398 1.00 0.00 H new ATOM 0 HE2 LYS A 141 30.092 -13.242 16.579 1.00 0.00 H new ATOM 0 HE3 LYS A 141 28.855 -12.340 15.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 29.274 -14.463 14.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 29.714 -13.201 13.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 30.912 -14.075 14.454 1.00 0.00 H new ATOM 2115 N HIS A 142 32.757 -6.268 17.198 1.00 0.00 N ATOM 2116 CA HIS A 142 33.858 -5.313 17.137 1.00 0.00 C ATOM 2117 C HIS A 142 33.960 -4.508 18.427 1.00 0.00 C ATOM 2118 O HIS A 142 35.021 -4.444 19.047 1.00 0.00 O ATOM 2119 CB HIS A 142 33.685 -4.363 15.948 1.00 0.00 C ATOM 2120 CG HIS A 142 34.802 -3.377 15.799 1.00 0.00 C ATOM 2121 ND1 HIS A 142 36.038 -3.724 15.294 1.00 0.00 N ATOM 2122 CD2 HIS A 142 34.870 -2.057 16.089 1.00 0.00 C ATOM 2123 CE1 HIS A 142 36.818 -2.657 15.279 1.00 0.00 C ATOM 2124 NE2 HIS A 142 36.134 -1.634 15.757 1.00 0.00 N ATOM 0 H HIS A 142 31.848 -5.879 16.946 1.00 0.00 H new ATOM 0 HA HIS A 142 34.779 -5.881 17.008 1.00 0.00 H new ATOM 0 HB2 HIS A 142 33.606 -4.950 15.033 1.00 0.00 H new ATOM 0 HB3 HIS A 142 32.746 -3.821 16.061 1.00 0.00 H new ATOM 0 HD1 HIS A 142 36.307 -4.657 14.981 1.00 0.00 H new ATOM 0 HD2 HIS A 142 34.079 -1.450 16.504 1.00 0.00 H new ATOM 0 HE1 HIS A 142 37.841 -2.627 14.934 1.00 0.00 H new ATOM 2132 N VAL A 143 32.851 -3.895 18.825 1.00 0.00 N ATOM 2133 CA VAL A 143 32.849 -2.971 19.953 1.00 0.00 C ATOM 2134 C VAL A 143 32.758 -3.718 21.277 1.00 0.00 C ATOM 2135 O VAL A 143 33.209 -3.225 22.311 1.00 0.00 O ATOM 2136 CB VAL A 143 31.668 -1.989 19.838 1.00 0.00 C ATOM 2137 CG1 VAL A 143 31.740 -1.220 18.527 1.00 0.00 C ATOM 2138 CG2 VAL A 143 30.353 -2.747 19.946 1.00 0.00 C ATOM 0 H VAL A 143 31.941 -4.021 18.383 1.00 0.00 H new ATOM 0 HA VAL A 143 33.788 -2.417 19.929 1.00 0.00 H new ATOM 0 HB VAL A 143 31.725 -1.270 20.655 1.00 0.00 H new ATOM 0 HG11 VAL A 143 30.898 -0.531 18.463 1.00 0.00 H new ATOM 0 HG12 VAL A 143 32.673 -0.658 18.486 1.00 0.00 H new ATOM 0 HG13 VAL A 143 31.701 -1.920 17.692 1.00 0.00 H new ATOM 0 HG21 VAL A 143 29.522 -2.047 19.864 1.00 0.00 H new ATOM 0 HG22 VAL A 143 30.289 -3.482 19.143 1.00 0.00 H new ATOM 0 HG23 VAL A 143 30.305 -3.256 20.908 1.00 0.00 H new ATOM 2148 N GLU A 144 32.172 -4.910 21.239 1.00 0.00 N ATOM 2149 CA GLU A 144 32.069 -5.751 22.425 1.00 0.00 C ATOM 2150 C GLU A 144 33.029 -6.931 22.349 1.00 0.00 C ATOM 2151 O GLU A 144 33.772 -7.203 23.292 1.00 0.00 O ATOM 2152 CB GLU A 144 30.636 -6.257 22.598 1.00 0.00 C ATOM 2153 CG GLU A 144 30.437 -7.191 23.783 1.00 0.00 C ATOM 2154 CD GLU A 144 29.006 -7.617 23.959 1.00 0.00 C ATOM 2155 OE1 GLU A 144 28.155 -7.056 23.311 1.00 0.00 O ATOM 2156 OE2 GLU A 144 28.763 -8.505 24.741 1.00 0.00 O ATOM 0 H GLU A 144 31.761 -5.316 20.398 1.00 0.00 H new ATOM 0 HA GLU A 144 32.340 -5.143 23.288 1.00 0.00 H new ATOM 0 HB2 GLU A 144 29.972 -5.400 22.711 1.00 0.00 H new ATOM 0 HB3 GLU A 144 30.334 -6.775 21.688 1.00 0.00 H new ATOM 0 HG2 GLU A 144 31.060 -8.075 23.651 1.00 0.00 H new ATOM 0 HG3 GLU A 144 30.777 -6.694 24.692 1.00 0.00 H new ATOM 2163 N GLY A 145 33.010 -7.631 21.219 1.00 0.00 N ATOM 2164 CA GLY A 145 33.874 -8.787 21.019 1.00 0.00 C ATOM 2165 C GLY A 145 33.060 -10.068 20.891 1.00 0.00 C ATOM 2166 O GLY A 145 32.534 -10.343 19.848 1.00 0.00 O ATOM 2167 OXT GLY A 145 32.946 -10.803 21.833 1.00 0.00 O ATOM 0 H GLY A 145 32.404 -7.416 20.427 1.00 0.00 H new ATOM 0 HA2 GLY A 145 34.475 -8.644 20.121 1.00 0.00 H new ATOM 0 HA3 GLY A 145 34.567 -8.875 21.856 1.00 0.00 H new