USER MOD reduce.3.24.130724 H: found=0, std=0, add=1106, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1109 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 11 SER OG : rot -130:sc= -0.876! USER MOD Set 1.2: A 25 CYS SG : rot 40:sc= -6.37! USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 SER OG : rot 140:sc= 0.0191 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 15 CYS SG : rot -3:sc= 0.312 USER MOD Single : A 32 TYR OH : rot 180:sc= 0.895 USER MOD Single : A 33 SER OG : rot -60:sc= -0.522 USER MOD Single : A 34 THR OG1 : rot -90:sc= 1.21 USER MOD Single : A 35 SER OG : rot 77:sc= -0.469! USER MOD Single : A 40 ASN : amide:sc= -2.09! C(o=-2.1!,f=-14!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= -3.99! USER MOD Single : A 45 ASN : amide:sc= -3.57! C(o=-3.6!,f=-8!) USER MOD Single : A 47 ASN : amide:sc= -1.1 K(o=-1.1,f=-5.3!) USER MOD Single : A 49 HIS : no HD1:sc= -0.06 X(o=-0.06,f=0.0016) USER MOD Single : A 62 THR OG1 : rot 27:sc= 0.144 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 GLN :FLIP amide:sc= 0 F(o=-0.77,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 CYS SG : rot -170:sc= -5.8! USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN :FLIP amide:sc= -1.34 F(o=-4.1!,f=-1.3) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= -0.413 X(o=-0.41,f=-0.082) USER MOD Single : A 95 ASN : amide:sc= -0.911 K(o=-0.91,f=-7.4!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.51 K(o=-0.51,f=-2.2) USER MOD Single : A 106 GLN : amide:sc= 0.00382 X(o=0.0038,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= 1.16 K(o=1.2,f=-0.022) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -127:sc= 1.16 (180deg=0.825) USER MOD Single : A 142 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.0253 K(o=-0.025,f=-0.68) USER MOD Single : A 149 SER OG : rot 70:sc= -2.28! USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 156 HIS :FLIP no HE2:sc= 0.0933 F(o=-0.46,f=0.093) USER MOD Single : A 159 ASN : amide:sc= -3.97! C(o=-4!,f=-10!) USER MOD Single : A 161 ASN : amide:sc= -0.503 K(o=-0.5,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 22 N TYR A 3 -9.341 6.993 10.931 1.00 0.00 N ATOM 23 CA TYR A 3 -7.902 7.056 11.126 1.00 0.00 C ATOM 24 C TYR A 3 -7.295 8.215 10.352 1.00 0.00 C ATOM 25 O TYR A 3 -7.190 9.331 10.866 1.00 0.00 O ATOM 26 CB TYR A 3 -7.238 5.739 10.728 1.00 0.00 C ATOM 27 CG TYR A 3 -7.615 4.561 11.608 1.00 0.00 C ATOM 28 CD1 TYR A 3 -8.888 3.999 11.555 1.00 0.00 C ATOM 29 CD2 TYR A 3 -6.686 3.996 12.472 1.00 0.00 C ATOM 30 CE1 TYR A 3 -9.219 2.905 12.334 1.00 0.00 C ATOM 31 CE2 TYR A 3 -7.012 2.906 13.256 1.00 0.00 C ATOM 32 CZ TYR A 3 -8.278 2.364 13.184 1.00 0.00 C ATOM 33 OH TYR A 3 -8.596 1.263 13.951 1.00 0.00 O ATOM 0 HA TYR A 3 -7.719 7.224 12.187 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -7.505 5.508 9.697 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -6.156 5.868 10.756 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -9.629 4.424 10.895 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -5.693 4.415 12.532 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -10.209 2.477 12.277 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -6.278 2.480 13.923 1.00 0.00 H new ATOM 0 HH TYR A 3 -7.821 1.007 14.494 1.00 0.00 H new ATOM 43 N ALA A 4 -6.914 7.960 9.116 1.00 0.00 N ATOM 44 CA ALA A 4 -6.318 8.979 8.276 1.00 0.00 C ATOM 45 C ALA A 4 -7.145 9.205 7.023 1.00 0.00 C ATOM 46 O ALA A 4 -7.183 10.318 6.497 1.00 0.00 O ATOM 47 CB ALA A 4 -4.893 8.597 7.899 1.00 0.00 C ATOM 0 H ALA A 4 -7.008 7.048 8.669 1.00 0.00 H new ATOM 0 HA ALA A 4 -6.295 9.908 8.845 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -4.463 9.375 7.268 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -4.294 8.490 8.803 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -4.901 7.652 7.355 1.00 0.00 H new ATOM 53 N GLY A 5 -7.818 8.155 6.549 1.00 0.00 N ATOM 54 CA GLY A 5 -8.601 8.290 5.351 1.00 0.00 C ATOM 55 C GLY A 5 -9.846 9.127 5.539 1.00 0.00 C ATOM 56 O GLY A 5 -9.961 10.211 4.963 1.00 0.00 O ATOM 0 H GLY A 5 -7.829 7.228 6.975 1.00 0.00 H new ATOM 0 HA2 GLY A 5 -7.985 8.738 4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 5 -8.888 7.299 5.000 1.00 0.00 H new ATOM 60 N ASN A 6 -10.782 8.614 6.333 1.00 0.00 N ATOM 61 CA ASN A 6 -12.053 9.297 6.597 1.00 0.00 C ATOM 62 C ASN A 6 -12.917 9.330 5.342 1.00 0.00 C ATOM 63 O ASN A 6 -13.915 10.049 5.296 1.00 0.00 O ATOM 64 CB ASN A 6 -11.843 10.740 7.091 1.00 0.00 C ATOM 65 CG ASN A 6 -11.165 10.832 8.444 1.00 0.00 C ATOM 66 OD1 ASN A 6 -9.938 10.836 8.538 1.00 0.00 O ATOM 67 ND2 ASN A 6 -11.959 10.939 9.497 1.00 0.00 N ATOM 0 H ASN A 6 -10.685 7.718 6.811 1.00 0.00 H new ATOM 0 HA ASN A 6 -12.554 8.730 7.382 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -11.245 11.281 6.358 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -12.810 11.240 7.145 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -11.558 11.029 10.431 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -12.972 10.931 9.375 1.00 0.00 H new ATOM 74 N PHE A 7 -12.536 8.558 4.319 1.00 0.00 N ATOM 75 CA PHE A 7 -13.290 8.536 3.071 1.00 0.00 C ATOM 76 C PHE A 7 -14.737 8.117 3.310 1.00 0.00 C ATOM 77 O PHE A 7 -15.643 8.656 2.695 1.00 0.00 O ATOM 78 CB PHE A 7 -12.614 7.635 2.023 1.00 0.00 C ATOM 79 CG PHE A 7 -12.924 6.165 2.111 1.00 0.00 C ATOM 80 CD1 PHE A 7 -12.701 5.448 3.272 1.00 0.00 C ATOM 81 CD2 PHE A 7 -13.419 5.502 1.005 1.00 0.00 C ATOM 82 CE1 PHE A 7 -12.972 4.096 3.326 1.00 0.00 C ATOM 83 CE2 PHE A 7 -13.684 4.153 1.052 1.00 0.00 C ATOM 84 CZ PHE A 7 -13.461 3.449 2.214 1.00 0.00 C ATOM 0 H PHE A 7 -11.719 7.948 4.334 1.00 0.00 H new ATOM 0 HA PHE A 7 -13.299 9.551 2.673 1.00 0.00 H new ATOM 0 HB2 PHE A 7 -12.901 7.987 1.032 1.00 0.00 H new ATOM 0 HB3 PHE A 7 -11.535 7.763 2.106 1.00 0.00 H new ATOM 0 HD1 PHE A 7 -12.311 5.951 4.145 1.00 0.00 H new ATOM 0 HD2 PHE A 7 -13.600 6.050 0.092 1.00 0.00 H new ATOM 0 HE1 PHE A 7 -12.801 3.546 4.240 1.00 0.00 H new ATOM 0 HE2 PHE A 7 -14.067 3.647 0.178 1.00 0.00 H new ATOM 0 HZ PHE A 7 -13.670 2.390 2.253 1.00 0.00 H new ATOM 94 N SER A 8 -14.952 7.201 4.246 1.00 0.00 N ATOM 95 CA SER A 8 -16.291 6.727 4.565 1.00 0.00 C ATOM 96 C SER A 8 -17.155 7.865 5.101 1.00 0.00 C ATOM 97 O SER A 8 -18.384 7.790 5.105 1.00 0.00 O ATOM 98 CB SER A 8 -16.193 5.598 5.591 1.00 0.00 C ATOM 99 OG SER A 8 -15.318 5.961 6.645 1.00 0.00 O ATOM 0 H SER A 8 -14.211 6.770 4.800 1.00 0.00 H new ATOM 0 HA SER A 8 -16.763 6.351 3.657 1.00 0.00 H new ATOM 0 HB2 SER A 8 -17.182 5.376 5.992 1.00 0.00 H new ATOM 0 HB3 SER A 8 -15.833 4.690 5.108 1.00 0.00 H new ATOM 0 HG SER A 8 -15.689 5.653 7.498 1.00 0.00 H new ATOM 105 N GLY A 9 -16.492 8.916 5.559 1.00 0.00 N ATOM 106 CA GLY A 9 -17.188 10.072 6.096 1.00 0.00 C ATOM 107 C GLY A 9 -17.853 10.938 5.033 1.00 0.00 C ATOM 108 O GLY A 9 -18.783 11.685 5.340 1.00 0.00 O ATOM 0 H GLY A 9 -15.475 8.991 5.569 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -17.946 9.732 6.801 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -16.480 10.682 6.658 1.00 0.00 H new ATOM 112 N SER A 10 -17.389 10.851 3.788 1.00 0.00 N ATOM 113 CA SER A 10 -17.964 11.653 2.714 1.00 0.00 C ATOM 114 C SER A 10 -18.254 10.814 1.469 1.00 0.00 C ATOM 115 O SER A 10 -19.001 11.233 0.596 1.00 0.00 O ATOM 116 CB SER A 10 -17.027 12.810 2.358 1.00 0.00 C ATOM 117 OG SER A 10 -16.839 13.682 3.463 1.00 0.00 O ATOM 0 H SER A 10 -16.625 10.240 3.501 1.00 0.00 H new ATOM 0 HA SER A 10 -18.912 12.051 3.075 1.00 0.00 H new ATOM 0 HB2 SER A 10 -16.064 12.414 2.036 1.00 0.00 H new ATOM 0 HB3 SER A 10 -17.439 13.369 1.517 1.00 0.00 H new ATOM 0 HG SER A 10 -16.235 14.410 3.206 1.00 0.00 H new ATOM 123 N SER A 11 -17.663 9.636 1.385 1.00 0.00 N ATOM 124 CA SER A 11 -17.868 8.760 0.251 1.00 0.00 C ATOM 125 C SER A 11 -18.971 7.773 0.571 1.00 0.00 C ATOM 126 O SER A 11 -19.005 7.198 1.660 1.00 0.00 O ATOM 127 CB SER A 11 -16.575 8.012 -0.083 1.00 0.00 C ATOM 128 OG SER A 11 -15.495 8.912 -0.263 1.00 0.00 O ATOM 0 H SER A 11 -17.033 9.264 2.096 1.00 0.00 H new ATOM 0 HA SER A 11 -18.156 9.357 -0.615 1.00 0.00 H new ATOM 0 HB2 SER A 11 -16.339 7.312 0.719 1.00 0.00 H new ATOM 0 HB3 SER A 11 -16.716 7.423 -0.989 1.00 0.00 H new ATOM 0 HG SER A 11 -15.039 8.711 -1.106 1.00 0.00 H new ATOM 134 N ARG A 12 -19.887 7.595 -0.358 1.00 0.00 N ATOM 135 CA ARG A 12 -20.970 6.665 -0.158 1.00 0.00 C ATOM 136 C ARG A 12 -20.794 5.492 -1.101 1.00 0.00 C ATOM 137 O ARG A 12 -19.843 5.457 -1.871 1.00 0.00 O ATOM 138 CB ARG A 12 -22.324 7.343 -0.380 1.00 0.00 C ATOM 139 CG ARG A 12 -22.671 7.565 -1.843 1.00 0.00 C ATOM 140 CD ARG A 12 -24.114 8.011 -2.016 1.00 0.00 C ATOM 141 NE ARG A 12 -24.461 8.206 -3.424 1.00 0.00 N ATOM 142 CZ ARG A 12 -25.622 7.842 -3.970 1.00 0.00 C ATOM 143 NH1 ARG A 12 -26.533 7.194 -3.255 1.00 0.00 N ATOM 144 NH2 ARG A 12 -25.861 8.107 -5.246 1.00 0.00 N ATOM 0 H ARG A 12 -19.901 8.082 -1.254 1.00 0.00 H new ATOM 0 HA ARG A 12 -20.950 6.308 0.872 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -23.103 6.735 0.079 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -22.326 8.305 0.133 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -22.004 8.317 -2.265 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -22.505 6.643 -2.400 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -24.779 7.266 -1.578 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -24.274 8.941 -1.471 1.00 0.00 H new ATOM 0 HE ARG A 12 -23.769 8.650 -4.028 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -26.349 6.969 -2.277 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -27.417 6.921 -3.683 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -25.158 8.588 -5.807 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -26.748 7.830 -5.667 1.00 0.00 H new ATOM 158 N ASP A 13 -21.719 4.554 -1.025 1.00 0.00 N ATOM 159 CA ASP A 13 -21.716 3.340 -1.848 1.00 0.00 C ATOM 160 C ASP A 13 -20.323 2.743 -1.977 1.00 0.00 C ATOM 161 O ASP A 13 -19.873 2.427 -3.078 1.00 0.00 O ATOM 162 CB ASP A 13 -22.298 3.619 -3.237 1.00 0.00 C ATOM 163 CG ASP A 13 -23.812 3.636 -3.231 1.00 0.00 C ATOM 164 OD1 ASP A 13 -24.395 4.691 -2.912 1.00 0.00 O ATOM 165 OD2 ASP A 13 -24.429 2.585 -3.529 1.00 0.00 O ATOM 0 H ASP A 13 -22.510 4.607 -0.383 1.00 0.00 H new ATOM 0 HA ASP A 13 -22.347 2.611 -1.339 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -21.927 4.578 -3.598 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -21.948 2.859 -3.935 1.00 0.00 H new ATOM 170 N ILE A 14 -19.634 2.599 -0.852 1.00 0.00 N ATOM 171 CA ILE A 14 -18.306 2.059 -0.849 1.00 0.00 C ATOM 172 C ILE A 14 -18.370 0.534 -0.923 1.00 0.00 C ATOM 173 O ILE A 14 -18.728 -0.129 0.051 1.00 0.00 O ATOM 174 CB ILE A 14 -17.586 2.510 0.434 1.00 0.00 C ATOM 175 CG1 ILE A 14 -17.806 4.019 0.632 1.00 0.00 C ATOM 176 CG2 ILE A 14 -16.112 2.182 0.366 1.00 0.00 C ATOM 177 CD1 ILE A 14 -16.958 4.642 1.712 1.00 0.00 C ATOM 0 H ILE A 14 -19.988 2.855 0.070 1.00 0.00 H new ATOM 0 HA ILE A 14 -17.753 2.422 -1.715 1.00 0.00 H new ATOM 0 HB ILE A 14 -18.000 1.974 1.288 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -17.603 4.529 -0.310 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -18.856 4.192 0.868 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -15.624 2.510 1.284 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -15.984 1.106 0.251 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -15.664 2.694 -0.486 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -17.180 5.707 1.780 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -17.176 4.164 2.667 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -15.904 4.506 1.471 1.00 0.00 H new ATOM 189 N CYS A 15 -18.079 -0.005 -2.098 1.00 0.00 N ATOM 190 CA CYS A 15 -18.077 -1.447 -2.324 1.00 0.00 C ATOM 191 C CYS A 15 -17.000 -1.797 -3.343 1.00 0.00 C ATOM 192 O CYS A 15 -16.944 -1.212 -4.421 1.00 0.00 O ATOM 193 CB CYS A 15 -19.445 -1.923 -2.810 1.00 0.00 C ATOM 194 SG CYS A 15 -20.788 -1.608 -1.639 1.00 0.00 S ATOM 0 H CYS A 15 -17.837 0.543 -2.923 1.00 0.00 H new ATOM 0 HA CYS A 15 -17.862 -1.952 -1.382 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -19.676 -1.430 -3.754 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -19.396 -2.993 -3.013 1.00 0.00 H new ATOM 0 HG CYS A 15 -20.304 -1.077 -0.556 1.00 0.00 H new ATOM 200 N LEU A 16 -16.132 -2.731 -2.989 1.00 0.00 N ATOM 201 CA LEU A 16 -15.050 -3.129 -3.880 1.00 0.00 C ATOM 202 C LEU A 16 -15.382 -4.350 -4.706 1.00 0.00 C ATOM 203 O LEU A 16 -16.202 -5.186 -4.325 1.00 0.00 O ATOM 204 CB LEU A 16 -13.761 -3.425 -3.110 1.00 0.00 C ATOM 205 CG LEU A 16 -13.891 -3.564 -1.605 1.00 0.00 C ATOM 206 CD1 LEU A 16 -14.467 -4.924 -1.246 1.00 0.00 C ATOM 207 CD2 LEU A 16 -12.537 -3.349 -0.950 1.00 0.00 C ATOM 0 H LEU A 16 -16.153 -3.226 -2.097 1.00 0.00 H new ATOM 0 HA LEU A 16 -14.910 -2.277 -4.545 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -13.333 -4.347 -3.503 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.047 -2.628 -3.319 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.578 -2.804 -1.232 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -14.554 -5.008 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -15.453 -5.033 -1.699 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.808 -5.708 -1.619 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -12.636 -3.450 0.131 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.831 -4.092 -1.321 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.171 -2.350 -1.189 1.00 0.00 H new ATOM 219 N ASP A 17 -14.697 -4.441 -5.829 1.00 0.00 N ATOM 220 CA ASP A 17 -14.836 -5.560 -6.729 1.00 0.00 C ATOM 221 C ASP A 17 -13.752 -6.562 -6.379 1.00 0.00 C ATOM 222 O ASP A 17 -12.693 -6.606 -7.012 1.00 0.00 O ATOM 223 CB ASP A 17 -14.702 -5.111 -8.187 1.00 0.00 C ATOM 224 CG ASP A 17 -14.985 -6.230 -9.170 1.00 0.00 C ATOM 225 OD1 ASP A 17 -16.166 -6.605 -9.318 1.00 0.00 O ATOM 226 OD2 ASP A 17 -14.032 -6.723 -9.812 1.00 0.00 O ATOM 0 H ASP A 17 -14.028 -3.737 -6.140 1.00 0.00 H new ATOM 0 HA ASP A 17 -15.824 -6.009 -6.622 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -15.389 -4.286 -8.374 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -13.694 -4.731 -8.355 1.00 0.00 H new ATOM 231 N GLY A 18 -13.969 -7.269 -5.284 1.00 0.00 N ATOM 232 CA GLY A 18 -13.024 -8.265 -4.833 1.00 0.00 C ATOM 233 C GLY A 18 -11.882 -7.645 -4.064 1.00 0.00 C ATOM 234 O GLY A 18 -11.595 -8.033 -2.938 1.00 0.00 O ATOM 0 H GLY A 18 -14.794 -7.169 -4.692 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -13.535 -8.992 -4.202 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -12.631 -8.809 -5.692 1.00 0.00 H new ATOM 238 N ALA A 19 -11.234 -6.674 -4.678 1.00 0.00 N ATOM 239 CA ALA A 19 -10.122 -5.987 -4.069 1.00 0.00 C ATOM 240 C ALA A 19 -10.049 -4.547 -4.565 1.00 0.00 C ATOM 241 O ALA A 19 -9.298 -3.735 -4.030 1.00 0.00 O ATOM 242 CB ALA A 19 -8.835 -6.735 -4.365 1.00 0.00 C ATOM 0 H ALA A 19 -11.467 -6.342 -5.614 1.00 0.00 H new ATOM 0 HA ALA A 19 -10.265 -5.959 -2.989 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -7.997 -6.213 -3.903 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -8.900 -7.745 -3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -8.683 -6.784 -5.443 1.00 0.00 H new ATOM 248 N ARG A 20 -10.828 -4.227 -5.595 1.00 0.00 N ATOM 249 CA ARG A 20 -10.835 -2.872 -6.136 1.00 0.00 C ATOM 250 C ARG A 20 -11.922 -2.035 -5.482 1.00 0.00 C ATOM 251 O ARG A 20 -13.086 -2.083 -5.877 1.00 0.00 O ATOM 252 CB ARG A 20 -10.990 -2.884 -7.656 1.00 0.00 C ATOM 253 CG ARG A 20 -9.711 -3.293 -8.364 1.00 0.00 C ATOM 254 CD ARG A 20 -9.818 -3.156 -9.870 1.00 0.00 C ATOM 255 NE ARG A 20 -8.507 -3.269 -10.505 1.00 0.00 N ATOM 256 CZ ARG A 20 -8.316 -3.547 -11.792 1.00 0.00 C ATOM 257 NH1 ARG A 20 -9.354 -3.758 -12.594 1.00 0.00 N ATOM 258 NH2 ARG A 20 -7.082 -3.600 -12.280 1.00 0.00 N ATOM 0 H ARG A 20 -11.455 -4.879 -6.067 1.00 0.00 H new ATOM 0 HA ARG A 20 -9.873 -2.415 -5.906 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -11.790 -3.571 -7.932 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -11.289 -1.893 -7.996 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.886 -2.679 -8.003 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.473 -4.326 -8.111 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.482 -3.926 -10.262 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.264 -2.193 -10.120 1.00 0.00 H new ATOM 0 HE ARG A 20 -7.682 -3.125 -9.922 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.303 -3.707 -12.224 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -9.202 -3.971 -13.580 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -6.284 -3.428 -11.669 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -6.932 -3.813 -13.266 1.00 0.00 H new ATOM 272 N LEU A 21 -11.510 -1.282 -4.467 1.00 0.00 N ATOM 273 CA LEU A 21 -12.393 -0.417 -3.695 1.00 0.00 C ATOM 274 C LEU A 21 -13.065 0.628 -4.552 1.00 0.00 C ATOM 275 O LEU A 21 -12.408 1.343 -5.284 1.00 0.00 O ATOM 276 CB LEU A 21 -11.605 0.232 -2.567 1.00 0.00 C ATOM 277 CG LEU A 21 -12.350 1.309 -1.788 1.00 0.00 C ATOM 278 CD1 LEU A 21 -13.599 0.722 -1.173 1.00 0.00 C ATOM 279 CD2 LEU A 21 -11.461 1.914 -0.716 1.00 0.00 C ATOM 0 H LEU A 21 -10.540 -1.256 -4.154 1.00 0.00 H new ATOM 0 HA LEU A 21 -13.189 -1.033 -3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -11.292 -0.546 -1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -10.698 0.670 -2.984 1.00 0.00 H new ATOM 0 HG LEU A 21 -12.633 2.106 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -14.129 1.495 -0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -14.245 0.335 -1.961 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -13.326 -0.088 -0.497 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -12.015 2.680 -0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -11.146 1.135 -0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.583 2.362 -1.182 1.00 0.00 H new ATOM 291 N ARG A 22 -14.380 0.724 -4.439 1.00 0.00 N ATOM 292 CA ARG A 22 -15.128 1.687 -5.229 1.00 0.00 C ATOM 293 C ARG A 22 -16.116 2.437 -4.346 1.00 0.00 C ATOM 294 O ARG A 22 -16.983 1.834 -3.728 1.00 0.00 O ATOM 295 CB ARG A 22 -15.850 0.974 -6.378 1.00 0.00 C ATOM 296 CG ARG A 22 -16.263 1.898 -7.509 1.00 0.00 C ATOM 297 CD ARG A 22 -16.780 1.123 -8.714 1.00 0.00 C ATOM 298 NE ARG A 22 -15.931 -0.019 -9.068 1.00 0.00 N ATOM 299 CZ ARG A 22 -16.367 -1.281 -9.158 1.00 0.00 C ATOM 300 NH1 ARG A 22 -17.629 -1.584 -8.874 1.00 0.00 N ATOM 301 NH2 ARG A 22 -15.535 -2.240 -9.541 1.00 0.00 N ATOM 0 H ARG A 22 -14.947 0.152 -3.813 1.00 0.00 H new ATOM 0 HA ARG A 22 -14.437 2.413 -5.657 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -15.199 0.196 -6.776 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -16.737 0.477 -5.985 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -17.037 2.580 -7.157 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -15.411 2.509 -7.808 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -17.789 0.768 -8.505 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -16.850 1.796 -9.569 1.00 0.00 H new ATOM 0 HE ARG A 22 -14.945 0.160 -9.258 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.277 -0.851 -8.584 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -17.950 -2.549 -8.946 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -14.566 -2.015 -9.766 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -15.864 -3.203 -9.611 1.00 0.00 H new ATOM 315 N ALA A 23 -15.968 3.751 -4.282 1.00 0.00 N ATOM 316 CA ALA A 23 -16.831 4.586 -3.466 1.00 0.00 C ATOM 317 C ALA A 23 -17.149 5.908 -4.141 1.00 0.00 C ATOM 318 O ALA A 23 -16.352 6.452 -4.899 1.00 0.00 O ATOM 319 CB ALA A 23 -16.199 4.864 -2.114 1.00 0.00 C ATOM 0 H ALA A 23 -15.250 4.265 -4.792 1.00 0.00 H new ATOM 0 HA ALA A 23 -17.759 4.031 -3.331 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -16.866 5.491 -1.523 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -16.028 3.923 -1.592 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -15.248 5.378 -2.256 1.00 0.00 H new ATOM 325 N GLU A 24 -18.323 6.404 -3.833 1.00 0.00 N ATOM 326 CA GLU A 24 -18.816 7.671 -4.334 1.00 0.00 C ATOM 327 C GLU A 24 -18.269 8.794 -3.459 1.00 0.00 C ATOM 328 O GLU A 24 -18.977 9.321 -2.604 1.00 0.00 O ATOM 329 CB GLU A 24 -20.341 7.689 -4.278 1.00 0.00 C ATOM 330 CG GLU A 24 -21.025 6.733 -5.237 1.00 0.00 C ATOM 331 CD GLU A 24 -20.978 7.209 -6.670 1.00 0.00 C ATOM 332 OE1 GLU A 24 -21.222 8.410 -6.913 1.00 0.00 O ATOM 333 OE2 GLU A 24 -20.703 6.384 -7.558 1.00 0.00 O ATOM 0 H GLU A 24 -18.980 5.930 -3.213 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.492 7.807 -5.366 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -20.656 7.450 -3.262 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -20.686 8.701 -4.488 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -20.550 5.754 -5.168 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -22.065 6.605 -4.935 1.00 0.00 H new ATOM 340 N CYS A 25 -17.002 9.108 -3.642 1.00 0.00 N ATOM 341 CA CYS A 25 -16.343 10.147 -2.881 1.00 0.00 C ATOM 342 C CYS A 25 -16.966 11.514 -3.130 1.00 0.00 C ATOM 343 O CYS A 25 -17.080 11.962 -4.271 1.00 0.00 O ATOM 344 CB CYS A 25 -14.870 10.159 -3.253 1.00 0.00 C ATOM 345 SG CYS A 25 -14.075 8.552 -3.078 1.00 0.00 S ATOM 0 H CYS A 25 -16.400 8.648 -4.325 1.00 0.00 H new ATOM 0 HA CYS A 25 -16.462 9.934 -1.819 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -14.766 10.497 -4.284 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -14.350 10.883 -2.626 1.00 0.00 H new ATOM 0 HG CYS A 25 -14.883 7.621 -3.489 1.00 0.00 H new ATOM 351 N ARG A 26 -17.389 12.160 -2.052 1.00 0.00 N ATOM 352 CA ARG A 26 -17.992 13.479 -2.136 1.00 0.00 C ATOM 353 C ARG A 26 -16.925 14.548 -2.355 1.00 0.00 C ATOM 354 O ARG A 26 -16.041 14.734 -1.519 1.00 0.00 O ATOM 355 CB ARG A 26 -18.752 13.799 -0.849 1.00 0.00 C ATOM 356 CG ARG A 26 -19.673 14.998 -0.984 1.00 0.00 C ATOM 357 CD ARG A 26 -20.217 15.450 0.359 1.00 0.00 C ATOM 358 NE ARG A 26 -21.224 14.541 0.907 1.00 0.00 N ATOM 359 CZ ARG A 26 -22.183 14.928 1.750 1.00 0.00 C ATOM 360 NH1 ARG A 26 -22.241 16.193 2.154 1.00 0.00 N ATOM 361 NH2 ARG A 26 -23.081 14.057 2.186 1.00 0.00 N ATOM 0 H ARG A 26 -17.324 11.788 -1.105 1.00 0.00 H new ATOM 0 HA ARG A 26 -18.681 13.477 -2.981 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -19.339 12.929 -0.555 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -18.036 13.986 -0.048 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -19.132 15.820 -1.451 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -20.502 14.746 -1.645 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -19.393 15.538 1.067 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -20.653 16.443 0.252 1.00 0.00 H new ATOM 0 HE ARG A 26 -21.191 13.560 0.630 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -21.553 16.867 1.820 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -22.974 16.489 2.798 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -23.041 13.086 1.877 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -23.812 14.358 2.830 1.00 0.00 H new ATOM 375 N ARG A 27 -17.001 15.244 -3.474 1.00 0.00 N ATOM 376 CA ARG A 27 -16.047 16.298 -3.768 1.00 0.00 C ATOM 377 C ARG A 27 -16.500 17.579 -3.094 1.00 0.00 C ATOM 378 O ARG A 27 -17.680 17.706 -2.734 1.00 0.00 O ATOM 379 CB ARG A 27 -15.927 16.555 -5.266 1.00 0.00 C ATOM 380 CG ARG A 27 -15.980 15.314 -6.129 1.00 0.00 C ATOM 381 CD ARG A 27 -15.649 15.650 -7.573 1.00 0.00 C ATOM 382 NE ARG A 27 -16.428 16.789 -8.061 1.00 0.00 N ATOM 383 CZ ARG A 27 -17.211 16.748 -9.133 1.00 0.00 C ATOM 384 NH1 ARG A 27 -17.383 15.609 -9.791 1.00 0.00 N ATOM 385 NH2 ARG A 27 -17.846 17.842 -9.529 1.00 0.00 N ATOM 0 H ARG A 27 -17.711 15.100 -4.192 1.00 0.00 H new ATOM 0 HA ARG A 27 -15.073 15.979 -3.395 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -16.730 17.227 -5.571 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -14.988 17.074 -5.457 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -15.275 14.573 -5.752 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -16.973 14.868 -6.073 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -14.586 15.874 -7.659 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -15.844 14.781 -8.202 1.00 0.00 H new ATOM 0 HE ARG A 27 -16.366 17.668 -7.547 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -16.913 14.761 -9.474 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -17.985 15.581 -10.614 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -17.733 18.713 -9.011 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -18.448 17.813 -10.352 1.00 0.00 H new ATOM 399 N GLY A 28 -15.572 18.537 -2.992 1.00 0.00 N ATOM 400 CA GLY A 28 -15.845 19.821 -2.357 1.00 0.00 C ATOM 401 C GLY A 28 -17.028 20.555 -2.965 1.00 0.00 C ATOM 402 O GLY A 28 -17.563 21.485 -2.362 1.00 0.00 O ATOM 0 H GLY A 28 -14.620 18.441 -3.345 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -16.033 19.660 -1.295 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -14.959 20.451 -2.432 1.00 0.00 H new ATOM 406 N ASP A 29 -17.433 20.130 -4.157 1.00 0.00 N ATOM 407 CA ASP A 29 -18.574 20.727 -4.843 1.00 0.00 C ATOM 408 C ASP A 29 -19.863 20.315 -4.153 1.00 0.00 C ATOM 409 O ASP A 29 -20.940 20.837 -4.443 1.00 0.00 O ATOM 410 CB ASP A 29 -18.638 20.267 -6.302 1.00 0.00 C ATOM 411 CG ASP A 29 -17.336 20.439 -7.053 1.00 0.00 C ATOM 412 OD1 ASP A 29 -17.086 21.541 -7.582 1.00 0.00 O ATOM 413 OD2 ASP A 29 -16.565 19.456 -7.135 1.00 0.00 O ATOM 0 H ASP A 29 -16.986 19.371 -4.670 1.00 0.00 H new ATOM 0 HA ASP A 29 -18.454 21.810 -4.812 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -18.927 19.216 -6.330 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -19.420 20.826 -6.816 1.00 0.00 H new ATOM 418 N GLY A 30 -19.740 19.361 -3.241 1.00 0.00 N ATOM 419 CA GLY A 30 -20.885 18.854 -2.527 1.00 0.00 C ATOM 420 C GLY A 30 -21.523 17.730 -3.302 1.00 0.00 C ATOM 421 O GLY A 30 -22.647 17.314 -3.014 1.00 0.00 O ATOM 0 H GLY A 30 -18.854 18.927 -2.983 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -20.581 18.500 -1.542 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -21.608 19.654 -2.369 1.00 0.00 H new ATOM 425 N GLY A 31 -20.788 17.233 -4.292 1.00 0.00 N ATOM 426 CA GLY A 31 -21.303 16.161 -5.132 1.00 0.00 C ATOM 427 C GLY A 31 -20.539 14.866 -4.980 1.00 0.00 C ATOM 428 O GLY A 31 -19.418 14.861 -4.486 1.00 0.00 O ATOM 0 H GLY A 31 -19.848 17.550 -4.529 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -22.351 15.988 -4.887 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -21.267 16.476 -6.175 1.00 0.00 H new ATOM 432 N TYR A 32 -21.143 13.764 -5.414 1.00 0.00 N ATOM 433 CA TYR A 32 -20.517 12.456 -5.325 1.00 0.00 C ATOM 434 C TYR A 32 -19.933 12.036 -6.663 1.00 0.00 C ATOM 435 O TYR A 32 -20.540 12.249 -7.715 1.00 0.00 O ATOM 436 CB TYR A 32 -21.529 11.403 -4.866 1.00 0.00 C ATOM 437 CG TYR A 32 -21.978 11.565 -3.435 1.00 0.00 C ATOM 438 CD1 TYR A 32 -21.081 11.391 -2.395 1.00 0.00 C ATOM 439 CD2 TYR A 32 -23.296 11.879 -3.122 1.00 0.00 C ATOM 440 CE1 TYR A 32 -21.474 11.526 -1.083 1.00 0.00 C ATOM 441 CE2 TYR A 32 -23.699 12.013 -1.806 1.00 0.00 C ATOM 442 CZ TYR A 32 -22.783 11.836 -0.793 1.00 0.00 C ATOM 443 OH TYR A 32 -23.174 11.963 0.519 1.00 0.00 O ATOM 0 H TYR A 32 -22.073 13.755 -5.834 1.00 0.00 H new ATOM 0 HA TYR A 32 -19.712 12.529 -4.594 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -22.402 11.446 -5.517 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -21.089 10.413 -4.988 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -20.053 11.145 -2.617 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -24.014 12.020 -3.917 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -20.759 11.389 -0.285 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -24.726 12.255 -1.574 1.00 0.00 H new ATOM 0 HH TYR A 32 -24.128 12.185 0.556 1.00 0.00 H new ATOM 453 N SER A 33 -18.754 11.449 -6.617 1.00 0.00 N ATOM 454 CA SER A 33 -18.087 10.967 -7.813 1.00 0.00 C ATOM 455 C SER A 33 -17.580 9.549 -7.579 1.00 0.00 C ATOM 456 O SER A 33 -16.970 9.268 -6.546 1.00 0.00 O ATOM 457 CB SER A 33 -16.936 11.899 -8.191 1.00 0.00 C ATOM 458 OG SER A 33 -17.413 13.216 -8.403 1.00 0.00 O ATOM 0 H SER A 33 -18.232 11.292 -5.755 1.00 0.00 H new ATOM 0 HA SER A 33 -18.797 10.954 -8.640 1.00 0.00 H new ATOM 0 HB2 SER A 33 -16.187 11.900 -7.400 1.00 0.00 H new ATOM 0 HB3 SER A 33 -16.446 11.534 -9.093 1.00 0.00 H new ATOM 0 HG SER A 33 -18.070 13.213 -9.130 1.00 0.00 H new ATOM 464 N THR A 34 -17.849 8.656 -8.522 1.00 0.00 N ATOM 465 CA THR A 34 -17.428 7.274 -8.387 1.00 0.00 C ATOM 466 C THR A 34 -15.917 7.135 -8.494 1.00 0.00 C ATOM 467 O THR A 34 -15.331 7.329 -9.564 1.00 0.00 O ATOM 468 CB THR A 34 -18.079 6.376 -9.445 1.00 0.00 C ATOM 469 OG1 THR A 34 -19.423 6.807 -9.682 1.00 0.00 O ATOM 470 CG2 THR A 34 -18.080 4.930 -8.967 1.00 0.00 C ATOM 0 H THR A 34 -18.354 8.865 -9.383 1.00 0.00 H new ATOM 0 HA THR A 34 -17.751 6.955 -7.396 1.00 0.00 H new ATOM 0 HB THR A 34 -17.510 6.445 -10.372 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.030 6.336 -9.073 1.00 0.00 H new ATOM 0 HG21 THR A 34 -18.544 4.297 -9.723 1.00 0.00 H new ATOM 0 HG22 THR A 34 -17.054 4.602 -8.799 1.00 0.00 H new ATOM 0 HG23 THR A 34 -18.642 4.855 -8.036 1.00 0.00 H new ATOM 478 N SER A 35 -15.302 6.809 -7.381 1.00 0.00 N ATOM 479 CA SER A 35 -13.864 6.625 -7.315 1.00 0.00 C ATOM 480 C SER A 35 -13.543 5.163 -6.999 1.00 0.00 C ATOM 481 O SER A 35 -14.248 4.529 -6.219 1.00 0.00 O ATOM 482 CB SER A 35 -13.281 7.549 -6.247 1.00 0.00 C ATOM 483 OG SER A 35 -11.889 7.346 -6.101 1.00 0.00 O ATOM 0 H SER A 35 -15.782 6.663 -6.493 1.00 0.00 H new ATOM 0 HA SER A 35 -13.417 6.876 -8.277 1.00 0.00 H new ATOM 0 HB2 SER A 35 -13.474 8.588 -6.516 1.00 0.00 H new ATOM 0 HB3 SER A 35 -13.780 7.369 -5.295 1.00 0.00 H new ATOM 0 HG SER A 35 -11.416 7.777 -6.843 1.00 0.00 H new ATOM 489 N VAL A 36 -12.490 4.628 -7.603 1.00 0.00 N ATOM 490 CA VAL A 36 -12.111 3.240 -7.374 1.00 0.00 C ATOM 491 C VAL A 36 -10.589 3.088 -7.262 1.00 0.00 C ATOM 492 O VAL A 36 -9.833 3.672 -8.038 1.00 0.00 O ATOM 493 CB VAL A 36 -12.706 2.303 -8.463 1.00 0.00 C ATOM 494 CG1 VAL A 36 -12.530 2.874 -9.859 1.00 0.00 C ATOM 495 CG2 VAL A 36 -12.119 0.902 -8.380 1.00 0.00 C ATOM 0 H VAL A 36 -11.886 5.131 -8.252 1.00 0.00 H new ATOM 0 HA VAL A 36 -12.537 2.934 -6.418 1.00 0.00 H new ATOM 0 HB VAL A 36 -13.775 2.233 -8.264 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -12.959 2.188 -10.589 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -13.036 3.837 -9.925 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -11.468 3.007 -10.067 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -12.559 0.277 -9.157 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -11.039 0.951 -8.522 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -12.337 0.473 -7.402 1.00 0.00 H new ATOM 505 N ILE A 37 -10.150 2.314 -6.270 1.00 0.00 N ATOM 506 CA ILE A 37 -8.729 2.108 -6.009 1.00 0.00 C ATOM 507 C ILE A 37 -8.421 0.623 -5.769 1.00 0.00 C ATOM 508 O ILE A 37 -9.270 -0.121 -5.287 1.00 0.00 O ATOM 509 CB ILE A 37 -8.304 2.950 -4.786 1.00 0.00 C ATOM 510 CG1 ILE A 37 -6.832 2.719 -4.430 1.00 0.00 C ATOM 511 CG2 ILE A 37 -9.208 2.641 -3.600 1.00 0.00 C ATOM 512 CD1 ILE A 37 -6.321 3.614 -3.319 1.00 0.00 C ATOM 0 H ILE A 37 -10.767 1.815 -5.629 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.163 2.427 -6.884 1.00 0.00 H new ATOM 0 HB ILE A 37 -8.412 4.004 -5.043 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.699 1.678 -4.135 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -6.224 2.878 -5.320 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -8.900 3.239 -2.742 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -10.240 2.879 -3.857 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -9.131 1.583 -3.350 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -5.272 3.390 -3.125 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -6.420 4.658 -3.618 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -6.903 3.439 -2.414 1.00 0.00 H new ATOM 524 N ASP A 38 -7.210 0.195 -6.110 1.00 0.00 N ATOM 525 CA ASP A 38 -6.810 -1.202 -5.935 1.00 0.00 C ATOM 526 C ASP A 38 -6.298 -1.482 -4.526 1.00 0.00 C ATOM 527 O ASP A 38 -5.131 -1.241 -4.227 1.00 0.00 O ATOM 528 CB ASP A 38 -5.715 -1.580 -6.933 1.00 0.00 C ATOM 529 CG ASP A 38 -6.250 -1.902 -8.313 1.00 0.00 C ATOM 530 OD1 ASP A 38 -6.406 -0.971 -9.129 1.00 0.00 O ATOM 531 OD2 ASP A 38 -6.501 -3.093 -8.600 1.00 0.00 O ATOM 0 H ASP A 38 -6.487 0.793 -6.509 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.703 -1.803 -6.109 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -5.003 -0.758 -7.009 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.168 -2.442 -6.552 1.00 0.00 H new ATOM 536 N LEU A 39 -7.163 -2.020 -3.668 1.00 0.00 N ATOM 537 CA LEU A 39 -6.779 -2.352 -2.304 1.00 0.00 C ATOM 538 C LEU A 39 -6.018 -3.670 -2.269 1.00 0.00 C ATOM 539 O LEU A 39 -5.443 -4.048 -1.249 1.00 0.00 O ATOM 540 CB LEU A 39 -8.014 -2.420 -1.405 1.00 0.00 C ATOM 541 CG LEU A 39 -8.338 -1.118 -0.659 1.00 0.00 C ATOM 542 CD1 LEU A 39 -7.251 -0.797 0.354 1.00 0.00 C ATOM 543 CD2 LEU A 39 -8.483 0.034 -1.630 1.00 0.00 C ATOM 0 H LEU A 39 -8.134 -2.234 -3.897 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.122 -1.568 -1.929 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.875 -2.698 -2.014 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -7.871 -3.216 -0.674 1.00 0.00 H new ATOM 0 HG LEU A 39 -9.283 -1.259 -0.134 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.499 0.129 0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.177 -1.609 1.077 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.297 -0.681 -0.160 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -8.712 0.947 -1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.551 0.166 -2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.290 -0.180 -2.331 1.00 0.00 H new ATOM 555 N ASN A 40 -6.002 -4.354 -3.404 1.00 0.00 N ATOM 556 CA ASN A 40 -5.298 -5.624 -3.544 1.00 0.00 C ATOM 557 C ASN A 40 -3.795 -5.428 -3.392 1.00 0.00 C ATOM 558 O ASN A 40 -3.049 -6.384 -3.182 1.00 0.00 O ATOM 559 CB ASN A 40 -5.622 -6.266 -4.904 1.00 0.00 C ATOM 560 CG ASN A 40 -5.525 -5.286 -6.063 1.00 0.00 C ATOM 561 OD1 ASN A 40 -4.681 -4.393 -6.071 1.00 0.00 O ATOM 562 ND2 ASN A 40 -6.411 -5.427 -7.038 1.00 0.00 N ATOM 0 H ASN A 40 -6.475 -4.046 -4.253 1.00 0.00 H new ATOM 0 HA ASN A 40 -5.635 -6.293 -2.753 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -4.938 -7.096 -5.080 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -6.628 -6.683 -4.872 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -6.407 -4.782 -7.828 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -7.098 -6.180 -6.998 1.00 0.00 H new ATOM 569 N ARG A 41 -3.361 -4.179 -3.492 1.00 0.00 N ATOM 570 CA ARG A 41 -1.957 -3.839 -3.362 1.00 0.00 C ATOM 571 C ARG A 41 -1.724 -2.998 -2.115 1.00 0.00 C ATOM 572 O ARG A 41 -0.721 -2.298 -2.003 1.00 0.00 O ATOM 573 CB ARG A 41 -1.482 -3.091 -4.611 1.00 0.00 C ATOM 574 CG ARG A 41 -1.526 -3.934 -5.878 1.00 0.00 C ATOM 575 CD ARG A 41 -1.550 -3.066 -7.126 1.00 0.00 C ATOM 576 NE ARG A 41 -1.401 -3.850 -8.354 1.00 0.00 N ATOM 577 CZ ARG A 41 -2.415 -4.210 -9.142 1.00 0.00 C ATOM 578 NH1 ARG A 41 -3.667 -3.955 -8.784 1.00 0.00 N ATOM 579 NH2 ARG A 41 -2.177 -4.849 -10.279 1.00 0.00 N ATOM 0 H ARG A 41 -3.971 -3.380 -3.665 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.381 -4.759 -3.264 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.102 -2.205 -4.752 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -0.461 -2.744 -4.451 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -0.658 -4.592 -5.908 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.409 -4.572 -5.861 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -2.489 -2.513 -7.163 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -0.748 -2.330 -7.069 1.00 0.00 H new ATOM 0 HE ARG A 41 -0.461 -4.139 -8.624 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.859 -3.481 -7.901 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.438 -4.233 -9.391 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -1.218 -5.065 -10.551 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -2.953 -5.124 -10.881 1.00 0.00 H new ATOM 593 N TYR A 42 -2.668 -3.068 -1.186 1.00 0.00 N ATOM 594 CA TYR A 42 -2.568 -2.326 0.070 1.00 0.00 C ATOM 595 C TYR A 42 -2.983 -3.188 1.259 1.00 0.00 C ATOM 596 O TYR A 42 -2.463 -3.031 2.362 1.00 0.00 O ATOM 597 CB TYR A 42 -3.426 -1.056 0.028 1.00 0.00 C ATOM 598 CG TYR A 42 -2.895 0.011 -0.903 1.00 0.00 C ATOM 599 CD1 TYR A 42 -1.758 0.742 -0.575 1.00 0.00 C ATOM 600 CD2 TYR A 42 -3.526 0.287 -2.109 1.00 0.00 C ATOM 601 CE1 TYR A 42 -1.269 1.716 -1.421 1.00 0.00 C ATOM 602 CE2 TYR A 42 -3.040 1.260 -2.961 1.00 0.00 C ATOM 603 CZ TYR A 42 -1.911 1.970 -2.612 1.00 0.00 C ATOM 604 OH TYR A 42 -1.420 2.938 -3.457 1.00 0.00 O ATOM 0 H TYR A 42 -3.514 -3.631 -1.276 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.523 -2.043 0.195 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -4.437 -1.322 -0.280 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -3.497 -0.644 1.035 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.250 0.544 0.357 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -4.411 -0.268 -2.385 1.00 0.00 H new ATOM 0 HE1 TYR A 42 -0.387 2.277 -1.150 1.00 0.00 H new ATOM 0 HE2 TYR A 42 -3.542 1.463 -3.895 1.00 0.00 H new ATOM 0 HH TYR A 42 -1.986 2.993 -4.255 1.00 0.00 H new ATOM 614 N LEU A 43 -3.914 -4.102 1.029 1.00 0.00 N ATOM 615 CA LEU A 43 -4.396 -4.978 2.076 1.00 0.00 C ATOM 616 C LEU A 43 -3.799 -6.358 1.913 1.00 0.00 C ATOM 617 O LEU A 43 -3.782 -6.919 0.816 1.00 0.00 O ATOM 618 CB LEU A 43 -5.909 -5.089 1.990 1.00 0.00 C ATOM 619 CG LEU A 43 -6.655 -3.765 1.958 1.00 0.00 C ATOM 620 CD1 LEU A 43 -8.124 -4.010 1.741 1.00 0.00 C ATOM 621 CD2 LEU A 43 -6.419 -2.984 3.236 1.00 0.00 C ATOM 0 H LEU A 43 -4.350 -4.253 0.120 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.104 -4.564 3.041 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.165 -5.654 1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.264 -5.667 2.843 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.275 -3.168 1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -8.652 -3.057 1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -8.270 -4.528 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -8.515 -4.623 2.553 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -6.962 -2.040 3.191 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -6.771 -3.565 4.088 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -5.353 -2.784 3.349 1.00 0.00 H new ATOM 633 N SER A 44 -3.325 -6.890 3.009 1.00 0.00 N ATOM 634 CA SER A 44 -2.708 -8.194 3.038 1.00 0.00 C ATOM 635 C SER A 44 -3.434 -9.098 4.015 1.00 0.00 C ATOM 636 O SER A 44 -3.963 -8.638 5.025 1.00 0.00 O ATOM 637 CB SER A 44 -1.254 -8.047 3.476 1.00 0.00 C ATOM 638 OG SER A 44 -0.617 -6.993 2.779 1.00 0.00 O ATOM 0 H SER A 44 -3.356 -6.427 3.917 1.00 0.00 H new ATOM 0 HA SER A 44 -2.759 -8.635 2.043 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.211 -7.856 4.548 1.00 0.00 H new ATOM 0 HB3 SER A 44 -0.721 -8.981 3.297 1.00 0.00 H new ATOM 0 HG SER A 44 0.313 -6.918 3.078 1.00 0.00 H new ATOM 644 N ASN A 45 -3.479 -10.374 3.699 1.00 0.00 N ATOM 645 CA ASN A 45 -4.106 -11.344 4.578 1.00 0.00 C ATOM 646 C ASN A 45 -3.024 -11.961 5.457 1.00 0.00 C ATOM 647 O ASN A 45 -2.381 -12.943 5.103 1.00 0.00 O ATOM 648 CB ASN A 45 -4.871 -12.409 3.766 1.00 0.00 C ATOM 649 CG ASN A 45 -3.991 -13.254 2.857 1.00 0.00 C ATOM 650 OD1 ASN A 45 -3.582 -12.810 1.786 1.00 0.00 O ATOM 651 ND2 ASN A 45 -3.734 -14.493 3.255 1.00 0.00 N ATOM 0 H ASN A 45 -3.090 -10.766 2.841 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.845 -10.856 5.213 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -5.397 -13.067 4.457 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -5.628 -11.912 3.160 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -3.179 -15.113 2.665 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -4.091 -14.825 4.151 1.00 0.00 H new ATOM 658 N ASP A 46 -2.818 -11.366 6.616 1.00 0.00 N ATOM 659 CA ASP A 46 -1.791 -11.835 7.524 1.00 0.00 C ATOM 660 C ASP A 46 -2.368 -12.813 8.528 1.00 0.00 C ATOM 661 O ASP A 46 -2.975 -12.410 9.521 1.00 0.00 O ATOM 662 CB ASP A 46 -1.137 -10.654 8.237 1.00 0.00 C ATOM 663 CG ASP A 46 0.068 -11.060 9.060 1.00 0.00 C ATOM 664 OD1 ASP A 46 -0.109 -11.509 10.207 1.00 0.00 O ATOM 665 OD2 ASP A 46 1.205 -10.919 8.564 1.00 0.00 O ATOM 0 H ASP A 46 -3.346 -10.560 6.950 1.00 0.00 H new ATOM 0 HA ASP A 46 -1.029 -12.356 6.945 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -0.834 -9.912 7.498 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -1.870 -10.176 8.886 1.00 0.00 H new ATOM 670 N ASN A 47 -2.197 -14.096 8.228 1.00 0.00 N ATOM 671 CA ASN A 47 -2.677 -15.179 9.081 1.00 0.00 C ATOM 672 C ASN A 47 -4.168 -15.022 9.398 1.00 0.00 C ATOM 673 O ASN A 47 -4.598 -15.126 10.548 1.00 0.00 O ATOM 674 CB ASN A 47 -1.846 -15.247 10.365 1.00 0.00 C ATOM 675 CG ASN A 47 -2.129 -16.489 11.193 1.00 0.00 C ATOM 676 OD1 ASN A 47 -2.475 -17.546 10.661 1.00 0.00 O ATOM 677 ND2 ASN A 47 -1.970 -16.368 12.501 1.00 0.00 N ATOM 0 H ASN A 47 -1.721 -14.416 7.385 1.00 0.00 H new ATOM 0 HA ASN A 47 -2.558 -16.118 8.540 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -0.787 -15.223 10.107 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -2.047 -14.362 10.968 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -2.135 -17.169 13.111 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -1.682 -15.474 12.899 1.00 0.00 H new ATOM 684 N GLY A 48 -4.952 -14.750 8.364 1.00 0.00 N ATOM 685 CA GLY A 48 -6.385 -14.610 8.541 1.00 0.00 C ATOM 686 C GLY A 48 -6.775 -13.296 9.184 1.00 0.00 C ATOM 687 O GLY A 48 -7.777 -13.219 9.891 1.00 0.00 O ATOM 0 H GLY A 48 -4.623 -14.624 7.407 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -6.875 -14.693 7.571 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.752 -15.432 9.155 1.00 0.00 H new ATOM 691 N HIS A 49 -5.969 -12.270 8.955 1.00 0.00 N ATOM 692 CA HIS A 49 -6.227 -10.941 9.494 1.00 0.00 C ATOM 693 C HIS A 49 -5.829 -9.888 8.479 1.00 0.00 C ATOM 694 O HIS A 49 -4.685 -9.865 8.019 1.00 0.00 O ATOM 695 CB HIS A 49 -5.454 -10.703 10.797 1.00 0.00 C ATOM 696 CG HIS A 49 -6.018 -11.414 11.987 1.00 0.00 C ATOM 697 ND1 HIS A 49 -6.904 -10.826 12.861 1.00 0.00 N ATOM 698 CD2 HIS A 49 -5.813 -12.670 12.450 1.00 0.00 C ATOM 699 CE1 HIS A 49 -7.220 -11.689 13.808 1.00 0.00 C ATOM 700 NE2 HIS A 49 -6.573 -12.816 13.582 1.00 0.00 N ATOM 0 H HIS A 49 -5.120 -12.334 8.393 1.00 0.00 H new ATOM 0 HA HIS A 49 -7.293 -10.871 9.709 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -4.421 -11.020 10.656 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -5.434 -9.633 11.004 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -5.170 -13.418 12.009 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -7.895 -11.504 14.630 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -6.629 -13.658 14.155 1.00 0.00 H new ATOM 709 N PHE A 50 -6.780 -9.042 8.106 1.00 0.00 N ATOM 710 CA PHE A 50 -6.520 -7.969 7.155 1.00 0.00 C ATOM 711 C PHE A 50 -5.490 -7.014 7.725 1.00 0.00 C ATOM 712 O PHE A 50 -5.663 -6.497 8.831 1.00 0.00 O ATOM 713 CB PHE A 50 -7.796 -7.195 6.851 1.00 0.00 C ATOM 714 CG PHE A 50 -8.620 -7.744 5.728 1.00 0.00 C ATOM 715 CD1 PHE A 50 -8.335 -7.399 4.420 1.00 0.00 C ATOM 716 CD2 PHE A 50 -9.691 -8.581 5.976 1.00 0.00 C ATOM 717 CE1 PHE A 50 -9.100 -7.877 3.382 1.00 0.00 C ATOM 718 CE2 PHE A 50 -10.461 -9.068 4.940 1.00 0.00 C ATOM 719 CZ PHE A 50 -10.164 -8.713 3.641 1.00 0.00 C ATOM 0 H PHE A 50 -7.740 -9.078 8.448 1.00 0.00 H new ATOM 0 HA PHE A 50 -6.146 -8.416 6.234 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -8.409 -7.168 7.752 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -7.530 -6.164 6.616 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -7.501 -6.746 4.211 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -9.928 -8.857 6.993 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -8.867 -7.597 2.365 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -11.293 -9.725 5.146 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.765 -9.090 2.827 1.00 0.00 H new ATOM 729 N ARG A 51 -4.431 -6.775 6.974 1.00 0.00 N ATOM 730 CA ARG A 51 -3.361 -5.904 7.421 1.00 0.00 C ATOM 731 C ARG A 51 -2.783 -5.099 6.266 1.00 0.00 C ATOM 732 O ARG A 51 -2.583 -5.626 5.185 1.00 0.00 O ATOM 733 CB ARG A 51 -2.277 -6.752 8.094 1.00 0.00 C ATOM 734 CG ARG A 51 -2.710 -7.226 9.476 1.00 0.00 C ATOM 735 CD ARG A 51 -1.632 -7.992 10.222 1.00 0.00 C ATOM 736 NE ARG A 51 -1.972 -8.109 11.643 1.00 0.00 N ATOM 737 CZ ARG A 51 -2.214 -9.254 12.283 1.00 0.00 C ATOM 738 NH1 ARG A 51 -2.079 -10.420 11.671 1.00 0.00 N ATOM 739 NH2 ARG A 51 -2.578 -9.235 13.558 1.00 0.00 N ATOM 0 H ARG A 51 -4.289 -7.175 6.046 1.00 0.00 H new ATOM 0 HA ARG A 51 -3.761 -5.189 8.140 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -2.049 -7.615 7.468 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.360 -6.169 8.180 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -3.007 -6.362 10.070 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -3.590 -7.861 9.374 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -1.517 -8.985 9.787 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -0.674 -7.483 10.112 1.00 0.00 H new ATOM 0 HE ARG A 51 -2.028 -7.247 12.185 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -1.786 -10.453 10.695 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -2.268 -11.286 12.176 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -2.673 -8.346 14.048 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -2.763 -10.110 14.049 1.00 0.00 H new ATOM 753 N TRP A 52 -2.524 -3.822 6.507 1.00 0.00 N ATOM 754 CA TRP A 52 -1.966 -2.946 5.487 1.00 0.00 C ATOM 755 C TRP A 52 -0.497 -3.275 5.263 1.00 0.00 C ATOM 756 O TRP A 52 0.341 -3.035 6.137 1.00 0.00 O ATOM 757 CB TRP A 52 -2.086 -1.474 5.907 1.00 0.00 C ATOM 758 CG TRP A 52 -3.495 -0.994 6.104 1.00 0.00 C ATOM 759 CD1 TRP A 52 -4.234 -1.047 7.251 1.00 0.00 C ATOM 760 CD2 TRP A 52 -4.324 -0.366 5.121 1.00 0.00 C ATOM 761 NE1 TRP A 52 -5.479 -0.500 7.036 1.00 0.00 N ATOM 762 CE2 TRP A 52 -5.555 -0.074 5.736 1.00 0.00 C ATOM 763 CE3 TRP A 52 -4.144 -0.023 3.777 1.00 0.00 C ATOM 764 CZ2 TRP A 52 -6.599 0.541 5.052 1.00 0.00 C ATOM 765 CZ3 TRP A 52 -5.181 0.587 3.103 1.00 0.00 C ATOM 766 CH2 TRP A 52 -6.394 0.864 3.742 1.00 0.00 C ATOM 0 H TRP A 52 -2.692 -3.368 7.405 1.00 0.00 H new ATOM 0 HA TRP A 52 -2.527 -3.103 4.566 1.00 0.00 H new ATOM 0 HB2 TRP A 52 -1.533 -1.328 6.835 1.00 0.00 H new ATOM 0 HB3 TRP A 52 -1.607 -0.853 5.150 1.00 0.00 H new ATOM 0 HD1 TRP A 52 -3.892 -1.458 8.189 1.00 0.00 H new ATOM 0 HE1 TRP A 52 -6.222 -0.424 7.730 1.00 0.00 H new ATOM 0 HE3 TRP A 52 -3.210 -0.232 3.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 -7.538 0.755 5.540 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 -5.054 0.855 2.065 1.00 0.00 H new ATOM 0 HH2 TRP A 52 -7.186 1.344 3.186 1.00 0.00 H new ATOM 853 N THR A 62 18.491 -6.059 -0.194 1.00 0.00 N ATOM 854 CA THR A 62 19.240 -4.825 -0.334 1.00 0.00 C ATOM 855 C THR A 62 18.608 -3.916 -1.389 1.00 0.00 C ATOM 856 O THR A 62 18.572 -4.246 -2.576 1.00 0.00 O ATOM 857 CB THR A 62 20.710 -5.102 -0.703 1.00 0.00 C ATOM 858 OG1 THR A 62 21.283 -6.018 0.247 1.00 0.00 O ATOM 859 CG2 THR A 62 21.521 -3.813 -0.723 1.00 0.00 C ATOM 0 HA THR A 62 19.212 -4.319 0.631 1.00 0.00 H new ATOM 0 HB THR A 62 20.736 -5.540 -1.701 1.00 0.00 H new ATOM 0 HG1 THR A 62 20.576 -6.579 0.628 1.00 0.00 H new ATOM 0 HG21 THR A 62 22.555 -4.038 -0.986 1.00 0.00 H new ATOM 0 HG22 THR A 62 21.099 -3.129 -1.460 1.00 0.00 H new ATOM 0 HG23 THR A 62 21.490 -3.348 0.263 1.00 0.00 H new ATOM 867 N ALA A 63 18.106 -2.782 -0.937 1.00 0.00 N ATOM 868 CA ALA A 63 17.475 -1.793 -1.795 1.00 0.00 C ATOM 869 C ALA A 63 18.168 -0.449 -1.601 1.00 0.00 C ATOM 870 O ALA A 63 19.079 -0.337 -0.786 1.00 0.00 O ATOM 871 CB ALA A 63 15.990 -1.693 -1.483 1.00 0.00 C ATOM 0 H ALA A 63 18.125 -2.517 0.048 1.00 0.00 H new ATOM 0 HA ALA A 63 17.574 -2.095 -2.838 1.00 0.00 H new ATOM 0 HB1 ALA A 63 15.531 -0.948 -2.133 1.00 0.00 H new ATOM 0 HB2 ALA A 63 15.517 -2.661 -1.649 1.00 0.00 H new ATOM 0 HB3 ALA A 63 15.856 -1.398 -0.442 1.00 0.00 H new ATOM 877 N THR A 64 17.762 0.562 -2.348 1.00 0.00 N ATOM 878 CA THR A 64 18.388 1.873 -2.236 1.00 0.00 C ATOM 879 C THR A 64 17.368 2.994 -2.055 1.00 0.00 C ATOM 880 O THR A 64 16.493 3.193 -2.900 1.00 0.00 O ATOM 881 CB THR A 64 19.269 2.164 -3.464 1.00 0.00 C ATOM 882 OG1 THR A 64 18.648 1.650 -4.653 1.00 0.00 O ATOM 883 CG2 THR A 64 20.650 1.550 -3.292 1.00 0.00 C ATOM 0 H THR A 64 17.009 0.505 -3.034 1.00 0.00 H new ATOM 0 HA THR A 64 19.010 1.845 -1.341 1.00 0.00 H new ATOM 0 HB THR A 64 19.379 3.244 -3.559 1.00 0.00 H new ATOM 0 HG1 THR A 64 19.216 1.842 -5.428 1.00 0.00 H new ATOM 0 HG21 THR A 64 21.257 1.767 -4.171 1.00 0.00 H new ATOM 0 HG22 THR A 64 21.128 1.972 -2.408 1.00 0.00 H new ATOM 0 HG23 THR A 64 20.556 0.471 -3.174 1.00 0.00 H new ATOM 891 N VAL A 65 17.477 3.712 -0.942 1.00 0.00 N ATOM 892 CA VAL A 65 16.582 4.826 -0.655 1.00 0.00 C ATOM 893 C VAL A 65 17.316 6.165 -0.823 1.00 0.00 C ATOM 894 O VAL A 65 18.519 6.254 -0.587 1.00 0.00 O ATOM 895 CB VAL A 65 16.014 4.725 0.781 1.00 0.00 C ATOM 896 CG1 VAL A 65 17.101 4.965 1.819 1.00 0.00 C ATOM 897 CG2 VAL A 65 14.865 5.701 0.971 1.00 0.00 C ATOM 0 H VAL A 65 18.179 3.541 -0.222 1.00 0.00 H new ATOM 0 HA VAL A 65 15.755 4.778 -1.364 1.00 0.00 H new ATOM 0 HB VAL A 65 15.634 3.713 0.922 1.00 0.00 H new ATOM 0 HG11 VAL A 65 16.673 4.888 2.819 1.00 0.00 H new ATOM 0 HG12 VAL A 65 17.887 4.219 1.702 1.00 0.00 H new ATOM 0 HG13 VAL A 65 17.523 5.961 1.681 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.479 5.615 1.987 1.00 0.00 H new ATOM 0 HG22 VAL A 65 15.220 6.718 0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 65 14.071 5.471 0.260 1.00 0.00 H new ATOM 907 N THR A 66 16.598 7.194 -1.251 1.00 0.00 N ATOM 908 CA THR A 66 17.178 8.519 -1.429 1.00 0.00 C ATOM 909 C THR A 66 16.932 9.368 -0.184 1.00 0.00 C ATOM 910 O THR A 66 15.794 9.527 0.256 1.00 0.00 O ATOM 911 CB THR A 66 16.580 9.227 -2.660 1.00 0.00 C ATOM 912 OG1 THR A 66 16.587 8.334 -3.786 1.00 0.00 O ATOM 913 CG2 THR A 66 17.376 10.480 -3.000 1.00 0.00 C ATOM 0 H THR A 66 15.606 7.136 -1.483 1.00 0.00 H new ATOM 0 HA THR A 66 18.250 8.399 -1.586 1.00 0.00 H new ATOM 0 HB THR A 66 15.555 9.516 -2.427 1.00 0.00 H new ATOM 0 HG1 THR A 66 16.204 8.788 -4.566 1.00 0.00 H new ATOM 0 HG21 THR A 66 16.937 10.965 -3.872 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.353 11.166 -2.154 1.00 0.00 H new ATOM 0 HG23 THR A 66 18.409 10.207 -3.218 1.00 0.00 H new ATOM 921 N VAL A 67 18.009 9.892 0.377 1.00 0.00 N ATOM 922 CA VAL A 67 17.946 10.709 1.564 1.00 0.00 C ATOM 923 C VAL A 67 17.394 12.082 1.231 1.00 0.00 C ATOM 924 O VAL A 67 17.829 12.700 0.255 1.00 0.00 O ATOM 925 CB VAL A 67 19.335 10.876 2.203 1.00 0.00 C ATOM 926 CG1 VAL A 67 19.237 11.680 3.491 1.00 0.00 C ATOM 927 CG2 VAL A 67 19.968 9.518 2.446 1.00 0.00 C ATOM 0 H VAL A 67 18.953 9.758 0.015 1.00 0.00 H new ATOM 0 HA VAL A 67 17.288 10.204 2.272 1.00 0.00 H new ATOM 0 HB VAL A 67 19.975 11.428 1.515 1.00 0.00 H new ATOM 0 HG11 VAL A 67 20.229 11.788 3.929 1.00 0.00 H new ATOM 0 HG12 VAL A 67 18.827 12.666 3.274 1.00 0.00 H new ATOM 0 HG13 VAL A 67 18.584 11.163 4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 67 20.951 9.650 2.899 1.00 0.00 H new ATOM 0 HG22 VAL A 67 19.335 8.936 3.116 1.00 0.00 H new ATOM 0 HG23 VAL A 67 20.073 8.991 1.498 1.00 0.00 H new ATOM 937 N GLN A 68 16.445 12.536 2.046 1.00 0.00 N ATOM 938 CA GLN A 68 15.806 13.822 1.877 1.00 0.00 C ATOM 939 C GLN A 68 16.416 14.867 2.807 1.00 0.00 C ATOM 940 O GLN A 68 17.224 14.546 3.682 1.00 0.00 O ATOM 941 CB GLN A 68 14.312 13.677 2.121 1.00 0.00 C ATOM 942 CG GLN A 68 13.511 13.516 0.839 1.00 0.00 C ATOM 943 CD GLN A 68 12.048 13.195 1.083 1.00 0.00 C ATOM 944 OE1 GLN A 68 11.515 13.646 2.207 1.00 0.00 O flip ATOM 945 NE2 GLN A 68 11.402 12.537 0.267 1.00 0.00 N flip ATOM 0 H GLN A 68 16.100 12.009 2.849 1.00 0.00 H new ATOM 0 HA GLN A 68 15.968 14.167 0.856 1.00 0.00 H new ATOM 0 HB2 GLN A 68 14.137 12.813 2.763 1.00 0.00 H new ATOM 0 HB3 GLN A 68 13.951 14.553 2.660 1.00 0.00 H new ATOM 0 HG2 GLN A 68 13.582 14.434 0.256 1.00 0.00 H new ATOM 0 HG3 GLN A 68 13.955 12.722 0.238 1.00 0.00 H new ATOM 0 HE21 GLN A 68 11.848 12.206 -0.589 1.00 0.00 H new ATOM 0 HE22 GLN A 68 10.421 12.323 0.447 1.00 0.00 H new ATOM 954 N GLN A 69 16.041 16.120 2.588 1.00 0.00 N ATOM 955 CA GLN A 69 16.561 17.245 3.363 1.00 0.00 C ATOM 956 C GLN A 69 16.226 17.140 4.849 1.00 0.00 C ATOM 957 O GLN A 69 15.057 17.116 5.231 1.00 0.00 O ATOM 958 CB GLN A 69 16.012 18.560 2.813 1.00 0.00 C ATOM 959 CG GLN A 69 16.741 19.785 3.335 1.00 0.00 C ATOM 960 CD GLN A 69 16.081 21.080 2.910 1.00 0.00 C ATOM 961 OE1 GLN A 69 15.431 21.147 1.866 1.00 0.00 O ATOM 962 NE2 GLN A 69 16.259 22.123 3.705 1.00 0.00 N ATOM 0 H GLN A 69 15.369 16.388 1.869 1.00 0.00 H new ATOM 0 HA GLN A 69 17.646 17.219 3.267 1.00 0.00 H new ATOM 0 HB2 GLN A 69 16.076 18.545 1.725 1.00 0.00 H new ATOM 0 HB3 GLN A 69 14.955 18.639 3.069 1.00 0.00 H new ATOM 0 HG2 GLN A 69 16.782 19.743 4.423 1.00 0.00 H new ATOM 0 HG3 GLN A 69 17.770 19.771 2.976 1.00 0.00 H new ATOM 0 HE21 GLN A 69 16.805 22.024 4.561 1.00 0.00 H new ATOM 0 HE22 GLN A 69 15.851 23.025 3.462 1.00 0.00 H new ATOM 971 N GLY A 70 17.266 17.089 5.678 1.00 0.00 N ATOM 972 CA GLY A 70 17.071 17.020 7.115 1.00 0.00 C ATOM 973 C GLY A 70 16.965 15.606 7.647 1.00 0.00 C ATOM 974 O GLY A 70 16.466 15.395 8.753 1.00 0.00 O ATOM 0 H GLY A 70 18.241 17.094 5.379 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.901 17.524 7.610 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.165 17.566 7.377 1.00 0.00 H new ATOM 978 N ASP A 71 17.428 14.634 6.876 1.00 0.00 N ATOM 979 CA ASP A 71 17.366 13.245 7.305 1.00 0.00 C ATOM 980 C ASP A 71 18.757 12.705 7.610 1.00 0.00 C ATOM 981 O ASP A 71 19.742 13.119 7.001 1.00 0.00 O ATOM 982 CB ASP A 71 16.692 12.370 6.244 1.00 0.00 C ATOM 983 CG ASP A 71 15.208 12.655 6.093 1.00 0.00 C ATOM 984 OD1 ASP A 71 14.605 13.245 7.014 1.00 0.00 O ATOM 985 OD2 ASP A 71 14.630 12.279 5.051 1.00 0.00 O ATOM 0 H ASP A 71 17.847 14.779 5.958 1.00 0.00 H new ATOM 0 HA ASP A 71 16.769 13.212 8.216 1.00 0.00 H new ATOM 0 HB2 ASP A 71 17.186 12.527 5.285 1.00 0.00 H new ATOM 0 HB3 ASP A 71 16.830 11.321 6.506 1.00 0.00 H new ATOM 990 N THR A 72 18.825 11.790 8.569 1.00 0.00 N ATOM 991 CA THR A 72 20.081 11.166 8.969 1.00 0.00 C ATOM 992 C THR A 72 19.934 9.651 8.909 1.00 0.00 C ATOM 993 O THR A 72 18.829 9.163 8.675 1.00 0.00 O ATOM 994 CB THR A 72 20.477 11.572 10.402 1.00 0.00 C ATOM 995 OG1 THR A 72 19.441 11.186 11.315 1.00 0.00 O ATOM 996 CG2 THR A 72 20.719 13.072 10.506 1.00 0.00 C ATOM 0 H THR A 72 18.013 11.460 9.091 1.00 0.00 H new ATOM 0 HA THR A 72 20.859 11.503 8.284 1.00 0.00 H new ATOM 0 HB THR A 72 21.405 11.060 10.656 1.00 0.00 H new ATOM 0 HG1 THR A 72 19.695 11.443 12.226 1.00 0.00 H new ATOM 0 HG21 THR A 72 20.996 13.326 11.529 1.00 0.00 H new ATOM 0 HG22 THR A 72 21.525 13.358 9.830 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.809 13.607 10.234 1.00 0.00 H new ATOM 1004 N LEU A 73 21.028 8.901 9.108 1.00 0.00 N ATOM 1005 CA LEU A 73 20.942 7.438 9.085 1.00 0.00 C ATOM 1006 C LEU A 73 19.853 6.973 10.041 1.00 0.00 C ATOM 1007 O LEU A 73 19.044 6.101 9.721 1.00 0.00 O ATOM 1008 CB LEU A 73 22.259 6.761 9.512 1.00 0.00 C ATOM 1009 CG LEU A 73 23.368 6.660 8.463 1.00 0.00 C ATOM 1010 CD1 LEU A 73 22.798 6.349 7.095 1.00 0.00 C ATOM 1011 CD2 LEU A 73 24.201 7.927 8.434 1.00 0.00 C ATOM 0 H LEU A 73 21.961 9.274 9.283 1.00 0.00 H new ATOM 0 HA LEU A 73 20.721 7.155 8.056 1.00 0.00 H new ATOM 0 HB2 LEU A 73 22.655 7.304 10.370 1.00 0.00 H new ATOM 0 HB3 LEU A 73 22.025 5.753 9.853 1.00 0.00 H new ATOM 0 HG LEU A 73 24.022 5.835 8.744 1.00 0.00 H new ATOM 0 HD11 LEU A 73 23.609 6.283 6.369 1.00 0.00 H new ATOM 0 HD12 LEU A 73 22.265 5.399 7.130 1.00 0.00 H new ATOM 0 HD13 LEU A 73 22.110 7.141 6.799 1.00 0.00 H new ATOM 0 HD21 LEU A 73 24.983 7.831 7.681 1.00 0.00 H new ATOM 0 HD22 LEU A 73 23.563 8.776 8.189 1.00 0.00 H new ATOM 0 HD23 LEU A 73 24.657 8.085 9.411 1.00 0.00 H new ATOM 1023 N ARG A 74 19.840 7.601 11.209 1.00 0.00 N ATOM 1024 CA ARG A 74 18.894 7.284 12.267 1.00 0.00 C ATOM 1025 C ARG A 74 17.455 7.530 11.830 1.00 0.00 C ATOM 1026 O ARG A 74 16.557 6.751 12.158 1.00 0.00 O ATOM 1027 CB ARG A 74 19.225 8.113 13.502 1.00 0.00 C ATOM 1028 CG ARG A 74 20.566 7.750 14.117 1.00 0.00 C ATOM 1029 CD ARG A 74 21.001 8.764 15.158 1.00 0.00 C ATOM 1030 NE ARG A 74 20.043 8.884 16.259 1.00 0.00 N ATOM 1031 CZ ARG A 74 20.277 9.581 17.372 1.00 0.00 C ATOM 1032 NH1 ARG A 74 21.441 10.203 17.539 1.00 0.00 N ATOM 1033 NH2 ARG A 74 19.348 9.642 18.323 1.00 0.00 N ATOM 0 H ARG A 74 20.490 8.349 11.449 1.00 0.00 H new ATOM 0 HA ARG A 74 18.982 6.223 12.501 1.00 0.00 H new ATOM 0 HB2 ARG A 74 19.228 9.169 13.234 1.00 0.00 H new ATOM 0 HB3 ARG A 74 18.441 7.976 14.246 1.00 0.00 H new ATOM 0 HG2 ARG A 74 20.500 6.763 14.576 1.00 0.00 H new ATOM 0 HG3 ARG A 74 21.321 7.687 13.333 1.00 0.00 H new ATOM 0 HD2 ARG A 74 21.974 8.476 15.557 1.00 0.00 H new ATOM 0 HD3 ARG A 74 21.127 9.737 14.683 1.00 0.00 H new ATOM 0 HE ARG A 74 19.146 8.407 16.170 1.00 0.00 H new ATOM 0 HH11 ARG A 74 22.157 10.148 16.815 1.00 0.00 H new ATOM 0 HH12 ARG A 74 21.617 10.735 18.391 1.00 0.00 H new ATOM 0 HH21 ARG A 74 18.459 9.156 18.200 1.00 0.00 H new ATOM 0 HH22 ARG A 74 19.525 10.174 19.175 1.00 0.00 H new ATOM 1047 N ASP A 75 17.240 8.596 11.069 1.00 0.00 N ATOM 1048 CA ASP A 75 15.903 8.932 10.601 1.00 0.00 C ATOM 1049 C ASP A 75 15.474 7.959 9.517 1.00 0.00 C ATOM 1050 O ASP A 75 14.325 7.508 9.492 1.00 0.00 O ATOM 1051 CB ASP A 75 15.849 10.364 10.069 1.00 0.00 C ATOM 1052 CG ASP A 75 14.426 10.879 9.960 1.00 0.00 C ATOM 1053 OD1 ASP A 75 13.723 10.523 8.993 1.00 0.00 O ATOM 1054 OD2 ASP A 75 14.000 11.649 10.851 1.00 0.00 O ATOM 0 H ASP A 75 17.971 9.239 10.764 1.00 0.00 H new ATOM 0 HA ASP A 75 15.218 8.858 11.446 1.00 0.00 H new ATOM 0 HB2 ASP A 75 16.421 11.017 10.728 1.00 0.00 H new ATOM 0 HB3 ASP A 75 16.325 10.404 9.089 1.00 0.00 H new ATOM 1059 N ILE A 76 16.409 7.626 8.630 1.00 0.00 N ATOM 1060 CA ILE A 76 16.135 6.687 7.551 1.00 0.00 C ATOM 1061 C ILE A 76 15.788 5.330 8.147 1.00 0.00 C ATOM 1062 O ILE A 76 14.789 4.712 7.770 1.00 0.00 O ATOM 1063 CB ILE A 76 17.339 6.540 6.592 1.00 0.00 C ATOM 1064 CG1 ILE A 76 17.772 7.914 6.072 1.00 0.00 C ATOM 1065 CG2 ILE A 76 16.991 5.613 5.430 1.00 0.00 C ATOM 1066 CD1 ILE A 76 16.708 8.632 5.263 1.00 0.00 C ATOM 0 H ILE A 76 17.361 7.993 8.639 1.00 0.00 H new ATOM 0 HA ILE A 76 15.298 7.074 6.971 1.00 0.00 H new ATOM 0 HB ILE A 76 18.169 6.098 7.143 1.00 0.00 H new ATOM 0 HG12 ILE A 76 18.053 8.539 6.919 1.00 0.00 H new ATOM 0 HG13 ILE A 76 18.663 7.793 5.455 1.00 0.00 H new ATOM 0 HG21 ILE A 76 17.851 5.523 4.767 1.00 0.00 H new ATOM 0 HG22 ILE A 76 16.726 4.629 5.816 1.00 0.00 H new ATOM 0 HG23 ILE A 76 16.147 6.025 4.876 1.00 0.00 H new ATOM 0 HD11 ILE A 76 17.092 9.597 4.931 1.00 0.00 H new ATOM 0 HD12 ILE A 76 16.443 8.029 4.395 1.00 0.00 H new ATOM 0 HD13 ILE A 76 15.824 8.787 5.881 1.00 0.00 H new ATOM 1078 N GLY A 77 16.615 4.885 9.094 1.00 0.00 N ATOM 1079 CA GLY A 77 16.376 3.624 9.761 1.00 0.00 C ATOM 1080 C GLY A 77 14.999 3.561 10.391 1.00 0.00 C ATOM 1081 O GLY A 77 14.247 2.621 10.156 1.00 0.00 O ATOM 0 H GLY A 77 17.448 5.382 9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.483 2.810 9.044 1.00 0.00 H new ATOM 0 HA3 GLY A 77 17.133 3.473 10.531 1.00 0.00 H new ATOM 1085 N ARG A 78 14.655 4.581 11.163 1.00 0.00 N ATOM 1086 CA ARG A 78 13.357 4.636 11.832 1.00 0.00 C ATOM 1087 C ARG A 78 12.207 4.685 10.820 1.00 0.00 C ATOM 1088 O ARG A 78 11.157 4.082 11.032 1.00 0.00 O ATOM 1089 CB ARG A 78 13.318 5.854 12.774 1.00 0.00 C ATOM 1090 CG ARG A 78 11.954 6.141 13.397 1.00 0.00 C ATOM 1091 CD ARG A 78 11.138 7.102 12.541 1.00 0.00 C ATOM 1092 NE ARG A 78 9.775 7.268 13.041 1.00 0.00 N ATOM 1093 CZ ARG A 78 8.775 7.778 12.324 1.00 0.00 C ATOM 1094 NH1 ARG A 78 9.001 8.241 11.097 1.00 0.00 N ATOM 1095 NH2 ARG A 78 7.554 7.839 12.838 1.00 0.00 N ATOM 0 H ARG A 78 15.256 5.385 11.344 1.00 0.00 H new ATOM 0 HA ARG A 78 13.227 3.727 12.419 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.042 5.699 13.574 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.640 6.735 12.219 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.406 5.207 13.520 1.00 0.00 H new ATOM 0 HG3 ARG A 78 12.090 6.565 14.392 1.00 0.00 H new ATOM 0 HD2 ARG A 78 11.634 8.072 12.515 1.00 0.00 H new ATOM 0 HD3 ARG A 78 11.104 6.733 11.516 1.00 0.00 H new ATOM 0 HE ARG A 78 9.577 6.975 13.998 1.00 0.00 H new ATOM 0 HH11 ARG A 78 9.942 8.206 10.704 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.234 8.631 10.550 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.381 7.495 13.783 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.788 8.230 12.289 1.00 0.00 H new ATOM 1109 N ARG A 79 12.420 5.387 9.714 1.00 0.00 N ATOM 1110 CA ARG A 79 11.391 5.541 8.687 1.00 0.00 C ATOM 1111 C ARG A 79 11.121 4.243 7.921 1.00 0.00 C ATOM 1112 O ARG A 79 9.968 3.900 7.668 1.00 0.00 O ATOM 1113 CB ARG A 79 11.790 6.644 7.708 1.00 0.00 C ATOM 1114 CG ARG A 79 10.688 7.046 6.740 1.00 0.00 C ATOM 1115 CD ARG A 79 11.146 8.178 5.833 1.00 0.00 C ATOM 1116 NE ARG A 79 10.067 8.701 4.997 1.00 0.00 N ATOM 1117 CZ ARG A 79 10.085 9.915 4.442 1.00 0.00 C ATOM 1118 NH1 ARG A 79 11.121 10.725 4.635 1.00 0.00 N ATOM 1119 NH2 ARG A 79 9.064 10.318 3.696 1.00 0.00 N ATOM 0 H ARG A 79 13.298 5.861 9.503 1.00 0.00 H new ATOM 0 HA ARG A 79 10.468 5.811 9.200 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.099 7.523 8.274 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.657 6.311 7.137 1.00 0.00 H new ATOM 0 HG2 ARG A 79 10.398 6.186 6.136 1.00 0.00 H new ATOM 0 HG3 ARG A 79 9.805 7.357 7.298 1.00 0.00 H new ATOM 0 HD2 ARG A 79 11.552 8.985 6.443 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.955 7.823 5.195 1.00 0.00 H new ATOM 0 HE ARG A 79 9.256 8.106 4.828 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.907 10.420 5.209 1.00 0.00 H new ATOM 0 HH12 ARG A 79 11.130 11.652 4.209 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.266 9.700 3.547 1.00 0.00 H new ATOM 0 HH22 ARG A 79 9.077 11.245 3.272 1.00 0.00 H new ATOM 1133 N PHE A 80 12.173 3.517 7.558 1.00 0.00 N ATOM 1134 CA PHE A 80 12.003 2.285 6.788 1.00 0.00 C ATOM 1135 C PHE A 80 12.207 1.033 7.635 1.00 0.00 C ATOM 1136 O PHE A 80 12.445 -0.054 7.102 1.00 0.00 O ATOM 1137 CB PHE A 80 12.950 2.285 5.587 1.00 0.00 C ATOM 1138 CG PHE A 80 12.657 3.398 4.622 1.00 0.00 C ATOM 1139 CD1 PHE A 80 13.260 4.636 4.766 1.00 0.00 C ATOM 1140 CD2 PHE A 80 11.756 3.213 3.587 1.00 0.00 C ATOM 1141 CE1 PHE A 80 12.972 5.668 3.895 1.00 0.00 C ATOM 1142 CE2 PHE A 80 11.468 4.240 2.709 1.00 0.00 C ATOM 1143 CZ PHE A 80 12.074 5.469 2.866 1.00 0.00 C ATOM 0 H PHE A 80 13.140 3.753 7.779 1.00 0.00 H new ATOM 0 HA PHE A 80 10.972 2.260 6.436 1.00 0.00 H new ATOM 0 HB2 PHE A 80 13.978 2.375 5.939 1.00 0.00 H new ATOM 0 HB3 PHE A 80 12.873 1.329 5.068 1.00 0.00 H new ATOM 0 HD1 PHE A 80 13.964 4.796 5.569 1.00 0.00 H new ATOM 0 HD2 PHE A 80 11.273 2.255 3.465 1.00 0.00 H new ATOM 0 HE1 PHE A 80 13.449 6.629 4.019 1.00 0.00 H new ATOM 0 HE2 PHE A 80 10.769 4.081 1.901 1.00 0.00 H new ATOM 0 HZ PHE A 80 11.846 6.275 2.184 1.00 0.00 H new ATOM 1153 N ASP A 81 12.116 1.202 8.951 1.00 0.00 N ATOM 1154 CA ASP A 81 12.258 0.099 9.909 1.00 0.00 C ATOM 1155 C ASP A 81 13.559 -0.683 9.679 1.00 0.00 C ATOM 1156 O ASP A 81 13.601 -1.911 9.772 1.00 0.00 O ATOM 1157 CB ASP A 81 11.035 -0.827 9.825 1.00 0.00 C ATOM 1158 CG ASP A 81 10.914 -1.759 11.015 1.00 0.00 C ATOM 1159 OD1 ASP A 81 11.042 -1.287 12.166 1.00 0.00 O ATOM 1160 OD2 ASP A 81 10.661 -2.965 10.805 1.00 0.00 O ATOM 0 H ASP A 81 11.942 2.107 9.388 1.00 0.00 H new ATOM 0 HA ASP A 81 12.311 0.521 10.912 1.00 0.00 H new ATOM 0 HB2 ASP A 81 10.132 -0.221 9.752 1.00 0.00 H new ATOM 0 HB3 ASP A 81 11.097 -1.419 8.912 1.00 0.00 H new ATOM 1165 N CYS A 82 14.615 0.048 9.364 1.00 0.00 N ATOM 1166 CA CYS A 82 15.926 -0.528 9.125 1.00 0.00 C ATOM 1167 C CYS A 82 16.902 -0.006 10.173 1.00 0.00 C ATOM 1168 O CYS A 82 16.559 0.884 10.949 1.00 0.00 O ATOM 1169 CB CYS A 82 16.399 -0.175 7.712 1.00 0.00 C ATOM 1170 SG CYS A 82 16.132 1.546 7.238 1.00 0.00 S ATOM 0 H CYS A 82 14.586 1.063 9.267 1.00 0.00 H new ATOM 0 HA CYS A 82 15.874 -1.614 9.204 1.00 0.00 H new ATOM 0 HB2 CYS A 82 17.463 -0.399 7.633 1.00 0.00 H new ATOM 0 HB3 CYS A 82 15.884 -0.819 6.999 1.00 0.00 H new ATOM 0 HG CYS A 82 16.370 1.688 5.968 1.00 0.00 H new ATOM 1176 N ASP A 83 18.101 -0.560 10.230 1.00 0.00 N ATOM 1177 CA ASP A 83 19.074 -0.092 11.206 1.00 0.00 C ATOM 1178 C ASP A 83 20.002 0.919 10.574 1.00 0.00 C ATOM 1179 O ASP A 83 20.644 0.635 9.562 1.00 0.00 O ATOM 1180 CB ASP A 83 19.911 -1.230 11.783 1.00 0.00 C ATOM 1181 CG ASP A 83 20.501 -0.855 13.124 1.00 0.00 C ATOM 1182 OD1 ASP A 83 21.427 -0.021 13.158 1.00 0.00 O ATOM 1183 OD2 ASP A 83 20.023 -1.381 14.152 1.00 0.00 O ATOM 0 H ASP A 83 18.421 -1.318 9.627 1.00 0.00 H new ATOM 0 HA ASP A 83 18.509 0.363 12.019 1.00 0.00 H new ATOM 0 HB2 ASP A 83 19.292 -2.120 11.892 1.00 0.00 H new ATOM 0 HB3 ASP A 83 20.712 -1.483 11.089 1.00 0.00 H new ATOM 1188 N PHE A 84 20.065 2.094 11.189 1.00 0.00 N ATOM 1189 CA PHE A 84 20.913 3.189 10.740 1.00 0.00 C ATOM 1190 C PHE A 84 22.363 2.736 10.554 1.00 0.00 C ATOM 1191 O PHE A 84 23.093 3.275 9.727 1.00 0.00 O ATOM 1192 CB PHE A 84 20.844 4.339 11.752 1.00 0.00 C ATOM 1193 CG PHE A 84 20.808 3.903 13.194 1.00 0.00 C ATOM 1194 CD1 PHE A 84 21.976 3.635 13.889 1.00 0.00 C ATOM 1195 CD2 PHE A 84 19.598 3.769 13.857 1.00 0.00 C ATOM 1196 CE1 PHE A 84 21.938 3.241 15.213 1.00 0.00 C ATOM 1197 CE2 PHE A 84 19.553 3.375 15.180 1.00 0.00 C ATOM 1198 CZ PHE A 84 20.725 3.111 15.859 1.00 0.00 C ATOM 0 H PHE A 84 19.522 2.315 12.024 1.00 0.00 H new ATOM 0 HA PHE A 84 20.547 3.530 9.772 1.00 0.00 H new ATOM 0 HB2 PHE A 84 21.707 4.989 11.604 1.00 0.00 H new ATOM 0 HB3 PHE A 84 19.956 4.936 11.544 1.00 0.00 H new ATOM 0 HD1 PHE A 84 22.928 3.735 13.390 1.00 0.00 H new ATOM 0 HD2 PHE A 84 18.677 3.976 13.332 1.00 0.00 H new ATOM 0 HE1 PHE A 84 22.857 3.035 15.742 1.00 0.00 H new ATOM 0 HE2 PHE A 84 18.602 3.274 15.682 1.00 0.00 H new ATOM 0 HZ PHE A 84 20.693 2.803 16.894 1.00 0.00 H new ATOM 1208 N HIS A 85 22.761 1.744 11.338 1.00 0.00 N ATOM 1209 CA HIS A 85 24.106 1.184 11.280 1.00 0.00 C ATOM 1210 C HIS A 85 24.311 0.429 9.975 1.00 0.00 C ATOM 1211 O HIS A 85 25.358 0.539 9.342 1.00 0.00 O ATOM 1212 CB HIS A 85 24.331 0.218 12.441 1.00 0.00 C ATOM 1213 CG HIS A 85 25.777 -0.035 12.746 1.00 0.00 C ATOM 1214 ND1 HIS A 85 26.446 -1.172 12.346 1.00 0.00 N ATOM 1215 CD2 HIS A 85 26.684 0.713 13.415 1.00 0.00 C ATOM 1216 CE1 HIS A 85 27.699 -1.114 12.759 1.00 0.00 C ATOM 1217 NE2 HIS A 85 27.867 0.024 13.406 1.00 0.00 N ATOM 0 H HIS A 85 22.160 1.303 12.034 1.00 0.00 H new ATOM 0 HA HIS A 85 24.815 2.009 11.344 1.00 0.00 H new ATOM 0 HB2 HIS A 85 23.846 0.616 13.332 1.00 0.00 H new ATOM 0 HB3 HIS A 85 23.846 -0.731 12.211 1.00 0.00 H new ATOM 0 HD2 HIS A 85 26.508 1.676 13.872 1.00 0.00 H new ATOM 0 HE1 HIS A 85 28.455 -1.867 12.596 1.00 0.00 H new ATOM 0 HE2 HIS A 85 28.739 0.340 13.831 1.00 0.00 H new ATOM 1226 N GLU A 86 23.303 -0.348 9.594 1.00 0.00 N ATOM 1227 CA GLU A 86 23.352 -1.129 8.367 1.00 0.00 C ATOM 1228 C GLU A 86 23.396 -0.188 7.180 1.00 0.00 C ATOM 1229 O GLU A 86 24.203 -0.356 6.273 1.00 0.00 O ATOM 1230 CB GLU A 86 22.130 -2.045 8.275 1.00 0.00 C ATOM 1231 CG GLU A 86 22.294 -3.188 7.289 1.00 0.00 C ATOM 1232 CD GLU A 86 23.447 -4.101 7.645 1.00 0.00 C ATOM 1233 OE1 GLU A 86 23.446 -4.662 8.764 1.00 0.00 O ATOM 1234 OE2 GLU A 86 24.353 -4.274 6.806 1.00 0.00 O ATOM 0 H GLU A 86 22.437 -0.453 10.123 1.00 0.00 H new ATOM 0 HA GLU A 86 24.247 -1.752 8.367 1.00 0.00 H new ATOM 0 HB2 GLU A 86 21.921 -2.456 9.262 1.00 0.00 H new ATOM 0 HB3 GLU A 86 21.263 -1.451 7.987 1.00 0.00 H new ATOM 0 HG2 GLU A 86 21.372 -3.769 7.255 1.00 0.00 H new ATOM 0 HG3 GLU A 86 22.452 -2.782 6.290 1.00 0.00 H new ATOM 1241 N ILE A 87 22.537 0.821 7.221 1.00 0.00 N ATOM 1242 CA ILE A 87 22.470 1.826 6.170 1.00 0.00 C ATOM 1243 C ILE A 87 23.850 2.441 5.977 1.00 0.00 C ATOM 1244 O ILE A 87 24.337 2.591 4.851 1.00 0.00 O ATOM 1245 CB ILE A 87 21.485 2.953 6.522 1.00 0.00 C ATOM 1246 CG1 ILE A 87 20.242 2.396 7.221 1.00 0.00 C ATOM 1247 CG2 ILE A 87 21.086 3.701 5.263 1.00 0.00 C ATOM 1248 CD1 ILE A 87 19.207 3.445 7.544 1.00 0.00 C ATOM 0 H ILE A 87 21.870 0.965 7.979 1.00 0.00 H new ATOM 0 HA ILE A 87 22.126 1.333 5.260 1.00 0.00 H new ATOM 0 HB ILE A 87 21.980 3.641 7.208 1.00 0.00 H new ATOM 0 HG12 ILE A 87 19.789 1.635 6.586 1.00 0.00 H new ATOM 0 HG13 ILE A 87 20.546 1.902 8.144 1.00 0.00 H new ATOM 0 HG21 ILE A 87 20.388 4.498 5.519 1.00 0.00 H new ATOM 0 HG22 ILE A 87 21.973 4.131 4.799 1.00 0.00 H new ATOM 0 HG23 ILE A 87 20.610 3.012 4.566 1.00 0.00 H new ATOM 0 HD11 ILE A 87 18.356 2.976 8.038 1.00 0.00 H new ATOM 0 HD12 ILE A 87 19.642 4.194 8.205 1.00 0.00 H new ATOM 0 HD13 ILE A 87 18.874 3.923 6.623 1.00 0.00 H new ATOM 1260 N ALA A 88 24.470 2.786 7.100 1.00 0.00 N ATOM 1261 CA ALA A 88 25.799 3.348 7.110 1.00 0.00 C ATOM 1262 C ALA A 88 26.816 2.352 6.554 1.00 0.00 C ATOM 1263 O ALA A 88 27.591 2.690 5.664 1.00 0.00 O ATOM 1264 CB ALA A 88 26.155 3.729 8.531 1.00 0.00 C ATOM 0 H ALA A 88 24.057 2.680 8.027 1.00 0.00 H new ATOM 0 HA ALA A 88 25.822 4.233 6.474 1.00 0.00 H new ATOM 0 HB1 ALA A 88 27.158 4.155 8.553 1.00 0.00 H new ATOM 0 HB2 ALA A 88 25.440 4.464 8.901 1.00 0.00 H new ATOM 0 HB3 ALA A 88 26.124 2.842 9.164 1.00 0.00 H new ATOM 1270 N ARG A 89 26.787 1.123 7.064 1.00 0.00 N ATOM 1271 CA ARG A 89 27.706 0.070 6.626 1.00 0.00 C ATOM 1272 C ARG A 89 27.642 -0.157 5.115 1.00 0.00 C ATOM 1273 O ARG A 89 28.667 -0.359 4.464 1.00 0.00 O ATOM 1274 CB ARG A 89 27.393 -1.242 7.352 1.00 0.00 C ATOM 1275 CG ARG A 89 28.182 -1.449 8.637 1.00 0.00 C ATOM 1276 CD ARG A 89 29.584 -1.979 8.358 1.00 0.00 C ATOM 1277 NE ARG A 89 30.351 -1.093 7.484 1.00 0.00 N ATOM 1278 CZ ARG A 89 31.116 -1.511 6.474 1.00 0.00 C ATOM 1279 NH1 ARG A 89 31.265 -2.809 6.238 1.00 0.00 N ATOM 1280 NH2 ARG A 89 31.738 -0.625 5.710 1.00 0.00 N ATOM 0 H ARG A 89 26.131 0.828 7.788 1.00 0.00 H new ATOM 0 HA ARG A 89 28.715 0.400 6.874 1.00 0.00 H new ATOM 0 HB2 ARG A 89 26.328 -1.270 7.584 1.00 0.00 H new ATOM 0 HB3 ARG A 89 27.594 -2.074 6.677 1.00 0.00 H new ATOM 0 HG2 ARG A 89 28.251 -0.505 9.178 1.00 0.00 H new ATOM 0 HG3 ARG A 89 27.650 -2.148 9.282 1.00 0.00 H new ATOM 0 HD2 ARG A 89 30.116 -2.105 9.301 1.00 0.00 H new ATOM 0 HD3 ARG A 89 29.512 -2.965 7.899 1.00 0.00 H new ATOM 0 HE ARG A 89 30.298 -0.089 7.658 1.00 0.00 H new ATOM 0 HH11 ARG A 89 30.793 -3.492 6.830 1.00 0.00 H new ATOM 0 HH12 ARG A 89 31.851 -3.123 5.464 1.00 0.00 H new ATOM 0 HH21 ARG A 89 31.631 0.372 5.895 1.00 0.00 H new ATOM 0 HH22 ARG A 89 32.324 -0.940 4.937 1.00 0.00 H new ATOM 1294 N ARG A 90 26.438 -0.107 4.567 1.00 0.00 N ATOM 1295 CA ARG A 90 26.231 -0.325 3.140 1.00 0.00 C ATOM 1296 C ARG A 90 26.785 0.828 2.307 1.00 0.00 C ATOM 1297 O ARG A 90 27.213 0.634 1.169 1.00 0.00 O ATOM 1298 CB ARG A 90 24.742 -0.513 2.862 1.00 0.00 C ATOM 1299 CG ARG A 90 24.125 -1.644 3.662 1.00 0.00 C ATOM 1300 CD ARG A 90 24.780 -2.976 3.328 1.00 0.00 C ATOM 1301 NE ARG A 90 24.238 -4.079 4.118 1.00 0.00 N ATOM 1302 CZ ARG A 90 23.765 -5.208 3.591 1.00 0.00 C ATOM 1303 NH1 ARG A 90 23.736 -5.371 2.272 1.00 0.00 N ATOM 1304 NH2 ARG A 90 23.327 -6.178 4.382 1.00 0.00 N ATOM 0 H ARG A 90 25.584 0.084 5.091 1.00 0.00 H new ATOM 0 HA ARG A 90 26.773 -1.225 2.851 1.00 0.00 H new ATOM 0 HB2 ARG A 90 24.216 0.414 3.090 1.00 0.00 H new ATOM 0 HB3 ARG A 90 24.599 -0.708 1.799 1.00 0.00 H new ATOM 0 HG2 ARG A 90 24.232 -1.440 4.727 1.00 0.00 H new ATOM 0 HG3 ARG A 90 23.056 -1.699 3.454 1.00 0.00 H new ATOM 0 HD2 ARG A 90 24.641 -3.190 2.268 1.00 0.00 H new ATOM 0 HD3 ARG A 90 25.854 -2.903 3.501 1.00 0.00 H new ATOM 0 HE ARG A 90 24.221 -3.979 5.133 1.00 0.00 H new ATOM 0 HH11 ARG A 90 24.077 -4.630 1.659 1.00 0.00 H new ATOM 0 HH12 ARG A 90 23.373 -6.237 1.873 1.00 0.00 H new ATOM 0 HH21 ARG A 90 23.352 -6.060 5.395 1.00 0.00 H new ATOM 0 HH22 ARG A 90 22.965 -7.042 3.978 1.00 0.00 H new ATOM 1318 N ASN A 91 26.761 2.026 2.872 1.00 0.00 N ATOM 1319 CA ASN A 91 27.274 3.211 2.177 1.00 0.00 C ATOM 1320 C ASN A 91 28.725 3.499 2.573 1.00 0.00 C ATOM 1321 O ASN A 91 29.340 4.442 2.076 1.00 0.00 O ATOM 1322 CB ASN A 91 26.407 4.444 2.452 1.00 0.00 C ATOM 1323 CG ASN A 91 26.708 5.584 1.486 1.00 0.00 C ATOM 1324 OD1 ASN A 91 26.615 6.817 1.960 1.00 0.00 O flip ATOM 1325 ND2 ASN A 91 27.027 5.355 0.320 1.00 0.00 N flip ATOM 0 H ASN A 91 26.395 2.209 3.806 1.00 0.00 H new ATOM 0 HA ASN A 91 27.237 2.995 1.109 1.00 0.00 H new ATOM 0 HB2 ASN A 91 25.355 4.171 2.374 1.00 0.00 H new ATOM 0 HB3 ASN A 91 26.573 4.783 3.475 1.00 0.00 H new ATOM 0 HD21 ASN A 91 27.089 4.393 -0.012 1.00 0.00 H new ATOM 0 HD22 ASN A 91 27.229 6.128 -0.314 1.00 0.00 H new ATOM 1332 N ASN A 92 29.240 2.707 3.510 1.00 0.00 N ATOM 1333 CA ASN A 92 30.614 2.850 4.010 1.00 0.00 C ATOM 1334 C ASN A 92 30.733 4.052 4.939 1.00 0.00 C ATOM 1335 O ASN A 92 31.830 4.544 5.203 1.00 0.00 O ATOM 1336 CB ASN A 92 31.642 2.949 2.871 1.00 0.00 C ATOM 1337 CG ASN A 92 31.879 1.622 2.179 1.00 0.00 C ATOM 1338 OD1 ASN A 92 32.706 0.824 2.621 1.00 0.00 O ATOM 1339 ND2 ASN A 92 31.190 1.389 1.071 1.00 0.00 N ATOM 0 H ASN A 92 28.720 1.946 3.947 1.00 0.00 H new ATOM 0 HA ASN A 92 30.840 1.945 4.574 1.00 0.00 H new ATOM 0 HB2 ASN A 92 31.297 3.679 2.139 1.00 0.00 H new ATOM 0 HB3 ASN A 92 32.586 3.319 3.271 1.00 0.00 H new ATOM 0 HD21 ASN A 92 31.336 0.523 0.552 1.00 0.00 H new ATOM 0 HD22 ASN A 92 30.513 2.076 0.737 1.00 0.00 H new ATOM 1346 N ILE A 93 29.595 4.519 5.427 1.00 0.00 N ATOM 1347 CA ILE A 93 29.548 5.643 6.349 1.00 0.00 C ATOM 1348 C ILE A 93 29.248 5.128 7.750 1.00 0.00 C ATOM 1349 O ILE A 93 29.135 3.919 7.953 1.00 0.00 O ATOM 1350 CB ILE A 93 28.475 6.671 5.929 1.00 0.00 C ATOM 1351 CG1 ILE A 93 27.082 6.028 5.902 1.00 0.00 C ATOM 1352 CG2 ILE A 93 28.824 7.277 4.577 1.00 0.00 C ATOM 1353 CD1 ILE A 93 26.001 6.932 5.356 1.00 0.00 C ATOM 0 H ILE A 93 28.680 4.131 5.196 1.00 0.00 H new ATOM 0 HA ILE A 93 30.516 6.144 6.333 1.00 0.00 H new ATOM 0 HB ILE A 93 28.456 7.472 6.668 1.00 0.00 H new ATOM 0 HG12 ILE A 93 27.123 5.121 5.299 1.00 0.00 H new ATOM 0 HG13 ILE A 93 26.812 5.726 6.914 1.00 0.00 H new ATOM 0 HG21 ILE A 93 28.059 8.000 4.294 1.00 0.00 H new ATOM 0 HG22 ILE A 93 29.790 7.778 4.641 1.00 0.00 H new ATOM 0 HG23 ILE A 93 28.873 6.488 3.826 1.00 0.00 H new ATOM 0 HD11 ILE A 93 25.046 6.406 5.369 1.00 0.00 H new ATOM 0 HD12 ILE A 93 25.930 7.828 5.972 1.00 0.00 H new ATOM 0 HD13 ILE A 93 26.246 7.214 4.332 1.00 0.00 H new ATOM 1365 N GLN A 94 29.164 6.023 8.721 1.00 0.00 N ATOM 1366 CA GLN A 94 28.845 5.627 10.086 1.00 0.00 C ATOM 1367 C GLN A 94 27.403 6.000 10.401 1.00 0.00 C ATOM 1368 O GLN A 94 26.806 6.797 9.688 1.00 0.00 O ATOM 1369 CB GLN A 94 29.790 6.277 11.107 1.00 0.00 C ATOM 1370 CG GLN A 94 31.186 5.661 11.169 1.00 0.00 C ATOM 1371 CD GLN A 94 32.065 6.012 9.983 1.00 0.00 C ATOM 1372 OE1 GLN A 94 32.752 7.033 9.990 1.00 0.00 O ATOM 1373 NE2 GLN A 94 32.078 5.155 8.973 1.00 0.00 N ATOM 0 H GLN A 94 29.311 7.024 8.592 1.00 0.00 H new ATOM 0 HA GLN A 94 28.975 4.547 10.161 1.00 0.00 H new ATOM 0 HB2 GLN A 94 29.886 7.336 10.869 1.00 0.00 H new ATOM 0 HB3 GLN A 94 29.335 6.212 12.095 1.00 0.00 H new ATOM 0 HG2 GLN A 94 31.678 5.991 12.084 1.00 0.00 H new ATOM 0 HG3 GLN A 94 31.092 4.577 11.231 1.00 0.00 H new ATOM 0 HE21 GLN A 94 31.494 4.320 9.005 1.00 0.00 H new ATOM 0 HE22 GLN A 94 32.672 5.330 8.163 1.00 0.00 H new ATOM 1382 N ASN A 95 26.824 5.402 11.428 1.00 0.00 N ATOM 1383 CA ASN A 95 25.448 5.725 11.797 1.00 0.00 C ATOM 1384 C ASN A 95 25.354 7.222 12.151 1.00 0.00 C ATOM 1385 O ASN A 95 24.680 8.019 11.474 1.00 0.00 O ATOM 1386 CB ASN A 95 24.962 4.850 12.970 1.00 0.00 C ATOM 1387 CG ASN A 95 25.848 4.909 14.209 1.00 0.00 C ATOM 1388 OD1 ASN A 95 27.061 5.082 14.120 1.00 0.00 O ATOM 1389 ND2 ASN A 95 25.242 4.780 15.377 1.00 0.00 N ATOM 0 H ASN A 95 27.273 4.700 12.016 1.00 0.00 H new ATOM 0 HA ASN A 95 24.797 5.515 10.948 1.00 0.00 H new ATOM 0 HB2 ASN A 95 23.953 5.159 13.244 1.00 0.00 H new ATOM 0 HB3 ASN A 95 24.898 3.815 12.633 1.00 0.00 H new ATOM 0 HD21 ASN A 95 25.784 4.823 16.240 1.00 0.00 H new ATOM 0 HD22 ASN A 95 24.233 4.637 15.415 1.00 0.00 H new ATOM 1396 N GLU A 96 26.125 7.617 13.157 1.00 0.00 N ATOM 1397 CA GLU A 96 26.154 8.995 13.625 1.00 0.00 C ATOM 1398 C GLU A 96 26.951 9.876 12.658 1.00 0.00 C ATOM 1399 O GLU A 96 27.303 11.008 12.984 1.00 0.00 O ATOM 1400 CB GLU A 96 26.769 9.061 15.022 1.00 0.00 C ATOM 1401 CG GLU A 96 26.129 10.107 15.922 1.00 0.00 C ATOM 1402 CD GLU A 96 24.699 9.759 16.287 1.00 0.00 C ATOM 1403 OE1 GLU A 96 24.486 8.713 16.932 1.00 0.00 O ATOM 1404 OE2 GLU A 96 23.779 10.533 15.938 1.00 0.00 O ATOM 0 H GLU A 96 26.746 6.991 13.670 1.00 0.00 H new ATOM 0 HA GLU A 96 25.130 9.367 13.669 1.00 0.00 H new ATOM 0 HB2 GLU A 96 26.680 8.083 15.495 1.00 0.00 H new ATOM 0 HB3 GLU A 96 27.834 9.275 14.931 1.00 0.00 H new ATOM 0 HG2 GLU A 96 26.719 10.209 16.833 1.00 0.00 H new ATOM 0 HG3 GLU A 96 26.148 11.075 15.420 1.00 0.00 H new ATOM 1411 N ASP A 97 27.249 9.339 11.480 1.00 0.00 N ATOM 1412 CA ASP A 97 27.990 10.071 10.461 1.00 0.00 C ATOM 1413 C ASP A 97 27.188 11.268 10.012 1.00 0.00 C ATOM 1414 O ASP A 97 27.748 12.328 9.732 1.00 0.00 O ATOM 1415 CB ASP A 97 28.224 9.207 9.226 1.00 0.00 C ATOM 1416 CG ASP A 97 29.480 9.581 8.468 1.00 0.00 C ATOM 1417 OD1 ASP A 97 29.534 10.687 7.896 1.00 0.00 O ATOM 1418 OD2 ASP A 97 30.420 8.763 8.438 1.00 0.00 O ATOM 0 H ASP A 97 26.986 8.392 11.207 1.00 0.00 H new ATOM 0 HA ASP A 97 28.943 10.367 10.899 1.00 0.00 H new ATOM 0 HB2 ASP A 97 28.287 8.162 9.528 1.00 0.00 H new ATOM 0 HB3 ASP A 97 27.365 9.295 8.560 1.00 0.00 H new ATOM 1423 N LEU A 98 25.868 11.083 9.967 1.00 0.00 N ATOM 1424 CA LEU A 98 24.959 12.126 9.490 1.00 0.00 C ATOM 1425 C LEU A 98 25.101 12.266 7.977 1.00 0.00 C ATOM 1426 O LEU A 98 26.162 12.614 7.458 1.00 0.00 O ATOM 1427 CB LEU A 98 25.192 13.475 10.183 1.00 0.00 C ATOM 1428 CG LEU A 98 24.360 13.711 11.445 1.00 0.00 C ATOM 1429 CD1 LEU A 98 24.713 12.715 12.537 1.00 0.00 C ATOM 1430 CD2 LEU A 98 24.557 15.132 11.934 1.00 0.00 C ATOM 0 H LEU A 98 25.405 10.221 10.255 1.00 0.00 H new ATOM 0 HA LEU A 98 23.943 11.823 9.741 1.00 0.00 H new ATOM 0 HB2 LEU A 98 26.248 13.554 10.443 1.00 0.00 H new ATOM 0 HB3 LEU A 98 24.978 14.273 9.472 1.00 0.00 H new ATOM 0 HG LEU A 98 23.310 13.563 11.194 1.00 0.00 H new ATOM 0 HD11 LEU A 98 24.104 12.911 13.419 1.00 0.00 H new ATOM 0 HD12 LEU A 98 24.522 11.702 12.182 1.00 0.00 H new ATOM 0 HD13 LEU A 98 25.767 12.816 12.795 1.00 0.00 H new ATOM 0 HD21 LEU A 98 23.962 15.293 12.833 1.00 0.00 H new ATOM 0 HD22 LEU A 98 25.610 15.296 12.162 1.00 0.00 H new ATOM 0 HD23 LEU A 98 24.241 15.831 11.159 1.00 0.00 H new ATOM 1442 N ILE A 99 24.019 11.985 7.289 1.00 0.00 N ATOM 1443 CA ILE A 99 23.975 12.026 5.833 1.00 0.00 C ATOM 1444 C ILE A 99 23.439 13.357 5.317 1.00 0.00 C ATOM 1445 O ILE A 99 23.079 14.240 6.097 1.00 0.00 O ATOM 1446 CB ILE A 99 23.094 10.877 5.312 1.00 0.00 C ATOM 1447 CG1 ILE A 99 21.722 10.918 5.990 1.00 0.00 C ATOM 1448 CG2 ILE A 99 23.778 9.544 5.562 1.00 0.00 C ATOM 1449 CD1 ILE A 99 20.852 9.722 5.694 1.00 0.00 C ATOM 0 H ILE A 99 23.134 11.719 7.721 1.00 0.00 H new ATOM 0 HA ILE A 99 24.995 11.914 5.465 1.00 0.00 H new ATOM 0 HB ILE A 99 22.950 10.995 4.238 1.00 0.00 H new ATOM 0 HG12 ILE A 99 21.864 10.993 7.068 1.00 0.00 H new ATOM 0 HG13 ILE A 99 21.199 11.821 5.674 1.00 0.00 H new ATOM 0 HG21 ILE A 99 23.148 8.736 5.190 1.00 0.00 H new ATOM 0 HG22 ILE A 99 24.737 9.524 5.044 1.00 0.00 H new ATOM 0 HG23 ILE A 99 23.941 9.414 6.632 1.00 0.00 H new ATOM 0 HD11 ILE A 99 19.899 9.829 6.212 1.00 0.00 H new ATOM 0 HD12 ILE A 99 20.677 9.656 4.620 1.00 0.00 H new ATOM 0 HD13 ILE A 99 21.351 8.815 6.036 1.00 0.00 H new ATOM 1461 N TYR A 100 23.385 13.488 3.996 1.00 0.00 N ATOM 1462 CA TYR A 100 22.918 14.713 3.356 1.00 0.00 C ATOM 1463 C TYR A 100 21.767 14.418 2.399 1.00 0.00 C ATOM 1464 O TYR A 100 21.618 13.295 1.918 1.00 0.00 O ATOM 1465 CB TYR A 100 24.064 15.380 2.589 1.00 0.00 C ATOM 1466 CG TYR A 100 25.267 15.725 3.440 1.00 0.00 C ATOM 1467 CD1 TYR A 100 25.292 16.885 4.204 1.00 0.00 C ATOM 1468 CD2 TYR A 100 26.380 14.895 3.472 1.00 0.00 C ATOM 1469 CE1 TYR A 100 26.390 17.205 4.978 1.00 0.00 C ATOM 1470 CE2 TYR A 100 27.482 15.208 4.243 1.00 0.00 C ATOM 1471 CZ TYR A 100 27.483 16.364 4.993 1.00 0.00 C ATOM 1472 OH TYR A 100 28.581 16.680 5.762 1.00 0.00 O ATOM 0 H TYR A 100 23.661 12.755 3.343 1.00 0.00 H new ATOM 0 HA TYR A 100 22.563 15.388 4.135 1.00 0.00 H new ATOM 0 HB2 TYR A 100 24.381 14.717 1.784 1.00 0.00 H new ATOM 0 HB3 TYR A 100 23.691 16.291 2.122 1.00 0.00 H new ATOM 0 HD1 TYR A 100 24.439 17.547 4.192 1.00 0.00 H new ATOM 0 HD2 TYR A 100 26.384 13.989 2.884 1.00 0.00 H new ATOM 0 HE1 TYR A 100 26.393 18.109 5.569 1.00 0.00 H new ATOM 0 HE2 TYR A 100 28.339 14.550 4.258 1.00 0.00 H new ATOM 0 HH TYR A 100 29.263 15.983 5.661 1.00 0.00 H new ATOM 1482 N PRO A 101 20.948 15.439 2.101 1.00 0.00 N ATOM 1483 CA PRO A 101 19.793 15.307 1.209 1.00 0.00 C ATOM 1484 C PRO A 101 20.184 15.157 -0.253 1.00 0.00 C ATOM 1485 O PRO A 101 21.002 15.916 -0.774 1.00 0.00 O ATOM 1486 CB PRO A 101 19.031 16.610 1.414 1.00 0.00 C ATOM 1487 CG PRO A 101 20.053 17.594 1.867 1.00 0.00 C ATOM 1488 CD PRO A 101 21.092 16.809 2.618 1.00 0.00 C ATOM 0 HA PRO A 101 19.216 14.411 1.440 1.00 0.00 H new ATOM 0 HB2 PRO A 101 18.553 16.936 0.490 1.00 0.00 H new ATOM 0 HB3 PRO A 101 18.242 16.492 2.157 1.00 0.00 H new ATOM 0 HG2 PRO A 101 20.497 18.113 1.017 1.00 0.00 H new ATOM 0 HG3 PRO A 101 19.604 18.355 2.506 1.00 0.00 H new ATOM 0 HD2 PRO A 101 22.094 17.200 2.439 1.00 0.00 H new ATOM 0 HD3 PRO A 101 20.922 16.849 3.694 1.00 0.00 H new ATOM 1496 N GLY A 102 19.590 14.177 -0.910 1.00 0.00 N ATOM 1497 CA GLY A 102 19.878 13.935 -2.302 1.00 0.00 C ATOM 1498 C GLY A 102 20.876 12.824 -2.432 1.00 0.00 C ATOM 1499 O GLY A 102 21.532 12.677 -3.462 1.00 0.00 O ATOM 0 H GLY A 102 18.908 13.540 -0.499 1.00 0.00 H new ATOM 0 HA2 GLY A 102 18.961 13.676 -2.832 1.00 0.00 H new ATOM 0 HA3 GLY A 102 20.268 14.842 -2.764 1.00 0.00 H new ATOM 1503 N GLN A 103 20.995 12.045 -1.370 1.00 0.00 N ATOM 1504 CA GLN A 103 21.934 10.934 -1.341 1.00 0.00 C ATOM 1505 C GLN A 103 21.179 9.621 -1.472 1.00 0.00 C ATOM 1506 O GLN A 103 19.988 9.575 -1.238 1.00 0.00 O ATOM 1507 CB GLN A 103 22.741 10.980 -0.034 1.00 0.00 C ATOM 1508 CG GLN A 103 23.742 9.849 0.132 1.00 0.00 C ATOM 1509 CD GLN A 103 24.690 10.079 1.291 1.00 0.00 C ATOM 1510 OE1 GLN A 103 24.404 9.706 2.424 1.00 0.00 O ATOM 1511 NE2 GLN A 103 25.833 10.679 1.006 1.00 0.00 N ATOM 0 H GLN A 103 20.452 12.161 -0.514 1.00 0.00 H new ATOM 0 HA GLN A 103 22.628 11.013 -2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 103 23.274 11.929 0.015 1.00 0.00 H new ATOM 0 HB3 GLN A 103 22.047 10.960 0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 103 23.205 8.913 0.286 1.00 0.00 H new ATOM 0 HG3 GLN A 103 24.317 9.739 -0.787 1.00 0.00 H new ATOM 0 HE21 GLN A 103 26.030 10.973 0.049 1.00 0.00 H new ATOM 0 HE22 GLN A 103 26.518 10.848 1.743 1.00 0.00 H new ATOM 1520 N VAL A 104 21.849 8.568 -1.889 1.00 0.00 N ATOM 1521 CA VAL A 104 21.209 7.273 -2.019 1.00 0.00 C ATOM 1522 C VAL A 104 21.896 6.265 -1.103 1.00 0.00 C ATOM 1523 O VAL A 104 23.090 5.998 -1.238 1.00 0.00 O ATOM 1524 CB VAL A 104 21.244 6.762 -3.478 1.00 0.00 C ATOM 1525 CG1 VAL A 104 20.590 5.392 -3.594 1.00 0.00 C ATOM 1526 CG2 VAL A 104 20.569 7.755 -4.416 1.00 0.00 C ATOM 0 H VAL A 104 22.836 8.581 -2.144 1.00 0.00 H new ATOM 0 HA VAL A 104 20.164 7.385 -1.729 1.00 0.00 H new ATOM 0 HB VAL A 104 22.289 6.666 -3.772 1.00 0.00 H new ATOM 0 HG11 VAL A 104 20.629 5.057 -4.631 1.00 0.00 H new ATOM 0 HG12 VAL A 104 21.122 4.680 -2.963 1.00 0.00 H new ATOM 0 HG13 VAL A 104 19.551 5.457 -3.272 1.00 0.00 H new ATOM 0 HG21 VAL A 104 20.606 7.374 -5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 104 19.530 7.890 -4.116 1.00 0.00 H new ATOM 0 HG23 VAL A 104 21.088 8.712 -4.367 1.00 0.00 H new ATOM 1536 N LEU A 105 21.137 5.726 -0.167 1.00 0.00 N ATOM 1537 CA LEU A 105 21.657 4.761 0.791 1.00 0.00 C ATOM 1538 C LEU A 105 21.050 3.387 0.565 1.00 0.00 C ATOM 1539 O LEU A 105 19.918 3.268 0.102 1.00 0.00 O ATOM 1540 CB LEU A 105 21.345 5.212 2.213 1.00 0.00 C ATOM 1541 CG LEU A 105 21.949 6.550 2.618 1.00 0.00 C ATOM 1542 CD1 LEU A 105 21.510 6.911 4.020 1.00 0.00 C ATOM 1543 CD2 LEU A 105 23.462 6.503 2.535 1.00 0.00 C ATOM 0 H LEU A 105 20.147 5.942 -0.047 1.00 0.00 H new ATOM 0 HA LEU A 105 22.736 4.700 0.649 1.00 0.00 H new ATOM 0 HB2 LEU A 105 20.263 5.270 2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 105 21.699 4.448 2.905 1.00 0.00 H new ATOM 0 HG LEU A 105 21.594 7.315 1.927 1.00 0.00 H new ATOM 0 HD11 LEU A 105 21.946 7.869 4.302 1.00 0.00 H new ATOM 0 HD12 LEU A 105 20.423 6.983 4.054 1.00 0.00 H new ATOM 0 HD13 LEU A 105 21.844 6.141 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 105 23.873 7.469 2.829 1.00 0.00 H new ATOM 0 HD22 LEU A 105 23.839 5.730 3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 105 23.763 6.276 1.512 1.00 0.00 H new ATOM 1555 N GLN A 106 21.804 2.352 0.898 1.00 0.00 N ATOM 1556 CA GLN A 106 21.323 0.995 0.745 1.00 0.00 C ATOM 1557 C GLN A 106 20.630 0.522 2.002 1.00 0.00 C ATOM 1558 O GLN A 106 21.247 0.335 3.052 1.00 0.00 O ATOM 1559 CB GLN A 106 22.461 0.051 0.367 1.00 0.00 C ATOM 1560 CG GLN A 106 23.112 0.412 -0.950 1.00 0.00 C ATOM 1561 CD GLN A 106 24.027 -0.681 -1.470 1.00 0.00 C ATOM 1562 OE1 GLN A 106 23.590 -1.583 -2.189 1.00 0.00 O ATOM 1563 NE2 GLN A 106 25.303 -0.607 -1.118 1.00 0.00 N ATOM 0 H GLN A 106 22.749 2.428 1.275 1.00 0.00 H new ATOM 0 HA GLN A 106 20.595 0.988 -0.066 1.00 0.00 H new ATOM 0 HB2 GLN A 106 23.214 0.064 1.155 1.00 0.00 H new ATOM 0 HB3 GLN A 106 22.078 -0.968 0.310 1.00 0.00 H new ATOM 0 HG2 GLN A 106 22.338 0.614 -1.690 1.00 0.00 H new ATOM 0 HG3 GLN A 106 23.684 1.332 -0.828 1.00 0.00 H new ATOM 0 HE21 GLN A 106 25.624 0.156 -0.522 1.00 0.00 H new ATOM 0 HE22 GLN A 106 25.964 -1.313 -1.444 1.00 0.00 H new ATOM 1572 N VAL A 107 19.333 0.347 1.874 1.00 0.00 N ATOM 1573 CA VAL A 107 18.495 -0.108 2.961 1.00 0.00 C ATOM 1574 C VAL A 107 17.825 -1.424 2.575 1.00 0.00 C ATOM 1575 O VAL A 107 17.583 -1.681 1.405 1.00 0.00 O ATOM 1576 CB VAL A 107 17.427 0.930 3.347 1.00 0.00 C ATOM 1577 CG1 VAL A 107 18.072 2.181 3.917 1.00 0.00 C ATOM 1578 CG2 VAL A 107 16.555 1.272 2.154 1.00 0.00 C ATOM 0 H VAL A 107 18.826 0.518 1.005 1.00 0.00 H new ATOM 0 HA VAL A 107 19.134 -0.255 3.832 1.00 0.00 H new ATOM 0 HB VAL A 107 16.793 0.493 4.119 1.00 0.00 H new ATOM 0 HG11 VAL A 107 17.298 2.901 4.183 1.00 0.00 H new ATOM 0 HG12 VAL A 107 18.647 1.921 4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 107 18.735 2.620 3.172 1.00 0.00 H new ATOM 0 HG21 VAL A 107 15.807 2.008 2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 107 17.174 1.684 1.357 1.00 0.00 H new ATOM 0 HG23 VAL A 107 16.057 0.371 1.797 1.00 0.00 H new ATOM 1588 N PRO A 108 17.522 -2.266 3.567 1.00 0.00 N ATOM 1589 CA PRO A 108 16.927 -3.598 3.352 1.00 0.00 C ATOM 1590 C PRO A 108 15.528 -3.588 2.743 1.00 0.00 C ATOM 1591 O PRO A 108 15.049 -4.623 2.273 1.00 0.00 O ATOM 1592 CB PRO A 108 16.877 -4.198 4.753 1.00 0.00 C ATOM 1593 CG PRO A 108 16.915 -3.035 5.680 1.00 0.00 C ATOM 1594 CD PRO A 108 17.722 -1.977 4.993 1.00 0.00 C ATOM 0 HA PRO A 108 17.520 -4.159 2.629 1.00 0.00 H new ATOM 0 HB2 PRO A 108 15.971 -4.786 4.897 1.00 0.00 H new ATOM 0 HB3 PRO A 108 17.721 -4.866 4.925 1.00 0.00 H new ATOM 0 HG2 PRO A 108 15.908 -2.677 5.896 1.00 0.00 H new ATOM 0 HG3 PRO A 108 17.367 -3.312 6.633 1.00 0.00 H new ATOM 0 HD2 PRO A 108 17.376 -0.976 5.252 1.00 0.00 H new ATOM 0 HD3 PRO A 108 18.775 -2.032 5.270 1.00 0.00 H new ATOM 1602 N THR A 109 14.861 -2.447 2.771 1.00 0.00 N ATOM 1603 CA THR A 109 13.521 -2.351 2.208 1.00 0.00 C ATOM 1604 C THR A 109 13.211 -0.929 1.748 1.00 0.00 C ATOM 1605 O THR A 109 13.776 0.040 2.257 1.00 0.00 O ATOM 1606 CB THR A 109 12.452 -2.809 3.227 1.00 0.00 C ATOM 1607 OG1 THR A 109 11.199 -3.033 2.568 1.00 0.00 O ATOM 1608 CG2 THR A 109 12.261 -1.777 4.329 1.00 0.00 C ATOM 0 H THR A 109 15.219 -1.581 3.173 1.00 0.00 H new ATOM 0 HA THR A 109 13.491 -3.013 1.343 1.00 0.00 H new ATOM 0 HB THR A 109 12.802 -3.739 3.675 1.00 0.00 H new ATOM 0 HG1 THR A 109 10.532 -3.324 3.224 1.00 0.00 H new ATOM 0 HG21 THR A 109 11.503 -2.128 5.029 1.00 0.00 H new ATOM 0 HG22 THR A 109 13.203 -1.630 4.857 1.00 0.00 H new ATOM 0 HG23 THR A 109 11.940 -0.832 3.891 1.00 0.00 H new ATOM 1694 N GLY A 118 0.061 -5.944 -0.831 1.00 0.00 N ATOM 1695 CA GLY A 118 -0.977 -6.610 -0.077 1.00 0.00 C ATOM 1696 C GLY A 118 -1.156 -8.062 -0.464 1.00 0.00 C ATOM 1697 O GLY A 118 -0.616 -8.957 0.191 1.00 0.00 O ATOM 0 HA2 GLY A 118 -0.741 -6.550 0.985 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -1.919 -6.083 -0.224 1.00 0.00 H new ATOM 1701 N ASN A 119 -1.947 -8.281 -1.514 1.00 0.00 N ATOM 1702 CA ASN A 119 -2.229 -9.615 -2.048 1.00 0.00 C ATOM 1703 C ASN A 119 -3.205 -10.388 -1.172 1.00 0.00 C ATOM 1704 O ASN A 119 -3.215 -11.618 -1.195 1.00 0.00 O ATOM 1705 CB ASN A 119 -0.947 -10.430 -2.241 1.00 0.00 C ATOM 1706 CG ASN A 119 -0.125 -9.950 -3.423 1.00 0.00 C ATOM 1707 OD1 ASN A 119 0.734 -9.076 -3.290 1.00 0.00 O ATOM 1708 ND2 ASN A 119 -0.397 -10.506 -4.592 1.00 0.00 N ATOM 0 H ASN A 119 -2.415 -7.531 -2.023 1.00 0.00 H new ATOM 0 HA ASN A 119 -2.694 -9.461 -3.022 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -0.343 -10.371 -1.335 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -1.206 -11.479 -2.385 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.112 -10.214 -5.426 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -1.116 -11.227 -4.659 1.00 0.00 H new ATOM 1715 N PHE A 120 -4.026 -9.676 -0.402 1.00 0.00 N ATOM 1716 CA PHE A 120 -5.008 -10.334 0.456 1.00 0.00 C ATOM 1717 C PHE A 120 -5.960 -11.180 -0.391 1.00 0.00 C ATOM 1718 O PHE A 120 -6.297 -12.303 -0.033 1.00 0.00 O ATOM 1719 CB PHE A 120 -5.811 -9.306 1.276 1.00 0.00 C ATOM 1720 CG PHE A 120 -6.865 -8.562 0.495 1.00 0.00 C ATOM 1721 CD1 PHE A 120 -6.538 -7.466 -0.286 1.00 0.00 C ATOM 1722 CD2 PHE A 120 -8.189 -8.968 0.543 1.00 0.00 C ATOM 1723 CE1 PHE A 120 -7.507 -6.789 -0.998 1.00 0.00 C ATOM 1724 CE2 PHE A 120 -9.162 -8.297 -0.170 1.00 0.00 C ATOM 1725 CZ PHE A 120 -8.820 -7.204 -0.940 1.00 0.00 C ATOM 0 H PHE A 120 -4.031 -8.657 -0.355 1.00 0.00 H new ATOM 0 HA PHE A 120 -4.470 -10.978 1.151 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.291 -9.821 2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -5.118 -8.583 1.705 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -5.511 -7.137 -0.338 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -8.463 -9.821 1.146 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -7.237 -5.934 -1.600 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -10.189 -8.627 -0.125 1.00 0.00 H new ATOM 0 HZ PHE A 120 -9.580 -6.675 -1.496 1.00 0.00 H new ATOM 1735 N TRP A 121 -6.335 -10.623 -1.540 1.00 0.00 N ATOM 1736 CA TRP A 121 -7.264 -11.251 -2.479 1.00 0.00 C ATOM 1737 C TRP A 121 -6.794 -12.628 -2.926 1.00 0.00 C ATOM 1738 O TRP A 121 -7.609 -13.529 -3.136 1.00 0.00 O ATOM 1739 CB TRP A 121 -7.428 -10.337 -3.691 1.00 0.00 C ATOM 1740 CG TRP A 121 -8.271 -10.898 -4.798 1.00 0.00 C ATOM 1741 CD1 TRP A 121 -7.850 -11.213 -6.057 1.00 0.00 C ATOM 1742 CD2 TRP A 121 -9.671 -11.211 -4.754 1.00 0.00 C ATOM 1743 NE1 TRP A 121 -8.899 -11.691 -6.800 1.00 0.00 N ATOM 1744 CE2 TRP A 121 -10.027 -11.701 -6.025 1.00 0.00 C ATOM 1745 CE3 TRP A 121 -10.655 -11.121 -3.769 1.00 0.00 C ATOM 1746 CZ2 TRP A 121 -11.324 -12.103 -6.335 1.00 0.00 C ATOM 1747 CZ3 TRP A 121 -11.943 -11.519 -4.078 1.00 0.00 C ATOM 1748 CH2 TRP A 121 -12.267 -12.003 -5.351 1.00 0.00 C ATOM 0 H TRP A 121 -5.999 -9.711 -1.850 1.00 0.00 H new ATOM 0 HA TRP A 121 -8.218 -11.392 -1.971 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -7.868 -9.396 -3.361 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -6.440 -10.105 -4.089 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -6.838 -11.102 -6.416 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -8.847 -11.991 -7.774 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -10.416 -10.748 -2.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -11.575 -12.479 -7.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -12.713 -11.455 -3.323 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -13.283 -12.304 -5.560 1.00 0.00 H new ATOM 1759 N ASP A 122 -5.482 -12.794 -3.055 1.00 0.00 N ATOM 1760 CA ASP A 122 -4.907 -14.065 -3.485 1.00 0.00 C ATOM 1761 C ASP A 122 -5.334 -15.197 -2.563 1.00 0.00 C ATOM 1762 O ASP A 122 -5.377 -16.360 -2.968 1.00 0.00 O ATOM 1763 CB ASP A 122 -3.382 -13.979 -3.545 1.00 0.00 C ATOM 1764 CG ASP A 122 -2.895 -13.153 -4.716 1.00 0.00 C ATOM 1765 OD1 ASP A 122 -2.759 -11.921 -4.569 1.00 0.00 O ATOM 1766 OD2 ASP A 122 -2.647 -13.732 -5.796 1.00 0.00 O ATOM 0 H ASP A 122 -4.795 -12.064 -2.868 1.00 0.00 H new ATOM 0 HA ASP A 122 -5.282 -14.277 -4.486 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -3.009 -13.545 -2.618 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -2.967 -14.984 -3.616 1.00 0.00 H new ATOM 1771 N SER A 123 -5.651 -14.856 -1.325 1.00 0.00 N ATOM 1772 CA SER A 123 -6.093 -15.840 -0.364 1.00 0.00 C ATOM 1773 C SER A 123 -7.355 -15.359 0.352 1.00 0.00 C ATOM 1774 O SER A 123 -7.619 -15.750 1.487 1.00 0.00 O ATOM 1775 CB SER A 123 -4.983 -16.132 0.644 1.00 0.00 C ATOM 1776 OG SER A 123 -3.749 -16.378 -0.007 1.00 0.00 O ATOM 0 H SER A 123 -5.609 -13.902 -0.966 1.00 0.00 H new ATOM 0 HA SER A 123 -6.330 -16.762 -0.895 1.00 0.00 H new ATOM 0 HB2 SER A 123 -4.876 -15.288 1.325 1.00 0.00 H new ATOM 0 HB3 SER A 123 -5.256 -16.997 1.249 1.00 0.00 H new ATOM 0 HG SER A 123 -3.057 -16.560 0.662 1.00 0.00 H new ATOM 1782 N ALA A 124 -8.119 -14.485 -0.300 1.00 0.00 N ATOM 1783 CA ALA A 124 -9.358 -13.981 0.280 1.00 0.00 C ATOM 1784 C ALA A 124 -10.556 -14.412 -0.548 1.00 0.00 C ATOM 1785 O ALA A 124 -10.508 -14.415 -1.779 1.00 0.00 O ATOM 1786 CB ALA A 124 -9.332 -12.466 0.397 1.00 0.00 C ATOM 0 H ALA A 124 -7.902 -14.114 -1.225 1.00 0.00 H new ATOM 0 HA ALA A 124 -9.448 -14.405 1.280 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -10.269 -12.119 0.833 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -8.501 -12.165 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -9.207 -12.027 -0.593 1.00 0.00 H new ATOM 1792 N ARG A 125 -11.628 -14.779 0.132 1.00 0.00 N ATOM 1793 CA ARG A 125 -12.851 -15.200 -0.530 1.00 0.00 C ATOM 1794 C ARG A 125 -14.044 -14.439 0.023 1.00 0.00 C ATOM 1795 O ARG A 125 -14.066 -14.088 1.202 1.00 0.00 O ATOM 1796 CB ARG A 125 -13.061 -16.711 -0.393 1.00 0.00 C ATOM 1797 CG ARG A 125 -12.385 -17.505 -1.496 1.00 0.00 C ATOM 1798 CD ARG A 125 -12.917 -17.078 -2.855 1.00 0.00 C ATOM 1799 NE ARG A 125 -12.226 -17.725 -3.966 1.00 0.00 N ATOM 1800 CZ ARG A 125 -12.210 -17.242 -5.207 1.00 0.00 C ATOM 1801 NH1 ARG A 125 -12.827 -16.097 -5.484 1.00 0.00 N ATOM 1802 NH2 ARG A 125 -11.572 -17.898 -6.168 1.00 0.00 N ATOM 0 H ARG A 125 -11.676 -14.794 1.151 1.00 0.00 H new ATOM 0 HA ARG A 125 -12.757 -14.971 -1.592 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -12.676 -17.040 0.572 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.130 -16.926 -0.400 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -11.307 -17.352 -1.455 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -12.561 -18.570 -1.347 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -13.981 -17.309 -2.912 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -12.820 -15.997 -2.954 1.00 0.00 H new ATOM 0 HE ARG A 125 -11.728 -18.596 -3.782 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -13.313 -15.588 -4.746 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -12.814 -15.728 -6.435 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -11.093 -18.773 -5.957 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -11.561 -17.527 -7.118 1.00 0.00 H new ATOM 1816 N ASP A 126 -15.017 -14.182 -0.849 1.00 0.00 N ATOM 1817 CA ASP A 126 -16.233 -13.447 -0.499 1.00 0.00 C ATOM 1818 C ASP A 126 -15.889 -12.131 0.192 1.00 0.00 C ATOM 1819 O ASP A 126 -16.275 -11.881 1.333 1.00 0.00 O ATOM 1820 CB ASP A 126 -17.161 -14.288 0.380 1.00 0.00 C ATOM 1821 CG ASP A 126 -18.549 -13.685 0.472 1.00 0.00 C ATOM 1822 OD1 ASP A 126 -19.296 -13.754 -0.528 1.00 0.00 O ATOM 1823 OD2 ASP A 126 -18.904 -13.137 1.534 1.00 0.00 O ATOM 0 H ASP A 126 -14.985 -14.479 -1.824 1.00 0.00 H new ATOM 0 HA ASP A 126 -16.762 -13.224 -1.426 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -17.229 -15.297 -0.025 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -16.735 -14.374 1.380 1.00 0.00 H new ATOM 1828 N VAL A 127 -15.144 -11.300 -0.517 1.00 0.00 N ATOM 1829 CA VAL A 127 -14.732 -10.006 -0.001 1.00 0.00 C ATOM 1830 C VAL A 127 -15.848 -8.996 -0.208 1.00 0.00 C ATOM 1831 O VAL A 127 -16.326 -8.806 -1.330 1.00 0.00 O ATOM 1832 CB VAL A 127 -13.457 -9.517 -0.709 1.00 0.00 C ATOM 1833 CG1 VAL A 127 -12.946 -8.237 -0.077 1.00 0.00 C ATOM 1834 CG2 VAL A 127 -12.384 -10.592 -0.698 1.00 0.00 C ATOM 0 H VAL A 127 -14.810 -11.501 -1.459 1.00 0.00 H new ATOM 0 HA VAL A 127 -14.520 -10.109 1.063 1.00 0.00 H new ATOM 0 HB VAL A 127 -13.709 -9.304 -1.748 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -12.044 -7.911 -0.594 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -13.709 -7.463 -0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -12.717 -8.416 0.973 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -11.493 -10.222 -1.205 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -12.136 -10.848 0.332 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -12.752 -11.479 -1.214 1.00 0.00 H new ATOM 1844 N ARG A 128 -16.267 -8.361 0.871 1.00 0.00 N ATOM 1845 CA ARG A 128 -17.342 -7.384 0.806 1.00 0.00 C ATOM 1846 C ARG A 128 -17.117 -6.254 1.805 1.00 0.00 C ATOM 1847 O ARG A 128 -16.605 -6.473 2.902 1.00 0.00 O ATOM 1848 CB ARG A 128 -18.684 -8.077 1.071 1.00 0.00 C ATOM 1849 CG ARG A 128 -18.729 -8.839 2.388 1.00 0.00 C ATOM 1850 CD ARG A 128 -20.036 -9.596 2.554 1.00 0.00 C ATOM 1851 NE ARG A 128 -20.167 -10.703 1.604 1.00 0.00 N ATOM 1852 CZ ARG A 128 -21.219 -10.883 0.804 1.00 0.00 C ATOM 1853 NH1 ARG A 128 -22.221 -10.010 0.804 1.00 0.00 N ATOM 1854 NH2 ARG A 128 -21.262 -11.935 -0.001 1.00 0.00 N ATOM 0 H ARG A 128 -15.880 -8.503 1.804 1.00 0.00 H new ATOM 0 HA ARG A 128 -17.355 -6.946 -0.192 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -19.476 -7.329 1.067 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -18.894 -8.768 0.254 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.895 -9.539 2.432 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -18.604 -8.142 3.216 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -20.101 -9.984 3.570 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -20.870 -8.907 2.422 1.00 0.00 H new ATOM 0 HE ARG A 128 -19.405 -11.379 1.551 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -22.188 -9.196 1.418 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -23.023 -10.154 0.190 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -20.492 -12.604 -0.007 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -22.065 -12.076 -0.614 1.00 0.00 H new ATOM 1868 N LEU A 129 -17.494 -5.045 1.413 1.00 0.00 N ATOM 1869 CA LEU A 129 -17.351 -3.886 2.277 1.00 0.00 C ATOM 1870 C LEU A 129 -18.557 -3.754 3.182 1.00 0.00 C ATOM 1871 O LEU A 129 -19.693 -3.961 2.755 1.00 0.00 O ATOM 1872 CB LEU A 129 -17.192 -2.610 1.453 1.00 0.00 C ATOM 1873 CG LEU A 129 -15.790 -2.345 0.919 1.00 0.00 C ATOM 1874 CD1 LEU A 129 -15.773 -1.076 0.121 1.00 0.00 C ATOM 1875 CD2 LEU A 129 -14.799 -2.260 2.063 1.00 0.00 C ATOM 0 H LEU A 129 -17.902 -4.843 0.500 1.00 0.00 H new ATOM 0 HA LEU A 129 -16.456 -4.027 2.884 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -17.881 -2.655 0.609 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -17.495 -1.762 2.067 1.00 0.00 H new ATOM 0 HG LEU A 129 -15.501 -3.171 0.269 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -14.766 -0.897 -0.256 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -16.464 -1.164 -0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -16.077 -0.243 0.755 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -13.801 -2.070 1.667 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -15.084 -1.448 2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -14.798 -3.200 2.614 1.00 0.00 H new ATOM 1887 N VAL A 130 -18.305 -3.416 4.432 1.00 0.00 N ATOM 1888 CA VAL A 130 -19.364 -3.265 5.408 1.00 0.00 C ATOM 1889 C VAL A 130 -19.201 -1.967 6.192 1.00 0.00 C ATOM 1890 O VAL A 130 -18.116 -1.383 6.237 1.00 0.00 O ATOM 1891 CB VAL A 130 -19.400 -4.456 6.395 1.00 0.00 C ATOM 1892 CG1 VAL A 130 -19.664 -5.765 5.660 1.00 0.00 C ATOM 1893 CG2 VAL A 130 -18.103 -4.541 7.179 1.00 0.00 C ATOM 0 H VAL A 130 -17.369 -3.240 4.796 1.00 0.00 H new ATOM 0 HA VAL A 130 -20.304 -3.239 4.857 1.00 0.00 H new ATOM 0 HB VAL A 130 -20.218 -4.288 7.096 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -19.684 -6.587 6.376 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -20.624 -5.707 5.147 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -18.873 -5.939 4.931 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -18.149 -5.385 7.867 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -17.270 -4.679 6.490 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -17.958 -3.620 7.743 1.00 0.00 H new ATOM 1903 N ASP A 131 -20.308 -1.503 6.754 1.00 0.00 N ATOM 1904 CA ASP A 131 -20.346 -0.289 7.570 1.00 0.00 C ATOM 1905 C ASP A 131 -20.025 0.960 6.765 1.00 0.00 C ATOM 1906 O ASP A 131 -19.678 1.998 7.326 1.00 0.00 O ATOM 1907 CB ASP A 131 -19.407 -0.390 8.773 1.00 0.00 C ATOM 1908 CG ASP A 131 -20.118 -0.853 10.029 1.00 0.00 C ATOM 1909 OD1 ASP A 131 -20.647 0.011 10.767 1.00 0.00 O ATOM 1910 OD2 ASP A 131 -20.143 -2.071 10.294 1.00 0.00 O ATOM 0 H ASP A 131 -21.215 -1.960 6.658 1.00 0.00 H new ATOM 0 HA ASP A 131 -21.370 -0.200 7.932 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -18.598 -1.083 8.541 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -18.950 0.583 8.956 1.00 0.00 H new ATOM 1915 N GLY A 132 -20.125 0.865 5.453 1.00 0.00 N ATOM 1916 CA GLY A 132 -19.878 2.015 4.622 1.00 0.00 C ATOM 1917 C GLY A 132 -18.440 2.154 4.185 1.00 0.00 C ATOM 1918 O GLY A 132 -17.952 3.267 4.053 1.00 0.00 O ATOM 0 H GLY A 132 -20.373 0.013 4.950 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -20.512 1.955 3.738 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -20.171 2.914 5.165 1.00 0.00 H new ATOM 1922 N GLY A 133 -17.733 1.041 4.031 1.00 0.00 N ATOM 1923 CA GLY A 133 -16.358 1.116 3.541 1.00 0.00 C ATOM 1924 C GLY A 133 -15.328 1.341 4.659 1.00 0.00 C ATOM 1925 O GLY A 133 -14.083 1.264 4.472 1.00 0.00 O ATOM 0 H GLY A 133 -18.074 0.101 4.231 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -16.116 0.193 3.014 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -16.281 1.927 2.816 1.00 0.00 H new ATOM 1929 N LYS A 134 -15.842 1.633 5.836 1.00 0.00 N ATOM 1930 CA LYS A 134 -14.982 1.828 6.984 1.00 0.00 C ATOM 1931 C LYS A 134 -14.469 0.469 7.439 1.00 0.00 C ATOM 1932 O LYS A 134 -13.510 0.371 8.178 1.00 0.00 O ATOM 1933 CB LYS A 134 -15.703 2.553 8.118 1.00 0.00 C ATOM 1934 CG LYS A 134 -16.859 1.770 8.692 1.00 0.00 C ATOM 1935 CD LYS A 134 -17.308 2.328 10.040 1.00 0.00 C ATOM 1936 CE LYS A 134 -17.837 3.751 9.928 1.00 0.00 C ATOM 1937 NZ LYS A 134 -19.135 3.813 9.209 1.00 0.00 N ATOM 0 H LYS A 134 -16.839 1.740 6.022 1.00 0.00 H new ATOM 0 HA LYS A 134 -14.144 2.463 6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -14.989 2.768 8.913 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -16.070 3.512 7.751 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -17.695 1.791 7.993 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -16.568 0.726 8.809 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -18.084 1.686 10.456 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -16.470 2.308 10.737 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -17.956 4.172 10.926 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -17.105 4.369 9.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -19.069 4.501 8.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -19.363 2.875 8.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -19.884 4.107 9.869 1.00 0.00 H new ATOM 1951 N VAL A 135 -15.141 -0.583 6.990 1.00 0.00 N ATOM 1952 CA VAL A 135 -14.737 -1.943 7.305 1.00 0.00 C ATOM 1953 C VAL A 135 -14.857 -2.822 6.056 1.00 0.00 C ATOM 1954 O VAL A 135 -15.768 -2.654 5.246 1.00 0.00 O ATOM 1955 CB VAL A 135 -15.566 -2.570 8.455 1.00 0.00 C ATOM 1956 CG1 VAL A 135 -14.983 -3.917 8.859 1.00 0.00 C ATOM 1957 CG2 VAL A 135 -15.627 -1.642 9.658 1.00 0.00 C ATOM 0 H VAL A 135 -15.973 -0.517 6.403 1.00 0.00 H new ATOM 0 HA VAL A 135 -13.702 -1.894 7.642 1.00 0.00 H new ATOM 0 HB VAL A 135 -16.582 -2.720 8.091 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -15.577 -4.343 9.667 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -14.998 -4.592 8.003 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -13.955 -3.782 9.196 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -16.215 -2.109 10.448 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -14.617 -1.451 10.022 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -16.092 -0.700 9.368 1.00 0.00 H new ATOM 1967 N LEU A 136 -13.921 -3.742 5.910 1.00 0.00 N ATOM 1968 CA LEU A 136 -13.879 -4.663 4.782 1.00 0.00 C ATOM 1969 C LEU A 136 -13.812 -6.076 5.317 1.00 0.00 C ATOM 1970 O LEU A 136 -12.849 -6.430 5.979 1.00 0.00 O ATOM 1971 CB LEU A 136 -12.658 -4.374 3.906 1.00 0.00 C ATOM 1972 CG LEU A 136 -12.399 -5.391 2.797 1.00 0.00 C ATOM 1973 CD1 LEU A 136 -13.623 -5.532 1.918 1.00 0.00 C ATOM 1974 CD2 LEU A 136 -11.193 -4.980 1.965 1.00 0.00 C ATOM 0 H LEU A 136 -13.160 -3.875 6.576 1.00 0.00 H new ATOM 0 HA LEU A 136 -14.773 -4.539 4.171 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -12.780 -3.390 3.453 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -11.776 -4.324 4.545 1.00 0.00 H new ATOM 0 HG LEU A 136 -12.186 -6.356 3.256 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -13.424 -6.260 1.132 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -14.467 -5.869 2.520 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -13.861 -4.568 1.468 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -11.024 -5.717 1.180 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -11.377 -4.005 1.514 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -10.312 -4.923 2.604 1.00 0.00 H new ATOM 1986 N GLU A 137 -14.801 -6.886 4.995 1.00 0.00 N ATOM 1987 CA GLU A 137 -14.873 -8.241 5.522 1.00 0.00 C ATOM 1988 C GLU A 137 -14.662 -9.276 4.423 1.00 0.00 C ATOM 1989 O GLU A 137 -15.171 -9.127 3.311 1.00 0.00 O ATOM 1990 CB GLU A 137 -16.232 -8.445 6.193 1.00 0.00 C ATOM 1991 CG GLU A 137 -16.231 -9.498 7.285 1.00 0.00 C ATOM 1992 CD GLU A 137 -17.593 -9.661 7.925 1.00 0.00 C ATOM 1993 OE1 GLU A 137 -17.910 -8.887 8.855 1.00 0.00 O ATOM 1994 OE2 GLU A 137 -18.348 -10.561 7.513 1.00 0.00 O ATOM 0 H GLU A 137 -15.567 -6.633 4.371 1.00 0.00 H new ATOM 0 HA GLU A 137 -14.077 -8.376 6.254 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -16.562 -7.497 6.618 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -16.962 -8.725 5.434 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -15.912 -10.452 6.866 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -15.503 -9.226 8.049 1.00 0.00 H new ATOM 2001 N ALA A 138 -13.895 -10.312 4.739 1.00 0.00 N ATOM 2002 CA ALA A 138 -13.607 -11.381 3.789 1.00 0.00 C ATOM 2003 C ALA A 138 -13.078 -12.619 4.504 1.00 0.00 C ATOM 2004 O ALA A 138 -12.704 -12.561 5.678 1.00 0.00 O ATOM 2005 CB ALA A 138 -12.584 -10.913 2.772 1.00 0.00 C ATOM 0 H ALA A 138 -13.458 -10.435 5.652 1.00 0.00 H new ATOM 0 HA ALA A 138 -14.537 -11.640 3.282 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.376 -11.719 2.068 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -12.976 -10.051 2.232 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -11.664 -10.633 3.284 1.00 0.00 H new ATOM 2011 N GLU A 139 -13.037 -13.729 3.781 1.00 0.00 N ATOM 2012 CA GLU A 139 -12.522 -14.978 4.317 1.00 0.00 C ATOM 2013 C GLU A 139 -11.058 -15.074 3.931 1.00 0.00 C ATOM 2014 O GLU A 139 -10.732 -15.306 2.767 1.00 0.00 O ATOM 2015 CB GLU A 139 -13.271 -16.180 3.733 1.00 0.00 C ATOM 2016 CG GLU A 139 -14.785 -16.028 3.715 1.00 0.00 C ATOM 2017 CD GLU A 139 -15.430 -16.211 5.074 1.00 0.00 C ATOM 2018 OE1 GLU A 139 -15.137 -15.426 5.993 1.00 0.00 O ATOM 2019 OE2 GLU A 139 -16.236 -17.157 5.231 1.00 0.00 O ATOM 0 H GLU A 139 -13.357 -13.788 2.814 1.00 0.00 H new ATOM 0 HA GLU A 139 -12.653 -14.990 5.399 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -12.923 -16.350 2.714 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -13.014 -17.068 4.310 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -15.038 -15.039 3.332 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -15.206 -16.755 3.021 1.00 0.00 H new ATOM 2026 N LEU A 140 -10.180 -14.871 4.892 1.00 0.00 N ATOM 2027 CA LEU A 140 -8.753 -14.908 4.630 1.00 0.00 C ATOM 2028 C LEU A 140 -8.157 -16.265 4.971 1.00 0.00 C ATOM 2029 O LEU A 140 -8.388 -16.812 6.051 1.00 0.00 O ATOM 2030 CB LEU A 140 -8.031 -13.819 5.419 1.00 0.00 C ATOM 2031 CG LEU A 140 -8.545 -12.396 5.199 1.00 0.00 C ATOM 2032 CD1 LEU A 140 -7.720 -11.415 6.006 1.00 0.00 C ATOM 2033 CD2 LEU A 140 -8.511 -12.023 3.726 1.00 0.00 C ATOM 0 H LEU A 140 -10.428 -14.678 5.862 1.00 0.00 H new ATOM 0 HA LEU A 140 -8.616 -14.731 3.563 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -8.106 -14.054 6.481 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -6.973 -13.848 5.160 1.00 0.00 H new ATOM 0 HG LEU A 140 -9.581 -12.353 5.535 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.094 -10.404 5.843 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.794 -11.662 7.065 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -6.678 -11.471 5.692 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -8.882 -11.006 3.600 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.486 -12.084 3.359 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -9.140 -12.711 3.162 1.00 0.00 H new ATOM 2045 N ARG A 141 -7.402 -16.792 4.028 1.00 0.00 N ATOM 2046 CA ARG A 141 -6.733 -18.067 4.172 1.00 0.00 C ATOM 2047 C ARG A 141 -5.555 -17.935 5.123 1.00 0.00 C ATOM 2048 O ARG A 141 -4.847 -16.923 5.101 1.00 0.00 O ATOM 2049 CB ARG A 141 -6.234 -18.514 2.810 1.00 0.00 C ATOM 2050 CG ARG A 141 -5.668 -19.913 2.787 1.00 0.00 C ATOM 2051 CD ARG A 141 -5.085 -20.241 1.426 1.00 0.00 C ATOM 2052 NE ARG A 141 -4.575 -21.609 1.369 1.00 0.00 N ATOM 2053 CZ ARG A 141 -4.117 -22.195 0.263 1.00 0.00 C ATOM 2054 NH1 ARG A 141 -4.065 -21.527 -0.886 1.00 0.00 N ATOM 2055 NH2 ARG A 141 -3.704 -23.457 0.310 1.00 0.00 N ATOM 0 H ARG A 141 -7.234 -16.340 3.129 1.00 0.00 H new ATOM 0 HA ARG A 141 -7.431 -18.800 4.576 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -7.056 -18.455 2.097 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -5.467 -17.818 2.470 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -4.896 -20.009 3.550 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -6.451 -20.630 3.034 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -5.850 -20.106 0.661 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -4.279 -19.543 1.198 1.00 0.00 H new ATOM 0 HE ARG A 141 -4.569 -22.151 2.233 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -4.377 -20.557 -0.926 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -3.713 -21.985 -1.727 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -3.738 -23.972 1.190 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -3.353 -23.910 -0.533 1.00 0.00 H new ATOM 2069 N TYR A 142 -5.343 -18.946 5.950 1.00 0.00 N ATOM 2070 CA TYR A 142 -4.251 -18.917 6.903 1.00 0.00 C ATOM 2071 C TYR A 142 -3.882 -20.321 7.367 1.00 0.00 C ATOM 2072 O TYR A 142 -4.362 -21.306 6.801 1.00 0.00 O ATOM 2073 CB TYR A 142 -4.625 -18.023 8.084 1.00 0.00 C ATOM 2074 CG TYR A 142 -5.669 -18.581 9.033 1.00 0.00 C ATOM 2075 CD1 TYR A 142 -6.941 -18.922 8.590 1.00 0.00 C ATOM 2076 CD2 TYR A 142 -5.381 -18.741 10.384 1.00 0.00 C ATOM 2077 CE1 TYR A 142 -7.891 -19.411 9.463 1.00 0.00 C ATOM 2078 CE2 TYR A 142 -6.328 -19.231 11.264 1.00 0.00 C ATOM 2079 CZ TYR A 142 -7.581 -19.564 10.799 1.00 0.00 C ATOM 2080 OH TYR A 142 -8.528 -20.050 11.671 1.00 0.00 O ATOM 0 H TYR A 142 -5.911 -19.793 5.979 1.00 0.00 H new ATOM 0 HA TYR A 142 -3.370 -18.502 6.413 1.00 0.00 H new ATOM 0 HB2 TYR A 142 -3.721 -17.810 8.654 1.00 0.00 H new ATOM 0 HB3 TYR A 142 -4.988 -17.072 7.694 1.00 0.00 H new ATOM 0 HD1 TYR A 142 -7.190 -18.802 7.546 1.00 0.00 H new ATOM 0 HD2 TYR A 142 -4.400 -18.478 10.752 1.00 0.00 H new ATOM 0 HE1 TYR A 142 -8.874 -19.673 9.102 1.00 0.00 H new ATOM 0 HE2 TYR A 142 -6.087 -19.352 12.310 1.00 0.00 H new ATOM 0 HH TYR A 142 -8.148 -20.097 12.573 1.00 0.00 H new ATOM 2090 N SER A 143 -3.040 -20.410 8.389 1.00 0.00 N ATOM 2091 CA SER A 143 -2.599 -21.694 8.923 1.00 0.00 C ATOM 2092 C SER A 143 -3.778 -22.576 9.342 1.00 0.00 C ATOM 2093 O SER A 143 -3.707 -23.802 9.264 1.00 0.00 O ATOM 2094 CB SER A 143 -1.677 -21.457 10.117 1.00 0.00 C ATOM 2095 OG SER A 143 -0.610 -20.591 9.769 1.00 0.00 O ATOM 0 H SER A 143 -2.646 -19.601 8.869 1.00 0.00 H new ATOM 0 HA SER A 143 -2.062 -22.220 8.133 1.00 0.00 H new ATOM 0 HB2 SER A 143 -2.246 -21.026 10.941 1.00 0.00 H new ATOM 0 HB3 SER A 143 -1.278 -22.409 10.468 1.00 0.00 H new ATOM 0 HG SER A 143 -0.034 -20.452 10.549 1.00 0.00 H new ATOM 2101 N GLY A 144 -4.874 -21.949 9.751 1.00 0.00 N ATOM 2102 CA GLY A 144 -6.033 -22.703 10.190 1.00 0.00 C ATOM 2103 C GLY A 144 -7.124 -22.790 9.139 1.00 0.00 C ATOM 2104 O GLY A 144 -8.303 -22.906 9.471 1.00 0.00 O ATOM 0 H GLY A 144 -4.981 -20.935 9.787 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -5.720 -23.711 10.464 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -6.440 -22.240 11.089 1.00 0.00 H new ATOM 2108 N GLY A 145 -6.744 -22.708 7.871 1.00 0.00 N ATOM 2109 CA GLY A 145 -7.720 -22.798 6.803 1.00 0.00 C ATOM 2110 C GLY A 145 -8.212 -21.439 6.357 1.00 0.00 C ATOM 2111 O GLY A 145 -7.454 -20.666 5.775 1.00 0.00 O ATOM 0 H GLY A 145 -5.780 -22.581 7.563 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -7.278 -23.318 5.953 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -8.567 -23.396 7.138 1.00 0.00 H new ATOM 2115 N TRP A 146 -9.471 -21.139 6.640 1.00 0.00 N ATOM 2116 CA TRP A 146 -10.062 -19.861 6.257 1.00 0.00 C ATOM 2117 C TRP A 146 -10.732 -19.205 7.460 1.00 0.00 C ATOM 2118 O TRP A 146 -11.468 -19.859 8.203 1.00 0.00 O ATOM 2119 CB TRP A 146 -11.083 -20.057 5.129 1.00 0.00 C ATOM 2120 CG TRP A 146 -10.482 -20.564 3.852 1.00 0.00 C ATOM 2121 CD1 TRP A 146 -10.184 -21.863 3.540 1.00 0.00 C ATOM 2122 CD2 TRP A 146 -10.108 -19.784 2.713 1.00 0.00 C ATOM 2123 NE1 TRP A 146 -9.642 -21.931 2.280 1.00 0.00 N ATOM 2124 CE2 TRP A 146 -9.587 -20.670 1.751 1.00 0.00 C ATOM 2125 CE3 TRP A 146 -10.165 -18.421 2.411 1.00 0.00 C ATOM 2126 CZ2 TRP A 146 -9.122 -20.234 0.512 1.00 0.00 C ATOM 2127 CZ3 TRP A 146 -9.703 -17.991 1.184 1.00 0.00 C ATOM 2128 CH2 TRP A 146 -9.190 -18.895 0.247 1.00 0.00 C ATOM 0 H TRP A 146 -10.107 -21.764 7.135 1.00 0.00 H new ATOM 0 HA TRP A 146 -9.266 -19.209 5.898 1.00 0.00 H new ATOM 0 HB2 TRP A 146 -11.849 -20.757 5.462 1.00 0.00 H new ATOM 0 HB3 TRP A 146 -11.582 -19.108 4.934 1.00 0.00 H new ATOM 0 HD1 TRP A 146 -10.351 -22.710 4.189 1.00 0.00 H new ATOM 0 HE1 TRP A 146 -9.331 -22.783 1.814 1.00 0.00 H new ATOM 0 HE3 TRP A 146 -10.564 -17.716 3.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 146 -8.723 -20.929 -0.212 1.00 0.00 H new ATOM 0 HZ3 TRP A 146 -9.738 -16.939 0.943 1.00 0.00 H new ATOM 0 HH2 TRP A 146 -8.840 -18.527 -0.706 1.00 0.00 H new ATOM 2139 N ASN A 147 -10.472 -17.919 7.656 1.00 0.00 N ATOM 2140 CA ASN A 147 -11.049 -17.180 8.775 1.00 0.00 C ATOM 2141 C ASN A 147 -11.615 -15.855 8.301 1.00 0.00 C ATOM 2142 O ASN A 147 -11.027 -15.189 7.450 1.00 0.00 O ATOM 2143 CB ASN A 147 -9.999 -16.902 9.850 1.00 0.00 C ATOM 2144 CG ASN A 147 -10.586 -16.217 11.072 1.00 0.00 C ATOM 2145 OD1 ASN A 147 -11.721 -16.490 11.465 1.00 0.00 O ATOM 2146 ND2 ASN A 147 -9.834 -15.303 11.663 1.00 0.00 N ATOM 0 H ASN A 147 -9.864 -17.364 7.054 1.00 0.00 H new ATOM 0 HA ASN A 147 -11.844 -17.796 9.196 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -9.535 -17.841 10.152 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -9.211 -16.277 9.431 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -10.190 -14.796 12.474 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -8.899 -15.105 11.308 1.00 0.00 H new ATOM 2153 N ARG A 148 -12.747 -15.473 8.863 1.00 0.00 N ATOM 2154 CA ARG A 148 -13.378 -14.220 8.507 1.00 0.00 C ATOM 2155 C ARG A 148 -12.690 -13.071 9.226 1.00 0.00 C ATOM 2156 O ARG A 148 -12.716 -12.983 10.454 1.00 0.00 O ATOM 2157 CB ARG A 148 -14.865 -14.252 8.851 1.00 0.00 C ATOM 2158 CG ARG A 148 -15.626 -13.034 8.364 1.00 0.00 C ATOM 2159 CD ARG A 148 -17.102 -13.342 8.219 1.00 0.00 C ATOM 2160 NE ARG A 148 -17.321 -14.456 7.301 1.00 0.00 N ATOM 2161 CZ ARG A 148 -18.517 -14.893 6.923 1.00 0.00 C ATOM 2162 NH1 ARG A 148 -19.614 -14.267 7.336 1.00 0.00 N ATOM 2163 NH2 ARG A 148 -18.612 -15.944 6.117 1.00 0.00 N ATOM 0 H ARG A 148 -13.247 -16.014 9.568 1.00 0.00 H new ATOM 0 HA ARG A 148 -13.281 -14.071 7.432 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -15.311 -15.147 8.416 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -14.978 -14.333 9.932 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -15.489 -12.210 9.065 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -15.223 -12.707 7.406 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -17.523 -13.583 9.195 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -17.627 -12.459 7.855 1.00 0.00 H new ATOM 0 HE ARG A 148 -16.500 -14.931 6.925 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.538 -13.451 7.943 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.532 -14.602 7.046 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -17.768 -16.414 5.790 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.529 -16.282 5.825 1.00 0.00 H new ATOM 2177 N SER A 149 -12.061 -12.210 8.456 1.00 0.00 N ATOM 2178 CA SER A 149 -11.359 -11.068 9.001 1.00 0.00 C ATOM 2179 C SER A 149 -11.860 -9.796 8.340 1.00 0.00 C ATOM 2180 O SER A 149 -12.578 -9.851 7.337 1.00 0.00 O ATOM 2181 CB SER A 149 -9.853 -11.232 8.779 1.00 0.00 C ATOM 2182 OG SER A 149 -9.116 -10.159 9.348 1.00 0.00 O ATOM 0 H SER A 149 -12.022 -12.281 7.439 1.00 0.00 H new ATOM 0 HA SER A 149 -11.548 -11.002 10.073 1.00 0.00 H new ATOM 0 HB2 SER A 149 -9.521 -12.173 9.217 1.00 0.00 H new ATOM 0 HB3 SER A 149 -9.647 -11.288 7.710 1.00 0.00 H new ATOM 0 HG SER A 149 -9.155 -10.218 10.325 1.00 0.00 H new ATOM 2188 N ARG A 150 -11.487 -8.658 8.901 1.00 0.00 N ATOM 2189 CA ARG A 150 -11.893 -7.378 8.360 1.00 0.00 C ATOM 2190 C ARG A 150 -10.828 -6.313 8.559 1.00 0.00 C ATOM 2191 O ARG A 150 -9.915 -6.471 9.369 1.00 0.00 O ATOM 2192 CB ARG A 150 -13.237 -6.927 8.945 1.00 0.00 C ATOM 2193 CG ARG A 150 -13.470 -7.312 10.395 1.00 0.00 C ATOM 2194 CD ARG A 150 -13.058 -6.232 11.385 1.00 0.00 C ATOM 2195 NE ARG A 150 -11.609 -6.041 11.456 1.00 0.00 N ATOM 2196 CZ ARG A 150 -11.004 -5.263 12.350 1.00 0.00 C ATOM 2197 NH1 ARG A 150 -11.706 -4.681 13.316 1.00 0.00 N ATOM 2198 NH2 ARG A 150 -9.689 -5.091 12.299 1.00 0.00 N ATOM 0 H ARG A 150 -10.901 -8.598 9.734 1.00 0.00 H new ATOM 0 HA ARG A 150 -12.020 -7.512 7.286 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -13.308 -5.843 8.857 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -14.039 -7.349 8.340 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -14.527 -7.539 10.537 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -12.915 -8.225 10.614 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -13.529 -5.290 11.103 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -13.433 -6.493 12.375 1.00 0.00 H new ATOM 0 HE ARG A 150 -11.027 -6.534 10.779 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -12.713 -4.830 13.375 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -11.238 -4.086 13.999 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -9.142 -5.555 11.574 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -9.226 -4.494 12.985 1.00 0.00 H new ATOM 2212 N ILE A 151 -10.958 -5.235 7.806 1.00 0.00 N ATOM 2213 CA ILE A 151 -10.026 -4.122 7.872 1.00 0.00 C ATOM 2214 C ILE A 151 -10.754 -2.812 7.643 1.00 0.00 C ATOM 2215 O ILE A 151 -11.789 -2.782 6.996 1.00 0.00 O ATOM 2216 CB ILE A 151 -8.899 -4.271 6.827 1.00 0.00 C ATOM 2217 CG1 ILE A 151 -7.823 -3.215 7.053 1.00 0.00 C ATOM 2218 CG2 ILE A 151 -9.442 -4.178 5.399 1.00 0.00 C ATOM 2219 CD1 ILE A 151 -6.462 -3.635 6.569 1.00 0.00 C ATOM 0 H ILE A 151 -11.712 -5.106 7.132 1.00 0.00 H new ATOM 0 HA ILE A 151 -9.580 -4.124 8.867 1.00 0.00 H new ATOM 0 HB ILE A 151 -8.458 -5.260 6.953 1.00 0.00 H new ATOM 0 HG12 ILE A 151 -8.114 -2.296 6.544 1.00 0.00 H new ATOM 0 HG13 ILE A 151 -7.767 -2.986 8.117 1.00 0.00 H new ATOM 0 HG21 ILE A 151 -8.621 -4.287 4.690 1.00 0.00 H new ATOM 0 HG22 ILE A 151 -10.171 -4.971 5.235 1.00 0.00 H new ATOM 0 HG23 ILE A 151 -9.920 -3.209 5.254 1.00 0.00 H new ATOM 0 HD11 ILE A 151 -5.745 -2.837 6.761 1.00 0.00 H new ATOM 0 HD12 ILE A 151 -6.151 -4.537 7.096 1.00 0.00 H new ATOM 0 HD13 ILE A 151 -6.503 -3.836 5.499 1.00 0.00 H new ATOM 2231 N TYR A 152 -10.226 -1.741 8.188 1.00 0.00 N ATOM 2232 CA TYR A 152 -10.831 -0.437 8.027 1.00 0.00 C ATOM 2233 C TYR A 152 -10.213 0.282 6.840 1.00 0.00 C ATOM 2234 O TYR A 152 -9.065 0.708 6.904 1.00 0.00 O ATOM 2235 CB TYR A 152 -10.626 0.399 9.291 1.00 0.00 C ATOM 2236 CG TYR A 152 -11.453 -0.033 10.484 1.00 0.00 C ATOM 2237 CD1 TYR A 152 -11.255 -1.268 11.084 1.00 0.00 C ATOM 2238 CD2 TYR A 152 -12.422 0.807 11.018 1.00 0.00 C ATOM 2239 CE1 TYR A 152 -12.001 -1.657 12.177 1.00 0.00 C ATOM 2240 CE2 TYR A 152 -13.173 0.426 12.110 1.00 0.00 C ATOM 2241 CZ TYR A 152 -12.959 -0.806 12.686 1.00 0.00 C ATOM 2242 OH TYR A 152 -13.702 -1.190 13.777 1.00 0.00 O ATOM 0 H TYR A 152 -9.375 -1.746 8.750 1.00 0.00 H new ATOM 0 HA TYR A 152 -11.899 -0.569 7.853 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -9.572 0.362 9.566 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -10.860 1.439 9.063 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -10.504 -1.936 10.689 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -12.590 1.775 10.570 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -11.836 -2.623 12.632 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -13.924 1.090 12.511 1.00 0.00 H new ATOM 0 HH TYR A 152 -14.332 -0.477 14.011 1.00 0.00 H new ATOM 2252 N LEU A 153 -10.939 0.378 5.731 1.00 0.00 N ATOM 2253 CA LEU A 153 -10.398 1.092 4.585 1.00 0.00 C ATOM 2254 C LEU A 153 -10.284 2.562 4.922 1.00 0.00 C ATOM 2255 O LEU A 153 -9.336 3.232 4.510 1.00 0.00 O ATOM 2256 CB LEU A 153 -11.241 0.881 3.331 1.00 0.00 C ATOM 2257 CG LEU A 153 -11.355 -0.576 2.890 1.00 0.00 C ATOM 2258 CD1 LEU A 153 -11.934 -0.666 1.496 1.00 0.00 C ATOM 2259 CD2 LEU A 153 -10.000 -1.262 2.949 1.00 0.00 C ATOM 0 H LEU A 153 -11.871 -0.015 5.604 1.00 0.00 H new ATOM 0 HA LEU A 153 -9.408 0.692 4.365 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -12.242 1.274 3.510 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -10.811 1.463 2.516 1.00 0.00 H new ATOM 0 HG LEU A 153 -12.029 -1.089 3.576 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -12.007 -1.712 1.199 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -12.926 -0.215 1.484 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -11.286 -0.136 0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -10.103 -2.299 2.631 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -9.303 -0.747 2.288 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -9.621 -1.232 3.971 1.00 0.00 H new ATOM 2271 N ASP A 154 -11.229 3.045 5.726 1.00 0.00 N ATOM 2272 CA ASP A 154 -11.232 4.447 6.165 1.00 0.00 C ATOM 2273 C ASP A 154 -9.929 4.824 6.891 1.00 0.00 C ATOM 2274 O ASP A 154 -9.674 6.007 7.132 1.00 0.00 O ATOM 2275 CB ASP A 154 -12.411 4.716 7.096 1.00 0.00 C ATOM 2276 CG ASP A 154 -12.174 4.200 8.500 1.00 0.00 C ATOM 2277 OD1 ASP A 154 -12.423 3.012 8.740 1.00 0.00 O ATOM 2278 OD2 ASP A 154 -11.752 4.999 9.361 1.00 0.00 O ATOM 0 H ASP A 154 -12.004 2.490 6.089 1.00 0.00 H new ATOM 0 HA ASP A 154 -11.320 5.058 5.267 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -12.601 5.789 7.134 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -13.306 4.248 6.687 1.00 0.00 H new ATOM 2283 N GLU A 155 -9.108 3.824 7.242 1.00 0.00 N ATOM 2284 CA GLU A 155 -7.851 4.080 7.936 1.00 0.00 C ATOM 2285 C GLU A 155 -6.914 4.907 7.110 1.00 0.00 C ATOM 2286 O GLU A 155 -6.428 5.931 7.548 1.00 0.00 O ATOM 2287 CB GLU A 155 -7.104 2.804 8.282 1.00 0.00 C ATOM 2288 CG GLU A 155 -7.829 1.927 9.251 1.00 0.00 C ATOM 2289 CD GLU A 155 -6.942 0.839 9.813 1.00 0.00 C ATOM 2290 OE1 GLU A 155 -6.005 1.172 10.571 1.00 0.00 O ATOM 2291 OE2 GLU A 155 -7.157 -0.349 9.489 1.00 0.00 O ATOM 0 H GLU A 155 -9.295 2.839 7.056 1.00 0.00 H new ATOM 0 HA GLU A 155 -8.142 4.607 8.845 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -6.918 2.243 7.366 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -6.131 3.065 8.699 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -8.217 2.535 10.068 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -8.687 1.473 8.756 1.00 0.00 H new ATOM 2298 N HIS A 156 -6.634 4.442 5.921 1.00 0.00 N ATOM 2299 CA HIS A 156 -5.702 5.157 5.062 1.00 0.00 C ATOM 2300 C HIS A 156 -6.358 5.620 3.786 1.00 0.00 C ATOM 2301 O HIS A 156 -5.794 6.418 3.051 1.00 0.00 O ATOM 2302 CB HIS A 156 -4.482 4.298 4.741 1.00 0.00 C ATOM 2303 CG HIS A 156 -3.660 3.952 5.943 1.00 0.00 C ATOM 2304 ND1 HIS A 156 -3.585 2.813 6.663 1.00 0.00 N flip ATOM 2305 CD2 HIS A 156 -2.799 4.841 6.548 1.00 0.00 C flip ATOM 2306 CE1 HIS A 156 -2.691 3.027 7.681 1.00 0.00 C flip ATOM 2307 NE2 HIS A 156 -2.230 4.261 7.587 1.00 0.00 N flip ATOM 0 H HIS A 156 -7.025 3.588 5.523 1.00 0.00 H new ATOM 0 HA HIS A 156 -5.376 6.039 5.613 1.00 0.00 H new ATOM 0 HB2 HIS A 156 -4.813 3.377 4.260 1.00 0.00 H new ATOM 0 HB3 HIS A 156 -3.855 4.826 4.022 1.00 0.00 H new ATOM 0 HD1 HIS A 156 -4.099 1.951 6.483 1.00 0.00 H new ATOM 0 HD2 HIS A 156 -2.618 5.855 6.222 1.00 0.00 H new ATOM 0 HE1 HIS A 156 -2.411 2.306 8.435 1.00 0.00 H new ATOM 2316 N ILE A 157 -7.539 5.127 3.516 1.00 0.00 N ATOM 2317 CA ILE A 157 -8.239 5.519 2.314 1.00 0.00 C ATOM 2318 C ILE A 157 -9.051 6.778 2.564 1.00 0.00 C ATOM 2319 O ILE A 157 -10.040 6.753 3.294 1.00 0.00 O ATOM 2320 CB ILE A 157 -9.166 4.404 1.835 1.00 0.00 C ATOM 2321 CG1 ILE A 157 -8.371 3.124 1.548 1.00 0.00 C ATOM 2322 CG2 ILE A 157 -9.929 4.845 0.603 1.00 0.00 C ATOM 2323 CD1 ILE A 157 -7.293 3.293 0.496 1.00 0.00 C ATOM 0 H ILE A 157 -8.035 4.458 4.105 1.00 0.00 H new ATOM 0 HA ILE A 157 -7.495 5.714 1.541 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.883 4.189 2.627 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.911 2.779 2.474 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -9.061 2.344 1.225 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -10.585 4.039 0.274 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -10.526 5.725 0.841 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -9.225 5.088 -0.193 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -6.776 2.345 0.349 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -7.748 3.607 -0.443 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.579 4.049 0.824 1.00 0.00 H new ATOM 2335 N GLY A 158 -8.608 7.883 1.991 1.00 0.00 N ATOM 2336 CA GLY A 158 -9.304 9.139 2.155 1.00 0.00 C ATOM 2337 C GLY A 158 -9.873 9.661 0.855 1.00 0.00 C ATOM 2338 O GLY A 158 -9.381 9.335 -0.223 1.00 0.00 O ATOM 0 H GLY A 158 -7.771 7.932 1.410 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -10.112 9.011 2.876 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -8.619 9.878 2.571 1.00 0.00 H new ATOM 2342 N ASN A 159 -10.913 10.469 0.957 1.00 0.00 N ATOM 2343 CA ASN A 159 -11.552 11.053 -0.214 1.00 0.00 C ATOM 2344 C ASN A 159 -10.973 12.435 -0.485 1.00 0.00 C ATOM 2345 O ASN A 159 -11.131 13.360 0.315 1.00 0.00 O ATOM 2346 CB ASN A 159 -13.076 11.114 -0.009 1.00 0.00 C ATOM 2347 CG ASN A 159 -13.757 12.219 -0.798 1.00 0.00 C ATOM 2348 OD1 ASN A 159 -13.395 12.519 -1.937 1.00 0.00 O ATOM 2349 ND2 ASN A 159 -14.744 12.843 -0.183 1.00 0.00 N ATOM 0 H ASN A 159 -11.337 10.739 1.845 1.00 0.00 H new ATOM 0 HA ASN A 159 -11.356 10.427 -1.084 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -13.510 10.156 -0.295 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -13.285 11.255 1.051 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -15.237 13.603 -0.651 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -15.014 12.565 0.760 1.00 0.00 H new ATOM 2356 N ARG A 160 -10.281 12.559 -1.602 1.00 0.00 N ATOM 2357 CA ARG A 160 -9.676 13.814 -1.992 1.00 0.00 C ATOM 2358 C ARG A 160 -10.393 14.379 -3.212 1.00 0.00 C ATOM 2359 O ARG A 160 -9.997 14.133 -4.352 1.00 0.00 O ATOM 2360 CB ARG A 160 -8.183 13.625 -2.282 1.00 0.00 C ATOM 2361 CG ARG A 160 -7.460 14.918 -2.615 1.00 0.00 C ATOM 2362 CD ARG A 160 -7.534 15.907 -1.465 1.00 0.00 C ATOM 2363 NE ARG A 160 -7.085 17.238 -1.858 1.00 0.00 N ATOM 2364 CZ ARG A 160 -7.789 18.346 -1.640 1.00 0.00 C ATOM 2365 NH1 ARG A 160 -8.977 18.267 -1.054 1.00 0.00 N ATOM 2366 NH2 ARG A 160 -7.316 19.528 -2.013 1.00 0.00 N ATOM 0 H ARG A 160 -10.124 11.796 -2.260 1.00 0.00 H new ATOM 0 HA ARG A 160 -9.774 14.522 -1.169 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -7.708 13.166 -1.415 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -8.068 12.930 -3.114 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -6.416 14.704 -2.846 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -7.899 15.363 -3.508 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -8.560 15.963 -1.101 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -6.922 15.548 -0.638 1.00 0.00 H new ATOM 0 HE ARG A 160 -6.182 17.324 -2.325 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -9.347 17.359 -0.772 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -9.520 19.114 -0.885 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -6.407 19.592 -2.470 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -7.862 20.373 -1.842 1.00 0.00 H new ATOM 2380 N ASN A 161 -11.458 15.122 -2.947 1.00 0.00 N ATOM 2381 CA ASN A 161 -12.278 15.746 -3.983 1.00 0.00 C ATOM 2382 C ASN A 161 -12.783 14.714 -4.990 1.00 0.00 C ATOM 2383 O ASN A 161 -12.558 14.825 -6.195 1.00 0.00 O ATOM 2384 CB ASN A 161 -11.511 16.872 -4.691 1.00 0.00 C ATOM 2385 CG ASN A 161 -12.438 17.812 -5.447 1.00 0.00 C ATOM 2386 OD1 ASN A 161 -12.965 18.770 -4.877 1.00 0.00 O ATOM 2387 ND2 ASN A 161 -12.642 17.553 -6.728 1.00 0.00 N ATOM 0 H ASN A 161 -11.783 15.312 -1.999 1.00 0.00 H new ATOM 0 HA ASN A 161 -13.147 16.185 -3.494 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -10.942 17.440 -3.955 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -10.791 16.438 -5.385 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -13.253 18.156 -7.279 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -12.188 16.751 -7.165 1.00 0.00 H new ATOM 2394 N GLY A 162 -13.462 13.701 -4.476 1.00 0.00 N ATOM 2395 CA GLY A 162 -14.026 12.664 -5.323 1.00 0.00 C ATOM 2396 C GLY A 162 -13.019 11.620 -5.764 1.00 0.00 C ATOM 2397 O GLY A 162 -13.333 10.763 -6.586 1.00 0.00 O ATOM 0 H GLY A 162 -13.635 13.575 -3.479 1.00 0.00 H new ATOM 0 HA2 GLY A 162 -14.836 12.170 -4.786 1.00 0.00 H new ATOM 0 HA3 GLY A 162 -14.465 13.128 -6.206 1.00 0.00 H new ATOM 2401 N GLU A 163 -11.820 11.679 -5.218 1.00 0.00 N ATOM 2402 CA GLU A 163 -10.774 10.737 -5.585 1.00 0.00 C ATOM 2403 C GLU A 163 -10.239 9.995 -4.363 1.00 0.00 C ATOM 2404 O GLU A 163 -9.823 10.609 -3.387 1.00 0.00 O ATOM 2405 CB GLU A 163 -9.665 11.489 -6.312 1.00 0.00 C ATOM 2406 CG GLU A 163 -8.484 10.635 -6.728 1.00 0.00 C ATOM 2407 CD GLU A 163 -7.569 11.372 -7.683 1.00 0.00 C ATOM 2408 OE1 GLU A 163 -6.663 12.089 -7.212 1.00 0.00 O ATOM 2409 OE2 GLU A 163 -7.766 11.245 -8.911 1.00 0.00 O ATOM 0 H GLU A 163 -11.543 12.368 -4.519 1.00 0.00 H new ATOM 0 HA GLU A 163 -11.189 9.980 -6.251 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -10.086 11.959 -7.201 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -9.306 12.291 -5.667 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -7.922 10.336 -5.843 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -8.844 9.721 -7.201 1.00 0.00 H new ATOM 2416 N LEU A 164 -10.269 8.670 -4.424 1.00 0.00 N ATOM 2417 CA LEU A 164 -9.796 7.825 -3.335 1.00 0.00 C ATOM 2418 C LEU A 164 -8.270 7.834 -3.272 1.00 0.00 C ATOM 2419 O LEU A 164 -7.601 7.324 -4.171 1.00 0.00 O ATOM 2420 CB LEU A 164 -10.325 6.397 -3.539 1.00 0.00 C ATOM 2421 CG LEU A 164 -11.145 5.816 -2.381 1.00 0.00 C ATOM 2422 CD1 LEU A 164 -11.800 6.922 -1.574 1.00 0.00 C ATOM 2423 CD2 LEU A 164 -12.209 4.863 -2.915 1.00 0.00 C ATOM 0 H LEU A 164 -10.621 8.151 -5.228 1.00 0.00 H new ATOM 0 HA LEU A 164 -10.169 8.213 -2.387 1.00 0.00 H new ATOM 0 HB2 LEU A 164 -10.941 6.383 -4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 164 -9.476 5.739 -3.724 1.00 0.00 H new ATOM 0 HG LEU A 164 -10.468 5.266 -1.727 1.00 0.00 H new ATOM 0 HD11 LEU A 164 -12.376 6.485 -0.758 1.00 0.00 H new ATOM 0 HD12 LEU A 164 -11.032 7.578 -1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 164 -12.464 7.499 -2.219 1.00 0.00 H new ATOM 0 HD21 LEU A 164 -12.784 4.457 -2.083 1.00 0.00 H new ATOM 0 HD22 LEU A 164 -12.875 5.402 -3.588 1.00 0.00 H new ATOM 0 HD23 LEU A 164 -11.729 4.048 -3.456 1.00 0.00 H new ATOM 2435 N ILE A 165 -7.731 8.424 -2.211 1.00 0.00 N ATOM 2436 CA ILE A 165 -6.289 8.525 -2.026 1.00 0.00 C ATOM 2437 C ILE A 165 -5.845 7.807 -0.755 1.00 0.00 C ATOM 2438 O ILE A 165 -6.519 7.862 0.269 1.00 0.00 O ATOM 2439 CB ILE A 165 -5.843 10.009 -1.962 1.00 0.00 C ATOM 2440 CG1 ILE A 165 -6.197 10.733 -3.266 1.00 0.00 C ATOM 2441 CG2 ILE A 165 -4.352 10.120 -1.679 1.00 0.00 C ATOM 2442 CD1 ILE A 165 -5.501 10.171 -4.487 1.00 0.00 C ATOM 0 H ILE A 165 -8.278 8.843 -1.459 1.00 0.00 H new ATOM 0 HA ILE A 165 -5.817 8.046 -2.884 1.00 0.00 H new ATOM 0 HB ILE A 165 -6.379 10.487 -1.142 1.00 0.00 H new ATOM 0 HG12 ILE A 165 -7.275 10.681 -3.418 1.00 0.00 H new ATOM 0 HG13 ILE A 165 -5.940 11.787 -3.166 1.00 0.00 H new ATOM 0 HG21 ILE A 165 -4.066 11.171 -1.639 1.00 0.00 H new ATOM 0 HG22 ILE A 165 -4.127 9.647 -0.723 1.00 0.00 H new ATOM 0 HG23 ILE A 165 -3.793 9.622 -2.471 1.00 0.00 H new ATOM 0 HD11 ILE A 165 -5.802 10.735 -5.370 1.00 0.00 H new ATOM 0 HD12 ILE A 165 -4.421 10.248 -4.358 1.00 0.00 H new ATOM 0 HD13 ILE A 165 -5.777 9.124 -4.614 1.00 0.00 H new