USER MOD reduce.3.24.130724 H: found=0, std=0, add=996, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 993 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 82 CYS SG : rot 180:sc= 0.075 USER MOD Set 1.2: A 100 HIS : no HD1:sc=-0.00601 X(o=0.069,f=0.075) USER MOD Set 2.1: A 73 ASN : amide:sc= 1.75 K(o=2.7,f=-1.1) USER MOD Set 2.2: A 95 HIS : no HE2:sc= 0.917 K(o=2.7,f=-4.7!) USER MOD Set 3.1: A 18 GLN : amide:sc= 2.15 K(o=4.1,f=-6.1!) USER MOD Set 3.2: A 62 GLN : amide:sc= 0.259 K(o=4.1,f=0.41!) USER MOD Set 3.3: A 64 SER OG : rot -141:sc= 1.7 USER MOD Set 4.1: A 25 LYS NZ :NH3+ -178:sc= 0.953 (180deg=0) USER MOD Set 4.2: A 61 ASN : amide:sc= 2.01 K(o=3,f=-2.5) USER MOD Set 5.1: A 10 CYS SG : rot 50:sc= -2.84 USER MOD Set 5.2: A 13 ASN : amide:sc= -0.137 K(o=-1.4,f=-5!) USER MOD Set 5.3: A 17 SER OG : rot -94:sc= 0.0499 USER MOD Set 5.4: A 36 SER OG : rot -76:sc= 1.54 USER MOD Single : A 3 ASN : amide:sc= -3.32 K(o=-3.3,f=-2.3!) USER MOD Single : A 4 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.22) USER MOD Single : A 7 TYR OH : rot 30:sc= 0.0717 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.933 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 CYS SG : rot 149:sc= -0.165 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= 0.861 K(o=0.86,f=-0.032) USER MOD Single : A 27 TYR OH : rot 132:sc= 0.193 USER MOD Single : A 33 LYS NZ :NH3+ 150:sc= 1.29 (180deg=0.964) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= 0.979 K(o=0.98,f=-2.9!) USER MOD Single : A 45 ASN : amide:sc= 0.617 K(o=0.62,f=-7.4!) USER MOD Single : A 47 ASN : amide:sc= -0.0172 K(o=-0.017,f=-1.2) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 MET CE :methyl -158:sc= -1.36 (180deg=-1.73) USER MOD Single : A 53 LYS NZ :NH3+ 164:sc= 1.27 (180deg=0.665) USER MOD Single : A 60 SER OG : rot 89:sc= 1.3 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.0233 USER MOD Single : A 74 ASN : amide:sc= 0.379 K(o=0.38,f=-0.12) USER MOD Single : A 80 THR OG1 : rot 100:sc= 0.842 USER MOD Single : A 91 MET CE :methyl -176:sc= 0 (180deg=-0.0319) USER MOD Single : A 92 THR OG1 : rot 120:sc= 0.358 USER MOD Single : A 97 LYS NZ :NH3+ -158:sc= 2.08 (180deg=1.41) USER MOD Single : A 110 GLN : amide:sc= 0.907 K(o=0.91,f=-0.049) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0.68 USER MOD Single : A 116 LYS NZ :NH3+ -170:sc= 0.829 (180deg=0.755) USER MOD Single : A 121 GLN : amide:sc= 1.16 K(o=1.2,f=-7.8!) USER MOD Single : A 129 ASN : amide:sc= 1.08 K(o=1.1,f=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 THR OG1 : rot -25:sc= 1.25 USER MOD Single : A 139 LYS NZ :NH3+ 153:sc= 0.798 (180deg=-0.0756!) USER MOD ----------------------------------------------------------------- ATOM 35 N ASN A 3 6.241 2.667 -2.971 1.00 0.00 N ATOM 36 CA ASN A 3 6.740 3.135 -4.259 1.00 0.00 C ATOM 37 C ASN A 3 8.226 2.797 -4.384 1.00 0.00 C ATOM 38 O ASN A 3 9.012 3.045 -3.466 1.00 0.00 O ATOM 39 CB ASN A 3 6.527 4.651 -4.446 1.00 0.00 C ATOM 40 CG ASN A 3 7.420 5.177 -5.527 1.00 0.00 C ATOM 41 OD1 ASN A 3 8.430 5.808 -5.237 1.00 0.00 O ATOM 42 ND2 ASN A 3 7.060 4.901 -6.769 1.00 0.00 N ATOM 0 HA ASN A 3 6.175 2.628 -5.041 1.00 0.00 H new ATOM 0 HB2 ASN A 3 5.485 4.849 -4.698 1.00 0.00 H new ATOM 0 HB3 ASN A 3 6.733 5.171 -3.511 1.00 0.00 H new ATOM 0 HD21 ASN A 3 7.635 5.218 -7.549 1.00 0.00 H new ATOM 0 HD22 ASN A 3 6.207 4.371 -6.947 1.00 0.00 H new ATOM 49 N LYS A 4 8.595 2.252 -5.540 1.00 0.00 N ATOM 50 CA LYS A 4 9.980 1.966 -5.888 1.00 0.00 C ATOM 51 C LYS A 4 10.522 3.103 -6.738 1.00 0.00 C ATOM 52 O LYS A 4 9.764 3.943 -7.207 1.00 0.00 O ATOM 53 CB LYS A 4 10.055 0.626 -6.646 1.00 0.00 C ATOM 54 CG LYS A 4 9.404 -0.603 -5.975 1.00 0.00 C ATOM 55 CD LYS A 4 10.254 -1.322 -4.916 1.00 0.00 C ATOM 56 CE LYS A 4 10.522 -0.497 -3.648 1.00 0.00 C ATOM 57 NZ LYS A 4 11.422 -1.211 -2.710 1.00 0.00 N ATOM 0 H LYS A 4 7.930 1.994 -6.269 1.00 0.00 H new ATOM 0 HA LYS A 4 10.586 1.882 -4.986 1.00 0.00 H new ATOM 0 HB2 LYS A 4 9.590 0.764 -7.622 1.00 0.00 H new ATOM 0 HB3 LYS A 4 11.106 0.397 -6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 4 8.471 -0.286 -5.509 1.00 0.00 H new ATOM 0 HG3 LYS A 4 9.144 -1.321 -6.752 1.00 0.00 H new ATOM 0 HD2 LYS A 4 9.753 -2.248 -4.633 1.00 0.00 H new ATOM 0 HD3 LYS A 4 11.209 -1.600 -5.362 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.967 0.459 -3.923 1.00 0.00 H new ATOM 0 HE3 LYS A 4 9.578 -0.277 -3.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 11.540 -0.647 -1.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 11.009 -2.134 -2.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 12.349 -1.353 -3.159 1.00 0.00 H new ATOM 71 N ILE A 5 11.823 3.123 -6.987 1.00 0.00 N ATOM 72 CA ILE A 5 12.463 4.149 -7.798 1.00 0.00 C ATOM 73 C ILE A 5 13.450 3.404 -8.691 1.00 0.00 C ATOM 74 O ILE A 5 14.073 2.447 -8.228 1.00 0.00 O ATOM 75 CB ILE A 5 13.135 5.215 -6.896 1.00 0.00 C ATOM 76 CG1 ILE A 5 12.194 5.881 -5.863 1.00 0.00 C ATOM 77 CG2 ILE A 5 13.796 6.311 -7.751 1.00 0.00 C ATOM 78 CD1 ILE A 5 12.267 5.209 -4.486 1.00 0.00 C ATOM 0 H ILE A 5 12.470 2.421 -6.629 1.00 0.00 H new ATOM 0 HA ILE A 5 11.754 4.707 -8.410 1.00 0.00 H new ATOM 0 HB ILE A 5 13.880 4.662 -6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 5 12.455 6.935 -5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 5 11.169 5.840 -6.230 1.00 0.00 H new ATOM 0 HG21 ILE A 5 14.262 7.050 -7.099 1.00 0.00 H new ATOM 0 HG22 ILE A 5 14.555 5.864 -8.393 1.00 0.00 H new ATOM 0 HG23 ILE A 5 13.040 6.797 -8.368 1.00 0.00 H new ATOM 0 HD11 ILE A 5 11.588 5.714 -3.798 1.00 0.00 H new ATOM 0 HD12 ILE A 5 11.979 4.162 -4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 5 13.286 5.273 -4.103 1.00 0.00 H new ATOM 90 N ILE A 6 13.617 3.821 -9.942 1.00 0.00 N ATOM 91 CA ILE A 6 14.514 3.159 -10.885 1.00 0.00 C ATOM 92 C ILE A 6 15.221 4.219 -11.725 1.00 0.00 C ATOM 93 O ILE A 6 14.638 5.270 -12.010 1.00 0.00 O ATOM 94 CB ILE A 6 13.740 2.107 -11.713 1.00 0.00 C ATOM 95 CG1 ILE A 6 14.701 1.305 -12.617 1.00 0.00 C ATOM 96 CG2 ILE A 6 12.587 2.732 -12.523 1.00 0.00 C ATOM 97 CD1 ILE A 6 14.059 0.058 -13.230 1.00 0.00 C ATOM 0 H ILE A 6 13.133 4.630 -10.332 1.00 0.00 H new ATOM 0 HA ILE A 6 15.290 2.602 -10.361 1.00 0.00 H new ATOM 0 HB ILE A 6 13.281 1.414 -11.008 1.00 0.00 H new ATOM 0 HG12 ILE A 6 15.059 1.952 -13.418 1.00 0.00 H new ATOM 0 HG13 ILE A 6 15.573 1.007 -12.034 1.00 0.00 H new ATOM 0 HG21 ILE A 6 12.075 1.953 -13.087 1.00 0.00 H new ATOM 0 HG22 ILE A 6 11.882 3.211 -11.843 1.00 0.00 H new ATOM 0 HG23 ILE A 6 12.988 3.475 -13.212 1.00 0.00 H new ATOM 0 HD11 ILE A 6 14.789 -0.458 -13.853 1.00 0.00 H new ATOM 0 HD12 ILE A 6 13.726 -0.608 -12.434 1.00 0.00 H new ATOM 0 HD13 ILE A 6 13.204 0.351 -13.840 1.00 0.00 H new ATOM 109 N TYR A 7 16.473 3.951 -12.106 1.00 0.00 N ATOM 110 CA TYR A 7 17.336 4.931 -12.749 1.00 0.00 C ATOM 111 C TYR A 7 18.112 4.255 -13.876 1.00 0.00 C ATOM 112 O TYR A 7 18.843 3.294 -13.632 1.00 0.00 O ATOM 113 CB TYR A 7 18.263 5.523 -11.675 1.00 0.00 C ATOM 114 CG TYR A 7 18.946 6.854 -11.946 1.00 0.00 C ATOM 115 CD1 TYR A 7 18.436 7.786 -12.872 1.00 0.00 C ATOM 116 CD2 TYR A 7 20.031 7.218 -11.125 1.00 0.00 C ATOM 117 CE1 TYR A 7 18.966 9.085 -12.940 1.00 0.00 C ATOM 118 CE2 TYR A 7 20.582 8.509 -11.205 1.00 0.00 C ATOM 119 CZ TYR A 7 20.029 9.458 -12.089 1.00 0.00 C ATOM 120 OH TYR A 7 20.502 10.735 -12.077 1.00 0.00 O ATOM 0 H TYR A 7 16.914 3.041 -11.974 1.00 0.00 H new ATOM 0 HA TYR A 7 16.761 5.742 -13.195 1.00 0.00 H new ATOM 0 HB2 TYR A 7 17.680 5.632 -10.760 1.00 0.00 H new ATOM 0 HB3 TYR A 7 19.042 4.788 -11.471 1.00 0.00 H new ATOM 0 HD1 TYR A 7 17.632 7.499 -13.534 1.00 0.00 H new ATOM 0 HD2 TYR A 7 20.442 6.501 -10.430 1.00 0.00 H new ATOM 0 HE1 TYR A 7 18.561 9.798 -13.643 1.00 0.00 H new ATOM 0 HE2 TYR A 7 21.429 8.774 -10.589 1.00 0.00 H new ATOM 0 HH TYR A 7 19.777 11.355 -12.302 1.00 0.00 H new ATOM 130 N PHE A 8 17.946 4.745 -15.102 1.00 0.00 N ATOM 131 CA PHE A 8 18.606 4.203 -16.296 1.00 0.00 C ATOM 132 C PHE A 8 19.750 5.134 -16.696 1.00 0.00 C ATOM 133 O PHE A 8 19.533 6.334 -16.855 1.00 0.00 O ATOM 134 CB PHE A 8 17.602 4.061 -17.453 1.00 0.00 C ATOM 135 CG PHE A 8 16.411 3.170 -17.151 1.00 0.00 C ATOM 136 CD1 PHE A 8 16.565 1.772 -17.106 1.00 0.00 C ATOM 137 CD2 PHE A 8 15.144 3.734 -16.913 1.00 0.00 C ATOM 138 CE1 PHE A 8 15.478 0.942 -16.789 1.00 0.00 C ATOM 139 CE2 PHE A 8 14.055 2.901 -16.610 1.00 0.00 C ATOM 140 CZ PHE A 8 14.223 1.511 -16.527 1.00 0.00 C ATOM 0 H PHE A 8 17.341 5.542 -15.301 1.00 0.00 H new ATOM 0 HA PHE A 8 19.001 3.212 -16.072 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.238 5.052 -17.724 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.125 3.664 -18.323 1.00 0.00 H new ATOM 0 HD1 PHE A 8 17.529 1.333 -17.317 1.00 0.00 H new ATOM 0 HD2 PHE A 8 15.010 4.804 -16.963 1.00 0.00 H new ATOM 0 HE1 PHE A 8 15.607 -0.129 -16.747 1.00 0.00 H new ATOM 0 HE2 PHE A 8 13.080 3.334 -16.440 1.00 0.00 H new ATOM 0 HZ PHE A 8 13.388 0.880 -16.262 1.00 0.00 H new ATOM 150 N LEU A 9 20.957 4.600 -16.875 1.00 0.00 N ATOM 151 CA LEU A 9 22.190 5.366 -17.050 1.00 0.00 C ATOM 152 C LEU A 9 22.819 5.003 -18.389 1.00 0.00 C ATOM 153 O LEU A 9 22.839 3.829 -18.762 1.00 0.00 O ATOM 154 CB LEU A 9 23.169 5.045 -15.902 1.00 0.00 C ATOM 155 CG LEU A 9 23.067 5.959 -14.668 1.00 0.00 C ATOM 156 CD1 LEU A 9 21.656 6.070 -14.088 1.00 0.00 C ATOM 157 CD2 LEU A 9 24.013 5.445 -13.578 1.00 0.00 C ATOM 0 H LEU A 9 21.109 3.592 -16.903 1.00 0.00 H new ATOM 0 HA LEU A 9 21.965 6.432 -17.033 1.00 0.00 H new ATOM 0 HB2 LEU A 9 23.004 4.015 -15.584 1.00 0.00 H new ATOM 0 HB3 LEU A 9 24.186 5.100 -16.290 1.00 0.00 H new ATOM 0 HG LEU A 9 23.345 6.958 -15.005 1.00 0.00 H new ATOM 0 HD11 LEU A 9 21.670 6.731 -13.222 1.00 0.00 H new ATOM 0 HD12 LEU A 9 20.983 6.475 -14.844 1.00 0.00 H new ATOM 0 HD13 LEU A 9 21.309 5.082 -13.785 1.00 0.00 H new ATOM 0 HD21 LEU A 9 23.944 6.090 -12.702 1.00 0.00 H new ATOM 0 HD22 LEU A 9 23.733 4.428 -13.303 1.00 0.00 H new ATOM 0 HD23 LEU A 9 25.037 5.451 -13.952 1.00 0.00 H new ATOM 169 N CYS A 10 23.373 5.992 -19.095 1.00 0.00 N ATOM 170 CA CYS A 10 24.029 5.818 -20.391 1.00 0.00 C ATOM 171 C CYS A 10 25.281 6.681 -20.508 1.00 0.00 C ATOM 172 O CYS A 10 25.501 7.603 -19.724 1.00 0.00 O ATOM 173 CB CYS A 10 23.047 6.219 -21.500 1.00 0.00 C ATOM 174 SG CYS A 10 21.886 4.870 -21.765 1.00 0.00 S ATOM 0 H CYS A 10 23.377 6.960 -18.772 1.00 0.00 H new ATOM 0 HA CYS A 10 24.324 4.773 -20.487 1.00 0.00 H new ATOM 0 HB2 CYS A 10 22.513 7.127 -21.220 1.00 0.00 H new ATOM 0 HB3 CYS A 10 23.587 6.438 -22.421 1.00 0.00 H new ATOM 0 HG CYS A 10 21.391 4.493 -20.624 1.00 0.00 H new ATOM 180 N THR A 11 26.072 6.427 -21.547 1.00 0.00 N ATOM 181 CA THR A 11 27.191 7.270 -21.944 1.00 0.00 C ATOM 182 C THR A 11 26.721 8.688 -22.316 1.00 0.00 C ATOM 183 O THR A 11 27.477 9.644 -22.154 1.00 0.00 O ATOM 184 CB THR A 11 27.958 6.560 -23.073 1.00 0.00 C ATOM 185 OG1 THR A 11 27.071 5.936 -23.989 1.00 0.00 O ATOM 186 CG2 THR A 11 28.818 5.432 -22.498 1.00 0.00 C ATOM 0 H THR A 11 25.949 5.612 -22.148 1.00 0.00 H new ATOM 0 HA THR A 11 27.875 7.412 -21.108 1.00 0.00 H new ATOM 0 HB THR A 11 28.558 7.324 -23.569 1.00 0.00 H new ATOM 0 HG1 THR A 11 27.587 5.495 -24.696 1.00 0.00 H new ATOM 0 HG21 THR A 11 29.356 4.937 -23.306 1.00 0.00 H new ATOM 0 HG22 THR A 11 29.532 5.846 -21.786 1.00 0.00 H new ATOM 0 HG23 THR A 11 28.179 4.709 -21.991 1.00 0.00 H new ATOM 194 N GLY A 12 25.459 8.844 -22.733 1.00 0.00 N ATOM 195 CA GLY A 12 24.784 10.116 -22.913 1.00 0.00 C ATOM 196 C GLY A 12 23.287 9.860 -22.787 1.00 0.00 C ATOM 197 O GLY A 12 22.789 8.856 -23.301 1.00 0.00 O ATOM 0 H GLY A 12 24.863 8.048 -22.961 1.00 0.00 H new ATOM 0 HA2 GLY A 12 25.115 10.835 -22.164 1.00 0.00 H new ATOM 0 HA3 GLY A 12 25.020 10.541 -23.889 1.00 0.00 H new ATOM 201 N ASN A 13 22.572 10.724 -22.064 1.00 0.00 N ATOM 202 CA ASN A 13 21.145 10.570 -21.767 1.00 0.00 C ATOM 203 C ASN A 13 20.292 11.011 -22.961 1.00 0.00 C ATOM 204 O ASN A 13 19.449 11.900 -22.829 1.00 0.00 O ATOM 205 CB ASN A 13 20.792 11.365 -20.501 1.00 0.00 C ATOM 206 CG ASN A 13 19.370 11.118 -19.982 1.00 0.00 C ATOM 207 OD1 ASN A 13 18.779 12.016 -19.396 1.00 0.00 O ATOM 208 ND2 ASN A 13 18.798 9.926 -20.122 1.00 0.00 N ATOM 0 H ASN A 13 22.977 11.568 -21.660 1.00 0.00 H new ATOM 0 HA ASN A 13 20.929 9.517 -21.585 1.00 0.00 H new ATOM 0 HB2 ASN A 13 21.503 11.111 -19.715 1.00 0.00 H new ATOM 0 HB3 ASN A 13 20.912 12.428 -20.708 1.00 0.00 H new ATOM 0 HD21 ASN A 13 17.867 9.759 -19.741 1.00 0.00 H new ATOM 0 HD22 ASN A 13 19.291 9.178 -20.610 1.00 0.00 H new ATOM 215 N SER A 14 20.521 10.426 -24.135 1.00 0.00 N ATOM 216 CA SER A 14 19.946 10.935 -25.377 1.00 0.00 C ATOM 217 C SER A 14 19.087 9.918 -26.125 1.00 0.00 C ATOM 218 O SER A 14 18.177 10.332 -26.842 1.00 0.00 O ATOM 219 CB SER A 14 21.085 11.447 -26.270 1.00 0.00 C ATOM 220 OG SER A 14 21.983 12.275 -25.539 1.00 0.00 O ATOM 0 H SER A 14 21.103 9.596 -24.252 1.00 0.00 H new ATOM 0 HA SER A 14 19.265 11.744 -25.114 1.00 0.00 H new ATOM 0 HB2 SER A 14 21.628 10.601 -26.691 1.00 0.00 H new ATOM 0 HB3 SER A 14 20.670 12.008 -27.107 1.00 0.00 H new ATOM 0 HG SER A 14 22.699 12.585 -26.132 1.00 0.00 H new ATOM 226 N CYS A 15 19.320 8.612 -25.954 1.00 0.00 N ATOM 227 CA CYS A 15 18.692 7.600 -26.799 1.00 0.00 C ATOM 228 C CYS A 15 18.119 6.472 -25.940 1.00 0.00 C ATOM 229 O CYS A 15 16.996 6.571 -25.449 1.00 0.00 O ATOM 230 CB CYS A 15 19.708 7.098 -27.851 1.00 0.00 C ATOM 231 SG CYS A 15 20.444 8.443 -28.821 1.00 0.00 S ATOM 0 H CYS A 15 19.940 8.235 -25.237 1.00 0.00 H new ATOM 0 HA CYS A 15 17.852 8.035 -27.341 1.00 0.00 H new ATOM 0 HB2 CYS A 15 20.501 6.544 -27.348 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.211 6.401 -28.525 1.00 0.00 H new ATOM 0 HG CYS A 15 21.654 8.117 -29.166 1.00 0.00 H new ATOM 237 N ARG A 16 18.879 5.393 -25.742 1.00 0.00 N ATOM 238 CA ARG A 16 18.382 4.160 -25.131 1.00 0.00 C ATOM 239 C ARG A 16 17.903 4.355 -23.690 1.00 0.00 C ATOM 240 O ARG A 16 16.899 3.761 -23.312 1.00 0.00 O ATOM 241 CB ARG A 16 19.450 3.064 -25.290 1.00 0.00 C ATOM 242 CG ARG A 16 20.718 3.290 -24.452 1.00 0.00 C ATOM 243 CD ARG A 16 21.983 2.639 -25.034 1.00 0.00 C ATOM 244 NE ARG A 16 22.925 3.690 -25.447 1.00 0.00 N ATOM 245 CZ ARG A 16 24.072 4.038 -24.862 1.00 0.00 C ATOM 246 NH1 ARG A 16 24.665 3.274 -23.947 1.00 0.00 N ATOM 247 NH2 ARG A 16 24.607 5.195 -25.225 1.00 0.00 N ATOM 0 H ARG A 16 19.864 5.351 -26.003 1.00 0.00 H new ATOM 0 HA ARG A 16 17.482 3.838 -25.655 1.00 0.00 H new ATOM 0 HB2 ARG A 16 19.013 2.104 -25.014 1.00 0.00 H new ATOM 0 HB3 ARG A 16 19.731 2.996 -26.341 1.00 0.00 H new ATOM 0 HG2 ARG A 16 20.888 4.362 -24.353 1.00 0.00 H new ATOM 0 HG3 ARG A 16 20.551 2.899 -23.448 1.00 0.00 H new ATOM 0 HD2 ARG A 16 22.447 1.991 -24.291 1.00 0.00 H new ATOM 0 HD3 ARG A 16 21.724 2.012 -25.887 1.00 0.00 H new ATOM 0 HE ARG A 16 22.670 4.217 -26.282 1.00 0.00 H new ATOM 0 HH11 ARG A 16 24.242 2.388 -23.671 1.00 0.00 H new ATOM 0 HH12 ARG A 16 25.542 3.575 -23.522 1.00 0.00 H new ATOM 0 HH21 ARG A 16 24.142 5.775 -25.923 1.00 0.00 H new ATOM 0 HH22 ARG A 16 25.484 5.505 -24.806 1.00 0.00 H new ATOM 261 N SER A 17 18.562 5.220 -22.916 1.00 0.00 N ATOM 262 CA SER A 17 18.124 5.590 -21.567 1.00 0.00 C ATOM 263 C SER A 17 16.719 6.192 -21.601 1.00 0.00 C ATOM 264 O SER A 17 15.837 5.770 -20.851 1.00 0.00 O ATOM 265 CB SER A 17 19.107 6.590 -20.943 1.00 0.00 C ATOM 266 OG SER A 17 19.637 7.496 -21.909 1.00 0.00 O ATOM 0 H SER A 17 19.420 5.687 -23.209 1.00 0.00 H new ATOM 0 HA SER A 17 18.101 4.687 -20.957 1.00 0.00 H new ATOM 0 HB2 SER A 17 18.602 7.153 -20.158 1.00 0.00 H new ATOM 0 HB3 SER A 17 19.925 6.046 -20.470 1.00 0.00 H new ATOM 0 HG SER A 17 20.486 7.148 -22.252 1.00 0.00 H new ATOM 272 N GLN A 18 16.516 7.161 -22.493 1.00 0.00 N ATOM 273 CA GLN A 18 15.255 7.872 -22.635 1.00 0.00 C ATOM 274 C GLN A 18 14.141 6.920 -23.076 1.00 0.00 C ATOM 275 O GLN A 18 13.046 6.950 -22.508 1.00 0.00 O ATOM 276 CB GLN A 18 15.449 9.043 -23.618 1.00 0.00 C ATOM 277 CG GLN A 18 16.205 10.226 -22.984 1.00 0.00 C ATOM 278 CD GLN A 18 15.323 11.025 -22.018 1.00 0.00 C ATOM 279 OE1 GLN A 18 14.178 10.675 -21.755 1.00 0.00 O ATOM 280 NE2 GLN A 18 15.799 12.129 -21.479 1.00 0.00 N ATOM 0 H GLN A 18 17.235 7.475 -23.144 1.00 0.00 H new ATOM 0 HA GLN A 18 14.947 8.280 -21.672 1.00 0.00 H new ATOM 0 HB2 GLN A 18 15.997 8.692 -24.492 1.00 0.00 H new ATOM 0 HB3 GLN A 18 14.475 9.384 -23.968 1.00 0.00 H new ATOM 0 HG2 GLN A 18 17.079 9.853 -22.451 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.569 10.886 -23.771 1.00 0.00 H new ATOM 0 HE21 GLN A 18 16.750 12.431 -21.690 1.00 0.00 H new ATOM 0 HE22 GLN A 18 15.216 12.682 -20.851 1.00 0.00 H new ATOM 289 N MET A 19 14.429 6.047 -24.045 1.00 0.00 N ATOM 290 CA MET A 19 13.484 5.026 -24.494 1.00 0.00 C ATOM 291 C MET A 19 13.133 4.061 -23.354 1.00 0.00 C ATOM 292 O MET A 19 11.955 3.762 -23.156 1.00 0.00 O ATOM 293 CB MET A 19 14.025 4.255 -25.713 1.00 0.00 C ATOM 294 CG MET A 19 14.223 5.148 -26.947 1.00 0.00 C ATOM 295 SD MET A 19 14.237 4.284 -28.541 1.00 0.00 S ATOM 296 CE MET A 19 15.721 3.255 -28.379 1.00 0.00 C ATOM 0 H MET A 19 15.322 6.029 -24.538 1.00 0.00 H new ATOM 0 HA MET A 19 12.572 5.537 -24.801 1.00 0.00 H new ATOM 0 HB2 MET A 19 14.976 3.791 -25.450 1.00 0.00 H new ATOM 0 HB3 MET A 19 13.335 3.449 -25.962 1.00 0.00 H new ATOM 0 HG2 MET A 19 13.429 5.894 -26.965 1.00 0.00 H new ATOM 0 HG3 MET A 19 15.164 5.687 -26.837 1.00 0.00 H new ATOM 0 HE1 MET A 19 15.857 2.667 -29.287 1.00 0.00 H new ATOM 0 HE2 MET A 19 16.591 3.893 -28.226 1.00 0.00 H new ATOM 0 HE3 MET A 19 15.608 2.585 -27.526 1.00 0.00 H new ATOM 306 N ALA A 20 14.125 3.590 -22.586 1.00 0.00 N ATOM 307 CA ALA A 20 13.902 2.665 -21.478 1.00 0.00 C ATOM 308 C ALA A 20 13.017 3.292 -20.411 1.00 0.00 C ATOM 309 O ALA A 20 12.093 2.636 -19.938 1.00 0.00 O ATOM 310 CB ALA A 20 15.237 2.215 -20.877 1.00 0.00 C ATOM 0 H ALA A 20 15.104 3.843 -22.720 1.00 0.00 H new ATOM 0 HA ALA A 20 13.386 1.788 -21.869 1.00 0.00 H new ATOM 0 HB1 ALA A 20 15.051 1.526 -20.053 1.00 0.00 H new ATOM 0 HB2 ALA A 20 15.830 1.714 -21.642 1.00 0.00 H new ATOM 0 HB3 ALA A 20 15.781 3.084 -20.508 1.00 0.00 H new ATOM 316 N GLU A 21 13.258 4.560 -20.073 1.00 0.00 N ATOM 317 CA GLU A 21 12.389 5.301 -19.169 1.00 0.00 C ATOM 318 C GLU A 21 10.953 5.330 -19.716 1.00 0.00 C ATOM 319 O GLU A 21 10.021 5.045 -18.964 1.00 0.00 O ATOM 320 CB GLU A 21 12.969 6.702 -18.923 1.00 0.00 C ATOM 321 CG GLU A 21 12.214 7.465 -17.823 1.00 0.00 C ATOM 322 CD GLU A 21 12.675 8.920 -17.640 1.00 0.00 C ATOM 323 OE1 GLU A 21 13.862 9.232 -17.888 1.00 0.00 O ATOM 324 OE2 GLU A 21 11.852 9.745 -17.178 1.00 0.00 O ATOM 0 H GLU A 21 14.055 5.095 -20.417 1.00 0.00 H new ATOM 0 HA GLU A 21 12.342 4.801 -18.202 1.00 0.00 H new ATOM 0 HB2 GLU A 21 14.019 6.614 -18.644 1.00 0.00 H new ATOM 0 HB3 GLU A 21 12.932 7.275 -19.849 1.00 0.00 H new ATOM 0 HG2 GLU A 21 11.149 7.459 -18.057 1.00 0.00 H new ATOM 0 HG3 GLU A 21 12.336 6.935 -16.879 1.00 0.00 H new ATOM 331 N GLY A 22 10.769 5.572 -21.021 1.00 0.00 N ATOM 332 CA GLY A 22 9.465 5.578 -21.668 1.00 0.00 C ATOM 333 C GLY A 22 8.721 4.271 -21.464 1.00 0.00 C ATOM 334 O GLY A 22 7.586 4.282 -20.983 1.00 0.00 O ATOM 0 H GLY A 22 11.539 5.771 -21.660 1.00 0.00 H new ATOM 0 HA2 GLY A 22 8.868 6.400 -21.273 1.00 0.00 H new ATOM 0 HA3 GLY A 22 9.591 5.760 -22.735 1.00 0.00 H new ATOM 338 N TRP A 23 9.359 3.147 -21.799 1.00 0.00 N ATOM 339 CA TRP A 23 8.759 1.829 -21.631 1.00 0.00 C ATOM 340 C TRP A 23 8.473 1.544 -20.162 1.00 0.00 C ATOM 341 O TRP A 23 7.394 1.053 -19.827 1.00 0.00 O ATOM 342 CB TRP A 23 9.686 0.754 -22.205 1.00 0.00 C ATOM 343 CG TRP A 23 9.734 0.705 -23.698 1.00 0.00 C ATOM 344 CD1 TRP A 23 10.771 1.085 -24.474 1.00 0.00 C ATOM 345 CD2 TRP A 23 8.707 0.226 -24.619 1.00 0.00 C ATOM 346 NE1 TRP A 23 10.460 0.878 -25.799 1.00 0.00 N ATOM 347 CE2 TRP A 23 9.209 0.319 -25.951 1.00 0.00 C ATOM 348 CE3 TRP A 23 7.404 -0.290 -24.456 1.00 0.00 C ATOM 349 CZ2 TRP A 23 8.459 -0.097 -27.063 1.00 0.00 C ATOM 350 CZ3 TRP A 23 6.659 -0.746 -25.558 1.00 0.00 C ATOM 351 CH2 TRP A 23 7.190 -0.664 -26.856 1.00 0.00 C ATOM 0 H TRP A 23 10.300 3.128 -22.192 1.00 0.00 H new ATOM 0 HA TRP A 23 7.813 1.812 -22.172 1.00 0.00 H new ATOM 0 HB2 TRP A 23 10.694 0.924 -21.828 1.00 0.00 H new ATOM 0 HB3 TRP A 23 9.366 -0.219 -21.833 1.00 0.00 H new ATOM 0 HD1 TRP A 23 11.704 1.490 -24.110 1.00 0.00 H new ATOM 0 HE1 TRP A 23 11.080 1.110 -26.575 1.00 0.00 H new ATOM 0 HE3 TRP A 23 6.971 -0.336 -23.468 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 8.852 0.017 -28.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 5.674 -1.161 -25.406 1.00 0.00 H new ATOM 0 HH2 TRP A 23 6.622 -1.037 -27.696 1.00 0.00 H new ATOM 362 N ALA A 24 9.424 1.857 -19.282 1.00 0.00 N ATOM 363 CA ALA A 24 9.311 1.568 -17.867 1.00 0.00 C ATOM 364 C ALA A 24 8.137 2.323 -17.256 1.00 0.00 C ATOM 365 O ALA A 24 7.364 1.714 -16.525 1.00 0.00 O ATOM 366 CB ALA A 24 10.634 1.884 -17.171 1.00 0.00 C ATOM 0 H ALA A 24 10.295 2.320 -19.540 1.00 0.00 H new ATOM 0 HA ALA A 24 9.107 0.507 -17.725 1.00 0.00 H new ATOM 0 HB1 ALA A 24 10.546 1.666 -16.107 1.00 0.00 H new ATOM 0 HB2 ALA A 24 11.427 1.273 -17.603 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.874 2.939 -17.307 1.00 0.00 H new ATOM 372 N LYS A 25 7.929 3.600 -17.595 1.00 0.00 N ATOM 373 CA LYS A 25 6.766 4.350 -17.116 1.00 0.00 C ATOM 374 C LYS A 25 5.460 3.634 -17.449 1.00 0.00 C ATOM 375 O LYS A 25 4.532 3.681 -16.641 1.00 0.00 O ATOM 376 CB LYS A 25 6.768 5.784 -17.669 1.00 0.00 C ATOM 377 CG LYS A 25 7.806 6.663 -16.951 1.00 0.00 C ATOM 378 CD LYS A 25 7.847 8.117 -17.447 1.00 0.00 C ATOM 379 CE LYS A 25 6.578 8.891 -17.058 1.00 0.00 C ATOM 380 NZ LYS A 25 6.725 10.357 -17.248 1.00 0.00 N ATOM 0 H LYS A 25 8.552 4.135 -18.200 1.00 0.00 H new ATOM 0 HA LYS A 25 6.838 4.408 -16.030 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.984 5.763 -18.737 1.00 0.00 H new ATOM 0 HB3 LYS A 25 5.776 6.221 -17.553 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.591 6.661 -15.882 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.793 6.219 -17.079 1.00 0.00 H new ATOM 0 HD2 LYS A 25 8.720 8.618 -17.030 1.00 0.00 H new ATOM 0 HD3 LYS A 25 7.961 8.128 -18.531 1.00 0.00 H new ATOM 0 HE2 LYS A 25 5.740 8.533 -17.656 1.00 0.00 H new ATOM 0 HE3 LYS A 25 6.336 8.685 -16.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 5.855 10.836 -16.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 7.528 10.701 -16.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 6.895 10.561 -18.253 1.00 0.00 H new ATOM 394 N GLN A 26 5.387 2.960 -18.601 1.00 0.00 N ATOM 395 CA GLN A 26 4.195 2.204 -18.967 1.00 0.00 C ATOM 396 C GLN A 26 4.073 0.938 -18.118 1.00 0.00 C ATOM 397 O GLN A 26 3.117 0.792 -17.355 1.00 0.00 O ATOM 398 CB GLN A 26 4.130 1.849 -20.466 1.00 0.00 C ATOM 399 CG GLN A 26 4.512 2.957 -21.454 1.00 0.00 C ATOM 400 CD GLN A 26 3.996 4.351 -21.094 1.00 0.00 C ATOM 401 OE1 GLN A 26 2.795 4.585 -20.989 1.00 0.00 O ATOM 402 NE2 GLN A 26 4.896 5.304 -20.896 1.00 0.00 N ATOM 0 H GLN A 26 6.138 2.925 -19.290 1.00 0.00 H new ATOM 0 HA GLN A 26 3.349 2.861 -18.765 1.00 0.00 H new ATOM 0 HB2 GLN A 26 4.785 0.996 -20.642 1.00 0.00 H new ATOM 0 HB3 GLN A 26 3.115 1.524 -20.695 1.00 0.00 H new ATOM 0 HG2 GLN A 26 5.599 2.997 -21.530 1.00 0.00 H new ATOM 0 HG3 GLN A 26 4.133 2.690 -22.441 1.00 0.00 H new ATOM 0 HE21 GLN A 26 5.890 5.094 -20.987 1.00 0.00 H new ATOM 0 HE22 GLN A 26 4.595 6.248 -20.653 1.00 0.00 H new ATOM 411 N TYR A 27 5.040 0.025 -18.234 1.00 0.00 N ATOM 412 CA TYR A 27 4.928 -1.314 -17.651 1.00 0.00 C ATOM 413 C TYR A 27 4.936 -1.280 -16.125 1.00 0.00 C ATOM 414 O TYR A 27 4.208 -2.044 -15.489 1.00 0.00 O ATOM 415 CB TYR A 27 6.054 -2.224 -18.149 1.00 0.00 C ATOM 416 CG TYR A 27 6.000 -2.553 -19.628 1.00 0.00 C ATOM 417 CD1 TYR A 27 4.928 -3.302 -20.151 1.00 0.00 C ATOM 418 CD2 TYR A 27 7.047 -2.148 -20.473 1.00 0.00 C ATOM 419 CE1 TYR A 27 4.899 -3.636 -21.516 1.00 0.00 C ATOM 420 CE2 TYR A 27 7.049 -2.517 -21.827 1.00 0.00 C ATOM 421 CZ TYR A 27 5.965 -3.251 -22.362 1.00 0.00 C ATOM 422 OH TYR A 27 5.940 -3.611 -23.676 1.00 0.00 O ATOM 0 H TYR A 27 5.916 0.191 -18.730 1.00 0.00 H new ATOM 0 HA TYR A 27 3.968 -1.716 -17.976 1.00 0.00 H new ATOM 0 HB2 TYR A 27 7.010 -1.747 -17.932 1.00 0.00 H new ATOM 0 HB3 TYR A 27 6.027 -3.155 -17.583 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.126 -3.621 -19.501 1.00 0.00 H new ATOM 0 HD2 TYR A 27 7.855 -1.549 -20.078 1.00 0.00 H new ATOM 0 HE1 TYR A 27 4.062 -4.187 -21.919 1.00 0.00 H new ATOM 0 HE2 TYR A 27 7.879 -2.240 -22.461 1.00 0.00 H new ATOM 0 HH TYR A 27 6.137 -2.829 -24.233 1.00 0.00 H new ATOM 432 N LEU A 28 5.737 -0.392 -15.532 1.00 0.00 N ATOM 433 CA LEU A 28 5.822 -0.229 -14.081 1.00 0.00 C ATOM 434 C LEU A 28 4.601 0.507 -13.502 1.00 0.00 C ATOM 435 O LEU A 28 4.515 0.678 -12.287 1.00 0.00 O ATOM 436 CB LEU A 28 7.146 0.455 -13.698 1.00 0.00 C ATOM 437 CG LEU A 28 8.421 -0.260 -14.201 1.00 0.00 C ATOM 438 CD1 LEU A 28 9.666 0.511 -13.755 1.00 0.00 C ATOM 439 CD2 LEU A 28 8.536 -1.712 -13.724 1.00 0.00 C ATOM 0 H LEU A 28 6.349 0.238 -16.050 1.00 0.00 H new ATOM 0 HA LEU A 28 5.811 -1.222 -13.632 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.139 1.472 -14.091 1.00 0.00 H new ATOM 0 HB3 LEU A 28 7.196 0.533 -12.612 1.00 0.00 H new ATOM 0 HG LEU A 28 8.347 -0.282 -15.288 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.559 -0.001 -14.114 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.636 1.520 -14.166 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.691 0.563 -12.667 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.454 -2.152 -14.114 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.557 -1.736 -12.634 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.679 -2.282 -14.083 1.00 0.00 H new ATOM 451 N GLY A 29 3.658 0.942 -14.345 1.00 0.00 N ATOM 452 CA GLY A 29 2.346 1.456 -13.960 1.00 0.00 C ATOM 453 C GLY A 29 2.371 2.646 -13.003 1.00 0.00 C ATOM 454 O GLY A 29 1.432 2.813 -12.226 1.00 0.00 O ATOM 0 H GLY A 29 3.797 0.944 -15.355 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.808 1.747 -14.862 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.779 0.649 -13.497 1.00 0.00 H new ATOM 458 N ASP A 30 3.441 3.449 -13.038 1.00 0.00 N ATOM 459 CA ASP A 30 3.723 4.571 -12.134 1.00 0.00 C ATOM 460 C ASP A 30 3.804 4.156 -10.651 1.00 0.00 C ATOM 461 O ASP A 30 3.898 4.996 -9.756 1.00 0.00 O ATOM 462 CB ASP A 30 2.749 5.724 -12.421 1.00 0.00 C ATOM 463 CG ASP A 30 3.054 6.998 -11.616 1.00 0.00 C ATOM 464 OD1 ASP A 30 4.200 7.500 -11.669 1.00 0.00 O ATOM 465 OD2 ASP A 30 2.134 7.540 -10.963 1.00 0.00 O ATOM 0 H ASP A 30 4.174 3.327 -13.737 1.00 0.00 H new ATOM 0 HA ASP A 30 4.728 4.939 -12.341 1.00 0.00 H new ATOM 0 HB2 ASP A 30 2.780 5.960 -13.485 1.00 0.00 H new ATOM 0 HB3 ASP A 30 1.734 5.396 -12.197 1.00 0.00 H new ATOM 470 N GLU A 31 3.854 2.848 -10.371 1.00 0.00 N ATOM 471 CA GLU A 31 4.142 2.304 -9.047 1.00 0.00 C ATOM 472 C GLU A 31 5.628 2.499 -8.705 1.00 0.00 C ATOM 473 O GLU A 31 6.032 2.368 -7.547 1.00 0.00 O ATOM 474 CB GLU A 31 3.750 0.820 -8.968 1.00 0.00 C ATOM 475 CG GLU A 31 2.259 0.574 -9.227 1.00 0.00 C ATOM 476 CD GLU A 31 1.366 1.060 -8.071 1.00 0.00 C ATOM 477 OE1 GLU A 31 1.150 0.293 -7.104 1.00 0.00 O ATOM 478 OE2 GLU A 31 0.846 2.198 -8.120 1.00 0.00 O ATOM 0 H GLU A 31 3.692 2.128 -11.075 1.00 0.00 H new ATOM 0 HA GLU A 31 3.545 2.845 -8.313 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.336 0.257 -9.695 1.00 0.00 H new ATOM 0 HB3 GLU A 31 4.009 0.434 -7.982 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.966 1.082 -10.146 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.093 -0.492 -9.385 1.00 0.00 H new ATOM 485 N TRP A 32 6.442 2.860 -9.704 1.00 0.00 N ATOM 486 CA TRP A 32 7.871 3.072 -9.617 1.00 0.00 C ATOM 487 C TRP A 32 8.135 4.481 -10.152 1.00 0.00 C ATOM 488 O TRP A 32 7.684 4.816 -11.247 1.00 0.00 O ATOM 489 CB TRP A 32 8.637 2.034 -10.458 1.00 0.00 C ATOM 490 CG TRP A 32 8.438 0.573 -10.153 1.00 0.00 C ATOM 491 CD1 TRP A 32 7.256 -0.085 -10.159 1.00 0.00 C ATOM 492 CD2 TRP A 32 9.447 -0.465 -9.932 1.00 0.00 C ATOM 493 NE1 TRP A 32 7.447 -1.421 -9.896 1.00 0.00 N ATOM 494 CE2 TRP A 32 8.783 -1.721 -9.793 1.00 0.00 C ATOM 495 CE3 TRP A 32 10.857 -0.482 -9.861 1.00 0.00 C ATOM 496 CZ2 TRP A 32 9.472 -2.927 -9.625 1.00 0.00 C ATOM 497 CZ3 TRP A 32 11.564 -1.689 -9.682 1.00 0.00 C ATOM 498 CH2 TRP A 32 10.875 -2.912 -9.582 1.00 0.00 C ATOM 0 H TRP A 32 6.088 3.019 -10.647 1.00 0.00 H new ATOM 0 HA TRP A 32 8.213 2.964 -8.588 1.00 0.00 H new ATOM 0 HB2 TRP A 32 8.372 2.193 -11.503 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.701 2.250 -10.363 1.00 0.00 H new ATOM 0 HD1 TRP A 32 6.297 0.375 -10.344 1.00 0.00 H new ATOM 0 HE1 TRP A 32 6.694 -2.101 -9.791 1.00 0.00 H new ATOM 0 HE3 TRP A 32 11.404 0.446 -9.945 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 8.932 -3.857 -9.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.642 -1.675 -9.621 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.424 -3.836 -9.473 1.00 0.00 H new ATOM 509 N LYS A 33 8.819 5.328 -9.381 1.00 0.00 N ATOM 510 CA LYS A 33 9.327 6.613 -9.846 1.00 0.00 C ATOM 511 C LYS A 33 10.475 6.339 -10.821 1.00 0.00 C ATOM 512 O LYS A 33 11.531 5.859 -10.414 1.00 0.00 O ATOM 513 CB LYS A 33 9.776 7.458 -8.645 1.00 0.00 C ATOM 514 CG LYS A 33 8.657 7.882 -7.673 1.00 0.00 C ATOM 515 CD LYS A 33 7.502 8.741 -8.210 1.00 0.00 C ATOM 516 CE LYS A 33 6.410 7.954 -8.960 1.00 0.00 C ATOM 517 NZ LYS A 33 5.388 8.846 -9.556 1.00 0.00 N ATOM 0 H LYS A 33 9.037 5.135 -8.403 1.00 0.00 H new ATOM 0 HA LYS A 33 8.554 7.181 -10.363 1.00 0.00 H new ATOM 0 HB2 LYS A 33 10.524 6.895 -8.087 1.00 0.00 H new ATOM 0 HB3 LYS A 33 10.267 8.356 -9.019 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.226 6.975 -7.249 1.00 0.00 H new ATOM 0 HG3 LYS A 33 9.121 8.428 -6.852 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.042 9.270 -7.375 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.911 9.498 -8.880 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.871 7.356 -9.746 1.00 0.00 H new ATOM 0 HE3 LYS A 33 5.927 7.260 -8.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.001 8.405 -10.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.621 9.001 -8.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.824 9.758 -9.801 1.00 0.00 H new ATOM 531 N VAL A 34 10.257 6.584 -12.108 1.00 0.00 N ATOM 532 CA VAL A 34 11.197 6.250 -13.162 1.00 0.00 C ATOM 533 C VAL A 34 12.022 7.501 -13.488 1.00 0.00 C ATOM 534 O VAL A 34 11.456 8.592 -13.603 1.00 0.00 O ATOM 535 CB VAL A 34 10.429 5.733 -14.400 1.00 0.00 C ATOM 536 CG1 VAL A 34 11.350 4.924 -15.310 1.00 0.00 C ATOM 537 CG2 VAL A 34 9.227 4.824 -14.079 1.00 0.00 C ATOM 0 H VAL A 34 9.405 7.029 -12.450 1.00 0.00 H new ATOM 0 HA VAL A 34 11.873 5.457 -12.842 1.00 0.00 H new ATOM 0 HB VAL A 34 10.059 6.641 -14.877 1.00 0.00 H new ATOM 0 HG11 VAL A 34 10.788 4.570 -16.175 1.00 0.00 H new ATOM 0 HG12 VAL A 34 12.174 5.553 -15.646 1.00 0.00 H new ATOM 0 HG13 VAL A 34 11.746 4.070 -14.760 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.750 4.510 -15.007 1.00 0.00 H new ATOM 0 HG22 VAL A 34 9.571 3.946 -13.533 1.00 0.00 H new ATOM 0 HG23 VAL A 34 8.509 5.372 -13.470 1.00 0.00 H new ATOM 547 N TYR A 35 13.335 7.343 -13.678 1.00 0.00 N ATOM 548 CA TYR A 35 14.248 8.408 -14.091 1.00 0.00 C ATOM 549 C TYR A 35 15.303 7.845 -15.048 1.00 0.00 C ATOM 550 O TYR A 35 15.530 6.632 -15.092 1.00 0.00 O ATOM 551 CB TYR A 35 14.963 8.983 -12.854 1.00 0.00 C ATOM 552 CG TYR A 35 14.066 9.622 -11.812 1.00 0.00 C ATOM 553 CD1 TYR A 35 13.651 10.960 -11.963 1.00 0.00 C ATOM 554 CD2 TYR A 35 13.666 8.887 -10.680 1.00 0.00 C ATOM 555 CE1 TYR A 35 12.832 11.562 -10.991 1.00 0.00 C ATOM 556 CE2 TYR A 35 12.855 9.487 -9.701 1.00 0.00 C ATOM 557 CZ TYR A 35 12.429 10.826 -9.853 1.00 0.00 C ATOM 558 OH TYR A 35 11.636 11.389 -8.899 1.00 0.00 O ATOM 0 H TYR A 35 13.803 6.446 -13.545 1.00 0.00 H new ATOM 0 HA TYR A 35 13.676 9.190 -14.590 1.00 0.00 H new ATOM 0 HB2 TYR A 35 15.527 8.181 -12.378 1.00 0.00 H new ATOM 0 HB3 TYR A 35 15.687 9.726 -13.189 1.00 0.00 H new ATOM 0 HD1 TYR A 35 13.963 11.526 -12.829 1.00 0.00 H new ATOM 0 HD2 TYR A 35 13.983 7.861 -10.564 1.00 0.00 H new ATOM 0 HE1 TYR A 35 12.511 12.586 -11.114 1.00 0.00 H new ATOM 0 HE2 TYR A 35 12.556 8.923 -8.830 1.00 0.00 H new ATOM 0 HH TYR A 35 11.460 10.734 -8.191 1.00 0.00 H new ATOM 568 N SER A 36 16.022 8.720 -15.750 1.00 0.00 N ATOM 569 CA SER A 36 17.198 8.352 -16.519 1.00 0.00 C ATOM 570 C SER A 36 18.202 9.506 -16.516 1.00 0.00 C ATOM 571 O SER A 36 17.835 10.649 -16.220 1.00 0.00 O ATOM 572 CB SER A 36 16.817 7.905 -17.935 1.00 0.00 C ATOM 573 OG SER A 36 16.285 8.943 -18.731 1.00 0.00 O ATOM 0 H SER A 36 15.797 9.714 -15.798 1.00 0.00 H new ATOM 0 HA SER A 36 17.679 7.494 -16.049 1.00 0.00 H new ATOM 0 HB2 SER A 36 17.699 7.496 -18.428 1.00 0.00 H new ATOM 0 HB3 SER A 36 16.087 7.099 -17.868 1.00 0.00 H new ATOM 0 HG SER A 36 15.361 9.124 -18.458 1.00 0.00 H new ATOM 579 N ALA A 37 19.470 9.198 -16.798 1.00 0.00 N ATOM 580 CA ALA A 37 20.578 10.140 -16.830 1.00 0.00 C ATOM 581 C ALA A 37 21.759 9.521 -17.588 1.00 0.00 C ATOM 582 O ALA A 37 21.629 8.471 -18.223 1.00 0.00 O ATOM 583 CB ALA A 37 20.976 10.506 -15.396 1.00 0.00 C ATOM 0 H ALA A 37 19.759 8.245 -17.019 1.00 0.00 H new ATOM 0 HA ALA A 37 20.278 11.050 -17.349 1.00 0.00 H new ATOM 0 HB1 ALA A 37 21.806 11.212 -15.418 1.00 0.00 H new ATOM 0 HB2 ALA A 37 20.126 10.961 -14.887 1.00 0.00 H new ATOM 0 HB3 ALA A 37 21.279 9.606 -14.862 1.00 0.00 H new ATOM 589 N GLY A 38 22.927 10.156 -17.527 1.00 0.00 N ATOM 590 CA GLY A 38 24.152 9.616 -18.087 1.00 0.00 C ATOM 591 C GLY A 38 25.359 10.480 -17.759 1.00 0.00 C ATOM 592 O GLY A 38 25.237 11.489 -17.061 1.00 0.00 O ATOM 0 H GLY A 38 23.045 11.067 -17.083 1.00 0.00 H new ATOM 0 HA2 GLY A 38 24.313 8.609 -17.703 1.00 0.00 H new ATOM 0 HA3 GLY A 38 24.050 9.532 -19.169 1.00 0.00 H new ATOM 596 N ILE A 39 26.518 10.067 -18.281 1.00 0.00 N ATOM 597 CA ILE A 39 27.783 10.803 -18.234 1.00 0.00 C ATOM 598 C ILE A 39 27.627 12.221 -18.815 1.00 0.00 C ATOM 599 O ILE A 39 28.332 13.137 -18.388 1.00 0.00 O ATOM 600 CB ILE A 39 28.865 9.933 -18.935 1.00 0.00 C ATOM 601 CG1 ILE A 39 29.533 9.006 -17.896 1.00 0.00 C ATOM 602 CG2 ILE A 39 29.930 10.736 -19.698 1.00 0.00 C ATOM 603 CD1 ILE A 39 30.331 7.849 -18.516 1.00 0.00 C ATOM 0 H ILE A 39 26.603 9.174 -18.767 1.00 0.00 H new ATOM 0 HA ILE A 39 28.105 10.972 -17.206 1.00 0.00 H new ATOM 0 HB ILE A 39 28.344 9.350 -19.694 1.00 0.00 H new ATOM 0 HG12 ILE A 39 30.199 9.599 -17.270 1.00 0.00 H new ATOM 0 HG13 ILE A 39 28.763 8.595 -17.243 1.00 0.00 H new ATOM 0 HG21 ILE A 39 30.644 10.051 -20.155 1.00 0.00 H new ATOM 0 HG22 ILE A 39 29.450 11.331 -20.474 1.00 0.00 H new ATOM 0 HG23 ILE A 39 30.453 11.396 -19.006 1.00 0.00 H new ATOM 0 HD11 ILE A 39 30.770 7.243 -17.723 1.00 0.00 H new ATOM 0 HD12 ILE A 39 29.666 7.231 -19.119 1.00 0.00 H new ATOM 0 HD13 ILE A 39 31.124 8.251 -19.146 1.00 0.00 H new ATOM 615 N GLU A 40 26.693 12.424 -19.746 1.00 0.00 N ATOM 616 CA GLU A 40 26.304 13.725 -20.261 1.00 0.00 C ATOM 617 C GLU A 40 24.812 13.696 -20.590 1.00 0.00 C ATOM 618 O GLU A 40 24.194 12.625 -20.628 1.00 0.00 O ATOM 619 CB GLU A 40 27.145 14.138 -21.482 1.00 0.00 C ATOM 620 CG GLU A 40 27.014 13.183 -22.680 1.00 0.00 C ATOM 621 CD GLU A 40 27.564 13.797 -23.976 1.00 0.00 C ATOM 622 OE1 GLU A 40 28.801 13.823 -24.175 1.00 0.00 O ATOM 623 OE2 GLU A 40 26.751 14.249 -24.815 1.00 0.00 O ATOM 0 H GLU A 40 26.173 11.657 -20.172 1.00 0.00 H new ATOM 0 HA GLU A 40 26.493 14.480 -19.498 1.00 0.00 H new ATOM 0 HB2 GLU A 40 26.848 15.139 -21.794 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.193 14.194 -21.187 1.00 0.00 H new ATOM 0 HG2 GLU A 40 27.547 12.257 -22.464 1.00 0.00 H new ATOM 0 HG3 GLU A 40 25.965 12.921 -22.821 1.00 0.00 H new ATOM 630 N ALA A 41 24.251 14.867 -20.880 1.00 0.00 N ATOM 631 CA ALA A 41 22.915 15.036 -21.417 1.00 0.00 C ATOM 632 C ALA A 41 22.944 16.268 -22.315 1.00 0.00 C ATOM 633 O ALA A 41 23.493 17.300 -21.924 1.00 0.00 O ATOM 634 CB ALA A 41 21.928 15.243 -20.267 1.00 0.00 C ATOM 0 H ALA A 41 24.737 15.753 -20.740 1.00 0.00 H new ATOM 0 HA ALA A 41 22.602 14.159 -21.983 1.00 0.00 H new ATOM 0 HB1 ALA A 41 20.923 15.370 -20.669 1.00 0.00 H new ATOM 0 HB2 ALA A 41 21.949 14.374 -19.609 1.00 0.00 H new ATOM 0 HB3 ALA A 41 22.208 16.132 -19.702 1.00 0.00 H new ATOM 640 N HIS A 42 22.319 16.162 -23.489 1.00 0.00 N ATOM 641 CA HIS A 42 22.158 17.262 -24.440 1.00 0.00 C ATOM 642 C HIS A 42 20.731 17.250 -25.016 1.00 0.00 C ATOM 643 O HIS A 42 20.474 17.817 -26.082 1.00 0.00 O ATOM 644 CB HIS A 42 23.268 17.189 -25.507 1.00 0.00 C ATOM 645 CG HIS A 42 24.619 17.626 -24.983 1.00 0.00 C ATOM 646 ND1 HIS A 42 25.718 16.835 -24.720 1.00 0.00 N ATOM 647 CD2 HIS A 42 24.968 18.912 -24.660 1.00 0.00 C ATOM 648 CE1 HIS A 42 26.696 17.625 -24.247 1.00 0.00 C ATOM 649 NE2 HIS A 42 26.291 18.907 -24.194 1.00 0.00 N ATOM 0 H HIS A 42 21.902 15.289 -23.812 1.00 0.00 H new ATOM 0 HA HIS A 42 22.274 18.225 -23.943 1.00 0.00 H new ATOM 0 HB2 HIS A 42 23.341 16.167 -25.878 1.00 0.00 H new ATOM 0 HB3 HIS A 42 22.992 17.817 -26.354 1.00 0.00 H new ATOM 0 HD1 HIS A 42 25.778 15.826 -24.860 1.00 0.00 H new ATOM 0 HD2 HIS A 42 24.333 19.781 -24.749 1.00 0.00 H new ATOM 0 HE1 HIS A 42 27.675 17.278 -23.950 1.00 0.00 H new ATOM 657 N GLY A 43 19.794 16.608 -24.305 1.00 0.00 N ATOM 658 CA GLY A 43 18.412 16.446 -24.727 1.00 0.00 C ATOM 659 C GLY A 43 18.254 15.146 -25.511 1.00 0.00 C ATOM 660 O GLY A 43 19.208 14.637 -26.108 1.00 0.00 O ATOM 0 H GLY A 43 19.989 16.180 -23.400 1.00 0.00 H new ATOM 0 HA2 GLY A 43 17.756 16.437 -23.856 1.00 0.00 H new ATOM 0 HA3 GLY A 43 18.110 17.292 -25.345 1.00 0.00 H new ATOM 664 N LEU A 44 17.042 14.595 -25.483 1.00 0.00 N ATOM 665 CA LEU A 44 16.725 13.348 -26.160 1.00 0.00 C ATOM 666 C LEU A 44 16.763 13.514 -27.682 1.00 0.00 C ATOM 667 O LEU A 44 16.502 14.595 -28.218 1.00 0.00 O ATOM 668 CB LEU A 44 15.391 12.769 -25.664 1.00 0.00 C ATOM 669 CG LEU A 44 14.104 13.449 -26.169 1.00 0.00 C ATOM 670 CD1 LEU A 44 12.940 12.670 -25.563 1.00 0.00 C ATOM 671 CD2 LEU A 44 13.948 14.922 -25.767 1.00 0.00 C ATOM 0 H LEU A 44 16.252 15.006 -24.987 1.00 0.00 H new ATOM 0 HA LEU A 44 17.497 12.621 -25.907 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.352 11.717 -25.947 1.00 0.00 H new ATOM 0 HB3 LEU A 44 15.389 12.807 -24.575 1.00 0.00 H new ATOM 0 HG LEU A 44 14.136 13.440 -27.258 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.998 13.111 -25.889 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.987 11.632 -25.891 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.002 12.710 -24.476 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.013 15.312 -26.169 1.00 0.00 H new ATOM 0 HD22 LEU A 44 13.938 15.003 -24.680 1.00 0.00 H new ATOM 0 HD23 LEU A 44 14.783 15.498 -26.166 1.00 0.00 H new ATOM 683 N ASN A 45 17.092 12.426 -28.375 1.00 0.00 N ATOM 684 CA ASN A 45 17.277 12.383 -29.819 1.00 0.00 C ATOM 685 C ASN A 45 15.902 12.367 -30.502 1.00 0.00 C ATOM 686 O ASN A 45 15.062 11.563 -30.097 1.00 0.00 O ATOM 687 CB ASN A 45 18.075 11.109 -30.146 1.00 0.00 C ATOM 688 CG ASN A 45 18.502 11.016 -31.605 1.00 0.00 C ATOM 689 OD1 ASN A 45 17.714 11.221 -32.519 1.00 0.00 O ATOM 690 ND2 ASN A 45 19.755 10.689 -31.856 1.00 0.00 N ATOM 0 H ASN A 45 17.242 11.521 -27.929 1.00 0.00 H new ATOM 0 HA ASN A 45 17.821 13.256 -30.180 1.00 0.00 H new ATOM 0 HB2 ASN A 45 18.962 11.073 -29.513 1.00 0.00 H new ATOM 0 HB3 ASN A 45 17.470 10.237 -29.897 1.00 0.00 H new ATOM 0 HD21 ASN A 45 20.077 10.605 -32.820 1.00 0.00 H new ATOM 0 HD22 ASN A 45 20.402 10.521 -31.086 1.00 0.00 H new ATOM 697 N PRO A 46 15.638 13.176 -31.545 1.00 0.00 N ATOM 698 CA PRO A 46 14.390 13.112 -32.305 1.00 0.00 C ATOM 699 C PRO A 46 14.006 11.706 -32.785 1.00 0.00 C ATOM 700 O PRO A 46 12.823 11.370 -32.806 1.00 0.00 O ATOM 701 CB PRO A 46 14.581 14.068 -33.486 1.00 0.00 C ATOM 702 CG PRO A 46 15.581 15.091 -32.954 1.00 0.00 C ATOM 703 CD PRO A 46 16.479 14.255 -32.042 1.00 0.00 C ATOM 0 HA PRO A 46 13.558 13.396 -31.660 1.00 0.00 H new ATOM 0 HB2 PRO A 46 14.965 13.550 -34.365 1.00 0.00 H new ATOM 0 HB3 PRO A 46 13.642 14.538 -33.778 1.00 0.00 H new ATOM 0 HG2 PRO A 46 16.147 15.558 -33.760 1.00 0.00 H new ATOM 0 HG3 PRO A 46 15.085 15.893 -32.407 1.00 0.00 H new ATOM 0 HD2 PRO A 46 17.337 13.863 -32.589 1.00 0.00 H new ATOM 0 HD3 PRO A 46 16.872 14.855 -31.221 1.00 0.00 H new ATOM 711 N ASN A 47 14.975 10.855 -33.137 1.00 0.00 N ATOM 712 CA ASN A 47 14.688 9.491 -33.572 1.00 0.00 C ATOM 713 C ASN A 47 14.248 8.630 -32.395 1.00 0.00 C ATOM 714 O ASN A 47 13.451 7.719 -32.594 1.00 0.00 O ATOM 715 CB ASN A 47 15.892 8.840 -34.267 1.00 0.00 C ATOM 716 CG ASN A 47 16.112 9.300 -35.704 1.00 0.00 C ATOM 717 OD1 ASN A 47 15.199 9.760 -36.386 1.00 0.00 O ATOM 718 ND2 ASN A 47 17.328 9.176 -36.210 1.00 0.00 N ATOM 0 H ASN A 47 15.967 11.091 -33.128 1.00 0.00 H new ATOM 0 HA ASN A 47 13.876 9.556 -34.297 1.00 0.00 H new ATOM 0 HB2 ASN A 47 16.790 9.054 -33.688 1.00 0.00 H new ATOM 0 HB3 ASN A 47 15.759 7.758 -34.261 1.00 0.00 H new ATOM 0 HD21 ASN A 47 17.512 9.463 -37.171 1.00 0.00 H new ATOM 0 HD22 ASN A 47 18.082 8.793 -35.639 1.00 0.00 H new ATOM 725 N ALA A 48 14.702 8.928 -31.172 1.00 0.00 N ATOM 726 CA ALA A 48 14.188 8.289 -29.972 1.00 0.00 C ATOM 727 C ALA A 48 12.708 8.644 -29.823 1.00 0.00 C ATOM 728 O ALA A 48 11.878 7.760 -29.616 1.00 0.00 O ATOM 729 CB ALA A 48 14.997 8.708 -28.730 1.00 0.00 C ATOM 0 H ALA A 48 15.433 9.617 -30.995 1.00 0.00 H new ATOM 0 HA ALA A 48 14.290 7.207 -30.062 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.590 8.215 -27.847 1.00 0.00 H new ATOM 0 HB2 ALA A 48 16.040 8.417 -28.860 1.00 0.00 H new ATOM 0 HB3 ALA A 48 14.935 9.789 -28.603 1.00 0.00 H new ATOM 735 N VAL A 49 12.363 9.928 -29.976 1.00 0.00 N ATOM 736 CA VAL A 49 10.980 10.392 -29.884 1.00 0.00 C ATOM 737 C VAL A 49 10.128 9.667 -30.934 1.00 0.00 C ATOM 738 O VAL A 49 9.093 9.098 -30.589 1.00 0.00 O ATOM 739 CB VAL A 49 10.904 11.932 -30.012 1.00 0.00 C ATOM 740 CG1 VAL A 49 9.466 12.444 -29.857 1.00 0.00 C ATOM 741 CG2 VAL A 49 11.767 12.620 -28.945 1.00 0.00 C ATOM 0 H VAL A 49 13.036 10.671 -30.167 1.00 0.00 H new ATOM 0 HA VAL A 49 10.575 10.149 -28.901 1.00 0.00 H new ATOM 0 HB VAL A 49 11.274 12.174 -31.008 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.454 13.530 -29.953 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.838 12.004 -30.632 1.00 0.00 H new ATOM 0 HG13 VAL A 49 9.083 12.162 -28.876 1.00 0.00 H new ATOM 0 HG21 VAL A 49 11.694 13.701 -29.060 1.00 0.00 H new ATOM 0 HG22 VAL A 49 11.415 12.336 -27.953 1.00 0.00 H new ATOM 0 HG23 VAL A 49 12.806 12.312 -29.063 1.00 0.00 H new ATOM 751 N LYS A 50 10.577 9.618 -32.196 1.00 0.00 N ATOM 752 CA LYS A 50 9.859 8.908 -33.254 1.00 0.00 C ATOM 753 C LYS A 50 9.723 7.422 -32.942 1.00 0.00 C ATOM 754 O LYS A 50 8.650 6.866 -33.169 1.00 0.00 O ATOM 755 CB LYS A 50 10.553 9.109 -34.614 1.00 0.00 C ATOM 756 CG LYS A 50 10.358 10.506 -35.226 1.00 0.00 C ATOM 757 CD LYS A 50 8.895 10.884 -35.536 1.00 0.00 C ATOM 758 CE LYS A 50 8.125 9.860 -36.393 1.00 0.00 C ATOM 759 NZ LYS A 50 8.647 9.755 -37.781 1.00 0.00 N ATOM 0 H LYS A 50 11.439 10.066 -32.506 1.00 0.00 H new ATOM 0 HA LYS A 50 8.856 9.330 -33.307 1.00 0.00 H new ATOM 0 HB2 LYS A 50 11.620 8.924 -34.494 1.00 0.00 H new ATOM 0 HB3 LYS A 50 10.177 8.363 -35.314 1.00 0.00 H new ATOM 0 HG2 LYS A 50 10.772 11.247 -34.542 1.00 0.00 H new ATOM 0 HG3 LYS A 50 10.936 10.566 -36.148 1.00 0.00 H new ATOM 0 HD2 LYS A 50 8.363 11.020 -34.594 1.00 0.00 H new ATOM 0 HD3 LYS A 50 8.885 11.846 -36.049 1.00 0.00 H new ATOM 0 HE2 LYS A 50 8.178 8.882 -35.916 1.00 0.00 H new ATOM 0 HE3 LYS A 50 7.072 10.141 -36.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 8.091 9.052 -38.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 8.572 10.680 -38.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 9.644 9.459 -37.756 1.00 0.00 H new ATOM 773 N ALA A 51 10.767 6.777 -32.417 1.00 0.00 N ATOM 774 CA ALA A 51 10.725 5.359 -32.096 1.00 0.00 C ATOM 775 C ALA A 51 9.639 5.095 -31.056 1.00 0.00 C ATOM 776 O ALA A 51 8.838 4.178 -31.227 1.00 0.00 O ATOM 777 CB ALA A 51 12.098 4.890 -31.603 1.00 0.00 C ATOM 0 H ALA A 51 11.659 7.225 -32.205 1.00 0.00 H new ATOM 0 HA ALA A 51 10.480 4.790 -32.993 1.00 0.00 H new ATOM 0 HB1 ALA A 51 12.056 3.827 -31.365 1.00 0.00 H new ATOM 0 HB2 ALA A 51 12.841 5.058 -32.382 1.00 0.00 H new ATOM 0 HB3 ALA A 51 12.375 5.451 -30.710 1.00 0.00 H new ATOM 783 N MET A 52 9.567 5.918 -30.008 1.00 0.00 N ATOM 784 CA MET A 52 8.549 5.763 -28.976 1.00 0.00 C ATOM 785 C MET A 52 7.158 6.109 -29.508 1.00 0.00 C ATOM 786 O MET A 52 6.184 5.430 -29.180 1.00 0.00 O ATOM 787 CB MET A 52 8.906 6.595 -27.741 1.00 0.00 C ATOM 788 CG MET A 52 10.227 6.143 -27.101 1.00 0.00 C ATOM 789 SD MET A 52 10.476 4.369 -26.799 1.00 0.00 S ATOM 790 CE MET A 52 9.015 4.027 -25.796 1.00 0.00 C ATOM 0 H MET A 52 10.205 6.699 -29.855 1.00 0.00 H new ATOM 0 HA MET A 52 8.523 4.715 -28.678 1.00 0.00 H new ATOM 0 HB2 MET A 52 8.981 7.646 -28.022 1.00 0.00 H new ATOM 0 HB3 MET A 52 8.103 6.517 -27.008 1.00 0.00 H new ATOM 0 HG2 MET A 52 11.041 6.489 -27.739 1.00 0.00 H new ATOM 0 HG3 MET A 52 10.328 6.660 -26.147 1.00 0.00 H new ATOM 0 HE1 MET A 52 9.183 3.127 -25.204 1.00 0.00 H new ATOM 0 HE2 MET A 52 8.825 4.869 -25.131 1.00 0.00 H new ATOM 0 HE3 MET A 52 8.154 3.878 -26.447 1.00 0.00 H new ATOM 800 N LYS A 53 7.036 7.095 -30.399 1.00 0.00 N ATOM 801 CA LYS A 53 5.766 7.358 -31.062 1.00 0.00 C ATOM 802 C LYS A 53 5.309 6.167 -31.898 1.00 0.00 C ATOM 803 O LYS A 53 4.101 5.979 -32.037 1.00 0.00 O ATOM 804 CB LYS A 53 5.829 8.624 -31.927 1.00 0.00 C ATOM 805 CG LYS A 53 5.137 9.814 -31.247 1.00 0.00 C ATOM 806 CD LYS A 53 5.944 10.444 -30.101 1.00 0.00 C ATOM 807 CE LYS A 53 5.008 11.353 -29.286 1.00 0.00 C ATOM 808 NZ LYS A 53 5.670 12.584 -28.783 1.00 0.00 N ATOM 0 H LYS A 53 7.796 7.717 -30.674 1.00 0.00 H new ATOM 0 HA LYS A 53 5.030 7.522 -30.274 1.00 0.00 H new ATOM 0 HB2 LYS A 53 6.870 8.875 -32.128 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.356 8.430 -32.890 1.00 0.00 H new ATOM 0 HG2 LYS A 53 4.935 10.579 -31.997 1.00 0.00 H new ATOM 0 HG3 LYS A 53 4.173 9.485 -30.859 1.00 0.00 H new ATOM 0 HD2 LYS A 53 6.367 9.667 -29.464 1.00 0.00 H new ATOM 0 HD3 LYS A 53 6.780 11.020 -30.498 1.00 0.00 H new ATOM 0 HE2 LYS A 53 4.157 11.635 -29.906 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.613 10.790 -28.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 4.947 13.270 -28.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 6.276 12.346 -27.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 6.251 12.999 -29.539 1.00 0.00 H new ATOM 822 N GLU A 54 6.225 5.341 -32.411 1.00 0.00 N ATOM 823 CA GLU A 54 5.862 4.176 -33.210 1.00 0.00 C ATOM 824 C GLU A 54 5.114 3.137 -32.354 1.00 0.00 C ATOM 825 O GLU A 54 4.407 2.287 -32.897 1.00 0.00 O ATOM 826 CB GLU A 54 7.088 3.592 -33.940 1.00 0.00 C ATOM 827 CG GLU A 54 6.648 2.827 -35.203 1.00 0.00 C ATOM 828 CD GLU A 54 7.787 2.054 -35.886 1.00 0.00 C ATOM 829 OE1 GLU A 54 8.013 0.879 -35.516 1.00 0.00 O ATOM 830 OE2 GLU A 54 8.408 2.586 -36.834 1.00 0.00 O ATOM 0 H GLU A 54 7.230 5.462 -32.284 1.00 0.00 H new ATOM 0 HA GLU A 54 5.170 4.492 -33.991 1.00 0.00 H new ATOM 0 HB2 GLU A 54 7.773 4.395 -34.214 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.632 2.923 -33.273 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.856 2.128 -34.936 1.00 0.00 H new ATOM 0 HG3 GLU A 54 6.223 3.534 -35.915 1.00 0.00 H new ATOM 837 N VAL A 55 5.204 3.233 -31.021 1.00 0.00 N ATOM 838 CA VAL A 55 4.541 2.318 -30.088 1.00 0.00 C ATOM 839 C VAL A 55 3.476 3.032 -29.239 1.00 0.00 C ATOM 840 O VAL A 55 2.802 2.389 -28.432 1.00 0.00 O ATOM 841 CB VAL A 55 5.601 1.567 -29.259 1.00 0.00 C ATOM 842 CG1 VAL A 55 6.445 0.684 -30.196 1.00 0.00 C ATOM 843 CG2 VAL A 55 6.512 2.527 -28.480 1.00 0.00 C ATOM 0 H VAL A 55 5.748 3.960 -30.556 1.00 0.00 H new ATOM 0 HA VAL A 55 3.984 1.570 -30.652 1.00 0.00 H new ATOM 0 HB VAL A 55 5.081 0.950 -28.526 1.00 0.00 H new ATOM 0 HG11 VAL A 55 7.197 0.151 -29.614 1.00 0.00 H new ATOM 0 HG12 VAL A 55 5.798 -0.035 -30.699 1.00 0.00 H new ATOM 0 HG13 VAL A 55 6.939 1.310 -30.939 1.00 0.00 H new ATOM 0 HG21 VAL A 55 7.243 1.953 -27.911 1.00 0.00 H new ATOM 0 HG22 VAL A 55 7.031 3.184 -29.178 1.00 0.00 H new ATOM 0 HG23 VAL A 55 5.910 3.126 -27.797 1.00 0.00 H new ATOM 853 N GLY A 56 3.280 4.338 -29.444 1.00 0.00 N ATOM 854 CA GLY A 56 2.219 5.104 -28.807 1.00 0.00 C ATOM 855 C GLY A 56 2.659 5.607 -27.437 1.00 0.00 C ATOM 856 O GLY A 56 1.836 5.709 -26.526 1.00 0.00 O ATOM 0 H GLY A 56 3.865 4.895 -30.067 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.946 5.949 -29.439 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.329 4.483 -28.702 1.00 0.00 H new ATOM 860 N ILE A 57 3.954 5.894 -27.281 1.00 0.00 N ATOM 861 CA ILE A 57 4.554 6.406 -26.063 1.00 0.00 C ATOM 862 C ILE A 57 5.175 7.752 -26.440 1.00 0.00 C ATOM 863 O ILE A 57 5.536 7.995 -27.593 1.00 0.00 O ATOM 864 CB ILE A 57 5.576 5.369 -25.520 1.00 0.00 C ATOM 865 CG1 ILE A 57 4.853 4.074 -25.074 1.00 0.00 C ATOM 866 CG2 ILE A 57 6.426 5.944 -24.367 1.00 0.00 C ATOM 867 CD1 ILE A 57 5.783 2.901 -24.727 1.00 0.00 C ATOM 0 H ILE A 57 4.632 5.769 -28.032 1.00 0.00 H new ATOM 0 HA ILE A 57 3.840 6.560 -25.254 1.00 0.00 H new ATOM 0 HB ILE A 57 6.258 5.127 -26.335 1.00 0.00 H new ATOM 0 HG12 ILE A 57 4.237 4.300 -24.204 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.177 3.760 -25.870 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.127 5.185 -24.018 1.00 0.00 H new ATOM 0 HG22 ILE A 57 6.980 6.813 -24.722 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.773 6.240 -23.546 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.186 2.040 -24.426 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.381 2.641 -25.600 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.442 3.189 -23.908 1.00 0.00 H new ATOM 879 N ASP A 58 5.327 8.621 -25.450 1.00 0.00 N ATOM 880 CA ASP A 58 6.085 9.854 -25.552 1.00 0.00 C ATOM 881 C ASP A 58 7.178 9.811 -24.493 1.00 0.00 C ATOM 882 O ASP A 58 6.969 9.299 -23.390 1.00 0.00 O ATOM 883 CB ASP A 58 5.207 11.092 -25.338 1.00 0.00 C ATOM 884 CG ASP A 58 6.117 12.321 -25.296 1.00 0.00 C ATOM 885 OD1 ASP A 58 6.842 12.523 -26.300 1.00 0.00 O ATOM 886 OD2 ASP A 58 6.249 12.956 -24.228 1.00 0.00 O ATOM 0 H ASP A 58 4.913 8.481 -24.528 1.00 0.00 H new ATOM 0 HA ASP A 58 6.503 9.932 -26.556 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.479 11.185 -26.144 1.00 0.00 H new ATOM 0 HB3 ASP A 58 4.645 11.003 -24.409 1.00 0.00 H new ATOM 891 N ILE A 59 8.324 10.396 -24.828 1.00 0.00 N ATOM 892 CA ILE A 59 9.465 10.572 -23.941 1.00 0.00 C ATOM 893 C ILE A 59 9.916 12.041 -23.917 1.00 0.00 C ATOM 894 O ILE A 59 10.803 12.394 -23.145 1.00 0.00 O ATOM 895 CB ILE A 59 10.584 9.576 -24.323 1.00 0.00 C ATOM 896 CG1 ILE A 59 10.929 9.598 -25.828 1.00 0.00 C ATOM 897 CG2 ILE A 59 10.151 8.160 -23.900 1.00 0.00 C ATOM 898 CD1 ILE A 59 12.254 8.893 -26.144 1.00 0.00 C ATOM 0 H ILE A 59 8.488 10.774 -25.761 1.00 0.00 H new ATOM 0 HA ILE A 59 9.180 10.339 -22.915 1.00 0.00 H new ATOM 0 HB ILE A 59 11.490 9.879 -23.798 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.125 9.119 -26.387 1.00 0.00 H new ATOM 0 HG13 ILE A 59 10.982 10.632 -26.169 1.00 0.00 H new ATOM 0 HG21 ILE A 59 10.932 7.447 -24.164 1.00 0.00 H new ATOM 0 HG22 ILE A 59 9.987 8.136 -22.823 1.00 0.00 H new ATOM 0 HG23 ILE A 59 9.227 7.893 -24.414 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.444 8.940 -27.216 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.065 9.387 -25.609 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.195 7.850 -25.831 1.00 0.00 H new ATOM 910 N SER A 60 9.272 12.925 -24.688 1.00 0.00 N ATOM 911 CA SER A 60 9.520 14.367 -24.657 1.00 0.00 C ATOM 912 C SER A 60 9.283 14.935 -23.250 1.00 0.00 C ATOM 913 O SER A 60 9.982 15.846 -22.819 1.00 0.00 O ATOM 914 CB SER A 60 8.632 15.088 -25.683 1.00 0.00 C ATOM 915 OG SER A 60 8.562 14.375 -26.906 1.00 0.00 O ATOM 0 H SER A 60 8.554 12.653 -25.360 1.00 0.00 H new ATOM 0 HA SER A 60 10.564 14.536 -24.920 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.629 15.210 -25.275 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.025 16.088 -25.866 1.00 0.00 H new ATOM 0 HG SER A 60 7.823 13.733 -26.868 1.00 0.00 H new ATOM 921 N ASN A 61 8.343 14.344 -22.509 1.00 0.00 N ATOM 922 CA ASN A 61 8.040 14.623 -21.102 1.00 0.00 C ATOM 923 C ASN A 61 9.175 14.282 -20.111 1.00 0.00 C ATOM 924 O ASN A 61 8.947 14.363 -18.903 1.00 0.00 O ATOM 925 CB ASN A 61 6.742 13.889 -20.704 1.00 0.00 C ATOM 926 CG ASN A 61 6.897 12.369 -20.667 1.00 0.00 C ATOM 927 OD1 ASN A 61 7.182 11.772 -19.633 1.00 0.00 O ATOM 928 ND2 ASN A 61 6.713 11.713 -21.797 1.00 0.00 N ATOM 0 H ASN A 61 7.739 13.618 -22.895 1.00 0.00 H new ATOM 0 HA ASN A 61 7.918 15.704 -21.028 1.00 0.00 H new ATOM 0 HB2 ASN A 61 6.421 14.239 -19.723 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.953 14.150 -21.410 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.807 10.698 -21.818 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.477 12.221 -22.649 1.00 0.00 H new ATOM 935 N GLN A 62 10.380 13.909 -20.565 1.00 0.00 N ATOM 936 CA GLN A 62 11.449 13.359 -19.724 1.00 0.00 C ATOM 937 C GLN A 62 12.800 14.045 -19.967 1.00 0.00 C ATOM 938 O GLN A 62 13.847 13.402 -19.866 1.00 0.00 O ATOM 939 CB GLN A 62 11.621 11.868 -20.040 1.00 0.00 C ATOM 940 CG GLN A 62 10.370 10.992 -20.085 1.00 0.00 C ATOM 941 CD GLN A 62 10.702 9.550 -20.487 1.00 0.00 C ATOM 942 OE1 GLN A 62 9.933 8.636 -20.214 1.00 0.00 O ATOM 943 NE2 GLN A 62 11.817 9.307 -21.166 1.00 0.00 N ATOM 0 H GLN A 62 10.643 13.983 -21.548 1.00 0.00 H new ATOM 0 HA GLN A 62 11.157 13.525 -18.687 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.119 11.787 -21.006 1.00 0.00 H new ATOM 0 HB3 GLN A 62 12.297 11.446 -19.297 1.00 0.00 H new ATOM 0 HG2 GLN A 62 9.888 10.995 -19.107 1.00 0.00 H new ATOM 0 HG3 GLN A 62 9.657 11.412 -20.794 1.00 0.00 H new ATOM 0 HE21 GLN A 62 12.454 10.071 -21.391 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.036 8.356 -21.463 1.00 0.00 H new ATOM 952 N THR A 63 12.785 15.317 -20.358 1.00 0.00 N ATOM 953 CA THR A 63 13.957 16.042 -20.843 1.00 0.00 C ATOM 954 C THR A 63 15.238 15.750 -20.033 1.00 0.00 C ATOM 955 O THR A 63 15.247 15.837 -18.801 1.00 0.00 O ATOM 956 CB THR A 63 13.626 17.546 -20.931 1.00 0.00 C ATOM 957 OG1 THR A 63 13.113 18.043 -19.705 1.00 0.00 O ATOM 958 CG2 THR A 63 12.537 17.799 -21.977 1.00 0.00 C ATOM 0 H THR A 63 11.938 15.885 -20.346 1.00 0.00 H new ATOM 0 HA THR A 63 14.191 15.679 -21.844 1.00 0.00 H new ATOM 0 HB THR A 63 14.559 18.046 -21.190 1.00 0.00 H new ATOM 0 HG1 THR A 63 12.916 18.999 -19.796 1.00 0.00 H new ATOM 0 HG21 THR A 63 12.318 18.866 -22.024 1.00 0.00 H new ATOM 0 HG22 THR A 63 12.883 17.457 -22.952 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.634 17.255 -21.701 1.00 0.00 H new ATOM 966 N SER A 64 16.302 15.370 -20.750 1.00 0.00 N ATOM 967 CA SER A 64 17.537 14.828 -20.226 1.00 0.00 C ATOM 968 C SER A 64 18.232 15.681 -19.167 1.00 0.00 C ATOM 969 O SER A 64 18.118 16.910 -19.150 1.00 0.00 O ATOM 970 CB SER A 64 18.476 14.596 -21.411 1.00 0.00 C ATOM 971 OG SER A 64 17.806 13.969 -22.490 1.00 0.00 O ATOM 0 H SER A 64 16.313 15.441 -21.767 1.00 0.00 H new ATOM 0 HA SER A 64 17.283 13.906 -19.703 1.00 0.00 H new ATOM 0 HB2 SER A 64 18.888 15.549 -21.742 1.00 0.00 H new ATOM 0 HB3 SER A 64 19.316 13.978 -21.095 1.00 0.00 H new ATOM 0 HG SER A 64 18.401 13.312 -22.907 1.00 0.00 H new ATOM 977 N ASP A 65 19.028 15.007 -18.336 1.00 0.00 N ATOM 978 CA ASP A 65 19.920 15.612 -17.348 1.00 0.00 C ATOM 979 C ASP A 65 21.083 14.655 -17.059 1.00 0.00 C ATOM 980 O ASP A 65 20.970 13.446 -17.285 1.00 0.00 O ATOM 981 CB ASP A 65 19.148 15.926 -16.056 1.00 0.00 C ATOM 982 CG ASP A 65 19.966 16.752 -15.044 1.00 0.00 C ATOM 983 OD1 ASP A 65 20.910 17.465 -15.450 1.00 0.00 O ATOM 984 OD2 ASP A 65 19.616 16.739 -13.842 1.00 0.00 O ATOM 0 H ASP A 65 19.070 13.988 -18.333 1.00 0.00 H new ATOM 0 HA ASP A 65 20.317 16.547 -17.744 1.00 0.00 H new ATOM 0 HB2 ASP A 65 18.238 16.470 -16.308 1.00 0.00 H new ATOM 0 HB3 ASP A 65 18.841 14.991 -15.588 1.00 0.00 H new ATOM 989 N ILE A 66 22.208 15.186 -16.584 1.00 0.00 N ATOM 990 CA ILE A 66 23.327 14.403 -16.080 1.00 0.00 C ATOM 991 C ILE A 66 22.931 13.750 -14.747 1.00 0.00 C ATOM 992 O ILE A 66 21.942 14.128 -14.112 1.00 0.00 O ATOM 993 CB ILE A 66 24.621 15.253 -15.956 1.00 0.00 C ATOM 994 CG1 ILE A 66 24.446 16.758 -15.629 1.00 0.00 C ATOM 995 CG2 ILE A 66 25.461 15.063 -17.222 1.00 0.00 C ATOM 996 CD1 ILE A 66 24.205 17.695 -16.831 1.00 0.00 C ATOM 0 H ILE A 66 22.367 16.193 -16.539 1.00 0.00 H new ATOM 0 HA ILE A 66 23.558 13.615 -16.797 1.00 0.00 H new ATOM 0 HB ILE A 66 25.127 14.871 -15.070 1.00 0.00 H new ATOM 0 HG12 ILE A 66 23.608 16.863 -14.940 1.00 0.00 H new ATOM 0 HG13 ILE A 66 25.337 17.100 -15.102 1.00 0.00 H new ATOM 0 HG21 ILE A 66 26.373 15.656 -17.146 1.00 0.00 H new ATOM 0 HG22 ILE A 66 25.721 14.010 -17.332 1.00 0.00 H new ATOM 0 HG23 ILE A 66 24.888 15.388 -18.091 1.00 0.00 H new ATOM 0 HD11 ILE A 66 24.098 18.720 -16.477 1.00 0.00 H new ATOM 0 HD12 ILE A 66 25.051 17.634 -17.516 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.295 17.394 -17.351 1.00 0.00 H new ATOM 1008 N ILE A 67 23.710 12.742 -14.346 1.00 0.00 N ATOM 1009 CA ILE A 67 23.498 11.958 -13.136 1.00 0.00 C ATOM 1010 C ILE A 67 23.469 12.883 -11.916 1.00 0.00 C ATOM 1011 O ILE A 67 24.216 13.864 -11.842 1.00 0.00 O ATOM 1012 CB ILE A 67 24.576 10.852 -13.045 1.00 0.00 C ATOM 1013 CG1 ILE A 67 24.326 9.796 -14.143 1.00 0.00 C ATOM 1014 CG2 ILE A 67 24.589 10.148 -11.679 1.00 0.00 C ATOM 1015 CD1 ILE A 67 25.526 8.887 -14.417 1.00 0.00 C ATOM 0 H ILE A 67 24.530 12.443 -14.874 1.00 0.00 H new ATOM 0 HA ILE A 67 22.531 11.456 -13.166 1.00 0.00 H new ATOM 0 HB ILE A 67 25.542 11.338 -13.180 1.00 0.00 H new ATOM 0 HG12 ILE A 67 23.475 9.180 -13.853 1.00 0.00 H new ATOM 0 HG13 ILE A 67 24.051 10.305 -15.067 1.00 0.00 H new ATOM 0 HG21 ILE A 67 25.364 9.382 -11.672 1.00 0.00 H new ATOM 0 HG22 ILE A 67 24.793 10.878 -10.895 1.00 0.00 H new ATOM 0 HG23 ILE A 67 23.619 9.684 -11.499 1.00 0.00 H new ATOM 0 HD11 ILE A 67 25.270 8.173 -15.200 1.00 0.00 H new ATOM 0 HD12 ILE A 67 26.374 9.491 -14.739 1.00 0.00 H new ATOM 0 HD13 ILE A 67 25.790 8.348 -13.507 1.00 0.00 H new ATOM 1027 N ASP A 68 22.639 12.521 -10.938 1.00 0.00 N ATOM 1028 CA ASP A 68 22.516 13.209 -9.659 1.00 0.00 C ATOM 1029 C ASP A 68 22.450 12.190 -8.520 1.00 0.00 C ATOM 1030 O ASP A 68 21.727 11.187 -8.585 1.00 0.00 O ATOM 1031 CB ASP A 68 21.280 14.112 -9.653 1.00 0.00 C ATOM 1032 CG ASP A 68 21.260 14.980 -8.388 1.00 0.00 C ATOM 1033 OD1 ASP A 68 20.875 14.474 -7.314 1.00 0.00 O ATOM 1034 OD2 ASP A 68 21.644 16.170 -8.465 1.00 0.00 O ATOM 0 H ASP A 68 22.017 11.717 -11.019 1.00 0.00 H new ATOM 0 HA ASP A 68 23.394 13.837 -9.511 1.00 0.00 H new ATOM 0 HB2 ASP A 68 21.282 14.748 -10.538 1.00 0.00 H new ATOM 0 HB3 ASP A 68 20.377 13.504 -9.699 1.00 0.00 H new ATOM 1039 N SER A 69 23.229 12.454 -7.471 1.00 0.00 N ATOM 1040 CA SER A 69 23.400 11.600 -6.307 1.00 0.00 C ATOM 1041 C SER A 69 22.089 11.259 -5.601 1.00 0.00 C ATOM 1042 O SER A 69 21.986 10.192 -4.994 1.00 0.00 O ATOM 1043 CB SER A 69 24.375 12.292 -5.342 1.00 0.00 C ATOM 1044 OG SER A 69 25.519 12.765 -6.041 1.00 0.00 O ATOM 0 H SER A 69 23.781 13.310 -7.412 1.00 0.00 H new ATOM 0 HA SER A 69 23.800 10.645 -6.647 1.00 0.00 H new ATOM 0 HB2 SER A 69 23.875 13.124 -4.846 1.00 0.00 H new ATOM 0 HB3 SER A 69 24.681 11.594 -4.563 1.00 0.00 H new ATOM 0 HG SER A 69 26.128 13.204 -5.412 1.00 0.00 H new ATOM 1050 N ASP A 70 21.078 12.121 -5.682 1.00 0.00 N ATOM 1051 CA ASP A 70 19.846 11.964 -4.919 1.00 0.00 C ATOM 1052 C ASP A 70 18.860 11.020 -5.614 1.00 0.00 C ATOM 1053 O ASP A 70 17.769 10.763 -5.105 1.00 0.00 O ATOM 1054 CB ASP A 70 19.206 13.333 -4.654 1.00 0.00 C ATOM 1055 CG ASP A 70 18.052 13.257 -3.638 1.00 0.00 C ATOM 1056 OD1 ASP A 70 18.274 12.809 -2.491 1.00 0.00 O ATOM 1057 OD2 ASP A 70 16.931 13.720 -3.953 1.00 0.00 O ATOM 0 H ASP A 70 21.092 12.948 -6.279 1.00 0.00 H new ATOM 0 HA ASP A 70 20.102 11.508 -3.963 1.00 0.00 H new ATOM 0 HB2 ASP A 70 19.967 14.021 -4.284 1.00 0.00 H new ATOM 0 HB3 ASP A 70 18.833 13.744 -5.592 1.00 0.00 H new ATOM 1062 N ILE A 71 19.236 10.484 -6.780 1.00 0.00 N ATOM 1063 CA ILE A 71 18.527 9.419 -7.462 1.00 0.00 C ATOM 1064 C ILE A 71 19.440 8.191 -7.409 1.00 0.00 C ATOM 1065 O ILE A 71 18.963 7.119 -7.060 1.00 0.00 O ATOM 1066 CB ILE A 71 18.147 9.851 -8.892 1.00 0.00 C ATOM 1067 CG1 ILE A 71 17.346 11.176 -8.937 1.00 0.00 C ATOM 1068 CG2 ILE A 71 17.317 8.742 -9.555 1.00 0.00 C ATOM 1069 CD1 ILE A 71 17.542 11.891 -10.273 1.00 0.00 C ATOM 0 H ILE A 71 20.068 10.795 -7.282 1.00 0.00 H new ATOM 0 HA ILE A 71 17.578 9.178 -6.984 1.00 0.00 H new ATOM 0 HB ILE A 71 19.080 10.020 -9.429 1.00 0.00 H new ATOM 0 HG12 ILE A 71 16.287 10.970 -8.783 1.00 0.00 H new ATOM 0 HG13 ILE A 71 17.666 11.826 -8.123 1.00 0.00 H new ATOM 0 HG21 ILE A 71 17.047 9.045 -10.567 1.00 0.00 H new ATOM 0 HG22 ILE A 71 17.903 7.824 -9.596 1.00 0.00 H new ATOM 0 HG23 ILE A 71 16.411 8.569 -8.974 1.00 0.00 H new ATOM 0 HD11 ILE A 71 16.969 12.818 -10.277 1.00 0.00 H new ATOM 0 HD12 ILE A 71 18.599 12.118 -10.413 1.00 0.00 H new ATOM 0 HD13 ILE A 71 17.198 11.248 -11.084 1.00 0.00 H new ATOM 1081 N LEU A 72 20.755 8.340 -7.624 1.00 0.00 N ATOM 1082 CA LEU A 72 21.734 7.248 -7.491 1.00 0.00 C ATOM 1083 C LEU A 72 21.550 6.475 -6.188 1.00 0.00 C ATOM 1084 O LEU A 72 21.375 5.260 -6.198 1.00 0.00 O ATOM 1085 CB LEU A 72 23.179 7.784 -7.473 1.00 0.00 C ATOM 1086 CG LEU A 72 23.801 8.212 -8.803 1.00 0.00 C ATOM 1087 CD1 LEU A 72 25.219 8.724 -8.519 1.00 0.00 C ATOM 1088 CD2 LEU A 72 23.858 7.048 -9.801 1.00 0.00 C ATOM 0 H LEU A 72 21.174 9.229 -7.897 1.00 0.00 H new ATOM 0 HA LEU A 72 21.565 6.601 -8.352 1.00 0.00 H new ATOM 0 HB2 LEU A 72 23.210 8.640 -6.799 1.00 0.00 H new ATOM 0 HB3 LEU A 72 23.816 7.013 -7.039 1.00 0.00 H new ATOM 0 HG LEU A 72 23.186 8.993 -9.251 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.687 9.037 -9.453 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.170 9.572 -7.836 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.810 7.928 -8.066 1.00 0.00 H new ATOM 0 HD21 LEU A 72 24.306 7.390 -10.734 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.460 6.241 -9.384 1.00 0.00 H new ATOM 0 HD23 LEU A 72 22.849 6.685 -9.995 1.00 0.00 H new ATOM 1100 N ASN A 73 21.611 7.188 -5.063 1.00 0.00 N ATOM 1101 CA ASN A 73 21.581 6.596 -3.722 1.00 0.00 C ATOM 1102 C ASN A 73 20.155 6.310 -3.234 1.00 0.00 C ATOM 1103 O ASN A 73 19.967 5.910 -2.084 1.00 0.00 O ATOM 1104 CB ASN A 73 22.266 7.525 -2.699 1.00 0.00 C ATOM 1105 CG ASN A 73 23.733 7.787 -2.998 1.00 0.00 C ATOM 1106 OD1 ASN A 73 24.597 6.959 -2.726 1.00 0.00 O ATOM 1107 ND2 ASN A 73 24.033 8.942 -3.567 1.00 0.00 N ATOM 0 H ASN A 73 21.684 8.205 -5.056 1.00 0.00 H new ATOM 0 HA ASN A 73 22.117 5.650 -3.799 1.00 0.00 H new ATOM 0 HB2 ASN A 73 21.734 8.476 -2.672 1.00 0.00 H new ATOM 0 HB3 ASN A 73 22.180 7.084 -1.706 1.00 0.00 H new ATOM 0 HD21 ASN A 73 25.003 9.163 -3.791 1.00 0.00 H new ATOM 0 HD22 ASN A 73 23.294 9.612 -3.782 1.00 0.00 H new ATOM 1114 N ASN A 74 19.146 6.537 -4.077 1.00 0.00 N ATOM 1115 CA ASN A 74 17.733 6.542 -3.700 1.00 0.00 C ATOM 1116 C ASN A 74 16.909 5.571 -4.548 1.00 0.00 C ATOM 1117 O ASN A 74 15.906 5.034 -4.083 1.00 0.00 O ATOM 1118 CB ASN A 74 17.271 7.988 -3.905 1.00 0.00 C ATOM 1119 CG ASN A 74 15.819 8.295 -3.563 1.00 0.00 C ATOM 1120 OD1 ASN A 74 15.147 7.599 -2.810 1.00 0.00 O ATOM 1121 ND2 ASN A 74 15.329 9.398 -4.103 1.00 0.00 N ATOM 0 H ASN A 74 19.294 6.728 -5.068 1.00 0.00 H new ATOM 0 HA ASN A 74 17.596 6.209 -2.671 1.00 0.00 H new ATOM 0 HB2 ASN A 74 17.907 8.637 -3.304 1.00 0.00 H new ATOM 0 HB3 ASN A 74 17.439 8.255 -4.948 1.00 0.00 H new ATOM 0 HD21 ASN A 74 14.373 9.686 -3.896 1.00 0.00 H new ATOM 0 HD22 ASN A 74 15.907 9.961 -4.727 1.00 0.00 H new ATOM 1128 N ALA A 75 17.354 5.309 -5.776 1.00 0.00 N ATOM 1129 CA ALA A 75 16.799 4.312 -6.661 1.00 0.00 C ATOM 1130 C ALA A 75 16.861 2.955 -5.968 1.00 0.00 C ATOM 1131 O ALA A 75 17.869 2.602 -5.361 1.00 0.00 O ATOM 1132 CB ALA A 75 17.519 4.367 -8.010 1.00 0.00 C ATOM 0 H ALA A 75 18.141 5.810 -6.188 1.00 0.00 H new ATOM 0 HA ALA A 75 15.748 4.504 -6.879 1.00 0.00 H new ATOM 0 HB1 ALA A 75 17.099 3.614 -8.677 1.00 0.00 H new ATOM 0 HB2 ALA A 75 17.390 5.355 -8.451 1.00 0.00 H new ATOM 0 HB3 ALA A 75 18.581 4.171 -7.864 1.00 0.00 H new ATOM 1138 N ASP A 76 15.769 2.198 -6.046 1.00 0.00 N ATOM 1139 CA ASP A 76 15.741 0.800 -5.630 1.00 0.00 C ATOM 1140 C ASP A 76 16.700 0.000 -6.512 1.00 0.00 C ATOM 1141 O ASP A 76 17.367 -0.920 -6.038 1.00 0.00 O ATOM 1142 CB ASP A 76 14.322 0.225 -5.742 1.00 0.00 C ATOM 1143 CG ASP A 76 14.257 -1.219 -5.221 1.00 0.00 C ATOM 1144 OD1 ASP A 76 14.562 -2.166 -5.981 1.00 0.00 O ATOM 1145 OD2 ASP A 76 13.866 -1.404 -4.046 1.00 0.00 O ATOM 0 H ASP A 76 14.876 2.539 -6.401 1.00 0.00 H new ATOM 0 HA ASP A 76 16.051 0.733 -4.587 1.00 0.00 H new ATOM 0 HB2 ASP A 76 13.630 0.849 -5.176 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.998 0.252 -6.782 1.00 0.00 H new ATOM 1150 N LEU A 77 16.806 0.395 -7.785 1.00 0.00 N ATOM 1151 CA LEU A 77 17.648 -0.248 -8.783 1.00 0.00 C ATOM 1152 C LEU A 77 18.197 0.810 -9.731 1.00 0.00 C ATOM 1153 O LEU A 77 17.454 1.672 -10.202 1.00 0.00 O ATOM 1154 CB LEU A 77 16.804 -1.271 -9.570 1.00 0.00 C ATOM 1155 CG LEU A 77 17.538 -1.918 -10.764 1.00 0.00 C ATOM 1156 CD1 LEU A 77 18.727 -2.776 -10.322 1.00 0.00 C ATOM 1157 CD2 LEU A 77 16.569 -2.793 -11.558 1.00 0.00 C ATOM 0 H LEU A 77 16.291 1.194 -8.154 1.00 0.00 H new ATOM 0 HA LEU A 77 18.478 -0.761 -8.298 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.480 -2.058 -8.889 1.00 0.00 H new ATOM 0 HB3 LEU A 77 15.904 -0.777 -9.937 1.00 0.00 H new ATOM 0 HG LEU A 77 17.918 -1.105 -11.382 1.00 0.00 H new ATOM 0 HD11 LEU A 77 19.209 -3.209 -11.199 1.00 0.00 H new ATOM 0 HD12 LEU A 77 19.443 -2.156 -9.783 1.00 0.00 H new ATOM 0 HD13 LEU A 77 18.376 -3.575 -9.669 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.094 -3.246 -12.399 1.00 0.00 H new ATOM 0 HD22 LEU A 77 16.174 -3.577 -10.912 1.00 0.00 H new ATOM 0 HD23 LEU A 77 15.748 -2.181 -11.930 1.00 0.00 H new ATOM 1169 N VAL A 78 19.477 0.697 -10.065 1.00 0.00 N ATOM 1170 CA VAL A 78 20.108 1.476 -11.119 1.00 0.00 C ATOM 1171 C VAL A 78 20.435 0.487 -12.241 1.00 0.00 C ATOM 1172 O VAL A 78 20.724 -0.680 -11.979 1.00 0.00 O ATOM 1173 CB VAL A 78 21.338 2.217 -10.552 1.00 0.00 C ATOM 1174 CG1 VAL A 78 22.000 3.102 -11.612 1.00 0.00 C ATOM 1175 CG2 VAL A 78 20.949 3.124 -9.373 1.00 0.00 C ATOM 0 H VAL A 78 20.115 0.050 -9.602 1.00 0.00 H new ATOM 0 HA VAL A 78 19.464 2.259 -11.520 1.00 0.00 H new ATOM 0 HB VAL A 78 22.032 1.444 -10.223 1.00 0.00 H new ATOM 0 HG11 VAL A 78 22.862 3.608 -11.177 1.00 0.00 H new ATOM 0 HG12 VAL A 78 22.326 2.485 -12.449 1.00 0.00 H new ATOM 0 HG13 VAL A 78 21.284 3.844 -11.965 1.00 0.00 H new ATOM 0 HG21 VAL A 78 21.837 3.632 -8.996 1.00 0.00 H new ATOM 0 HG22 VAL A 78 20.222 3.864 -9.708 1.00 0.00 H new ATOM 0 HG23 VAL A 78 20.512 2.520 -8.578 1.00 0.00 H new ATOM 1185 N VAL A 79 20.390 0.917 -13.497 1.00 0.00 N ATOM 1186 CA VAL A 79 20.619 0.059 -14.647 1.00 0.00 C ATOM 1187 C VAL A 79 21.543 0.845 -15.564 1.00 0.00 C ATOM 1188 O VAL A 79 21.178 1.935 -16.003 1.00 0.00 O ATOM 1189 CB VAL A 79 19.281 -0.294 -15.336 1.00 0.00 C ATOM 1190 CG1 VAL A 79 19.480 -1.415 -16.368 1.00 0.00 C ATOM 1191 CG2 VAL A 79 18.164 -0.718 -14.367 1.00 0.00 C ATOM 0 H VAL A 79 20.190 1.886 -13.745 1.00 0.00 H new ATOM 0 HA VAL A 79 21.069 -0.894 -14.368 1.00 0.00 H new ATOM 0 HB VAL A 79 18.961 0.630 -15.817 1.00 0.00 H new ATOM 0 HG11 VAL A 79 18.526 -1.648 -16.841 1.00 0.00 H new ATOM 0 HG12 VAL A 79 20.191 -1.089 -17.127 1.00 0.00 H new ATOM 0 HG13 VAL A 79 19.864 -2.305 -15.869 1.00 0.00 H new ATOM 0 HG21 VAL A 79 17.260 -0.948 -14.932 1.00 0.00 H new ATOM 0 HG22 VAL A 79 18.480 -1.601 -13.812 1.00 0.00 H new ATOM 0 HG23 VAL A 79 17.959 0.095 -13.670 1.00 0.00 H new ATOM 1201 N THR A 80 22.737 0.329 -15.845 1.00 0.00 N ATOM 1202 CA THR A 80 23.613 0.920 -16.849 1.00 0.00 C ATOM 1203 C THR A 80 23.361 0.218 -18.176 1.00 0.00 C ATOM 1204 O THR A 80 23.312 -1.009 -18.235 1.00 0.00 O ATOM 1205 CB THR A 80 25.086 0.837 -16.417 1.00 0.00 C ATOM 1206 OG1 THR A 80 25.390 -0.364 -15.722 1.00 0.00 O ATOM 1207 CG2 THR A 80 25.420 2.018 -15.508 1.00 0.00 C ATOM 0 H THR A 80 23.119 -0.500 -15.389 1.00 0.00 H new ATOM 0 HA THR A 80 23.392 1.981 -16.962 1.00 0.00 H new ATOM 0 HB THR A 80 25.683 0.858 -17.329 1.00 0.00 H new ATOM 0 HG1 THR A 80 25.819 -0.997 -16.335 1.00 0.00 H new ATOM 0 HG21 THR A 80 26.465 1.958 -15.202 1.00 0.00 H new ATOM 0 HG22 THR A 80 25.253 2.951 -16.047 1.00 0.00 H new ATOM 0 HG23 THR A 80 24.782 1.990 -14.625 1.00 0.00 H new ATOM 1215 N LEU A 81 23.212 0.996 -19.248 1.00 0.00 N ATOM 1216 CA LEU A 81 22.872 0.500 -20.586 1.00 0.00 C ATOM 1217 C LEU A 81 24.119 0.596 -21.485 1.00 0.00 C ATOM 1218 O LEU A 81 24.021 0.768 -22.704 1.00 0.00 O ATOM 1219 CB LEU A 81 21.652 1.266 -21.157 1.00 0.00 C ATOM 1220 CG LEU A 81 20.254 0.983 -20.552 1.00 0.00 C ATOM 1221 CD1 LEU A 81 20.151 1.269 -19.052 1.00 0.00 C ATOM 1222 CD2 LEU A 81 19.183 1.852 -21.233 1.00 0.00 C ATOM 0 H LEU A 81 23.326 2.009 -19.212 1.00 0.00 H new ATOM 0 HA LEU A 81 22.575 -0.548 -20.539 1.00 0.00 H new ATOM 0 HB2 LEU A 81 21.850 2.332 -21.050 1.00 0.00 H new ATOM 0 HB3 LEU A 81 21.600 1.057 -22.226 1.00 0.00 H new ATOM 0 HG LEU A 81 20.096 -0.082 -20.719 1.00 0.00 H new ATOM 0 HD11 LEU A 81 19.141 1.045 -18.707 1.00 0.00 H new ATOM 0 HD12 LEU A 81 20.865 0.646 -18.513 1.00 0.00 H new ATOM 0 HD13 LEU A 81 20.373 2.320 -18.866 1.00 0.00 H new ATOM 0 HD21 LEU A 81 18.208 1.639 -20.794 1.00 0.00 H new ATOM 0 HD22 LEU A 81 19.423 2.905 -21.088 1.00 0.00 H new ATOM 0 HD23 LEU A 81 19.157 1.629 -22.300 1.00 0.00 H new ATOM 1234 N CYS A 82 25.318 0.568 -20.892 1.00 0.00 N ATOM 1235 CA CYS A 82 26.587 0.681 -21.591 1.00 0.00 C ATOM 1236 C CYS A 82 26.903 -0.598 -22.383 1.00 0.00 C ATOM 1237 O CYS A 82 27.286 -1.613 -21.809 1.00 0.00 O ATOM 1238 CB CYS A 82 27.719 1.049 -20.613 1.00 0.00 C ATOM 1239 SG CYS A 82 27.883 0.053 -19.097 1.00 0.00 S ATOM 0 H CYS A 82 25.427 0.463 -19.883 1.00 0.00 H new ATOM 0 HA CYS A 82 26.506 1.491 -22.316 1.00 0.00 H new ATOM 0 HB2 CYS A 82 28.663 0.993 -21.155 1.00 0.00 H new ATOM 0 HB3 CYS A 82 27.583 2.089 -20.318 1.00 0.00 H new ATOM 0 HG CYS A 82 28.882 0.496 -18.393 1.00 0.00 H new ATOM 1244 N GLY A 83 26.728 -0.555 -23.703 1.00 0.00 N ATOM 1245 CA GLY A 83 27.176 -1.578 -24.646 1.00 0.00 C ATOM 1246 C GLY A 83 27.439 -0.939 -26.021 1.00 0.00 C ATOM 1247 O GLY A 83 27.494 -1.630 -27.037 1.00 0.00 O ATOM 0 H GLY A 83 26.253 0.222 -24.162 1.00 0.00 H new ATOM 0 HA2 GLY A 83 28.084 -2.054 -24.276 1.00 0.00 H new ATOM 0 HA3 GLY A 83 26.421 -2.359 -24.736 1.00 0.00 H new ATOM 1327 N PRO A 90 28.890 4.705 -16.950 1.00 0.00 N ATOM 1328 CA PRO A 90 28.720 5.665 -15.861 1.00 0.00 C ATOM 1329 C PRO A 90 28.865 5.019 -14.476 1.00 0.00 C ATOM 1330 O PRO A 90 28.368 3.912 -14.243 1.00 0.00 O ATOM 1331 CB PRO A 90 27.328 6.264 -16.044 1.00 0.00 C ATOM 1332 CG PRO A 90 27.017 6.058 -17.519 1.00 0.00 C ATOM 1333 CD PRO A 90 27.764 4.782 -17.872 1.00 0.00 C ATOM 0 HA PRO A 90 29.499 6.426 -15.902 1.00 0.00 H new ATOM 0 HB2 PRO A 90 26.595 5.765 -15.410 1.00 0.00 H new ATOM 0 HB3 PRO A 90 27.313 7.321 -15.779 1.00 0.00 H new ATOM 0 HG2 PRO A 90 25.946 5.955 -17.691 1.00 0.00 H new ATOM 0 HG3 PRO A 90 27.357 6.900 -18.121 1.00 0.00 H new ATOM 0 HD2 PRO A 90 27.117 3.911 -17.771 1.00 0.00 H new ATOM 0 HD3 PRO A 90 28.108 4.805 -18.906 1.00 0.00 H new ATOM 1341 N MET A 91 29.538 5.715 -13.557 1.00 0.00 N ATOM 1342 CA MET A 91 29.769 5.237 -12.206 1.00 0.00 C ATOM 1343 C MET A 91 28.480 5.300 -11.388 1.00 0.00 C ATOM 1344 O MET A 91 27.650 6.197 -11.560 1.00 0.00 O ATOM 1345 CB MET A 91 30.871 6.068 -11.523 1.00 0.00 C ATOM 1346 CG MET A 91 32.253 5.878 -12.165 1.00 0.00 C ATOM 1347 SD MET A 91 32.911 4.181 -12.174 1.00 0.00 S ATOM 1348 CE MET A 91 33.145 3.892 -10.397 1.00 0.00 C ATOM 0 H MET A 91 29.939 6.635 -13.739 1.00 0.00 H new ATOM 0 HA MET A 91 30.097 4.199 -12.261 1.00 0.00 H new ATOM 0 HB2 MET A 91 30.600 7.123 -11.563 1.00 0.00 H new ATOM 0 HB3 MET A 91 30.925 5.793 -10.470 1.00 0.00 H new ATOM 0 HG2 MET A 91 32.203 6.231 -13.195 1.00 0.00 H new ATOM 0 HG3 MET A 91 32.964 6.518 -11.642 1.00 0.00 H new ATOM 0 HE1 MET A 91 33.611 2.918 -10.245 1.00 0.00 H new ATOM 0 HE2 MET A 91 33.787 4.670 -9.983 1.00 0.00 H new ATOM 0 HE3 MET A 91 32.178 3.914 -9.894 1.00 0.00 H new ATOM 1358 N THR A 92 28.365 4.372 -10.445 1.00 0.00 N ATOM 1359 CA THR A 92 27.272 4.217 -9.501 1.00 0.00 C ATOM 1360 C THR A 92 27.847 4.056 -8.079 1.00 0.00 C ATOM 1361 O THR A 92 29.014 3.668 -7.937 1.00 0.00 O ATOM 1362 CB THR A 92 26.478 2.974 -9.932 1.00 0.00 C ATOM 1363 OG1 THR A 92 27.340 1.853 -10.073 1.00 0.00 O ATOM 1364 CG2 THR A 92 25.785 3.194 -11.282 1.00 0.00 C ATOM 0 H THR A 92 29.084 3.661 -10.313 1.00 0.00 H new ATOM 0 HA THR A 92 26.616 5.087 -9.492 1.00 0.00 H new ATOM 0 HB THR A 92 25.734 2.793 -9.157 1.00 0.00 H new ATOM 0 HG1 THR A 92 27.058 1.144 -9.457 1.00 0.00 H new ATOM 0 HG21 THR A 92 25.232 2.296 -11.558 1.00 0.00 H new ATOM 0 HG22 THR A 92 25.096 4.035 -11.204 1.00 0.00 H new ATOM 0 HG23 THR A 92 26.534 3.408 -12.045 1.00 0.00 H new ATOM 1372 N PRO A 93 27.071 4.327 -7.013 1.00 0.00 N ATOM 1373 CA PRO A 93 27.522 4.101 -5.647 1.00 0.00 C ATOM 1374 C PRO A 93 27.502 2.595 -5.318 1.00 0.00 C ATOM 1375 O PRO A 93 26.737 1.842 -5.927 1.00 0.00 O ATOM 1376 CB PRO A 93 26.539 4.890 -4.775 1.00 0.00 C ATOM 1377 CG PRO A 93 25.235 4.824 -5.563 1.00 0.00 C ATOM 1378 CD PRO A 93 25.712 4.848 -7.018 1.00 0.00 C ATOM 0 HA PRO A 93 28.549 4.428 -5.481 1.00 0.00 H new ATOM 0 HB2 PRO A 93 26.433 4.445 -3.786 1.00 0.00 H new ATOM 0 HB3 PRO A 93 26.868 5.919 -4.629 1.00 0.00 H new ATOM 0 HG2 PRO A 93 24.672 3.918 -5.337 1.00 0.00 H new ATOM 0 HG3 PRO A 93 24.584 5.668 -5.338 1.00 0.00 H new ATOM 0 HD2 PRO A 93 25.065 4.239 -7.649 1.00 0.00 H new ATOM 0 HD3 PRO A 93 25.686 5.861 -7.419 1.00 0.00 H new ATOM 1386 N PRO A 94 28.254 2.144 -4.300 1.00 0.00 N ATOM 1387 CA PRO A 94 28.149 0.787 -3.772 1.00 0.00 C ATOM 1388 C PRO A 94 26.855 0.607 -2.958 1.00 0.00 C ATOM 1389 O PRO A 94 26.447 -0.521 -2.682 1.00 0.00 O ATOM 1390 CB PRO A 94 29.395 0.611 -2.904 1.00 0.00 C ATOM 1391 CG PRO A 94 29.638 2.017 -2.357 1.00 0.00 C ATOM 1392 CD PRO A 94 29.156 2.936 -3.481 1.00 0.00 C ATOM 0 HA PRO A 94 28.099 0.037 -4.562 1.00 0.00 H new ATOM 0 HB2 PRO A 94 29.230 -0.110 -2.103 1.00 0.00 H new ATOM 0 HB3 PRO A 94 30.244 0.252 -3.486 1.00 0.00 H new ATOM 0 HG2 PRO A 94 29.083 2.189 -1.435 1.00 0.00 H new ATOM 0 HG3 PRO A 94 30.691 2.181 -2.130 1.00 0.00 H new ATOM 0 HD2 PRO A 94 28.646 3.810 -3.076 1.00 0.00 H new ATOM 0 HD3 PRO A 94 29.996 3.302 -4.071 1.00 0.00 H new ATOM 1400 N HIS A 95 26.211 1.717 -2.571 1.00 0.00 N ATOM 1401 CA HIS A 95 25.006 1.752 -1.751 1.00 0.00 C ATOM 1402 C HIS A 95 23.775 1.194 -2.475 1.00 0.00 C ATOM 1403 O HIS A 95 22.753 0.981 -1.819 1.00 0.00 O ATOM 1404 CB HIS A 95 24.717 3.205 -1.328 1.00 0.00 C ATOM 1405 CG HIS A 95 25.897 3.971 -0.774 1.00 0.00 C ATOM 1406 ND1 HIS A 95 26.231 5.270 -1.089 1.00 0.00 N ATOM 1407 CD2 HIS A 95 26.826 3.524 0.128 1.00 0.00 C ATOM 1408 CE1 HIS A 95 27.339 5.595 -0.401 1.00 0.00 C ATOM 1409 NE2 HIS A 95 27.745 4.558 0.358 1.00 0.00 N ATOM 0 H HIS A 95 26.533 2.648 -2.834 1.00 0.00 H new ATOM 0 HA HIS A 95 25.193 1.119 -0.884 1.00 0.00 H new ATOM 0 HB2 HIS A 95 24.329 3.745 -2.191 1.00 0.00 H new ATOM 0 HB3 HIS A 95 23.928 3.196 -0.576 1.00 0.00 H new ATOM 0 HD1 HIS A 95 25.725 5.879 -1.732 1.00 0.00 H new ATOM 0 HD2 HIS A 95 26.847 2.545 0.583 1.00 0.00 H new ATOM 0 HE1 HIS A 95 27.835 6.553 -0.450 1.00 0.00 H new ATOM 1417 N VAL A 96 23.834 0.981 -3.799 1.00 0.00 N ATOM 1418 CA VAL A 96 22.647 0.662 -4.593 1.00 0.00 C ATOM 1419 C VAL A 96 22.804 -0.654 -5.362 1.00 0.00 C ATOM 1420 O VAL A 96 23.905 -1.034 -5.771 1.00 0.00 O ATOM 1421 CB VAL A 96 22.288 1.873 -5.485 1.00 0.00 C ATOM 1422 CG1 VAL A 96 23.143 2.000 -6.753 1.00 0.00 C ATOM 1423 CG2 VAL A 96 20.803 1.851 -5.845 1.00 0.00 C ATOM 0 H VAL A 96 24.698 1.025 -4.340 1.00 0.00 H new ATOM 0 HA VAL A 96 21.802 0.485 -3.928 1.00 0.00 H new ATOM 0 HB VAL A 96 22.513 2.756 -4.886 1.00 0.00 H new ATOM 0 HG11 VAL A 96 22.825 2.875 -7.320 1.00 0.00 H new ATOM 0 HG12 VAL A 96 24.191 2.109 -6.475 1.00 0.00 H new ATOM 0 HG13 VAL A 96 23.021 1.107 -7.365 1.00 0.00 H new ATOM 0 HG21 VAL A 96 20.568 2.710 -6.473 1.00 0.00 H new ATOM 0 HG22 VAL A 96 20.573 0.933 -6.386 1.00 0.00 H new ATOM 0 HG23 VAL A 96 20.207 1.894 -4.933 1.00 0.00 H new ATOM 1433 N LYS A 97 21.679 -1.352 -5.552 1.00 0.00 N ATOM 1434 CA LYS A 97 21.562 -2.506 -6.431 1.00 0.00 C ATOM 1435 C LYS A 97 21.718 -2.004 -7.863 1.00 0.00 C ATOM 1436 O LYS A 97 21.185 -0.943 -8.208 1.00 0.00 O ATOM 1437 CB LYS A 97 20.185 -3.149 -6.191 1.00 0.00 C ATOM 1438 CG LYS A 97 19.983 -4.458 -6.964 1.00 0.00 C ATOM 1439 CD LYS A 97 18.730 -5.237 -6.528 1.00 0.00 C ATOM 1440 CE LYS A 97 17.369 -4.586 -6.847 1.00 0.00 C ATOM 1441 NZ LYS A 97 16.904 -3.629 -5.812 1.00 0.00 N ATOM 0 H LYS A 97 20.804 -1.118 -5.083 1.00 0.00 H new ATOM 0 HA LYS A 97 22.325 -3.260 -6.239 1.00 0.00 H new ATOM 0 HB2 LYS A 97 20.063 -3.342 -5.125 1.00 0.00 H new ATOM 0 HB3 LYS A 97 19.407 -2.442 -6.478 1.00 0.00 H new ATOM 0 HG2 LYS A 97 19.911 -4.235 -8.029 1.00 0.00 H new ATOM 0 HG3 LYS A 97 20.860 -5.090 -6.829 1.00 0.00 H new ATOM 0 HD2 LYS A 97 18.757 -6.219 -7.000 1.00 0.00 H new ATOM 0 HD3 LYS A 97 18.787 -5.399 -5.452 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.441 -4.066 -7.803 1.00 0.00 H new ATOM 0 HE3 LYS A 97 16.621 -5.370 -6.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 15.872 -3.518 -5.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 17.152 -3.990 -4.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 17.362 -2.707 -5.961 1.00 0.00 H new ATOM 1455 N ARG A 98 22.401 -2.772 -8.708 1.00 0.00 N ATOM 1456 CA ARG A 98 22.680 -2.387 -10.087 1.00 0.00 C ATOM 1457 C ARG A 98 22.429 -3.556 -11.034 1.00 0.00 C ATOM 1458 O ARG A 98 22.614 -4.715 -10.659 1.00 0.00 O ATOM 1459 CB ARG A 98 24.112 -1.829 -10.188 1.00 0.00 C ATOM 1460 CG ARG A 98 24.475 -1.327 -11.597 1.00 0.00 C ATOM 1461 CD ARG A 98 25.825 -0.614 -11.580 1.00 0.00 C ATOM 1462 NE ARG A 98 26.317 -0.345 -12.941 1.00 0.00 N ATOM 1463 CZ ARG A 98 27.573 0.000 -13.244 1.00 0.00 C ATOM 1464 NH1 ARG A 98 28.402 0.457 -12.310 1.00 0.00 N ATOM 1465 NH2 ARG A 98 27.990 -0.136 -14.497 1.00 0.00 N ATOM 0 H ARG A 98 22.778 -3.685 -8.453 1.00 0.00 H new ATOM 0 HA ARG A 98 21.999 -1.594 -10.394 1.00 0.00 H new ATOM 0 HB2 ARG A 98 24.226 -1.010 -9.478 1.00 0.00 H new ATOM 0 HB3 ARG A 98 24.818 -2.606 -9.894 1.00 0.00 H new ATOM 0 HG2 ARG A 98 24.510 -2.167 -12.291 1.00 0.00 H new ATOM 0 HG3 ARG A 98 23.703 -0.647 -11.957 1.00 0.00 H new ATOM 0 HD2 ARG A 98 25.734 0.325 -11.034 1.00 0.00 H new ATOM 0 HD3 ARG A 98 26.552 -1.224 -11.044 1.00 0.00 H new ATOM 0 HE ARG A 98 25.651 -0.428 -13.709 1.00 0.00 H new ATOM 0 HH11 ARG A 98 28.083 0.549 -11.346 1.00 0.00 H new ATOM 0 HH12 ARG A 98 29.357 0.716 -12.558 1.00 0.00 H new ATOM 0 HH21 ARG A 98 27.356 -0.498 -15.209 1.00 0.00 H new ATOM 0 HH22 ARG A 98 28.945 0.122 -14.748 1.00 0.00 H new ATOM 1479 N GLU A 99 22.063 -3.233 -12.269 1.00 0.00 N ATOM 1480 CA GLU A 99 21.914 -4.130 -13.407 1.00 0.00 C ATOM 1481 C GLU A 99 22.729 -3.557 -14.573 1.00 0.00 C ATOM 1482 O GLU A 99 23.040 -2.362 -14.598 1.00 0.00 O ATOM 1483 CB GLU A 99 20.423 -4.217 -13.784 1.00 0.00 C ATOM 1484 CG GLU A 99 19.658 -5.327 -13.054 1.00 0.00 C ATOM 1485 CD GLU A 99 19.854 -6.686 -13.745 1.00 0.00 C ATOM 1486 OE1 GLU A 99 19.182 -6.937 -14.772 1.00 0.00 O ATOM 1487 OE2 GLU A 99 20.679 -7.500 -13.274 1.00 0.00 O ATOM 0 H GLU A 99 21.847 -2.268 -12.518 1.00 0.00 H new ATOM 0 HA GLU A 99 22.273 -5.131 -13.167 1.00 0.00 H new ATOM 0 HB2 GLU A 99 19.948 -3.260 -13.568 1.00 0.00 H new ATOM 0 HB3 GLU A 99 20.340 -4.379 -14.859 1.00 0.00 H new ATOM 0 HG2 GLU A 99 20.000 -5.389 -12.021 1.00 0.00 H new ATOM 0 HG3 GLU A 99 18.596 -5.081 -13.024 1.00 0.00 H new ATOM 1494 N HIS A 100 23.038 -4.402 -15.558 1.00 0.00 N ATOM 1495 CA HIS A 100 23.820 -4.050 -16.736 1.00 0.00 C ATOM 1496 C HIS A 100 23.086 -4.600 -17.959 1.00 0.00 C ATOM 1497 O HIS A 100 22.953 -5.815 -18.115 1.00 0.00 O ATOM 1498 CB HIS A 100 25.240 -4.619 -16.601 1.00 0.00 C ATOM 1499 CG HIS A 100 26.065 -4.470 -17.856 1.00 0.00 C ATOM 1500 ND1 HIS A 100 26.782 -3.361 -18.246 1.00 0.00 N ATOM 1501 CD2 HIS A 100 26.227 -5.418 -18.832 1.00 0.00 C ATOM 1502 CE1 HIS A 100 27.366 -3.638 -19.424 1.00 0.00 C ATOM 1503 NE2 HIS A 100 27.053 -4.884 -19.828 1.00 0.00 N ATOM 0 H HIS A 100 22.741 -5.378 -15.554 1.00 0.00 H new ATOM 0 HA HIS A 100 23.922 -2.970 -16.843 1.00 0.00 H new ATOM 0 HB2 HIS A 100 25.749 -4.116 -15.778 1.00 0.00 H new ATOM 0 HB3 HIS A 100 25.177 -5.675 -16.339 1.00 0.00 H new ATOM 0 HD2 HIS A 100 25.792 -6.407 -18.833 1.00 0.00 H new ATOM 0 HE1 HIS A 100 27.999 -2.955 -19.971 1.00 0.00 H new ATOM 0 HE2 HIS A 100 27.356 -5.345 -20.686 1.00 0.00 H new ATOM 1511 N TRP A 101 22.574 -3.698 -18.795 1.00 0.00 N ATOM 1512 CA TRP A 101 21.735 -3.975 -19.959 1.00 0.00 C ATOM 1513 C TRP A 101 22.414 -3.323 -21.178 1.00 0.00 C ATOM 1514 O TRP A 101 21.823 -2.486 -21.856 1.00 0.00 O ATOM 1515 CB TRP A 101 20.298 -3.445 -19.734 1.00 0.00 C ATOM 1516 CG TRP A 101 19.364 -4.146 -18.779 1.00 0.00 C ATOM 1517 CD1 TRP A 101 19.689 -4.867 -17.681 1.00 0.00 C ATOM 1518 CD2 TRP A 101 17.899 -4.182 -18.829 1.00 0.00 C ATOM 1519 NE1 TRP A 101 18.556 -5.334 -17.054 1.00 0.00 N ATOM 1520 CE2 TRP A 101 17.415 -4.933 -17.712 1.00 0.00 C ATOM 1521 CE3 TRP A 101 16.929 -3.658 -19.713 1.00 0.00 C ATOM 1522 CZ2 TRP A 101 16.046 -5.138 -17.481 1.00 0.00 C ATOM 1523 CZ3 TRP A 101 15.551 -3.870 -19.500 1.00 0.00 C ATOM 1524 CH2 TRP A 101 15.111 -4.603 -18.383 1.00 0.00 C ATOM 0 H TRP A 101 22.743 -2.700 -18.671 1.00 0.00 H new ATOM 0 HA TRP A 101 21.638 -5.047 -20.128 1.00 0.00 H new ATOM 0 HB2 TRP A 101 20.385 -2.412 -19.398 1.00 0.00 H new ATOM 0 HB3 TRP A 101 19.807 -3.424 -20.707 1.00 0.00 H new ATOM 0 HD1 TRP A 101 20.698 -5.051 -17.343 1.00 0.00 H new ATOM 0 HE1 TRP A 101 18.561 -5.905 -16.209 1.00 0.00 H new ATOM 0 HE3 TRP A 101 17.249 -3.083 -20.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 15.715 -5.700 -16.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 14.831 -3.468 -20.197 1.00 0.00 H new ATOM 0 HH2 TRP A 101 14.054 -4.755 -18.219 1.00 0.00 H new ATOM 1535 N GLY A 102 23.702 -3.603 -21.405 1.00 0.00 N ATOM 1536 CA GLY A 102 24.457 -2.982 -22.477 1.00 0.00 C ATOM 1537 C GLY A 102 23.967 -3.416 -23.855 1.00 0.00 C ATOM 1538 O GLY A 102 23.772 -4.609 -24.103 1.00 0.00 O ATOM 0 H GLY A 102 24.241 -4.266 -20.848 1.00 0.00 H new ATOM 0 HA2 GLY A 102 24.381 -1.898 -22.391 1.00 0.00 H new ATOM 0 HA3 GLY A 102 25.511 -3.237 -22.371 1.00 0.00 H new ATOM 1542 N PHE A 103 23.822 -2.445 -24.756 1.00 0.00 N ATOM 1543 CA PHE A 103 23.581 -2.631 -26.181 1.00 0.00 C ATOM 1544 C PHE A 103 24.073 -1.369 -26.901 1.00 0.00 C ATOM 1545 O PHE A 103 24.233 -0.309 -26.289 1.00 0.00 O ATOM 1546 CB PHE A 103 22.101 -2.949 -26.494 1.00 0.00 C ATOM 1547 CG PHE A 103 21.066 -2.446 -25.501 1.00 0.00 C ATOM 1548 CD1 PHE A 103 20.979 -1.074 -25.200 1.00 0.00 C ATOM 1549 CD2 PHE A 103 20.213 -3.359 -24.847 1.00 0.00 C ATOM 1550 CE1 PHE A 103 20.085 -0.630 -24.213 1.00 0.00 C ATOM 1551 CE2 PHE A 103 19.302 -2.907 -23.875 1.00 0.00 C ATOM 1552 CZ PHE A 103 19.254 -1.542 -23.543 1.00 0.00 C ATOM 0 H PHE A 103 23.872 -1.460 -24.496 1.00 0.00 H new ATOM 0 HA PHE A 103 24.132 -3.501 -26.539 1.00 0.00 H new ATOM 0 HB2 PHE A 103 21.864 -2.531 -27.472 1.00 0.00 H new ATOM 0 HB3 PHE A 103 21.996 -4.031 -26.575 1.00 0.00 H new ATOM 0 HD1 PHE A 103 21.599 -0.364 -25.727 1.00 0.00 H new ATOM 0 HD2 PHE A 103 20.259 -4.409 -25.093 1.00 0.00 H new ATOM 0 HE1 PHE A 103 20.036 0.421 -23.967 1.00 0.00 H new ATOM 0 HE2 PHE A 103 18.641 -3.607 -23.385 1.00 0.00 H new ATOM 0 HZ PHE A 103 18.579 -1.195 -22.774 1.00 0.00 H new ATOM 1562 N ASP A 104 24.345 -1.516 -28.196 1.00 0.00 N ATOM 1563 CA ASP A 104 24.842 -0.481 -29.089 1.00 0.00 C ATOM 1564 C ASP A 104 23.872 0.695 -29.140 1.00 0.00 C ATOM 1565 O ASP A 104 22.662 0.487 -29.262 1.00 0.00 O ATOM 1566 CB ASP A 104 25.046 -1.080 -30.485 1.00 0.00 C ATOM 1567 CG ASP A 104 25.628 -0.052 -31.463 1.00 0.00 C ATOM 1568 OD1 ASP A 104 26.709 0.506 -31.169 1.00 0.00 O ATOM 1569 OD2 ASP A 104 25.042 0.136 -32.551 1.00 0.00 O ATOM 0 H ASP A 104 24.217 -2.409 -28.672 1.00 0.00 H new ATOM 0 HA ASP A 104 25.795 -0.107 -28.716 1.00 0.00 H new ATOM 0 HB2 ASP A 104 25.714 -1.938 -30.419 1.00 0.00 H new ATOM 0 HB3 ASP A 104 24.093 -1.447 -30.867 1.00 0.00 H new ATOM 1574 N ASP A 105 24.378 1.924 -29.027 1.00 0.00 N ATOM 1575 CA ASP A 105 23.516 3.106 -29.099 1.00 0.00 C ATOM 1576 C ASP A 105 22.976 3.257 -30.525 1.00 0.00 C ATOM 1577 O ASP A 105 23.771 3.300 -31.469 1.00 0.00 O ATOM 1578 CB ASP A 105 24.235 4.397 -28.698 1.00 0.00 C ATOM 1579 CG ASP A 105 23.193 5.499 -28.491 1.00 0.00 C ATOM 1580 OD1 ASP A 105 22.670 6.041 -29.487 1.00 0.00 O ATOM 1581 OD2 ASP A 105 22.863 5.751 -27.308 1.00 0.00 O ATOM 0 H ASP A 105 25.368 2.127 -28.887 1.00 0.00 H new ATOM 0 HA ASP A 105 22.705 2.951 -28.387 1.00 0.00 H new ATOM 0 HB2 ASP A 105 24.807 4.242 -27.783 1.00 0.00 H new ATOM 0 HB3 ASP A 105 24.945 4.689 -29.472 1.00 0.00 H new ATOM 1586 N PRO A 106 21.651 3.354 -30.731 1.00 0.00 N ATOM 1587 CA PRO A 106 21.097 3.375 -32.074 1.00 0.00 C ATOM 1588 C PRO A 106 21.504 4.617 -32.876 1.00 0.00 C ATOM 1589 O PRO A 106 21.587 4.540 -34.100 1.00 0.00 O ATOM 1590 CB PRO A 106 19.587 3.244 -31.888 1.00 0.00 C ATOM 1591 CG PRO A 106 19.325 3.765 -30.474 1.00 0.00 C ATOM 1592 CD PRO A 106 20.597 3.373 -29.728 1.00 0.00 C ATOM 0 HA PRO A 106 21.491 2.557 -32.677 1.00 0.00 H new ATOM 0 HB2 PRO A 106 19.044 3.827 -32.632 1.00 0.00 H new ATOM 0 HB3 PRO A 106 19.263 2.209 -31.995 1.00 0.00 H new ATOM 0 HG2 PRO A 106 19.166 4.843 -30.463 1.00 0.00 H new ATOM 0 HG3 PRO A 106 18.440 3.308 -30.032 1.00 0.00 H new ATOM 0 HD2 PRO A 106 20.823 4.087 -28.936 1.00 0.00 H new ATOM 0 HD3 PRO A 106 20.489 2.397 -29.255 1.00 0.00 H new ATOM 1600 N ALA A 107 21.840 5.734 -32.221 1.00 0.00 N ATOM 1601 CA ALA A 107 22.326 6.933 -32.892 1.00 0.00 C ATOM 1602 C ALA A 107 23.795 6.813 -33.318 1.00 0.00 C ATOM 1603 O ALA A 107 24.315 7.722 -33.971 1.00 0.00 O ATOM 1604 CB ALA A 107 22.125 8.157 -31.994 1.00 0.00 C ATOM 0 H ALA A 107 21.780 5.827 -31.207 1.00 0.00 H new ATOM 0 HA ALA A 107 21.742 7.053 -33.804 1.00 0.00 H new ATOM 0 HB1 ALA A 107 22.492 9.047 -32.505 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.064 8.276 -31.773 1.00 0.00 H new ATOM 0 HB3 ALA A 107 22.676 8.020 -31.064 1.00 0.00 H new ATOM 1610 N ARG A 108 24.477 5.711 -32.984 1.00 0.00 N ATOM 1611 CA ARG A 108 25.885 5.469 -33.284 1.00 0.00 C ATOM 1612 C ARG A 108 26.018 4.160 -34.068 1.00 0.00 C ATOM 1613 O ARG A 108 27.139 3.744 -34.356 1.00 0.00 O ATOM 1614 CB ARG A 108 26.674 5.507 -31.959 1.00 0.00 C ATOM 1615 CG ARG A 108 28.204 5.566 -32.127 1.00 0.00 C ATOM 1616 CD ARG A 108 28.907 5.993 -30.830 1.00 0.00 C ATOM 1617 NE ARG A 108 28.702 7.423 -30.533 1.00 0.00 N ATOM 1618 CZ ARG A 108 28.545 7.976 -29.321 1.00 0.00 C ATOM 1619 NH1 ARG A 108 28.541 7.242 -28.213 1.00 0.00 N ATOM 1620 NH2 ARG A 108 28.390 9.294 -29.227 1.00 0.00 N ATOM 0 H ARG A 108 24.044 4.938 -32.479 1.00 0.00 H new ATOM 0 HA ARG A 108 26.310 6.241 -33.926 1.00 0.00 H new ATOM 0 HB2 ARG A 108 26.351 6.374 -31.383 1.00 0.00 H new ATOM 0 HB3 ARG A 108 26.419 4.623 -31.374 1.00 0.00 H new ATOM 0 HG2 ARG A 108 28.573 4.588 -32.435 1.00 0.00 H new ATOM 0 HG3 ARG A 108 28.455 6.267 -32.923 1.00 0.00 H new ATOM 0 HD2 ARG A 108 28.532 5.393 -30.001 1.00 0.00 H new ATOM 0 HD3 ARG A 108 29.975 5.790 -30.913 1.00 0.00 H new ATOM 0 HE ARG A 108 28.677 8.057 -31.332 1.00 0.00 H new ATOM 0 HH11 ARG A 108 28.659 6.231 -28.271 1.00 0.00 H new ATOM 0 HH12 ARG A 108 28.420 7.690 -27.305 1.00 0.00 H new ATOM 0 HH21 ARG A 108 28.392 9.869 -30.069 1.00 0.00 H new ATOM 0 HH22 ARG A 108 28.269 9.729 -28.313 1.00 0.00 H new ATOM 1634 N ALA A 109 24.894 3.549 -34.469 1.00 0.00 N ATOM 1635 CA ALA A 109 24.848 2.430 -35.388 1.00 0.00 C ATOM 1636 C ALA A 109 25.482 2.863 -36.711 1.00 0.00 C ATOM 1637 O ALA A 109 24.860 3.562 -37.509 1.00 0.00 O ATOM 1638 CB ALA A 109 23.403 1.954 -35.581 1.00 0.00 C ATOM 0 H ALA A 109 23.970 3.837 -34.146 1.00 0.00 H new ATOM 0 HA ALA A 109 25.409 1.587 -34.985 1.00 0.00 H new ATOM 0 HB1 ALA A 109 23.386 1.113 -36.274 1.00 0.00 H new ATOM 0 HB2 ALA A 109 22.992 1.641 -34.621 1.00 0.00 H new ATOM 0 HB3 ALA A 109 22.802 2.769 -35.985 1.00 0.00 H new ATOM 1644 N GLN A 110 26.745 2.493 -36.903 1.00 0.00 N ATOM 1645 CA GLN A 110 27.517 2.821 -38.093 1.00 0.00 C ATOM 1646 C GLN A 110 26.779 2.285 -39.327 1.00 0.00 C ATOM 1647 O GLN A 110 26.484 1.090 -39.411 1.00 0.00 O ATOM 1648 CB GLN A 110 28.939 2.237 -37.992 1.00 0.00 C ATOM 1649 CG GLN A 110 29.741 2.718 -36.769 1.00 0.00 C ATOM 1650 CD GLN A 110 29.943 4.235 -36.748 1.00 0.00 C ATOM 1651 OE1 GLN A 110 30.723 4.788 -37.518 1.00 0.00 O ATOM 1652 NE2 GLN A 110 29.245 4.943 -35.874 1.00 0.00 N ATOM 0 H GLN A 110 27.269 1.946 -36.220 1.00 0.00 H new ATOM 0 HA GLN A 110 27.617 3.903 -38.182 1.00 0.00 H new ATOM 0 HB2 GLN A 110 28.870 1.150 -37.961 1.00 0.00 H new ATOM 0 HB3 GLN A 110 29.490 2.496 -38.896 1.00 0.00 H new ATOM 0 HG2 GLN A 110 29.224 2.413 -35.859 1.00 0.00 H new ATOM 0 HG3 GLN A 110 30.714 2.227 -36.763 1.00 0.00 H new ATOM 0 HE21 GLN A 110 28.599 4.475 -35.238 1.00 0.00 H new ATOM 0 HE22 GLN A 110 29.353 5.957 -35.836 1.00 0.00 H new ATOM 1661 N GLY A 111 26.466 3.174 -40.270 1.00 0.00 N ATOM 1662 CA GLY A 111 25.708 2.853 -41.470 1.00 0.00 C ATOM 1663 C GLY A 111 25.237 4.140 -42.136 1.00 0.00 C ATOM 1664 O GLY A 111 26.042 4.861 -42.730 1.00 0.00 O ATOM 0 H GLY A 111 26.740 4.155 -40.216 1.00 0.00 H new ATOM 0 HA2 GLY A 111 26.326 2.279 -42.160 1.00 0.00 H new ATOM 0 HA3 GLY A 111 24.852 2.229 -41.215 1.00 0.00 H new ATOM 1668 N THR A 112 23.945 4.439 -42.014 1.00 0.00 N ATOM 1669 CA THR A 112 23.260 5.571 -42.620 1.00 0.00 C ATOM 1670 C THR A 112 22.265 6.113 -41.590 1.00 0.00 C ATOM 1671 O THR A 112 22.029 5.467 -40.567 1.00 0.00 O ATOM 1672 CB THR A 112 22.563 5.137 -43.934 1.00 0.00 C ATOM 1673 OG1 THR A 112 21.367 4.435 -43.661 1.00 0.00 O ATOM 1674 CG2 THR A 112 23.389 4.192 -44.811 1.00 0.00 C ATOM 0 H THR A 112 23.315 3.862 -41.457 1.00 0.00 H new ATOM 0 HA THR A 112 23.964 6.359 -42.890 1.00 0.00 H new ATOM 0 HB THR A 112 22.402 6.077 -44.462 1.00 0.00 H new ATOM 0 HG1 THR A 112 20.942 4.172 -44.504 1.00 0.00 H new ATOM 0 HG21 THR A 112 22.823 3.941 -45.708 1.00 0.00 H new ATOM 0 HG22 THR A 112 24.321 4.680 -45.094 1.00 0.00 H new ATOM 0 HG23 THR A 112 23.611 3.281 -44.255 1.00 0.00 H new ATOM 1682 N GLU A 113 21.632 7.258 -41.846 1.00 0.00 N ATOM 1683 CA GLU A 113 20.535 7.724 -41.006 1.00 0.00 C ATOM 1684 C GLU A 113 19.352 6.744 -41.042 1.00 0.00 C ATOM 1685 O GLU A 113 18.634 6.617 -40.050 1.00 0.00 O ATOM 1686 CB GLU A 113 20.106 9.160 -41.358 1.00 0.00 C ATOM 1687 CG GLU A 113 19.659 9.409 -42.809 1.00 0.00 C ATOM 1688 CD GLU A 113 20.832 9.720 -43.758 1.00 0.00 C ATOM 1689 OE1 GLU A 113 21.530 8.779 -44.197 1.00 0.00 O ATOM 1690 OE2 GLU A 113 21.056 10.909 -44.084 1.00 0.00 O ATOM 0 H GLU A 113 21.860 7.875 -42.625 1.00 0.00 H new ATOM 0 HA GLU A 113 20.902 7.754 -39.980 1.00 0.00 H new ATOM 0 HB2 GLU A 113 19.288 9.443 -40.696 1.00 0.00 H new ATOM 0 HB3 GLU A 113 20.939 9.828 -41.139 1.00 0.00 H new ATOM 0 HG2 GLU A 113 19.127 8.531 -43.175 1.00 0.00 H new ATOM 0 HG3 GLU A 113 18.954 10.240 -42.828 1.00 0.00 H new ATOM 1697 N GLU A 114 19.164 6.018 -42.149 1.00 0.00 N ATOM 1698 CA GLU A 114 18.119 5.017 -42.271 1.00 0.00 C ATOM 1699 C GLU A 114 18.494 3.772 -41.465 1.00 0.00 C ATOM 1700 O GLU A 114 17.649 3.211 -40.770 1.00 0.00 O ATOM 1701 CB GLU A 114 17.863 4.701 -43.753 1.00 0.00 C ATOM 1702 CG GLU A 114 16.637 3.798 -43.944 1.00 0.00 C ATOM 1703 CD GLU A 114 16.327 3.576 -45.435 1.00 0.00 C ATOM 1704 OE1 GLU A 114 16.848 2.609 -46.035 1.00 0.00 O ATOM 1705 OE2 GLU A 114 15.541 4.355 -46.023 1.00 0.00 O ATOM 0 H GLU A 114 19.740 6.115 -42.985 1.00 0.00 H new ATOM 0 HA GLU A 114 17.187 5.403 -41.858 1.00 0.00 H new ATOM 0 HB2 GLU A 114 17.717 5.631 -44.302 1.00 0.00 H new ATOM 0 HB3 GLU A 114 18.741 4.215 -44.177 1.00 0.00 H new ATOM 0 HG2 GLU A 114 16.813 2.837 -43.461 1.00 0.00 H new ATOM 0 HG3 GLU A 114 15.773 4.247 -43.455 1.00 0.00 H new ATOM 1712 N GLU A 115 19.765 3.366 -41.502 1.00 0.00 N ATOM 1713 CA GLU A 115 20.260 2.249 -40.713 1.00 0.00 C ATOM 1714 C GLU A 115 20.144 2.582 -39.221 1.00 0.00 C ATOM 1715 O GLU A 115 19.668 1.764 -38.438 1.00 0.00 O ATOM 1716 CB GLU A 115 21.697 1.896 -41.121 1.00 0.00 C ATOM 1717 CG GLU A 115 22.178 0.552 -40.555 1.00 0.00 C ATOM 1718 CD GLU A 115 21.338 -0.643 -41.047 1.00 0.00 C ATOM 1719 OE1 GLU A 115 21.583 -1.137 -42.171 1.00 0.00 O ATOM 1720 OE2 GLU A 115 20.443 -1.103 -40.304 1.00 0.00 O ATOM 0 H GLU A 115 20.477 3.808 -42.083 1.00 0.00 H new ATOM 0 HA GLU A 115 19.651 1.365 -40.906 1.00 0.00 H new ATOM 0 HB2 GLU A 115 21.762 1.868 -42.209 1.00 0.00 H new ATOM 0 HB3 GLU A 115 22.368 2.686 -40.782 1.00 0.00 H new ATOM 0 HG2 GLU A 115 23.220 0.397 -40.836 1.00 0.00 H new ATOM 0 HG3 GLU A 115 22.144 0.589 -39.466 1.00 0.00 H new ATOM 1727 N LYS A 116 20.507 3.807 -38.828 1.00 0.00 N ATOM 1728 CA LYS A 116 20.341 4.295 -37.465 1.00 0.00 C ATOM 1729 C LYS A 116 18.875 4.268 -37.062 1.00 0.00 C ATOM 1730 O LYS A 116 18.559 3.747 -35.997 1.00 0.00 O ATOM 1731 CB LYS A 116 20.937 5.703 -37.328 1.00 0.00 C ATOM 1732 CG LYS A 116 22.469 5.649 -37.302 1.00 0.00 C ATOM 1733 CD LYS A 116 23.069 7.051 -37.154 1.00 0.00 C ATOM 1734 CE LYS A 116 24.599 6.966 -37.142 1.00 0.00 C ATOM 1735 NZ LYS A 116 25.219 8.219 -36.642 1.00 0.00 N ATOM 0 H LYS A 116 20.928 4.491 -39.457 1.00 0.00 H new ATOM 0 HA LYS A 116 20.881 3.635 -36.786 1.00 0.00 H new ATOM 0 HB2 LYS A 116 20.605 6.325 -38.159 1.00 0.00 H new ATOM 0 HB3 LYS A 116 20.570 6.170 -36.414 1.00 0.00 H new ATOM 0 HG2 LYS A 116 22.800 5.020 -36.476 1.00 0.00 H new ATOM 0 HG3 LYS A 116 22.835 5.189 -38.220 1.00 0.00 H new ATOM 0 HD2 LYS A 116 22.738 7.686 -37.976 1.00 0.00 H new ATOM 0 HD3 LYS A 116 22.715 7.512 -36.232 1.00 0.00 H new ATOM 0 HE2 LYS A 116 24.911 6.131 -36.515 1.00 0.00 H new ATOM 0 HE3 LYS A 116 24.959 6.760 -38.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 26.245 8.188 -36.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 24.812 9.033 -37.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 25.034 8.315 -35.623 1.00 0.00 H new ATOM 1749 N TRP A 117 17.965 4.767 -37.900 1.00 0.00 N ATOM 1750 CA TRP A 117 16.534 4.703 -37.626 1.00 0.00 C ATOM 1751 C TRP A 117 16.049 3.251 -37.476 1.00 0.00 C ATOM 1752 O TRP A 117 15.207 2.967 -36.619 1.00 0.00 O ATOM 1753 CB TRP A 117 15.773 5.461 -38.721 1.00 0.00 C ATOM 1754 CG TRP A 117 14.286 5.282 -38.721 1.00 0.00 C ATOM 1755 CD1 TRP A 117 13.571 4.764 -39.743 1.00 0.00 C ATOM 1756 CD2 TRP A 117 13.321 5.532 -37.650 1.00 0.00 C ATOM 1757 NE1 TRP A 117 12.243 4.676 -39.389 1.00 0.00 N ATOM 1758 CE2 TRP A 117 12.025 5.145 -38.111 1.00 0.00 C ATOM 1759 CE3 TRP A 117 13.410 5.999 -36.319 1.00 0.00 C ATOM 1760 CZ2 TRP A 117 10.883 5.229 -37.300 1.00 0.00 C ATOM 1761 CZ3 TRP A 117 12.275 6.056 -35.488 1.00 0.00 C ATOM 1762 CH2 TRP A 117 11.014 5.673 -35.975 1.00 0.00 C ATOM 0 H TRP A 117 18.200 5.223 -38.781 1.00 0.00 H new ATOM 0 HA TRP A 117 16.332 5.186 -36.670 1.00 0.00 H new ATOM 0 HB2 TRP A 117 15.993 6.524 -38.621 1.00 0.00 H new ATOM 0 HB3 TRP A 117 16.159 5.146 -39.691 1.00 0.00 H new ATOM 0 HD1 TRP A 117 13.980 4.463 -40.696 1.00 0.00 H new ATOM 0 HE1 TRP A 117 11.511 4.309 -39.997 1.00 0.00 H new ATOM 0 HE3 TRP A 117 14.367 6.318 -35.932 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 9.914 4.955 -37.691 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 12.374 6.397 -34.468 1.00 0.00 H new ATOM 0 HH2 TRP A 117 10.148 5.720 -35.332 1.00 0.00 H new ATOM 1773 N ALA A 118 16.590 2.308 -38.251 1.00 0.00 N ATOM 1774 CA ALA A 118 16.222 0.910 -38.120 1.00 0.00 C ATOM 1775 C ALA A 118 16.751 0.339 -36.804 1.00 0.00 C ATOM 1776 O ALA A 118 16.032 -0.368 -36.101 1.00 0.00 O ATOM 1777 CB ALA A 118 16.704 0.118 -39.336 1.00 0.00 C ATOM 0 H ALA A 118 17.284 2.495 -38.974 1.00 0.00 H new ATOM 0 HA ALA A 118 15.136 0.825 -38.091 1.00 0.00 H new ATOM 0 HB1 ALA A 118 16.421 -0.929 -39.224 1.00 0.00 H new ATOM 0 HB2 ALA A 118 16.246 0.523 -40.239 1.00 0.00 H new ATOM 0 HB3 ALA A 118 17.789 0.194 -39.413 1.00 0.00 H new ATOM 1783 N PHE A 119 17.978 0.691 -36.419 1.00 0.00 N ATOM 1784 CA PHE A 119 18.524 0.324 -35.123 1.00 0.00 C ATOM 1785 C PHE A 119 17.763 0.970 -33.972 1.00 0.00 C ATOM 1786 O PHE A 119 17.645 0.339 -32.927 1.00 0.00 O ATOM 1787 CB PHE A 119 20.033 0.591 -35.034 1.00 0.00 C ATOM 1788 CG PHE A 119 20.851 -0.603 -35.486 1.00 0.00 C ATOM 1789 CD1 PHE A 119 20.962 -1.732 -34.651 1.00 0.00 C ATOM 1790 CD2 PHE A 119 21.470 -0.611 -36.748 1.00 0.00 C ATOM 1791 CE1 PHE A 119 21.684 -2.860 -35.079 1.00 0.00 C ATOM 1792 CE2 PHE A 119 22.208 -1.731 -37.170 1.00 0.00 C ATOM 1793 CZ PHE A 119 22.310 -2.859 -36.338 1.00 0.00 C ATOM 0 H PHE A 119 18.615 1.237 -36.999 1.00 0.00 H new ATOM 0 HA PHE A 119 18.387 -0.753 -35.024 1.00 0.00 H new ATOM 0 HB2 PHE A 119 20.285 1.456 -35.648 1.00 0.00 H new ATOM 0 HB3 PHE A 119 20.296 0.842 -34.007 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.491 -1.731 -33.679 1.00 0.00 H new ATOM 0 HD2 PHE A 119 21.378 0.247 -37.397 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.758 -3.728 -34.440 1.00 0.00 H new ATOM 0 HE2 PHE A 119 22.696 -1.724 -38.133 1.00 0.00 H new ATOM 0 HZ PHE A 119 22.868 -3.724 -36.665 1.00 0.00 H new ATOM 1803 N PHE A 120 17.196 2.163 -34.144 1.00 0.00 N ATOM 1804 CA PHE A 120 16.320 2.758 -33.144 1.00 0.00 C ATOM 1805 C PHE A 120 15.141 1.832 -32.890 1.00 0.00 C ATOM 1806 O PHE A 120 14.905 1.489 -31.739 1.00 0.00 O ATOM 1807 CB PHE A 120 15.871 4.173 -33.545 1.00 0.00 C ATOM 1808 CG PHE A 120 16.662 5.272 -32.869 1.00 0.00 C ATOM 1809 CD1 PHE A 120 16.389 5.586 -31.526 1.00 0.00 C ATOM 1810 CD2 PHE A 120 17.674 5.966 -33.559 1.00 0.00 C ATOM 1811 CE1 PHE A 120 17.124 6.590 -30.876 1.00 0.00 C ATOM 1812 CE2 PHE A 120 18.402 6.977 -32.909 1.00 0.00 C ATOM 1813 CZ PHE A 120 18.120 7.296 -31.569 1.00 0.00 C ATOM 0 H PHE A 120 17.331 2.738 -34.975 1.00 0.00 H new ATOM 0 HA PHE A 120 16.876 2.874 -32.213 1.00 0.00 H new ATOM 0 HB2 PHE A 120 15.963 4.282 -34.626 1.00 0.00 H new ATOM 0 HB3 PHE A 120 14.815 4.293 -33.301 1.00 0.00 H new ATOM 0 HD1 PHE A 120 15.614 5.055 -30.994 1.00 0.00 H new ATOM 0 HD2 PHE A 120 17.891 5.721 -34.588 1.00 0.00 H new ATOM 0 HE1 PHE A 120 16.923 6.820 -29.840 1.00 0.00 H new ATOM 0 HE2 PHE A 120 19.178 7.509 -33.439 1.00 0.00 H new ATOM 0 HZ PHE A 120 18.669 8.083 -31.074 1.00 0.00 H new ATOM 1823 N GLN A 121 14.463 1.351 -33.933 1.00 0.00 N ATOM 1824 CA GLN A 121 13.422 0.332 -33.791 1.00 0.00 C ATOM 1825 C GLN A 121 13.947 -0.923 -33.096 1.00 0.00 C ATOM 1826 O GLN A 121 13.300 -1.402 -32.165 1.00 0.00 O ATOM 1827 CB GLN A 121 12.832 -0.026 -35.169 1.00 0.00 C ATOM 1828 CG GLN A 121 11.514 0.689 -35.478 1.00 0.00 C ATOM 1829 CD GLN A 121 11.537 2.175 -35.128 1.00 0.00 C ATOM 1830 OE1 GLN A 121 10.829 2.629 -34.229 1.00 0.00 O ATOM 1831 NE2 GLN A 121 12.391 2.945 -35.780 1.00 0.00 N ATOM 0 H GLN A 121 14.618 1.654 -34.894 1.00 0.00 H new ATOM 0 HA GLN A 121 12.635 0.751 -33.163 1.00 0.00 H new ATOM 0 HB2 GLN A 121 13.560 0.222 -35.942 1.00 0.00 H new ATOM 0 HB3 GLN A 121 12.671 -1.103 -35.217 1.00 0.00 H new ATOM 0 HG2 GLN A 121 11.287 0.576 -36.538 1.00 0.00 H new ATOM 0 HG3 GLN A 121 10.708 0.205 -34.926 1.00 0.00 H new ATOM 0 HE21 GLN A 121 12.969 2.551 -36.522 1.00 0.00 H new ATOM 0 HE22 GLN A 121 12.472 3.933 -35.541 1.00 0.00 H new ATOM 1840 N ARG A 122 15.105 -1.453 -33.504 1.00 0.00 N ATOM 1841 CA ARG A 122 15.634 -2.687 -32.918 1.00 0.00 C ATOM 1842 C ARG A 122 15.881 -2.511 -31.421 1.00 0.00 C ATOM 1843 O ARG A 122 15.448 -3.349 -30.629 1.00 0.00 O ATOM 1844 CB ARG A 122 16.917 -3.139 -33.644 1.00 0.00 C ATOM 1845 CG ARG A 122 16.664 -3.560 -35.105 1.00 0.00 C ATOM 1846 CD ARG A 122 17.974 -3.706 -35.894 1.00 0.00 C ATOM 1847 NE ARG A 122 17.710 -3.864 -37.338 1.00 0.00 N ATOM 1848 CZ ARG A 122 18.292 -3.193 -38.344 1.00 0.00 C ATOM 1849 NH1 ARG A 122 19.268 -2.322 -38.125 1.00 0.00 N ATOM 1850 NH2 ARG A 122 17.892 -3.387 -39.595 1.00 0.00 N ATOM 0 H ARG A 122 15.691 -1.048 -34.234 1.00 0.00 H new ATOM 0 HA ARG A 122 14.888 -3.471 -33.047 1.00 0.00 H new ATOM 0 HB2 ARG A 122 17.644 -2.327 -33.626 1.00 0.00 H new ATOM 0 HB3 ARG A 122 17.360 -3.975 -33.102 1.00 0.00 H new ATOM 0 HG2 ARG A 122 16.123 -4.506 -35.122 1.00 0.00 H new ATOM 0 HG3 ARG A 122 16.028 -2.820 -35.591 1.00 0.00 H new ATOM 0 HD2 ARG A 122 18.601 -2.830 -35.730 1.00 0.00 H new ATOM 0 HD3 ARG A 122 18.529 -4.569 -35.526 1.00 0.00 H new ATOM 0 HE ARG A 122 17.010 -4.558 -37.599 1.00 0.00 H new ATOM 0 HH11 ARG A 122 19.593 -2.149 -37.174 1.00 0.00 H new ATOM 0 HH12 ARG A 122 19.693 -1.825 -38.908 1.00 0.00 H new ATOM 0 HH21 ARG A 122 17.140 -4.047 -39.794 1.00 0.00 H new ATOM 0 HH22 ARG A 122 18.336 -2.876 -40.358 1.00 0.00 H new ATOM 1864 N VAL A 123 16.538 -1.421 -31.019 1.00 0.00 N ATOM 1865 CA VAL A 123 16.863 -1.179 -29.621 1.00 0.00 C ATOM 1866 C VAL A 123 15.577 -0.841 -28.859 1.00 0.00 C ATOM 1867 O VAL A 123 15.390 -1.338 -27.751 1.00 0.00 O ATOM 1868 CB VAL A 123 17.959 -0.093 -29.531 1.00 0.00 C ATOM 1869 CG1 VAL A 123 18.271 0.318 -28.085 1.00 0.00 C ATOM 1870 CG2 VAL A 123 19.272 -0.594 -30.163 1.00 0.00 C ATOM 0 H VAL A 123 16.856 -0.688 -31.653 1.00 0.00 H new ATOM 0 HA VAL A 123 17.278 -2.068 -29.145 1.00 0.00 H new ATOM 0 HB VAL A 123 17.566 0.770 -30.069 1.00 0.00 H new ATOM 0 HG11 VAL A 123 19.048 1.083 -28.084 1.00 0.00 H new ATOM 0 HG12 VAL A 123 17.370 0.715 -27.617 1.00 0.00 H new ATOM 0 HG13 VAL A 123 18.617 -0.551 -27.526 1.00 0.00 H new ATOM 0 HG21 VAL A 123 20.031 0.185 -30.090 1.00 0.00 H new ATOM 0 HG22 VAL A 123 19.613 -1.484 -29.635 1.00 0.00 H new ATOM 0 HG23 VAL A 123 19.101 -0.837 -31.212 1.00 0.00 H new ATOM 1880 N ARG A 124 14.657 -0.067 -29.447 1.00 0.00 N ATOM 1881 CA ARG A 124 13.385 0.292 -28.828 1.00 0.00 C ATOM 1882 C ARG A 124 12.632 -0.978 -28.471 1.00 0.00 C ATOM 1883 O ARG A 124 12.193 -1.132 -27.335 1.00 0.00 O ATOM 1884 CB ARG A 124 12.575 1.150 -29.821 1.00 0.00 C ATOM 1885 CG ARG A 124 11.157 1.516 -29.356 1.00 0.00 C ATOM 1886 CD ARG A 124 10.142 1.457 -30.503 1.00 0.00 C ATOM 1887 NE ARG A 124 9.822 0.074 -30.924 1.00 0.00 N ATOM 1888 CZ ARG A 124 9.219 -0.240 -32.079 1.00 0.00 C ATOM 1889 NH1 ARG A 124 9.056 0.695 -33.006 1.00 0.00 N ATOM 1890 NH2 ARG A 124 8.774 -1.472 -32.307 1.00 0.00 N ATOM 0 H ARG A 124 14.781 0.330 -30.378 1.00 0.00 H new ATOM 0 HA ARG A 124 13.548 0.867 -27.917 1.00 0.00 H new ATOM 0 HB2 ARG A 124 13.126 2.070 -30.017 1.00 0.00 H new ATOM 0 HB3 ARG A 124 12.504 0.614 -30.767 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.848 0.834 -28.564 1.00 0.00 H new ATOM 0 HG3 ARG A 124 11.163 2.519 -28.929 1.00 0.00 H new ATOM 0 HD2 ARG A 124 9.224 1.958 -30.195 1.00 0.00 H new ATOM 0 HD3 ARG A 124 10.535 2.009 -31.357 1.00 0.00 H new ATOM 0 HE ARG A 124 10.077 -0.688 -30.295 1.00 0.00 H new ATOM 0 HH11 ARG A 124 9.389 1.644 -32.837 1.00 0.00 H new ATOM 0 HH12 ARG A 124 8.598 0.465 -33.888 1.00 0.00 H new ATOM 0 HH21 ARG A 124 8.889 -2.195 -31.597 1.00 0.00 H new ATOM 0 HH22 ARG A 124 8.317 -1.694 -33.192 1.00 0.00 H new ATOM 1904 N ASP A 125 12.442 -1.855 -29.454 1.00 0.00 N ATOM 1905 CA ASP A 125 11.576 -3.011 -29.300 1.00 0.00 C ATOM 1906 C ASP A 125 12.177 -4.014 -28.315 1.00 0.00 C ATOM 1907 O ASP A 125 11.460 -4.568 -27.484 1.00 0.00 O ATOM 1908 CB ASP A 125 11.322 -3.662 -30.663 1.00 0.00 C ATOM 1909 CG ASP A 125 10.009 -4.445 -30.629 1.00 0.00 C ATOM 1910 OD1 ASP A 125 8.952 -3.779 -30.725 1.00 0.00 O ATOM 1911 OD2 ASP A 125 10.028 -5.692 -30.539 1.00 0.00 O ATOM 0 H ASP A 125 12.882 -1.782 -30.371 1.00 0.00 H new ATOM 0 HA ASP A 125 10.621 -2.680 -28.892 1.00 0.00 H new ATOM 0 HB2 ASP A 125 11.280 -2.897 -31.439 1.00 0.00 H new ATOM 0 HB3 ASP A 125 12.146 -4.328 -30.917 1.00 0.00 H new ATOM 1916 N GLU A 126 13.499 -4.211 -28.356 1.00 0.00 N ATOM 1917 CA GLU A 126 14.220 -5.034 -27.392 1.00 0.00 C ATOM 1918 C GLU A 126 14.050 -4.493 -25.972 1.00 0.00 C ATOM 1919 O GLU A 126 13.712 -5.260 -25.069 1.00 0.00 O ATOM 1920 CB GLU A 126 15.685 -5.154 -27.813 1.00 0.00 C ATOM 1921 CG GLU A 126 16.524 -5.915 -26.778 1.00 0.00 C ATOM 1922 CD GLU A 126 16.013 -7.319 -26.410 1.00 0.00 C ATOM 1923 OE1 GLU A 126 15.458 -8.042 -27.265 1.00 0.00 O ATOM 1924 OE2 GLU A 126 16.157 -7.734 -25.241 1.00 0.00 O ATOM 0 H GLU A 126 14.100 -3.797 -29.068 1.00 0.00 H new ATOM 0 HA GLU A 126 13.798 -6.039 -27.383 1.00 0.00 H new ATOM 0 HB2 GLU A 126 15.745 -5.665 -28.774 1.00 0.00 H new ATOM 0 HB3 GLU A 126 16.103 -4.158 -27.956 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.542 -6.006 -27.158 1.00 0.00 H new ATOM 0 HG3 GLU A 126 16.576 -5.317 -25.868 1.00 0.00 H new ATOM 1931 N ILE A 127 14.244 -3.186 -25.774 1.00 0.00 N ATOM 1932 CA ILE A 127 14.091 -2.559 -24.470 1.00 0.00 C ATOM 1933 C ILE A 127 12.660 -2.770 -23.987 1.00 0.00 C ATOM 1934 O ILE A 127 12.476 -3.236 -22.867 1.00 0.00 O ATOM 1935 CB ILE A 127 14.504 -1.074 -24.550 1.00 0.00 C ATOM 1936 CG1 ILE A 127 16.041 -0.981 -24.652 1.00 0.00 C ATOM 1937 CG2 ILE A 127 14.036 -0.260 -23.336 1.00 0.00 C ATOM 1938 CD1 ILE A 127 16.554 0.437 -24.922 1.00 0.00 C ATOM 0 H ILE A 127 14.511 -2.539 -26.516 1.00 0.00 H new ATOM 0 HA ILE A 127 14.751 -3.017 -23.733 1.00 0.00 H new ATOM 0 HB ILE A 127 14.023 -0.652 -25.432 1.00 0.00 H new ATOM 0 HG12 ILE A 127 16.481 -1.347 -23.724 1.00 0.00 H new ATOM 0 HG13 ILE A 127 16.384 -1.640 -25.449 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.355 0.776 -23.448 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.949 -0.300 -23.269 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.471 -0.678 -22.428 1.00 0.00 H new ATOM 0 HD11 ILE A 127 17.642 0.425 -24.981 1.00 0.00 H new ATOM 0 HD12 ILE A 127 16.143 0.799 -25.865 1.00 0.00 H new ATOM 0 HD13 ILE A 127 16.242 1.097 -24.113 1.00 0.00 H new ATOM 1950 N GLY A 128 11.660 -2.489 -24.827 1.00 0.00 N ATOM 1951 CA GLY A 128 10.261 -2.725 -24.507 1.00 0.00 C ATOM 1952 C GLY A 128 10.018 -4.151 -24.027 1.00 0.00 C ATOM 1953 O GLY A 128 9.421 -4.344 -22.967 1.00 0.00 O ATOM 0 H GLY A 128 11.806 -2.089 -25.754 1.00 0.00 H new ATOM 0 HA2 GLY A 128 9.942 -2.024 -23.736 1.00 0.00 H new ATOM 0 HA3 GLY A 128 9.650 -2.530 -25.388 1.00 0.00 H new ATOM 1957 N ASN A 129 10.530 -5.149 -24.753 1.00 0.00 N ATOM 1958 CA ASN A 129 10.352 -6.549 -24.381 1.00 0.00 C ATOM 1959 C ASN A 129 10.965 -6.833 -23.022 1.00 0.00 C ATOM 1960 O ASN A 129 10.334 -7.463 -22.174 1.00 0.00 O ATOM 1961 CB ASN A 129 10.957 -7.510 -25.419 1.00 0.00 C ATOM 1962 CG ASN A 129 10.011 -7.788 -26.577 1.00 0.00 C ATOM 1963 OD1 ASN A 129 9.198 -8.707 -26.527 1.00 0.00 O ATOM 1964 ND2 ASN A 129 10.094 -7.011 -27.640 1.00 0.00 N ATOM 0 H ASN A 129 11.073 -5.009 -25.605 1.00 0.00 H new ATOM 0 HA ASN A 129 9.276 -6.722 -24.341 1.00 0.00 H new ATOM 0 HB2 ASN A 129 11.884 -7.086 -25.805 1.00 0.00 H new ATOM 0 HB3 ASN A 129 11.215 -8.450 -24.932 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.477 -7.169 -28.437 1.00 0.00 H new ATOM 0 HD22 ASN A 129 10.775 -6.252 -27.665 1.00 0.00 H new ATOM 1971 N ARG A 130 12.196 -6.384 -22.786 1.00 0.00 N ATOM 1972 CA ARG A 130 12.879 -6.742 -21.553 1.00 0.00 C ATOM 1973 C ARG A 130 12.341 -5.943 -20.371 1.00 0.00 C ATOM 1974 O ARG A 130 12.321 -6.474 -19.264 1.00 0.00 O ATOM 1975 CB ARG A 130 14.405 -6.658 -21.741 1.00 0.00 C ATOM 1976 CG ARG A 130 15.144 -7.921 -21.257 1.00 0.00 C ATOM 1977 CD ARG A 130 14.665 -9.238 -21.900 1.00 0.00 C ATOM 1978 NE ARG A 130 14.665 -9.186 -23.375 1.00 0.00 N ATOM 1979 CZ ARG A 130 13.931 -9.938 -24.202 1.00 0.00 C ATOM 1980 NH1 ARG A 130 13.079 -10.849 -23.743 1.00 0.00 N ATOM 1981 NH2 ARG A 130 14.058 -9.769 -25.513 1.00 0.00 N ATOM 0 H ARG A 130 12.728 -5.786 -23.418 1.00 0.00 H new ATOM 0 HA ARG A 130 12.666 -7.782 -21.307 1.00 0.00 H new ATOM 0 HB2 ARG A 130 14.627 -6.496 -22.796 1.00 0.00 H new ATOM 0 HB3 ARG A 130 14.785 -5.792 -21.199 1.00 0.00 H new ATOM 0 HG2 ARG A 130 16.209 -7.801 -21.458 1.00 0.00 H new ATOM 0 HG3 ARG A 130 15.031 -7.999 -20.176 1.00 0.00 H new ATOM 0 HD2 ARG A 130 15.308 -10.054 -21.570 1.00 0.00 H new ATOM 0 HD3 ARG A 130 13.658 -9.464 -21.549 1.00 0.00 H new ATOM 0 HE ARG A 130 15.290 -8.506 -23.808 1.00 0.00 H new ATOM 0 HH11 ARG A 130 12.973 -10.988 -22.738 1.00 0.00 H new ATOM 0 HH12 ARG A 130 12.531 -11.409 -24.396 1.00 0.00 H new ATOM 0 HH21 ARG A 130 14.709 -9.073 -25.877 1.00 0.00 H new ATOM 0 HH22 ARG A 130 13.505 -10.335 -26.156 1.00 0.00 H new ATOM 1995 N LEU A 131 11.828 -4.726 -20.581 1.00 0.00 N ATOM 1996 CA LEU A 131 11.140 -3.986 -19.532 1.00 0.00 C ATOM 1997 C LEU A 131 9.828 -4.686 -19.180 1.00 0.00 C ATOM 1998 O LEU A 131 9.496 -4.784 -17.999 1.00 0.00 O ATOM 1999 CB LEU A 131 10.900 -2.518 -19.928 1.00 0.00 C ATOM 2000 CG LEU A 131 11.251 -1.518 -18.815 1.00 0.00 C ATOM 2001 CD1 LEU A 131 10.527 -1.796 -17.493 1.00 0.00 C ATOM 2002 CD2 LEU A 131 12.765 -1.444 -18.586 1.00 0.00 C ATOM 0 H LEU A 131 11.880 -4.236 -21.474 1.00 0.00 H new ATOM 0 HA LEU A 131 11.780 -3.971 -18.650 1.00 0.00 H new ATOM 0 HB2 LEU A 131 11.493 -2.287 -20.813 1.00 0.00 H new ATOM 0 HB3 LEU A 131 9.853 -2.391 -20.203 1.00 0.00 H new ATOM 0 HG LEU A 131 10.897 -0.550 -19.170 1.00 0.00 H new ATOM 0 HD11 LEU A 131 10.822 -1.052 -16.753 1.00 0.00 H new ATOM 0 HD12 LEU A 131 9.450 -1.744 -17.650 1.00 0.00 H new ATOM 0 HD13 LEU A 131 10.794 -2.790 -17.134 1.00 0.00 H new ATOM 0 HD21 LEU A 131 12.978 -0.728 -17.793 1.00 0.00 H new ATOM 0 HD22 LEU A 131 13.138 -2.427 -18.298 1.00 0.00 H new ATOM 0 HD23 LEU A 131 13.257 -1.125 -19.505 1.00 0.00 H new ATOM 2014 N LYS A 132 9.105 -5.226 -20.173 1.00 0.00 N ATOM 2015 CA LYS A 132 7.913 -6.023 -19.910 1.00 0.00 C ATOM 2016 C LYS A 132 8.269 -7.185 -18.999 1.00 0.00 C ATOM 2017 O LYS A 132 7.621 -7.376 -17.972 1.00 0.00 O ATOM 2018 CB LYS A 132 7.275 -6.493 -21.226 1.00 0.00 C ATOM 2019 CG LYS A 132 5.978 -7.281 -20.999 1.00 0.00 C ATOM 2020 CD LYS A 132 5.344 -7.640 -22.352 1.00 0.00 C ATOM 2021 CE LYS A 132 4.102 -8.534 -22.208 1.00 0.00 C ATOM 2022 NZ LYS A 132 2.943 -7.838 -21.589 1.00 0.00 N ATOM 0 H LYS A 132 9.331 -5.121 -21.162 1.00 0.00 H new ATOM 0 HA LYS A 132 7.170 -5.411 -19.399 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.066 -5.627 -21.855 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.985 -7.117 -21.769 1.00 0.00 H new ATOM 0 HG2 LYS A 132 6.187 -8.189 -20.433 1.00 0.00 H new ATOM 0 HG3 LYS A 132 5.281 -6.689 -20.406 1.00 0.00 H new ATOM 0 HD2 LYS A 132 5.068 -6.724 -22.874 1.00 0.00 H new ATOM 0 HD3 LYS A 132 6.083 -8.149 -22.971 1.00 0.00 H new ATOM 0 HE2 LYS A 132 3.812 -8.902 -23.192 1.00 0.00 H new ATOM 0 HE3 LYS A 132 4.358 -9.405 -21.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 2.140 -8.495 -21.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 3.203 -7.509 -20.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 2.674 -7.022 -22.175 1.00 0.00 H new ATOM 2036 N GLU A 133 9.318 -7.932 -19.333 1.00 0.00 N ATOM 2037 CA GLU A 133 9.703 -9.080 -18.524 1.00 0.00 C ATOM 2038 C GLU A 133 10.179 -8.658 -17.139 1.00 0.00 C ATOM 2039 O GLU A 133 9.881 -9.339 -16.163 1.00 0.00 O ATOM 2040 CB GLU A 133 10.765 -9.955 -19.186 1.00 0.00 C ATOM 2041 CG GLU A 133 10.257 -10.587 -20.483 1.00 0.00 C ATOM 2042 CD GLU A 133 11.160 -11.750 -20.908 1.00 0.00 C ATOM 2043 OE1 GLU A 133 12.353 -11.524 -21.199 1.00 0.00 O ATOM 2044 OE2 GLU A 133 10.711 -12.917 -20.928 1.00 0.00 O ATOM 0 H GLU A 133 9.909 -7.765 -20.148 1.00 0.00 H new ATOM 0 HA GLU A 133 8.798 -9.679 -18.426 1.00 0.00 H new ATOM 0 HB2 GLU A 133 11.650 -9.355 -19.397 1.00 0.00 H new ATOM 0 HB3 GLU A 133 11.070 -10.741 -18.495 1.00 0.00 H new ATOM 0 HG2 GLU A 133 9.237 -10.944 -20.344 1.00 0.00 H new ATOM 0 HG3 GLU A 133 10.227 -9.836 -21.272 1.00 0.00 H new ATOM 2051 N PHE A 134 10.877 -7.539 -17.012 1.00 0.00 N ATOM 2052 CA PHE A 134 11.315 -7.032 -15.723 1.00 0.00 C ATOM 2053 C PHE A 134 10.124 -6.694 -14.828 1.00 0.00 C ATOM 2054 O PHE A 134 10.178 -6.918 -13.619 1.00 0.00 O ATOM 2055 CB PHE A 134 12.224 -5.819 -15.947 1.00 0.00 C ATOM 2056 CG PHE A 134 12.571 -5.036 -14.696 1.00 0.00 C ATOM 2057 CD1 PHE A 134 13.545 -5.515 -13.802 1.00 0.00 C ATOM 2058 CD2 PHE A 134 11.908 -3.825 -14.422 1.00 0.00 C ATOM 2059 CE1 PHE A 134 13.854 -4.781 -12.643 1.00 0.00 C ATOM 2060 CE2 PHE A 134 12.232 -3.076 -13.279 1.00 0.00 C ATOM 2061 CZ PHE A 134 13.201 -3.562 -12.384 1.00 0.00 C ATOM 0 H PHE A 134 11.155 -6.957 -17.802 1.00 0.00 H new ATOM 0 HA PHE A 134 11.882 -7.804 -15.203 1.00 0.00 H new ATOM 0 HB2 PHE A 134 13.149 -6.159 -16.413 1.00 0.00 H new ATOM 0 HB3 PHE A 134 11.739 -5.147 -16.655 1.00 0.00 H new ATOM 0 HD1 PHE A 134 14.055 -6.445 -14.005 1.00 0.00 H new ATOM 0 HD2 PHE A 134 11.144 -3.469 -15.097 1.00 0.00 H new ATOM 0 HE1 PHE A 134 14.594 -5.154 -11.950 1.00 0.00 H new ATOM 0 HE2 PHE A 134 11.740 -2.133 -13.089 1.00 0.00 H new ATOM 0 HZ PHE A 134 13.445 -2.998 -11.496 1.00 0.00 H new ATOM 2071 N ALA A 135 9.036 -6.195 -15.415 1.00 0.00 N ATOM 2072 CA ALA A 135 7.855 -5.811 -14.667 1.00 0.00 C ATOM 2073 C ALA A 135 7.003 -7.033 -14.312 1.00 0.00 C ATOM 2074 O ALA A 135 6.439 -7.103 -13.220 1.00 0.00 O ATOM 2075 CB ALA A 135 7.037 -4.811 -15.491 1.00 0.00 C ATOM 0 H ALA A 135 8.956 -6.049 -16.421 1.00 0.00 H new ATOM 0 HA ALA A 135 8.168 -5.345 -13.733 1.00 0.00 H new ATOM 0 HB1 ALA A 135 6.148 -4.520 -14.932 1.00 0.00 H new ATOM 0 HB2 ALA A 135 7.642 -3.928 -15.696 1.00 0.00 H new ATOM 0 HB3 ALA A 135 6.738 -5.273 -16.432 1.00 0.00 H new ATOM 2081 N GLU A 136 6.900 -7.984 -15.240 1.00 0.00 N ATOM 2082 CA GLU A 136 5.976 -9.107 -15.159 1.00 0.00 C ATOM 2083 C GLU A 136 6.617 -10.297 -14.445 1.00 0.00 C ATOM 2084 O GLU A 136 6.012 -10.908 -13.562 1.00 0.00 O ATOM 2085 CB GLU A 136 5.565 -9.500 -16.592 1.00 0.00 C ATOM 2086 CG GLU A 136 4.650 -10.733 -16.676 1.00 0.00 C ATOM 2087 CD GLU A 136 3.241 -10.460 -16.119 1.00 0.00 C ATOM 2088 OE1 GLU A 136 2.403 -9.867 -16.836 1.00 0.00 O ATOM 2089 OE2 GLU A 136 2.942 -10.854 -14.970 1.00 0.00 O ATOM 0 H GLU A 136 7.470 -7.992 -16.086 1.00 0.00 H new ATOM 0 HA GLU A 136 5.099 -8.815 -14.582 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.058 -8.654 -17.056 1.00 0.00 H new ATOM 0 HB3 GLU A 136 6.466 -9.691 -17.176 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.571 -11.053 -17.715 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.103 -11.556 -16.123 1.00 0.00 H new ATOM 2096 N THR A 137 7.856 -10.607 -14.821 1.00 0.00 N ATOM 2097 CA THR A 137 8.554 -11.829 -14.435 1.00 0.00 C ATOM 2098 C THR A 137 9.725 -11.548 -13.477 1.00 0.00 C ATOM 2099 O THR A 137 10.175 -12.454 -12.769 1.00 0.00 O ATOM 2100 CB THR A 137 8.987 -12.603 -15.697 1.00 0.00 C ATOM 2101 OG1 THR A 137 10.058 -11.970 -16.361 1.00 0.00 O ATOM 2102 CG2 THR A 137 7.871 -12.771 -16.734 1.00 0.00 C ATOM 0 H THR A 137 8.416 -9.999 -15.418 1.00 0.00 H new ATOM 0 HA THR A 137 7.866 -12.461 -13.873 1.00 0.00 H new ATOM 0 HB THR A 137 9.277 -13.581 -15.314 1.00 0.00 H new ATOM 0 HG1 THR A 137 10.050 -11.012 -16.155 1.00 0.00 H new ATOM 0 HG21 THR A 137 8.252 -13.325 -17.592 1.00 0.00 H new ATOM 0 HG22 THR A 137 7.040 -13.318 -16.289 1.00 0.00 H new ATOM 0 HG23 THR A 137 7.526 -11.790 -17.060 1.00 0.00 H new ATOM 2110 N GLY A 138 10.210 -10.299 -13.426 1.00 0.00 N ATOM 2111 CA GLY A 138 11.362 -9.910 -12.621 1.00 0.00 C ATOM 2112 C GLY A 138 12.694 -10.368 -13.225 1.00 0.00 C ATOM 2113 O GLY A 138 13.684 -10.446 -12.493 1.00 0.00 O ATOM 0 H GLY A 138 9.803 -9.525 -13.952 1.00 0.00 H new ATOM 0 HA2 GLY A 138 11.373 -8.826 -12.511 1.00 0.00 H new ATOM 0 HA3 GLY A 138 11.259 -10.331 -11.621 1.00 0.00 H new ATOM 2117 N LYS A 139 12.737 -10.714 -14.520 1.00 0.00 N ATOM 2118 CA LYS A 139 13.967 -11.117 -15.187 1.00 0.00 C ATOM 2119 C LYS A 139 14.927 -9.934 -15.241 1.00 0.00 C ATOM 2120 O LYS A 139 14.483 -8.807 -15.538 1.00 0.00 O ATOM 2121 CB LYS A 139 13.661 -11.668 -16.587 1.00 0.00 C ATOM 2122 CG LYS A 139 13.107 -13.102 -16.493 1.00 0.00 C ATOM 2123 CD LYS A 139 12.568 -13.645 -17.825 1.00 0.00 C ATOM 2124 CE LYS A 139 13.629 -13.584 -18.928 1.00 0.00 C ATOM 2125 NZ LYS A 139 13.147 -14.175 -20.199 1.00 0.00 N ATOM 2126 OXT LYS A 139 16.133 -10.147 -14.993 1.00 0.00 O ATOM 0 H LYS A 139 11.917 -10.720 -15.127 1.00 0.00 H new ATOM 0 HA LYS A 139 14.445 -11.918 -14.623 1.00 0.00 H new ATOM 0 HB2 LYS A 139 12.938 -11.024 -17.087 1.00 0.00 H new ATOM 0 HB3 LYS A 139 14.567 -11.661 -17.193 1.00 0.00 H new ATOM 0 HG2 LYS A 139 13.895 -13.764 -16.134 1.00 0.00 H new ATOM 0 HG3 LYS A 139 12.308 -13.125 -15.752 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.239 -14.676 -17.692 1.00 0.00 H new ATOM 0 HD3 LYS A 139 11.694 -13.068 -18.127 1.00 0.00 H new ATOM 0 HE2 LYS A 139 13.916 -12.546 -19.097 1.00 0.00 H new ATOM 0 HE3 LYS A 139 14.524 -14.113 -18.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 13.648 -13.737 -20.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 13.328 -15.199 -20.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 12.126 -14.005 -20.296 1.00 0.00 H new