USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 884 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 79 LYS NZ :NH3+ 176:sc= 0.0597 (180deg=0) USER MOD Set 1.2: A 94 SER OG : rot 180:sc= 0.0582 USER MOD Set 1.3: A 120 HIS : no HE2:sc= -1.86 K(o=-1.7,f=-7!) USER MOD Set 2.1: A 67 MET CE :methyl 158:sc= -0.615 (180deg=-1.04) USER MOD Set 2.2: A 90 SER OG : rot -150:sc= 0 USER MOD Set 3.1: A 72 GLN : amide:sc= 0.603 K(o=1.1,f=0.49) USER MOD Set 3.2: A 81 THR OG1 : rot -130:sc= 0.448 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.596 K(o=-0.6,f=-1.4) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0295 USER MOD Single : A 45 TYR OH : rot 29:sc= 1.27 USER MOD Single : A 47 LYS NZ :NH3+ -131:sc= 2.13 (180deg=-0.455) USER MOD Single : A 50 THR OG1 : rot -44:sc= 0.217 USER MOD Single : A 51 GLN : amide:sc= -0.753 X(o=-0.75,f=-0.54) USER MOD Single : A 52 GLN : amide:sc= -0.1 X(o=-0.1,f=0) USER MOD Single : A 53 MET CE :methyl 173:sc= -0.147 (180deg=-0.21) USER MOD Single : A 58 GLN : amide:sc=-0.00224 K(o=-0.0022,f=-0.75) USER MOD Single : A 65 MET CE :methyl -151:sc= -0.464 (180deg=-1.69!) USER MOD Single : A 70 SER OG : rot -80:sc= 1.52 USER MOD Single : A 76 ASN : amide:sc= 0.58 K(o=0.58,f=-0.013) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 99:sc= 0.51 USER MOD Single : A 95 TYR OH : rot 180:sc= -0.0715 USER MOD Single : A 107 GLN : amide:sc= 0.262 K(o=0.26,f=-0.61) USER MOD Single : A 112 GLN : amide:sc= -0.0725 X(o=-0.072,f=-0.07) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 148:sc= 0.256 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 HIS :FLIP no HD1:sc= -2.09! C(o=-3.1!,f=-2.1!) USER MOD Single : A 133 ASN : amide:sc= 0.391 K(o=0.39,f=-3.4!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -92:sc= 0.269 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 30 1.638 -25.280 -3.392 1.00 0.00 N ATOM 2 CA LEU A 30 2.547 -24.403 -4.151 1.00 0.00 C ATOM 3 C LEU A 30 3.646 -23.923 -3.216 1.00 0.00 C ATOM 4 O LEU A 30 3.408 -23.788 -2.011 1.00 0.00 O ATOM 5 CB LEU A 30 1.774 -23.221 -4.758 1.00 0.00 C ATOM 6 CG LEU A 30 2.564 -22.314 -5.721 1.00 0.00 C ATOM 7 CD1 LEU A 30 3.124 -23.063 -6.937 1.00 0.00 C ATOM 8 CD2 LEU A 30 1.643 -21.186 -6.201 1.00 0.00 C ATOM 0 HA LEU A 30 2.994 -24.954 -4.979 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.909 -23.615 -5.291 1.00 0.00 H new ATOM 0 HB3 LEU A 30 1.393 -22.606 -3.943 1.00 0.00 H new ATOM 0 HG LEU A 30 3.420 -21.924 -5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.669 -22.366 -7.574 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.798 -23.850 -6.600 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.303 -23.505 -7.502 1.00 0.00 H new ATOM 0 HD21 LEU A 30 2.190 -20.536 -6.884 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.783 -21.613 -6.717 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.301 -20.606 -5.344 1.00 0.00 H new ATOM 20 N ARG A 31 4.852 -23.670 -3.743 1.00 0.00 N ATOM 21 CA ARG A 31 5.894 -22.997 -2.969 1.00 0.00 C ATOM 22 C ARG A 31 5.350 -21.656 -2.475 1.00 0.00 C ATOM 23 O ARG A 31 4.580 -21.021 -3.188 1.00 0.00 O ATOM 24 CB ARG A 31 7.147 -22.763 -3.837 1.00 0.00 C ATOM 25 CG ARG A 31 8.442 -23.035 -3.051 1.00 0.00 C ATOM 26 CD ARG A 31 9.166 -24.304 -3.519 1.00 0.00 C ATOM 27 NE ARG A 31 8.300 -25.493 -3.624 1.00 0.00 N ATOM 28 CZ ARG A 31 8.718 -26.732 -3.918 1.00 0.00 C ATOM 29 NH1 ARG A 31 10.013 -26.986 -4.087 1.00 0.00 N ATOM 30 NH2 ARG A 31 7.827 -27.709 -4.028 1.00 0.00 N ATOM 0 H ARG A 31 5.125 -23.920 -4.694 1.00 0.00 H new ATOM 0 HA ARG A 31 6.176 -23.623 -2.122 1.00 0.00 H new ATOM 0 HB2 ARG A 31 7.110 -23.411 -4.713 1.00 0.00 H new ATOM 0 HB3 ARG A 31 7.151 -21.736 -4.201 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.111 -22.181 -3.155 1.00 0.00 H new ATOM 0 HG3 ARG A 31 8.206 -23.127 -1.991 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.619 -24.112 -4.492 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.979 -24.521 -2.826 1.00 0.00 H new ATOM 0 HE ARG A 31 7.302 -25.362 -3.460 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.697 -26.235 -3.993 1.00 0.00 H new ATOM 0 HH12 ARG A 31 10.322 -27.932 -4.311 1.00 0.00 H new ATOM 0 HH21 ARG A 31 6.836 -27.513 -3.889 1.00 0.00 H new ATOM 0 HH22 ARG A 31 8.133 -28.656 -4.251 1.00 0.00 H new ATOM 44 N SER A 32 5.767 -21.203 -1.300 1.00 0.00 N ATOM 45 CA SER A 32 5.415 -19.886 -0.805 1.00 0.00 C ATOM 46 C SER A 32 6.599 -19.434 0.042 1.00 0.00 C ATOM 47 O SER A 32 7.131 -20.222 0.828 1.00 0.00 O ATOM 48 CB SER A 32 4.088 -19.985 -0.038 1.00 0.00 C ATOM 49 OG SER A 32 3.569 -18.707 0.264 1.00 0.00 O ATOM 0 H SER A 32 6.358 -21.741 -0.666 1.00 0.00 H new ATOM 0 HA SER A 32 5.245 -19.146 -1.587 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.364 -20.542 -0.632 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.241 -20.544 0.885 1.00 0.00 H new ATOM 0 HG SER A 32 2.724 -18.804 0.750 1.00 0.00 H new ATOM 55 N ASN A 33 7.050 -18.199 -0.155 1.00 0.00 N ATOM 56 CA ASN A 33 8.210 -17.617 0.519 1.00 0.00 C ATOM 57 C ASN A 33 8.188 -16.105 0.390 1.00 0.00 C ATOM 58 O ASN A 33 8.442 -15.400 1.367 1.00 0.00 O ATOM 59 CB ASN A 33 9.548 -18.124 -0.058 1.00 0.00 C ATOM 60 CG ASN A 33 9.763 -17.875 -1.549 1.00 0.00 C ATOM 61 OD1 ASN A 33 8.927 -18.221 -2.377 1.00 0.00 O ATOM 62 ND2 ASN A 33 10.862 -17.254 -1.930 1.00 0.00 N ATOM 0 H ASN A 33 6.606 -17.554 -0.808 1.00 0.00 H new ATOM 0 HA ASN A 33 8.142 -17.923 1.563 1.00 0.00 H new ATOM 0 HB2 ASN A 33 10.362 -17.651 0.492 1.00 0.00 H new ATOM 0 HB3 ASN A 33 9.619 -19.196 0.127 1.00 0.00 H new ATOM 0 HD21 ASN A 33 11.021 -17.059 -2.918 1.00 0.00 H new ATOM 0 HD22 ASN A 33 11.553 -16.969 -1.236 1.00 0.00 H new ATOM 69 N ILE A 34 7.912 -15.626 -0.822 1.00 0.00 N ATOM 70 CA ILE A 34 7.860 -14.218 -1.152 1.00 0.00 C ATOM 71 C ILE A 34 6.743 -13.559 -0.334 1.00 0.00 C ATOM 72 O ILE A 34 5.766 -14.191 0.090 1.00 0.00 O ATOM 73 CB ILE A 34 7.714 -14.095 -2.689 1.00 0.00 C ATOM 74 CG1 ILE A 34 9.059 -14.425 -3.377 1.00 0.00 C ATOM 75 CG2 ILE A 34 7.231 -12.732 -3.186 1.00 0.00 C ATOM 76 CD1 ILE A 34 8.953 -14.785 -4.863 1.00 0.00 C ATOM 0 H ILE A 34 7.714 -16.231 -1.619 1.00 0.00 H new ATOM 0 HA ILE A 34 8.770 -13.681 -0.885 1.00 0.00 H new ATOM 0 HB ILE A 34 6.938 -14.812 -2.955 1.00 0.00 H new ATOM 0 HG12 ILE A 34 9.724 -13.568 -3.272 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.526 -15.257 -2.849 1.00 0.00 H new ATOM 0 HG21 ILE A 34 7.161 -12.745 -4.274 1.00 0.00 H new ATOM 0 HG22 ILE A 34 6.250 -12.517 -2.762 1.00 0.00 H new ATOM 0 HG23 ILE A 34 7.937 -11.961 -2.877 1.00 0.00 H new ATOM 0 HD11 ILE A 34 9.946 -15.000 -5.257 1.00 0.00 H new ATOM 0 HD12 ILE A 34 8.318 -15.663 -4.980 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.519 -13.948 -5.410 1.00 0.00 H new ATOM 88 N ASP A 35 6.905 -12.257 -0.150 1.00 0.00 N ATOM 89 CA ASP A 35 6.014 -11.368 0.591 1.00 0.00 C ATOM 90 C ASP A 35 4.639 -11.338 -0.064 1.00 0.00 C ATOM 91 O ASP A 35 4.517 -11.474 -1.287 1.00 0.00 O ATOM 92 CB ASP A 35 6.593 -9.955 0.625 1.00 0.00 C ATOM 93 CG ASP A 35 7.698 -9.831 1.670 1.00 0.00 C ATOM 94 OD1 ASP A 35 7.376 -9.816 2.884 1.00 0.00 O ATOM 95 OD2 ASP A 35 8.874 -9.699 1.249 1.00 0.00 O ATOM 0 H ASP A 35 7.708 -11.761 -0.536 1.00 0.00 H new ATOM 0 HA ASP A 35 5.918 -11.742 1.610 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.989 -9.699 -0.358 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.800 -9.240 0.845 1.00 0.00 H new ATOM 100 N LEU A 36 3.577 -11.161 0.713 1.00 0.00 N ATOM 101 CA LEU A 36 2.215 -11.127 0.208 1.00 0.00 C ATOM 102 C LEU A 36 1.892 -9.738 -0.348 1.00 0.00 C ATOM 103 O LEU A 36 2.761 -8.877 -0.529 1.00 0.00 O ATOM 104 CB LEU A 36 1.230 -11.658 1.272 1.00 0.00 C ATOM 105 CG LEU A 36 1.381 -11.051 2.671 1.00 0.00 C ATOM 106 CD1 LEU A 36 1.209 -9.528 2.709 1.00 0.00 C ATOM 107 CD2 LEU A 36 0.395 -11.742 3.609 1.00 0.00 C ATOM 0 H LEU A 36 3.641 -11.036 1.723 1.00 0.00 H new ATOM 0 HA LEU A 36 2.104 -11.806 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.213 -11.476 0.924 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.352 -12.738 1.348 1.00 0.00 H new ATOM 0 HG LEU A 36 2.406 -11.224 2.998 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.330 -9.174 3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.960 -9.061 2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.214 -9.265 2.349 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.489 -11.321 4.610 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.621 -11.589 3.246 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.612 -12.810 3.642 1.00 0.00 H new ATOM 119 N PHE A 37 0.629 -9.581 -0.722 1.00 0.00 N ATOM 120 CA PHE A 37 0.033 -8.454 -1.414 1.00 0.00 C ATOM 121 C PHE A 37 -1.487 -8.657 -1.324 1.00 0.00 C ATOM 122 O PHE A 37 -1.945 -9.798 -1.186 1.00 0.00 O ATOM 123 CB PHE A 37 0.502 -8.491 -2.875 1.00 0.00 C ATOM 124 CG PHE A 37 0.308 -7.209 -3.652 1.00 0.00 C ATOM 125 CD1 PHE A 37 -0.886 -6.986 -4.362 1.00 0.00 C ATOM 126 CD2 PHE A 37 1.350 -6.262 -3.720 1.00 0.00 C ATOM 127 CE1 PHE A 37 -1.037 -5.826 -5.138 1.00 0.00 C ATOM 128 CE2 PHE A 37 1.203 -5.112 -4.506 1.00 0.00 C ATOM 129 CZ PHE A 37 0.017 -4.903 -5.222 1.00 0.00 C ATOM 0 H PHE A 37 -0.063 -10.306 -0.530 1.00 0.00 H new ATOM 0 HA PHE A 37 0.314 -7.492 -0.985 1.00 0.00 H new ATOM 0 HB2 PHE A 37 1.561 -8.749 -2.892 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -0.030 -9.291 -3.389 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.687 -7.708 -4.310 1.00 0.00 H new ATOM 0 HD2 PHE A 37 2.263 -6.423 -3.165 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -1.960 -5.645 -5.668 1.00 0.00 H new ATOM 0 HE2 PHE A 37 2.002 -4.388 -4.560 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.087 -4.025 -5.843 1.00 0.00 H new ATOM 139 N TYR A 38 -2.255 -7.575 -1.402 1.00 0.00 N ATOM 140 CA TYR A 38 -3.713 -7.530 -1.404 1.00 0.00 C ATOM 141 C TYR A 38 -4.178 -6.451 -2.384 1.00 0.00 C ATOM 142 O TYR A 38 -3.367 -5.664 -2.874 1.00 0.00 O ATOM 143 CB TYR A 38 -4.217 -7.189 0.004 1.00 0.00 C ATOM 144 CG TYR A 38 -4.034 -8.282 1.029 1.00 0.00 C ATOM 145 CD1 TYR A 38 -2.791 -8.448 1.668 1.00 0.00 C ATOM 146 CD2 TYR A 38 -5.094 -9.161 1.312 1.00 0.00 C ATOM 147 CE1 TYR A 38 -2.573 -9.531 2.535 1.00 0.00 C ATOM 148 CE2 TYR A 38 -4.888 -10.207 2.212 1.00 0.00 C ATOM 149 CZ TYR A 38 -3.632 -10.425 2.804 1.00 0.00 C ATOM 150 OH TYR A 38 -3.482 -11.560 3.531 1.00 0.00 O ATOM 0 H TYR A 38 -1.847 -6.643 -1.470 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.110 -8.499 -1.705 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -3.700 -6.295 0.352 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -5.277 -6.941 -0.056 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.998 -7.737 1.490 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -6.056 -9.028 0.839 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -1.605 -9.678 2.991 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -5.710 -10.862 2.459 1.00 0.00 H new ATOM 0 HH TYR A 38 -4.342 -12.025 3.592 1.00 0.00 H new ATOM 160 N THR A 39 -5.484 -6.346 -2.622 1.00 0.00 N ATOM 161 CA THR A 39 -6.094 -5.232 -3.334 1.00 0.00 C ATOM 162 C THR A 39 -7.349 -4.767 -2.584 1.00 0.00 C ATOM 163 O THR A 39 -7.823 -5.511 -1.716 1.00 0.00 O ATOM 164 CB THR A 39 -6.366 -5.647 -4.801 1.00 0.00 C ATOM 165 OG1 THR A 39 -7.292 -6.717 -4.845 1.00 0.00 O ATOM 166 CG2 THR A 39 -5.107 -6.086 -5.557 1.00 0.00 C ATOM 0 H THR A 39 -6.158 -7.048 -2.318 1.00 0.00 H new ATOM 0 HA THR A 39 -5.420 -4.376 -3.370 1.00 0.00 H new ATOM 0 HB THR A 39 -6.761 -4.755 -5.288 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.457 -6.969 -5.778 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.373 -6.362 -6.577 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.391 -5.265 -5.579 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.661 -6.944 -5.054 1.00 0.00 H new ATOM 174 N PRO A 40 -7.894 -3.565 -2.864 1.00 0.00 N ATOM 175 CA PRO A 40 -9.151 -3.094 -2.293 1.00 0.00 C ATOM 176 C PRO A 40 -10.326 -3.867 -2.912 1.00 0.00 C ATOM 177 O PRO A 40 -11.088 -3.382 -3.744 1.00 0.00 O ATOM 178 CB PRO A 40 -9.191 -1.596 -2.569 1.00 0.00 C ATOM 179 CG PRO A 40 -8.395 -1.447 -3.852 1.00 0.00 C ATOM 180 CD PRO A 40 -7.331 -2.529 -3.720 1.00 0.00 C ATOM 0 HA PRO A 40 -9.229 -3.267 -1.220 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -10.214 -1.238 -2.688 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -8.746 -1.026 -1.753 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -9.018 -1.598 -4.734 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.953 -0.455 -3.940 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.068 -2.935 -4.697 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.417 -2.123 -3.287 1.00 0.00 H new ATOM 188 N GLY A 41 -10.428 -5.115 -2.493 1.00 0.00 N ATOM 189 CA GLY A 41 -11.264 -6.140 -3.053 1.00 0.00 C ATOM 190 C GLY A 41 -10.952 -7.383 -2.257 1.00 0.00 C ATOM 191 O GLY A 41 -11.786 -7.797 -1.466 1.00 0.00 O ATOM 0 H GLY A 41 -9.888 -5.454 -1.697 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -12.318 -5.876 -2.973 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -11.051 -6.287 -4.112 1.00 0.00 H new ATOM 195 N GLU A 42 -9.708 -7.871 -2.304 1.00 0.00 N ATOM 196 CA GLU A 42 -9.256 -8.980 -1.460 1.00 0.00 C ATOM 197 C GLU A 42 -9.671 -8.734 -0.008 1.00 0.00 C ATOM 198 O GLU A 42 -10.225 -9.615 0.640 1.00 0.00 O ATOM 199 CB GLU A 42 -7.721 -9.108 -1.475 1.00 0.00 C ATOM 200 CG GLU A 42 -7.071 -9.377 -2.831 1.00 0.00 C ATOM 201 CD GLU A 42 -6.951 -10.848 -3.168 1.00 0.00 C ATOM 202 OE1 GLU A 42 -5.972 -11.490 -2.713 1.00 0.00 O ATOM 203 OE2 GLU A 42 -7.787 -11.337 -3.943 1.00 0.00 O ATOM 0 H GLU A 42 -8.987 -7.508 -2.928 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.710 -9.889 -1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.298 -8.188 -1.071 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -7.439 -9.913 -0.796 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.654 -8.882 -3.608 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.078 -8.928 -2.843 1.00 0.00 H new ATOM 210 N ILE A 43 -9.395 -7.528 0.493 1.00 0.00 N ATOM 211 CA ILE A 43 -9.546 -7.092 1.883 1.00 0.00 C ATOM 212 C ILE A 43 -11.024 -7.057 2.325 1.00 0.00 C ATOM 213 O ILE A 43 -11.287 -7.016 3.521 1.00 0.00 O ATOM 214 CB ILE A 43 -8.799 -5.730 2.007 1.00 0.00 C ATOM 215 CG1 ILE A 43 -7.306 -5.990 1.638 1.00 0.00 C ATOM 216 CG2 ILE A 43 -8.969 -4.990 3.359 1.00 0.00 C ATOM 217 CD1 ILE A 43 -6.274 -4.965 2.094 1.00 0.00 C ATOM 0 H ILE A 43 -9.036 -6.780 -0.101 1.00 0.00 H new ATOM 0 HA ILE A 43 -9.099 -7.805 2.577 1.00 0.00 H new ATOM 0 HB ILE A 43 -9.259 -5.026 1.313 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -7.022 -6.958 2.051 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -7.238 -6.074 0.553 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.408 -4.056 3.336 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -10.025 -4.775 3.526 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -8.594 -5.618 4.167 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -5.282 -5.277 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -6.510 -3.993 1.660 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -6.291 -4.891 3.181 1.00 0.00 H new ATOM 229 N LEU A 44 -11.978 -7.100 1.392 1.00 0.00 N ATOM 230 CA LEU A 44 -13.397 -6.805 1.622 1.00 0.00 C ATOM 231 C LEU A 44 -14.280 -7.981 1.177 1.00 0.00 C ATOM 232 O LEU A 44 -15.336 -8.234 1.758 1.00 0.00 O ATOM 233 CB LEU A 44 -13.818 -5.525 0.861 1.00 0.00 C ATOM 234 CG LEU A 44 -12.738 -4.445 0.629 1.00 0.00 C ATOM 235 CD1 LEU A 44 -13.167 -3.472 -0.459 1.00 0.00 C ATOM 236 CD2 LEU A 44 -12.424 -3.685 1.911 1.00 0.00 C ATOM 0 H LEU A 44 -11.779 -7.349 0.423 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.534 -6.646 2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -14.208 -5.825 -0.112 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.642 -5.065 1.407 1.00 0.00 H new ATOM 0 HG LEU A 44 -11.833 -4.959 0.306 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -12.390 -2.722 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -13.325 -4.015 -1.391 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -14.094 -2.981 -0.163 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -11.660 -2.933 1.711 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.328 -3.196 2.275 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -12.059 -4.381 2.666 1.00 0.00 H new ATOM 248 N TYR A 45 -13.852 -8.692 0.135 1.00 0.00 N ATOM 249 CA TYR A 45 -14.491 -9.846 -0.475 1.00 0.00 C ATOM 250 C TYR A 45 -13.865 -11.115 0.124 1.00 0.00 C ATOM 251 O TYR A 45 -14.553 -11.899 0.782 1.00 0.00 O ATOM 252 CB TYR A 45 -14.318 -9.783 -2.009 1.00 0.00 C ATOM 253 CG TYR A 45 -15.086 -8.678 -2.734 1.00 0.00 C ATOM 254 CD1 TYR A 45 -14.847 -7.314 -2.471 1.00 0.00 C ATOM 255 CD2 TYR A 45 -16.040 -9.018 -3.712 1.00 0.00 C ATOM 256 CE1 TYR A 45 -15.629 -6.313 -3.073 1.00 0.00 C ATOM 257 CE2 TYR A 45 -16.817 -8.027 -4.336 1.00 0.00 C ATOM 258 CZ TYR A 45 -16.639 -6.670 -3.996 1.00 0.00 C ATOM 259 OH TYR A 45 -17.412 -5.724 -4.596 1.00 0.00 O ATOM 0 H TYR A 45 -12.980 -8.453 -0.338 1.00 0.00 H new ATOM 0 HA TYR A 45 -15.562 -9.856 -0.270 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -13.257 -9.663 -2.229 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -14.623 -10.742 -2.427 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -14.051 -7.034 -1.797 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -16.176 -10.054 -3.986 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -15.459 -5.274 -2.831 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -17.552 -8.305 -5.077 1.00 0.00 H new ATOM 0 HH TYR A 45 -16.906 -4.889 -4.673 1.00 0.00 H new ATOM 269 N GLY A 46 -12.550 -11.301 -0.050 1.00 0.00 N ATOM 270 CA GLY A 46 -11.786 -12.449 0.428 1.00 0.00 C ATOM 271 C GLY A 46 -10.527 -12.648 -0.421 1.00 0.00 C ATOM 272 O GLY A 46 -10.591 -12.563 -1.644 1.00 0.00 O ATOM 0 H GLY A 46 -11.971 -10.625 -0.548 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -11.508 -12.299 1.471 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -12.404 -13.346 0.388 1.00 0.00 H new ATOM 276 N LYS A 47 -9.374 -12.912 0.214 1.00 0.00 N ATOM 277 CA LYS A 47 -8.076 -13.101 -0.452 1.00 0.00 C ATOM 278 C LYS A 47 -8.158 -14.189 -1.513 1.00 0.00 C ATOM 279 O LYS A 47 -8.302 -15.353 -1.145 1.00 0.00 O ATOM 280 CB LYS A 47 -7.007 -13.503 0.576 1.00 0.00 C ATOM 281 CG LYS A 47 -5.621 -13.695 -0.078 1.00 0.00 C ATOM 282 CD LYS A 47 -4.717 -12.526 0.272 1.00 0.00 C ATOM 283 CE LYS A 47 -3.363 -12.574 -0.421 1.00 0.00 C ATOM 284 NZ LYS A 47 -3.427 -12.117 -1.826 1.00 0.00 N ATOM 0 H LYS A 47 -9.317 -13.002 1.228 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.808 -12.156 -0.925 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.941 -12.737 1.349 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.307 -14.428 1.069 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -5.173 -14.628 0.266 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.727 -13.772 -1.160 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.220 -11.596 0.005 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.563 -12.507 1.351 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.656 -11.952 0.128 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.980 -13.594 -0.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.947 -12.808 -2.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -4.421 -12.028 -2.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.957 -11.193 -1.912 1.00 0.00 H new ATOM 298 N ARG A 48 -7.945 -13.886 -2.790 1.00 0.00 N ATOM 299 CA ARG A 48 -8.183 -14.881 -3.851 1.00 0.00 C ATOM 300 C ARG A 48 -7.346 -16.160 -3.712 1.00 0.00 C ATOM 301 O ARG A 48 -7.790 -17.205 -4.169 1.00 0.00 O ATOM 302 CB ARG A 48 -8.090 -14.248 -5.246 1.00 0.00 C ATOM 303 CG ARG A 48 -6.678 -13.765 -5.593 1.00 0.00 C ATOM 304 CD ARG A 48 -6.081 -14.575 -6.753 1.00 0.00 C ATOM 305 NE ARG A 48 -4.667 -14.245 -6.987 1.00 0.00 N ATOM 306 CZ ARG A 48 -4.148 -13.113 -7.477 1.00 0.00 C ATOM 307 NH1 ARG A 48 -4.916 -12.121 -7.929 1.00 0.00 N ATOM 308 NH2 ARG A 48 -2.831 -12.983 -7.491 1.00 0.00 N ATOM 0 H ARG A 48 -7.614 -12.979 -3.120 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.210 -15.221 -3.719 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.412 -14.976 -5.991 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.780 -13.406 -5.303 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.708 -12.709 -5.862 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.036 -13.853 -4.717 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.174 -15.639 -6.537 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -6.653 -14.383 -7.661 1.00 0.00 H new ATOM 0 HE ARG A 48 -3.995 -14.973 -6.744 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -5.932 -12.212 -7.908 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -4.488 -11.271 -8.296 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -2.241 -13.734 -7.134 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -2.406 -12.131 -7.858 1.00 0.00 H new ATOM 322 N GLU A 49 -6.192 -16.111 -3.031 1.00 0.00 N ATOM 323 CA GLU A 49 -5.365 -17.274 -2.687 1.00 0.00 C ATOM 324 C GLU A 49 -6.213 -18.364 -2.005 1.00 0.00 C ATOM 325 O GLU A 49 -6.459 -19.415 -2.598 1.00 0.00 O ATOM 326 CB GLU A 49 -4.147 -16.832 -1.830 1.00 0.00 C ATOM 327 CG GLU A 49 -2.771 -17.001 -2.503 1.00 0.00 C ATOM 328 CD GLU A 49 -2.175 -18.413 -2.397 1.00 0.00 C ATOM 329 OE1 GLU A 49 -2.911 -19.404 -2.613 1.00 0.00 O ATOM 330 OE2 GLU A 49 -0.947 -18.555 -2.177 1.00 0.00 O ATOM 0 H GLU A 49 -5.797 -15.233 -2.694 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.969 -17.718 -3.600 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.275 -15.784 -1.561 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.151 -17.403 -0.901 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.862 -16.738 -3.557 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.074 -16.292 -2.057 1.00 0.00 H new ATOM 337 N THR A 50 -6.685 -18.127 -0.778 1.00 0.00 N ATOM 338 CA THR A 50 -7.389 -19.133 0.026 1.00 0.00 C ATOM 339 C THR A 50 -8.384 -18.486 1.009 1.00 0.00 C ATOM 340 O THR A 50 -8.754 -19.061 2.030 1.00 0.00 O ATOM 341 CB THR A 50 -6.350 -20.061 0.683 1.00 0.00 C ATOM 342 OG1 THR A 50 -6.983 -21.212 1.194 1.00 0.00 O ATOM 343 CG2 THR A 50 -5.520 -19.359 1.761 1.00 0.00 C ATOM 0 H THR A 50 -6.589 -17.226 -0.310 1.00 0.00 H new ATOM 0 HA THR A 50 -8.017 -19.754 -0.612 1.00 0.00 H new ATOM 0 HB THR A 50 -5.645 -20.357 -0.093 1.00 0.00 H new ATOM 0 HG1 THR A 50 -7.803 -20.953 1.664 1.00 0.00 H new ATOM 0 HG21 THR A 50 -4.806 -20.064 2.187 1.00 0.00 H new ATOM 0 HG22 THR A 50 -4.982 -18.521 1.318 1.00 0.00 H new ATOM 0 HG23 THR A 50 -6.180 -18.992 2.547 1.00 0.00 H new ATOM 351 N GLN A 51 -8.813 -17.257 0.713 1.00 0.00 N ATOM 352 CA GLN A 51 -9.777 -16.463 1.462 1.00 0.00 C ATOM 353 C GLN A 51 -9.319 -16.201 2.909 1.00 0.00 C ATOM 354 O GLN A 51 -10.149 -16.006 3.789 1.00 0.00 O ATOM 355 CB GLN A 51 -11.180 -17.078 1.303 1.00 0.00 C ATOM 356 CG GLN A 51 -11.539 -17.410 -0.162 1.00 0.00 C ATOM 357 CD GLN A 51 -11.760 -16.193 -1.056 1.00 0.00 C ATOM 358 OE1 GLN A 51 -12.726 -15.458 -0.896 1.00 0.00 O ATOM 359 NE2 GLN A 51 -10.891 -15.951 -2.021 1.00 0.00 N ATOM 0 H GLN A 51 -8.471 -16.762 -0.111 1.00 0.00 H new ATOM 0 HA GLN A 51 -9.840 -15.458 1.044 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -11.240 -17.988 1.900 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -11.920 -16.385 1.703 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -10.741 -18.017 -0.589 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -12.443 -18.019 -0.171 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -10.088 -16.566 -2.150 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -11.023 -15.149 -2.637 1.00 0.00 H new ATOM 368 N GLN A 52 -7.999 -16.170 3.138 1.00 0.00 N ATOM 369 CA GLN A 52 -7.355 -16.121 4.456 1.00 0.00 C ATOM 370 C GLN A 52 -7.578 -14.829 5.239 1.00 0.00 C ATOM 371 O GLN A 52 -7.389 -14.833 6.451 1.00 0.00 O ATOM 372 CB GLN A 52 -5.832 -16.343 4.294 1.00 0.00 C ATOM 373 CG GLN A 52 -5.132 -15.346 3.350 1.00 0.00 C ATOM 374 CD GLN A 52 -3.610 -15.504 3.335 1.00 0.00 C ATOM 375 OE1 GLN A 52 -2.880 -14.700 3.900 1.00 0.00 O ATOM 376 NE2 GLN A 52 -3.079 -16.496 2.637 1.00 0.00 N ATOM 0 H GLN A 52 -7.322 -16.179 2.375 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.828 -16.913 5.036 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -5.363 -16.282 5.276 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.664 -17.354 3.922 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -5.516 -15.481 2.339 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -5.383 -14.330 3.653 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -3.684 -17.168 2.165 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -2.065 -16.588 2.572 1.00 0.00 H new ATOM 385 N MET A 53 -7.919 -13.743 4.536 1.00 0.00 N ATOM 386 CA MET A 53 -7.850 -12.357 4.999 1.00 0.00 C ATOM 387 C MET A 53 -6.452 -11.951 5.522 1.00 0.00 C ATOM 388 O MET A 53 -5.619 -12.803 5.822 1.00 0.00 O ATOM 389 CB MET A 53 -9.003 -12.083 5.980 1.00 0.00 C ATOM 390 CG MET A 53 -10.333 -12.028 5.209 1.00 0.00 C ATOM 391 SD MET A 53 -11.068 -10.368 5.169 1.00 0.00 S ATOM 392 CE MET A 53 -11.887 -10.403 3.554 1.00 0.00 C ATOM 0 H MET A 53 -8.268 -13.813 3.580 1.00 0.00 H new ATOM 0 HA MET A 53 -7.989 -11.698 4.142 1.00 0.00 H new ATOM 0 HB2 MET A 53 -9.042 -12.865 6.738 1.00 0.00 H new ATOM 0 HB3 MET A 53 -8.834 -11.141 6.502 1.00 0.00 H new ATOM 0 HG2 MET A 53 -10.168 -12.370 4.187 1.00 0.00 H new ATOM 0 HG3 MET A 53 -11.040 -12.720 5.666 1.00 0.00 H new ATOM 0 HE1 MET A 53 -12.489 -9.502 3.432 1.00 0.00 H new ATOM 0 HE2 MET A 53 -11.135 -10.447 2.766 1.00 0.00 H new ATOM 0 HE3 MET A 53 -12.531 -11.281 3.491 1.00 0.00 H new ATOM 402 N PRO A 54 -6.126 -10.648 5.579 1.00 0.00 N ATOM 403 CA PRO A 54 -4.969 -10.181 6.332 1.00 0.00 C ATOM 404 C PRO A 54 -5.270 -10.243 7.833 1.00 0.00 C ATOM 405 O PRO A 54 -6.424 -10.119 8.249 1.00 0.00 O ATOM 406 CB PRO A 54 -4.745 -8.738 5.867 1.00 0.00 C ATOM 407 CG PRO A 54 -6.141 -8.270 5.452 1.00 0.00 C ATOM 408 CD PRO A 54 -6.831 -9.535 4.965 1.00 0.00 C ATOM 0 HA PRO A 54 -4.082 -10.791 6.164 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.336 -8.119 6.665 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -4.043 -8.690 5.035 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -6.676 -7.822 6.290 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -6.091 -7.516 4.666 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.883 -9.537 5.249 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -6.794 -9.604 3.878 1.00 0.00 H new ATOM 416 N GLU A 55 -4.230 -10.337 8.658 1.00 0.00 N ATOM 417 CA GLU A 55 -4.356 -10.193 10.097 1.00 0.00 C ATOM 418 C GLU A 55 -4.442 -8.694 10.395 1.00 0.00 C ATOM 419 O GLU A 55 -3.599 -7.920 9.940 1.00 0.00 O ATOM 420 CB GLU A 55 -3.123 -10.808 10.797 1.00 0.00 C ATOM 421 CG GLU A 55 -3.534 -11.739 11.936 1.00 0.00 C ATOM 422 CD GLU A 55 -2.369 -12.177 12.831 1.00 0.00 C ATOM 423 OE1 GLU A 55 -1.252 -12.455 12.332 1.00 0.00 O ATOM 424 OE2 GLU A 55 -2.582 -12.274 14.057 1.00 0.00 O ATOM 0 H GLU A 55 -3.277 -10.516 8.342 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.243 -10.709 10.465 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.528 -11.361 10.070 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -2.489 -10.011 11.187 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.282 -11.238 12.550 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -4.009 -12.625 11.515 1.00 0.00 H new ATOM 431 N VAL A 56 -5.398 -8.267 11.217 1.00 0.00 N ATOM 432 CA VAL A 56 -5.423 -6.906 11.775 1.00 0.00 C ATOM 433 C VAL A 56 -4.288 -6.677 12.803 1.00 0.00 C ATOM 434 O VAL A 56 -4.101 -5.607 13.376 1.00 0.00 O ATOM 435 CB VAL A 56 -6.864 -6.578 12.208 1.00 0.00 C ATOM 436 CG1 VAL A 56 -7.514 -7.610 13.138 1.00 0.00 C ATOM 437 CG2 VAL A 56 -6.990 -5.183 12.808 1.00 0.00 C ATOM 0 H VAL A 56 -6.179 -8.850 11.518 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.176 -6.156 11.023 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.422 -6.617 11.273 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.526 -7.290 13.386 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.552 -8.578 12.638 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -6.927 -7.697 14.052 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.026 -5.003 13.096 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -6.350 -5.106 13.687 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -6.684 -4.441 12.071 1.00 0.00 H new ATOM 447 N GLY A 57 -3.483 -7.708 13.012 1.00 0.00 N ATOM 448 CA GLY A 57 -2.278 -7.723 13.815 1.00 0.00 C ATOM 449 C GLY A 57 -1.018 -7.897 12.974 1.00 0.00 C ATOM 450 O GLY A 57 -0.037 -8.381 13.538 1.00 0.00 O ATOM 0 H GLY A 57 -3.672 -8.619 12.593 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.209 -6.793 14.379 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.340 -8.532 14.542 1.00 0.00 H new ATOM 454 N GLN A 58 -1.006 -7.579 11.668 1.00 0.00 N ATOM 455 CA GLN A 58 0.198 -7.785 10.858 1.00 0.00 C ATOM 456 C GLN A 58 0.510 -6.614 9.925 1.00 0.00 C ATOM 457 O GLN A 58 -0.258 -5.656 9.784 1.00 0.00 O ATOM 458 CB GLN A 58 0.138 -9.127 10.099 1.00 0.00 C ATOM 459 CG GLN A 58 -0.703 -9.088 8.818 1.00 0.00 C ATOM 460 CD GLN A 58 -0.449 -10.240 7.861 1.00 0.00 C ATOM 461 OE1 GLN A 58 0.360 -11.130 8.103 1.00 0.00 O ATOM 462 NE2 GLN A 58 -1.169 -10.224 6.752 1.00 0.00 N ATOM 0 H GLN A 58 -1.801 -7.187 11.163 1.00 0.00 H new ATOM 0 HA GLN A 58 1.033 -7.831 11.557 1.00 0.00 H new ATOM 0 HB2 GLN A 58 1.153 -9.433 9.845 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.268 -9.890 10.764 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.758 -9.086 9.091 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.506 -8.150 8.298 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -1.832 -9.467 6.585 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -1.061 -10.969 6.063 1.00 0.00 H new ATOM 471 N ARG A 59 1.632 -6.766 9.217 1.00 0.00 N ATOM 472 CA ARG A 59 2.003 -5.935 8.088 1.00 0.00 C ATOM 473 C ARG A 59 1.513 -6.614 6.824 1.00 0.00 C ATOM 474 O ARG A 59 1.477 -7.842 6.756 1.00 0.00 O ATOM 475 CB ARG A 59 3.523 -5.675 8.084 1.00 0.00 C ATOM 476 CG ARG A 59 4.377 -6.875 7.631 1.00 0.00 C ATOM 477 CD ARG A 59 4.665 -6.861 6.123 1.00 0.00 C ATOM 478 NE ARG A 59 5.846 -6.036 5.823 1.00 0.00 N ATOM 479 CZ ARG A 59 7.072 -6.480 5.511 1.00 0.00 C ATOM 480 NH1 ARG A 59 7.358 -7.778 5.518 1.00 0.00 N ATOM 481 NH2 ARG A 59 8.022 -5.595 5.237 1.00 0.00 N ATOM 0 H ARG A 59 2.319 -7.491 9.425 1.00 0.00 H new ATOM 0 HA ARG A 59 1.534 -4.953 8.154 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.732 -4.829 7.429 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.831 -5.385 9.088 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.320 -6.871 8.177 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.863 -7.800 7.890 1.00 0.00 H new ATOM 0 HD2 ARG A 59 4.828 -7.879 5.770 1.00 0.00 H new ATOM 0 HD3 ARG A 59 3.799 -6.473 5.587 1.00 0.00 H new ATOM 0 HE ARG A 59 5.719 -5.024 5.856 1.00 0.00 H new ATOM 0 HH11 ARG A 59 6.638 -8.458 5.764 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.297 -8.095 5.277 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.813 -4.597 5.266 1.00 0.00 H new ATOM 0 HH22 ARG A 59 8.961 -5.913 4.997 1.00 0.00 H new ATOM 495 N LEU A 60 1.189 -5.843 5.796 1.00 0.00 N ATOM 496 CA LEU A 60 0.882 -6.339 4.473 1.00 0.00 C ATOM 497 C LEU A 60 1.130 -5.241 3.442 1.00 0.00 C ATOM 498 O LEU A 60 1.488 -4.111 3.787 1.00 0.00 O ATOM 499 CB LEU A 60 -0.540 -6.931 4.413 1.00 0.00 C ATOM 500 CG LEU A 60 -1.768 -6.150 4.915 1.00 0.00 C ATOM 501 CD1 LEU A 60 -1.910 -6.137 6.432 1.00 0.00 C ATOM 502 CD2 LEU A 60 -1.872 -4.725 4.386 1.00 0.00 C ATOM 0 H LEU A 60 1.132 -4.827 5.867 1.00 0.00 H new ATOM 0 HA LEU A 60 1.549 -7.165 4.229 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.732 -7.183 3.370 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.514 -7.868 4.968 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.597 -6.719 4.495 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.797 -5.568 6.710 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -2.006 -7.160 6.797 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.029 -5.674 6.876 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.766 -4.251 4.791 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -0.992 -4.159 4.690 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -1.933 -4.744 3.298 1.00 0.00 H new ATOM 514 N ARG A 61 0.925 -5.566 2.166 1.00 0.00 N ATOM 515 CA ARG A 61 0.959 -4.657 1.025 1.00 0.00 C ATOM 516 C ARG A 61 -0.424 -4.622 0.396 1.00 0.00 C ATOM 517 O ARG A 61 -1.106 -5.646 0.397 1.00 0.00 O ATOM 518 CB ARG A 61 1.990 -5.166 0.002 1.00 0.00 C ATOM 519 CG ARG A 61 3.285 -4.357 0.033 1.00 0.00 C ATOM 520 CD ARG A 61 4.228 -4.701 -1.120 1.00 0.00 C ATOM 521 NE ARG A 61 4.484 -6.143 -1.228 1.00 0.00 N ATOM 522 CZ ARG A 61 5.186 -6.726 -2.202 1.00 0.00 C ATOM 523 NH1 ARG A 61 5.806 -6.002 -3.133 1.00 0.00 N ATOM 524 NH2 ARG A 61 5.213 -8.051 -2.243 1.00 0.00 N ATOM 0 H ARG A 61 0.719 -6.525 1.887 1.00 0.00 H new ATOM 0 HA ARG A 61 1.243 -3.654 1.345 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.214 -6.213 0.205 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.559 -5.120 -0.998 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.045 -3.294 -0.005 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.796 -4.535 0.979 1.00 0.00 H new ATOM 0 HD2 ARG A 61 3.799 -4.341 -2.055 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.174 -4.177 -0.980 1.00 0.00 H new ATOM 0 HE ARG A 61 4.095 -6.746 -0.503 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.749 -4.984 -3.109 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.338 -6.466 -3.869 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.707 -8.593 -1.543 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.740 -8.528 -2.974 1.00 0.00 H new ATOM 538 N VAL A 62 -0.796 -3.505 -0.216 1.00 0.00 N ATOM 539 CA VAL A 62 -1.977 -3.350 -1.050 1.00 0.00 C ATOM 540 C VAL A 62 -1.520 -2.804 -2.405 1.00 0.00 C ATOM 541 O VAL A 62 -0.501 -2.118 -2.482 1.00 0.00 O ATOM 542 CB VAL A 62 -2.989 -2.421 -0.341 1.00 0.00 C ATOM 543 CG1 VAL A 62 -4.258 -2.147 -1.165 1.00 0.00 C ATOM 544 CG2 VAL A 62 -3.442 -3.050 0.981 1.00 0.00 C ATOM 0 H VAL A 62 -0.256 -2.643 -0.140 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.486 -4.300 -1.214 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.462 -1.479 -0.192 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.921 -1.488 -0.604 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -3.985 -1.671 -2.106 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.769 -3.088 -1.369 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.155 -2.388 1.473 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.916 -4.011 0.783 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.578 -3.198 1.628 1.00 0.00 H new ATOM 554 N GLY A 63 -2.289 -3.056 -3.463 1.00 0.00 N ATOM 555 CA GLY A 63 -2.255 -2.284 -4.691 1.00 0.00 C ATOM 556 C GLY A 63 -3.675 -1.904 -5.080 1.00 0.00 C ATOM 557 O GLY A 63 -4.578 -2.730 -4.946 1.00 0.00 O ATOM 0 H GLY A 63 -2.965 -3.820 -3.485 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.650 -1.388 -4.555 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -1.790 -2.865 -5.487 1.00 0.00 H new ATOM 561 N GLY A 64 -3.879 -0.700 -5.609 1.00 0.00 N ATOM 562 CA GLY A 64 -5.147 -0.265 -6.182 1.00 0.00 C ATOM 563 C GLY A 64 -4.995 1.100 -6.847 1.00 0.00 C ATOM 564 O GLY A 64 -3.909 1.690 -6.811 1.00 0.00 O ATOM 0 H GLY A 64 -3.152 0.014 -5.651 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.491 -0.996 -6.914 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.906 -0.213 -5.402 1.00 0.00 H new ATOM 568 N MET A 65 -6.087 1.606 -7.416 1.00 0.00 N ATOM 569 CA MET A 65 -6.219 2.912 -8.045 1.00 0.00 C ATOM 570 C MET A 65 -6.719 3.946 -7.034 1.00 0.00 C ATOM 571 O MET A 65 -7.772 3.772 -6.438 1.00 0.00 O ATOM 572 CB MET A 65 -7.194 2.777 -9.217 1.00 0.00 C ATOM 573 CG MET A 65 -7.019 3.919 -10.226 1.00 0.00 C ATOM 574 SD MET A 65 -7.733 3.631 -11.871 1.00 0.00 S ATOM 575 CE MET A 65 -6.985 2.023 -12.245 1.00 0.00 C ATOM 0 H MET A 65 -6.959 1.077 -7.450 1.00 0.00 H new ATOM 0 HA MET A 65 -5.250 3.256 -8.408 1.00 0.00 H new ATOM 0 HB2 MET A 65 -7.035 1.821 -9.716 1.00 0.00 H new ATOM 0 HB3 MET A 65 -8.218 2.774 -8.842 1.00 0.00 H new ATOM 0 HG2 MET A 65 -7.467 4.821 -9.808 1.00 0.00 H new ATOM 0 HG3 MET A 65 -5.953 4.117 -10.342 1.00 0.00 H new ATOM 0 HE1 MET A 65 -6.866 1.919 -13.323 1.00 0.00 H new ATOM 0 HE2 MET A 65 -6.009 1.955 -11.764 1.00 0.00 H new ATOM 0 HE3 MET A 65 -7.629 1.227 -11.873 1.00 0.00 H new ATOM 585 N VAL A 66 -5.965 5.002 -6.764 1.00 0.00 N ATOM 586 CA VAL A 66 -6.341 6.057 -5.813 1.00 0.00 C ATOM 587 C VAL A 66 -7.589 6.783 -6.348 1.00 0.00 C ATOM 588 O VAL A 66 -7.566 7.238 -7.495 1.00 0.00 O ATOM 589 CB VAL A 66 -5.150 7.028 -5.761 1.00 0.00 C ATOM 590 CG1 VAL A 66 -5.427 8.323 -4.994 1.00 0.00 C ATOM 591 CG2 VAL A 66 -3.954 6.303 -5.147 1.00 0.00 C ATOM 0 H VAL A 66 -5.058 5.159 -7.203 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.568 5.660 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 66 -4.946 7.335 -6.787 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.536 8.951 -5.006 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -6.252 8.856 -5.466 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.690 8.086 -3.963 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.101 6.980 -5.104 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.207 5.973 -4.139 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.700 5.438 -5.759 1.00 0.00 H new ATOM 601 N MET A 67 -8.642 6.934 -5.535 1.00 0.00 N ATOM 602 CA MET A 67 -9.852 7.674 -5.881 1.00 0.00 C ATOM 603 C MET A 67 -9.572 9.137 -6.217 1.00 0.00 C ATOM 604 O MET A 67 -8.830 9.802 -5.484 1.00 0.00 O ATOM 605 CB MET A 67 -10.837 7.684 -4.711 1.00 0.00 C ATOM 606 CG MET A 67 -11.723 6.456 -4.675 1.00 0.00 C ATOM 607 SD MET A 67 -13.075 6.681 -3.508 1.00 0.00 S ATOM 608 CE MET A 67 -13.636 4.975 -3.510 1.00 0.00 C ATOM 0 H MET A 67 -8.672 6.534 -4.597 1.00 0.00 H new ATOM 0 HA MET A 67 -10.262 7.164 -6.752 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.281 7.752 -3.776 1.00 0.00 H new ATOM 0 HB3 MET A 67 -11.462 8.575 -4.776 1.00 0.00 H new ATOM 0 HG2 MET A 67 -12.123 6.261 -5.670 1.00 0.00 H new ATOM 0 HG3 MET A 67 -11.133 5.584 -4.392 1.00 0.00 H new ATOM 0 HE1 MET A 67 -14.197 4.775 -2.597 1.00 0.00 H new ATOM 0 HE2 MET A 67 -14.277 4.804 -4.375 1.00 0.00 H new ATOM 0 HE3 MET A 67 -12.775 4.309 -3.560 1.00 0.00 H new ATOM 618 N PRO A 68 -10.276 9.675 -7.224 1.00 0.00 N ATOM 619 CA PRO A 68 -10.260 11.083 -7.587 1.00 0.00 C ATOM 620 C PRO A 68 -10.793 11.923 -6.422 1.00 0.00 C ATOM 621 O PRO A 68 -11.798 11.561 -5.806 1.00 0.00 O ATOM 622 CB PRO A 68 -11.113 11.152 -8.859 1.00 0.00 C ATOM 623 CG PRO A 68 -12.091 9.989 -8.723 1.00 0.00 C ATOM 624 CD PRO A 68 -11.270 8.952 -8.004 1.00 0.00 C ATOM 0 HA PRO A 68 -9.268 11.489 -7.783 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.637 12.105 -8.935 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -10.500 11.053 -9.755 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -12.978 10.269 -8.155 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -12.434 9.632 -9.694 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -11.899 8.340 -7.358 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -10.790 8.278 -8.713 1.00 0.00 H new ATOM 632 N GLY A 69 -10.114 13.019 -6.081 1.00 0.00 N ATOM 633 CA GLY A 69 -10.537 13.961 -5.052 1.00 0.00 C ATOM 634 C GLY A 69 -10.373 13.458 -3.616 1.00 0.00 C ATOM 635 O GLY A 69 -10.680 14.204 -2.689 1.00 0.00 O ATOM 0 H GLY A 69 -9.234 13.280 -6.525 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -9.967 14.883 -5.167 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -11.585 14.212 -5.217 1.00 0.00 H new ATOM 639 N SER A 70 -9.920 12.218 -3.394 1.00 0.00 N ATOM 640 CA SER A 70 -9.890 11.648 -2.048 1.00 0.00 C ATOM 641 C SER A 70 -8.762 12.239 -1.197 1.00 0.00 C ATOM 642 O SER A 70 -8.944 12.505 -0.009 1.00 0.00 O ATOM 643 CB SER A 70 -9.790 10.119 -2.126 1.00 0.00 C ATOM 644 OG SER A 70 -8.609 9.664 -2.780 1.00 0.00 O ATOM 0 H SER A 70 -9.573 11.597 -4.125 1.00 0.00 H new ATOM 0 HA SER A 70 -10.824 11.912 -1.551 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.819 9.708 -1.117 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.661 9.731 -2.654 1.00 0.00 H new ATOM 0 HG SER A 70 -8.728 9.727 -3.751 1.00 0.00 H new ATOM 650 N VAL A 71 -7.580 12.378 -1.799 1.00 0.00 N ATOM 651 CA VAL A 71 -6.328 12.732 -1.154 1.00 0.00 C ATOM 652 C VAL A 71 -6.376 14.173 -0.623 1.00 0.00 C ATOM 653 O VAL A 71 -6.337 15.116 -1.410 1.00 0.00 O ATOM 654 CB VAL A 71 -5.143 12.378 -2.084 1.00 0.00 C ATOM 655 CG1 VAL A 71 -5.357 12.693 -3.559 1.00 0.00 C ATOM 656 CG2 VAL A 71 -3.805 12.916 -1.581 1.00 0.00 C ATOM 0 H VAL A 71 -7.471 12.238 -2.803 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.164 12.135 -0.257 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.101 11.290 -2.032 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.470 12.408 -4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.218 12.136 -3.929 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.537 13.761 -3.681 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.015 12.634 -2.277 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.854 14.002 -1.508 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.590 12.496 -0.598 1.00 0.00 H new ATOM 666 N GLN A 72 -6.473 14.325 0.702 1.00 0.00 N ATOM 667 CA GLN A 72 -6.486 15.602 1.424 1.00 0.00 C ATOM 668 C GLN A 72 -5.091 16.237 1.465 1.00 0.00 C ATOM 669 O GLN A 72 -4.891 17.388 1.059 1.00 0.00 O ATOM 670 CB GLN A 72 -6.957 15.343 2.870 1.00 0.00 C ATOM 671 CG GLN A 72 -8.480 15.243 3.010 1.00 0.00 C ATOM 672 CD GLN A 72 -8.918 15.486 4.455 1.00 0.00 C ATOM 673 OE1 GLN A 72 -9.405 16.562 4.794 1.00 0.00 O ATOM 674 NE2 GLN A 72 -8.729 14.529 5.348 1.00 0.00 N ATOM 0 H GLN A 72 -6.548 13.524 1.329 1.00 0.00 H new ATOM 0 HA GLN A 72 -7.158 16.286 0.907 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -6.506 14.418 3.230 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -6.593 16.146 3.511 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -8.957 15.972 2.355 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -8.814 14.257 2.687 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -8.324 13.637 5.062 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -8.988 14.683 6.323 1.00 0.00 H new ATOM 683 N ARG A 73 -4.129 15.459 1.978 1.00 0.00 N ATOM 684 CA ARG A 73 -2.794 15.876 2.419 1.00 0.00 C ATOM 685 C ARG A 73 -2.870 16.800 3.634 1.00 0.00 C ATOM 686 O ARG A 73 -3.960 17.126 4.110 1.00 0.00 O ATOM 687 CB ARG A 73 -1.959 16.478 1.269 1.00 0.00 C ATOM 688 CG ARG A 73 -2.061 15.711 -0.064 1.00 0.00 C ATOM 689 CD ARG A 73 -0.872 15.780 -1.034 1.00 0.00 C ATOM 690 NE ARG A 73 0.450 15.895 -0.389 1.00 0.00 N ATOM 691 CZ ARG A 73 1.634 15.680 -0.976 1.00 0.00 C ATOM 692 NH1 ARG A 73 1.754 15.505 -2.288 1.00 0.00 N ATOM 693 NH2 ARG A 73 2.712 15.620 -0.212 1.00 0.00 N ATOM 0 H ARG A 73 -4.273 14.457 2.104 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.264 14.978 2.736 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -2.277 17.508 1.106 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -0.913 16.512 1.575 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -2.240 14.661 0.169 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.942 16.076 -0.591 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.879 14.887 -1.658 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.012 16.634 -1.697 1.00 0.00 H new ATOM 0 HE ARG A 73 0.463 16.163 0.595 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.927 15.532 -2.884 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.673 15.344 -2.699 1.00 0.00 H new ATOM 0 HH21 ARG A 73 2.628 15.736 0.798 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.627 15.457 -0.633 1.00 0.00 H new ATOM 707 N ASP A 74 -1.719 17.210 4.168 1.00 0.00 N ATOM 708 CA ASP A 74 -1.659 18.345 5.061 1.00 0.00 C ATOM 709 C ASP A 74 -0.521 19.236 4.589 1.00 0.00 C ATOM 710 O ASP A 74 0.590 18.714 4.456 1.00 0.00 O ATOM 711 CB ASP A 74 -1.421 17.901 6.508 1.00 0.00 C ATOM 712 CG ASP A 74 -2.168 18.877 7.394 1.00 0.00 C ATOM 713 OD1 ASP A 74 -1.868 20.083 7.309 1.00 0.00 O ATOM 714 OD2 ASP A 74 -3.111 18.434 8.084 1.00 0.00 O ATOM 0 H ASP A 74 -0.818 16.765 3.991 1.00 0.00 H new ATOM 0 HA ASP A 74 -2.607 18.883 5.043 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.780 16.884 6.664 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.357 17.903 6.743 1.00 0.00 H new ATOM 719 N PRO A 75 -0.738 20.532 4.311 1.00 0.00 N ATOM 720 CA PRO A 75 0.364 21.456 4.096 1.00 0.00 C ATOM 721 C PRO A 75 1.068 21.808 5.405 1.00 0.00 C ATOM 722 O PRO A 75 2.212 22.263 5.364 1.00 0.00 O ATOM 723 CB PRO A 75 -0.262 22.707 3.487 1.00 0.00 C ATOM 724 CG PRO A 75 -1.686 22.705 4.033 1.00 0.00 C ATOM 725 CD PRO A 75 -2.017 21.217 4.170 1.00 0.00 C ATOM 0 HA PRO A 75 1.120 21.012 3.448 1.00 0.00 H new ATOM 0 HB2 PRO A 75 0.278 23.608 3.780 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -0.251 22.670 2.398 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.748 23.220 4.992 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -2.376 23.208 3.356 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -2.654 21.037 5.036 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -2.559 20.856 3.296 1.00 0.00 H new ATOM 733 N ASN A 76 0.403 21.625 6.552 1.00 0.00 N ATOM 734 CA ASN A 76 0.972 21.952 7.852 1.00 0.00 C ATOM 735 C ASN A 76 2.027 20.927 8.218 1.00 0.00 C ATOM 736 O ASN A 76 3.014 21.284 8.865 1.00 0.00 O ATOM 737 CB ASN A 76 -0.055 21.951 8.997 1.00 0.00 C ATOM 738 CG ASN A 76 -1.153 22.980 8.826 1.00 0.00 C ATOM 739 OD1 ASN A 76 -1.203 23.973 9.545 1.00 0.00 O ATOM 740 ND2 ASN A 76 -2.075 22.776 7.907 1.00 0.00 N ATOM 0 H ASN A 76 -0.543 21.246 6.598 1.00 0.00 H new ATOM 0 HA ASN A 76 1.377 22.959 7.748 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -0.505 20.961 9.070 1.00 0.00 H new ATOM 0 HB3 ASN A 76 0.462 22.137 9.938 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.836 23.445 7.790 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -2.028 21.949 7.312 1.00 0.00 H new ATOM 747 N SER A 77 1.810 19.675 7.811 1.00 0.00 N ATOM 748 CA SER A 77 2.632 18.538 8.150 1.00 0.00 C ATOM 749 C SER A 77 2.888 17.883 6.795 1.00 0.00 C ATOM 750 O SER A 77 3.233 18.588 5.847 1.00 0.00 O ATOM 751 CB SER A 77 1.876 17.682 9.185 1.00 0.00 C ATOM 752 OG SER A 77 1.594 18.420 10.364 1.00 0.00 O ATOM 0 H SER A 77 1.022 19.428 7.212 1.00 0.00 H new ATOM 0 HA SER A 77 3.587 18.748 8.632 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.945 17.321 8.749 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.471 16.804 9.437 1.00 0.00 H new ATOM 0 HG SER A 77 1.113 17.850 11.000 1.00 0.00 H new ATOM 758 N LEU A 78 2.678 16.577 6.670 1.00 0.00 N ATOM 759 CA LEU A 78 2.629 15.814 5.427 1.00 0.00 C ATOM 760 C LEU A 78 1.726 14.585 5.608 1.00 0.00 C ATOM 761 O LEU A 78 1.754 13.658 4.798 1.00 0.00 O ATOM 762 CB LEU A 78 4.065 15.446 4.986 1.00 0.00 C ATOM 763 CG LEU A 78 4.547 16.400 3.875 1.00 0.00 C ATOM 764 CD1 LEU A 78 6.053 16.649 3.883 1.00 0.00 C ATOM 765 CD2 LEU A 78 4.093 15.864 2.523 1.00 0.00 C ATOM 0 H LEU A 78 2.528 15.985 7.487 1.00 0.00 H new ATOM 0 HA LEU A 78 2.193 16.415 4.629 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.740 15.502 5.840 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.090 14.417 4.627 1.00 0.00 H new ATOM 0 HG LEU A 78 4.094 17.372 4.069 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.314 17.330 3.072 1.00 0.00 H new ATOM 0 HD12 LEU A 78 6.344 17.091 4.836 1.00 0.00 H new ATOM 0 HD13 LEU A 78 6.579 15.704 3.746 1.00 0.00 H new ATOM 0 HD21 LEU A 78 4.431 16.535 1.733 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.517 14.873 2.363 1.00 0.00 H new ATOM 0 HD23 LEU A 78 3.005 15.800 2.504 1.00 0.00 H new ATOM 777 N LYS A 79 0.913 14.556 6.673 1.00 0.00 N ATOM 778 CA LYS A 79 -0.070 13.509 6.915 1.00 0.00 C ATOM 779 C LYS A 79 -1.074 13.519 5.780 1.00 0.00 C ATOM 780 O LYS A 79 -1.775 14.508 5.569 1.00 0.00 O ATOM 781 CB LYS A 79 -0.761 13.692 8.282 1.00 0.00 C ATOM 782 CG LYS A 79 -0.694 12.393 9.094 1.00 0.00 C ATOM 783 CD LYS A 79 -1.610 11.258 8.610 1.00 0.00 C ATOM 784 CE LYS A 79 -3.025 11.385 9.183 1.00 0.00 C ATOM 785 NZ LYS A 79 -3.749 10.095 9.186 1.00 0.00 N ATOM 0 H LYS A 79 0.926 15.274 7.398 1.00 0.00 H new ATOM 0 HA LYS A 79 0.430 12.541 6.948 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -0.280 14.499 8.835 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.801 13.983 8.135 1.00 0.00 H new ATOM 0 HG2 LYS A 79 0.335 12.033 9.086 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -0.944 12.620 10.130 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.657 11.268 7.521 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -1.184 10.298 8.902 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.969 11.770 10.201 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.587 12.113 8.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.675 10.217 9.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -3.887 9.772 8.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.195 9.387 9.709 1.00 0.00 H new ATOM 799 N VAL A 80 -1.128 12.430 5.034 1.00 0.00 N ATOM 800 CA VAL A 80 -2.091 12.226 3.981 1.00 0.00 C ATOM 801 C VAL A 80 -3.187 11.302 4.460 1.00 0.00 C ATOM 802 O VAL A 80 -2.980 10.396 5.272 1.00 0.00 O ATOM 803 CB VAL A 80 -1.459 11.643 2.700 1.00 0.00 C ATOM 804 CG1 VAL A 80 -1.717 12.595 1.568 1.00 0.00 C ATOM 805 CG2 VAL A 80 0.038 11.385 2.744 1.00 0.00 C ATOM 0 H VAL A 80 -0.485 11.647 5.151 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.498 13.205 3.730 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.927 10.666 2.578 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.277 12.199 0.653 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -2.792 12.715 1.432 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -1.270 13.562 1.797 1.00 0.00 H new ATOM 0 HG21 VAL A 80 0.365 10.976 1.788 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.563 12.321 2.937 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.261 10.673 3.538 1.00 0.00 H new ATOM 815 N THR A 81 -4.329 11.484 3.825 1.00 0.00 N ATOM 816 CA THR A 81 -5.473 10.620 3.890 1.00 0.00 C ATOM 817 C THR A 81 -6.027 10.597 2.472 1.00 0.00 C ATOM 818 O THR A 81 -6.338 11.653 1.921 1.00 0.00 O ATOM 819 CB THR A 81 -6.483 11.158 4.928 1.00 0.00 C ATOM 820 OG1 THR A 81 -6.688 12.555 4.834 1.00 0.00 O ATOM 821 CG2 THR A 81 -5.997 10.910 6.346 1.00 0.00 C ATOM 0 H THR A 81 -4.483 12.288 3.217 1.00 0.00 H new ATOM 0 HA THR A 81 -5.235 9.609 4.220 1.00 0.00 H new ATOM 0 HB THR A 81 -7.409 10.626 4.710 1.00 0.00 H new ATOM 0 HG1 THR A 81 -6.594 12.960 5.722 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.728 11.299 7.055 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.872 9.839 6.506 1.00 0.00 H new ATOM 0 HG23 THR A 81 -5.042 11.414 6.497 1.00 0.00 H new ATOM 829 N PHE A 82 -5.985 9.435 1.825 1.00 0.00 N ATOM 830 CA PHE A 82 -6.609 9.152 0.533 1.00 0.00 C ATOM 831 C PHE A 82 -7.545 7.937 0.606 1.00 0.00 C ATOM 832 O PHE A 82 -7.613 7.256 1.641 1.00 0.00 O ATOM 833 CB PHE A 82 -5.520 9.002 -0.542 1.00 0.00 C ATOM 834 CG PHE A 82 -4.456 7.925 -0.383 1.00 0.00 C ATOM 835 CD1 PHE A 82 -3.374 8.168 0.483 1.00 0.00 C ATOM 836 CD2 PHE A 82 -4.435 6.778 -1.206 1.00 0.00 C ATOM 837 CE1 PHE A 82 -2.264 7.307 0.501 1.00 0.00 C ATOM 838 CE2 PHE A 82 -3.329 5.909 -1.172 1.00 0.00 C ATOM 839 CZ PHE A 82 -2.233 6.181 -0.336 1.00 0.00 C ATOM 0 H PHE A 82 -5.492 8.627 2.204 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.244 9.992 0.253 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -6.022 8.828 -1.494 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -5.006 9.960 -0.623 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.397 9.025 1.140 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.267 6.568 -1.861 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -1.433 7.512 1.160 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.322 5.026 -1.794 1.00 0.00 H new ATOM 0 HZ PHE A 82 -1.373 5.528 -0.338 1.00 0.00 H new ATOM 849 N THR A 83 -8.194 7.597 -0.513 1.00 0.00 N ATOM 850 CA THR A 83 -8.938 6.344 -0.703 1.00 0.00 C ATOM 851 C THR A 83 -8.361 5.662 -1.950 1.00 0.00 C ATOM 852 O THR A 83 -7.950 6.351 -2.887 1.00 0.00 O ATOM 853 CB THR A 83 -10.456 6.601 -0.739 1.00 0.00 C ATOM 854 OG1 THR A 83 -10.855 7.307 0.425 1.00 0.00 O ATOM 855 CG2 THR A 83 -11.291 5.318 -0.795 1.00 0.00 C ATOM 0 H THR A 83 -8.218 8.201 -1.334 1.00 0.00 H new ATOM 0 HA THR A 83 -8.815 5.661 0.137 1.00 0.00 H new ATOM 0 HB THR A 83 -10.636 7.173 -1.650 1.00 0.00 H new ATOM 0 HG1 THR A 83 -11.821 7.468 0.395 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.350 5.574 -0.818 1.00 0.00 H new ATOM 0 HG22 THR A 83 -11.034 4.755 -1.693 1.00 0.00 H new ATOM 0 HG23 THR A 83 -11.084 4.710 0.086 1.00 0.00 H new ATOM 863 N ILE A 84 -8.301 4.328 -1.965 1.00 0.00 N ATOM 864 CA ILE A 84 -7.923 3.511 -3.116 1.00 0.00 C ATOM 865 C ILE A 84 -9.113 2.616 -3.415 1.00 0.00 C ATOM 866 O ILE A 84 -9.805 2.200 -2.492 1.00 0.00 O ATOM 867 CB ILE A 84 -6.644 2.644 -2.927 1.00 0.00 C ATOM 868 CG1 ILE A 84 -5.694 3.030 -1.808 1.00 0.00 C ATOM 869 CG2 ILE A 84 -5.760 2.772 -4.150 1.00 0.00 C ATOM 870 CD1 ILE A 84 -4.784 1.864 -1.384 1.00 0.00 C ATOM 0 H ILE A 84 -8.524 3.768 -1.142 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.670 4.185 -3.934 1.00 0.00 H new ATOM 0 HB ILE A 84 -7.069 1.663 -2.717 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.078 3.869 -2.131 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.270 3.370 -0.947 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.865 2.165 -4.017 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.304 2.428 -5.030 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.474 3.815 -4.285 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.123 2.191 -0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -5.397 1.033 -1.034 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -4.186 1.540 -2.236 1.00 0.00 H new ATOM 882 N TYR A 85 -9.322 2.282 -4.677 1.00 0.00 N ATOM 883 CA TYR A 85 -10.346 1.380 -5.159 1.00 0.00 C ATOM 884 C TYR A 85 -9.745 0.505 -6.254 1.00 0.00 C ATOM 885 O TYR A 85 -8.561 0.631 -6.579 1.00 0.00 O ATOM 886 CB TYR A 85 -11.553 2.185 -5.654 1.00 0.00 C ATOM 887 CG TYR A 85 -11.301 2.940 -6.934 1.00 0.00 C ATOM 888 CD1 TYR A 85 -10.588 4.148 -6.904 1.00 0.00 C ATOM 889 CD2 TYR A 85 -11.719 2.402 -8.160 1.00 0.00 C ATOM 890 CE1 TYR A 85 -10.274 4.815 -8.093 1.00 0.00 C ATOM 891 CE2 TYR A 85 -11.440 3.081 -9.352 1.00 0.00 C ATOM 892 CZ TYR A 85 -10.720 4.300 -9.325 1.00 0.00 C ATOM 893 OH TYR A 85 -10.497 5.026 -10.449 1.00 0.00 O ATOM 0 H TYR A 85 -8.748 2.656 -5.433 1.00 0.00 H new ATOM 0 HA TYR A 85 -10.701 0.731 -4.359 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.393 1.507 -5.803 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.848 2.892 -4.879 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.280 4.566 -5.957 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.255 1.465 -8.184 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.690 5.723 -8.066 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.775 2.674 -10.295 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.707 4.677 -10.913 1.00 0.00 H new ATOM 903 N ASP A 86 -10.546 -0.409 -6.783 1.00 0.00 N ATOM 904 CA ASP A 86 -10.173 -1.309 -7.878 1.00 0.00 C ATOM 905 C ASP A 86 -11.473 -1.850 -8.502 1.00 0.00 C ATOM 906 O ASP A 86 -12.502 -1.161 -8.459 1.00 0.00 O ATOM 907 CB ASP A 86 -9.204 -2.386 -7.354 1.00 0.00 C ATOM 908 CG ASP A 86 -8.654 -3.292 -8.455 1.00 0.00 C ATOM 909 OD1 ASP A 86 -7.909 -2.812 -9.340 1.00 0.00 O ATOM 910 OD2 ASP A 86 -9.020 -4.488 -8.437 1.00 0.00 O ATOM 0 H ASP A 86 -11.502 -0.553 -6.457 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.626 -0.801 -8.672 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.372 -1.900 -6.844 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -9.718 -2.998 -6.613 1.00 0.00 H new ATOM 915 N ALA A 87 -11.478 -3.031 -9.125 1.00 0.00 N ATOM 916 CA ALA A 87 -12.638 -3.599 -9.799 1.00 0.00 C ATOM 917 C ALA A 87 -13.754 -4.012 -8.831 1.00 0.00 C ATOM 918 O ALA A 87 -14.896 -4.168 -9.271 1.00 0.00 O ATOM 919 CB ALA A 87 -12.188 -4.822 -10.603 1.00 0.00 C ATOM 0 H ALA A 87 -10.654 -3.630 -9.173 1.00 0.00 H new ATOM 0 HA ALA A 87 -13.051 -2.826 -10.447 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.047 -5.258 -11.113 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -11.443 -4.520 -11.339 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -11.753 -5.560 -9.929 1.00 0.00 H new ATOM 925 N GLU A 88 -13.456 -4.174 -7.542 1.00 0.00 N ATOM 926 CA GLU A 88 -14.294 -4.886 -6.587 1.00 0.00 C ATOM 927 C GLU A 88 -14.822 -3.852 -5.595 1.00 0.00 C ATOM 928 O GLU A 88 -16.031 -3.625 -5.501 1.00 0.00 O ATOM 929 CB GLU A 88 -13.485 -5.968 -5.846 1.00 0.00 C ATOM 930 CG GLU A 88 -12.480 -6.801 -6.645 1.00 0.00 C ATOM 931 CD GLU A 88 -13.060 -8.042 -7.327 1.00 0.00 C ATOM 932 OE1 GLU A 88 -14.127 -7.951 -7.965 1.00 0.00 O ATOM 933 OE2 GLU A 88 -12.417 -9.122 -7.254 1.00 0.00 O ATOM 0 H GLU A 88 -12.602 -3.803 -7.126 1.00 0.00 H new ATOM 0 HA GLU A 88 -15.112 -5.389 -7.102 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -12.942 -5.480 -5.036 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -14.194 -6.656 -5.386 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.029 -6.165 -7.406 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.679 -7.115 -5.976 1.00 0.00 H new ATOM 940 N GLY A 89 -13.913 -3.225 -4.844 1.00 0.00 N ATOM 941 CA GLY A 89 -14.274 -2.333 -3.754 1.00 0.00 C ATOM 942 C GLY A 89 -13.269 -1.206 -3.547 1.00 0.00 C ATOM 943 O GLY A 89 -12.574 -0.813 -4.492 1.00 0.00 O ATOM 0 H GLY A 89 -12.907 -3.326 -4.980 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.256 -1.904 -3.953 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -14.359 -2.910 -2.833 1.00 0.00 H new ATOM 947 N SER A 90 -13.243 -0.631 -2.339 1.00 0.00 N ATOM 948 CA SER A 90 -12.357 0.461 -1.980 1.00 0.00 C ATOM 949 C SER A 90 -11.962 0.471 -0.489 1.00 0.00 C ATOM 950 O SER A 90 -12.608 -0.181 0.334 1.00 0.00 O ATOM 951 CB SER A 90 -12.966 1.747 -2.528 1.00 0.00 C ATOM 952 OG SER A 90 -14.228 2.087 -1.994 1.00 0.00 O ATOM 0 H SER A 90 -13.852 -0.924 -1.575 1.00 0.00 H new ATOM 0 HA SER A 90 -11.380 0.335 -2.446 1.00 0.00 H new ATOM 0 HB2 SER A 90 -12.275 2.568 -2.337 1.00 0.00 H new ATOM 0 HB3 SER A 90 -13.060 1.654 -3.610 1.00 0.00 H new ATOM 0 HG SER A 90 -14.744 2.581 -2.664 1.00 0.00 H new ATOM 958 N VAL A 91 -10.861 1.152 -0.137 1.00 0.00 N ATOM 959 CA VAL A 91 -10.184 1.074 1.154 1.00 0.00 C ATOM 960 C VAL A 91 -9.572 2.418 1.543 1.00 0.00 C ATOM 961 O VAL A 91 -9.162 3.229 0.703 1.00 0.00 O ATOM 962 CB VAL A 91 -9.117 -0.037 1.073 1.00 0.00 C ATOM 963 CG1 VAL A 91 -7.865 0.375 0.278 1.00 0.00 C ATOM 964 CG2 VAL A 91 -8.686 -0.588 2.430 1.00 0.00 C ATOM 0 H VAL A 91 -10.402 1.800 -0.778 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.904 0.830 1.935 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.630 -0.833 0.533 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.156 -0.453 0.261 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.150 0.630 -0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.401 1.240 0.752 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -7.934 -1.364 2.285 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.265 0.217 3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -9.550 -1.011 2.942 1.00 0.00 H new ATOM 974 N ASP A 92 -9.449 2.603 2.851 1.00 0.00 N ATOM 975 CA ASP A 92 -8.833 3.772 3.468 1.00 0.00 C ATOM 976 C ASP A 92 -7.311 3.615 3.455 1.00 0.00 C ATOM 977 O ASP A 92 -6.804 2.526 3.739 1.00 0.00 O ATOM 978 CB ASP A 92 -9.270 3.896 4.938 1.00 0.00 C ATOM 979 CG ASP A 92 -10.097 5.135 5.229 1.00 0.00 C ATOM 980 OD1 ASP A 92 -11.263 5.190 4.782 1.00 0.00 O ATOM 981 OD2 ASP A 92 -9.605 5.956 6.037 1.00 0.00 O ATOM 0 H ASP A 92 -9.785 1.923 3.533 1.00 0.00 H new ATOM 0 HA ASP A 92 -9.142 4.654 2.907 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -9.847 3.013 5.211 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.383 3.906 5.571 1.00 0.00 H new ATOM 986 N VAL A 93 -6.573 4.711 3.262 1.00 0.00 N ATOM 987 CA VAL A 93 -5.142 4.774 3.549 1.00 0.00 C ATOM 988 C VAL A 93 -4.857 6.109 4.231 1.00 0.00 C ATOM 989 O VAL A 93 -5.071 7.174 3.638 1.00 0.00 O ATOM 990 CB VAL A 93 -4.245 4.634 2.299 1.00 0.00 C ATOM 991 CG1 VAL A 93 -2.770 4.693 2.703 1.00 0.00 C ATOM 992 CG2 VAL A 93 -4.449 3.364 1.452 1.00 0.00 C ATOM 0 H VAL A 93 -6.956 5.584 2.900 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.899 3.925 4.189 1.00 0.00 H new ATOM 0 HB VAL A 93 -4.547 5.471 1.669 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -2.145 4.593 1.815 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -2.563 5.647 3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.549 3.880 3.395 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.765 3.379 0.604 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.251 2.483 2.063 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -5.476 3.330 1.089 1.00 0.00 H new ATOM 1002 N SER A 94 -4.310 6.042 5.439 1.00 0.00 N ATOM 1003 CA SER A 94 -3.512 7.102 6.017 1.00 0.00 C ATOM 1004 C SER A 94 -2.056 6.818 5.653 1.00 0.00 C ATOM 1005 O SER A 94 -1.610 5.677 5.784 1.00 0.00 O ATOM 1006 CB SER A 94 -3.709 7.121 7.527 1.00 0.00 C ATOM 1007 OG SER A 94 -4.907 7.815 7.838 1.00 0.00 O ATOM 0 H SER A 94 -4.414 5.232 6.051 1.00 0.00 H new ATOM 0 HA SER A 94 -3.806 8.080 5.635 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.756 6.102 7.911 1.00 0.00 H new ATOM 0 HB3 SER A 94 -2.860 7.605 8.009 1.00 0.00 H new ATOM 0 HG SER A 94 -5.036 7.826 8.809 1.00 0.00 H new ATOM 1013 N TYR A 95 -1.319 7.826 5.187 1.00 0.00 N ATOM 1014 CA TYR A 95 0.126 7.799 5.028 1.00 0.00 C ATOM 1015 C TYR A 95 0.661 9.066 5.690 1.00 0.00 C ATOM 1016 O TYR A 95 -0.094 9.992 5.982 1.00 0.00 O ATOM 1017 CB TYR A 95 0.489 7.741 3.533 1.00 0.00 C ATOM 1018 CG TYR A 95 1.975 7.837 3.219 1.00 0.00 C ATOM 1019 CD1 TYR A 95 2.925 7.049 3.899 1.00 0.00 C ATOM 1020 CD2 TYR A 95 2.414 8.789 2.288 1.00 0.00 C ATOM 1021 CE1 TYR A 95 4.301 7.245 3.666 1.00 0.00 C ATOM 1022 CE2 TYR A 95 3.781 8.978 2.031 1.00 0.00 C ATOM 1023 CZ TYR A 95 4.733 8.214 2.733 1.00 0.00 C ATOM 1024 OH TYR A 95 6.051 8.462 2.514 1.00 0.00 O ATOM 0 H TYR A 95 -1.731 8.714 4.901 1.00 0.00 H new ATOM 0 HA TYR A 95 0.569 6.918 5.493 1.00 0.00 H new ATOM 0 HB2 TYR A 95 0.107 6.808 3.119 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -0.027 8.552 3.019 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.598 6.294 4.599 1.00 0.00 H new ATOM 0 HD2 TYR A 95 1.687 9.388 1.759 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.028 6.653 4.202 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.101 9.705 1.299 1.00 0.00 H new ATOM 0 HH TYR A 95 6.144 9.162 1.835 1.00 0.00 H new ATOM 1034 N GLU A 96 1.965 9.151 5.881 1.00 0.00 N ATOM 1035 CA GLU A 96 2.639 10.288 6.455 1.00 0.00 C ATOM 1036 C GLU A 96 4.079 10.176 5.980 1.00 0.00 C ATOM 1037 O GLU A 96 4.742 9.194 6.325 1.00 0.00 O ATOM 1038 CB GLU A 96 2.495 10.232 7.986 1.00 0.00 C ATOM 1039 CG GLU A 96 3.237 11.403 8.625 1.00 0.00 C ATOM 1040 CD GLU A 96 2.755 11.765 10.034 1.00 0.00 C ATOM 1041 OE1 GLU A 96 2.267 10.893 10.794 1.00 0.00 O ATOM 1042 OE2 GLU A 96 2.801 12.985 10.331 1.00 0.00 O ATOM 0 H GLU A 96 2.604 8.397 5.628 1.00 0.00 H new ATOM 0 HA GLU A 96 2.226 11.250 6.151 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.441 10.265 8.262 1.00 0.00 H new ATOM 0 HB3 GLU A 96 2.893 9.290 8.362 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.300 11.164 8.668 1.00 0.00 H new ATOM 0 HG3 GLU A 96 3.133 12.277 7.983 1.00 0.00 H new ATOM 1049 N GLY A 97 4.543 11.107 5.139 1.00 0.00 N ATOM 1050 CA GLY A 97 5.975 11.096 4.817 1.00 0.00 C ATOM 1051 C GLY A 97 6.399 12.253 3.931 1.00 0.00 C ATOM 1052 O GLY A 97 6.541 13.368 4.436 1.00 0.00 O ATOM 0 H GLY A 97 3.988 11.837 4.692 1.00 0.00 H new ATOM 0 HA2 GLY A 97 6.549 11.127 5.743 1.00 0.00 H new ATOM 0 HA3 GLY A 97 6.222 10.158 4.320 1.00 0.00 H new ATOM 1056 N ILE A 98 6.581 12.019 2.627 1.00 0.00 N ATOM 1057 CA ILE A 98 6.730 13.078 1.632 1.00 0.00 C ATOM 1058 C ILE A 98 5.739 12.940 0.472 1.00 0.00 C ATOM 1059 O ILE A 98 5.280 13.950 -0.066 1.00 0.00 O ATOM 1060 CB ILE A 98 8.211 13.183 1.207 1.00 0.00 C ATOM 1061 CG1 ILE A 98 8.505 14.504 0.478 1.00 0.00 C ATOM 1062 CG2 ILE A 98 8.741 11.954 0.451 1.00 0.00 C ATOM 1063 CD1 ILE A 98 8.337 14.505 -1.046 1.00 0.00 C ATOM 0 H ILE A 98 6.629 11.080 2.232 1.00 0.00 H new ATOM 0 HA ILE A 98 6.461 14.034 2.081 1.00 0.00 H new ATOM 0 HB ILE A 98 8.780 13.194 2.137 1.00 0.00 H new ATOM 0 HG12 ILE A 98 7.853 15.273 0.892 1.00 0.00 H new ATOM 0 HG13 ILE A 98 9.529 14.798 0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 98 9.788 12.111 0.190 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.653 11.071 1.085 1.00 0.00 H new ATOM 0 HG23 ILE A 98 8.158 11.807 -0.458 1.00 0.00 H new ATOM 0 HD11 ILE A 98 8.574 15.494 -1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 98 9.010 13.769 -1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 98 7.307 14.252 -1.299 1.00 0.00 H new ATOM 1075 N LEU A 99 5.324 11.701 0.181 1.00 0.00 N ATOM 1076 CA LEU A 99 4.552 11.233 -0.954 1.00 0.00 C ATOM 1077 C LEU A 99 5.260 11.472 -2.297 1.00 0.00 C ATOM 1078 O LEU A 99 5.684 12.595 -2.563 1.00 0.00 O ATOM 1079 CB LEU A 99 3.165 11.863 -0.873 1.00 0.00 C ATOM 1080 CG LEU A 99 2.126 11.169 -1.750 1.00 0.00 C ATOM 1081 CD1 LEU A 99 1.835 9.726 -1.321 1.00 0.00 C ATOM 1082 CD2 LEU A 99 0.857 11.973 -1.536 1.00 0.00 C ATOM 0 H LEU A 99 5.550 10.928 0.807 1.00 0.00 H new ATOM 0 HA LEU A 99 4.450 10.149 -0.908 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.826 11.843 0.163 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.233 12.911 -1.165 1.00 0.00 H new ATOM 0 HG LEU A 99 2.483 11.124 -2.779 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.088 9.292 -1.986 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.752 9.139 -1.373 1.00 0.00 H new ATOM 0 HD13 LEU A 99 1.457 9.720 -0.299 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.050 11.545 -2.131 1.00 0.00 H new ATOM 0 HD22 LEU A 99 0.583 11.947 -0.481 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.025 13.006 -1.842 1.00 0.00 H new ATOM 1094 N PRO A 100 5.407 10.442 -3.154 1.00 0.00 N ATOM 1095 CA PRO A 100 6.052 10.611 -4.448 1.00 0.00 C ATOM 1096 C PRO A 100 5.233 11.610 -5.259 1.00 0.00 C ATOM 1097 O PRO A 100 4.025 11.433 -5.368 1.00 0.00 O ATOM 1098 CB PRO A 100 6.036 9.234 -5.141 1.00 0.00 C ATOM 1099 CG PRO A 100 5.435 8.272 -4.122 1.00 0.00 C ATOM 1100 CD PRO A 100 4.750 9.146 -3.093 1.00 0.00 C ATOM 0 HA PRO A 100 7.074 10.977 -4.353 1.00 0.00 H new ATOM 0 HB2 PRO A 100 5.441 9.261 -6.054 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.042 8.926 -5.425 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.725 7.593 -4.595 1.00 0.00 H new ATOM 0 HG3 PRO A 100 6.207 7.656 -3.661 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.686 9.239 -3.309 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.836 8.713 -2.096 1.00 0.00 H new ATOM 1108 N ASP A 101 5.867 12.563 -5.933 1.00 0.00 N ATOM 1109 CA ASP A 101 5.215 13.392 -6.952 1.00 0.00 C ATOM 1110 C ASP A 101 4.566 12.535 -8.052 1.00 0.00 C ATOM 1111 O ASP A 101 3.587 12.927 -8.689 1.00 0.00 O ATOM 1112 CB ASP A 101 6.286 14.306 -7.545 1.00 0.00 C ATOM 1113 CG ASP A 101 5.776 15.118 -8.724 1.00 0.00 C ATOM 1114 OD1 ASP A 101 4.795 15.874 -8.530 1.00 0.00 O ATOM 1115 OD2 ASP A 101 6.406 15.034 -9.802 1.00 0.00 O ATOM 0 H ASP A 101 6.852 12.787 -5.791 1.00 0.00 H new ATOM 0 HA ASP A 101 4.412 13.974 -6.499 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.648 14.984 -6.772 1.00 0.00 H new ATOM 0 HB3 ASP A 101 7.136 13.703 -7.865 1.00 0.00 H new ATOM 1120 N LEU A 102 5.093 11.325 -8.241 1.00 0.00 N ATOM 1121 CA LEU A 102 4.569 10.337 -9.166 1.00 0.00 C ATOM 1122 C LEU A 102 3.193 9.826 -8.744 1.00 0.00 C ATOM 1123 O LEU A 102 2.484 9.302 -9.592 1.00 0.00 O ATOM 1124 CB LEU A 102 5.547 9.158 -9.303 1.00 0.00 C ATOM 1125 CG LEU A 102 6.735 9.488 -10.227 1.00 0.00 C ATOM 1126 CD1 LEU A 102 7.802 10.358 -9.553 1.00 0.00 C ATOM 1127 CD2 LEU A 102 7.377 8.179 -10.665 1.00 0.00 C ATOM 0 H LEU A 102 5.919 11.002 -7.737 1.00 0.00 H new ATOM 0 HA LEU A 102 4.457 10.829 -10.132 1.00 0.00 H new ATOM 0 HB2 LEU A 102 5.922 8.883 -8.317 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.015 8.291 -9.695 1.00 0.00 H new ATOM 0 HG LEU A 102 6.346 10.057 -11.071 1.00 0.00 H new ATOM 0 HD11 LEU A 102 8.610 10.554 -10.258 1.00 0.00 H new ATOM 0 HD12 LEU A 102 7.357 11.303 -9.240 1.00 0.00 H new ATOM 0 HD13 LEU A 102 8.199 9.837 -8.681 1.00 0.00 H new ATOM 0 HD21 LEU A 102 8.222 8.390 -11.321 1.00 0.00 H new ATOM 0 HD22 LEU A 102 7.726 7.633 -9.788 1.00 0.00 H new ATOM 0 HD23 LEU A 102 6.644 7.575 -11.200 1.00 0.00 H new ATOM 1139 N PHE A 103 2.808 9.901 -7.467 1.00 0.00 N ATOM 1140 CA PHE A 103 1.451 9.631 -6.997 1.00 0.00 C ATOM 1141 C PHE A 103 0.510 10.761 -7.466 1.00 0.00 C ATOM 1142 O PHE A 103 0.813 11.933 -7.231 1.00 0.00 O ATOM 1143 CB PHE A 103 1.525 9.516 -5.465 1.00 0.00 C ATOM 1144 CG PHE A 103 0.243 9.195 -4.739 1.00 0.00 C ATOM 1145 CD1 PHE A 103 -0.717 10.205 -4.559 1.00 0.00 C ATOM 1146 CD2 PHE A 103 0.020 7.911 -4.207 1.00 0.00 C ATOM 1147 CE1 PHE A 103 -1.909 9.938 -3.870 1.00 0.00 C ATOM 1148 CE2 PHE A 103 -1.158 7.663 -3.477 1.00 0.00 C ATOM 1149 CZ PHE A 103 -2.127 8.670 -3.315 1.00 0.00 C ATOM 0 H PHE A 103 3.448 10.157 -6.715 1.00 0.00 H new ATOM 0 HA PHE A 103 1.047 8.704 -7.405 1.00 0.00 H new ATOM 0 HB2 PHE A 103 2.256 8.746 -5.218 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.909 10.458 -5.073 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.536 11.194 -4.954 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.745 7.125 -4.357 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -2.658 10.709 -3.767 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.319 6.690 -3.037 1.00 0.00 H new ATOM 0 HZ PHE A 103 -3.034 8.467 -2.766 1.00 0.00 H new ATOM 1159 N ARG A 104 -0.647 10.448 -8.079 1.00 0.00 N ATOM 1160 CA ARG A 104 -1.706 11.396 -8.430 1.00 0.00 C ATOM 1161 C ARG A 104 -3.011 10.863 -7.844 1.00 0.00 C ATOM 1162 O ARG A 104 -2.980 9.949 -7.018 1.00 0.00 O ATOM 1163 CB ARG A 104 -1.783 11.495 -9.961 1.00 0.00 C ATOM 1164 CG ARG A 104 -0.463 11.873 -10.634 1.00 0.00 C ATOM 1165 CD ARG A 104 -0.027 13.313 -10.370 1.00 0.00 C ATOM 1166 NE ARG A 104 1.148 13.625 -11.197 1.00 0.00 N ATOM 1167 CZ ARG A 104 1.128 13.855 -12.516 1.00 0.00 C ATOM 1168 NH1 ARG A 104 -0.009 14.102 -13.156 1.00 0.00 N ATOM 1169 NH2 ARG A 104 2.250 13.830 -13.215 1.00 0.00 N ATOM 0 H ARG A 104 -0.872 9.491 -8.351 1.00 0.00 H new ATOM 0 HA ARG A 104 -1.512 12.392 -8.031 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -2.119 10.538 -10.359 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.538 12.234 -10.228 1.00 0.00 H new ATOM 0 HG2 ARG A 104 0.318 11.197 -10.286 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -0.558 11.723 -11.709 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -0.841 14.000 -10.601 1.00 0.00 H new ATOM 0 HD3 ARG A 104 0.211 13.445 -9.315 1.00 0.00 H new ATOM 0 HE ARG A 104 2.052 13.670 -10.728 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -0.890 14.119 -12.642 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -0.001 14.275 -14.161 1.00 0.00 H new ATOM 0 HH21 ARG A 104 3.136 13.635 -12.750 1.00 0.00 H new ATOM 0 HH22 ARG A 104 2.229 14.006 -14.220 1.00 0.00 H new ATOM 1183 N GLU A 105 -4.165 11.323 -8.310 1.00 0.00 N ATOM 1184 CA GLU A 105 -5.338 10.460 -8.290 1.00 0.00 C ATOM 1185 C GLU A 105 -5.504 9.830 -9.660 1.00 0.00 C ATOM 1186 O GLU A 105 -5.151 10.425 -10.680 1.00 0.00 O ATOM 1187 CB GLU A 105 -6.624 11.193 -7.910 1.00 0.00 C ATOM 1188 CG GLU A 105 -6.500 12.067 -6.650 1.00 0.00 C ATOM 1189 CD GLU A 105 -6.861 13.538 -6.870 1.00 0.00 C ATOM 1190 OE1 GLU A 105 -6.685 14.064 -7.990 1.00 0.00 O ATOM 1191 OE2 GLU A 105 -7.391 14.152 -5.920 1.00 0.00 O ATOM 0 H GLU A 105 -4.313 12.256 -8.694 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.171 9.705 -7.522 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -6.932 11.821 -8.746 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.415 10.460 -7.754 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.146 11.658 -5.873 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -5.477 12.007 -6.279 1.00 0.00 H new ATOM 1198 N GLY A 106 -6.105 8.649 -9.664 1.00 0.00 N ATOM 1199 CA GLY A 106 -6.629 7.994 -10.862 1.00 0.00 C ATOM 1200 C GLY A 106 -5.625 7.007 -11.443 1.00 0.00 C ATOM 1201 O GLY A 106 -5.804 6.500 -12.550 1.00 0.00 O ATOM 0 H GLY A 106 -6.247 8.103 -8.814 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -7.554 7.472 -10.617 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.876 8.747 -11.611 1.00 0.00 H new ATOM 1205 N GLN A 107 -4.547 6.744 -10.702 1.00 0.00 N ATOM 1206 CA GLN A 107 -3.461 5.872 -11.114 1.00 0.00 C ATOM 1207 C GLN A 107 -3.240 4.793 -10.062 1.00 0.00 C ATOM 1208 O GLN A 107 -3.734 4.896 -8.934 1.00 0.00 O ATOM 1209 CB GLN A 107 -2.191 6.697 -11.344 1.00 0.00 C ATOM 1210 CG GLN A 107 -1.815 7.549 -10.142 1.00 0.00 C ATOM 1211 CD GLN A 107 -0.388 7.992 -10.346 1.00 0.00 C ATOM 1212 OE1 GLN A 107 -0.095 8.821 -11.195 1.00 0.00 O ATOM 1213 NE2 GLN A 107 0.523 7.407 -9.597 1.00 0.00 N ATOM 0 H GLN A 107 -4.408 7.146 -9.775 1.00 0.00 H new ATOM 0 HA GLN A 107 -3.719 5.382 -12.053 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.365 6.026 -11.580 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -2.335 7.343 -12.210 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -2.478 8.410 -10.057 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -1.914 6.978 -9.219 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.243 6.719 -8.898 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.509 7.642 -9.716 1.00 0.00 H new ATOM 1222 N GLY A 108 -2.473 3.779 -10.451 1.00 0.00 N ATOM 1223 CA GLY A 108 -2.126 2.643 -9.630 1.00 0.00 C ATOM 1224 C GLY A 108 -1.059 3.060 -8.635 1.00 0.00 C ATOM 1225 O GLY A 108 -0.089 3.738 -8.987 1.00 0.00 O ATOM 0 H GLY A 108 -2.065 3.732 -11.384 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.007 2.275 -9.105 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.762 1.826 -10.253 1.00 0.00 H new ATOM 1229 N VAL A 109 -1.235 2.636 -7.391 1.00 0.00 N ATOM 1230 CA VAL A 109 -0.229 2.766 -6.342 1.00 0.00 C ATOM 1231 C VAL A 109 -0.129 1.435 -5.614 1.00 0.00 C ATOM 1232 O VAL A 109 -1.057 0.618 -5.650 1.00 0.00 O ATOM 1233 CB VAL A 109 -0.512 3.941 -5.390 1.00 0.00 C ATOM 1234 CG1 VAL A 109 -0.887 5.186 -6.178 1.00 0.00 C ATOM 1235 CG2 VAL A 109 -1.523 3.632 -4.284 1.00 0.00 C ATOM 0 H VAL A 109 -2.094 2.185 -7.076 1.00 0.00 H new ATOM 0 HA VAL A 109 0.734 3.005 -6.794 1.00 0.00 H new ATOM 0 HB VAL A 109 0.420 4.130 -4.857 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -1.084 6.007 -5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.066 5.458 -6.841 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.781 4.987 -6.770 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.662 4.515 -3.661 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.476 3.350 -4.731 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -1.152 2.810 -3.671 1.00 0.00 H new ATOM 1245 N VAL A 110 0.957 1.254 -4.883 1.00 0.00 N ATOM 1246 CA VAL A 110 1.238 0.136 -4.022 1.00 0.00 C ATOM 1247 C VAL A 110 1.514 0.733 -2.649 1.00 0.00 C ATOM 1248 O VAL A 110 2.464 1.500 -2.457 1.00 0.00 O ATOM 1249 CB VAL A 110 2.381 -0.689 -4.639 1.00 0.00 C ATOM 1250 CG1 VAL A 110 3.090 -1.577 -3.620 1.00 0.00 C ATOM 1251 CG2 VAL A 110 1.795 -1.563 -5.756 1.00 0.00 C ATOM 0 H VAL A 110 1.714 1.937 -4.881 1.00 0.00 H new ATOM 0 HA VAL A 110 0.419 -0.575 -3.912 1.00 0.00 H new ATOM 0 HB VAL A 110 3.127 0.006 -5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 110 3.886 -2.134 -4.114 1.00 0.00 H new ATOM 0 HG12 VAL A 110 3.517 -0.957 -2.832 1.00 0.00 H new ATOM 0 HG13 VAL A 110 2.374 -2.275 -3.185 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.589 -2.157 -6.208 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.038 -2.227 -5.339 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.341 -0.927 -6.516 1.00 0.00 H new ATOM 1261 N VAL A 111 0.628 0.466 -1.701 1.00 0.00 N ATOM 1262 CA VAL A 111 0.795 0.802 -0.300 1.00 0.00 C ATOM 1263 C VAL A 111 1.382 -0.418 0.420 1.00 0.00 C ATOM 1264 O VAL A 111 1.278 -1.551 -0.048 1.00 0.00 O ATOM 1265 CB VAL A 111 -0.568 1.281 0.220 1.00 0.00 C ATOM 1266 CG1 VAL A 111 -0.856 1.010 1.688 1.00 0.00 C ATOM 1267 CG2 VAL A 111 -0.778 2.756 -0.088 1.00 0.00 C ATOM 0 H VAL A 111 -0.255 -0.006 -1.895 1.00 0.00 H new ATOM 0 HA VAL A 111 1.499 1.614 -0.121 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.286 0.667 -0.324 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.845 1.392 1.941 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.823 -0.064 1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -0.107 1.507 2.304 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.750 3.072 0.290 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.006 3.343 0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.740 2.912 -1.166 1.00 0.00 H new ATOM 1277 N GLN A 112 2.019 -0.167 1.555 1.00 0.00 N ATOM 1278 CA GLN A 112 2.683 -1.116 2.422 1.00 0.00 C ATOM 1279 C GLN A 112 2.682 -0.532 3.811 1.00 0.00 C ATOM 1280 O GLN A 112 3.001 0.636 3.980 1.00 0.00 O ATOM 1281 CB GLN A 112 4.130 -1.340 1.922 1.00 0.00 C ATOM 1282 CG GLN A 112 4.992 -2.143 2.898 1.00 0.00 C ATOM 1283 CD GLN A 112 5.895 -3.180 2.234 1.00 0.00 C ATOM 1284 OE1 GLN A 112 6.472 -3.015 1.161 1.00 0.00 O ATOM 1285 NE2 GLN A 112 5.932 -4.327 2.881 1.00 0.00 N ATOM 0 H GLN A 112 2.087 0.784 1.918 1.00 0.00 H new ATOM 0 HA GLN A 112 2.173 -2.079 2.423 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.099 -1.859 0.964 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.600 -0.372 1.745 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.612 -1.452 3.470 1.00 0.00 H new ATOM 0 HG3 GLN A 112 4.339 -2.649 3.609 1.00 0.00 H new ATOM 0 HE21 GLN A 112 5.441 -4.427 3.769 1.00 0.00 H new ATOM 0 HE22 GLN A 112 6.452 -5.115 2.494 1.00 0.00 H new ATOM 1294 N GLY A 113 2.368 -1.348 4.805 1.00 0.00 N ATOM 1295 CA GLY A 113 2.487 -0.984 6.188 1.00 0.00 C ATOM 1296 C GLY A 113 1.602 -1.977 6.885 1.00 0.00 C ATOM 1297 O GLY A 113 1.827 -3.177 6.731 1.00 0.00 O ATOM 0 H GLY A 113 2.019 -2.295 4.660 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.518 -1.052 6.534 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.159 0.040 6.364 1.00 0.00 H new ATOM 1301 N GLU A 114 0.587 -1.521 7.598 1.00 0.00 N ATOM 1302 CA GLU A 114 -0.055 -2.321 8.609 1.00 0.00 C ATOM 1303 C GLU A 114 -1.551 -2.093 8.564 1.00 0.00 C ATOM 1304 O GLU A 114 -2.045 -1.093 8.041 1.00 0.00 O ATOM 1305 CB GLU A 114 0.549 -1.956 9.966 1.00 0.00 C ATOM 1306 CG GLU A 114 1.930 -2.613 10.142 1.00 0.00 C ATOM 1307 CD GLU A 114 2.461 -2.598 11.575 1.00 0.00 C ATOM 1308 OE1 GLU A 114 2.141 -3.541 12.335 1.00 0.00 O ATOM 1309 OE2 GLU A 114 3.300 -1.723 11.888 1.00 0.00 O ATOM 0 H GLU A 114 0.191 -0.588 7.488 1.00 0.00 H new ATOM 0 HA GLU A 114 0.111 -3.384 8.434 1.00 0.00 H new ATOM 0 HB2 GLU A 114 0.643 -0.873 10.048 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -0.118 -2.280 10.765 1.00 0.00 H new ATOM 0 HG2 GLU A 114 1.873 -3.646 9.800 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.646 -2.103 9.497 1.00 0.00 H new ATOM 1316 N LEU A 115 -2.296 -3.092 9.011 1.00 0.00 N ATOM 1317 CA LEU A 115 -3.742 -3.053 9.118 1.00 0.00 C ATOM 1318 C LEU A 115 -4.134 -2.319 10.384 1.00 0.00 C ATOM 1319 O LEU A 115 -3.647 -2.645 11.465 1.00 0.00 O ATOM 1320 CB LEU A 115 -4.249 -4.488 8.986 1.00 0.00 C ATOM 1321 CG LEU A 115 -5.767 -4.652 8.838 1.00 0.00 C ATOM 1322 CD1 LEU A 115 -6.480 -3.614 7.947 1.00 0.00 C ATOM 1323 CD2 LEU A 115 -6.105 -6.045 8.303 1.00 0.00 C ATOM 0 H LEU A 115 -1.896 -3.979 9.318 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.221 -2.485 8.321 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -3.768 -4.945 8.121 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -3.926 -5.049 9.863 1.00 0.00 H new ATOM 0 HG LEU A 115 -6.140 -4.493 9.850 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.548 -3.831 7.918 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -6.324 -2.616 8.355 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.073 -3.661 6.937 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.186 -6.144 8.204 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -5.637 -6.184 7.328 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -5.733 -6.801 8.995 1.00 0.00 H new ATOM 1335 N GLU A 116 -4.923 -1.257 10.204 1.00 0.00 N ATOM 1336 CA GLU A 116 -5.342 -0.417 11.322 1.00 0.00 C ATOM 1337 C GLU A 116 -6.421 -1.192 12.053 1.00 0.00 C ATOM 1338 O GLU A 116 -6.199 -1.634 13.178 1.00 0.00 O ATOM 1339 CB GLU A 116 -5.827 0.975 10.868 1.00 0.00 C ATOM 1340 CG GLU A 116 -5.656 2.065 11.941 1.00 0.00 C ATOM 1341 CD GLU A 116 -6.595 1.982 13.140 1.00 0.00 C ATOM 1342 OE1 GLU A 116 -7.806 2.260 12.978 1.00 0.00 O ATOM 1343 OE2 GLU A 116 -6.091 1.753 14.261 1.00 0.00 O ATOM 0 H GLU A 116 -5.282 -0.961 9.296 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.500 -0.207 11.981 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.278 1.268 9.973 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -6.879 0.912 10.590 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -4.630 2.028 12.306 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.791 3.037 11.467 1.00 0.00 H new ATOM 1350 N LYS A 117 -7.571 -1.381 11.395 1.00 0.00 N ATOM 1351 CA LYS A 117 -8.631 -2.239 11.866 1.00 0.00 C ATOM 1352 C LYS A 117 -9.232 -3.043 10.723 1.00 0.00 C ATOM 1353 O LYS A 117 -8.676 -4.075 10.372 1.00 0.00 O ATOM 1354 CB LYS A 117 -9.612 -1.465 12.754 1.00 0.00 C ATOM 1355 CG LYS A 117 -9.165 -1.589 14.221 1.00 0.00 C ATOM 1356 CD LYS A 117 -10.208 -1.068 15.199 1.00 0.00 C ATOM 1357 CE LYS A 117 -10.052 0.445 15.319 1.00 0.00 C ATOM 1358 NZ LYS A 117 -11.116 0.998 16.163 1.00 0.00 N ATOM 0 H LYS A 117 -7.781 -0.928 10.506 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.230 -3.002 12.532 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.642 -0.417 12.457 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.621 -1.860 12.633 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.953 -2.635 14.445 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.235 -1.038 14.361 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.210 -1.318 14.852 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -10.081 -1.540 16.174 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.078 0.685 15.745 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.088 0.901 14.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -11.000 2.029 16.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -12.042 0.784 15.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -11.063 0.574 17.111 1.00 0.00 H new ATOM 1372 N GLY A 118 -10.333 -2.600 10.124 1.00 0.00 N ATOM 1373 CA GLY A 118 -11.043 -3.412 9.151 1.00 0.00 C ATOM 1374 C GLY A 118 -10.518 -3.122 7.763 1.00 0.00 C ATOM 1375 O GLY A 118 -9.850 -3.938 7.125 1.00 0.00 O ATOM 0 H GLY A 118 -10.749 -1.685 10.297 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -10.917 -4.469 9.384 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.111 -3.201 9.197 1.00 0.00 H new ATOM 1379 N ASN A 119 -10.831 -1.930 7.267 1.00 0.00 N ATOM 1380 CA ASN A 119 -10.612 -1.573 5.871 1.00 0.00 C ATOM 1381 C ASN A 119 -9.812 -0.278 5.809 1.00 0.00 C ATOM 1382 O ASN A 119 -10.113 0.597 4.995 1.00 0.00 O ATOM 1383 CB ASN A 119 -11.929 -1.556 5.072 1.00 0.00 C ATOM 1384 CG ASN A 119 -12.847 -2.738 5.324 1.00 0.00 C ATOM 1385 OD1 ASN A 119 -14.046 -2.580 5.519 1.00 0.00 O ATOM 1386 ND2 ASN A 119 -12.339 -3.954 5.328 1.00 0.00 N ATOM 0 H ASN A 119 -11.245 -1.182 7.824 1.00 0.00 H new ATOM 0 HA ASN A 119 -10.015 -2.339 5.376 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -12.469 -0.639 5.309 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -11.691 -1.520 4.009 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.944 -4.759 5.493 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -11.341 -4.090 5.166 1.00 0.00 H new ATOM 1393 N HIS A 120 -8.809 -0.154 6.688 1.00 0.00 N ATOM 1394 CA HIS A 120 -7.876 0.957 6.737 1.00 0.00 C ATOM 1395 C HIS A 120 -6.459 0.400 6.821 1.00 0.00 C ATOM 1396 O HIS A 120 -6.145 -0.405 7.700 1.00 0.00 O ATOM 1397 CB HIS A 120 -8.188 1.860 7.938 1.00 0.00 C ATOM 1398 CG HIS A 120 -7.298 3.084 8.077 1.00 0.00 C ATOM 1399 ND1 HIS A 120 -7.195 3.916 9.173 1.00 0.00 N ATOM 1400 CD2 HIS A 120 -6.457 3.590 7.126 1.00 0.00 C ATOM 1401 CE1 HIS A 120 -6.301 4.883 8.886 1.00 0.00 C ATOM 1402 NE2 HIS A 120 -5.871 4.741 7.629 1.00 0.00 N ATOM 0 H HIS A 120 -8.627 -0.855 7.406 1.00 0.00 H new ATOM 0 HA HIS A 120 -7.969 1.564 5.837 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -9.224 2.191 7.864 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.107 1.267 8.849 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -7.707 3.816 10.049 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.279 3.165 6.149 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -5.981 5.656 9.569 1.00 0.00 H new ATOM 1410 N ILE A 121 -5.615 0.839 5.898 1.00 0.00 N ATOM 1411 CA ILE A 121 -4.187 0.607 5.859 1.00 0.00 C ATOM 1412 C ILE A 121 -3.491 1.833 6.437 1.00 0.00 C ATOM 1413 O ILE A 121 -3.702 2.953 5.970 1.00 0.00 O ATOM 1414 CB ILE A 121 -3.763 0.405 4.387 1.00 0.00 C ATOM 1415 CG1 ILE A 121 -4.743 -0.417 3.513 1.00 0.00 C ATOM 1416 CG2 ILE A 121 -2.353 -0.192 4.359 1.00 0.00 C ATOM 1417 CD1 ILE A 121 -4.927 -1.869 3.939 1.00 0.00 C ATOM 0 H ILE A 121 -5.934 1.401 5.109 1.00 0.00 H new ATOM 0 HA ILE A 121 -3.916 -0.276 6.438 1.00 0.00 H new ATOM 0 HB ILE A 121 -3.780 1.392 3.924 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -5.716 0.075 3.524 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -4.389 -0.399 2.482 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -2.041 -0.340 3.325 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -1.660 0.489 4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -2.353 -1.150 4.879 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -5.631 -2.359 3.266 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -3.967 -2.384 3.899 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -5.315 -1.903 4.957 1.00 0.00 H new ATOM 1429 N LEU A 122 -2.577 1.602 7.369 1.00 0.00 N ATOM 1430 CA LEU A 122 -1.477 2.517 7.571 1.00 0.00 C ATOM 1431 C LEU A 122 -0.499 2.187 6.474 1.00 0.00 C ATOM 1432 O LEU A 122 0.124 1.126 6.487 1.00 0.00 O ATOM 1433 CB LEU A 122 -0.783 2.295 8.912 1.00 0.00 C ATOM 1434 CG LEU A 122 -1.403 3.045 10.082 1.00 0.00 C ATOM 1435 CD1 LEU A 122 -1.377 4.577 9.935 1.00 0.00 C ATOM 1436 CD2 LEU A 122 -2.850 2.669 10.357 1.00 0.00 C ATOM 0 H LEU A 122 -2.580 0.793 7.990 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.831 3.548 7.560 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.790 1.229 9.137 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.261 2.594 8.819 1.00 0.00 H new ATOM 0 HG LEU A 122 -0.764 2.736 10.909 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.838 5.034 10.811 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -0.345 4.917 9.849 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -1.930 4.866 9.041 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.221 3.245 11.205 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.456 2.886 9.477 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.912 1.605 10.587 1.00 0.00 H new ATOM 1448 N ALA A 123 -0.400 3.074 5.503 1.00 0.00 N ATOM 1449 CA ALA A 123 0.742 3.122 4.629 1.00 0.00 C ATOM 1450 C ALA A 123 1.943 3.641 5.402 1.00 0.00 C ATOM 1451 O ALA A 123 1.822 4.515 6.257 1.00 0.00 O ATOM 1452 CB ALA A 123 0.409 4.078 3.509 1.00 0.00 C ATOM 0 H ALA A 123 -1.111 3.778 5.303 1.00 0.00 H new ATOM 0 HA ALA A 123 0.977 2.133 4.236 1.00 0.00 H new ATOM 0 HB1 ALA A 123 1.253 4.142 2.822 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.469 3.718 2.972 1.00 0.00 H new ATOM 0 HB3 ALA A 123 0.202 5.065 3.923 1.00 0.00 H new ATOM 1458 N LYS A 124 3.114 3.153 5.022 1.00 0.00 N ATOM 1459 CA LYS A 124 4.398 3.460 5.625 1.00 0.00 C ATOM 1460 C LYS A 124 5.387 3.996 4.593 1.00 0.00 C ATOM 1461 O LYS A 124 6.406 4.545 5.001 1.00 0.00 O ATOM 1462 CB LYS A 124 4.854 2.244 6.454 1.00 0.00 C ATOM 1463 CG LYS A 124 5.705 1.182 5.737 1.00 0.00 C ATOM 1464 CD LYS A 124 7.197 1.521 5.834 1.00 0.00 C ATOM 1465 CE LYS A 124 8.013 0.230 5.954 1.00 0.00 C ATOM 1466 NZ LYS A 124 9.455 0.515 6.005 1.00 0.00 N ATOM 0 H LYS A 124 3.196 2.498 4.244 1.00 0.00 H new ATOM 0 HA LYS A 124 4.323 4.288 6.330 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.423 2.612 7.308 1.00 0.00 H new ATOM 0 HB3 LYS A 124 3.965 1.753 6.850 1.00 0.00 H new ATOM 0 HG2 LYS A 124 5.521 0.203 6.179 1.00 0.00 H new ATOM 0 HG3 LYS A 124 5.409 1.119 4.690 1.00 0.00 H new ATOM 0 HD2 LYS A 124 7.511 2.080 4.953 1.00 0.00 H new ATOM 0 HD3 LYS A 124 7.379 2.160 6.698 1.00 0.00 H new ATOM 0 HE2 LYS A 124 7.714 -0.310 6.853 1.00 0.00 H new ATOM 0 HE3 LYS A 124 7.798 -0.420 5.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 9.929 -0.199 6.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 9.849 0.488 5.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 9.608 1.459 6.415 1.00 0.00 H new ATOM 1480 N GLU A 125 5.100 3.925 3.281 1.00 0.00 N ATOM 1481 CA GLU A 125 6.051 4.424 2.277 1.00 0.00 C ATOM 1482 C GLU A 125 5.509 4.902 0.926 1.00 0.00 C ATOM 1483 O GLU A 125 6.172 5.700 0.275 1.00 0.00 O ATOM 1484 CB GLU A 125 7.139 3.365 2.081 1.00 0.00 C ATOM 1485 CG GLU A 125 6.702 1.936 1.712 1.00 0.00 C ATOM 1486 CD GLU A 125 7.859 0.949 1.962 1.00 0.00 C ATOM 1487 OE1 GLU A 125 8.864 1.019 1.223 1.00 0.00 O ATOM 1488 OE2 GLU A 125 7.771 0.130 2.905 1.00 0.00 O ATOM 0 H GLU A 125 4.238 3.536 2.899 1.00 0.00 H new ATOM 0 HA GLU A 125 6.427 5.356 2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.813 3.720 1.301 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.719 3.309 3.002 1.00 0.00 H new ATOM 0 HG2 GLU A 125 5.833 1.648 2.304 1.00 0.00 H new ATOM 0 HG3 GLU A 125 6.401 1.898 0.665 1.00 0.00 H new ATOM 1495 N VAL A 126 4.314 4.465 0.540 1.00 0.00 N ATOM 1496 CA VAL A 126 3.519 4.784 -0.654 1.00 0.00 C ATOM 1497 C VAL A 126 4.298 4.868 -1.965 1.00 0.00 C ATOM 1498 O VAL A 126 5.083 5.777 -2.218 1.00 0.00 O ATOM 1499 CB VAL A 126 2.653 6.026 -0.419 1.00 0.00 C ATOM 1500 CG1 VAL A 126 1.834 6.387 -1.672 1.00 0.00 C ATOM 1501 CG2 VAL A 126 1.639 5.702 0.673 1.00 0.00 C ATOM 0 H VAL A 126 3.814 3.796 1.126 1.00 0.00 H new ATOM 0 HA VAL A 126 2.871 3.919 -0.797 1.00 0.00 H new ATOM 0 HB VAL A 126 3.314 6.852 -0.156 1.00 0.00 H new ATOM 0 HG11 VAL A 126 1.231 7.272 -1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 126 2.510 6.590 -2.503 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.180 5.554 -1.932 1.00 0.00 H new ATOM 0 HG21 VAL A 126 1.011 6.574 0.857 1.00 0.00 H new ATOM 0 HG22 VAL A 126 1.016 4.866 0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 126 2.165 5.434 1.590 1.00 0.00 H new ATOM 1511 N LEU A 127 4.004 3.930 -2.861 1.00 0.00 N ATOM 1512 CA LEU A 127 4.809 3.689 -4.044 1.00 0.00 C ATOM 1513 C LEU A 127 3.854 3.763 -5.219 1.00 0.00 C ATOM 1514 O LEU A 127 2.701 3.362 -5.098 1.00 0.00 O ATOM 1515 CB LEU A 127 5.499 2.321 -3.915 1.00 0.00 C ATOM 1516 CG LEU A 127 6.358 2.189 -2.628 1.00 0.00 C ATOM 1517 CD1 LEU A 127 6.762 0.750 -2.312 1.00 0.00 C ATOM 1518 CD2 LEU A 127 7.609 3.065 -2.671 1.00 0.00 C ATOM 0 H LEU A 127 3.195 3.314 -2.782 1.00 0.00 H new ATOM 0 HA LEU A 127 5.606 4.420 -4.178 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.742 1.537 -3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 127 6.133 2.158 -4.786 1.00 0.00 H new ATOM 0 HG LEU A 127 5.705 2.538 -1.828 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.360 0.732 -1.401 1.00 0.00 H new ATOM 0 HD12 LEU A 127 5.867 0.143 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 127 7.347 0.347 -3.138 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.175 2.937 -1.748 1.00 0.00 H new ATOM 0 HD22 LEU A 127 8.228 2.774 -3.520 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.318 4.110 -2.775 1.00 0.00 H new ATOM 1530 N ALA A 128 4.285 4.289 -6.357 1.00 0.00 N ATOM 1531 CA ALA A 128 3.377 4.710 -7.428 1.00 0.00 C ATOM 1532 C ALA A 128 3.604 3.893 -8.698 1.00 0.00 C ATOM 1533 O ALA A 128 3.635 4.466 -9.786 1.00 0.00 O ATOM 1534 CB ALA A 128 3.480 6.226 -7.655 1.00 0.00 C ATOM 0 H ALA A 128 5.272 4.438 -6.569 1.00 0.00 H new ATOM 0 HA ALA A 128 2.351 4.508 -7.122 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.799 6.521 -8.453 1.00 0.00 H new ATOM 0 HB2 ALA A 128 3.213 6.750 -6.738 1.00 0.00 H new ATOM 0 HB3 ALA A 128 4.501 6.483 -7.935 1.00 0.00 H new ATOM 1540 N LYS A 129 3.781 2.567 -8.569 1.00 0.00 N ATOM 1541 CA LYS A 129 4.088 1.683 -9.709 1.00 0.00 C ATOM 1542 C LYS A 129 5.327 2.130 -10.509 1.00 0.00 C ATOM 1543 O LYS A 129 5.494 1.777 -11.676 1.00 0.00 O ATOM 1544 CB LYS A 129 2.830 1.519 -10.594 1.00 0.00 C ATOM 1545 CG LYS A 129 1.810 0.531 -10.014 1.00 0.00 C ATOM 1546 CD LYS A 129 2.334 -0.910 -10.121 1.00 0.00 C ATOM 1547 CE LYS A 129 1.162 -1.887 -10.129 1.00 0.00 C ATOM 1548 NZ LYS A 129 1.606 -3.273 -10.349 1.00 0.00 N ATOM 0 H LYS A 129 3.716 2.078 -7.676 1.00 0.00 H new ATOM 0 HA LYS A 129 4.359 0.705 -9.312 1.00 0.00 H new ATOM 0 HB2 LYS A 129 2.353 2.491 -10.721 1.00 0.00 H new ATOM 0 HB3 LYS A 129 3.132 1.180 -11.585 1.00 0.00 H new ATOM 0 HG2 LYS A 129 1.611 0.775 -8.970 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.864 0.621 -10.548 1.00 0.00 H new ATOM 0 HD2 LYS A 129 2.922 -1.026 -11.031 1.00 0.00 H new ATOM 0 HD3 LYS A 129 2.996 -1.129 -9.283 1.00 0.00 H new ATOM 0 HE2 LYS A 129 0.629 -1.823 -9.180 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.457 -1.603 -10.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.781 -3.906 -10.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 2.093 -3.340 -11.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 2.259 -3.553 -9.589 1.00 0.00 H new ATOM 1562 N HIS A 130 6.207 2.921 -9.907 1.00 0.00 N ATOM 1563 CA HIS A 130 7.381 3.525 -10.498 1.00 0.00 C ATOM 1564 C HIS A 130 8.545 2.544 -10.410 1.00 0.00 C ATOM 1565 O HIS A 130 9.586 2.852 -9.831 1.00 0.00 O ATOM 1566 CB HIS A 130 7.628 4.852 -9.772 1.00 0.00 C ATOM 1567 CG HIS A 130 7.571 4.808 -8.263 1.00 0.00 C ATOM 1568 ND1 HIS A 130 7.762 3.721 -7.449 1.00 0.00 N flip ATOM 1569 CD2 HIS A 130 7.235 5.875 -7.466 1.00 0.00 C flip ATOM 1570 CE1 HIS A 130 7.464 4.119 -6.148 1.00 0.00 C flip ATOM 1571 NE2 HIS A 130 7.194 5.429 -6.204 1.00 0.00 N flip ATOM 0 H HIS A 130 6.106 3.171 -8.923 1.00 0.00 H new ATOM 0 HA HIS A 130 7.254 3.745 -11.558 1.00 0.00 H new ATOM 0 HB2 HIS A 130 8.608 5.226 -10.067 1.00 0.00 H new ATOM 0 HB3 HIS A 130 6.892 5.576 -10.122 1.00 0.00 H new ATOM 0 HD2 HIS A 130 7.040 6.885 -7.796 1.00 0.00 H new ATOM 0 HE1 HIS A 130 7.453 3.494 -5.267 1.00 0.00 H new ATOM 0 HE2 HIS A 130 6.985 6.011 -5.393 1.00 0.00 H new ATOM 1579 N ASP A 131 8.332 1.344 -10.947 1.00 0.00 N ATOM 1580 CA ASP A 131 9.341 0.307 -11.107 1.00 0.00 C ATOM 1581 C ASP A 131 10.112 0.056 -9.812 1.00 0.00 C ATOM 1582 O ASP A 131 11.325 0.270 -9.702 1.00 0.00 O ATOM 1583 CB ASP A 131 10.227 0.685 -12.283 1.00 0.00 C ATOM 1584 CG ASP A 131 11.142 -0.478 -12.663 1.00 0.00 C ATOM 1585 OD1 ASP A 131 10.609 -1.512 -13.112 1.00 0.00 O ATOM 1586 OD2 ASP A 131 12.386 -0.343 -12.583 1.00 0.00 O ATOM 0 H ASP A 131 7.416 1.060 -11.295 1.00 0.00 H new ATOM 0 HA ASP A 131 8.868 -0.650 -11.328 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.609 0.962 -13.137 1.00 0.00 H new ATOM 0 HB3 ASP A 131 10.827 1.558 -12.027 1.00 0.00 H new ATOM 1591 N GLU A 132 9.362 -0.368 -8.800 1.00 0.00 N ATOM 1592 CA GLU A 132 9.874 -0.800 -7.513 1.00 0.00 C ATOM 1593 C GLU A 132 9.309 -2.183 -7.191 1.00 0.00 C ATOM 1594 O GLU A 132 8.297 -2.595 -7.770 1.00 0.00 O ATOM 1595 CB GLU A 132 9.580 0.265 -6.438 1.00 0.00 C ATOM 1596 CG GLU A 132 8.104 0.490 -6.067 1.00 0.00 C ATOM 1597 CD GLU A 132 7.480 -0.678 -5.283 1.00 0.00 C ATOM 1598 OE1 GLU A 132 8.189 -1.338 -4.494 1.00 0.00 O ATOM 1599 OE2 GLU A 132 6.274 -0.968 -5.479 1.00 0.00 O ATOM 0 H GLU A 132 8.345 -0.420 -8.860 1.00 0.00 H new ATOM 0 HA GLU A 132 10.959 -0.899 -7.538 1.00 0.00 H new ATOM 0 HB2 GLU A 132 10.120 -0.010 -5.532 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.993 1.214 -6.779 1.00 0.00 H new ATOM 0 HG2 GLU A 132 8.022 1.400 -5.473 1.00 0.00 H new ATOM 0 HG3 GLU A 132 7.530 0.652 -6.979 1.00 0.00 H new ATOM 1606 N ASN A 133 9.942 -2.883 -6.251 1.00 0.00 N ATOM 1607 CA ASN A 133 9.358 -4.018 -5.546 1.00 0.00 C ATOM 1608 C ASN A 133 10.071 -4.195 -4.197 1.00 0.00 C ATOM 1609 O ASN A 133 10.419 -5.321 -3.828 1.00 0.00 O ATOM 1610 CB ASN A 133 9.469 -5.278 -6.420 1.00 0.00 C ATOM 1611 CG ASN A 133 8.696 -6.453 -5.833 1.00 0.00 C ATOM 1612 OD1 ASN A 133 7.565 -6.320 -5.369 1.00 0.00 O ATOM 1613 ND2 ASN A 133 9.260 -7.643 -5.890 1.00 0.00 N ATOM 0 H ASN A 133 10.894 -2.671 -5.954 1.00 0.00 H new ATOM 0 HA ASN A 133 8.300 -3.841 -5.350 1.00 0.00 H new ATOM 0 HB2 ASN A 133 9.092 -5.060 -7.419 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.518 -5.553 -6.528 1.00 0.00 H new ATOM 0 HD21 ASN A 133 8.758 -8.462 -5.548 1.00 0.00 H new ATOM 0 HD22 ASN A 133 10.198 -7.745 -6.276 1.00 0.00 H new ATOM 1620 N TYR A 134 10.418 -3.104 -3.507 1.00 0.00 N ATOM 1621 CA TYR A 134 11.401 -3.125 -2.419 1.00 0.00 C ATOM 1622 C TYR A 134 11.311 -1.855 -1.572 1.00 0.00 C ATOM 1623 O TYR A 134 11.154 -0.766 -2.130 1.00 0.00 O ATOM 1624 CB TYR A 134 12.795 -3.219 -3.064 1.00 0.00 C ATOM 1625 CG TYR A 134 13.992 -3.050 -2.145 1.00 0.00 C ATOM 1626 CD1 TYR A 134 14.271 -3.996 -1.139 1.00 0.00 C ATOM 1627 CD2 TYR A 134 14.860 -1.960 -2.336 1.00 0.00 C ATOM 1628 CE1 TYR A 134 15.447 -3.898 -0.373 1.00 0.00 C ATOM 1629 CE2 TYR A 134 16.032 -1.849 -1.571 1.00 0.00 C ATOM 1630 CZ TYR A 134 16.336 -2.822 -0.596 1.00 0.00 C ATOM 1631 OH TYR A 134 17.540 -2.762 0.032 1.00 0.00 O ATOM 0 H TYR A 134 10.025 -2.180 -3.687 1.00 0.00 H new ATOM 0 HA TYR A 134 11.210 -3.973 -1.762 1.00 0.00 H new ATOM 0 HB2 TYR A 134 12.877 -4.190 -3.553 1.00 0.00 H new ATOM 0 HB3 TYR A 134 12.858 -2.462 -3.846 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.577 -4.803 -0.954 1.00 0.00 H new ATOM 0 HD2 TYR A 134 14.624 -1.206 -3.073 1.00 0.00 H new ATOM 0 HE1 TYR A 134 15.669 -4.640 0.380 1.00 0.00 H new ATOM 0 HE2 TYR A 134 16.702 -1.017 -1.729 1.00 0.00 H new ATOM 0 HH TYR A 134 18.014 -1.951 -0.246 1.00 0.00 H new ATOM 1641 N THR A 135 11.512 -1.988 -0.259 1.00 0.00 N ATOM 1642 CA THR A 135 11.626 -0.872 0.674 1.00 0.00 C ATOM 1643 C THR A 135 13.054 -0.281 0.567 1.00 0.00 C ATOM 1644 O THR A 135 14.019 -1.038 0.691 1.00 0.00 O ATOM 1645 CB THR A 135 11.344 -1.389 2.102 1.00 0.00 C ATOM 1646 OG1 THR A 135 10.009 -1.863 2.227 1.00 0.00 O ATOM 1647 CG2 THR A 135 11.543 -0.353 3.213 1.00 0.00 C ATOM 0 H THR A 135 11.602 -2.898 0.193 1.00 0.00 H new ATOM 0 HA THR A 135 10.905 -0.089 0.439 1.00 0.00 H new ATOM 0 HB THR A 135 12.078 -2.184 2.233 1.00 0.00 H new ATOM 0 HG1 THR A 135 9.431 -1.135 2.538 1.00 0.00 H new ATOM 0 HG21 THR A 135 11.322 -0.808 4.179 1.00 0.00 H new ATOM 0 HG22 THR A 135 12.576 -0.004 3.204 1.00 0.00 H new ATOM 0 HG23 THR A 135 10.873 0.491 3.048 1.00 0.00 H new ATOM 1655 N PRO A 136 13.209 1.043 0.363 1.00 0.00 N ATOM 1656 CA PRO A 136 14.495 1.756 0.263 1.00 0.00 C ATOM 1657 C PRO A 136 15.220 1.816 1.634 1.00 0.00 C ATOM 1658 O PRO A 136 14.750 1.203 2.592 1.00 0.00 O ATOM 1659 CB PRO A 136 14.101 3.136 -0.290 1.00 0.00 C ATOM 1660 CG PRO A 136 12.719 3.365 0.291 1.00 0.00 C ATOM 1661 CD PRO A 136 12.100 1.979 0.282 1.00 0.00 C ATOM 0 HA PRO A 136 15.219 1.261 -0.384 1.00 0.00 H new ATOM 0 HB2 PRO A 136 14.802 3.910 0.023 1.00 0.00 H new ATOM 0 HB3 PRO A 136 14.085 3.143 -1.380 1.00 0.00 H new ATOM 0 HG2 PRO A 136 12.770 3.776 1.299 1.00 0.00 H new ATOM 0 HG3 PRO A 136 12.141 4.067 -0.310 1.00 0.00 H new ATOM 0 HD2 PRO A 136 11.419 1.851 1.123 1.00 0.00 H new ATOM 0 HD3 PRO A 136 11.519 1.817 -0.626 1.00 0.00 H new ATOM 1669 N PRO A 137 16.380 2.489 1.791 1.00 0.00 N ATOM 1670 CA PRO A 137 17.091 2.484 3.073 1.00 0.00 C ATOM 1671 C PRO A 137 16.549 3.416 4.151 1.00 0.00 C ATOM 1672 O PRO A 137 16.637 3.076 5.333 1.00 0.00 O ATOM 1673 CB PRO A 137 18.520 2.900 2.754 1.00 0.00 C ATOM 1674 CG PRO A 137 18.405 3.699 1.459 1.00 0.00 C ATOM 1675 CD PRO A 137 17.251 3.005 0.740 1.00 0.00 C ATOM 0 HA PRO A 137 16.980 1.486 3.497 1.00 0.00 H new ATOM 0 HB2 PRO A 137 18.946 3.503 3.556 1.00 0.00 H new ATOM 0 HB3 PRO A 137 19.168 2.032 2.629 1.00 0.00 H new ATOM 0 HG2 PRO A 137 18.190 4.751 1.649 1.00 0.00 H new ATOM 0 HG3 PRO A 137 19.326 3.662 0.877 1.00 0.00 H new ATOM 0 HD2 PRO A 137 16.716 3.703 0.096 1.00 0.00 H new ATOM 0 HD3 PRO A 137 17.615 2.199 0.103 1.00 0.00 H new ATOM 1683 N GLU A 138 16.078 4.602 3.773 1.00 0.00 N ATOM 1684 CA GLU A 138 15.676 5.679 4.685 1.00 0.00 C ATOM 1685 C GLU A 138 14.278 5.403 5.251 1.00 0.00 C ATOM 1686 O GLU A 138 13.327 6.169 5.076 1.00 0.00 O ATOM 1687 CB GLU A 138 15.843 7.037 3.971 1.00 0.00 C ATOM 1688 CG GLU A 138 17.249 7.607 4.240 1.00 0.00 C ATOM 1689 CD GLU A 138 17.903 8.247 3.015 1.00 0.00 C ATOM 1690 OE1 GLU A 138 18.019 7.581 1.962 1.00 0.00 O ATOM 1691 OE2 GLU A 138 18.391 9.395 3.132 1.00 0.00 O ATOM 0 H GLU A 138 15.960 4.852 2.791 1.00 0.00 H new ATOM 0 HA GLU A 138 16.324 5.721 5.560 1.00 0.00 H new ATOM 0 HB2 GLU A 138 15.691 6.914 2.899 1.00 0.00 H new ATOM 0 HB3 GLU A 138 15.085 7.737 4.322 1.00 0.00 H new ATOM 0 HG2 GLU A 138 17.183 8.350 5.034 1.00 0.00 H new ATOM 0 HG3 GLU A 138 17.891 6.806 4.606 1.00 0.00 H new ATOM 1698 N VAL A 139 14.157 4.246 5.900 1.00 0.00 N ATOM 1699 CA VAL A 139 12.949 3.710 6.495 1.00 0.00 C ATOM 1700 C VAL A 139 13.363 2.580 7.438 1.00 0.00 C ATOM 1701 O VAL A 139 13.414 2.787 8.649 1.00 0.00 O ATOM 1702 CB VAL A 139 11.933 3.219 5.428 1.00 0.00 C ATOM 1703 CG1 VAL A 139 10.822 4.221 5.111 1.00 0.00 C ATOM 1704 CG2 VAL A 139 12.612 2.772 4.131 1.00 0.00 C ATOM 0 H VAL A 139 14.955 3.624 6.029 1.00 0.00 H new ATOM 0 HA VAL A 139 12.433 4.496 7.046 1.00 0.00 H new ATOM 0 HB VAL A 139 11.461 2.355 5.895 1.00 0.00 H new ATOM 0 HG11 VAL A 139 10.157 3.800 4.357 1.00 0.00 H new ATOM 0 HG12 VAL A 139 10.255 4.434 6.017 1.00 0.00 H new ATOM 0 HG13 VAL A 139 11.261 5.144 4.732 1.00 0.00 H new ATOM 0 HG21 VAL A 139 11.856 2.439 3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 139 13.168 3.607 3.705 1.00 0.00 H new ATOM 0 HG23 VAL A 139 13.297 1.951 4.343 1.00 0.00 H new ATOM 1714 N GLU A 140 13.651 1.405 6.869 1.00 0.00 N ATOM 1715 CA GLU A 140 13.507 0.053 7.393 1.00 0.00 C ATOM 1716 C GLU A 140 12.413 -0.055 8.460 1.00 0.00 C ATOM 1717 O GLU A 140 11.296 -0.479 8.144 1.00 0.00 O ATOM 1718 CB GLU A 140 14.877 -0.529 7.780 1.00 0.00 C ATOM 1719 CG GLU A 140 14.970 -2.041 7.523 1.00 0.00 C ATOM 1720 CD GLU A 140 14.092 -2.905 8.432 1.00 0.00 C ATOM 1721 OE1 GLU A 140 14.497 -3.171 9.590 1.00 0.00 O ATOM 1722 OE2 GLU A 140 13.034 -3.395 7.964 1.00 0.00 O ATOM 0 H GLU A 140 14.033 1.382 5.924 1.00 0.00 H new ATOM 0 HA GLU A 140 13.135 -0.594 6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 140 15.657 -0.019 7.214 1.00 0.00 H new ATOM 0 HB3 GLU A 140 15.067 -0.331 8.835 1.00 0.00 H new ATOM 0 HG2 GLU A 140 14.696 -2.236 6.486 1.00 0.00 H new ATOM 0 HG3 GLU A 140 16.008 -2.352 7.643 1.00 0.00 H new ATOM 1729 N LYS A 141 12.720 0.323 9.703 1.00 0.00 N ATOM 1730 CA LYS A 141 11.855 0.206 10.867 1.00 0.00 C ATOM 1731 C LYS A 141 11.218 1.563 11.183 1.00 0.00 C ATOM 1732 O LYS A 141 10.091 1.803 10.744 1.00 0.00 O ATOM 1733 CB LYS A 141 12.676 -0.403 12.022 1.00 0.00 C ATOM 1734 CG LYS A 141 11.873 -0.655 13.306 1.00 0.00 C ATOM 1735 CD LYS A 141 10.783 -1.713 13.128 1.00 0.00 C ATOM 1736 CE LYS A 141 10.126 -1.978 14.483 1.00 0.00 C ATOM 1737 NZ LYS A 141 9.281 -3.183 14.456 1.00 0.00 N ATOM 0 H LYS A 141 13.623 0.738 9.930 1.00 0.00 H new ATOM 0 HA LYS A 141 11.017 -0.467 10.684 1.00 0.00 H new ATOM 0 HB2 LYS A 141 13.108 -1.346 11.687 1.00 0.00 H new ATOM 0 HB3 LYS A 141 13.507 0.264 12.252 1.00 0.00 H new ATOM 0 HG2 LYS A 141 12.553 -0.970 14.098 1.00 0.00 H new ATOM 0 HG3 LYS A 141 11.416 0.279 13.632 1.00 0.00 H new ATOM 0 HD2 LYS A 141 10.039 -1.371 12.409 1.00 0.00 H new ATOM 0 HD3 LYS A 141 11.212 -2.633 12.730 1.00 0.00 H new ATOM 0 HE2 LYS A 141 10.897 -2.092 15.245 1.00 0.00 H new ATOM 0 HE3 LYS A 141 9.522 -1.117 14.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 8.854 -3.328 15.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 8.529 -3.064 13.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 9.862 -4.009 14.209 1.00 0.00 H new ATOM 1751 N ALA A 142 11.905 2.439 11.922 1.00 0.00 N ATOM 1752 CA ALA A 142 11.375 3.705 12.418 1.00 0.00 C ATOM 1753 C ALA A 142 12.151 4.854 11.783 1.00 0.00 C ATOM 1754 O ALA A 142 13.382 4.796 11.731 1.00 0.00 O ATOM 1755 CB ALA A 142 11.519 3.748 13.943 1.00 0.00 C ATOM 0 H ALA A 142 12.874 2.279 12.198 1.00 0.00 H new ATOM 0 HA ALA A 142 10.321 3.799 12.157 1.00 0.00 H new ATOM 0 HB1 ALA A 142 11.125 4.692 14.319 1.00 0.00 H new ATOM 0 HB2 ALA A 142 10.963 2.921 14.384 1.00 0.00 H new ATOM 0 HB3 ALA A 142 12.572 3.662 14.212 1.00 0.00 H new ATOM 1761 N MET A 143 11.467 5.910 11.327 1.00 0.00 N ATOM 1762 CA MET A 143 12.140 7.088 10.762 1.00 0.00 C ATOM 1763 C MET A 143 12.598 8.016 11.876 1.00 0.00 C ATOM 1764 O MET A 143 13.588 8.749 11.659 1.00 0.00 O ATOM 1765 CB MET A 143 11.248 7.811 9.731 1.00 0.00 C ATOM 1766 CG MET A 143 11.892 7.836 8.329 1.00 0.00 C ATOM 1767 SD MET A 143 12.645 9.433 7.938 1.00 0.00 S ATOM 1768 CE MET A 143 13.546 9.004 6.429 1.00 0.00 C ATOM 0 H MET A 143 10.449 5.974 11.338 1.00 0.00 H new ATOM 0 HA MET A 143 13.025 6.754 10.221 1.00 0.00 H new ATOM 0 HB2 MET A 143 10.280 7.313 9.677 1.00 0.00 H new ATOM 0 HB3 MET A 143 11.063 8.832 10.064 1.00 0.00 H new ATOM 0 HG2 MET A 143 12.651 7.056 8.268 1.00 0.00 H new ATOM 0 HG3 MET A 143 11.134 7.603 7.581 1.00 0.00 H new ATOM 0 HE1 MET A 143 14.069 9.884 6.055 1.00 0.00 H new ATOM 0 HE2 MET A 143 14.269 8.218 6.648 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.844 8.651 5.674 1.00 0.00 H new TER 1778 MET A 143