USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1069 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 51 SER OG : rot 21:sc= 0.276 USER MOD Set 1.2: A 126 HIS : no HD1:sc= 0.897 K(o=1.2,f=-2.9!) USER MOD Set 2.1: A 44 THR OG1 : rot -160:sc= 0.807 USER MOD Set 2.2: A 63 LYS NZ :NH3+ 142:sc= 0.913 (180deg=0) USER MOD Set 3.1: A 27 SER OG : rot 180:sc= 0.25 USER MOD Set 3.2: A 28 ASN : amide:sc= 1.35 K(o=1.6,f=0.66) USER MOD Set 4.1: A 9 SER OG : rot -150:sc= 0.45 USER MOD Set 4.2: A 52 LYS NZ :NH3+ -162:sc= 0.486 (180deg=0) USER MOD Set 5.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A -3 SER OG : rot 160:sc= 0 USER MOD Set 6.1: A 0 SER OG : rot 170:sc= 0.367 USER MOD Set 6.2: A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -1 ASN : amide:sc= 0.51 K(o=0.51,f=-3.2!) USER MOD Single : A -4 GLY N :NH3+ -109:sc= 0.0867 (180deg=0) USER MOD Single : A 12 CYS SG : rot 90:sc= -0.0514 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 2.5 (180deg=2.5) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 15:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 154:sc= 1.32 (180deg=1.07) USER MOD Single : A 40 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.17) USER MOD Single : A 50 THR OG1 : rot -150:sc= -0.21 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ -176:sc= 1.29 (180deg=1.15) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.365 K(o=0.36,f=-0.61) USER MOD Single : A 76 GLN : amide:sc= -0.05 X(o=-0.05,f=-0.24) USER MOD Single : A 77 TYR OH : rot 30:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -100:sc= 0.639 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0.488 K(o=0.49,f=-2.9!) USER MOD Single : A 100 THR OG1 : rot -39:sc= 0.0966 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.39 K(o=-0.39,f=-1.5) USER MOD Single : A 122 SER OG : rot -89:sc= 1.14 USER MOD Single : A 124 GLN : amide:sc= 0.823 K(o=0.82,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.17) USER MOD Single : A 131 LYS NZ :NH3+ -157:sc= 1.03 (180deg=0.642) USER MOD Single : A 132 GLN : amide:sc= 0.827 K(o=0.83,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -8.741 38.595 16.436 1.00 0.00 N ATOM 2 CA GLY A -4 -8.936 37.641 15.321 1.00 0.00 C ATOM 3 C GLY A -4 -8.971 36.197 15.802 1.00 0.00 C ATOM 4 O GLY A -4 -8.697 35.909 16.970 1.00 0.00 O ATOM 0 H1 GLY A -4 -9.623 39.121 16.601 1.00 0.00 H new ATOM 0 H2 GLY A -4 -8.482 38.074 17.298 1.00 0.00 H new ATOM 0 H3 GLY A -4 -7.981 39.262 16.193 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -9.867 37.873 14.805 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -8.131 37.762 14.596 1.00 0.00 H new ATOM 10 N SER A -3 -9.311 35.268 14.903 1.00 0.00 N ATOM 11 CA SER A -3 -9.419 33.825 15.191 1.00 0.00 C ATOM 12 C SER A -3 -8.057 33.175 15.521 1.00 0.00 C ATOM 13 O SER A -3 -7.034 33.587 14.962 1.00 0.00 O ATOM 14 CB SER A -3 -10.056 33.098 13.997 1.00 0.00 C ATOM 15 OG SER A -3 -11.302 33.688 13.652 1.00 0.00 O ATOM 0 H SER A -3 -9.524 35.498 13.932 1.00 0.00 H new ATOM 0 HA SER A -3 -10.049 33.727 16.075 1.00 0.00 H new ATOM 0 HB2 SER A -3 -9.382 33.135 13.141 1.00 0.00 H new ATOM 0 HB3 SER A -3 -10.202 32.046 14.242 1.00 0.00 H new ATOM 0 HG SER A -3 -11.535 33.445 12.732 1.00 0.00 H new ATOM 21 N PRO A -2 -8.013 32.137 16.383 1.00 0.00 N ATOM 22 CA PRO A -2 -6.767 31.464 16.783 1.00 0.00 C ATOM 23 C PRO A -2 -6.207 30.493 15.722 1.00 0.00 C ATOM 24 O PRO A -2 -5.083 30.008 15.867 1.00 0.00 O ATOM 25 CB PRO A -2 -7.119 30.742 18.089 1.00 0.00 C ATOM 26 CG PRO A -2 -8.593 30.389 17.906 1.00 0.00 C ATOM 27 CD PRO A -2 -9.137 31.594 17.140 1.00 0.00 C ATOM 0 HA PRO A -2 -5.962 32.189 16.904 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -6.507 29.852 18.235 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -6.963 31.382 18.958 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -8.721 29.463 17.346 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -9.099 30.256 18.862 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -9.948 31.298 16.474 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -9.542 32.340 17.824 1.00 0.00 H new ATOM 35 N ASN A -1 -6.972 30.204 14.662 1.00 0.00 N ATOM 36 CA ASN A -1 -6.589 29.351 13.530 1.00 0.00 C ATOM 37 C ASN A -1 -7.024 29.965 12.180 1.00 0.00 C ATOM 38 O ASN A -1 -7.839 30.890 12.136 1.00 0.00 O ATOM 39 CB ASN A -1 -7.159 27.934 13.745 1.00 0.00 C ATOM 40 CG ASN A -1 -8.659 27.856 13.514 1.00 0.00 C ATOM 41 OD1 ASN A -1 -9.119 27.615 12.407 1.00 0.00 O ATOM 42 ND2 ASN A -1 -9.467 28.084 14.524 1.00 0.00 N ATOM 0 H ASN A -1 -7.917 30.575 14.566 1.00 0.00 H new ATOM 0 HA ASN A -1 -5.502 29.280 13.486 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -6.657 27.240 13.071 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -6.936 27.609 14.761 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -10.477 28.060 14.385 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -9.084 28.285 15.448 1.00 0.00 H new ATOM 49 N SER A 0 -6.495 29.434 11.073 1.00 0.00 N ATOM 50 CA SER A 0 -6.706 29.948 9.707 1.00 0.00 C ATOM 51 C SER A 0 -8.053 29.579 9.066 1.00 0.00 C ATOM 52 O SER A 0 -8.383 30.100 7.999 1.00 0.00 O ATOM 53 CB SER A 0 -5.570 29.446 8.810 1.00 0.00 C ATOM 54 OG SER A 0 -5.574 28.025 8.743 1.00 0.00 O ATOM 0 H SER A 0 -5.891 28.612 11.098 1.00 0.00 H new ATOM 0 HA SER A 0 -6.716 31.034 9.797 1.00 0.00 H new ATOM 0 HB2 SER A 0 -5.679 29.863 7.809 1.00 0.00 H new ATOM 0 HB3 SER A 0 -4.613 29.794 9.198 1.00 0.00 H new ATOM 0 HG SER A 0 -4.952 27.729 8.046 1.00 0.00 H new ATOM 60 N MET A 1 -8.820 28.662 9.674 1.00 0.00 N ATOM 61 CA MET A 1 -10.002 28.004 9.088 1.00 0.00 C ATOM 62 C MET A 1 -9.722 27.336 7.720 1.00 0.00 C ATOM 63 O MET A 1 -10.608 27.223 6.868 1.00 0.00 O ATOM 64 CB MET A 1 -11.228 28.939 9.099 1.00 0.00 C ATOM 65 CG MET A 1 -11.571 29.422 10.514 1.00 0.00 C ATOM 66 SD MET A 1 -13.072 30.435 10.606 1.00 0.00 S ATOM 67 CE MET A 1 -13.114 30.729 12.395 1.00 0.00 C ATOM 0 H MET A 1 -8.628 28.345 10.624 1.00 0.00 H new ATOM 0 HA MET A 1 -10.255 27.165 9.736 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.033 29.800 8.460 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.086 28.416 8.677 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.690 28.555 11.164 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.732 29.999 10.903 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.980 31.343 12.643 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.183 29.776 12.919 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.204 31.246 12.700 1.00 0.00 H new ATOM 77 N ALA A 2 -8.470 26.907 7.508 1.00 0.00 N ATOM 78 CA ALA A 2 -7.996 26.211 6.307 1.00 0.00 C ATOM 79 C ALA A 2 -6.996 25.079 6.628 1.00 0.00 C ATOM 80 O ALA A 2 -7.030 24.025 5.986 1.00 0.00 O ATOM 81 CB ALA A 2 -7.371 27.254 5.370 1.00 0.00 C ATOM 0 H ALA A 2 -7.731 27.042 8.198 1.00 0.00 H new ATOM 0 HA ALA A 2 -8.843 25.724 5.825 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -7.010 26.762 4.467 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -8.121 27.998 5.102 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -6.538 27.744 5.875 1.00 0.00 H new ATOM 87 N THR A 3 -6.139 25.259 7.641 1.00 0.00 N ATOM 88 CA THR A 3 -5.145 24.265 8.090 1.00 0.00 C ATOM 89 C THR A 3 -5.729 23.424 9.229 1.00 0.00 C ATOM 90 O THR A 3 -5.443 23.628 10.411 1.00 0.00 O ATOM 91 CB THR A 3 -3.809 24.923 8.480 1.00 0.00 C ATOM 92 OG1 THR A 3 -3.411 25.867 7.502 1.00 0.00 O ATOM 93 CG2 THR A 3 -2.688 23.883 8.582 1.00 0.00 C ATOM 0 H THR A 3 -6.114 26.120 8.187 1.00 0.00 H new ATOM 0 HA THR A 3 -4.920 23.600 7.256 1.00 0.00 H new ATOM 0 HB THR A 3 -3.968 25.406 9.444 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.561 26.276 7.768 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.757 24.378 8.859 1.00 0.00 H new ATOM 0 HG22 THR A 3 -2.946 23.144 9.340 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.563 23.387 7.619 1.00 0.00 H new ATOM 101 N GLU A 4 -6.616 22.500 8.862 1.00 0.00 N ATOM 102 CA GLU A 4 -7.459 21.708 9.776 1.00 0.00 C ATOM 103 C GLU A 4 -7.434 20.199 9.453 1.00 0.00 C ATOM 104 O GLU A 4 -8.442 19.497 9.565 1.00 0.00 O ATOM 105 CB GLU A 4 -8.868 22.329 9.851 1.00 0.00 C ATOM 106 CG GLU A 4 -9.614 22.404 8.510 1.00 0.00 C ATOM 107 CD GLU A 4 -11.009 23.031 8.699 1.00 0.00 C ATOM 108 OE1 GLU A 4 -12.024 22.293 8.671 1.00 0.00 O ATOM 109 OE2 GLU A 4 -11.102 24.271 8.872 1.00 0.00 O ATOM 0 H GLU A 4 -6.778 22.268 7.882 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.039 21.756 10.781 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.468 21.749 10.552 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.784 23.336 10.260 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.037 22.996 7.799 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.713 21.405 8.086 1.00 0.00 H new ATOM 116 N LEU A 5 -6.266 19.697 9.029 1.00 0.00 N ATOM 117 CA LEU A 5 -6.024 18.321 8.577 1.00 0.00 C ATOM 118 C LEU A 5 -5.957 17.310 9.748 1.00 0.00 C ATOM 119 O LEU A 5 -4.923 16.704 10.037 1.00 0.00 O ATOM 120 CB LEU A 5 -4.791 18.313 7.645 1.00 0.00 C ATOM 121 CG LEU A 5 -4.895 17.316 6.477 1.00 0.00 C ATOM 122 CD1 LEU A 5 -3.602 17.356 5.659 1.00 0.00 C ATOM 123 CD2 LEU A 5 -5.158 15.866 6.890 1.00 0.00 C ATOM 0 H LEU A 5 -5.422 20.269 8.990 1.00 0.00 H new ATOM 0 HA LEU A 5 -6.876 17.969 7.996 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -4.647 19.315 7.242 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -3.905 18.076 8.234 1.00 0.00 H new ATOM 0 HG LEU A 5 -5.762 17.636 5.899 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -3.673 16.651 4.831 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.451 18.362 5.267 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -2.760 17.084 6.296 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -5.215 15.239 6.000 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -4.347 15.517 7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -6.100 15.808 7.436 1.00 0.00 H new ATOM 135 N GLU A 6 -7.081 17.150 10.443 1.00 0.00 N ATOM 136 CA GLU A 6 -7.288 16.227 11.569 1.00 0.00 C ATOM 137 C GLU A 6 -8.525 15.347 11.296 1.00 0.00 C ATOM 138 O GLU A 6 -9.526 15.371 12.019 1.00 0.00 O ATOM 139 CB GLU A 6 -7.343 17.035 12.882 1.00 0.00 C ATOM 140 CG GLU A 6 -7.178 16.152 14.127 1.00 0.00 C ATOM 141 CD GLU A 6 -7.186 17.005 15.411 1.00 0.00 C ATOM 142 OE1 GLU A 6 -6.099 17.451 15.856 1.00 0.00 O ATOM 143 OE2 GLU A 6 -8.276 17.229 15.994 1.00 0.00 O ATOM 0 H GLU A 6 -7.921 17.688 10.228 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.455 15.533 11.678 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -6.559 17.792 12.872 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -8.295 17.563 12.939 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -7.984 15.419 14.167 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -6.243 15.595 14.061 1.00 0.00 H new ATOM 150 N TYR A 7 -8.483 14.617 10.175 1.00 0.00 N ATOM 151 CA TYR A 7 -9.582 13.832 9.618 1.00 0.00 C ATOM 152 C TYR A 7 -9.041 12.634 8.835 1.00 0.00 C ATOM 153 O TYR A 7 -7.936 12.682 8.294 1.00 0.00 O ATOM 154 CB TYR A 7 -10.460 14.730 8.731 1.00 0.00 C ATOM 155 CG TYR A 7 -9.759 15.458 7.590 1.00 0.00 C ATOM 156 CD1 TYR A 7 -9.637 16.861 7.623 1.00 0.00 C ATOM 157 CD2 TYR A 7 -9.275 14.748 6.471 1.00 0.00 C ATOM 158 CE1 TYR A 7 -9.058 17.551 6.540 1.00 0.00 C ATOM 159 CE2 TYR A 7 -8.678 15.430 5.399 1.00 0.00 C ATOM 160 CZ TYR A 7 -8.578 16.837 5.420 1.00 0.00 C ATOM 161 OH TYR A 7 -8.040 17.495 4.357 1.00 0.00 O ATOM 0 H TYR A 7 -7.638 14.557 9.607 1.00 0.00 H new ATOM 0 HA TYR A 7 -10.196 13.443 10.430 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -11.255 14.117 8.306 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -10.938 15.475 9.368 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -9.989 17.411 8.483 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -9.364 13.672 6.439 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -8.981 18.628 6.566 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -8.294 14.876 4.555 1.00 0.00 H new ATOM 0 HH TYR A 7 -7.761 16.846 3.678 1.00 0.00 H new ATOM 171 N GLU A 8 -9.829 11.558 8.777 1.00 0.00 N ATOM 172 CA GLU A 8 -9.530 10.325 8.050 1.00 0.00 C ATOM 173 C GLU A 8 -10.758 9.395 8.092 1.00 0.00 C ATOM 174 O GLU A 8 -11.189 8.941 9.154 1.00 0.00 O ATOM 175 CB GLU A 8 -8.268 9.645 8.632 1.00 0.00 C ATOM 176 CG GLU A 8 -8.280 9.368 10.147 1.00 0.00 C ATOM 177 CD GLU A 8 -6.924 8.897 10.702 1.00 0.00 C ATOM 178 OE1 GLU A 8 -6.927 8.159 11.716 1.00 0.00 O ATOM 179 OE2 GLU A 8 -5.854 9.246 10.151 1.00 0.00 O ATOM 0 H GLU A 8 -10.729 11.522 9.255 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.315 10.556 7.007 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.119 8.699 8.112 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.406 10.272 8.406 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -8.581 10.275 10.671 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.033 8.610 10.363 1.00 0.00 H new ATOM 186 N SER A 9 -11.348 9.123 6.930 1.00 0.00 N ATOM 187 CA SER A 9 -12.455 8.171 6.769 1.00 0.00 C ATOM 188 C SER A 9 -11.915 6.795 6.383 1.00 0.00 C ATOM 189 O SER A 9 -11.393 6.612 5.285 1.00 0.00 O ATOM 190 CB SER A 9 -13.457 8.661 5.717 1.00 0.00 C ATOM 191 OG SER A 9 -14.296 9.674 6.255 1.00 0.00 O ATOM 0 H SER A 9 -11.068 9.565 6.054 1.00 0.00 H new ATOM 0 HA SER A 9 -12.977 8.094 7.723 1.00 0.00 H new ATOM 0 HB2 SER A 9 -12.921 9.048 4.850 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.065 7.825 5.369 1.00 0.00 H new ATOM 0 HG SER A 9 -15.170 9.644 5.813 1.00 0.00 H new ATOM 197 N VAL A 10 -12.019 5.829 7.297 1.00 0.00 N ATOM 198 CA VAL A 10 -11.550 4.435 7.126 1.00 0.00 C ATOM 199 C VAL A 10 -12.215 3.721 5.932 1.00 0.00 C ATOM 200 O VAL A 10 -13.404 3.910 5.667 1.00 0.00 O ATOM 201 CB VAL A 10 -11.750 3.645 8.437 1.00 0.00 C ATOM 202 CG1 VAL A 10 -11.324 2.177 8.325 1.00 0.00 C ATOM 203 CG2 VAL A 10 -10.921 4.257 9.578 1.00 0.00 C ATOM 0 H VAL A 10 -12.445 5.991 8.210 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.486 4.475 6.895 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.819 3.699 8.641 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -11.489 1.676 9.279 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.913 1.685 7.550 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -10.267 2.124 8.066 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -11.079 3.683 10.491 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.864 4.234 9.313 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.232 5.289 9.740 1.00 0.00 H new ATOM 213 N LEU A 11 -11.444 2.875 5.232 1.00 0.00 N ATOM 214 CA LEU A 11 -11.850 2.088 4.054 1.00 0.00 C ATOM 215 C LEU A 11 -11.488 0.598 4.203 1.00 0.00 C ATOM 216 O LEU A 11 -12.280 -0.270 3.834 1.00 0.00 O ATOM 217 CB LEU A 11 -11.172 2.664 2.791 1.00 0.00 C ATOM 218 CG LEU A 11 -11.600 4.081 2.367 1.00 0.00 C ATOM 219 CD1 LEU A 11 -10.815 4.493 1.120 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.090 4.166 2.029 1.00 0.00 C ATOM 0 H LEU A 11 -10.469 2.712 5.484 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.934 2.157 3.964 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.094 2.668 2.954 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.366 1.986 1.960 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.397 4.741 3.210 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.115 5.496 0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.748 4.485 1.343 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.022 3.792 0.312 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.339 5.186 1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.316 3.487 1.207 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.678 3.885 2.903 1.00 0.00 H new ATOM 232 N CYS A 12 -10.314 0.300 4.771 1.00 0.00 N ATOM 233 CA CYS A 12 -9.846 -1.048 5.108 1.00 0.00 C ATOM 234 C CYS A 12 -8.926 -0.982 6.330 1.00 0.00 C ATOM 235 O CYS A 12 -8.122 -0.060 6.456 1.00 0.00 O ATOM 236 CB CYS A 12 -9.101 -1.647 3.906 1.00 0.00 C ATOM 237 SG CYS A 12 -8.556 -3.352 4.220 1.00 0.00 S ATOM 0 H CYS A 12 -9.637 1.021 5.018 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.698 -1.684 5.346 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -9.752 -1.630 3.032 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.235 -1.028 3.671 1.00 0.00 H new ATOM 0 HG CYS A 12 -9.490 -4.180 3.857 1.00 0.00 H new ATOM 243 N VAL A 13 -9.010 -1.978 7.208 1.00 0.00 N ATOM 244 CA VAL A 13 -8.083 -2.185 8.330 1.00 0.00 C ATOM 245 C VAL A 13 -7.772 -3.673 8.420 1.00 0.00 C ATOM 246 O VAL A 13 -8.694 -4.495 8.465 1.00 0.00 O ATOM 247 CB VAL A 13 -8.641 -1.669 9.672 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.618 -1.824 10.808 1.00 0.00 C ATOM 249 CG2 VAL A 13 -9.022 -0.189 9.604 1.00 0.00 C ATOM 0 H VAL A 13 -9.743 -2.686 7.162 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.178 -1.609 8.139 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.526 -2.274 9.871 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.047 -1.450 11.738 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.361 -2.877 10.925 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.719 -1.256 10.568 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.410 0.132 10.571 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -8.142 0.402 9.352 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.786 -0.045 8.840 1.00 0.00 H new ATOM 259 N LYS A 14 -6.485 -4.029 8.428 1.00 0.00 N ATOM 260 CA LYS A 14 -6.024 -5.424 8.444 1.00 0.00 C ATOM 261 C LYS A 14 -4.837 -5.626 9.404 1.00 0.00 C ATOM 262 O LYS A 14 -3.882 -4.853 9.333 1.00 0.00 O ATOM 263 CB LYS A 14 -5.732 -5.846 6.995 1.00 0.00 C ATOM 264 CG LYS A 14 -6.170 -7.289 6.719 1.00 0.00 C ATOM 265 CD LYS A 14 -6.248 -7.566 5.213 1.00 0.00 C ATOM 266 CE LYS A 14 -7.384 -6.847 4.469 1.00 0.00 C ATOM 267 NZ LYS A 14 -8.720 -7.359 4.863 1.00 0.00 N ATOM 0 H LYS A 14 -5.723 -3.351 8.424 1.00 0.00 H new ATOM 0 HA LYS A 14 -6.801 -6.077 8.841 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -6.248 -5.173 6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -4.665 -5.746 6.796 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -5.466 -7.980 7.183 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -7.143 -7.470 7.176 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -5.300 -7.279 4.758 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -6.361 -8.640 5.064 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.331 -5.778 4.674 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -7.250 -6.973 3.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -9.457 -6.847 4.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -8.781 -8.374 4.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -8.860 -7.216 5.884 1.00 0.00 H new ATOM 281 N PRO A 15 -4.868 -6.629 10.302 1.00 0.00 N ATOM 282 CA PRO A 15 -3.921 -6.737 11.420 1.00 0.00 C ATOM 283 C PRO A 15 -2.506 -7.203 11.043 1.00 0.00 C ATOM 284 O PRO A 15 -1.587 -7.040 11.845 1.00 0.00 O ATOM 285 CB PRO A 15 -4.554 -7.740 12.385 1.00 0.00 C ATOM 286 CG PRO A 15 -5.405 -8.621 11.473 1.00 0.00 C ATOM 287 CD PRO A 15 -5.919 -7.628 10.442 1.00 0.00 C ATOM 0 HA PRO A 15 -3.766 -5.743 11.841 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -3.798 -8.321 12.913 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.160 -7.242 13.142 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.818 -9.416 11.013 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.220 -9.100 12.016 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.121 -8.120 9.491 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -6.853 -7.171 10.769 1.00 0.00 H new ATOM 295 N ASP A 16 -2.324 -7.794 9.860 1.00 0.00 N ATOM 296 CA ASP A 16 -1.046 -8.344 9.401 1.00 0.00 C ATOM 297 C ASP A 16 -0.712 -7.850 7.987 1.00 0.00 C ATOM 298 O ASP A 16 -1.333 -8.255 7.000 1.00 0.00 O ATOM 299 CB ASP A 16 -1.080 -9.880 9.458 1.00 0.00 C ATOM 300 CG ASP A 16 -1.028 -10.411 10.900 1.00 0.00 C ATOM 301 OD1 ASP A 16 0.077 -10.436 11.493 1.00 0.00 O ATOM 302 OD2 ASP A 16 -2.081 -10.842 11.432 1.00 0.00 O ATOM 0 H ASP A 16 -3.076 -7.906 9.180 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.257 -7.992 10.066 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.988 -10.239 8.973 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -0.237 -10.281 8.895 1.00 0.00 H new ATOM 307 N VAL A 17 0.299 -6.987 7.902 1.00 0.00 N ATOM 308 CA VAL A 17 0.951 -6.552 6.657 1.00 0.00 C ATOM 309 C VAL A 17 2.459 -6.397 6.885 1.00 0.00 C ATOM 310 O VAL A 17 2.902 -6.017 7.976 1.00 0.00 O ATOM 311 CB VAL A 17 0.288 -5.276 6.088 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.586 -4.008 6.896 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.690 -5.019 4.634 1.00 0.00 C ATOM 0 H VAL A 17 0.707 -6.551 8.729 1.00 0.00 H new ATOM 0 HA VAL A 17 0.815 -7.319 5.894 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.780 -5.481 6.154 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.086 -3.156 6.434 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.222 -4.133 7.916 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.662 -3.832 6.913 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.201 -4.113 4.276 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.771 -4.896 4.572 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.385 -5.864 4.017 1.00 0.00 H new ATOM 323 N SER A 18 3.251 -6.700 5.857 1.00 0.00 N ATOM 324 CA SER A 18 4.719 -6.731 5.924 1.00 0.00 C ATOM 325 C SER A 18 5.331 -5.864 4.828 1.00 0.00 C ATOM 326 O SER A 18 4.923 -5.975 3.673 1.00 0.00 O ATOM 327 CB SER A 18 5.233 -8.169 5.787 1.00 0.00 C ATOM 328 OG SER A 18 4.660 -9.016 6.771 1.00 0.00 O ATOM 0 H SER A 18 2.887 -6.936 4.934 1.00 0.00 H new ATOM 0 HA SER A 18 5.017 -6.335 6.895 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.996 -8.549 4.793 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.319 -8.180 5.882 1.00 0.00 H new ATOM 0 HG SER A 18 5.004 -9.927 6.659 1.00 0.00 H new ATOM 334 N VAL A 19 6.304 -5.020 5.184 1.00 0.00 N ATOM 335 CA VAL A 19 6.997 -4.094 4.272 1.00 0.00 C ATOM 336 C VAL A 19 8.353 -4.637 3.850 1.00 0.00 C ATOM 337 O VAL A 19 9.161 -5.043 4.685 1.00 0.00 O ATOM 338 CB VAL A 19 7.161 -2.690 4.887 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.031 -1.754 4.031 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.802 -2.006 5.044 1.00 0.00 C ATOM 0 H VAL A 19 6.644 -4.957 6.143 1.00 0.00 H new ATOM 0 HA VAL A 19 6.367 -4.004 3.387 1.00 0.00 H new ATOM 0 HB VAL A 19 7.646 -2.854 5.850 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.108 -0.782 4.518 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.027 -2.184 3.919 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.576 -1.632 3.048 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.941 -1.017 5.480 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.328 -1.909 4.067 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.167 -2.604 5.697 1.00 0.00 H new ATOM 350 N TYR A 20 8.637 -4.533 2.556 1.00 0.00 N ATOM 351 CA TYR A 20 9.950 -4.770 1.969 1.00 0.00 C ATOM 352 C TYR A 20 10.295 -3.601 1.040 1.00 0.00 C ATOM 353 O TYR A 20 9.597 -3.342 0.058 1.00 0.00 O ATOM 354 CB TYR A 20 9.999 -6.128 1.233 1.00 0.00 C ATOM 355 CG TYR A 20 8.847 -7.084 1.501 1.00 0.00 C ATOM 356 CD1 TYR A 20 8.887 -7.959 2.605 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.721 -7.074 0.656 1.00 0.00 C ATOM 358 CE1 TYR A 20 7.809 -8.829 2.859 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.642 -7.941 0.905 1.00 0.00 C ATOM 360 CZ TYR A 20 6.684 -8.825 2.006 1.00 0.00 C ATOM 361 OH TYR A 20 5.649 -9.679 2.230 1.00 0.00 O ATOM 0 H TYR A 20 7.935 -4.272 1.864 1.00 0.00 H new ATOM 0 HA TYR A 20 10.699 -4.824 2.759 1.00 0.00 H new ATOM 0 HB2 TYR A 20 10.040 -5.934 0.161 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.929 -6.629 1.502 1.00 0.00 H new ATOM 0 HD1 TYR A 20 9.747 -7.962 3.258 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.686 -6.399 -0.186 1.00 0.00 H new ATOM 0 HE1 TYR A 20 7.843 -9.499 3.706 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.780 -7.931 0.254 1.00 0.00 H new ATOM 0 HH TYR A 20 5.722 -10.052 3.133 1.00 0.00 H new ATOM 371 N ARG A 21 11.389 -2.891 1.327 1.00 0.00 N ATOM 372 CA ARG A 21 11.994 -1.936 0.383 1.00 0.00 C ATOM 373 C ARG A 21 12.499 -2.688 -0.851 1.00 0.00 C ATOM 374 O ARG A 21 13.158 -3.724 -0.727 1.00 0.00 O ATOM 375 CB ARG A 21 13.111 -1.125 1.058 1.00 0.00 C ATOM 376 CG ARG A 21 12.543 -0.112 2.067 1.00 0.00 C ATOM 377 CD ARG A 21 13.652 0.744 2.692 1.00 0.00 C ATOM 378 NE ARG A 21 14.493 -0.047 3.608 1.00 0.00 N ATOM 379 CZ ARG A 21 15.586 0.329 4.240 1.00 0.00 C ATOM 380 NH1 ARG A 21 16.150 -0.519 5.046 1.00 0.00 N ATOM 381 NH2 ARG A 21 16.120 1.508 4.096 1.00 0.00 N ATOM 0 H ARG A 21 11.883 -2.959 2.217 1.00 0.00 H new ATOM 0 HA ARG A 21 11.238 -1.220 0.062 1.00 0.00 H new ATOM 0 HB2 ARG A 21 13.796 -1.802 1.568 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.689 -0.598 0.299 1.00 0.00 H new ATOM 0 HG2 ARG A 21 11.821 0.534 1.568 1.00 0.00 H new ATOM 0 HG3 ARG A 21 12.005 -0.643 2.853 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.272 1.170 1.903 1.00 0.00 H new ATOM 0 HD3 ARG A 21 13.207 1.579 3.234 1.00 0.00 H new ATOM 0 HE ARG A 21 14.191 -1.007 3.774 1.00 0.00 H new ATOM 0 HH11 ARG A 21 15.745 -1.446 5.175 1.00 0.00 H new ATOM 0 HH12 ARG A 21 16.997 -0.258 5.550 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.690 2.189 3.470 1.00 0.00 H new ATOM 0 HH22 ARG A 21 16.968 1.750 4.609 1.00 0.00 H new ATOM 395 N ILE A 22 12.149 -2.178 -2.031 1.00 0.00 N ATOM 396 CA ILE A 22 12.298 -2.872 -3.322 1.00 0.00 C ATOM 397 C ILE A 22 13.626 -2.532 -4.035 1.00 0.00 C ATOM 398 O ILE A 22 14.163 -1.436 -3.837 1.00 0.00 O ATOM 399 CB ILE A 22 11.063 -2.627 -4.226 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.871 -1.139 -4.598 1.00 0.00 C ATOM 401 CG2 ILE A 22 9.798 -3.212 -3.572 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.682 -0.910 -5.536 1.00 0.00 C ATOM 0 H ILE A 22 11.743 -1.247 -2.125 1.00 0.00 H new ATOM 0 HA ILE A 22 12.346 -3.940 -3.110 1.00 0.00 H new ATOM 0 HB ILE A 22 11.246 -3.147 -5.166 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.727 -0.557 -3.688 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.779 -0.768 -5.073 1.00 0.00 H new ATOM 0 HG21 ILE A 22 8.938 -3.033 -4.218 1.00 0.00 H new ATOM 0 HG22 ILE A 22 9.926 -4.285 -3.428 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.633 -2.733 -2.607 1.00 0.00 H new ATOM 0 HD11 ILE A 22 9.597 0.153 -5.762 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.835 -1.467 -6.460 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.767 -1.253 -5.054 1.00 0.00 H new ATOM 414 N PRO A 23 14.166 -3.438 -4.878 1.00 0.00 N ATOM 415 CA PRO A 23 15.325 -3.160 -5.738 1.00 0.00 C ATOM 416 C PRO A 23 15.040 -2.071 -6.797 1.00 0.00 C ATOM 417 O PRO A 23 13.873 -1.830 -7.128 1.00 0.00 O ATOM 418 CB PRO A 23 15.650 -4.501 -6.411 1.00 0.00 C ATOM 419 CG PRO A 23 14.292 -5.198 -6.461 1.00 0.00 C ATOM 420 CD PRO A 23 13.682 -4.791 -5.127 1.00 0.00 C ATOM 0 HA PRO A 23 16.156 -2.769 -5.150 1.00 0.00 H new ATOM 0 HB2 PRO A 23 16.069 -4.361 -7.408 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.377 -5.075 -5.837 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.691 -4.861 -7.305 1.00 0.00 H new ATOM 0 HG3 PRO A 23 14.391 -6.280 -6.552 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.593 -4.818 -5.168 1.00 0.00 H new ATOM 0 HD3 PRO A 23 13.988 -5.470 -4.331 1.00 0.00 H new ATOM 428 N PRO A 24 16.080 -1.445 -7.388 1.00 0.00 N ATOM 429 CA PRO A 24 15.928 -0.542 -8.532 1.00 0.00 C ATOM 430 C PRO A 24 15.399 -1.310 -9.755 1.00 0.00 C ATOM 431 O PRO A 24 16.040 -2.239 -10.261 1.00 0.00 O ATOM 432 CB PRO A 24 17.316 0.069 -8.759 1.00 0.00 C ATOM 433 CG PRO A 24 18.272 -0.992 -8.214 1.00 0.00 C ATOM 434 CD PRO A 24 17.490 -1.599 -7.050 1.00 0.00 C ATOM 0 HA PRO A 24 15.197 0.246 -8.353 1.00 0.00 H new ATOM 0 HB2 PRO A 24 17.498 0.268 -9.815 1.00 0.00 H new ATOM 0 HB3 PRO A 24 17.427 1.017 -8.232 1.00 0.00 H new ATOM 0 HG2 PRO A 24 18.517 -1.740 -8.968 1.00 0.00 H new ATOM 0 HG3 PRO A 24 19.213 -0.554 -7.882 1.00 0.00 H new ATOM 0 HD2 PRO A 24 17.746 -2.650 -6.914 1.00 0.00 H new ATOM 0 HD3 PRO A 24 17.725 -1.090 -6.115 1.00 0.00 H new ATOM 442 N ARG A 25 14.185 -0.958 -10.198 1.00 0.00 N ATOM 443 CA ARG A 25 13.367 -1.761 -11.124 1.00 0.00 C ATOM 444 C ARG A 25 12.404 -0.930 -11.973 1.00 0.00 C ATOM 445 O ARG A 25 11.990 0.163 -11.586 1.00 0.00 O ATOM 446 CB ARG A 25 12.538 -2.772 -10.298 1.00 0.00 C ATOM 447 CG ARG A 25 13.247 -4.079 -9.956 1.00 0.00 C ATOM 448 CD ARG A 25 13.511 -4.927 -11.198 1.00 0.00 C ATOM 449 NE ARG A 25 14.250 -6.142 -10.820 1.00 0.00 N ATOM 450 CZ ARG A 25 15.554 -6.276 -10.665 1.00 0.00 C ATOM 451 NH1 ARG A 25 16.032 -7.400 -10.222 1.00 0.00 N ATOM 452 NH2 ARG A 25 16.402 -5.315 -10.913 1.00 0.00 N ATOM 0 H ARG A 25 13.732 -0.088 -9.918 1.00 0.00 H new ATOM 0 HA ARG A 25 14.057 -2.252 -11.810 1.00 0.00 H new ATOM 0 HB2 ARG A 25 12.232 -2.291 -9.369 1.00 0.00 H new ATOM 0 HB3 ARG A 25 11.628 -3.006 -10.850 1.00 0.00 H new ATOM 0 HG2 ARG A 25 14.192 -3.860 -9.459 1.00 0.00 H new ATOM 0 HG3 ARG A 25 12.640 -4.647 -9.251 1.00 0.00 H new ATOM 0 HD2 ARG A 25 12.568 -5.196 -11.674 1.00 0.00 H new ATOM 0 HD3 ARG A 25 14.083 -4.353 -11.927 1.00 0.00 H new ATOM 0 HE ARG A 25 13.689 -6.979 -10.659 1.00 0.00 H new ATOM 0 HH11 ARG A 25 15.401 -8.169 -9.997 1.00 0.00 H new ATOM 0 HH12 ARG A 25 17.038 -7.513 -10.099 1.00 0.00 H new ATOM 0 HH21 ARG A 25 16.065 -4.410 -11.243 1.00 0.00 H new ATOM 0 HH22 ARG A 25 17.401 -5.469 -10.777 1.00 0.00 H new ATOM 466 N ALA A 26 11.973 -1.533 -13.081 1.00 0.00 N ATOM 467 CA ALA A 26 10.732 -1.187 -13.764 1.00 0.00 C ATOM 468 C ALA A 26 9.546 -1.881 -13.075 1.00 0.00 C ATOM 469 O ALA A 26 9.588 -3.077 -12.780 1.00 0.00 O ATOM 470 CB ALA A 26 10.830 -1.582 -15.240 1.00 0.00 C ATOM 0 H ALA A 26 12.487 -2.288 -13.535 1.00 0.00 H new ATOM 0 HA ALA A 26 10.569 -0.111 -13.710 1.00 0.00 H new ATOM 0 HB1 ALA A 26 9.901 -1.323 -15.749 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.659 -1.049 -15.705 1.00 0.00 H new ATOM 0 HB3 ALA A 26 10.999 -2.656 -15.319 1.00 0.00 H new ATOM 476 N SER A 27 8.474 -1.133 -12.854 1.00 0.00 N ATOM 477 CA SER A 27 7.280 -1.552 -12.113 1.00 0.00 C ATOM 478 C SER A 27 6.478 -2.635 -12.834 1.00 0.00 C ATOM 479 O SER A 27 6.425 -3.785 -12.398 1.00 0.00 O ATOM 480 CB SER A 27 6.413 -0.327 -11.793 1.00 0.00 C ATOM 481 OG SER A 27 6.071 0.387 -12.977 1.00 0.00 O ATOM 0 H SER A 27 8.404 -0.176 -13.199 1.00 0.00 H new ATOM 0 HA SER A 27 7.614 -2.007 -11.181 1.00 0.00 H new ATOM 0 HB2 SER A 27 5.504 -0.645 -11.282 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.949 0.332 -11.110 1.00 0.00 H new ATOM 0 HG SER A 27 5.517 1.161 -12.744 1.00 0.00 H new ATOM 487 N ASN A 28 5.921 -2.290 -13.994 1.00 0.00 N ATOM 488 CA ASN A 28 5.005 -3.136 -14.765 1.00 0.00 C ATOM 489 C ASN A 28 5.722 -4.255 -15.549 1.00 0.00 C ATOM 490 O ASN A 28 5.072 -5.072 -16.206 1.00 0.00 O ATOM 491 CB ASN A 28 4.130 -2.225 -15.650 1.00 0.00 C ATOM 492 CG ASN A 28 3.039 -1.509 -14.863 1.00 0.00 C ATOM 493 OD1 ASN A 28 1.867 -1.851 -14.946 1.00 0.00 O ATOM 494 ND2 ASN A 28 3.370 -0.508 -14.076 1.00 0.00 N ATOM 0 H ASN A 28 6.098 -1.389 -14.438 1.00 0.00 H new ATOM 0 HA ASN A 28 4.360 -3.683 -14.078 1.00 0.00 H new ATOM 0 HB2 ASN A 28 4.763 -1.485 -16.140 1.00 0.00 H new ATOM 0 HB3 ASN A 28 3.671 -2.823 -16.437 1.00 0.00 H new ATOM 0 HD21 ASN A 28 2.651 -0.022 -13.539 1.00 0.00 H new ATOM 0 HD22 ASN A 28 4.345 -0.218 -14.002 1.00 0.00 H new ATOM 501 N ARG A 29 7.060 -4.300 -15.468 1.00 0.00 N ATOM 502 CA ARG A 29 7.935 -5.286 -16.125 1.00 0.00 C ATOM 503 C ARG A 29 8.722 -6.162 -15.142 1.00 0.00 C ATOM 504 O ARG A 29 9.047 -7.297 -15.487 1.00 0.00 O ATOM 505 CB ARG A 29 8.896 -4.564 -17.078 1.00 0.00 C ATOM 506 CG ARG A 29 8.171 -3.647 -18.075 1.00 0.00 C ATOM 507 CD ARG A 29 9.170 -3.163 -19.126 1.00 0.00 C ATOM 508 NE ARG A 29 8.546 -2.235 -20.091 1.00 0.00 N ATOM 509 CZ ARG A 29 7.900 -2.545 -21.203 1.00 0.00 C ATOM 510 NH1 ARG A 29 7.411 -1.605 -21.962 1.00 0.00 N ATOM 511 NH2 ARG A 29 7.722 -3.777 -21.589 1.00 0.00 N ATOM 0 H ARG A 29 7.586 -3.621 -14.919 1.00 0.00 H new ATOM 0 HA ARG A 29 7.286 -5.963 -16.679 1.00 0.00 H new ATOM 0 HB2 ARG A 29 9.602 -3.973 -16.495 1.00 0.00 H new ATOM 0 HB3 ARG A 29 9.478 -5.303 -17.629 1.00 0.00 H new ATOM 0 HG2 ARG A 29 7.352 -4.184 -18.554 1.00 0.00 H new ATOM 0 HG3 ARG A 29 7.732 -2.796 -17.553 1.00 0.00 H new ATOM 0 HD2 ARG A 29 10.005 -2.666 -18.632 1.00 0.00 H new ATOM 0 HD3 ARG A 29 9.580 -4.020 -19.660 1.00 0.00 H new ATOM 0 HE ARG A 29 8.622 -1.241 -19.875 1.00 0.00 H new ATOM 0 HH11 ARG A 29 7.526 -0.626 -21.699 1.00 0.00 H new ATOM 0 HH12 ARG A 29 6.914 -1.848 -22.819 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.087 -4.546 -21.026 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.218 -3.973 -22.454 1.00 0.00 H new ATOM 525 N GLY A 30 9.042 -5.645 -13.949 1.00 0.00 N ATOM 526 CA GLY A 30 10.022 -6.259 -13.043 1.00 0.00 C ATOM 527 C GLY A 30 9.718 -6.243 -11.541 1.00 0.00 C ATOM 528 O GLY A 30 10.503 -6.810 -10.781 1.00 0.00 O ATOM 0 H GLY A 30 8.628 -4.787 -13.584 1.00 0.00 H new ATOM 0 HA2 GLY A 30 10.153 -7.298 -13.347 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.978 -5.759 -13.196 1.00 0.00 H new ATOM 532 N TYR A 31 8.603 -5.676 -11.074 1.00 0.00 N ATOM 533 CA TYR A 31 8.086 -5.988 -9.737 1.00 0.00 C ATOM 534 C TYR A 31 7.370 -7.346 -9.792 1.00 0.00 C ATOM 535 O TYR A 31 6.204 -7.392 -10.152 1.00 0.00 O ATOM 536 CB TYR A 31 7.098 -4.903 -9.278 1.00 0.00 C ATOM 537 CG TYR A 31 7.595 -3.490 -9.034 1.00 0.00 C ATOM 538 CD1 TYR A 31 8.944 -3.111 -9.200 1.00 0.00 C ATOM 539 CD2 TYR A 31 6.638 -2.526 -8.667 1.00 0.00 C ATOM 540 CE1 TYR A 31 9.313 -1.759 -9.053 1.00 0.00 C ATOM 541 CE2 TYR A 31 7.011 -1.181 -8.496 1.00 0.00 C ATOM 542 CZ TYR A 31 8.348 -0.788 -8.707 1.00 0.00 C ATOM 543 OH TYR A 31 8.693 0.522 -8.582 1.00 0.00 O ATOM 0 H TYR A 31 8.043 -5.003 -11.597 1.00 0.00 H new ATOM 0 HA TYR A 31 8.913 -6.026 -9.028 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.307 -4.846 -10.025 1.00 0.00 H new ATOM 0 HB3 TYR A 31 6.638 -5.251 -8.353 1.00 0.00 H new ATOM 0 HD1 TYR A 31 9.691 -3.854 -9.439 1.00 0.00 H new ATOM 0 HD2 TYR A 31 5.610 -2.821 -8.516 1.00 0.00 H new ATOM 0 HE1 TYR A 31 10.340 -1.464 -9.206 1.00 0.00 H new ATOM 0 HE2 TYR A 31 6.273 -0.449 -8.203 1.00 0.00 H new ATOM 0 HH TYR A 31 7.902 1.047 -8.340 1.00 0.00 H new ATOM 553 N ARG A 32 8.016 -8.461 -9.434 1.00 0.00 N ATOM 554 CA ARG A 32 7.395 -9.816 -9.490 1.00 0.00 C ATOM 555 C ARG A 32 7.100 -10.440 -8.134 1.00 0.00 C ATOM 556 O ARG A 32 6.958 -11.655 -8.040 1.00 0.00 O ATOM 557 CB ARG A 32 8.121 -10.782 -10.455 1.00 0.00 C ATOM 558 CG ARG A 32 9.555 -11.187 -10.083 1.00 0.00 C ATOM 559 CD ARG A 32 10.580 -10.245 -10.712 1.00 0.00 C ATOM 560 NE ARG A 32 10.690 -10.417 -12.174 1.00 0.00 N ATOM 561 CZ ARG A 32 11.573 -9.834 -12.964 1.00 0.00 C ATOM 562 NH1 ARG A 32 11.539 -10.041 -14.250 1.00 0.00 N ATOM 563 NH2 ARG A 32 12.499 -9.039 -12.512 1.00 0.00 N ATOM 0 H ARG A 32 8.979 -8.465 -9.097 1.00 0.00 H new ATOM 0 HA ARG A 32 6.411 -9.636 -9.923 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.523 -11.690 -10.540 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.144 -10.322 -11.443 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.668 -11.178 -8.999 1.00 0.00 H new ATOM 0 HG3 ARG A 32 9.744 -12.208 -10.415 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.303 -9.214 -10.491 1.00 0.00 H new ATOM 0 HD3 ARG A 32 11.555 -10.418 -10.256 1.00 0.00 H new ATOM 0 HE ARG A 32 10.020 -11.046 -12.616 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.829 -10.655 -14.649 1.00 0.00 H new ATOM 0 HH12 ARG A 32 12.222 -9.589 -14.858 1.00 0.00 H new ATOM 0 HH21 ARG A 32 12.562 -8.846 -11.512 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.162 -8.609 -13.157 1.00 0.00 H new ATOM 577 N ALA A 33 7.039 -9.614 -7.092 1.00 0.00 N ATOM 578 CA ALA A 33 7.070 -9.976 -5.672 1.00 0.00 C ATOM 579 C ALA A 33 8.342 -10.749 -5.241 1.00 0.00 C ATOM 580 O ALA A 33 9.032 -10.332 -4.316 1.00 0.00 O ATOM 581 CB ALA A 33 5.757 -10.688 -5.336 1.00 0.00 C ATOM 0 H ALA A 33 6.961 -8.605 -7.223 1.00 0.00 H new ATOM 0 HA ALA A 33 7.143 -9.067 -5.075 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.754 -10.969 -4.283 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.919 -10.020 -5.535 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.661 -11.583 -5.950 1.00 0.00 H new ATOM 587 N SER A 34 8.720 -11.811 -5.956 1.00 0.00 N ATOM 588 CA SER A 34 9.903 -12.653 -5.704 1.00 0.00 C ATOM 589 C SER A 34 11.253 -11.939 -5.885 1.00 0.00 C ATOM 590 O SER A 34 12.290 -12.468 -5.485 1.00 0.00 O ATOM 591 CB SER A 34 9.861 -13.890 -6.610 1.00 0.00 C ATOM 592 OG SER A 34 8.662 -14.622 -6.401 1.00 0.00 O ATOM 0 H SER A 34 8.187 -12.127 -6.767 1.00 0.00 H new ATOM 0 HA SER A 34 9.846 -12.927 -4.651 1.00 0.00 H new ATOM 0 HB2 SER A 34 9.930 -13.585 -7.654 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.722 -14.526 -6.406 1.00 0.00 H new ATOM 0 HG SER A 34 8.651 -15.407 -6.988 1.00 0.00 H new ATOM 598 N ASP A 35 11.259 -10.731 -6.463 1.00 0.00 N ATOM 599 CA ASP A 35 12.438 -9.854 -6.541 1.00 0.00 C ATOM 600 C ASP A 35 12.723 -9.125 -5.206 1.00 0.00 C ATOM 601 O ASP A 35 13.798 -8.551 -5.020 1.00 0.00 O ATOM 602 CB ASP A 35 12.236 -8.837 -7.686 1.00 0.00 C ATOM 603 CG ASP A 35 13.420 -8.761 -8.664 1.00 0.00 C ATOM 604 OD1 ASP A 35 13.183 -8.543 -9.873 1.00 0.00 O ATOM 605 OD2 ASP A 35 14.598 -8.878 -8.264 1.00 0.00 O ATOM 0 H ASP A 35 10.430 -10.327 -6.898 1.00 0.00 H new ATOM 0 HA ASP A 35 13.310 -10.476 -6.744 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.335 -9.102 -8.240 1.00 0.00 H new ATOM 0 HB3 ASP A 35 12.067 -7.849 -7.257 1.00 0.00 H new ATOM 610 N TRP A 36 11.757 -9.114 -4.279 1.00 0.00 N ATOM 611 CA TRP A 36 11.793 -8.385 -3.015 1.00 0.00 C ATOM 612 C TRP A 36 12.248 -9.284 -1.853 1.00 0.00 C ATOM 613 O TRP A 36 12.340 -10.509 -1.966 1.00 0.00 O ATOM 614 CB TRP A 36 10.400 -7.793 -2.735 1.00 0.00 C ATOM 615 CG TRP A 36 9.682 -7.058 -3.835 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.212 -6.563 -4.981 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.267 -6.699 -3.871 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.228 -5.936 -5.722 1.00 0.00 N ATOM 619 CE2 TRP A 36 8.027 -5.945 -5.056 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.161 -6.919 -3.017 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.783 -5.386 -5.352 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.900 -6.359 -3.303 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.717 -5.582 -4.460 1.00 0.00 C ATOM 0 H TRP A 36 10.891 -9.639 -4.400 1.00 0.00 H new ATOM 0 HA TRP A 36 12.523 -7.580 -3.097 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.755 -8.610 -2.410 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.497 -7.109 -1.892 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.249 -6.646 -5.271 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.375 -5.521 -6.642 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.285 -7.526 -2.132 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.642 -4.810 -6.255 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 5.071 -6.527 -2.631 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.755 -5.135 -4.663 1.00 0.00 H new ATOM 634 N LYS A 37 12.491 -8.666 -0.693 1.00 0.00 N ATOM 635 CA LYS A 37 12.931 -9.331 0.550 1.00 0.00 C ATOM 636 C LYS A 37 11.777 -9.987 1.323 1.00 0.00 C ATOM 637 O LYS A 37 11.551 -9.694 2.495 1.00 0.00 O ATOM 638 CB LYS A 37 13.710 -8.345 1.431 1.00 0.00 C ATOM 639 CG LYS A 37 14.937 -7.711 0.762 1.00 0.00 C ATOM 640 CD LYS A 37 15.873 -7.108 1.822 1.00 0.00 C ATOM 641 CE LYS A 37 15.155 -6.195 2.831 1.00 0.00 C ATOM 642 NZ LYS A 37 14.712 -4.916 2.217 1.00 0.00 N ATOM 0 H LYS A 37 12.385 -7.657 -0.584 1.00 0.00 H new ATOM 0 HA LYS A 37 13.594 -10.146 0.261 1.00 0.00 H new ATOM 0 HB2 LYS A 37 13.034 -7.550 1.746 1.00 0.00 H new ATOM 0 HB3 LYS A 37 14.034 -8.864 2.333 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.471 -8.463 0.181 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.619 -6.936 0.065 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.365 -7.917 2.363 1.00 0.00 H new ATOM 0 HD3 LYS A 37 16.655 -6.538 1.321 1.00 0.00 H new ATOM 0 HE2 LYS A 37 14.291 -6.718 3.240 1.00 0.00 H new ATOM 0 HE3 LYS A 37 15.823 -5.983 3.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 13.896 -4.543 2.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.490 -4.227 2.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 14.440 -5.082 1.227 1.00 0.00 H new ATOM 656 N LEU A 38 11.040 -10.883 0.671 1.00 0.00 N ATOM 657 CA LEU A 38 9.770 -11.445 1.166 1.00 0.00 C ATOM 658 C LEU A 38 9.846 -12.154 2.531 1.00 0.00 C ATOM 659 O LEU A 38 8.837 -12.236 3.233 1.00 0.00 O ATOM 660 CB LEU A 38 9.221 -12.434 0.127 1.00 0.00 C ATOM 661 CG LEU A 38 8.860 -11.821 -1.237 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.213 -12.904 -2.102 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.891 -10.644 -1.112 1.00 0.00 C ATOM 0 H LEU A 38 11.310 -11.253 -0.240 1.00 0.00 H new ATOM 0 HA LEU A 38 9.114 -10.587 1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.961 -13.219 -0.030 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.332 -12.912 0.539 1.00 0.00 H new ATOM 0 HG LEU A 38 9.778 -11.444 -1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.951 -12.485 -3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.914 -13.727 -2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.312 -13.272 -1.611 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.669 -10.248 -2.103 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.968 -10.981 -0.641 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.345 -9.862 -0.503 1.00 0.00 H new ATOM 675 N ASP A 39 11.023 -12.656 2.916 1.00 0.00 N ATOM 676 CA ASP A 39 11.253 -13.348 4.197 1.00 0.00 C ATOM 677 C ASP A 39 12.060 -12.493 5.196 1.00 0.00 C ATOM 678 O ASP A 39 12.327 -12.919 6.322 1.00 0.00 O ATOM 679 CB ASP A 39 11.890 -14.719 3.911 1.00 0.00 C ATOM 680 CG ASP A 39 11.820 -15.690 5.107 1.00 0.00 C ATOM 681 OD1 ASP A 39 12.832 -16.373 5.399 1.00 0.00 O ATOM 682 OD2 ASP A 39 10.731 -15.839 5.714 1.00 0.00 O ATOM 0 H ASP A 39 11.861 -12.594 2.338 1.00 0.00 H new ATOM 0 HA ASP A 39 10.297 -13.510 4.696 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.390 -15.172 3.055 1.00 0.00 H new ATOM 0 HB3 ASP A 39 12.933 -14.575 3.630 1.00 0.00 H new ATOM 687 N GLN A 40 12.429 -11.267 4.797 1.00 0.00 N ATOM 688 CA GLN A 40 13.180 -10.293 5.598 1.00 0.00 C ATOM 689 C GLN A 40 12.530 -8.905 5.544 1.00 0.00 C ATOM 690 O GLN A 40 13.021 -8.022 4.827 1.00 0.00 O ATOM 691 CB GLN A 40 14.636 -10.207 5.111 1.00 0.00 C ATOM 692 CG GLN A 40 15.501 -11.372 5.567 1.00 0.00 C ATOM 693 CD GLN A 40 15.316 -12.682 4.794 1.00 0.00 C ATOM 694 OE1 GLN A 40 15.268 -13.764 5.363 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.252 -12.661 3.475 1.00 0.00 N ATOM 0 H GLN A 40 12.202 -10.913 3.868 1.00 0.00 H new ATOM 0 HA GLN A 40 13.167 -10.636 6.633 1.00 0.00 H new ATOM 0 HB2 GLN A 40 14.644 -10.164 4.022 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.076 -9.277 5.470 1.00 0.00 H new ATOM 0 HG2 GLN A 40 16.547 -11.074 5.494 1.00 0.00 H new ATOM 0 HG3 GLN A 40 15.296 -11.562 6.621 1.00 0.00 H new ATOM 0 HE21 GLN A 40 15.290 -11.772 2.977 1.00 0.00 H new ATOM 0 HE22 GLN A 40 15.165 -13.534 2.955 1.00 0.00 H new ATOM 704 N PRO A 41 11.434 -8.670 6.288 1.00 0.00 N ATOM 705 CA PRO A 41 10.781 -7.380 6.225 1.00 0.00 C ATOM 706 C PRO A 41 11.617 -6.261 6.852 1.00 0.00 C ATOM 707 O PRO A 41 12.284 -6.450 7.873 1.00 0.00 O ATOM 708 CB PRO A 41 9.408 -7.533 6.896 1.00 0.00 C ATOM 709 CG PRO A 41 9.181 -9.047 6.892 1.00 0.00 C ATOM 710 CD PRO A 41 10.597 -9.610 7.019 1.00 0.00 C ATOM 0 HA PRO A 41 10.660 -7.076 5.185 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.408 -7.129 7.908 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.629 -7.008 6.343 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.546 -9.362 7.720 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.696 -9.380 5.974 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.902 -9.683 8.063 1.00 0.00 H new ATOM 0 HD3 PRO A 41 10.664 -10.612 6.596 1.00 0.00 H new ATOM 718 N ASP A 42 11.530 -5.068 6.271 1.00 0.00 N ATOM 719 CA ASP A 42 12.048 -3.832 6.868 1.00 0.00 C ATOM 720 C ASP A 42 11.199 -3.401 8.081 1.00 0.00 C ATOM 721 O ASP A 42 11.714 -2.789 9.020 1.00 0.00 O ATOM 722 CB ASP A 42 12.062 -2.733 5.797 1.00 0.00 C ATOM 723 CG ASP A 42 13.109 -3.005 4.717 1.00 0.00 C ATOM 724 OD1 ASP A 42 14.276 -2.580 4.875 1.00 0.00 O ATOM 725 OD2 ASP A 42 12.770 -3.599 3.669 1.00 0.00 O ATOM 0 H ASP A 42 11.093 -4.926 5.360 1.00 0.00 H new ATOM 0 HA ASP A 42 13.062 -4.006 7.229 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.076 -2.661 5.337 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.266 -1.771 6.267 1.00 0.00 H new ATOM 730 N TRP A 43 9.907 -3.753 8.070 1.00 0.00 N ATOM 731 CA TRP A 43 8.931 -3.530 9.141 1.00 0.00 C ATOM 732 C TRP A 43 7.724 -4.474 8.979 1.00 0.00 C ATOM 733 O TRP A 43 7.397 -4.885 7.862 1.00 0.00 O ATOM 734 CB TRP A 43 8.490 -2.058 9.089 1.00 0.00 C ATOM 735 CG TRP A 43 7.341 -1.659 9.963 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.422 -1.132 11.205 1.00 0.00 C ATOM 737 CD2 TRP A 43 5.921 -1.691 9.633 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.153 -0.809 11.653 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.193 -1.089 10.702 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.181 -2.156 8.527 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.806 -0.891 10.641 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.789 -1.955 8.456 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.101 -1.323 9.507 1.00 0.00 C ATOM 0 H TRP A 43 9.493 -4.228 7.268 1.00 0.00 H new ATOM 0 HA TRP A 43 9.382 -3.745 10.110 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.347 -1.439 9.353 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.230 -1.819 8.058 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.336 -0.986 11.762 1.00 0.00 H new ATOM 0 HE1 TRP A 43 5.952 -0.413 12.571 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.687 -2.672 7.725 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.286 -0.412 11.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.244 -2.290 7.586 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.034 -1.171 9.442 1.00 0.00 H new ATOM 754 N THR A 44 7.030 -4.790 10.077 1.00 0.00 N ATOM 755 CA THR A 44 5.711 -5.451 10.065 1.00 0.00 C ATOM 756 C THR A 44 4.728 -4.757 11.004 1.00 0.00 C ATOM 757 O THR A 44 5.111 -4.223 12.049 1.00 0.00 O ATOM 758 CB THR A 44 5.775 -6.942 10.429 1.00 0.00 C ATOM 759 OG1 THR A 44 6.351 -7.160 11.701 1.00 0.00 O ATOM 760 CG2 THR A 44 6.563 -7.764 9.421 1.00 0.00 C ATOM 0 H THR A 44 7.371 -4.592 11.018 1.00 0.00 H new ATOM 0 HA THR A 44 5.362 -5.370 9.036 1.00 0.00 H new ATOM 0 HB THR A 44 4.734 -7.267 10.429 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.662 -8.087 11.765 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.573 -8.809 9.732 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.096 -7.682 8.440 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.586 -7.391 9.368 1.00 0.00 H new ATOM 768 N GLY A 45 3.441 -4.797 10.658 1.00 0.00 N ATOM 769 CA GLY A 45 2.383 -4.174 11.454 1.00 0.00 C ATOM 770 C GLY A 45 0.997 -4.316 10.836 1.00 0.00 C ATOM 771 O GLY A 45 0.675 -5.354 10.256 1.00 0.00 O ATOM 0 H GLY A 45 3.102 -5.263 9.816 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.377 -4.620 12.449 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.609 -3.115 11.581 1.00 0.00 H new ATOM 775 N ARG A 46 0.176 -3.272 10.983 1.00 0.00 N ATOM 776 CA ARG A 46 -1.221 -3.211 10.534 1.00 0.00 C ATOM 777 C ARG A 46 -1.382 -2.306 9.313 1.00 0.00 C ATOM 778 O ARG A 46 -0.774 -1.237 9.224 1.00 0.00 O ATOM 779 CB ARG A 46 -2.143 -2.735 11.673 1.00 0.00 C ATOM 780 CG ARG A 46 -1.969 -3.512 12.989 1.00 0.00 C ATOM 781 CD ARG A 46 -3.081 -3.135 13.980 1.00 0.00 C ATOM 782 NE ARG A 46 -2.914 -3.807 15.286 1.00 0.00 N ATOM 783 CZ ARG A 46 -3.613 -3.574 16.383 1.00 0.00 C ATOM 784 NH1 ARG A 46 -3.258 -4.103 17.517 1.00 0.00 N ATOM 785 NH2 ARG A 46 -4.668 -2.809 16.383 1.00 0.00 N ATOM 0 H ARG A 46 0.478 -2.410 11.437 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.512 -4.221 10.245 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.955 -1.678 11.860 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.180 -2.821 11.347 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -1.995 -4.584 12.793 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.994 -3.291 13.424 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -3.084 -2.055 14.127 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -4.049 -3.402 13.557 1.00 0.00 H new ATOM 0 HE ARG A 46 -2.188 -4.521 15.346 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -2.434 -4.703 17.564 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -3.803 -3.918 18.359 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -4.978 -2.368 15.517 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -5.184 -2.651 17.249 1.00 0.00 H new ATOM 799 N LEU A 47 -2.258 -2.719 8.404 1.00 0.00 N ATOM 800 CA LEU A 47 -2.800 -1.897 7.324 1.00 0.00 C ATOM 801 C LEU A 47 -3.951 -1.042 7.863 1.00 0.00 C ATOM 802 O LEU A 47 -4.820 -1.565 8.564 1.00 0.00 O ATOM 803 CB LEU A 47 -3.310 -2.837 6.217 1.00 0.00 C ATOM 804 CG LEU A 47 -3.994 -2.123 5.036 1.00 0.00 C ATOM 805 CD1 LEU A 47 -2.992 -1.330 4.196 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.675 -3.161 4.154 1.00 0.00 C ATOM 0 H LEU A 47 -2.625 -3.671 8.397 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.033 -1.234 6.923 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.470 -3.418 5.836 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.015 -3.544 6.655 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.724 -1.422 5.441 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.513 -0.841 3.373 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.511 -0.576 4.819 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.237 -2.006 3.796 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.162 -2.663 3.315 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.931 -3.863 3.777 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.421 -3.701 4.737 1.00 0.00 H new ATOM 818 N ARG A 48 -4.014 0.231 7.464 1.00 0.00 N ATOM 819 CA ARG A 48 -5.168 1.113 7.694 1.00 0.00 C ATOM 820 C ARG A 48 -5.354 2.086 6.527 1.00 0.00 C ATOM 821 O ARG A 48 -4.828 3.198 6.510 1.00 0.00 O ATOM 822 CB ARG A 48 -5.010 1.793 9.064 1.00 0.00 C ATOM 823 CG ARG A 48 -6.198 2.705 9.410 1.00 0.00 C ATOM 824 CD ARG A 48 -6.497 2.659 10.914 1.00 0.00 C ATOM 825 NE ARG A 48 -7.509 3.658 11.292 1.00 0.00 N ATOM 826 CZ ARG A 48 -7.293 4.946 11.491 1.00 0.00 C ATOM 827 NH1 ARG A 48 -8.273 5.752 11.763 1.00 0.00 N ATOM 828 NH2 ARG A 48 -6.121 5.503 11.429 1.00 0.00 N ATOM 0 H ARG A 48 -3.252 0.689 6.963 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.092 0.536 7.728 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.906 1.029 9.835 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.092 2.380 9.071 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -5.976 3.729 9.109 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.079 2.392 8.849 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.847 1.663 11.186 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.579 2.839 11.474 1.00 0.00 H new ATOM 0 HE ARG A 48 -8.466 3.325 11.411 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.226 5.393 11.826 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -8.090 6.744 11.914 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -5.299 4.938 11.216 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.023 6.505 11.593 1.00 0.00 H new ATOM 842 N ILE A 49 -6.127 1.653 5.534 1.00 0.00 N ATOM 843 CA ILE A 49 -6.538 2.504 4.414 1.00 0.00 C ATOM 844 C ILE A 49 -7.618 3.464 4.908 1.00 0.00 C ATOM 845 O ILE A 49 -8.635 3.051 5.469 1.00 0.00 O ATOM 846 CB ILE A 49 -7.023 1.710 3.185 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.065 0.554 2.833 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.186 2.667 1.987 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.521 -0.244 1.610 1.00 0.00 C ATOM 0 H ILE A 49 -6.488 0.701 5.481 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.663 3.056 4.071 1.00 0.00 H new ATOM 0 HB ILE A 49 -7.987 1.262 3.426 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.070 0.957 2.647 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -5.983 -0.117 3.688 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.529 2.106 1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -7.917 3.437 2.233 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.228 3.135 1.762 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.808 -1.044 1.411 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.504 -0.674 1.802 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.577 0.416 0.745 1.00 0.00 H new ATOM 861 N THR A 50 -7.387 4.745 4.668 1.00 0.00 N ATOM 862 CA THR A 50 -8.264 5.875 4.984 1.00 0.00 C ATOM 863 C THR A 50 -8.398 6.783 3.754 1.00 0.00 C ATOM 864 O THR A 50 -7.760 6.546 2.729 1.00 0.00 O ATOM 865 CB THR A 50 -7.729 6.636 6.214 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.333 6.795 6.200 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.086 5.950 7.531 1.00 0.00 C ATOM 0 H THR A 50 -6.525 5.050 4.217 1.00 0.00 H new ATOM 0 HA THR A 50 -9.259 5.511 5.239 1.00 0.00 H new ATOM 0 HB THR A 50 -8.214 7.610 6.150 1.00 0.00 H new ATOM 0 HG1 THR A 50 -5.998 6.825 7.120 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.685 6.528 8.363 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.170 5.884 7.625 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.659 4.947 7.547 1.00 0.00 H new ATOM 875 N SER A 51 -9.254 7.805 3.797 1.00 0.00 N ATOM 876 CA SER A 51 -9.439 8.777 2.713 1.00 0.00 C ATOM 877 C SER A 51 -10.089 10.042 3.249 1.00 0.00 C ATOM 878 O SER A 51 -10.705 9.991 4.310 1.00 0.00 O ATOM 879 CB SER A 51 -10.315 8.160 1.616 1.00 0.00 C ATOM 880 OG SER A 51 -10.381 9.017 0.496 1.00 0.00 O ATOM 0 H SER A 51 -9.852 7.986 4.603 1.00 0.00 H new ATOM 0 HA SER A 51 -8.467 9.036 2.294 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.908 7.193 1.318 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.318 7.979 2.002 1.00 0.00 H new ATOM 0 HG SER A 51 -9.621 9.636 0.513 1.00 0.00 H new ATOM 886 N LYS A 52 -9.984 11.161 2.530 1.00 0.00 N ATOM 887 CA LYS A 52 -10.961 12.252 2.584 1.00 0.00 C ATOM 888 C LYS A 52 -11.068 12.986 1.243 1.00 0.00 C ATOM 889 O LYS A 52 -10.079 13.443 0.667 1.00 0.00 O ATOM 890 CB LYS A 52 -10.643 13.210 3.744 1.00 0.00 C ATOM 891 CG LYS A 52 -11.852 13.479 4.649 1.00 0.00 C ATOM 892 CD LYS A 52 -12.177 12.255 5.510 1.00 0.00 C ATOM 893 CE LYS A 52 -13.116 12.553 6.669 1.00 0.00 C ATOM 894 NZ LYS A 52 -14.539 12.577 6.247 1.00 0.00 N ATOM 0 H LYS A 52 -9.212 11.338 1.888 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.941 11.816 2.776 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.834 12.791 4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.282 14.155 3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -11.646 14.335 5.291 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -12.717 13.739 4.039 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -12.625 11.487 4.879 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -11.248 11.842 5.904 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -12.982 11.800 7.446 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.853 13.515 7.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -15.106 13.070 6.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -14.623 13.075 5.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -14.886 11.602 6.141 1.00 0.00 H new ATOM 908 N GLY A 53 -12.299 13.097 0.754 1.00 0.00 N ATOM 909 CA GLY A 53 -12.674 13.770 -0.486 1.00 0.00 C ATOM 910 C GLY A 53 -12.176 12.974 -1.683 1.00 0.00 C ATOM 911 O GLY A 53 -12.588 11.833 -1.901 1.00 0.00 O ATOM 0 H GLY A 53 -13.105 12.699 1.237 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.757 13.879 -0.537 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -12.252 14.775 -0.506 1.00 0.00 H new ATOM 915 N LYS A 54 -11.250 13.573 -2.425 1.00 0.00 N ATOM 916 CA LYS A 54 -10.573 12.984 -3.588 1.00 0.00 C ATOM 917 C LYS A 54 -9.135 12.538 -3.291 1.00 0.00 C ATOM 918 O LYS A 54 -8.372 12.272 -4.218 1.00 0.00 O ATOM 919 CB LYS A 54 -10.684 13.983 -4.745 1.00 0.00 C ATOM 920 CG LYS A 54 -12.119 14.064 -5.293 1.00 0.00 C ATOM 921 CD LYS A 54 -12.249 14.964 -6.530 1.00 0.00 C ATOM 922 CE LYS A 54 -11.911 16.430 -6.223 1.00 0.00 C ATOM 923 NZ LYS A 54 -12.100 17.296 -7.417 1.00 0.00 N ATOM 0 H LYS A 54 -10.933 14.523 -2.229 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.066 12.053 -3.869 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.368 14.969 -4.405 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.005 13.689 -5.546 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.461 13.060 -5.546 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -12.779 14.438 -4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -11.587 14.597 -7.314 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -13.266 14.901 -6.917 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -12.543 16.787 -5.410 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -10.879 16.502 -5.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.863 18.279 -7.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.479 16.970 -8.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -13.091 17.246 -7.729 1.00 0.00 H new ATOM 937 N THR A 55 -8.768 12.428 -2.014 1.00 0.00 N ATOM 938 CA THR A 55 -7.436 11.990 -1.580 1.00 0.00 C ATOM 939 C THR A 55 -7.543 10.793 -0.640 1.00 0.00 C ATOM 940 O THR A 55 -7.962 10.937 0.508 1.00 0.00 O ATOM 941 CB THR A 55 -6.663 13.128 -0.903 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.711 14.307 -1.686 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.189 12.753 -0.761 1.00 0.00 C ATOM 0 H THR A 55 -9.395 12.643 -1.239 1.00 0.00 H new ATOM 0 HA THR A 55 -6.883 11.691 -2.470 1.00 0.00 H new ATOM 0 HB THR A 55 -7.124 13.296 0.070 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.213 15.020 -1.234 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.651 13.569 -0.279 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.100 11.851 -0.155 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.763 12.571 -1.748 1.00 0.00 H new ATOM 951 N ALA A 56 -7.138 9.614 -1.115 1.00 0.00 N ATOM 952 CA ALA A 56 -7.004 8.418 -0.288 1.00 0.00 C ATOM 953 C ALA A 56 -5.634 8.379 0.405 1.00 0.00 C ATOM 954 O ALA A 56 -4.689 9.038 -0.026 1.00 0.00 O ATOM 955 CB ALA A 56 -7.301 7.170 -1.119 1.00 0.00 C ATOM 0 H ALA A 56 -6.892 9.463 -2.093 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.742 8.446 0.514 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.198 6.283 -0.493 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.318 7.225 -1.507 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.598 7.111 -1.950 1.00 0.00 H new ATOM 961 N TYR A 57 -5.531 7.605 1.481 1.00 0.00 N ATOM 962 CA TYR A 57 -4.387 7.544 2.386 1.00 0.00 C ATOM 963 C TYR A 57 -4.153 6.085 2.823 1.00 0.00 C ATOM 964 O TYR A 57 -4.838 5.576 3.711 1.00 0.00 O ATOM 965 CB TYR A 57 -4.677 8.448 3.604 1.00 0.00 C ATOM 966 CG TYR A 57 -4.946 9.921 3.323 1.00 0.00 C ATOM 967 CD1 TYR A 57 -3.895 10.745 2.876 1.00 0.00 C ATOM 968 CD2 TYR A 57 -6.226 10.481 3.545 1.00 0.00 C ATOM 969 CE1 TYR A 57 -4.119 12.117 2.637 1.00 0.00 C ATOM 970 CE2 TYR A 57 -6.455 11.847 3.292 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.403 12.669 2.839 1.00 0.00 C ATOM 972 OH TYR A 57 -5.630 13.993 2.612 1.00 0.00 O ATOM 0 H TYR A 57 -6.280 6.972 1.760 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.484 7.896 1.887 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.540 8.040 4.131 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.828 8.382 4.284 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.913 10.325 2.715 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.030 9.859 3.910 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -3.308 12.746 2.299 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.439 12.266 3.445 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.569 14.201 2.800 1.00 0.00 H new ATOM 982 N ILE A 58 -3.182 5.383 2.229 1.00 0.00 N ATOM 983 CA ILE A 58 -2.755 4.065 2.730 1.00 0.00 C ATOM 984 C ILE A 58 -1.823 4.318 3.912 1.00 0.00 C ATOM 985 O ILE A 58 -0.629 4.558 3.715 1.00 0.00 O ATOM 986 CB ILE A 58 -2.107 3.170 1.640 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.058 2.775 0.488 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.607 1.852 2.266 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.303 3.876 -0.544 1.00 0.00 C ATOM 0 H ILE A 58 -2.676 5.701 1.403 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.627 3.493 3.047 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.301 3.777 1.228 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.647 1.903 -0.021 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.016 2.474 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.154 1.231 1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.866 2.072 3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.447 1.320 2.713 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.982 3.509 -1.314 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.746 4.743 -0.053 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.356 4.163 -1.002 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.364 4.308 5.137 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.570 4.425 6.369 1.00 0.00 C ATOM 1003 C LYS A 59 -1.161 3.044 6.895 1.00 0.00 C ATOM 1004 O LYS A 59 -1.955 2.102 6.895 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.307 5.276 7.421 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.828 6.594 6.820 1.00 0.00 C ATOM 1007 CD LYS A 59 -3.151 7.659 7.872 1.00 0.00 C ATOM 1008 CE LYS A 59 -3.815 8.861 7.189 1.00 0.00 C ATOM 1009 NZ LYS A 59 -4.104 9.949 8.156 1.00 0.00 N ATOM 0 H LYS A 59 -3.366 4.218 5.303 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.644 4.952 6.138 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.142 4.707 7.830 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.634 5.494 8.250 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -2.082 6.990 6.131 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.725 6.388 6.235 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.814 7.246 8.632 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -2.239 7.973 8.380 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -3.163 9.238 6.401 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.742 8.543 6.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -4.613 10.716 7.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.690 9.578 8.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -3.211 10.316 8.543 1.00 0.00 H new ATOM 1023 N LEU A 60 0.085 2.926 7.338 1.00 0.00 N ATOM 1024 CA LEU A 60 0.657 1.749 7.999 1.00 0.00 C ATOM 1025 C LEU A 60 0.920 2.073 9.473 1.00 0.00 C ATOM 1026 O LEU A 60 1.538 3.092 9.784 1.00 0.00 O ATOM 1027 CB LEU A 60 1.944 1.332 7.266 1.00 0.00 C ATOM 1028 CG LEU A 60 1.753 0.224 6.217 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.711 0.538 5.143 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.082 -0.011 5.506 1.00 0.00 C ATOM 0 H LEU A 60 0.761 3.684 7.243 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.039 0.911 7.960 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.368 2.209 6.776 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.673 0.995 8.003 1.00 0.00 H new ATOM 0 HG LEU A 60 1.398 -0.648 6.766 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.643 -0.298 4.447 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.259 0.699 5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.005 1.438 4.602 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.961 -0.795 4.759 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.401 0.910 5.018 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.835 -0.316 6.233 1.00 0.00 H new ATOM 1042 N GLU A 61 0.454 1.217 10.381 1.00 0.00 N ATOM 1043 CA GLU A 61 0.422 1.489 11.827 1.00 0.00 C ATOM 1044 C GLU A 61 0.963 0.312 12.652 1.00 0.00 C ATOM 1045 O GLU A 61 0.800 -0.852 12.289 1.00 0.00 O ATOM 1046 CB GLU A 61 -1.006 1.859 12.268 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.478 3.209 11.695 1.00 0.00 C ATOM 1048 CD GLU A 61 -2.928 3.568 12.085 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.435 3.106 13.135 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.578 4.336 11.332 1.00 0.00 O ATOM 0 H GLU A 61 0.081 0.300 10.135 1.00 0.00 H new ATOM 0 HA GLU A 61 1.081 2.336 12.016 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.694 1.075 11.951 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -1.046 1.898 13.357 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.810 3.997 12.044 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.398 3.182 10.608 1.00 0.00 H new ATOM 1057 N ASP A 62 1.628 0.598 13.772 1.00 0.00 N ATOM 1058 CA ASP A 62 2.256 -0.405 14.627 1.00 0.00 C ATOM 1059 C ASP A 62 1.214 -1.282 15.329 1.00 0.00 C ATOM 1060 O ASP A 62 0.229 -0.796 15.892 1.00 0.00 O ATOM 1061 CB ASP A 62 3.133 0.302 15.657 1.00 0.00 C ATOM 1062 CG ASP A 62 4.009 -0.696 16.416 1.00 0.00 C ATOM 1063 OD1 ASP A 62 3.484 -1.304 17.374 1.00 0.00 O ATOM 1064 OD2 ASP A 62 5.186 -0.894 16.034 1.00 0.00 O ATOM 0 H ASP A 62 1.746 1.551 14.115 1.00 0.00 H new ATOM 0 HA ASP A 62 2.865 -1.062 14.005 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.764 1.037 15.158 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.504 0.847 16.361 1.00 0.00 H new ATOM 1069 N LYS A 63 1.466 -2.589 15.337 1.00 0.00 N ATOM 1070 CA LYS A 63 0.553 -3.609 15.867 1.00 0.00 C ATOM 1071 C LYS A 63 0.470 -3.705 17.389 1.00 0.00 C ATOM 1072 O LYS A 63 -0.408 -4.411 17.891 1.00 0.00 O ATOM 1073 CB LYS A 63 0.844 -4.974 15.204 1.00 0.00 C ATOM 1074 CG LYS A 63 2.345 -5.304 15.225 1.00 0.00 C ATOM 1075 CD LYS A 63 2.660 -6.708 14.704 1.00 0.00 C ATOM 1076 CE LYS A 63 4.139 -6.754 14.302 1.00 0.00 C ATOM 1077 NZ LYS A 63 4.522 -8.070 13.732 1.00 0.00 N ATOM 0 H LYS A 63 2.331 -2.982 14.967 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.448 -3.276 15.594 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.291 -5.757 15.724 1.00 0.00 H new ATOM 0 HB3 LYS A 63 0.488 -4.962 14.174 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.880 -4.571 14.622 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.717 -5.210 16.245 1.00 0.00 H new ATOM 0 HD2 LYS A 63 2.452 -7.453 15.472 1.00 0.00 H new ATOM 0 HD3 LYS A 63 2.027 -6.946 13.849 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.340 -5.971 13.571 1.00 0.00 H new ATOM 0 HE3 LYS A 63 4.758 -6.543 15.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 5.191 -7.928 12.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 4.971 -8.650 14.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 3.673 -8.555 13.378 1.00 0.00 H new ATOM 1091 N VAL A 64 1.324 -2.982 18.109 1.00 0.00 N ATOM 1092 CA VAL A 64 1.364 -2.933 19.575 1.00 0.00 C ATOM 1093 C VAL A 64 1.120 -1.515 20.095 1.00 0.00 C ATOM 1094 O VAL A 64 0.344 -1.342 21.039 1.00 0.00 O ATOM 1095 CB VAL A 64 2.717 -3.485 20.068 1.00 0.00 C ATOM 1096 CG1 VAL A 64 2.889 -3.373 21.588 1.00 0.00 C ATOM 1097 CG2 VAL A 64 2.886 -4.963 19.688 1.00 0.00 C ATOM 0 H VAL A 64 2.034 -2.392 17.676 1.00 0.00 H new ATOM 0 HA VAL A 64 0.561 -3.556 19.970 1.00 0.00 H new ATOM 0 HB VAL A 64 3.473 -2.871 19.579 1.00 0.00 H new ATOM 0 HG11 VAL A 64 3.860 -3.777 21.875 1.00 0.00 H new ATOM 0 HG12 VAL A 64 2.830 -2.326 21.885 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.100 -3.936 22.086 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.849 -5.324 20.049 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.086 -5.549 20.141 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.843 -5.067 18.604 1.00 0.00 H new ATOM 1107 N SER A 65 1.730 -0.499 19.479 1.00 0.00 N ATOM 1108 CA SER A 65 1.658 0.893 19.955 1.00 0.00 C ATOM 1109 C SER A 65 0.565 1.720 19.268 1.00 0.00 C ATOM 1110 O SER A 65 0.156 2.759 19.790 1.00 0.00 O ATOM 1111 CB SER A 65 3.016 1.582 19.778 1.00 0.00 C ATOM 1112 OG SER A 65 4.009 0.941 20.566 1.00 0.00 O ATOM 0 H SER A 65 2.290 -0.614 18.634 1.00 0.00 H new ATOM 0 HA SER A 65 1.394 0.841 21.011 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.307 1.559 18.728 1.00 0.00 H new ATOM 0 HB3 SER A 65 2.938 2.631 20.065 1.00 0.00 H new ATOM 0 HG SER A 65 4.869 1.393 20.439 1.00 0.00 H new ATOM 1118 N GLY A 66 0.095 1.282 18.095 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.899 1.995 17.278 1.00 0.00 C ATOM 1120 C GLY A 66 -0.349 3.258 16.599 1.00 0.00 C ATOM 1121 O GLY A 66 -1.117 4.106 16.144 1.00 0.00 O ATOM 0 H GLY A 66 0.400 0.403 17.676 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.280 1.319 16.513 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.744 2.271 17.909 1.00 0.00 H new ATOM 1125 N GLU A 67 0.977 3.411 16.565 1.00 0.00 N ATOM 1126 CA GLU A 67 1.678 4.587 16.048 1.00 0.00 C ATOM 1127 C GLU A 67 1.948 4.482 14.537 1.00 0.00 C ATOM 1128 O GLU A 67 2.088 3.382 14.001 1.00 0.00 O ATOM 1129 CB GLU A 67 2.947 4.833 16.883 1.00 0.00 C ATOM 1130 CG GLU A 67 4.096 3.848 16.630 1.00 0.00 C ATOM 1131 CD GLU A 67 5.316 4.195 17.506 1.00 0.00 C ATOM 1132 OE1 GLU A 67 5.410 3.691 18.651 1.00 0.00 O ATOM 1133 OE2 GLU A 67 6.189 4.978 17.058 1.00 0.00 O ATOM 0 H GLU A 67 1.614 2.693 16.909 1.00 0.00 H new ATOM 0 HA GLU A 67 1.037 5.462 16.154 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.305 5.843 16.682 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.681 4.793 17.939 1.00 0.00 H new ATOM 0 HG2 GLU A 67 3.765 2.832 16.846 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.379 3.874 15.578 1.00 0.00 H new ATOM 1140 N LEU A 68 2.026 5.615 13.837 1.00 0.00 N ATOM 1141 CA LEU A 68 2.216 5.646 12.382 1.00 0.00 C ATOM 1142 C LEU A 68 3.650 5.241 11.992 1.00 0.00 C ATOM 1143 O LEU A 68 4.622 5.849 12.450 1.00 0.00 O ATOM 1144 CB LEU A 68 1.849 7.048 11.854 1.00 0.00 C ATOM 1145 CG LEU A 68 1.791 7.141 10.316 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.541 6.462 9.756 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.758 8.602 9.870 1.00 0.00 C ATOM 0 H LEU A 68 1.959 6.540 14.262 1.00 0.00 H new ATOM 0 HA LEU A 68 1.555 4.914 11.918 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.881 7.337 12.262 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.579 7.768 12.224 1.00 0.00 H new ATOM 0 HG LEU A 68 2.682 6.639 9.939 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.536 6.548 8.669 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.543 5.409 10.036 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.348 6.944 10.163 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.717 8.649 8.782 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.877 9.090 10.288 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.656 9.110 10.222 1.00 0.00 H new ATOM 1159 N PHE A 69 3.780 4.257 11.098 1.00 0.00 N ATOM 1160 CA PHE A 69 5.042 3.894 10.443 1.00 0.00 C ATOM 1161 C PHE A 69 5.282 4.759 9.197 1.00 0.00 C ATOM 1162 O PHE A 69 6.300 5.447 9.098 1.00 0.00 O ATOM 1163 CB PHE A 69 5.033 2.394 10.103 1.00 0.00 C ATOM 1164 CG PHE A 69 6.144 1.962 9.159 1.00 0.00 C ATOM 1165 CD1 PHE A 69 7.481 1.951 9.602 1.00 0.00 C ATOM 1166 CD2 PHE A 69 5.851 1.617 7.824 1.00 0.00 C ATOM 1167 CE1 PHE A 69 8.516 1.597 8.717 1.00 0.00 C ATOM 1168 CE2 PHE A 69 6.888 1.282 6.936 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.221 1.265 7.383 1.00 0.00 C ATOM 0 H PHE A 69 2.995 3.677 10.802 1.00 0.00 H new ATOM 0 HA PHE A 69 5.869 4.086 11.126 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.115 1.823 11.028 1.00 0.00 H new ATOM 0 HB3 PHE A 69 4.072 2.140 9.655 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.712 2.215 10.623 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.827 1.610 7.482 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.539 1.580 9.063 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.660 1.037 5.909 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.016 0.998 6.703 1.00 0.00 H new ATOM 1179 N ALA A 70 4.328 4.741 8.261 1.00 0.00 N ATOM 1180 CA ALA A 70 4.369 5.476 6.998 1.00 0.00 C ATOM 1181 C ALA A 70 2.949 5.710 6.452 1.00 0.00 C ATOM 1182 O ALA A 70 2.008 5.017 6.845 1.00 0.00 O ATOM 1183 CB ALA A 70 5.212 4.667 6.000 1.00 0.00 C ATOM 0 H ALA A 70 3.475 4.193 8.369 1.00 0.00 H new ATOM 0 HA ALA A 70 4.818 6.457 7.155 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.257 5.197 5.048 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.221 4.542 6.393 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.757 3.688 5.849 1.00 0.00 H new ATOM 1189 N GLN A 71 2.789 6.655 5.519 1.00 0.00 N ATOM 1190 CA GLN A 71 1.526 6.860 4.798 1.00 0.00 C ATOM 1191 C GLN A 71 1.737 7.251 3.331 1.00 0.00 C ATOM 1192 O GLN A 71 2.615 8.056 3.023 1.00 0.00 O ATOM 1193 CB GLN A 71 0.630 7.861 5.548 1.00 0.00 C ATOM 1194 CG GLN A 71 1.141 9.314 5.596 1.00 0.00 C ATOM 1195 CD GLN A 71 0.644 10.187 4.443 1.00 0.00 C ATOM 1196 OE1 GLN A 71 -0.495 10.113 4.000 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.460 11.075 3.925 1.00 0.00 N ATOM 0 H GLN A 71 3.530 7.299 5.242 1.00 0.00 H new ATOM 0 HA GLN A 71 1.007 5.902 4.771 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.355 7.858 5.082 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.500 7.508 6.571 1.00 0.00 H new ATOM 0 HG2 GLN A 71 0.833 9.766 6.539 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.231 9.305 5.588 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.414 11.157 4.276 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.140 11.683 3.171 1.00 0.00 H new ATOM 1206 N ALA A 72 0.923 6.692 2.433 1.00 0.00 N ATOM 1207 CA ALA A 72 0.936 6.981 0.999 1.00 0.00 C ATOM 1208 C ALA A 72 -0.367 7.691 0.564 1.00 0.00 C ATOM 1209 O ALA A 72 -1.419 7.042 0.512 1.00 0.00 O ATOM 1210 CB ALA A 72 1.199 5.676 0.238 1.00 0.00 C ATOM 0 H ALA A 72 0.215 6.005 2.693 1.00 0.00 H new ATOM 0 HA ALA A 72 1.740 7.678 0.760 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.212 5.876 -0.833 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.162 5.265 0.542 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.411 4.958 0.464 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.325 9.007 0.266 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.463 9.763 -0.247 1.00 0.00 C ATOM 1218 C PRO A 73 -1.656 9.529 -1.754 1.00 0.00 C ATOM 1219 O PRO A 73 -0.688 9.483 -2.517 1.00 0.00 O ATOM 1220 CB PRO A 73 -1.157 11.227 0.081 1.00 0.00 C ATOM 1221 CG PRO A 73 0.366 11.288 -0.003 1.00 0.00 C ATOM 1222 CD PRO A 73 0.804 9.903 0.478 1.00 0.00 C ATOM 0 HA PRO A 73 -2.402 9.449 0.209 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.628 11.906 -0.630 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.518 11.502 1.072 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.705 11.486 -1.020 1.00 0.00 H new ATOM 0 HG3 PRO A 73 0.772 12.079 0.628 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.679 9.560 -0.075 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.084 9.930 1.531 1.00 0.00 H new ATOM 1230 N VAL A 74 -2.913 9.403 -2.185 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.318 8.996 -3.542 1.00 0.00 C ATOM 1232 C VAL A 74 -4.428 9.919 -4.053 1.00 0.00 C ATOM 1233 O VAL A 74 -5.483 10.004 -3.430 1.00 0.00 O ATOM 1234 CB VAL A 74 -3.827 7.532 -3.560 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.781 6.958 -4.979 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -3.074 6.571 -2.635 1.00 0.00 C ATOM 0 H VAL A 74 -3.712 9.588 -1.578 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.444 9.070 -4.189 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.849 7.601 -3.186 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.143 5.930 -4.967 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.413 7.557 -5.635 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.755 6.978 -5.346 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.504 5.573 -2.719 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.023 6.538 -2.922 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.158 6.917 -1.605 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.229 10.597 -5.185 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.231 11.526 -5.756 1.00 0.00 C ATOM 1248 C GLU A 75 -6.231 10.844 -6.714 1.00 0.00 C ATOM 1249 O GLU A 75 -7.287 11.397 -7.026 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.518 12.692 -6.459 1.00 0.00 C ATOM 1251 CG GLU A 75 -3.728 13.571 -5.480 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.111 14.782 -6.206 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -3.765 15.852 -6.282 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -1.961 14.679 -6.701 1.00 0.00 O ATOM 0 H GLU A 75 -3.374 10.524 -5.737 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.825 11.900 -4.922 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.841 12.297 -7.216 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.255 13.304 -6.979 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.386 13.916 -4.682 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.940 12.982 -5.011 1.00 0.00 H new ATOM 1261 N GLN A 76 -5.892 9.644 -7.195 1.00 0.00 N ATOM 1262 CA GLN A 76 -6.720 8.764 -8.025 1.00 0.00 C ATOM 1263 C GLN A 76 -6.154 7.334 -8.010 1.00 0.00 C ATOM 1264 O GLN A 76 -4.932 7.166 -8.065 1.00 0.00 O ATOM 1265 CB GLN A 76 -6.838 9.303 -9.470 1.00 0.00 C ATOM 1266 CG GLN A 76 -5.586 9.241 -10.370 1.00 0.00 C ATOM 1267 CD GLN A 76 -4.398 10.069 -9.878 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -4.232 11.235 -10.211 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -3.519 9.500 -9.077 1.00 0.00 N ATOM 0 H GLN A 76 -4.977 9.237 -7.004 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.725 8.742 -7.605 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -7.635 8.751 -9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.158 10.344 -9.413 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.273 8.201 -10.461 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -5.858 9.580 -11.370 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.644 8.529 -8.791 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -2.714 10.031 -8.744 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.015 6.314 -7.988 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.628 4.902 -8.079 1.00 0.00 C ATOM 1280 C TYR A 77 -7.394 4.188 -9.213 1.00 0.00 C ATOM 1281 O TYR A 77 -8.626 4.268 -9.230 1.00 0.00 O ATOM 1282 CB TYR A 77 -6.865 4.198 -6.738 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.408 2.756 -6.748 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -5.036 2.470 -6.858 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -7.347 1.707 -6.731 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -4.601 1.139 -6.985 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -6.911 0.371 -6.822 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.536 0.082 -6.957 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.123 -1.208 -7.074 1.00 0.00 O ATOM 0 H TYR A 77 -8.023 6.448 -7.905 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.565 4.855 -8.314 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.337 4.737 -5.951 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -7.927 4.237 -6.494 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.315 3.274 -6.845 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.401 1.927 -6.648 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -3.549 0.925 -7.104 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.630 -0.434 -6.788 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.220 -1.297 -6.703 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.720 3.491 -10.153 1.00 0.00 N ATOM 1300 CA PRO A 78 -5.262 3.378 -10.312 1.00 0.00 C ATOM 1301 C PRO A 78 -4.553 4.718 -10.579 1.00 0.00 C ATOM 1302 O PRO A 78 -5.121 5.616 -11.208 1.00 0.00 O ATOM 1303 CB PRO A 78 -5.042 2.390 -11.465 1.00 0.00 C ATOM 1304 CG PRO A 78 -6.320 1.555 -11.461 1.00 0.00 C ATOM 1305 CD PRO A 78 -7.377 2.590 -11.090 1.00 0.00 C ATOM 0 HA PRO A 78 -4.819 3.031 -9.378 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -4.901 2.905 -12.415 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.158 1.773 -11.303 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -6.515 1.104 -12.434 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.273 0.742 -10.736 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.728 3.127 -11.971 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.248 2.117 -10.636 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.320 4.848 -10.084 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.491 6.056 -10.194 1.00 0.00 C ATOM 1315 C GLY A 79 -1.082 5.900 -9.599 1.00 0.00 C ATOM 1316 O GLY A 79 -0.612 4.787 -9.366 1.00 0.00 O ATOM 0 H GLY A 79 -2.854 4.094 -9.580 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.403 6.330 -11.245 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.998 6.880 -9.692 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.394 7.022 -9.357 1.00 0.00 N ATOM 1321 CA ILE A 80 1.051 7.062 -9.043 1.00 0.00 C ATOM 1322 C ILE A 80 1.450 6.383 -7.722 1.00 0.00 C ATOM 1323 O ILE A 80 2.492 5.733 -7.649 1.00 0.00 O ATOM 1324 CB ILE A 80 1.550 8.529 -9.099 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.069 8.692 -8.863 1.00 0.00 C ATOM 1326 CG2 ILE A 80 0.827 9.458 -8.102 1.00 0.00 C ATOM 1327 CD1 ILE A 80 3.951 7.940 -9.863 1.00 0.00 C ATOM 0 H ILE A 80 -0.827 7.946 -9.373 1.00 0.00 H new ATOM 0 HA ILE A 80 1.546 6.464 -9.808 1.00 0.00 H new ATOM 0 HB ILE A 80 1.315 8.821 -10.122 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.318 9.752 -8.903 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.307 8.347 -7.857 1.00 0.00 H new ATOM 0 HG21 ILE A 80 1.224 10.469 -8.193 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -0.241 9.466 -8.321 1.00 0.00 H new ATOM 0 HG23 ILE A 80 0.986 9.096 -7.086 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.000 8.110 -9.622 1.00 0.00 H new ATOM 0 HD12 ILE A 80 3.735 6.873 -9.808 1.00 0.00 H new ATOM 0 HD13 ILE A 80 3.747 8.300 -10.871 1.00 0.00 H new ATOM 1339 N ALA A 81 0.640 6.521 -6.670 1.00 0.00 N ATOM 1340 CA ALA A 81 1.016 6.148 -5.302 1.00 0.00 C ATOM 1341 C ALA A 81 0.623 4.721 -4.897 1.00 0.00 C ATOM 1342 O ALA A 81 0.826 4.359 -3.739 1.00 0.00 O ATOM 1343 CB ALA A 81 0.499 7.233 -4.353 1.00 0.00 C ATOM 0 H ALA A 81 -0.305 6.898 -6.743 1.00 0.00 H new ATOM 0 HA ALA A 81 2.103 6.106 -5.239 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.767 6.977 -3.328 1.00 0.00 H new ATOM 0 HB2 ALA A 81 0.947 8.191 -4.617 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.585 7.304 -4.438 1.00 0.00 H new ATOM 1349 N VAL A 82 0.104 3.910 -5.827 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.288 2.507 -5.595 1.00 0.00 C ATOM 1351 C VAL A 82 -0.153 1.691 -6.888 1.00 0.00 C ATOM 1352 O VAL A 82 -0.763 2.021 -7.904 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.744 2.388 -5.097 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -2.075 0.944 -4.689 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.123 3.292 -3.920 1.00 0.00 C ATOM 0 H VAL A 82 -0.061 4.215 -6.786 1.00 0.00 H new ATOM 0 HA VAL A 82 0.381 2.119 -4.827 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.326 2.718 -5.958 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.107 0.891 -4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.946 0.285 -5.547 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.407 0.630 -3.887 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.167 3.125 -3.654 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.489 3.060 -3.064 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.983 4.335 -4.203 1.00 0.00 H new ATOM 1365 N GLU A 83 0.610 0.601 -6.841 1.00 0.00 N ATOM 1366 CA GLU A 83 0.906 -0.290 -7.971 1.00 0.00 C ATOM 1367 C GLU A 83 0.911 -1.775 -7.592 1.00 0.00 C ATOM 1368 O GLU A 83 1.020 -2.134 -6.421 1.00 0.00 O ATOM 1369 CB GLU A 83 2.263 0.092 -8.596 1.00 0.00 C ATOM 1370 CG GLU A 83 2.078 1.014 -9.802 1.00 0.00 C ATOM 1371 CD GLU A 83 1.571 0.289 -11.071 1.00 0.00 C ATOM 1372 OE1 GLU A 83 0.981 -0.814 -10.974 1.00 0.00 O ATOM 1373 OE2 GLU A 83 1.763 0.833 -12.186 1.00 0.00 O ATOM 0 H GLU A 83 1.061 0.298 -5.978 1.00 0.00 H new ATOM 0 HA GLU A 83 0.101 -0.154 -8.693 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.884 0.587 -7.849 1.00 0.00 H new ATOM 0 HB3 GLU A 83 2.792 -0.810 -8.903 1.00 0.00 H new ATOM 0 HG2 GLU A 83 1.373 1.803 -9.540 1.00 0.00 H new ATOM 0 HG3 GLU A 83 3.029 1.498 -10.027 1.00 0.00 H new ATOM 1380 N THR A 84 0.817 -2.641 -8.599 1.00 0.00 N ATOM 1381 CA THR A 84 0.767 -4.109 -8.474 1.00 0.00 C ATOM 1382 C THR A 84 2.063 -4.759 -8.973 1.00 0.00 C ATOM 1383 O THR A 84 2.845 -4.151 -9.710 1.00 0.00 O ATOM 1384 CB THR A 84 -0.454 -4.685 -9.223 1.00 0.00 C ATOM 1385 OG1 THR A 84 -0.327 -4.566 -10.626 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.753 -3.967 -8.840 1.00 0.00 C ATOM 0 H THR A 84 0.771 -2.332 -9.570 1.00 0.00 H new ATOM 0 HA THR A 84 0.663 -4.344 -7.415 1.00 0.00 H new ATOM 0 HB THR A 84 -0.492 -5.735 -8.931 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.120 -4.944 -11.060 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.586 -4.404 -9.390 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.927 -4.077 -7.770 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.670 -2.909 -9.087 1.00 0.00 H new ATOM 1394 N VAL A 85 2.294 -6.017 -8.591 1.00 0.00 N ATOM 1395 CA VAL A 85 3.352 -6.865 -9.153 1.00 0.00 C ATOM 1396 C VAL A 85 2.890 -7.548 -10.451 1.00 0.00 C ATOM 1397 O VAL A 85 1.729 -7.438 -10.856 1.00 0.00 O ATOM 1398 CB VAL A 85 3.816 -7.900 -8.117 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.360 -7.199 -6.873 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.705 -8.859 -7.716 1.00 0.00 C ATOM 0 H VAL A 85 1.743 -6.484 -7.871 1.00 0.00 H new ATOM 0 HA VAL A 85 4.200 -6.228 -9.404 1.00 0.00 H new ATOM 0 HB VAL A 85 4.605 -8.486 -8.588 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.685 -7.945 -6.148 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.206 -6.570 -7.150 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.578 -6.581 -6.432 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.085 -9.570 -6.982 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.878 -8.297 -7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.355 -9.398 -8.596 1.00 0.00 H new ATOM 1410 N THR A 86 3.788 -8.294 -11.089 1.00 0.00 N ATOM 1411 CA THR A 86 3.547 -9.047 -12.327 1.00 0.00 C ATOM 1412 C THR A 86 3.077 -10.476 -12.041 1.00 0.00 C ATOM 1413 O THR A 86 2.212 -10.992 -12.752 1.00 0.00 O ATOM 1414 CB THR A 86 4.814 -9.093 -13.199 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.829 -9.820 -12.548 1.00 0.00 O ATOM 1416 CG2 THR A 86 5.404 -7.713 -13.490 1.00 0.00 C ATOM 0 H THR A 86 4.744 -8.398 -10.748 1.00 0.00 H new ATOM 0 HA THR A 86 2.756 -8.524 -12.865 1.00 0.00 H new ATOM 0 HB THR A 86 4.498 -9.557 -14.133 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.629 -9.843 -13.114 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.295 -7.821 -14.109 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.667 -7.106 -14.017 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.671 -7.226 -12.552 1.00 0.00 H new ATOM 1424 N ASP A 87 3.629 -11.119 -11.001 1.00 0.00 N ATOM 1425 CA ASP A 87 3.489 -12.573 -10.812 1.00 0.00 C ATOM 1426 C ASP A 87 2.352 -13.007 -9.865 1.00 0.00 C ATOM 1427 O ASP A 87 1.660 -13.982 -10.166 1.00 0.00 O ATOM 1428 CB ASP A 87 4.829 -13.153 -10.354 1.00 0.00 C ATOM 1429 CG ASP A 87 4.806 -14.691 -10.328 1.00 0.00 C ATOM 1430 OD1 ASP A 87 4.915 -15.314 -11.412 1.00 0.00 O ATOM 1431 OD2 ASP A 87 4.691 -15.281 -9.228 1.00 0.00 O ATOM 0 H ASP A 87 4.177 -10.655 -10.277 1.00 0.00 H new ATOM 0 HA ASP A 87 3.201 -12.977 -11.782 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.620 -12.812 -11.022 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.068 -12.776 -9.359 1.00 0.00 H new ATOM 1436 N SER A 88 2.147 -12.309 -8.737 1.00 0.00 N ATOM 1437 CA SER A 88 1.202 -12.750 -7.686 1.00 0.00 C ATOM 1438 C SER A 88 0.388 -11.607 -7.076 1.00 0.00 C ATOM 1439 O SER A 88 0.935 -10.725 -6.421 1.00 0.00 O ATOM 1440 CB SER A 88 1.961 -13.513 -6.597 1.00 0.00 C ATOM 1441 OG SER A 88 1.048 -14.020 -5.637 1.00 0.00 O ATOM 0 H SER A 88 2.623 -11.432 -8.524 1.00 0.00 H new ATOM 0 HA SER A 88 0.478 -13.407 -8.167 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.527 -14.332 -7.042 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.682 -12.853 -6.114 1.00 0.00 H new ATOM 0 HG SER A 88 1.540 -14.508 -4.944 1.00 0.00 H new ATOM 1447 N SER A 89 -0.939 -11.620 -7.239 1.00 0.00 N ATOM 1448 CA SER A 89 -1.808 -10.469 -6.925 1.00 0.00 C ATOM 1449 C SER A 89 -1.901 -10.094 -5.433 1.00 0.00 C ATOM 1450 O SER A 89 -2.545 -9.097 -5.108 1.00 0.00 O ATOM 1451 CB SER A 89 -3.228 -10.677 -7.474 1.00 0.00 C ATOM 1452 OG SER A 89 -3.252 -11.438 -8.676 1.00 0.00 O ATOM 0 H SER A 89 -1.448 -12.430 -7.594 1.00 0.00 H new ATOM 0 HA SER A 89 -1.315 -9.632 -7.421 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.833 -11.180 -6.720 1.00 0.00 H new ATOM 0 HB3 SER A 89 -3.687 -9.705 -7.656 1.00 0.00 H new ATOM 0 HG SER A 89 -3.343 -10.835 -9.443 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.269 -10.851 -4.519 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.224 -10.563 -3.073 1.00 0.00 C ATOM 1460 C ARG A 90 -0.085 -9.629 -2.632 1.00 0.00 C ATOM 1461 O ARG A 90 0.272 -9.609 -1.456 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.422 -11.841 -2.237 1.00 0.00 C ATOM 1463 CG ARG A 90 -0.219 -12.786 -2.176 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.600 -14.058 -1.408 1.00 0.00 C ATOM 1465 NE ARG A 90 0.497 -15.044 -1.402 1.00 0.00 N ATOM 1466 CZ ARG A 90 1.470 -15.161 -0.516 1.00 0.00 C ATOM 1467 NH1 ARG A 90 2.364 -16.099 -0.652 1.00 0.00 N ATOM 1468 NH2 ARG A 90 1.598 -14.367 0.506 1.00 0.00 N ATOM 0 H ARG A 90 -0.763 -11.700 -4.770 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.090 -9.941 -2.849 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.685 -11.551 -1.220 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.272 -12.390 -2.642 1.00 0.00 H new ATOM 0 HG2 ARG A 90 0.106 -13.042 -3.184 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.620 -12.291 -1.686 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -0.861 -13.799 -0.382 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -1.486 -14.503 -1.860 1.00 0.00 H new ATOM 0 HE ARG A 90 0.505 -15.713 -2.172 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.312 -16.742 -1.442 1.00 0.00 H new ATOM 0 HH12 ARG A 90 3.116 -16.190 0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.929 -13.611 0.652 1.00 0.00 H new ATOM 0 HH22 ARG A 90 2.368 -14.500 1.162 1.00 0.00 H new ATOM 1482 N TYR A 91 0.469 -8.846 -3.563 1.00 0.00 N ATOM 1483 CA TYR A 91 1.598 -7.944 -3.349 1.00 0.00 C ATOM 1484 C TYR A 91 1.410 -6.620 -4.111 1.00 0.00 C ATOM 1485 O TYR A 91 0.971 -6.616 -5.266 1.00 0.00 O ATOM 1486 CB TYR A 91 2.881 -8.651 -3.800 1.00 0.00 C ATOM 1487 CG TYR A 91 3.232 -9.903 -3.020 1.00 0.00 C ATOM 1488 CD1 TYR A 91 2.852 -11.175 -3.497 1.00 0.00 C ATOM 1489 CD2 TYR A 91 3.950 -9.792 -1.815 1.00 0.00 C ATOM 1490 CE1 TYR A 91 3.218 -12.335 -2.786 1.00 0.00 C ATOM 1491 CE2 TYR A 91 4.291 -10.947 -1.088 1.00 0.00 C ATOM 1492 CZ TYR A 91 3.948 -12.223 -1.582 1.00 0.00 C ATOM 1493 OH TYR A 91 4.331 -13.336 -0.899 1.00 0.00 O ATOM 0 H TYR A 91 0.127 -8.825 -4.524 1.00 0.00 H new ATOM 0 HA TYR A 91 1.664 -7.697 -2.289 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.782 -8.913 -4.853 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.711 -7.949 -3.723 1.00 0.00 H new ATOM 0 HD1 TYR A 91 2.279 -11.260 -4.409 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.240 -8.819 -1.448 1.00 0.00 H new ATOM 0 HE1 TYR A 91 2.941 -13.309 -3.161 1.00 0.00 H new ATOM 0 HE2 TYR A 91 4.817 -10.857 -0.149 1.00 0.00 H new ATOM 0 HH TYR A 91 4.825 -13.072 -0.095 1.00 0.00 H new ATOM 1503 N PHE A 92 1.774 -5.501 -3.478 1.00 0.00 N ATOM 1504 CA PHE A 92 1.638 -4.141 -4.016 1.00 0.00 C ATOM 1505 C PHE A 92 2.868 -3.287 -3.706 1.00 0.00 C ATOM 1506 O PHE A 92 3.617 -3.593 -2.781 1.00 0.00 O ATOM 1507 CB PHE A 92 0.401 -3.455 -3.416 1.00 0.00 C ATOM 1508 CG PHE A 92 -0.898 -4.178 -3.686 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.448 -5.014 -2.701 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.546 -4.036 -4.925 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.643 -5.703 -2.949 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.728 -4.750 -5.185 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.275 -5.585 -4.199 1.00 0.00 C ATOM 0 H PHE A 92 2.186 -5.516 -2.545 1.00 0.00 H new ATOM 0 HA PHE A 92 1.534 -4.230 -5.097 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.536 -3.364 -2.338 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.331 -2.443 -3.815 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -0.949 -5.126 -1.750 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -1.136 -3.378 -5.677 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.078 -6.324 -2.180 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.216 -4.656 -6.144 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.181 -6.137 -4.400 1.00 0.00 H new ATOM 1523 N VAL A 93 3.049 -2.182 -4.429 1.00 0.00 N ATOM 1524 CA VAL A 93 3.989 -1.110 -4.072 1.00 0.00 C ATOM 1525 C VAL A 93 3.206 0.178 -3.842 1.00 0.00 C ATOM 1526 O VAL A 93 2.311 0.483 -4.628 1.00 0.00 O ATOM 1527 CB VAL A 93 5.076 -0.935 -5.150 1.00 0.00 C ATOM 1528 CG1 VAL A 93 6.084 0.164 -4.808 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.864 -2.234 -5.321 1.00 0.00 C ATOM 0 H VAL A 93 2.540 -2.000 -5.294 1.00 0.00 H new ATOM 0 HA VAL A 93 4.509 -1.376 -3.152 1.00 0.00 H new ATOM 0 HB VAL A 93 4.548 -0.659 -6.063 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.824 0.239 -5.605 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.563 1.116 -4.705 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.584 -0.080 -3.870 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.629 -2.098 -6.085 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.338 -2.499 -4.376 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.187 -3.033 -5.624 1.00 0.00 H new ATOM 1539 N ILE A 94 3.532 0.951 -2.802 1.00 0.00 N ATOM 1540 CA ILE A 94 2.915 2.262 -2.556 1.00 0.00 C ATOM 1541 C ILE A 94 3.958 3.366 -2.378 1.00 0.00 C ATOM 1542 O ILE A 94 5.054 3.123 -1.866 1.00 0.00 O ATOM 1543 CB ILE A 94 1.873 2.256 -1.414 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.422 1.952 0.000 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.671 1.360 -1.750 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.615 0.473 0.365 1.00 0.00 C ATOM 0 H ILE A 94 4.230 0.688 -2.106 1.00 0.00 H new ATOM 0 HA ILE A 94 2.352 2.491 -3.461 1.00 0.00 H new ATOM 0 HB ILE A 94 1.543 3.293 -1.356 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.382 2.456 0.107 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.745 2.396 0.730 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.040 1.381 -0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.187 1.725 -2.655 1.00 0.00 H new ATOM 0 HG23 ILE A 94 1.013 0.337 -1.909 1.00 0.00 H new ATOM 0 HD11 ILE A 94 3.004 0.397 1.380 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.658 -0.045 0.303 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.320 0.016 -0.329 1.00 0.00 H new ATOM 1558 N ARG A 95 3.611 4.590 -2.799 1.00 0.00 N ATOM 1559 CA ARG A 95 4.490 5.770 -2.693 1.00 0.00 C ATOM 1560 C ARG A 95 4.249 6.514 -1.381 1.00 0.00 C ATOM 1561 O ARG A 95 3.476 7.474 -1.337 1.00 0.00 O ATOM 1562 CB ARG A 95 4.368 6.678 -3.931 1.00 0.00 C ATOM 1563 CG ARG A 95 5.600 7.587 -4.056 1.00 0.00 C ATOM 1564 CD ARG A 95 5.516 8.539 -5.257 1.00 0.00 C ATOM 1565 NE ARG A 95 4.664 9.718 -4.988 1.00 0.00 N ATOM 1566 CZ ARG A 95 4.553 10.791 -5.754 1.00 0.00 C ATOM 1567 NH1 ARG A 95 3.863 11.822 -5.361 1.00 0.00 N ATOM 1568 NH2 ARG A 95 5.131 10.872 -6.919 1.00 0.00 N ATOM 0 H ARG A 95 2.707 4.794 -3.226 1.00 0.00 H new ATOM 0 HA ARG A 95 5.524 5.426 -2.672 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.267 6.068 -4.828 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.466 7.286 -3.856 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.710 8.171 -3.142 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.494 6.970 -4.149 1.00 0.00 H new ATOM 0 HD2 ARG A 95 6.519 8.873 -5.522 1.00 0.00 H new ATOM 0 HD3 ARG A 95 5.122 7.999 -6.118 1.00 0.00 H new ATOM 0 HE ARG A 95 4.110 9.702 -4.132 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.400 11.809 -4.452 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.786 12.643 -5.962 1.00 0.00 H new ATOM 0 HH21 ARG A 95 5.690 10.093 -7.266 1.00 0.00 H new ATOM 0 HH22 ARG A 95 5.024 11.715 -7.484 1.00 0.00 H new ATOM 1582 N ILE A 96 4.894 6.073 -0.306 1.00 0.00 N ATOM 1583 CA ILE A 96 4.804 6.752 0.994 1.00 0.00 C ATOM 1584 C ILE A 96 5.510 8.115 0.952 1.00 0.00 C ATOM 1585 O ILE A 96 6.557 8.265 0.320 1.00 0.00 O ATOM 1586 CB ILE A 96 5.214 5.861 2.186 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.709 5.465 2.228 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.339 4.600 2.247 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.565 6.403 3.085 1.00 0.00 C ATOM 0 H ILE A 96 5.489 5.245 -0.304 1.00 0.00 H new ATOM 0 HA ILE A 96 3.750 6.955 1.181 1.00 0.00 H new ATOM 0 HB ILE A 96 5.051 6.484 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.797 4.450 2.615 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.103 5.454 1.212 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.644 3.986 3.094 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.294 4.887 2.365 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.457 4.031 1.325 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.601 6.066 3.069 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.507 7.415 2.685 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.197 6.396 4.111 1.00 0.00 H new ATOM 1601 N GLN A 97 4.897 9.125 1.572 1.00 0.00 N ATOM 1602 CA GLN A 97 5.281 10.540 1.480 1.00 0.00 C ATOM 1603 C GLN A 97 5.181 11.238 2.844 1.00 0.00 C ATOM 1604 O GLN A 97 4.331 10.912 3.677 1.00 0.00 O ATOM 1605 CB GLN A 97 4.402 11.260 0.437 1.00 0.00 C ATOM 1606 CG GLN A 97 4.768 10.895 -1.015 1.00 0.00 C ATOM 1607 CD GLN A 97 3.625 11.091 -2.004 1.00 0.00 C ATOM 1608 OE1 GLN A 97 3.383 12.165 -2.533 1.00 0.00 O ATOM 1609 NE2 GLN A 97 2.916 10.043 -2.362 1.00 0.00 N ATOM 0 H GLN A 97 4.088 8.977 2.176 1.00 0.00 H new ATOM 0 HA GLN A 97 6.322 10.589 1.161 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.356 11.009 0.616 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.499 12.337 0.570 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.617 11.502 -1.330 1.00 0.00 H new ATOM 0 HG3 GLN A 97 5.091 9.854 -1.048 1.00 0.00 H new ATOM 0 HE21 GLN A 97 3.098 9.134 -1.936 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.184 10.139 -3.066 1.00 0.00 H new ATOM 1618 N ASP A 98 6.035 12.239 3.054 1.00 0.00 N ATOM 1619 CA ASP A 98 6.138 12.999 4.316 1.00 0.00 C ATOM 1620 C ASP A 98 5.310 14.307 4.313 1.00 0.00 C ATOM 1621 O ASP A 98 5.353 15.091 5.262 1.00 0.00 O ATOM 1622 CB ASP A 98 7.626 13.242 4.609 1.00 0.00 C ATOM 1623 CG ASP A 98 7.944 13.681 6.050 1.00 0.00 C ATOM 1624 OD1 ASP A 98 7.381 13.107 7.012 1.00 0.00 O ATOM 1625 OD2 ASP A 98 8.827 14.558 6.212 1.00 0.00 O ATOM 0 H ASP A 98 6.692 12.557 2.341 1.00 0.00 H new ATOM 0 HA ASP A 98 5.698 12.409 5.120 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.177 12.326 4.395 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.996 14.004 3.923 1.00 0.00 H new ATOM 1630 N GLY A 99 4.565 14.564 3.229 1.00 0.00 N ATOM 1631 CA GLY A 99 3.693 15.740 3.060 1.00 0.00 C ATOM 1632 C GLY A 99 4.423 17.026 2.639 1.00 0.00 C ATOM 1633 O GLY A 99 3.840 18.111 2.681 1.00 0.00 O ATOM 0 H GLY A 99 4.550 13.942 2.420 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.934 15.508 2.313 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.170 15.926 3.998 1.00 0.00 H new ATOM 1637 N THR A 100 5.698 16.910 2.248 1.00 0.00 N ATOM 1638 CA THR A 100 6.615 18.032 1.947 1.00 0.00 C ATOM 1639 C THR A 100 7.389 17.856 0.620 1.00 0.00 C ATOM 1640 O THR A 100 8.313 18.612 0.311 1.00 0.00 O ATOM 1641 CB THR A 100 7.527 18.255 3.172 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.139 19.527 3.148 1.00 0.00 O ATOM 1643 CG2 THR A 100 8.610 17.182 3.315 1.00 0.00 C ATOM 0 H THR A 100 6.143 16.000 2.126 1.00 0.00 H new ATOM 0 HA THR A 100 6.029 18.935 1.775 1.00 0.00 H new ATOM 0 HB THR A 100 6.865 18.188 4.035 1.00 0.00 H new ATOM 0 HG1 THR A 100 8.406 19.745 2.230 1.00 0.00 H new ATOM 0 HG21 THR A 100 9.218 17.394 4.194 1.00 0.00 H new ATOM 0 HG22 THR A 100 8.141 16.204 3.425 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.243 17.183 2.427 1.00 0.00 H new ATOM 1651 N GLY A 101 7.028 16.847 -0.189 1.00 0.00 N ATOM 1652 CA GLY A 101 7.697 16.504 -1.457 1.00 0.00 C ATOM 1653 C GLY A 101 8.765 15.404 -1.345 1.00 0.00 C ATOM 1654 O GLY A 101 9.325 14.983 -2.361 1.00 0.00 O ATOM 0 H GLY A 101 6.244 16.231 0.025 1.00 0.00 H new ATOM 0 HA2 GLY A 101 6.942 16.186 -2.176 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.162 17.403 -1.861 1.00 0.00 H new ATOM 1658 N ARG A 102 9.013 14.891 -0.131 1.00 0.00 N ATOM 1659 CA ARG A 102 9.733 13.639 0.129 1.00 0.00 C ATOM 1660 C ARG A 102 8.848 12.472 -0.260 1.00 0.00 C ATOM 1661 O ARG A 102 7.676 12.431 0.122 1.00 0.00 O ATOM 1662 CB ARG A 102 10.070 13.491 1.620 1.00 0.00 C ATOM 1663 CG ARG A 102 11.073 14.535 2.095 1.00 0.00 C ATOM 1664 CD ARG A 102 11.215 14.504 3.622 1.00 0.00 C ATOM 1665 NE ARG A 102 12.174 15.520 4.096 1.00 0.00 N ATOM 1666 CZ ARG A 102 12.143 16.182 5.240 1.00 0.00 C ATOM 1667 NH1 ARG A 102 13.091 17.030 5.521 1.00 0.00 N ATOM 1668 NH2 ARG A 102 11.201 16.038 6.130 1.00 0.00 N ATOM 0 H ARG A 102 8.707 15.353 0.725 1.00 0.00 H new ATOM 0 HA ARG A 102 10.656 13.653 -0.451 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.155 13.576 2.207 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.473 12.495 1.801 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.042 14.351 1.632 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.751 15.526 1.776 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.242 14.677 4.083 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.546 13.515 3.938 1.00 0.00 H new ATOM 0 HE ARG A 102 12.949 15.736 3.470 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.853 17.181 4.860 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.071 17.543 6.402 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.435 15.386 5.961 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.230 16.577 6.996 1.00 0.00 H new ATOM 1682 N SER A 103 9.435 11.511 -0.951 1.00 0.00 N ATOM 1683 CA SER A 103 8.769 10.262 -1.316 1.00 0.00 C ATOM 1684 C SER A 103 9.689 9.035 -1.326 1.00 0.00 C ATOM 1685 O SER A 103 10.898 9.140 -1.562 1.00 0.00 O ATOM 1686 CB SER A 103 8.070 10.412 -2.676 1.00 0.00 C ATOM 1687 OG SER A 103 9.006 10.652 -3.716 1.00 0.00 O ATOM 0 H SER A 103 10.398 11.571 -1.281 1.00 0.00 H new ATOM 0 HA SER A 103 8.035 10.076 -0.532 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.503 9.508 -2.897 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.355 11.234 -2.631 1.00 0.00 H new ATOM 0 HG SER A 103 8.532 10.741 -4.569 1.00 0.00 H new ATOM 1693 N ALA A 104 9.100 7.858 -1.097 1.00 0.00 N ATOM 1694 CA ALA A 104 9.723 6.549 -1.293 1.00 0.00 C ATOM 1695 C ALA A 104 8.693 5.517 -1.777 1.00 0.00 C ATOM 1696 O ALA A 104 7.550 5.510 -1.320 1.00 0.00 O ATOM 1697 CB ALA A 104 10.382 6.103 0.020 1.00 0.00 C ATOM 0 H ALA A 104 8.141 7.790 -0.757 1.00 0.00 H new ATOM 0 HA ALA A 104 10.488 6.626 -2.066 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.848 5.128 -0.120 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.141 6.829 0.311 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.626 6.035 0.802 1.00 0.00 H new ATOM 1703 N PHE A 105 9.097 4.620 -2.676 1.00 0.00 N ATOM 1704 CA PHE A 105 8.296 3.459 -3.075 1.00 0.00 C ATOM 1705 C PHE A 105 8.650 2.253 -2.193 1.00 0.00 C ATOM 1706 O PHE A 105 9.796 1.796 -2.189 1.00 0.00 O ATOM 1707 CB PHE A 105 8.494 3.164 -4.568 1.00 0.00 C ATOM 1708 CG PHE A 105 7.744 4.095 -5.504 1.00 0.00 C ATOM 1709 CD1 PHE A 105 8.420 5.119 -6.197 1.00 0.00 C ATOM 1710 CD2 PHE A 105 6.364 3.910 -5.719 1.00 0.00 C ATOM 1711 CE1 PHE A 105 7.722 5.934 -7.110 1.00 0.00 C ATOM 1712 CE2 PHE A 105 5.671 4.706 -6.647 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.351 5.720 -7.343 1.00 0.00 C ATOM 0 H PHE A 105 9.997 4.678 -3.153 1.00 0.00 H new ATOM 0 HA PHE A 105 7.238 3.676 -2.928 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.558 3.220 -4.797 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.179 2.140 -4.767 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.475 5.279 -6.028 1.00 0.00 H new ATOM 0 HD2 PHE A 105 5.834 3.149 -5.165 1.00 0.00 H new ATOM 0 HE1 PHE A 105 8.240 6.725 -7.632 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.619 4.539 -6.825 1.00 0.00 H new ATOM 0 HZ PHE A 105 5.822 6.334 -8.056 1.00 0.00 H new ATOM 1723 N ILE A 106 7.666 1.735 -1.452 1.00 0.00 N ATOM 1724 CA ILE A 106 7.804 0.556 -0.579 1.00 0.00 C ATOM 1725 C ILE A 106 6.882 -0.574 -1.039 1.00 0.00 C ATOM 1726 O ILE A 106 5.754 -0.318 -1.455 1.00 0.00 O ATOM 1727 CB ILE A 106 7.606 0.898 0.918 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.148 1.250 1.298 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.568 2.028 1.318 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.906 1.403 2.806 1.00 0.00 C ATOM 0 H ILE A 106 6.726 2.131 -1.439 1.00 0.00 H new ATOM 0 HA ILE A 106 8.832 0.204 -0.671 1.00 0.00 H new ATOM 0 HB ILE A 106 7.836 -0.007 1.480 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.870 2.180 0.801 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.487 0.473 0.913 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.428 2.269 2.372 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.596 1.706 1.152 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.363 2.912 0.714 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.859 1.650 2.983 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.149 0.468 3.310 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.538 2.201 3.197 1.00 0.00 H new ATOM 1742 N GLY A 107 7.350 -1.819 -0.960 1.00 0.00 N ATOM 1743 CA GLY A 107 6.557 -3.006 -1.275 1.00 0.00 C ATOM 1744 C GLY A 107 5.835 -3.526 -0.034 1.00 0.00 C ATOM 1745 O GLY A 107 6.408 -3.506 1.055 1.00 0.00 O ATOM 0 H GLY A 107 8.304 -2.034 -0.671 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.829 -2.766 -2.050 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.205 -3.785 -1.676 1.00 0.00 H new ATOM 1749 N ILE A 108 4.602 -4.009 -0.192 1.00 0.00 N ATOM 1750 CA ILE A 108 3.840 -4.721 0.841 1.00 0.00 C ATOM 1751 C ILE A 108 3.269 -6.044 0.328 1.00 0.00 C ATOM 1752 O ILE A 108 2.884 -6.157 -0.839 1.00 0.00 O ATOM 1753 CB ILE A 108 2.739 -3.858 1.504 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.692 -3.302 0.513 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.386 -2.745 2.339 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.473 -2.658 1.199 1.00 0.00 C ATOM 0 H ILE A 108 4.088 -3.914 -1.068 1.00 0.00 H new ATOM 0 HA ILE A 108 4.564 -4.948 1.623 1.00 0.00 H new ATOM 0 HB ILE A 108 2.171 -4.517 2.160 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.169 -2.562 -0.129 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.350 -4.111 -0.132 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.608 -2.140 2.804 1.00 0.00 H new ATOM 0 HG22 ILE A 108 4.012 -3.188 3.113 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.998 -2.115 1.694 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.219 -2.290 0.441 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.029 -3.400 1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.803 -1.827 1.822 1.00 0.00 H new ATOM 1768 N GLY A 109 3.200 -7.042 1.211 1.00 0.00 N ATOM 1769 CA GLY A 109 2.623 -8.364 0.944 1.00 0.00 C ATOM 1770 C GLY A 109 1.504 -8.754 1.913 1.00 0.00 C ATOM 1771 O GLY A 109 1.513 -8.367 3.085 1.00 0.00 O ATOM 0 H GLY A 109 3.555 -6.951 2.163 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.233 -8.382 -0.074 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.413 -9.113 0.995 1.00 0.00 H new ATOM 1775 N PHE A 110 0.547 -9.533 1.404 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.639 -10.022 2.114 1.00 0.00 C ATOM 1777 C PHE A 110 -0.612 -11.549 2.271 1.00 0.00 C ATOM 1778 O PHE A 110 0.012 -12.263 1.483 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.909 -9.580 1.369 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.224 -8.100 1.471 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -1.440 -7.156 0.779 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -3.298 -7.663 2.273 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -1.713 -5.786 0.910 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -3.590 -6.292 2.376 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.797 -5.357 1.688 1.00 0.00 C ATOM 0 H PHE A 110 0.579 -9.857 0.437 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.639 -9.591 3.115 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.806 -9.843 0.316 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.756 -10.145 1.757 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -0.629 -7.487 0.148 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.898 -8.383 2.809 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -1.087 -5.061 0.411 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.420 -5.958 2.981 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.024 -4.304 1.759 1.00 0.00 H new ATOM 1795 N THR A 111 -1.334 -12.060 3.270 1.00 0.00 N ATOM 1796 CA THR A 111 -1.398 -13.497 3.591 1.00 0.00 C ATOM 1797 C THR A 111 -2.247 -14.296 2.592 1.00 0.00 C ATOM 1798 O THR A 111 -2.040 -15.498 2.414 1.00 0.00 O ATOM 1799 CB THR A 111 -1.896 -13.680 5.037 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.653 -14.994 5.487 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.384 -13.373 5.240 1.00 0.00 C ATOM 0 H THR A 111 -1.901 -11.483 3.891 1.00 0.00 H new ATOM 0 HA THR A 111 -0.390 -13.903 3.506 1.00 0.00 H new ATOM 0 HB THR A 111 -1.331 -12.951 5.617 1.00 0.00 H new ATOM 0 HG1 THR A 111 -1.975 -15.089 6.408 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.648 -13.528 6.286 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.583 -12.337 4.965 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.981 -14.035 4.613 1.00 0.00 H new ATOM 1809 N ASP A 112 -3.182 -13.632 1.900 1.00 0.00 N ATOM 1810 CA ASP A 112 -4.119 -14.257 0.965 1.00 0.00 C ATOM 1811 C ASP A 112 -4.563 -13.285 -0.141 1.00 0.00 C ATOM 1812 O ASP A 112 -4.696 -12.077 0.085 1.00 0.00 O ATOM 1813 CB ASP A 112 -5.334 -14.794 1.742 1.00 0.00 C ATOM 1814 CG ASP A 112 -6.227 -15.676 0.856 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -5.968 -16.899 0.760 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -7.165 -15.139 0.225 1.00 0.00 O ATOM 0 H ASP A 112 -3.309 -12.623 1.978 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.609 -15.084 0.471 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.991 -15.370 2.602 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.917 -13.959 2.130 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.827 -13.815 -1.342 1.00 0.00 N ATOM 1822 CA ARG A 113 -5.260 -13.037 -2.513 1.00 0.00 C ATOM 1823 C ARG A 113 -6.612 -12.343 -2.311 1.00 0.00 C ATOM 1824 O ARG A 113 -6.782 -11.224 -2.786 1.00 0.00 O ATOM 1825 CB ARG A 113 -5.262 -13.966 -3.739 1.00 0.00 C ATOM 1826 CG ARG A 113 -5.428 -13.187 -5.049 1.00 0.00 C ATOM 1827 CD ARG A 113 -5.249 -14.113 -6.260 1.00 0.00 C ATOM 1828 NE ARG A 113 -5.225 -13.353 -7.525 1.00 0.00 N ATOM 1829 CZ ARG A 113 -6.218 -13.111 -8.359 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -5.986 -12.385 -9.413 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -7.426 -13.562 -8.173 1.00 0.00 N ATOM 0 H ARG A 113 -4.745 -14.814 -1.532 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.554 -12.222 -2.670 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.330 -14.530 -3.768 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -6.070 -14.691 -3.643 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.415 -12.726 -5.081 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -4.698 -12.379 -5.092 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -4.321 -14.675 -6.155 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -6.061 -14.840 -6.287 1.00 0.00 H new ATOM 0 HE ARG A 113 -4.320 -12.963 -7.790 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -5.051 -12.015 -9.582 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -6.740 -12.186 -10.071 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -7.638 -14.130 -7.353 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -8.160 -13.347 -8.848 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.541 -12.939 -1.564 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.832 -12.326 -1.225 1.00 0.00 C ATOM 1847 C GLY A 114 -8.708 -11.111 -0.295 1.00 0.00 C ATOM 1848 O GLY A 114 -9.508 -10.179 -0.377 1.00 0.00 O ATOM 0 H GLY A 114 -7.420 -13.872 -1.171 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.333 -12.021 -2.144 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.467 -13.074 -0.750 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.669 -11.072 0.542 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.381 -9.950 1.447 1.00 0.00 C ATOM 1854 C ASP A 115 -6.568 -8.837 0.767 1.00 0.00 C ATOM 1855 O ASP A 115 -6.765 -7.658 1.059 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.693 -10.477 2.711 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.729 -10.935 3.751 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -7.775 -12.144 4.080 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -8.493 -10.071 4.246 1.00 0.00 O ATOM 0 H ASP A 115 -6.991 -11.831 0.613 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.327 -9.487 1.729 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -6.039 -11.310 2.453 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.063 -9.697 3.139 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.728 -9.184 -0.209 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.168 -8.219 -1.151 1.00 0.00 C ATOM 1866 C ALA A 116 -6.234 -7.613 -2.082 1.00 0.00 C ATOM 1867 O ALA A 116 -6.202 -6.416 -2.371 1.00 0.00 O ATOM 1868 CB ALA A 116 -4.095 -8.945 -1.943 1.00 0.00 C ATOM 0 H ALA A 116 -5.418 -10.143 -0.367 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.749 -7.374 -0.605 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.647 -8.259 -2.662 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.326 -9.311 -1.263 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.541 -9.787 -2.473 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.232 -8.402 -2.492 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.410 -7.872 -3.181 1.00 0.00 C ATOM 1876 C PHE A 117 -9.196 -6.898 -2.292 1.00 0.00 C ATOM 1877 O PHE A 117 -9.648 -5.875 -2.792 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.283 -9.005 -3.743 1.00 0.00 C ATOM 1879 CG PHE A 117 -8.992 -9.327 -5.200 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -7.694 -9.697 -5.610 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -10.015 -9.221 -6.163 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -7.423 -9.954 -6.965 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -9.745 -9.481 -7.519 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.447 -9.847 -7.921 1.00 0.00 C ATOM 0 H PHE A 117 -7.246 -9.413 -2.358 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.066 -7.291 -4.036 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.131 -9.902 -3.143 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.333 -8.729 -3.643 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -6.904 -9.783 -4.879 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.012 -8.939 -5.859 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -6.426 -10.234 -7.272 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -10.534 -9.400 -8.252 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.238 -10.045 -8.962 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.286 -7.122 -0.978 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.904 -6.157 -0.055 1.00 0.00 C ATOM 1896 C ASP A 118 -9.144 -4.811 -0.010 1.00 0.00 C ATOM 1897 O ASP A 118 -9.773 -3.752 0.002 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.037 -6.802 1.335 1.00 0.00 C ATOM 1899 CG ASP A 118 -10.969 -6.021 2.275 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -10.589 -5.848 3.457 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -12.096 -5.654 1.867 1.00 0.00 O ATOM 0 H ASP A 118 -8.938 -7.967 -0.525 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.900 -5.910 -0.424 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -10.413 -7.819 1.223 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -9.050 -6.876 1.791 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.805 -4.826 -0.098 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.977 -3.621 -0.283 1.00 0.00 C ATOM 1908 C PHE A 119 -7.309 -2.875 -1.593 1.00 0.00 C ATOM 1909 O PHE A 119 -7.593 -1.676 -1.559 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.487 -4.000 -0.170 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.503 -2.925 -0.600 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -3.913 -2.079 0.354 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -4.160 -2.774 -1.958 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.039 -1.057 -0.044 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -3.274 -1.759 -2.358 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.717 -0.893 -1.402 1.00 0.00 C ATOM 0 H PHE A 119 -7.259 -5.686 -0.042 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.209 -2.912 0.511 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.276 -4.268 0.865 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.310 -4.891 -0.772 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.134 -2.217 1.402 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.580 -3.442 -2.696 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.613 -0.395 0.695 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -3.021 -1.645 -3.402 1.00 0.00 H new ATOM 0 HZ PHE A 119 -2.045 -0.105 -1.709 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.329 -3.558 -2.745 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.537 -2.879 -4.037 1.00 0.00 C ATOM 1928 C ASN A 120 -9.005 -2.540 -4.358 1.00 0.00 C ATOM 1929 O ASN A 120 -9.264 -1.594 -5.108 1.00 0.00 O ATOM 1930 CB ASN A 120 -6.813 -3.605 -5.189 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.295 -5.003 -5.553 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -6.564 -5.975 -5.461 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.499 -5.162 -6.052 1.00 0.00 N ATOM 0 H ASN A 120 -7.206 -4.568 -2.813 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.067 -1.902 -3.928 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.888 -2.981 -6.080 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -5.755 -3.670 -4.934 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -8.808 -6.086 -6.354 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -9.126 -4.362 -6.137 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.977 -3.277 -3.816 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.411 -3.000 -4.000 1.00 0.00 C ATOM 1942 C VAL A 121 -11.860 -1.834 -3.118 1.00 0.00 C ATOM 1943 O VAL A 121 -12.561 -0.948 -3.602 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.265 -4.264 -3.758 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.772 -3.974 -3.707 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -12.050 -5.285 -4.885 1.00 0.00 C ATOM 0 H VAL A 121 -9.793 -4.092 -3.231 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.565 -2.705 -5.038 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.940 -4.650 -2.792 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.316 -4.903 -3.534 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -13.981 -3.275 -2.897 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.091 -3.538 -4.654 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.660 -6.169 -4.697 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.338 -4.841 -5.838 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.999 -5.571 -4.921 1.00 0.00 H new ATOM 1956 N SER A 122 -11.417 -1.769 -1.858 1.00 0.00 N ATOM 1957 CA SER A 122 -11.771 -0.660 -0.956 1.00 0.00 C ATOM 1958 C SER A 122 -11.236 0.697 -1.439 1.00 0.00 C ATOM 1959 O SER A 122 -11.906 1.716 -1.262 1.00 0.00 O ATOM 1960 CB SER A 122 -11.297 -0.949 0.469 1.00 0.00 C ATOM 1961 OG SER A 122 -9.892 -1.054 0.529 1.00 0.00 O ATOM 0 H SER A 122 -10.811 -2.472 -1.436 1.00 0.00 H new ATOM 0 HA SER A 122 -12.859 -0.589 -0.962 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.633 -0.154 1.135 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.749 -1.875 0.824 1.00 0.00 H new ATOM 0 HG SER A 122 -9.626 -1.982 0.362 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.085 0.708 -2.125 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.564 1.878 -2.837 1.00 0.00 C ATOM 1969 C LEU A 123 -10.424 2.238 -4.060 1.00 0.00 C ATOM 1970 O LEU A 123 -10.933 3.355 -4.141 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.097 1.632 -3.237 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.086 1.736 -2.080 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.719 1.235 -2.548 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -6.920 3.181 -1.599 1.00 0.00 C ATOM 0 H LEU A 123 -9.481 -0.111 -2.201 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.608 2.734 -2.164 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.018 0.640 -3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.820 2.350 -4.009 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.468 1.130 -1.258 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.004 1.309 -1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.801 0.195 -2.865 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.376 1.843 -3.385 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.199 3.212 -0.782 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.563 3.800 -2.422 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.880 3.561 -1.250 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.630 1.317 -5.011 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.330 1.652 -6.265 1.00 0.00 C ATOM 1988 C GLN A 124 -12.825 1.971 -6.068 1.00 0.00 C ATOM 1989 O GLN A 124 -13.390 2.757 -6.825 1.00 0.00 O ATOM 1990 CB GLN A 124 -11.080 0.567 -7.327 1.00 0.00 C ATOM 1991 CG GLN A 124 -11.958 -0.679 -7.169 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.454 -1.837 -8.025 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.052 -2.226 -9.020 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.329 -2.424 -7.677 1.00 0.00 N ATOM 0 H GLN A 124 -10.328 0.345 -4.941 1.00 0.00 H new ATOM 0 HA GLN A 124 -10.902 2.584 -6.635 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.250 0.995 -8.315 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.033 0.268 -7.285 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.976 -0.981 -6.122 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -12.984 -0.439 -7.449 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.823 -2.107 -6.850 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -9.963 -3.196 -8.234 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.454 1.448 -5.011 1.00 0.00 N ATOM 2004 CA ASP A 125 -14.835 1.765 -4.632 1.00 0.00 C ATOM 2005 C ASP A 125 -14.949 3.112 -3.885 1.00 0.00 C ATOM 2006 O ASP A 125 -16.054 3.591 -3.629 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.430 0.597 -3.829 1.00 0.00 C ATOM 2008 CG ASP A 125 -16.943 0.748 -3.591 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.686 1.054 -4.557 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.402 0.536 -2.443 1.00 0.00 O ATOM 0 H ASP A 125 -13.009 0.779 -4.382 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.420 1.891 -5.543 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.241 -0.336 -4.360 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -14.921 0.526 -2.868 1.00 0.00 H new ATOM 2015 N HIS A 126 -13.821 3.772 -3.595 1.00 0.00 N ATOM 2016 CA HIS A 126 -13.793 5.196 -3.253 1.00 0.00 C ATOM 2017 C HIS A 126 -13.616 6.095 -4.485 1.00 0.00 C ATOM 2018 O HIS A 126 -14.116 7.217 -4.491 1.00 0.00 O ATOM 2019 CB HIS A 126 -12.724 5.464 -2.181 1.00 0.00 C ATOM 2020 CG HIS A 126 -12.831 6.851 -1.597 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -13.596 7.202 -0.481 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -12.291 7.984 -2.135 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.513 8.540 -0.382 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -12.747 9.034 -1.370 1.00 0.00 N ATOM 0 H HIS A 126 -12.901 3.331 -3.591 1.00 0.00 H new ATOM 0 HA HIS A 126 -14.766 5.457 -2.837 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -12.821 4.728 -1.383 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -11.734 5.332 -2.618 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.636 8.044 -2.991 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -13.993 9.133 0.382 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -12.539 10.020 -1.527 1.00 0.00 H new ATOM 2032 N PHE A 127 -12.961 5.611 -5.547 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.641 6.393 -6.750 1.00 0.00 C ATOM 2034 C PHE A 127 -13.557 6.163 -7.963 1.00 0.00 C ATOM 2035 O PHE A 127 -13.382 6.849 -8.968 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.162 6.193 -7.111 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.201 6.865 -6.151 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -10.081 8.267 -6.138 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -9.403 6.094 -5.290 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -9.144 8.887 -5.294 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -8.447 6.706 -4.466 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.316 8.107 -4.469 1.00 0.00 C ATOM 0 H PHE A 127 -12.632 4.647 -5.596 1.00 0.00 H new ATOM 0 HA PHE A 127 -12.833 7.433 -6.486 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -10.946 5.125 -7.139 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -10.987 6.580 -8.115 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -10.710 8.868 -6.778 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.526 5.021 -5.262 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -9.060 9.964 -5.279 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.814 6.104 -3.831 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.580 8.582 -3.838 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.565 5.279 -7.909 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.453 5.006 -9.064 1.00 0.00 C ATOM 2054 C LYS A 128 -16.157 6.239 -9.653 1.00 0.00 C ATOM 2055 O LYS A 128 -16.405 6.285 -10.857 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.438 3.852 -8.790 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.657 4.174 -7.913 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.285 4.383 -6.445 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.512 4.529 -5.544 1.00 0.00 C ATOM 2060 NZ LYS A 128 -19.226 3.239 -5.349 1.00 0.00 N ATOM 0 H LYS A 128 -14.791 4.735 -7.076 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.771 4.680 -9.850 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.799 3.479 -9.748 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.886 3.039 -8.319 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -18.146 5.072 -8.292 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.380 3.362 -7.989 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.685 3.540 -6.102 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.664 5.274 -6.354 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.204 4.921 -4.575 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.195 5.258 -5.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.846 3.308 -4.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -19.799 3.028 -6.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.533 2.477 -5.202 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.424 7.261 -8.834 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.004 8.546 -9.270 1.00 0.00 C ATOM 2076 C TRP A 129 -15.970 9.534 -9.848 1.00 0.00 C ATOM 2077 O TRP A 129 -16.340 10.474 -10.553 1.00 0.00 O ATOM 2078 CB TRP A 129 -17.773 9.180 -8.107 1.00 0.00 C ATOM 2079 CG TRP A 129 -16.935 9.605 -6.939 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.441 8.779 -5.992 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -16.484 10.947 -6.565 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -15.687 9.499 -5.094 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -15.727 10.849 -5.357 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -16.644 12.240 -7.112 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.199 11.972 -4.703 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -16.131 13.377 -6.459 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -15.428 13.248 -5.249 1.00 0.00 C ATOM 0 H TRP A 129 -16.242 7.223 -7.831 1.00 0.00 H new ATOM 0 HA TRP A 129 -17.683 8.324 -10.093 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.312 10.050 -8.481 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.520 8.468 -7.757 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.612 7.714 -5.946 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.162 9.082 -4.326 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -17.169 12.358 -8.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -14.626 11.859 -3.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -16.279 14.356 -6.891 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.064 14.128 -4.739 1.00 0.00 H new ATOM 2098 N VAL A 130 -14.677 9.305 -9.595 1.00 0.00 N ATOM 2099 CA VAL A 130 -13.541 10.025 -10.204 1.00 0.00 C ATOM 2100 C VAL A 130 -13.105 9.341 -11.514 1.00 0.00 C ATOM 2101 O VAL A 130 -12.750 10.014 -12.482 1.00 0.00 O ATOM 2102 CB VAL A 130 -12.370 10.134 -9.200 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -11.203 10.961 -9.756 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -12.814 10.794 -7.886 1.00 0.00 C ATOM 0 H VAL A 130 -14.376 8.587 -8.936 1.00 0.00 H new ATOM 0 HA VAL A 130 -13.859 11.037 -10.453 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.044 9.109 -9.022 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.405 11.009 -9.015 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -10.826 10.493 -10.665 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -11.548 11.970 -9.984 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -11.966 10.854 -7.204 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.187 11.798 -8.091 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -13.605 10.199 -7.429 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.212 8.006 -11.587 1.00 0.00 N ATOM 2115 CA LYS A 131 -12.896 7.143 -12.743 1.00 0.00 C ATOM 2116 C LYS A 131 -14.096 6.981 -13.683 1.00 0.00 C ATOM 2117 O LYS A 131 -14.403 5.888 -14.164 1.00 0.00 O ATOM 2118 CB LYS A 131 -12.322 5.801 -12.239 1.00 0.00 C ATOM 2119 CG LYS A 131 -10.938 5.939 -11.587 1.00 0.00 C ATOM 2120 CD LYS A 131 -9.831 6.195 -12.624 1.00 0.00 C ATOM 2121 CE LYS A 131 -8.501 6.365 -11.892 1.00 0.00 C ATOM 2122 NZ LYS A 131 -7.345 6.422 -12.829 1.00 0.00 N ATOM 0 H LYS A 131 -13.543 7.462 -10.790 1.00 0.00 H new ATOM 0 HA LYS A 131 -12.129 7.622 -13.352 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -13.014 5.366 -11.518 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.254 5.106 -13.076 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -10.957 6.758 -10.868 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -10.709 5.031 -11.030 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -9.772 5.363 -13.326 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -10.058 7.088 -13.206 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -8.530 7.278 -11.298 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -8.362 5.537 -11.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -6.477 6.149 -12.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.507 5.767 -13.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -7.243 7.390 -13.196 1.00 0.00 H new ATOM 2136 N GLN A 132 -14.790 8.090 -13.930 1.00 0.00 N ATOM 2137 CA GLN A 132 -15.927 8.166 -14.845 1.00 0.00 C ATOM 2138 C GLN A 132 -15.440 8.405 -16.282 1.00 0.00 C ATOM 2139 O GLN A 132 -15.145 9.531 -16.690 1.00 0.00 O ATOM 2140 CB GLN A 132 -16.927 9.238 -14.389 1.00 0.00 C ATOM 2141 CG GLN A 132 -17.710 8.833 -13.129 1.00 0.00 C ATOM 2142 CD GLN A 132 -18.689 7.687 -13.384 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -19.685 7.825 -14.083 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -18.447 6.511 -12.845 1.00 0.00 N ATOM 0 H GLN A 132 -14.572 8.983 -13.488 1.00 0.00 H new ATOM 0 HA GLN A 132 -16.455 7.212 -14.830 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.391 10.167 -14.194 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -17.630 9.439 -15.198 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -17.008 8.538 -12.349 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -18.259 9.697 -12.754 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.622 6.378 -12.260 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -19.084 5.732 -13.012 1.00 0.00 H new ATOM 2153 N GLU A 133 -15.340 7.311 -17.035 1.00 0.00 N ATOM 2154 CA GLU A 133 -14.933 7.267 -18.455 1.00 0.00 C ATOM 2155 C GLU A 133 -15.999 7.829 -19.418 1.00 0.00 C ATOM 2156 O GLU A 133 -15.629 8.620 -20.315 1.00 0.00 O ATOM 2157 CB GLU A 133 -14.545 5.832 -18.855 1.00 0.00 C ATOM 2158 CG GLU A 133 -13.314 5.300 -18.104 1.00 0.00 C ATOM 2159 CD GLU A 133 -12.899 3.905 -18.625 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -12.015 3.816 -19.514 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -13.447 2.878 -18.148 1.00 0.00 O ATOM 2162 OXT GLU A 133 -17.195 7.475 -19.285 1.00 0.00 O ATOM 0 H GLU A 133 -15.548 6.384 -16.663 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.066 7.920 -18.548 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -15.390 5.170 -18.667 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -14.348 5.802 -19.927 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -12.484 5.997 -18.222 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -13.532 5.242 -17.038 1.00 0.00 H new TER 2169 GLU A 133