USER MOD reduce.3.24.130724 H: found=0, std=0, add=607, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 610 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 36 HIS : no HE2:sc= 0.295 K(o=0.75,f=-9.6!) USER MOD Set 1.2: A 39 GLN : amide:sc= 0.451 K(o=0.75,f=-8.8!) USER MOD Set 2.1: A 38 TYR OH : rot 176:sc= 1.28 USER MOD Set 2.2: B 201 ASN : amide:sc= 0.988 K(o=2.3,f=-3.4!) USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 9 ASN : amide:sc= 1.18 K(o=1.2,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 40:sc= 1.24 USER MOD Single : A 15 ASN : amide:sc= -0.0114 K(o=-0.011,f=-1.2) USER MOD Single : A 16 LYS NZ :NH3+ -179:sc= 1.12 (180deg=1.06) USER MOD Single : A 18 LYS NZ :NH3+ 160:sc= 0.623 (180deg=0.472) USER MOD Single : A 19 THR OG1 : rot 70:sc= 1.31 USER MOD Single : A 24 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 85:sc= 1.22 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.0742 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= -0.691 K(o=-0.69,f=-1.3) USER MOD Single : A 69 GLN : amide:sc= -0.0327 X(o=-0.033,f=-0.3) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0.413 K(o=0.41,f=-0.12) USER MOD Single : B 203 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 204 MET CE :methyl -160:sc= -0.274 (180deg=-1.09) USER MOD Single : B 211 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 52 N VAL A 5 35.505 44.226 40.511 1.00 0.00 N ATOM 53 CA VAL A 5 35.816 42.997 41.174 1.00 0.00 C ATOM 54 C VAL A 5 35.501 41.788 40.363 1.00 0.00 C ATOM 55 O VAL A 5 36.346 40.935 40.097 1.00 0.00 O ATOM 56 CB VAL A 5 35.076 42.915 42.476 1.00 0.00 C ATOM 57 CG1 VAL A 5 35.552 41.689 43.274 1.00 0.00 C ATOM 58 CG2 VAL A 5 35.301 44.211 43.274 1.00 0.00 C ATOM 0 HA VAL A 5 36.894 43.006 41.337 1.00 0.00 H new ATOM 0 HB VAL A 5 34.009 42.802 42.286 1.00 0.00 H new ATOM 0 HG11 VAL A 5 35.010 41.637 44.218 1.00 0.00 H new ATOM 0 HG12 VAL A 5 35.364 40.784 42.697 1.00 0.00 H new ATOM 0 HG13 VAL A 5 36.620 41.777 43.473 1.00 0.00 H new ATOM 0 HG21 VAL A 5 34.764 44.153 44.221 1.00 0.00 H new ATOM 0 HG22 VAL A 5 36.366 44.338 43.468 1.00 0.00 H new ATOM 0 HG23 VAL A 5 34.933 45.061 42.699 1.00 0.00 H new ATOM 68 N GLU A 6 34.247 41.677 39.890 1.00 0.00 N ATOM 69 CA GLU A 6 33.791 40.547 39.141 1.00 0.00 C ATOM 70 C GLU A 6 34.370 40.451 37.772 1.00 0.00 C ATOM 71 O GLU A 6 34.570 39.363 37.233 1.00 0.00 O ATOM 72 CB GLU A 6 32.256 40.571 39.053 1.00 0.00 C ATOM 73 CG GLU A 6 31.737 41.680 38.135 1.00 0.00 C ATOM 74 CD GLU A 6 30.305 42.105 38.432 1.00 0.00 C ATOM 75 OE1 GLU A 6 29.364 41.309 38.169 1.00 0.00 O ATOM 76 OE2 GLU A 6 30.123 43.255 38.912 1.00 0.00 O ATOM 0 H GLU A 6 33.532 42.390 40.032 1.00 0.00 H new ATOM 0 HA GLU A 6 34.137 39.665 39.680 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.901 39.607 38.688 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.840 40.707 40.052 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.390 42.548 38.225 1.00 0.00 H new ATOM 0 HG3 GLU A 6 31.798 41.341 37.101 1.00 0.00 H new ATOM 83 N PHE A 7 34.743 41.608 37.197 1.00 0.00 N ATOM 84 CA PHE A 7 35.431 41.712 35.947 1.00 0.00 C ATOM 85 C PHE A 7 36.782 41.104 36.102 1.00 0.00 C ATOM 86 O PHE A 7 37.224 40.315 35.267 1.00 0.00 O ATOM 87 CB PHE A 7 35.508 43.192 35.540 1.00 0.00 C ATOM 88 CG PHE A 7 35.859 43.531 34.132 1.00 0.00 C ATOM 89 CD1 PHE A 7 36.195 42.616 33.162 1.00 0.00 C ATOM 90 CD2 PHE A 7 35.791 44.859 33.787 1.00 0.00 C ATOM 91 CE1 PHE A 7 36.459 43.017 31.873 1.00 0.00 C ATOM 92 CE2 PHE A 7 36.046 45.274 32.501 1.00 0.00 C ATOM 93 CZ PHE A 7 36.381 44.349 31.540 1.00 0.00 C ATOM 0 H PHE A 7 34.556 42.515 37.624 1.00 0.00 H new ATOM 0 HA PHE A 7 34.903 41.178 35.157 1.00 0.00 H new ATOM 0 HB2 PHE A 7 34.541 43.645 35.757 1.00 0.00 H new ATOM 0 HB3 PHE A 7 36.239 43.675 36.188 1.00 0.00 H new ATOM 0 HD1 PHE A 7 36.252 41.568 33.416 1.00 0.00 H new ATOM 0 HD2 PHE A 7 35.533 45.590 34.539 1.00 0.00 H new ATOM 0 HE1 PHE A 7 36.727 42.287 31.124 1.00 0.00 H new ATOM 0 HE2 PHE A 7 35.983 46.322 32.247 1.00 0.00 H new ATOM 0 HZ PHE A 7 36.582 44.667 30.528 1.00 0.00 H new ATOM 103 N ASN A 8 37.445 41.364 37.243 1.00 0.00 N ATOM 104 CA ASN A 8 38.799 41.019 37.545 1.00 0.00 C ATOM 105 C ASN A 8 38.894 39.572 37.890 1.00 0.00 C ATOM 106 O ASN A 8 39.857 38.885 37.553 1.00 0.00 O ATOM 107 CB ASN A 8 39.230 41.926 38.709 1.00 0.00 C ATOM 108 CG ASN A 8 40.735 41.963 38.939 1.00 0.00 C ATOM 109 OD1 ASN A 8 41.384 40.941 39.155 1.00 0.00 O ATOM 110 ND2 ASN A 8 41.308 43.196 38.933 1.00 0.00 N ATOM 0 H ASN A 8 36.996 41.855 38.016 1.00 0.00 H new ATOM 0 HA ASN A 8 39.461 41.172 36.692 1.00 0.00 H new ATOM 0 HB2 ASN A 8 38.877 42.939 38.517 1.00 0.00 H new ATOM 0 HB3 ASN A 8 38.741 41.586 39.622 1.00 0.00 H new ATOM 0 HD21 ASN A 8 42.307 43.295 39.112 1.00 0.00 H new ATOM 0 HD22 ASN A 8 40.738 44.022 38.750 1.00 0.00 H new ATOM 117 N ASN A 9 37.838 39.021 38.514 1.00 0.00 N ATOM 118 CA ASN A 9 37.634 37.616 38.683 1.00 0.00 C ATOM 119 C ASN A 9 37.470 36.908 37.381 1.00 0.00 C ATOM 120 O ASN A 9 37.889 35.761 37.230 1.00 0.00 O ATOM 121 CB ASN A 9 36.416 37.324 39.574 1.00 0.00 C ATOM 122 CG ASN A 9 36.773 37.409 41.051 1.00 0.00 C ATOM 123 OD1 ASN A 9 36.888 36.386 41.724 1.00 0.00 O ATOM 124 ND2 ASN A 9 36.947 38.644 41.594 1.00 0.00 N ATOM 0 H ASN A 9 37.090 39.583 38.920 1.00 0.00 H new ATOM 0 HA ASN A 9 38.533 37.240 39.170 1.00 0.00 H new ATOM 0 HB2 ASN A 9 35.621 38.035 39.349 1.00 0.00 H new ATOM 0 HB3 ASN A 9 36.029 36.330 39.349 1.00 0.00 H new ATOM 0 HD21 ASN A 9 37.179 38.738 42.583 1.00 0.00 H new ATOM 0 HD22 ASN A 9 36.846 39.476 41.012 1.00 0.00 H new ATOM 131 N ALA A 10 36.872 37.552 36.364 1.00 0.00 N ATOM 132 CA ALA A 10 36.812 37.022 35.037 1.00 0.00 C ATOM 133 C ALA A 10 38.142 37.069 34.366 1.00 0.00 C ATOM 134 O ALA A 10 38.577 36.069 33.798 1.00 0.00 O ATOM 135 CB ALA A 10 35.655 37.654 34.246 1.00 0.00 C ATOM 0 H ALA A 10 36.420 38.461 36.465 1.00 0.00 H new ATOM 0 HA ALA A 10 36.574 35.959 35.085 1.00 0.00 H new ATOM 0 HB1 ALA A 10 35.630 37.235 33.240 1.00 0.00 H new ATOM 0 HB2 ALA A 10 34.712 37.444 34.750 1.00 0.00 H new ATOM 0 HB3 ALA A 10 35.802 38.732 34.186 1.00 0.00 H new ATOM 141 N ILE A 11 38.895 38.178 34.479 1.00 0.00 N ATOM 142 CA ILE A 11 40.229 38.342 33.991 1.00 0.00 C ATOM 143 C ILE A 11 41.174 37.301 34.485 1.00 0.00 C ATOM 144 O ILE A 11 41.858 36.639 33.705 1.00 0.00 O ATOM 145 CB ILE A 11 40.854 39.651 34.369 1.00 0.00 C ATOM 146 CG1 ILE A 11 40.028 40.887 33.976 1.00 0.00 C ATOM 147 CG2 ILE A 11 42.224 39.847 33.697 1.00 0.00 C ATOM 148 CD1 ILE A 11 39.372 40.809 32.598 1.00 0.00 C ATOM 0 H ILE A 11 38.547 39.017 34.943 1.00 0.00 H new ATOM 0 HA ILE A 11 40.091 38.272 32.912 1.00 0.00 H new ATOM 0 HB ILE A 11 40.927 39.584 35.455 1.00 0.00 H new ATOM 0 HG12 ILE A 11 39.251 41.040 34.725 1.00 0.00 H new ATOM 0 HG13 ILE A 11 40.675 41.763 34.005 1.00 0.00 H new ATOM 0 HG21 ILE A 11 42.642 40.808 33.997 1.00 0.00 H new ATOM 0 HG22 ILE A 11 42.897 39.046 34.003 1.00 0.00 H new ATOM 0 HG23 ILE A 11 42.104 39.826 32.614 1.00 0.00 H new ATOM 0 HD11 ILE A 11 38.812 41.725 32.409 1.00 0.00 H new ATOM 0 HD12 ILE A 11 40.141 40.691 31.835 1.00 0.00 H new ATOM 0 HD13 ILE A 11 38.694 39.956 32.565 1.00 0.00 H new ATOM 160 N SER A 12 41.234 37.126 35.817 1.00 0.00 N ATOM 161 CA SER A 12 42.120 36.236 36.501 1.00 0.00 C ATOM 162 C SER A 12 42.017 34.825 36.032 1.00 0.00 C ATOM 163 O SER A 12 43.024 34.132 35.885 1.00 0.00 O ATOM 164 CB SER A 12 41.937 36.313 38.026 1.00 0.00 C ATOM 165 OG SER A 12 42.918 35.573 38.739 1.00 0.00 O ATOM 0 H SER A 12 40.626 37.638 36.456 1.00 0.00 H new ATOM 0 HA SER A 12 43.125 36.577 36.254 1.00 0.00 H new ATOM 0 HB2 SER A 12 41.977 37.356 38.339 1.00 0.00 H new ATOM 0 HB3 SER A 12 40.947 35.940 38.287 1.00 0.00 H new ATOM 0 HG SER A 12 42.756 35.658 39.702 1.00 0.00 H new ATOM 171 N TYR A 13 40.797 34.367 35.701 1.00 0.00 N ATOM 172 CA TYR A 13 40.556 33.080 35.126 1.00 0.00 C ATOM 173 C TYR A 13 41.151 32.931 33.769 1.00 0.00 C ATOM 174 O TYR A 13 41.931 32.012 33.525 1.00 0.00 O ATOM 175 CB TYR A 13 39.044 32.800 35.085 1.00 0.00 C ATOM 176 CG TYR A 13 38.728 31.387 34.730 1.00 0.00 C ATOM 177 CD1 TYR A 13 39.193 30.329 35.475 1.00 0.00 C ATOM 178 CD2 TYR A 13 37.950 31.135 33.625 1.00 0.00 C ATOM 179 CE1 TYR A 13 38.846 29.039 35.149 1.00 0.00 C ATOM 180 CE2 TYR A 13 37.582 29.851 33.298 1.00 0.00 C ATOM 181 CZ TYR A 13 38.030 28.803 34.067 1.00 0.00 C ATOM 182 OH TYR A 13 37.686 27.480 33.719 1.00 0.00 O ATOM 0 H TYR A 13 39.947 34.913 35.839 1.00 0.00 H new ATOM 0 HA TYR A 13 41.049 32.346 35.763 1.00 0.00 H new ATOM 0 HB2 TYR A 13 38.610 33.031 36.058 1.00 0.00 H new ATOM 0 HB3 TYR A 13 38.575 33.466 34.360 1.00 0.00 H new ATOM 0 HD1 TYR A 13 39.836 30.513 36.323 1.00 0.00 H new ATOM 0 HD2 TYR A 13 37.623 31.957 33.005 1.00 0.00 H new ATOM 0 HE1 TYR A 13 39.213 28.213 35.741 1.00 0.00 H new ATOM 0 HE2 TYR A 13 36.946 29.667 32.444 1.00 0.00 H new ATOM 0 HH TYR A 13 37.515 26.962 34.533 1.00 0.00 H new ATOM 192 N VAL A 14 40.859 33.839 32.822 1.00 0.00 N ATOM 193 CA VAL A 14 41.398 33.845 31.497 1.00 0.00 C ATOM 194 C VAL A 14 42.883 33.965 31.484 1.00 0.00 C ATOM 195 O VAL A 14 43.578 33.286 30.730 1.00 0.00 O ATOM 196 CB VAL A 14 40.810 34.953 30.675 1.00 0.00 C ATOM 197 CG1 VAL A 14 41.180 34.771 29.194 1.00 0.00 C ATOM 198 CG2 VAL A 14 39.275 34.898 30.760 1.00 0.00 C ATOM 0 H VAL A 14 40.213 34.610 32.989 1.00 0.00 H new ATOM 0 HA VAL A 14 41.129 32.883 31.061 1.00 0.00 H new ATOM 0 HB VAL A 14 41.196 35.898 31.056 1.00 0.00 H new ATOM 0 HG11 VAL A 14 40.747 35.582 28.608 1.00 0.00 H new ATOM 0 HG12 VAL A 14 42.265 34.784 29.086 1.00 0.00 H new ATOM 0 HG13 VAL A 14 40.791 33.818 28.836 1.00 0.00 H new ATOM 0 HG21 VAL A 14 38.848 35.704 30.162 1.00 0.00 H new ATOM 0 HG22 VAL A 14 38.924 33.939 30.380 1.00 0.00 H new ATOM 0 HG23 VAL A 14 38.964 35.013 31.798 1.00 0.00 H new ATOM 208 N ASN A 15 43.448 34.805 32.369 1.00 0.00 N ATOM 209 CA ASN A 15 44.856 34.879 32.613 1.00 0.00 C ATOM 210 C ASN A 15 45.478 33.602 33.062 1.00 0.00 C ATOM 211 O ASN A 15 46.490 33.167 32.516 1.00 0.00 O ATOM 212 CB ASN A 15 45.160 35.992 33.629 1.00 0.00 C ATOM 213 CG ASN A 15 46.631 36.387 33.648 1.00 0.00 C ATOM 214 OD1 ASN A 15 47.442 35.936 32.839 1.00 0.00 O ATOM 215 ND2 ASN A 15 47.015 37.265 34.611 1.00 0.00 N ATOM 0 H ASN A 15 42.905 35.457 32.936 1.00 0.00 H new ATOM 0 HA ASN A 15 45.306 35.105 31.646 1.00 0.00 H new ATOM 0 HB2 ASN A 15 44.556 36.868 33.393 1.00 0.00 H new ATOM 0 HB3 ASN A 15 44.865 35.660 34.624 1.00 0.00 H new ATOM 0 HD21 ASN A 15 47.989 37.561 34.672 1.00 0.00 H new ATOM 0 HD22 ASN A 15 46.329 37.628 35.273 1.00 0.00 H new ATOM 222 N LYS A 16 44.914 32.901 34.062 1.00 0.00 N ATOM 223 CA LYS A 16 45.346 31.620 34.529 1.00 0.00 C ATOM 224 C LYS A 16 45.323 30.577 33.466 1.00 0.00 C ATOM 225 O LYS A 16 46.245 29.773 33.336 1.00 0.00 O ATOM 226 CB LYS A 16 44.421 31.273 35.707 1.00 0.00 C ATOM 227 CG LYS A 16 44.358 29.804 36.131 1.00 0.00 C ATOM 228 CD LYS A 16 43.335 29.601 37.251 1.00 0.00 C ATOM 229 CE LYS A 16 43.883 29.909 38.646 1.00 0.00 C ATOM 230 NZ LYS A 16 42.788 30.381 39.523 1.00 0.00 N ATOM 0 H LYS A 16 44.106 33.251 34.576 1.00 0.00 H new ATOM 0 HA LYS A 16 46.390 31.654 34.840 1.00 0.00 H new ATOM 0 HB2 LYS A 16 44.735 31.861 36.569 1.00 0.00 H new ATOM 0 HB3 LYS A 16 43.412 31.596 35.452 1.00 0.00 H new ATOM 0 HG2 LYS A 16 44.092 29.185 35.274 1.00 0.00 H new ATOM 0 HG3 LYS A 16 45.341 29.476 36.468 1.00 0.00 H new ATOM 0 HD2 LYS A 16 42.470 30.237 37.061 1.00 0.00 H new ATOM 0 HD3 LYS A 16 42.983 28.570 37.228 1.00 0.00 H new ATOM 0 HE2 LYS A 16 44.343 29.017 39.071 1.00 0.00 H new ATOM 0 HE3 LYS A 16 44.662 30.669 38.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 43.169 30.605 40.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 42.357 31.234 39.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 42.067 29.636 39.610 1.00 0.00 H new ATOM 244 N ILE A 17 44.291 30.599 32.603 1.00 0.00 N ATOM 245 CA ILE A 17 44.138 29.785 31.438 1.00 0.00 C ATOM 246 C ILE A 17 45.222 30.056 30.451 1.00 0.00 C ATOM 247 O ILE A 17 45.913 29.137 30.014 1.00 0.00 O ATOM 248 CB ILE A 17 42.768 30.019 30.874 1.00 0.00 C ATOM 249 CG1 ILE A 17 41.731 29.322 31.771 1.00 0.00 C ATOM 250 CG2 ILE A 17 42.601 29.539 29.422 1.00 0.00 C ATOM 251 CD1 ILE A 17 40.282 29.576 31.356 1.00 0.00 C ATOM 0 H ILE A 17 43.504 31.235 32.732 1.00 0.00 H new ATOM 0 HA ILE A 17 44.230 28.730 31.697 1.00 0.00 H new ATOM 0 HB ILE A 17 42.615 31.098 30.856 1.00 0.00 H new ATOM 0 HG12 ILE A 17 41.919 28.248 31.760 1.00 0.00 H new ATOM 0 HG13 ILE A 17 41.869 29.659 32.798 1.00 0.00 H new ATOM 0 HG21 ILE A 17 41.584 29.743 29.086 1.00 0.00 H new ATOM 0 HG22 ILE A 17 43.308 30.066 28.781 1.00 0.00 H new ATOM 0 HG23 ILE A 17 42.793 28.467 29.369 1.00 0.00 H new ATOM 0 HD11 ILE A 17 39.611 29.051 32.036 1.00 0.00 H new ATOM 0 HD12 ILE A 17 40.075 30.645 31.395 1.00 0.00 H new ATOM 0 HD13 ILE A 17 40.125 29.213 30.340 1.00 0.00 H new ATOM 263 N LYS A 18 45.454 31.330 30.087 1.00 0.00 N ATOM 264 CA LYS A 18 46.474 31.744 29.176 1.00 0.00 C ATOM 265 C LYS A 18 47.845 31.373 29.626 1.00 0.00 C ATOM 266 O LYS A 18 48.669 30.910 28.838 1.00 0.00 O ATOM 267 CB LYS A 18 46.325 33.227 28.801 1.00 0.00 C ATOM 268 CG LYS A 18 47.343 34.233 29.343 1.00 0.00 C ATOM 269 CD LYS A 18 47.098 35.682 28.918 1.00 0.00 C ATOM 270 CE LYS A 18 46.776 35.847 27.431 1.00 0.00 C ATOM 271 NZ LYS A 18 47.120 37.191 26.914 1.00 0.00 N ATOM 0 H LYS A 18 44.902 32.109 30.446 1.00 0.00 H new ATOM 0 HA LYS A 18 46.329 31.180 28.255 1.00 0.00 H new ATOM 0 HB2 LYS A 18 46.342 33.295 27.713 1.00 0.00 H new ATOM 0 HB3 LYS A 18 45.336 33.551 29.126 1.00 0.00 H new ATOM 0 HG2 LYS A 18 47.339 34.182 30.432 1.00 0.00 H new ATOM 0 HG3 LYS A 18 48.338 33.935 29.014 1.00 0.00 H new ATOM 0 HD2 LYS A 18 46.274 36.088 29.505 1.00 0.00 H new ATOM 0 HD3 LYS A 18 47.981 36.274 29.156 1.00 0.00 H new ATOM 0 HE2 LYS A 18 47.319 35.094 26.861 1.00 0.00 H new ATOM 0 HE3 LYS A 18 45.714 35.663 27.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 47.207 37.153 25.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 46.372 37.865 27.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 48.023 37.501 27.326 1.00 0.00 H new ATOM 285 N THR A 19 48.127 31.512 30.934 1.00 0.00 N ATOM 286 CA THR A 19 49.384 31.229 31.553 1.00 0.00 C ATOM 287 C THR A 19 49.694 29.774 31.641 1.00 0.00 C ATOM 288 O THR A 19 50.860 29.386 31.586 1.00 0.00 O ATOM 289 CB THR A 19 49.432 31.851 32.917 1.00 0.00 C ATOM 290 OG1 THR A 19 49.157 33.243 32.850 1.00 0.00 O ATOM 291 CG2 THR A 19 50.835 31.762 33.539 1.00 0.00 C ATOM 0 H THR A 19 47.431 31.844 31.601 1.00 0.00 H new ATOM 0 HA THR A 19 50.150 31.665 30.912 1.00 0.00 H new ATOM 0 HB THR A 19 48.696 31.307 33.509 1.00 0.00 H new ATOM 0 HG1 THR A 19 48.212 33.380 32.629 1.00 0.00 H new ATOM 0 HG21 THR A 19 50.825 32.224 34.526 1.00 0.00 H new ATOM 0 HG22 THR A 19 51.127 30.716 33.631 1.00 0.00 H new ATOM 0 HG23 THR A 19 51.549 32.283 32.901 1.00 0.00 H new ATOM 299 N ARG A 20 48.699 28.877 31.765 1.00 0.00 N ATOM 300 CA ARG A 20 48.937 27.468 31.725 1.00 0.00 C ATOM 301 C ARG A 20 48.939 26.902 30.346 1.00 0.00 C ATOM 302 O ARG A 20 49.731 26.016 30.030 1.00 0.00 O ATOM 303 CB ARG A 20 47.930 26.737 32.629 1.00 0.00 C ATOM 304 CG ARG A 20 48.123 27.098 34.103 1.00 0.00 C ATOM 305 CD ARG A 20 47.089 26.459 35.033 1.00 0.00 C ATOM 306 NE ARG A 20 47.426 26.902 36.415 1.00 0.00 N ATOM 307 CZ ARG A 20 46.629 26.731 37.509 1.00 0.00 C ATOM 308 NH1 ARG A 20 45.428 26.084 37.459 1.00 0.00 N ATOM 309 NH2 ARG A 20 47.082 27.210 38.704 1.00 0.00 N ATOM 0 H ARG A 20 47.720 29.132 31.894 1.00 0.00 H new ATOM 0 HA ARG A 20 49.946 27.307 32.106 1.00 0.00 H new ATOM 0 HB2 ARG A 20 46.915 26.991 32.322 1.00 0.00 H new ATOM 0 HB3 ARG A 20 48.042 25.660 32.501 1.00 0.00 H new ATOM 0 HG2 ARG A 20 49.120 26.789 34.416 1.00 0.00 H new ATOM 0 HG3 ARG A 20 48.076 28.182 34.212 1.00 0.00 H new ATOM 0 HD2 ARG A 20 46.080 26.770 34.762 1.00 0.00 H new ATOM 0 HD3 ARG A 20 47.119 25.372 34.957 1.00 0.00 H new ATOM 0 HE ARG A 20 48.322 27.369 36.554 1.00 0.00 H new ATOM 0 HH11 ARG A 20 45.090 25.703 36.575 1.00 0.00 H new ATOM 0 HH12 ARG A 20 44.868 25.982 38.305 1.00 0.00 H new ATOM 0 HH21 ARG A 20 47.988 27.677 38.756 1.00 0.00 H new ATOM 0 HH22 ARG A 20 46.515 27.102 39.545 1.00 0.00 H new ATOM 323 N PHE A 21 48.086 27.399 29.432 1.00 0.00 N ATOM 324 CA PHE A 21 48.052 26.951 28.074 1.00 0.00 C ATOM 325 C PHE A 21 49.017 27.673 27.199 1.00 0.00 C ATOM 326 O PHE A 21 48.695 28.148 26.111 1.00 0.00 O ATOM 327 CB PHE A 21 46.630 27.023 27.494 1.00 0.00 C ATOM 328 CG PHE A 21 45.693 26.093 28.185 1.00 0.00 C ATOM 329 CD1 PHE A 21 45.963 24.750 28.306 1.00 0.00 C ATOM 330 CD2 PHE A 21 44.489 26.567 28.649 1.00 0.00 C ATOM 331 CE1 PHE A 21 45.053 23.903 28.892 1.00 0.00 C ATOM 332 CE2 PHE A 21 43.576 25.734 29.251 1.00 0.00 C ATOM 333 CZ PHE A 21 43.866 24.396 29.381 1.00 0.00 C ATOM 0 H PHE A 21 47.405 28.129 29.641 1.00 0.00 H new ATOM 0 HA PHE A 21 48.365 25.907 28.093 1.00 0.00 H new ATOM 0 HB2 PHE A 21 46.256 28.043 27.579 1.00 0.00 H new ATOM 0 HB3 PHE A 21 46.660 26.783 26.431 1.00 0.00 H new ATOM 0 HD1 PHE A 21 46.899 24.357 27.937 1.00 0.00 H new ATOM 0 HD2 PHE A 21 44.255 27.616 28.538 1.00 0.00 H new ATOM 0 HE1 PHE A 21 45.271 22.848 28.969 1.00 0.00 H new ATOM 0 HE2 PHE A 21 42.639 26.127 29.619 1.00 0.00 H new ATOM 0 HZ PHE A 21 43.164 23.734 29.866 1.00 0.00 H new ATOM 343 N LEU A 22 50.294 27.727 27.619 1.00 0.00 N ATOM 344 CA LEU A 22 51.395 28.199 26.838 1.00 0.00 C ATOM 345 C LEU A 22 52.005 27.114 26.018 1.00 0.00 C ATOM 346 O LEU A 22 52.384 27.318 24.866 1.00 0.00 O ATOM 347 CB LEU A 22 52.472 28.861 27.712 1.00 0.00 C ATOM 348 CG LEU A 22 51.921 30.098 28.442 1.00 0.00 C ATOM 349 CD1 LEU A 22 53.000 30.586 29.423 1.00 0.00 C ATOM 350 CD2 LEU A 22 51.493 31.255 27.522 1.00 0.00 C ATOM 0 H LEU A 22 50.572 27.425 28.553 1.00 0.00 H new ATOM 0 HA LEU A 22 50.988 28.950 26.162 1.00 0.00 H new ATOM 0 HB2 LEU A 22 52.843 28.141 28.442 1.00 0.00 H new ATOM 0 HB3 LEU A 22 53.319 29.151 27.091 1.00 0.00 H new ATOM 0 HG LEU A 22 51.008 29.788 28.950 1.00 0.00 H new ATOM 0 HD11 LEU A 22 52.636 31.464 29.956 1.00 0.00 H new ATOM 0 HD12 LEU A 22 53.226 29.795 30.138 1.00 0.00 H new ATOM 0 HD13 LEU A 22 53.903 30.845 28.871 1.00 0.00 H new ATOM 0 HD21 LEU A 22 51.119 32.081 28.127 1.00 0.00 H new ATOM 0 HD22 LEU A 22 52.350 31.592 26.938 1.00 0.00 H new ATOM 0 HD23 LEU A 22 50.707 30.913 26.849 1.00 0.00 H new ATOM 362 N ASP A 23 52.067 25.889 26.568 1.00 0.00 N ATOM 363 CA ASP A 23 52.447 24.715 25.845 1.00 0.00 C ATOM 364 C ASP A 23 51.409 24.275 24.871 1.00 0.00 C ATOM 365 O ASP A 23 51.668 23.480 23.968 1.00 0.00 O ATOM 366 CB ASP A 23 52.715 23.550 26.813 1.00 0.00 C ATOM 367 CG ASP A 23 54.101 23.679 27.428 1.00 0.00 C ATOM 368 OD1 ASP A 23 55.103 23.528 26.679 1.00 0.00 O ATOM 369 OD2 ASP A 23 54.199 23.838 28.674 1.00 0.00 O ATOM 0 H ASP A 23 51.846 25.709 27.547 1.00 0.00 H new ATOM 0 HA ASP A 23 53.349 24.980 25.294 1.00 0.00 H new ATOM 0 HB2 ASP A 23 51.961 23.542 27.600 1.00 0.00 H new ATOM 0 HB3 ASP A 23 52.633 22.602 26.282 1.00 0.00 H new ATOM 374 N HIS A 24 50.173 24.787 24.999 1.00 0.00 N ATOM 375 CA HIS A 24 49.083 24.417 24.149 1.00 0.00 C ATOM 376 C HIS A 24 48.345 25.636 23.714 1.00 0.00 C ATOM 377 O HIS A 24 47.246 25.850 24.223 1.00 0.00 O ATOM 378 CB HIS A 24 48.175 23.444 24.919 1.00 0.00 C ATOM 379 CG HIS A 24 48.808 22.143 25.317 1.00 0.00 C ATOM 380 ND1 HIS A 24 49.244 21.241 24.382 1.00 0.00 N ATOM 381 CD2 HIS A 24 48.879 21.516 26.522 1.00 0.00 C ATOM 382 CE1 HIS A 24 49.569 20.112 24.984 1.00 0.00 C ATOM 383 NE2 HIS A 24 49.349 20.252 26.277 1.00 0.00 N ATOM 0 H HIS A 24 49.924 25.475 25.710 1.00 0.00 H new ATOM 0 HA HIS A 24 49.446 23.920 23.250 1.00 0.00 H new ATOM 0 HB2 HIS A 24 47.818 23.944 25.819 1.00 0.00 H new ATOM 0 HB3 HIS A 24 47.300 23.229 24.305 1.00 0.00 H new ATOM 0 HD2 HIS A 24 48.617 21.932 27.483 1.00 0.00 H new ATOM 0 HE1 HIS A 24 49.950 19.225 24.500 1.00 0.00 H new ATOM 0 HE2 HIS A 24 49.504 19.533 26.983 1.00 0.00 H new ATOM 392 N PRO A 25 48.786 26.469 22.819 1.00 0.00 N ATOM 393 CA PRO A 25 48.172 27.740 22.568 1.00 0.00 C ATOM 394 C PRO A 25 46.858 27.659 21.869 1.00 0.00 C ATOM 395 O PRO A 25 46.184 28.672 21.691 1.00 0.00 O ATOM 396 CB PRO A 25 49.164 28.502 21.694 1.00 0.00 C ATOM 397 CG PRO A 25 50.512 27.806 21.941 1.00 0.00 C ATOM 398 CD PRO A 25 50.066 26.349 22.137 1.00 0.00 C ATOM 0 HA PRO A 25 47.956 28.225 23.520 1.00 0.00 H new ATOM 0 HB2 PRO A 25 48.882 28.457 20.642 1.00 0.00 H new ATOM 0 HB3 PRO A 25 49.206 29.556 21.968 1.00 0.00 H new ATOM 0 HG2 PRO A 25 51.193 27.918 21.097 1.00 0.00 H new ATOM 0 HG3 PRO A 25 51.024 28.201 22.818 1.00 0.00 H new ATOM 0 HD2 PRO A 25 49.965 25.830 21.184 1.00 0.00 H new ATOM 0 HD3 PRO A 25 50.786 25.786 22.732 1.00 0.00 H new ATOM 406 N GLU A 26 46.469 26.451 21.422 1.00 0.00 N ATOM 407 CA GLU A 26 45.257 26.166 20.719 1.00 0.00 C ATOM 408 C GLU A 26 44.100 26.051 21.651 1.00 0.00 C ATOM 409 O GLU A 26 42.961 26.292 21.255 1.00 0.00 O ATOM 410 CB GLU A 26 45.438 24.912 19.847 1.00 0.00 C ATOM 411 CG GLU A 26 45.764 23.636 20.626 1.00 0.00 C ATOM 412 CD GLU A 26 46.348 22.510 19.784 1.00 0.00 C ATOM 413 OE1 GLU A 26 46.630 22.710 18.573 1.00 0.00 O ATOM 414 OE2 GLU A 26 46.561 21.411 20.360 1.00 0.00 O ATOM 0 H GLU A 26 47.041 25.618 21.562 1.00 0.00 H new ATOM 0 HA GLU A 26 45.029 27.001 20.056 1.00 0.00 H new ATOM 0 HB2 GLU A 26 44.525 24.749 19.274 1.00 0.00 H new ATOM 0 HB3 GLU A 26 46.236 25.097 19.128 1.00 0.00 H new ATOM 0 HG2 GLU A 26 46.469 23.881 21.420 1.00 0.00 H new ATOM 0 HG3 GLU A 26 44.854 23.278 21.107 1.00 0.00 H new ATOM 421 N ILE A 27 44.320 25.731 22.938 1.00 0.00 N ATOM 422 CA ILE A 27 43.279 25.585 23.909 1.00 0.00 C ATOM 423 C ILE A 27 42.691 26.916 24.233 1.00 0.00 C ATOM 424 O ILE A 27 41.473 27.075 24.276 1.00 0.00 O ATOM 425 CB ILE A 27 43.696 24.959 25.207 1.00 0.00 C ATOM 426 CG1 ILE A 27 44.767 23.857 25.155 1.00 0.00 C ATOM 427 CG2 ILE A 27 42.460 24.315 25.857 1.00 0.00 C ATOM 428 CD1 ILE A 27 44.659 22.905 23.965 1.00 0.00 C ATOM 0 H ILE A 27 45.253 25.568 23.316 1.00 0.00 H new ATOM 0 HA ILE A 27 42.565 24.910 23.437 1.00 0.00 H new ATOM 0 HB ILE A 27 44.141 25.788 25.757 1.00 0.00 H new ATOM 0 HG12 ILE A 27 45.750 24.328 25.136 1.00 0.00 H new ATOM 0 HG13 ILE A 27 44.711 23.273 26.074 1.00 0.00 H new ATOM 0 HG21 ILE A 27 42.745 23.854 26.803 1.00 0.00 H new ATOM 0 HG22 ILE A 27 41.704 25.079 26.039 1.00 0.00 H new ATOM 0 HG23 ILE A 27 42.053 23.554 25.191 1.00 0.00 H new ATOM 0 HD11 ILE A 27 45.457 22.165 24.018 1.00 0.00 H new ATOM 0 HD12 ILE A 27 43.694 22.400 23.990 1.00 0.00 H new ATOM 0 HD13 ILE A 27 44.749 23.470 23.037 1.00 0.00 H new ATOM 440 N TYR A 28 43.573 27.918 24.400 1.00 0.00 N ATOM 441 CA TYR A 28 43.274 29.297 24.629 1.00 0.00 C ATOM 442 C TYR A 28 42.294 29.840 23.648 1.00 0.00 C ATOM 443 O TYR A 28 41.321 30.482 24.039 1.00 0.00 O ATOM 444 CB TYR A 28 44.566 30.134 24.653 1.00 0.00 C ATOM 445 CG TYR A 28 44.306 31.558 25.004 1.00 0.00 C ATOM 446 CD1 TYR A 28 43.988 31.909 26.296 1.00 0.00 C ATOM 447 CD2 TYR A 28 44.303 32.527 24.030 1.00 0.00 C ATOM 448 CE1 TYR A 28 43.667 33.208 26.610 1.00 0.00 C ATOM 449 CE2 TYR A 28 43.976 33.829 24.334 1.00 0.00 C ATOM 450 CZ TYR A 28 43.663 34.171 25.628 1.00 0.00 C ATOM 451 OH TYR A 28 43.339 35.503 25.962 1.00 0.00 O ATOM 0 H TYR A 28 44.578 27.747 24.372 1.00 0.00 H new ATOM 0 HA TYR A 28 42.799 29.366 25.607 1.00 0.00 H new ATOM 0 HB2 TYR A 28 45.262 29.705 25.374 1.00 0.00 H new ATOM 0 HB3 TYR A 28 45.048 30.084 23.676 1.00 0.00 H new ATOM 0 HD1 TYR A 28 43.991 31.157 27.071 1.00 0.00 H new ATOM 0 HD2 TYR A 28 44.560 32.264 23.015 1.00 0.00 H new ATOM 0 HE1 TYR A 28 43.418 33.472 27.627 1.00 0.00 H new ATOM 0 HE2 TYR A 28 43.965 34.580 23.558 1.00 0.00 H new ATOM 0 HH TYR A 28 43.382 36.062 25.158 1.00 0.00 H new ATOM 461 N ARG A 29 42.486 29.561 22.347 1.00 0.00 N ATOM 462 CA ARG A 29 41.565 29.923 21.314 1.00 0.00 C ATOM 463 C ARG A 29 40.345 29.072 21.243 1.00 0.00 C ATOM 464 O ARG A 29 39.223 29.570 21.155 1.00 0.00 O ATOM 465 CB ARG A 29 42.277 29.966 19.951 1.00 0.00 C ATOM 466 CG ARG A 29 43.080 31.264 19.843 1.00 0.00 C ATOM 467 CD ARG A 29 43.395 31.626 18.391 1.00 0.00 C ATOM 468 NE ARG A 29 43.781 33.065 18.382 1.00 0.00 N ATOM 469 CZ ARG A 29 44.213 33.708 17.258 1.00 0.00 C ATOM 470 NH1 ARG A 29 44.657 33.025 16.162 1.00 0.00 N ATOM 471 NH2 ARG A 29 44.155 35.071 17.221 1.00 0.00 N ATOM 0 H ARG A 29 43.309 29.067 22.002 1.00 0.00 H new ATOM 0 HA ARG A 29 41.206 30.918 21.578 1.00 0.00 H new ATOM 0 HB2 ARG A 29 42.938 29.106 19.845 1.00 0.00 H new ATOM 0 HB3 ARG A 29 41.547 29.908 19.144 1.00 0.00 H new ATOM 0 HG2 ARG A 29 42.519 32.076 20.305 1.00 0.00 H new ATOM 0 HG3 ARG A 29 44.011 31.161 20.401 1.00 0.00 H new ATOM 0 HD2 ARG A 29 44.204 31.006 18.004 1.00 0.00 H new ATOM 0 HD3 ARG A 29 42.528 31.454 17.753 1.00 0.00 H new ATOM 0 HE ARG A 29 43.720 33.592 19.253 1.00 0.00 H new ATOM 0 HH11 ARG A 29 44.672 32.005 16.168 1.00 0.00 H new ATOM 0 HH12 ARG A 29 44.973 33.535 15.337 1.00 0.00 H new ATOM 0 HH21 ARG A 29 43.794 35.588 18.023 1.00 0.00 H new ATOM 0 HH22 ARG A 29 44.472 35.573 16.392 1.00 0.00 H new ATOM 485 N SER A 30 40.494 27.736 21.282 1.00 0.00 N ATOM 486 CA SER A 30 39.429 26.819 21.014 1.00 0.00 C ATOM 487 C SER A 30 38.367 26.821 22.058 1.00 0.00 C ATOM 488 O SER A 30 37.193 26.621 21.751 1.00 0.00 O ATOM 489 CB SER A 30 39.911 25.377 20.788 1.00 0.00 C ATOM 490 OG SER A 30 40.921 25.319 19.792 1.00 0.00 O ATOM 0 H SER A 30 41.379 27.281 21.506 1.00 0.00 H new ATOM 0 HA SER A 30 38.997 27.190 20.085 1.00 0.00 H new ATOM 0 HB2 SER A 30 40.296 24.970 21.723 1.00 0.00 H new ATOM 0 HB3 SER A 30 39.069 24.752 20.491 1.00 0.00 H new ATOM 0 HG SER A 30 41.794 25.496 20.201 1.00 0.00 H new ATOM 496 N PHE A 31 38.710 27.090 23.330 1.00 0.00 N ATOM 497 CA PHE A 31 37.722 27.252 24.351 1.00 0.00 C ATOM 498 C PHE A 31 36.834 28.438 24.185 1.00 0.00 C ATOM 499 O PHE A 31 35.645 28.379 24.495 1.00 0.00 O ATOM 500 CB PHE A 31 38.270 27.066 25.776 1.00 0.00 C ATOM 501 CG PHE A 31 38.474 28.289 26.601 1.00 0.00 C ATOM 502 CD1 PHE A 31 39.618 29.039 26.457 1.00 0.00 C ATOM 503 CD2 PHE A 31 37.538 28.664 27.537 1.00 0.00 C ATOM 504 CE1 PHE A 31 39.815 30.167 27.218 1.00 0.00 C ATOM 505 CE2 PHE A 31 37.751 29.763 28.335 1.00 0.00 C ATOM 506 CZ PHE A 31 38.885 30.522 28.168 1.00 0.00 C ATOM 0 H PHE A 31 39.672 27.195 23.652 1.00 0.00 H new ATOM 0 HA PHE A 31 37.045 26.411 24.199 1.00 0.00 H new ATOM 0 HB2 PHE A 31 37.589 26.407 26.315 1.00 0.00 H new ATOM 0 HB3 PHE A 31 39.225 26.546 25.703 1.00 0.00 H new ATOM 0 HD1 PHE A 31 40.368 28.739 25.740 1.00 0.00 H new ATOM 0 HD2 PHE A 31 36.629 28.091 27.646 1.00 0.00 H new ATOM 0 HE1 PHE A 31 40.697 30.773 27.071 1.00 0.00 H new ATOM 0 HE2 PHE A 31 37.028 30.030 29.092 1.00 0.00 H new ATOM 0 HZ PHE A 31 39.046 31.396 28.782 1.00 0.00 H new ATOM 516 N LEU A 32 37.345 29.565 23.658 1.00 0.00 N ATOM 517 CA LEU A 32 36.569 30.746 23.443 1.00 0.00 C ATOM 518 C LEU A 32 35.550 30.560 22.372 1.00 0.00 C ATOM 519 O LEU A 32 34.417 31.024 22.484 1.00 0.00 O ATOM 520 CB LEU A 32 37.350 31.991 22.987 1.00 0.00 C ATOM 521 CG LEU A 32 38.801 32.135 23.476 1.00 0.00 C ATOM 522 CD1 LEU A 32 39.590 32.992 22.472 1.00 0.00 C ATOM 523 CD2 LEU A 32 38.935 32.702 24.900 1.00 0.00 C ATOM 0 H LEU A 32 38.321 29.657 23.375 1.00 0.00 H new ATOM 0 HA LEU A 32 36.148 30.909 24.435 1.00 0.00 H new ATOM 0 HB2 LEU A 32 37.359 32.002 21.897 1.00 0.00 H new ATOM 0 HB3 LEU A 32 36.797 32.873 23.310 1.00 0.00 H new ATOM 0 HG LEU A 32 39.216 31.129 23.531 1.00 0.00 H new ATOM 0 HD11 LEU A 32 40.620 33.097 22.814 1.00 0.00 H new ATOM 0 HD12 LEU A 32 39.580 32.509 21.495 1.00 0.00 H new ATOM 0 HD13 LEU A 32 39.131 33.977 22.395 1.00 0.00 H new ATOM 0 HD21 LEU A 32 39.990 32.771 25.166 1.00 0.00 H new ATOM 0 HD22 LEU A 32 38.485 33.694 24.941 1.00 0.00 H new ATOM 0 HD23 LEU A 32 38.425 32.043 25.603 1.00 0.00 H new ATOM 535 N GLU A 33 35.938 29.891 21.271 1.00 0.00 N ATOM 536 CA GLU A 33 35.091 29.527 20.178 1.00 0.00 C ATOM 537 C GLU A 33 33.825 28.837 20.550 1.00 0.00 C ATOM 538 O GLU A 33 32.770 29.105 19.980 1.00 0.00 O ATOM 539 CB GLU A 33 35.863 28.710 19.127 1.00 0.00 C ATOM 540 CG GLU A 33 36.941 29.514 18.397 1.00 0.00 C ATOM 541 CD GLU A 33 36.405 30.663 17.555 1.00 0.00 C ATOM 542 OE1 GLU A 33 35.229 30.628 17.101 1.00 0.00 O ATOM 543 OE2 GLU A 33 37.183 31.620 17.298 1.00 0.00 O ATOM 0 H GLU A 33 36.902 29.586 21.137 1.00 0.00 H new ATOM 0 HA GLU A 33 34.777 30.480 19.751 1.00 0.00 H new ATOM 0 HB2 GLU A 33 36.328 27.853 19.615 1.00 0.00 H new ATOM 0 HB3 GLU A 33 35.158 28.316 18.395 1.00 0.00 H new ATOM 0 HG2 GLU A 33 37.640 29.913 19.132 1.00 0.00 H new ATOM 0 HG3 GLU A 33 37.506 28.840 17.753 1.00 0.00 H new ATOM 550 N ILE A 34 33.844 27.973 21.582 1.00 0.00 N ATOM 551 CA ILE A 34 32.692 27.357 22.163 1.00 0.00 C ATOM 552 C ILE A 34 31.803 28.357 22.821 1.00 0.00 C ATOM 553 O ILE A 34 30.600 28.396 22.566 1.00 0.00 O ATOM 554 CB ILE A 34 33.140 26.271 23.095 1.00 0.00 C ATOM 555 CG1 ILE A 34 33.863 25.156 22.321 1.00 0.00 C ATOM 556 CG2 ILE A 34 31.952 25.695 23.883 1.00 0.00 C ATOM 557 CD1 ILE A 34 34.813 24.343 23.199 1.00 0.00 C ATOM 0 H ILE A 34 34.713 27.689 22.035 1.00 0.00 H new ATOM 0 HA ILE A 34 32.084 26.906 21.378 1.00 0.00 H new ATOM 0 HB ILE A 34 33.840 26.708 23.808 1.00 0.00 H new ATOM 0 HG12 ILE A 34 33.123 24.488 21.880 1.00 0.00 H new ATOM 0 HG13 ILE A 34 34.425 25.597 21.498 1.00 0.00 H new ATOM 0 HG21 ILE A 34 32.305 24.909 24.551 1.00 0.00 H new ATOM 0 HG22 ILE A 34 31.486 26.487 24.469 1.00 0.00 H new ATOM 0 HG23 ILE A 34 31.222 25.279 23.188 1.00 0.00 H new ATOM 0 HD11 ILE A 34 35.294 23.572 22.598 1.00 0.00 H new ATOM 0 HD12 ILE A 34 35.573 25.002 23.620 1.00 0.00 H new ATOM 0 HD13 ILE A 34 34.251 23.875 24.007 1.00 0.00 H new ATOM 569 N LEU A 35 32.321 29.279 23.652 1.00 0.00 N ATOM 570 CA LEU A 35 31.530 30.303 24.258 1.00 0.00 C ATOM 571 C LEU A 35 30.992 31.298 23.289 1.00 0.00 C ATOM 572 O LEU A 35 29.890 31.830 23.421 1.00 0.00 O ATOM 573 CB LEU A 35 32.352 31.085 25.297 1.00 0.00 C ATOM 574 CG LEU A 35 33.323 30.274 26.173 1.00 0.00 C ATOM 575 CD1 LEU A 35 33.515 31.086 27.465 1.00 0.00 C ATOM 576 CD2 LEU A 35 32.909 28.892 26.706 1.00 0.00 C ATOM 0 H LEU A 35 33.308 29.313 23.907 1.00 0.00 H new ATOM 0 HA LEU A 35 30.695 29.775 24.717 1.00 0.00 H new ATOM 0 HB2 LEU A 35 32.927 31.847 24.771 1.00 0.00 H new ATOM 0 HB3 LEU A 35 31.658 31.607 25.955 1.00 0.00 H new ATOM 0 HG LEU A 35 34.165 30.104 25.502 1.00 0.00 H new ATOM 0 HD11 LEU A 35 34.198 30.557 28.129 1.00 0.00 H new ATOM 0 HD12 LEU A 35 33.930 32.064 27.222 1.00 0.00 H new ATOM 0 HD13 LEU A 35 32.553 31.213 27.961 1.00 0.00 H new ATOM 0 HD21 LEU A 35 33.720 28.474 27.302 1.00 0.00 H new ATOM 0 HD22 LEU A 35 32.018 28.993 27.326 1.00 0.00 H new ATOM 0 HD23 LEU A 35 32.695 28.228 25.868 1.00 0.00 H new ATOM 588 N HIS A 36 31.769 31.580 22.228 1.00 0.00 N ATOM 589 CA HIS A 36 31.406 32.379 21.100 1.00 0.00 C ATOM 590 C HIS A 36 30.307 31.777 20.294 1.00 0.00 C ATOM 591 O HIS A 36 29.542 32.509 19.666 1.00 0.00 O ATOM 592 CB HIS A 36 32.580 32.577 20.125 1.00 0.00 C ATOM 593 CG HIS A 36 33.760 33.398 20.555 1.00 0.00 C ATOM 594 ND1 HIS A 36 33.647 34.706 20.944 1.00 0.00 N ATOM 595 CD2 HIS A 36 35.090 33.162 20.395 1.00 0.00 C ATOM 596 CE1 HIS A 36 34.849 35.245 21.032 1.00 0.00 C ATOM 597 NE2 HIS A 36 35.738 34.325 20.712 1.00 0.00 N ATOM 0 H HIS A 36 32.721 31.222 22.155 1.00 0.00 H new ATOM 0 HA HIS A 36 31.089 33.326 21.537 1.00 0.00 H new ATOM 0 HB2 HIS A 36 32.950 31.589 19.853 1.00 0.00 H new ATOM 0 HB3 HIS A 36 32.180 33.029 19.217 1.00 0.00 H new ATOM 0 HD1 HIS A 36 32.770 35.189 21.136 1.00 0.00 H new ATOM 0 HD2 HIS A 36 35.546 32.236 20.079 1.00 0.00 H new ATOM 0 HE1 HIS A 36 35.067 36.264 21.317 1.00 0.00 H new ATOM 606 N THR A 37 30.120 30.445 20.300 1.00 0.00 N ATOM 607 CA THR A 37 29.002 29.781 19.705 1.00 0.00 C ATOM 608 C THR A 37 27.705 30.242 20.277 1.00 0.00 C ATOM 609 O THR A 37 26.692 30.356 19.589 1.00 0.00 O ATOM 610 CB THR A 37 29.142 28.288 19.705 1.00 0.00 C ATOM 611 OG1 THR A 37 28.980 27.742 18.405 1.00 0.00 O ATOM 612 CG2 THR A 37 28.135 27.546 20.600 1.00 0.00 C ATOM 0 H THR A 37 30.778 29.802 20.740 1.00 0.00 H new ATOM 0 HA THR A 37 28.995 30.073 18.655 1.00 0.00 H new ATOM 0 HB THR A 37 30.149 28.138 20.095 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.080 26.768 18.445 1.00 0.00 H new ATOM 0 HG21 THR A 37 28.313 26.473 20.536 1.00 0.00 H new ATOM 0 HG22 THR A 37 28.256 27.873 21.633 1.00 0.00 H new ATOM 0 HG23 THR A 37 27.121 27.766 20.267 1.00 0.00 H new ATOM 620 N TYR A 38 27.715 30.618 21.569 1.00 0.00 N ATOM 621 CA TYR A 38 26.665 31.381 22.167 1.00 0.00 C ATOM 622 C TYR A 38 26.732 32.817 21.775 1.00 0.00 C ATOM 623 O TYR A 38 25.802 33.331 21.154 1.00 0.00 O ATOM 624 CB TYR A 38 26.684 31.118 23.683 1.00 0.00 C ATOM 625 CG TYR A 38 26.222 32.132 24.670 1.00 0.00 C ATOM 626 CD1 TYR A 38 25.247 33.067 24.406 1.00 0.00 C ATOM 627 CD2 TYR A 38 26.765 32.079 25.932 1.00 0.00 C ATOM 628 CE1 TYR A 38 24.903 34.004 25.351 1.00 0.00 C ATOM 629 CE2 TYR A 38 26.388 32.978 26.902 1.00 0.00 C ATOM 630 CZ TYR A 38 25.463 33.951 26.606 1.00 0.00 C ATOM 631 OH TYR A 38 25.070 34.891 27.582 1.00 0.00 O ATOM 0 H TYR A 38 28.471 30.386 22.213 1.00 0.00 H new ATOM 0 HA TYR A 38 25.692 31.063 21.794 1.00 0.00 H new ATOM 0 HB2 TYR A 38 26.088 30.221 23.853 1.00 0.00 H new ATOM 0 HB3 TYR A 38 27.713 30.871 23.945 1.00 0.00 H new ATOM 0 HD1 TYR A 38 24.748 33.064 23.448 1.00 0.00 H new ATOM 0 HD2 TYR A 38 27.498 31.321 26.165 1.00 0.00 H new ATOM 0 HE1 TYR A 38 24.194 34.781 25.108 1.00 0.00 H new ATOM 0 HE2 TYR A 38 26.817 32.920 27.892 1.00 0.00 H new ATOM 0 HH TYR A 38 25.507 34.681 28.433 1.00 0.00 H new ATOM 641 N GLN A 39 27.821 33.534 22.103 1.00 0.00 N ATOM 642 CA GLN A 39 27.758 34.963 22.099 1.00 0.00 C ATOM 643 C GLN A 39 27.873 35.675 20.796 1.00 0.00 C ATOM 644 O GLN A 39 27.423 36.814 20.680 1.00 0.00 O ATOM 645 CB GLN A 39 28.602 35.529 23.254 1.00 0.00 C ATOM 646 CG GLN A 39 30.130 35.476 23.187 1.00 0.00 C ATOM 647 CD GLN A 39 30.749 36.280 22.053 1.00 0.00 C ATOM 648 OE1 GLN A 39 31.193 35.714 21.055 1.00 0.00 O ATOM 649 NE2 GLN A 39 30.845 37.628 22.207 1.00 0.00 N ATOM 0 H GLN A 39 28.724 33.138 22.365 1.00 0.00 H new ATOM 0 HA GLN A 39 26.712 35.202 22.289 1.00 0.00 H new ATOM 0 HB2 GLN A 39 28.320 36.574 23.379 1.00 0.00 H new ATOM 0 HB3 GLN A 39 28.300 35.007 24.162 1.00 0.00 H new ATOM 0 HG2 GLN A 39 30.534 35.838 24.132 1.00 0.00 H new ATOM 0 HG3 GLN A 39 30.439 34.436 23.086 1.00 0.00 H new ATOM 0 HE21 GLN A 39 30.469 38.074 23.044 1.00 0.00 H new ATOM 0 HE22 GLN A 39 31.293 38.193 21.486 1.00 0.00 H new ATOM 898 N SER A 54 21.984 25.850 25.909 1.00 0.00 N ATOM 899 CA SER A 54 22.251 25.159 27.132 1.00 0.00 C ATOM 900 C SER A 54 23.605 25.521 27.640 1.00 0.00 C ATOM 901 O SER A 54 24.628 25.394 26.969 1.00 0.00 O ATOM 902 CB SER A 54 22.084 23.633 27.052 1.00 0.00 C ATOM 903 OG SER A 54 23.017 22.998 26.188 1.00 0.00 O ATOM 0 HA SER A 54 21.489 25.491 27.837 1.00 0.00 H new ATOM 0 HB2 SER A 54 22.185 23.213 28.053 1.00 0.00 H new ATOM 0 HB3 SER A 54 21.074 23.405 26.711 1.00 0.00 H new ATOM 0 HG SER A 54 22.855 22.031 26.186 1.00 0.00 H new ATOM 909 N GLU A 55 23.667 25.951 28.913 1.00 0.00 N ATOM 910 CA GLU A 55 24.879 26.225 29.621 1.00 0.00 C ATOM 911 C GLU A 55 25.665 24.977 29.825 1.00 0.00 C ATOM 912 O GLU A 55 26.894 24.972 29.867 1.00 0.00 O ATOM 913 CB GLU A 55 24.534 26.878 30.970 1.00 0.00 C ATOM 914 CG GLU A 55 24.002 28.298 30.765 1.00 0.00 C ATOM 915 CD GLU A 55 23.439 28.946 32.021 1.00 0.00 C ATOM 916 OE1 GLU A 55 23.477 28.315 33.111 1.00 0.00 O ATOM 917 OE2 GLU A 55 22.899 30.077 31.894 1.00 0.00 O ATOM 0 H GLU A 55 22.832 26.115 29.475 1.00 0.00 H new ATOM 0 HA GLU A 55 25.493 26.908 29.035 1.00 0.00 H new ATOM 0 HB2 GLU A 55 23.788 26.277 31.490 1.00 0.00 H new ATOM 0 HB3 GLU A 55 25.420 26.905 31.604 1.00 0.00 H new ATOM 0 HG2 GLU A 55 24.808 28.922 30.379 1.00 0.00 H new ATOM 0 HG3 GLU A 55 23.223 28.275 30.003 1.00 0.00 H new ATOM 924 N GLU A 56 24.944 23.841 29.843 1.00 0.00 N ATOM 925 CA GLU A 56 25.433 22.499 29.764 1.00 0.00 C ATOM 926 C GLU A 56 26.373 22.249 28.635 1.00 0.00 C ATOM 927 O GLU A 56 27.367 21.553 28.833 1.00 0.00 O ATOM 928 CB GLU A 56 24.255 21.513 29.673 1.00 0.00 C ATOM 929 CG GLU A 56 23.249 21.633 30.819 1.00 0.00 C ATOM 930 CD GLU A 56 22.090 20.653 30.714 1.00 0.00 C ATOM 931 OE1 GLU A 56 22.328 19.416 30.768 1.00 0.00 O ATOM 932 OE2 GLU A 56 20.921 21.116 30.636 1.00 0.00 O ATOM 0 H GLU A 56 23.927 23.867 29.920 1.00 0.00 H new ATOM 0 HA GLU A 56 26.005 22.343 30.679 1.00 0.00 H new ATOM 0 HB2 GLU A 56 23.734 21.672 28.729 1.00 0.00 H new ATOM 0 HB3 GLU A 56 24.647 20.496 29.653 1.00 0.00 H new ATOM 0 HG2 GLU A 56 23.766 21.471 31.765 1.00 0.00 H new ATOM 0 HG3 GLU A 56 22.855 22.649 30.841 1.00 0.00 H new ATOM 939 N GLU A 57 26.148 22.777 27.418 1.00 0.00 N ATOM 940 CA GLU A 57 26.925 22.409 26.275 1.00 0.00 C ATOM 941 C GLU A 57 28.185 23.201 26.200 1.00 0.00 C ATOM 942 O GLU A 57 29.264 22.719 25.860 1.00 0.00 O ATOM 943 CB GLU A 57 26.184 22.402 24.927 1.00 0.00 C ATOM 944 CG GLU A 57 26.328 23.653 24.057 1.00 0.00 C ATOM 945 CD GLU A 57 25.656 23.503 22.700 1.00 0.00 C ATOM 946 OE1 GLU A 57 24.406 23.359 22.646 1.00 0.00 O ATOM 947 OE2 GLU A 57 26.396 23.500 21.679 1.00 0.00 O ATOM 0 H GLU A 57 25.421 23.465 27.225 1.00 0.00 H new ATOM 0 HA GLU A 57 27.165 21.360 26.446 1.00 0.00 H new ATOM 0 HB2 GLU A 57 26.533 21.545 24.351 1.00 0.00 H new ATOM 0 HB3 GLU A 57 25.123 22.244 25.123 1.00 0.00 H new ATOM 0 HG2 GLU A 57 25.896 24.506 24.580 1.00 0.00 H new ATOM 0 HG3 GLU A 57 27.386 23.870 23.912 1.00 0.00 H new ATOM 954 N VAL A 58 28.074 24.497 26.540 1.00 0.00 N ATOM 955 CA VAL A 58 29.148 25.440 26.488 1.00 0.00 C ATOM 956 C VAL A 58 30.189 25.114 27.503 1.00 0.00 C ATOM 957 O VAL A 58 31.397 25.241 27.307 1.00 0.00 O ATOM 958 CB VAL A 58 28.569 26.823 26.547 1.00 0.00 C ATOM 959 CG1 VAL A 58 28.557 27.437 27.958 1.00 0.00 C ATOM 960 CG2 VAL A 58 29.409 27.739 25.641 1.00 0.00 C ATOM 0 H VAL A 58 27.198 24.906 26.865 1.00 0.00 H new ATOM 0 HA VAL A 58 29.693 25.386 25.546 1.00 0.00 H new ATOM 0 HB VAL A 58 27.531 26.741 26.223 1.00 0.00 H new ATOM 0 HG11 VAL A 58 28.124 28.436 27.916 1.00 0.00 H new ATOM 0 HG12 VAL A 58 27.961 26.811 28.622 1.00 0.00 H new ATOM 0 HG13 VAL A 58 29.577 27.499 28.336 1.00 0.00 H new ATOM 0 HG21 VAL A 58 29.004 28.750 25.670 1.00 0.00 H new ATOM 0 HG22 VAL A 58 30.441 27.751 25.992 1.00 0.00 H new ATOM 0 HG23 VAL A 58 29.379 27.365 24.617 1.00 0.00 H new ATOM 970 N PHE A 59 29.699 24.550 28.620 1.00 0.00 N ATOM 971 CA PHE A 59 30.420 23.779 29.583 1.00 0.00 C ATOM 972 C PHE A 59 31.017 22.536 29.021 1.00 0.00 C ATOM 973 O PHE A 59 32.237 22.384 29.058 1.00 0.00 O ATOM 974 CB PHE A 59 29.478 23.485 30.763 1.00 0.00 C ATOM 975 CG PHE A 59 29.999 22.621 31.859 1.00 0.00 C ATOM 976 CD1 PHE A 59 30.903 23.111 32.773 1.00 0.00 C ATOM 977 CD2 PHE A 59 29.543 21.330 31.993 1.00 0.00 C ATOM 978 CE1 PHE A 59 31.364 22.317 33.797 1.00 0.00 C ATOM 979 CE2 PHE A 59 29.994 20.534 33.019 1.00 0.00 C ATOM 980 CZ PHE A 59 30.907 21.026 33.921 1.00 0.00 C ATOM 0 H PHE A 59 28.714 24.642 28.869 1.00 0.00 H new ATOM 0 HA PHE A 59 31.277 24.361 29.923 1.00 0.00 H new ATOM 0 HB2 PHE A 59 29.178 24.438 31.199 1.00 0.00 H new ATOM 0 HB3 PHE A 59 28.577 23.018 30.366 1.00 0.00 H new ATOM 0 HD1 PHE A 59 31.254 24.129 32.686 1.00 0.00 H new ATOM 0 HD2 PHE A 59 28.825 20.939 31.287 1.00 0.00 H new ATOM 0 HE1 PHE A 59 32.083 22.707 34.502 1.00 0.00 H new ATOM 0 HE2 PHE A 59 29.631 19.522 33.116 1.00 0.00 H new ATOM 0 HZ PHE A 59 31.265 20.400 34.725 1.00 0.00 H new ATOM 990 N THR A 60 30.220 21.601 28.472 1.00 0.00 N ATOM 991 CA THR A 60 30.594 20.325 27.944 1.00 0.00 C ATOM 992 C THR A 60 31.797 20.309 27.066 1.00 0.00 C ATOM 993 O THR A 60 32.713 19.505 27.234 1.00 0.00 O ATOM 994 CB THR A 60 29.460 19.545 27.349 1.00 0.00 C ATOM 995 OG1 THR A 60 29.438 18.202 27.811 1.00 0.00 O ATOM 996 CG2 THR A 60 29.409 19.460 25.814 1.00 0.00 C ATOM 0 H THR A 60 29.215 21.757 28.391 1.00 0.00 H new ATOM 0 HA THR A 60 30.901 19.797 28.847 1.00 0.00 H new ATOM 0 HB THR A 60 28.602 20.128 27.684 1.00 0.00 H new ATOM 0 HG1 THR A 60 28.684 17.728 27.402 1.00 0.00 H new ATOM 0 HG21 THR A 60 28.544 18.870 25.511 1.00 0.00 H new ATOM 0 HG22 THR A 60 29.328 20.464 25.397 1.00 0.00 H new ATOM 0 HG23 THR A 60 30.319 18.986 25.445 1.00 0.00 H new ATOM 1004 N GLU A 61 31.864 21.230 26.089 1.00 0.00 N ATOM 1005 CA GLU A 61 32.942 21.287 25.152 1.00 0.00 C ATOM 1006 C GLU A 61 34.177 21.889 25.732 1.00 0.00 C ATOM 1007 O GLU A 61 35.290 21.485 25.394 1.00 0.00 O ATOM 1008 CB GLU A 61 32.498 21.841 23.788 1.00 0.00 C ATOM 1009 CG GLU A 61 31.477 20.928 23.108 1.00 0.00 C ATOM 1010 CD GLU A 61 31.140 21.287 21.668 1.00 0.00 C ATOM 1011 OE1 GLU A 61 32.071 21.537 20.856 1.00 0.00 O ATOM 1012 OE2 GLU A 61 29.935 21.233 21.305 1.00 0.00 O ATOM 0 H GLU A 61 31.155 21.950 25.947 1.00 0.00 H new ATOM 0 HA GLU A 61 33.245 20.264 24.930 1.00 0.00 H new ATOM 0 HB2 GLU A 61 32.066 22.833 23.922 1.00 0.00 H new ATOM 0 HB3 GLU A 61 33.368 21.957 23.142 1.00 0.00 H new ATOM 0 HG2 GLU A 61 31.856 19.906 23.131 1.00 0.00 H new ATOM 0 HG3 GLU A 61 30.557 20.940 23.693 1.00 0.00 H new ATOM 1019 N VAL A 62 34.076 22.818 26.698 1.00 0.00 N ATOM 1020 CA VAL A 62 35.206 23.395 27.359 1.00 0.00 C ATOM 1021 C VAL A 62 35.857 22.467 28.326 1.00 0.00 C ATOM 1022 O VAL A 62 37.063 22.437 28.567 1.00 0.00 O ATOM 1023 CB VAL A 62 34.838 24.663 28.072 1.00 0.00 C ATOM 1024 CG1 VAL A 62 36.012 25.246 28.876 1.00 0.00 C ATOM 1025 CG2 VAL A 62 34.399 25.669 26.994 1.00 0.00 C ATOM 0 H VAL A 62 33.182 23.179 27.030 1.00 0.00 H new ATOM 0 HA VAL A 62 35.922 23.612 26.566 1.00 0.00 H new ATOM 0 HB VAL A 62 34.044 24.457 28.789 1.00 0.00 H new ATOM 0 HG11 VAL A 62 35.693 26.162 29.373 1.00 0.00 H new ATOM 0 HG12 VAL A 62 36.336 24.522 29.624 1.00 0.00 H new ATOM 0 HG13 VAL A 62 36.840 25.467 28.202 1.00 0.00 H new ATOM 0 HG21 VAL A 62 34.121 26.611 27.467 1.00 0.00 H new ATOM 0 HG22 VAL A 62 35.222 25.841 26.300 1.00 0.00 H new ATOM 0 HG23 VAL A 62 33.543 25.269 26.450 1.00 0.00 H new ATOM 1035 N ALA A 63 35.028 21.582 28.908 1.00 0.00 N ATOM 1036 CA ALA A 63 35.442 20.585 29.845 1.00 0.00 C ATOM 1037 C ALA A 63 36.344 19.597 29.186 1.00 0.00 C ATOM 1038 O ALA A 63 37.357 19.190 29.753 1.00 0.00 O ATOM 1039 CB ALA A 63 34.223 19.860 30.441 1.00 0.00 C ATOM 0 H ALA A 63 34.026 21.561 28.717 1.00 0.00 H new ATOM 0 HA ALA A 63 35.984 21.080 30.651 1.00 0.00 H new ATOM 0 HB1 ALA A 63 34.560 19.105 31.152 1.00 0.00 H new ATOM 0 HB2 ALA A 63 33.585 20.581 30.953 1.00 0.00 H new ATOM 0 HB3 ALA A 63 33.659 19.379 29.642 1.00 0.00 H new ATOM 1045 N ASN A 64 36.051 19.226 27.928 1.00 0.00 N ATOM 1046 CA ASN A 64 36.807 18.221 27.247 1.00 0.00 C ATOM 1047 C ASN A 64 38.192 18.647 26.902 1.00 0.00 C ATOM 1048 O ASN A 64 39.146 17.875 26.982 1.00 0.00 O ATOM 1049 CB ASN A 64 36.069 17.580 26.061 1.00 0.00 C ATOM 1050 CG ASN A 64 36.168 18.257 24.700 1.00 0.00 C ATOM 1051 OD1 ASN A 64 37.238 18.406 24.114 1.00 0.00 O ATOM 1052 ND2 ASN A 64 35.002 18.643 24.116 1.00 0.00 N ATOM 0 H ASN A 64 35.288 19.623 27.380 1.00 0.00 H new ATOM 0 HA ASN A 64 36.917 17.424 27.982 1.00 0.00 H new ATOM 0 HB2 ASN A 64 36.436 16.560 25.953 1.00 0.00 H new ATOM 0 HB3 ASN A 64 35.013 17.513 26.323 1.00 0.00 H new ATOM 0 HD21 ASN A 64 35.011 19.060 23.185 1.00 0.00 H new ATOM 0 HD22 ASN A 64 34.118 18.516 24.609 1.00 0.00 H new ATOM 1059 N LEU A 65 38.344 19.916 26.483 1.00 0.00 N ATOM 1060 CA LEU A 65 39.575 20.463 26.003 1.00 0.00 C ATOM 1061 C LEU A 65 40.510 20.853 27.096 1.00 0.00 C ATOM 1062 O LEU A 65 41.720 20.955 26.897 1.00 0.00 O ATOM 1063 CB LEU A 65 39.251 21.493 24.908 1.00 0.00 C ATOM 1064 CG LEU A 65 39.422 22.985 25.239 1.00 0.00 C ATOM 1065 CD1 LEU A 65 39.768 23.793 23.976 1.00 0.00 C ATOM 1066 CD2 LEU A 65 38.114 23.508 25.856 1.00 0.00 C ATOM 0 H LEU A 65 37.577 20.589 26.479 1.00 0.00 H new ATOM 0 HA LEU A 65 40.187 19.707 25.511 1.00 0.00 H new ATOM 0 HB2 LEU A 65 39.878 21.270 24.045 1.00 0.00 H new ATOM 0 HB3 LEU A 65 38.217 21.337 24.600 1.00 0.00 H new ATOM 0 HG LEU A 65 40.243 23.102 25.946 1.00 0.00 H new ATOM 0 HD11 LEU A 65 39.884 24.845 24.237 1.00 0.00 H new ATOM 0 HD12 LEU A 65 40.699 23.421 23.550 1.00 0.00 H new ATOM 0 HD13 LEU A 65 38.966 23.687 23.245 1.00 0.00 H new ATOM 0 HD21 LEU A 65 38.222 24.566 26.096 1.00 0.00 H new ATOM 0 HD22 LEU A 65 37.299 23.379 25.144 1.00 0.00 H new ATOM 0 HD23 LEU A 65 37.893 22.951 26.766 1.00 0.00 H new ATOM 1078 N PHE A 66 39.973 21.039 28.315 1.00 0.00 N ATOM 1079 CA PHE A 66 40.720 21.356 29.491 1.00 0.00 C ATOM 1080 C PHE A 66 41.073 20.131 30.262 1.00 0.00 C ATOM 1081 O PHE A 66 42.094 20.093 30.946 1.00 0.00 O ATOM 1082 CB PHE A 66 39.937 22.307 30.412 1.00 0.00 C ATOM 1083 CG PHE A 66 39.854 23.728 29.974 1.00 0.00 C ATOM 1084 CD1 PHE A 66 40.369 24.205 28.792 1.00 0.00 C ATOM 1085 CD2 PHE A 66 39.240 24.617 30.826 1.00 0.00 C ATOM 1086 CE1 PHE A 66 40.286 25.537 28.463 1.00 0.00 C ATOM 1087 CE2 PHE A 66 39.155 25.955 30.519 1.00 0.00 C ATOM 1088 CZ PHE A 66 39.684 26.413 29.335 1.00 0.00 C ATOM 0 H PHE A 66 38.971 20.965 28.488 1.00 0.00 H new ATOM 0 HA PHE A 66 41.634 21.845 29.154 1.00 0.00 H new ATOM 0 HB2 PHE A 66 38.923 21.922 30.519 1.00 0.00 H new ATOM 0 HB3 PHE A 66 40.395 22.280 31.401 1.00 0.00 H new ATOM 0 HD1 PHE A 66 40.848 23.520 28.109 1.00 0.00 H new ATOM 0 HD2 PHE A 66 38.817 24.258 31.753 1.00 0.00 H new ATOM 0 HE1 PHE A 66 40.690 25.893 27.527 1.00 0.00 H new ATOM 0 HE2 PHE A 66 38.676 26.641 31.202 1.00 0.00 H new ATOM 0 HZ PHE A 66 39.626 27.463 29.090 1.00 0.00 H new ATOM 1098 N ARG A 67 40.233 19.085 30.172 1.00 0.00 N ATOM 1099 CA ARG A 67 40.253 17.857 30.905 1.00 0.00 C ATOM 1100 C ARG A 67 41.588 17.253 31.173 1.00 0.00 C ATOM 1101 O ARG A 67 42.384 17.018 30.265 1.00 0.00 O ATOM 1102 CB ARG A 67 39.351 16.824 30.209 1.00 0.00 C ATOM 1103 CG ARG A 67 38.209 16.269 31.062 1.00 0.00 C ATOM 1104 CD ARG A 67 38.571 15.153 32.044 1.00 0.00 C ATOM 1105 NE ARG A 67 38.948 13.979 31.208 1.00 0.00 N ATOM 1106 CZ ARG A 67 39.122 12.711 31.684 1.00 0.00 C ATOM 1107 NH1 ARG A 67 39.023 12.392 33.007 1.00 0.00 N ATOM 1108 NH2 ARG A 67 39.421 11.718 30.797 1.00 0.00 N ATOM 0 H ARG A 67 39.455 19.105 29.512 1.00 0.00 H new ATOM 0 HA ARG A 67 39.881 18.132 31.892 1.00 0.00 H new ATOM 0 HB2 ARG A 67 38.925 17.282 29.316 1.00 0.00 H new ATOM 0 HB3 ARG A 67 39.971 15.991 29.876 1.00 0.00 H new ATOM 0 HG2 ARG A 67 37.774 17.093 31.627 1.00 0.00 H new ATOM 0 HG3 ARG A 67 37.433 15.897 30.393 1.00 0.00 H new ATOM 0 HD2 ARG A 67 39.396 15.454 32.690 1.00 0.00 H new ATOM 0 HD3 ARG A 67 37.728 14.916 32.693 1.00 0.00 H new ATOM 0 HE ARG A 67 39.086 14.133 30.209 1.00 0.00 H new ATOM 0 HH11 ARG A 67 38.810 13.117 33.692 1.00 0.00 H new ATOM 0 HH12 ARG A 67 39.162 11.428 33.311 1.00 0.00 H new ATOM 0 HH21 ARG A 67 39.510 11.931 29.804 1.00 0.00 H new ATOM 0 HH22 ARG A 67 39.556 10.762 31.128 1.00 0.00 H new ATOM 1122 N GLY A 68 41.889 17.014 32.462 1.00 0.00 N ATOM 1123 CA GLY A 68 43.217 16.782 32.941 1.00 0.00 C ATOM 1124 C GLY A 68 43.573 17.853 33.913 1.00 0.00 C ATOM 1125 O GLY A 68 44.106 17.593 34.990 1.00 0.00 O ATOM 0 H GLY A 68 41.183 16.981 33.197 1.00 0.00 H new ATOM 0 HA2 GLY A 68 43.280 15.804 33.418 1.00 0.00 H new ATOM 0 HA3 GLY A 68 43.922 16.778 32.110 1.00 0.00 H new ATOM 1129 N GLN A 69 43.273 19.114 33.554 1.00 0.00 N ATOM 1130 CA GLN A 69 43.428 20.242 34.419 1.00 0.00 C ATOM 1131 C GLN A 69 42.123 20.623 35.027 1.00 0.00 C ATOM 1132 O GLN A 69 41.371 21.478 34.558 1.00 0.00 O ATOM 1133 CB GLN A 69 44.074 21.430 33.685 1.00 0.00 C ATOM 1134 CG GLN A 69 45.520 21.111 33.299 1.00 0.00 C ATOM 1135 CD GLN A 69 46.267 22.342 32.807 1.00 0.00 C ATOM 1136 OE1 GLN A 69 46.721 23.173 33.591 1.00 0.00 O ATOM 1137 NE2 GLN A 69 46.414 22.453 31.459 1.00 0.00 N ATOM 0 H GLN A 69 42.911 19.356 32.632 1.00 0.00 H new ATOM 0 HA GLN A 69 44.104 19.956 35.225 1.00 0.00 H new ATOM 0 HB2 GLN A 69 43.498 21.667 32.790 1.00 0.00 H new ATOM 0 HB3 GLN A 69 44.050 22.314 34.323 1.00 0.00 H new ATOM 0 HG2 GLN A 69 46.040 20.692 34.160 1.00 0.00 H new ATOM 0 HG3 GLN A 69 45.527 20.348 32.520 1.00 0.00 H new ATOM 0 HE21 GLN A 69 46.022 21.741 30.843 1.00 0.00 H new ATOM 0 HE22 GLN A 69 46.916 23.248 31.065 1.00 0.00 H new ATOM 1146 N GLU A 70 41.840 19.970 36.169 1.00 0.00 N ATOM 1147 CA GLU A 70 40.586 19.953 36.855 1.00 0.00 C ATOM 1148 C GLU A 70 40.291 21.218 37.585 1.00 0.00 C ATOM 1149 O GLU A 70 39.139 21.610 37.760 1.00 0.00 O ATOM 1150 CB GLU A 70 40.597 18.780 37.849 1.00 0.00 C ATOM 1151 CG GLU A 70 40.909 17.415 37.230 1.00 0.00 C ATOM 1152 CD GLU A 70 39.875 16.962 36.209 1.00 0.00 C ATOM 1153 OE1 GLU A 70 38.687 16.780 36.588 1.00 0.00 O ATOM 1154 OE2 GLU A 70 40.239 16.743 35.023 1.00 0.00 O ATOM 0 H GLU A 70 42.545 19.410 36.649 1.00 0.00 H new ATOM 0 HA GLU A 70 39.802 19.841 36.106 1.00 0.00 H new ATOM 0 HB2 GLU A 70 41.333 18.988 38.626 1.00 0.00 H new ATOM 0 HB3 GLU A 70 39.624 18.727 38.338 1.00 0.00 H new ATOM 0 HG2 GLU A 70 41.887 17.457 36.751 1.00 0.00 H new ATOM 0 HG3 GLU A 70 40.975 16.671 38.024 1.00 0.00 H new ATOM 1161 N ASP A 71 41.356 21.929 37.999 1.00 0.00 N ATOM 1162 CA ASP A 71 41.364 23.172 38.705 1.00 0.00 C ATOM 1163 C ASP A 71 40.556 24.230 38.036 1.00 0.00 C ATOM 1164 O ASP A 71 39.791 24.967 38.656 1.00 0.00 O ATOM 1165 CB ASP A 71 42.846 23.566 38.813 1.00 0.00 C ATOM 1166 CG ASP A 71 43.156 24.679 39.804 1.00 0.00 C ATOM 1167 OD1 ASP A 71 42.308 25.006 40.676 1.00 0.00 O ATOM 1168 OD2 ASP A 71 44.293 25.216 39.724 1.00 0.00 O ATOM 0 H ASP A 71 42.304 21.597 37.820 1.00 0.00 H new ATOM 0 HA ASP A 71 40.897 23.063 39.684 1.00 0.00 H new ATOM 0 HB2 ASP A 71 43.420 22.683 39.094 1.00 0.00 H new ATOM 0 HB3 ASP A 71 43.195 23.873 37.827 1.00 0.00 H new ATOM 1173 N LEU A 72 40.647 24.314 36.697 1.00 0.00 N ATOM 1174 CA LEU A 72 39.950 25.298 35.928 1.00 0.00 C ATOM 1175 C LEU A 72 38.468 25.142 35.911 1.00 0.00 C ATOM 1176 O LEU A 72 37.738 26.127 36.003 1.00 0.00 O ATOM 1177 CB LEU A 72 40.503 25.330 34.494 1.00 0.00 C ATOM 1178 CG LEU A 72 42.019 25.567 34.388 1.00 0.00 C ATOM 1179 CD1 LEU A 72 42.404 25.604 32.899 1.00 0.00 C ATOM 1180 CD2 LEU A 72 42.499 26.865 35.059 1.00 0.00 C ATOM 0 H LEU A 72 41.219 23.683 36.135 1.00 0.00 H new ATOM 0 HA LEU A 72 40.132 26.249 36.429 1.00 0.00 H new ATOM 0 HB2 LEU A 72 40.263 24.385 34.007 1.00 0.00 H new ATOM 0 HB3 LEU A 72 39.988 26.114 33.939 1.00 0.00 H new ATOM 0 HG LEU A 72 42.505 24.748 34.919 1.00 0.00 H new ATOM 0 HD11 LEU A 72 43.477 25.771 32.805 1.00 0.00 H new ATOM 0 HD12 LEU A 72 42.142 24.655 32.432 1.00 0.00 H new ATOM 0 HD13 LEU A 72 41.866 26.412 32.404 1.00 0.00 H new ATOM 0 HD21 LEU A 72 43.578 26.958 34.940 1.00 0.00 H new ATOM 0 HD22 LEU A 72 42.007 27.719 34.593 1.00 0.00 H new ATOM 0 HD23 LEU A 72 42.252 26.839 36.120 1.00 0.00 H new ATOM 1192 N LEU A 73 37.904 23.925 35.815 1.00 0.00 N ATOM 1193 CA LEU A 73 36.492 23.741 35.685 1.00 0.00 C ATOM 1194 C LEU A 73 35.739 23.971 36.950 1.00 0.00 C ATOM 1195 O LEU A 73 34.556 24.310 36.960 1.00 0.00 O ATOM 1196 CB LEU A 73 36.112 22.344 35.165 1.00 0.00 C ATOM 1197 CG LEU A 73 36.425 22.117 33.676 1.00 0.00 C ATOM 1198 CD1 LEU A 73 35.921 23.268 32.789 1.00 0.00 C ATOM 1199 CD2 LEU A 73 37.920 21.831 33.457 1.00 0.00 C ATOM 0 H LEU A 73 38.436 23.055 35.828 1.00 0.00 H new ATOM 0 HA LEU A 73 36.207 24.499 34.955 1.00 0.00 H new ATOM 0 HB2 LEU A 73 36.640 21.594 35.754 1.00 0.00 H new ATOM 0 HB3 LEU A 73 35.046 22.186 35.329 1.00 0.00 H new ATOM 0 HG LEU A 73 35.874 21.230 33.365 1.00 0.00 H new ATOM 0 HD11 LEU A 73 36.167 23.059 31.748 1.00 0.00 H new ATOM 0 HD12 LEU A 73 34.840 23.363 32.895 1.00 0.00 H new ATOM 0 HD13 LEU A 73 36.398 24.199 33.095 1.00 0.00 H new ATOM 0 HD21 LEU A 73 38.109 21.675 32.395 1.00 0.00 H new ATOM 0 HD22 LEU A 73 38.508 22.678 33.810 1.00 0.00 H new ATOM 0 HD23 LEU A 73 38.204 20.936 34.011 1.00 0.00 H new ATOM 1211 N SER A 74 36.468 23.876 38.076 1.00 0.00 N ATOM 1212 CA SER A 74 36.052 24.248 39.392 1.00 0.00 C ATOM 1213 C SER A 74 35.644 25.682 39.429 1.00 0.00 C ATOM 1214 O SER A 74 34.543 26.037 39.845 1.00 0.00 O ATOM 1215 CB SER A 74 37.136 23.966 40.446 1.00 0.00 C ATOM 1216 OG SER A 74 36.725 24.274 41.770 1.00 0.00 O ATOM 0 H SER A 74 37.420 23.511 38.064 1.00 0.00 H new ATOM 0 HA SER A 74 35.190 23.630 39.643 1.00 0.00 H new ATOM 0 HB2 SER A 74 37.417 22.914 40.396 1.00 0.00 H new ATOM 0 HB3 SER A 74 38.027 24.546 40.205 1.00 0.00 H new ATOM 0 HG SER A 74 37.454 24.073 42.394 1.00 0.00 H new ATOM 1222 N GLU A 75 36.507 26.572 38.906 1.00 0.00 N ATOM 1223 CA GLU A 75 36.258 27.970 38.742 1.00 0.00 C ATOM 1224 C GLU A 75 35.346 28.328 37.620 1.00 0.00 C ATOM 1225 O GLU A 75 34.780 29.421 37.624 1.00 0.00 O ATOM 1226 CB GLU A 75 37.589 28.735 38.655 1.00 0.00 C ATOM 1227 CG GLU A 75 38.329 28.714 39.993 1.00 0.00 C ATOM 1228 CD GLU A 75 39.645 29.476 39.901 1.00 0.00 C ATOM 1229 OE1 GLU A 75 40.567 29.009 39.181 1.00 0.00 O ATOM 1230 OE2 GLU A 75 39.793 30.525 40.584 1.00 0.00 O ATOM 0 H GLU A 75 37.433 26.298 38.579 1.00 0.00 H new ATOM 0 HA GLU A 75 35.710 28.278 39.633 1.00 0.00 H new ATOM 0 HB2 GLU A 75 38.217 28.291 37.883 1.00 0.00 H new ATOM 0 HB3 GLU A 75 37.400 29.766 38.358 1.00 0.00 H new ATOM 0 HG2 GLU A 75 37.702 29.157 40.767 1.00 0.00 H new ATOM 0 HG3 GLU A 75 38.522 27.683 40.290 1.00 0.00 H new ATOM 1237 N PHE A 76 35.112 27.448 36.631 1.00 0.00 N ATOM 1238 CA PHE A 76 34.188 27.693 35.566 1.00 0.00 C ATOM 1239 C PHE A 76 32.779 27.867 36.019 1.00 0.00 C ATOM 1240 O PHE A 76 31.957 28.516 35.375 1.00 0.00 O ATOM 1241 CB PHE A 76 34.294 26.584 34.505 1.00 0.00 C ATOM 1242 CG PHE A 76 33.770 26.939 33.157 1.00 0.00 C ATOM 1243 CD1 PHE A 76 34.589 27.525 32.221 1.00 0.00 C ATOM 1244 CD2 PHE A 76 32.488 26.604 32.788 1.00 0.00 C ATOM 1245 CE1 PHE A 76 34.165 27.739 30.931 1.00 0.00 C ATOM 1246 CE2 PHE A 76 32.055 26.800 31.498 1.00 0.00 C ATOM 1247 CZ PHE A 76 32.897 27.353 30.563 1.00 0.00 C ATOM 0 H PHE A 76 35.577 26.542 36.569 1.00 0.00 H new ATOM 0 HA PHE A 76 34.472 28.648 35.124 1.00 0.00 H new ATOM 0 HB2 PHE A 76 35.341 26.298 34.406 1.00 0.00 H new ATOM 0 HB3 PHE A 76 33.757 25.707 34.866 1.00 0.00 H new ATOM 0 HD1 PHE A 76 35.587 27.824 32.505 1.00 0.00 H new ATOM 0 HD2 PHE A 76 31.814 26.183 33.519 1.00 0.00 H new ATOM 0 HE1 PHE A 76 34.822 28.206 30.212 1.00 0.00 H new ATOM 0 HE2 PHE A 76 31.050 26.519 31.219 1.00 0.00 H new ATOM 0 HZ PHE A 76 32.565 27.484 29.544 1.00 0.00 H new ATOM 1257 N GLY A 77 32.442 27.354 37.216 1.00 0.00 N ATOM 1258 CA GLY A 77 31.157 27.470 37.834 1.00 0.00 C ATOM 1259 C GLY A 77 30.740 28.848 38.219 1.00 0.00 C ATOM 1260 O GLY A 77 29.550 29.117 38.375 1.00 0.00 O ATOM 0 H GLY A 77 33.105 26.828 37.785 1.00 0.00 H new ATOM 0 HA2 GLY A 77 30.410 27.063 37.153 1.00 0.00 H new ATOM 0 HA3 GLY A 77 31.148 26.846 38.728 1.00 0.00 H new ATOM 1264 N GLN A 78 31.672 29.808 38.357 1.00 0.00 N ATOM 1265 CA GLN A 78 31.342 31.169 38.641 1.00 0.00 C ATOM 1266 C GLN A 78 30.607 31.857 37.540 1.00 0.00 C ATOM 1267 O GLN A 78 29.856 32.804 37.766 1.00 0.00 O ATOM 1268 CB GLN A 78 32.608 31.962 39.004 1.00 0.00 C ATOM 1269 CG GLN A 78 33.509 32.356 37.832 1.00 0.00 C ATOM 1270 CD GLN A 78 34.858 32.874 38.310 1.00 0.00 C ATOM 1271 OE1 GLN A 78 34.974 33.956 38.882 1.00 0.00 O ATOM 1272 NE2 GLN A 78 35.936 32.085 38.056 1.00 0.00 N ATOM 0 H GLN A 78 32.673 29.635 38.270 1.00 0.00 H new ATOM 0 HA GLN A 78 30.660 31.139 39.491 1.00 0.00 H new ATOM 0 HB2 GLN A 78 32.307 32.870 39.527 1.00 0.00 H new ATOM 0 HB3 GLN A 78 33.195 31.370 39.706 1.00 0.00 H new ATOM 0 HG2 GLN A 78 33.659 31.494 37.182 1.00 0.00 H new ATOM 0 HG3 GLN A 78 33.015 33.123 37.235 1.00 0.00 H new ATOM 0 HE21 GLN A 78 35.813 31.191 37.580 1.00 0.00 H new ATOM 0 HE22 GLN A 78 36.868 32.387 38.342 1.00 0.00 H new ATOM 1466 N ASN B 201 28.446 35.845 33.894 1.00 0.00 N ATOM 1467 CA ASN B 201 27.990 34.901 32.922 1.00 0.00 C ATOM 1468 C ASN B 201 29.137 34.591 32.022 1.00 0.00 C ATOM 1469 O ASN B 201 30.122 35.328 31.992 1.00 0.00 O ATOM 1470 CB ASN B 201 26.797 35.498 32.158 1.00 0.00 C ATOM 1471 CG ASN B 201 26.196 34.552 31.130 1.00 0.00 C ATOM 1472 OD1 ASN B 201 26.410 34.714 29.929 1.00 0.00 O ATOM 1473 ND2 ASN B 201 25.474 33.502 31.605 1.00 0.00 N ATOM 0 HA ASN B 201 27.646 33.976 33.385 1.00 0.00 H new ATOM 0 HB2 ASN B 201 26.025 35.783 32.873 1.00 0.00 H new ATOM 0 HB3 ASN B 201 27.118 36.410 31.656 1.00 0.00 H new ATOM 0 HD21 ASN B 201 25.088 32.814 30.958 1.00 0.00 H new ATOM 0 HD22 ASN B 201 25.318 33.402 32.608 1.00 0.00 H new ATOM 1480 N ILE B 202 29.037 33.529 31.203 1.00 0.00 N ATOM 1481 CA ILE B 202 29.905 33.168 30.125 1.00 0.00 C ATOM 1482 C ILE B 202 30.251 34.293 29.211 1.00 0.00 C ATOM 1483 O ILE B 202 31.386 34.405 28.750 1.00 0.00 O ATOM 1484 CB ILE B 202 29.331 31.995 29.389 1.00 0.00 C ATOM 1485 CG1 ILE B 202 29.538 30.681 30.162 1.00 0.00 C ATOM 1486 CG2 ILE B 202 29.757 31.915 27.913 1.00 0.00 C ATOM 1487 CD1 ILE B 202 30.952 30.120 30.306 1.00 0.00 C ATOM 0 H ILE B 202 28.274 32.860 31.308 1.00 0.00 H new ATOM 0 HA ILE B 202 30.860 32.885 30.567 1.00 0.00 H new ATOM 0 HB ILE B 202 28.255 32.162 29.343 1.00 0.00 H new ATOM 0 HG12 ILE B 202 29.137 30.823 31.165 1.00 0.00 H new ATOM 0 HG13 ILE B 202 28.928 29.917 29.680 1.00 0.00 H new ATOM 0 HG21 ILE B 202 29.301 31.040 27.450 1.00 0.00 H new ATOM 0 HG22 ILE B 202 29.430 32.814 27.391 1.00 0.00 H new ATOM 0 HG23 ILE B 202 30.842 31.834 27.851 1.00 0.00 H new ATOM 0 HD11 ILE B 202 30.919 29.192 30.877 1.00 0.00 H new ATOM 0 HD12 ILE B 202 31.368 29.923 29.318 1.00 0.00 H new ATOM 0 HD13 ILE B 202 31.579 30.844 30.826 1.00 0.00 H new ATOM 1499 N GLN B 203 29.313 35.220 28.950 1.00 0.00 N ATOM 1500 CA GLN B 203 29.503 36.441 28.229 1.00 0.00 C ATOM 1501 C GLN B 203 30.673 37.273 28.630 1.00 0.00 C ATOM 1502 O GLN B 203 31.339 37.885 27.796 1.00 0.00 O ATOM 1503 CB GLN B 203 28.192 37.241 28.313 1.00 0.00 C ATOM 1504 CG GLN B 203 28.186 38.603 27.615 1.00 0.00 C ATOM 1505 CD GLN B 203 28.307 39.755 28.602 1.00 0.00 C ATOM 1506 OE1 GLN B 203 27.388 40.063 29.359 1.00 0.00 O ATOM 1507 NE2 GLN B 203 29.498 40.411 28.608 1.00 0.00 N ATOM 0 H GLN B 203 28.350 35.107 29.267 1.00 0.00 H new ATOM 0 HA GLN B 203 29.751 36.163 27.205 1.00 0.00 H new ATOM 0 HB2 GLN B 203 27.393 36.634 27.888 1.00 0.00 H new ATOM 0 HB3 GLN B 203 27.951 37.394 29.365 1.00 0.00 H new ATOM 0 HG2 GLN B 203 29.010 38.648 26.903 1.00 0.00 H new ATOM 0 HG3 GLN B 203 27.265 38.712 27.043 1.00 0.00 H new ATOM 0 HE21 GLN B 203 30.239 40.129 27.966 1.00 0.00 H new ATOM 0 HE22 GLN B 203 29.651 41.185 29.254 1.00 0.00 H new ATOM 1516 N MET B 204 31.034 37.301 29.924 1.00 0.00 N ATOM 1517 CA MET B 204 32.183 37.995 30.419 1.00 0.00 C ATOM 1518 C MET B 204 33.492 37.432 29.984 1.00 0.00 C ATOM 1519 O MET B 204 34.490 38.149 29.958 1.00 0.00 O ATOM 1520 CB MET B 204 32.125 38.059 31.954 1.00 0.00 C ATOM 1521 CG MET B 204 31.269 39.242 32.412 1.00 0.00 C ATOM 1522 SD MET B 204 30.793 39.228 34.167 1.00 0.00 S ATOM 1523 CE MET B 204 32.399 39.839 34.755 1.00 0.00 C ATOM 0 H MET B 204 30.506 36.823 30.654 1.00 0.00 H new ATOM 0 HA MET B 204 32.137 38.992 29.981 1.00 0.00 H new ATOM 0 HB2 MET B 204 31.711 37.130 32.347 1.00 0.00 H new ATOM 0 HB3 MET B 204 33.133 38.155 32.358 1.00 0.00 H new ATOM 0 HG2 MET B 204 31.814 40.163 32.208 1.00 0.00 H new ATOM 0 HG3 MET B 204 30.362 39.268 31.807 1.00 0.00 H new ATOM 0 HE1 MET B 204 32.515 39.598 35.812 1.00 0.00 H new ATOM 0 HE2 MET B 204 33.199 39.367 34.185 1.00 0.00 H new ATOM 0 HE3 MET B 204 32.448 40.920 34.622 1.00 0.00 H new ATOM 1533 N LEU B 205 33.554 36.147 29.589 1.00 0.00 N ATOM 1534 CA LEU B 205 34.768 35.500 29.202 1.00 0.00 C ATOM 1535 C LEU B 205 35.365 35.981 27.924 1.00 0.00 C ATOM 1536 O LEU B 205 36.577 36.158 27.817 1.00 0.00 O ATOM 1537 CB LEU B 205 34.648 33.967 29.210 1.00 0.00 C ATOM 1538 CG LEU B 205 34.683 33.331 30.610 1.00 0.00 C ATOM 1539 CD1 LEU B 205 34.486 31.807 30.535 1.00 0.00 C ATOM 1540 CD2 LEU B 205 36.019 33.636 31.306 1.00 0.00 C ATOM 0 H LEU B 205 32.735 35.541 29.538 1.00 0.00 H new ATOM 0 HA LEU B 205 35.472 35.796 29.979 1.00 0.00 H new ATOM 0 HB2 LEU B 205 33.716 33.686 28.720 1.00 0.00 H new ATOM 0 HB3 LEU B 205 35.459 33.549 28.615 1.00 0.00 H new ATOM 0 HG LEU B 205 33.865 33.762 31.187 1.00 0.00 H new ATOM 0 HD11 LEU B 205 34.516 31.386 31.540 1.00 0.00 H new ATOM 0 HD12 LEU B 205 33.521 31.587 30.078 1.00 0.00 H new ATOM 0 HD13 LEU B 205 35.281 31.366 29.934 1.00 0.00 H new ATOM 0 HD21 LEU B 205 36.027 33.179 32.295 1.00 0.00 H new ATOM 0 HD22 LEU B 205 36.839 33.231 30.713 1.00 0.00 H new ATOM 0 HD23 LEU B 205 36.140 34.715 31.404 1.00 0.00 H new ATOM 1552 N LEU B 206 34.526 36.275 26.914 1.00 0.00 N ATOM 1553 CA LEU B 206 34.968 36.780 25.651 1.00 0.00 C ATOM 1554 C LEU B 206 35.350 38.217 25.741 1.00 0.00 C ATOM 1555 O LEU B 206 36.115 38.740 24.932 1.00 0.00 O ATOM 1556 CB LEU B 206 33.836 36.542 24.637 1.00 0.00 C ATOM 1557 CG LEU B 206 33.387 35.075 24.526 1.00 0.00 C ATOM 1558 CD1 LEU B 206 34.581 34.108 24.442 1.00 0.00 C ATOM 1559 CD2 LEU B 206 32.372 34.598 25.579 1.00 0.00 C ATOM 0 H LEU B 206 33.515 36.159 26.977 1.00 0.00 H new ATOM 0 HA LEU B 206 35.868 36.258 25.326 1.00 0.00 H new ATOM 0 HB2 LEU B 206 32.978 37.153 24.918 1.00 0.00 H new ATOM 0 HB3 LEU B 206 34.164 36.885 23.656 1.00 0.00 H new ATOM 0 HG LEU B 206 32.839 35.055 23.584 1.00 0.00 H new ATOM 0 HD11 LEU B 206 34.215 33.084 24.365 1.00 0.00 H new ATOM 0 HD12 LEU B 206 35.181 34.346 23.564 1.00 0.00 H new ATOM 0 HD13 LEU B 206 35.194 34.208 25.338 1.00 0.00 H new ATOM 0 HD21 LEU B 206 32.129 33.550 25.402 1.00 0.00 H new ATOM 0 HD22 LEU B 206 32.802 34.708 26.575 1.00 0.00 H new ATOM 0 HD23 LEU B 206 31.465 35.198 25.508 1.00 0.00 H new ATOM 1571 N GLU B 207 34.867 38.912 26.786 1.00 0.00 N ATOM 1572 CA GLU B 207 35.165 40.285 27.056 1.00 0.00 C ATOM 1573 C GLU B 207 36.477 40.425 27.747 1.00 0.00 C ATOM 1574 O GLU B 207 37.298 41.272 27.398 1.00 0.00 O ATOM 1575 CB GLU B 207 33.978 40.906 27.813 1.00 0.00 C ATOM 1576 CG GLU B 207 34.336 41.981 28.841 1.00 0.00 C ATOM 1577 CD GLU B 207 33.105 42.662 29.419 1.00 0.00 C ATOM 1578 OE1 GLU B 207 32.654 43.687 28.840 1.00 0.00 O ATOM 1579 OE2 GLU B 207 32.608 42.190 30.476 1.00 0.00 O ATOM 0 H GLU B 207 34.239 38.498 27.475 1.00 0.00 H new ATOM 0 HA GLU B 207 35.285 40.844 26.128 1.00 0.00 H new ATOM 0 HB2 GLU B 207 33.293 41.340 27.084 1.00 0.00 H new ATOM 0 HB3 GLU B 207 33.438 40.108 28.322 1.00 0.00 H new ATOM 0 HG2 GLU B 207 34.912 41.530 29.649 1.00 0.00 H new ATOM 0 HG3 GLU B 207 34.976 42.729 28.373 1.00 0.00 H new ATOM 1586 N ALA B 208 36.748 39.555 28.736 1.00 0.00 N ATOM 1587 CA ALA B 208 38.005 39.434 29.408 1.00 0.00 C ATOM 1588 C ALA B 208 39.093 38.955 28.511 1.00 0.00 C ATOM 1589 O ALA B 208 40.222 39.436 28.599 1.00 0.00 O ATOM 1590 CB ALA B 208 37.850 38.496 30.618 1.00 0.00 C ATOM 0 H ALA B 208 36.050 38.899 29.086 1.00 0.00 H new ATOM 0 HA ALA B 208 38.297 40.429 29.744 1.00 0.00 H new ATOM 0 HB1 ALA B 208 38.807 38.403 31.131 1.00 0.00 H new ATOM 0 HB2 ALA B 208 37.109 38.906 31.304 1.00 0.00 H new ATOM 0 HB3 ALA B 208 37.524 37.513 30.277 1.00 0.00 H new ATOM 1596 N ALA B 209 38.800 38.034 27.575 1.00 0.00 N ATOM 1597 CA ALA B 209 39.716 37.551 26.589 1.00 0.00 C ATOM 1598 C ALA B 209 40.249 38.598 25.672 1.00 0.00 C ATOM 1599 O ALA B 209 41.462 38.721 25.515 1.00 0.00 O ATOM 1600 CB ALA B 209 39.064 36.431 25.761 1.00 0.00 C ATOM 0 H ALA B 209 37.877 37.605 27.503 1.00 0.00 H new ATOM 0 HA ALA B 209 40.571 37.174 27.150 1.00 0.00 H new ATOM 0 HB1 ALA B 209 39.772 36.072 25.014 1.00 0.00 H new ATOM 0 HB2 ALA B 209 38.782 35.609 26.419 1.00 0.00 H new ATOM 0 HB3 ALA B 209 38.175 36.817 25.263 1.00 0.00 H new ATOM 1606 N ASP B 210 39.389 39.435 25.066 1.00 0.00 N ATOM 1607 CA ASP B 210 39.794 40.505 24.208 1.00 0.00 C ATOM 1608 C ASP B 210 40.645 41.518 24.893 1.00 0.00 C ATOM 1609 O ASP B 210 41.641 41.995 24.350 1.00 0.00 O ATOM 1610 CB ASP B 210 38.579 41.211 23.581 1.00 0.00 C ATOM 1611 CG ASP B 210 37.968 40.428 22.428 1.00 0.00 C ATOM 1612 OD1 ASP B 210 38.403 39.283 22.133 1.00 0.00 O ATOM 1613 OD2 ASP B 210 37.051 40.981 21.765 1.00 0.00 O ATOM 0 H ASP B 210 38.377 39.365 25.177 1.00 0.00 H new ATOM 0 HA ASP B 210 40.394 40.038 23.427 1.00 0.00 H new ATOM 0 HB2 ASP B 210 37.821 41.369 24.348 1.00 0.00 H new ATOM 0 HB3 ASP B 210 38.881 42.196 23.225 1.00 0.00 H new ATOM 1618 N TYR B 211 40.312 41.861 26.150 1.00 0.00 N ATOM 1619 CA TYR B 211 41.089 42.685 27.024 1.00 0.00 C ATOM 1620 C TYR B 211 42.450 42.138 27.285 1.00 0.00 C ATOM 1621 O TYR B 211 43.459 42.830 27.154 1.00 0.00 O ATOM 1622 CB TYR B 211 40.254 42.875 28.301 1.00 0.00 C ATOM 1623 CG TYR B 211 40.981 43.456 29.465 1.00 0.00 C ATOM 1624 CD1 TYR B 211 41.205 44.809 29.567 1.00 0.00 C ATOM 1625 CD2 TYR B 211 41.435 42.617 30.456 1.00 0.00 C ATOM 1626 CE1 TYR B 211 41.859 45.320 30.664 1.00 0.00 C ATOM 1627 CE2 TYR B 211 42.069 43.127 31.565 1.00 0.00 C ATOM 1628 CZ TYR B 211 42.282 44.481 31.668 1.00 0.00 C ATOM 1629 OH TYR B 211 42.926 45.008 32.807 1.00 0.00 O ATOM 0 H TYR B 211 39.445 41.542 26.583 1.00 0.00 H new ATOM 0 HA TYR B 211 41.292 43.650 26.559 1.00 0.00 H new ATOM 0 HB2 TYR B 211 39.406 43.519 28.067 1.00 0.00 H new ATOM 0 HB3 TYR B 211 39.848 41.907 28.595 1.00 0.00 H new ATOM 0 HD1 TYR B 211 40.867 45.472 28.784 1.00 0.00 H new ATOM 0 HD2 TYR B 211 41.293 41.550 30.363 1.00 0.00 H new ATOM 0 HE1 TYR B 211 42.041 46.382 30.737 1.00 0.00 H new ATOM 0 HE2 TYR B 211 42.398 42.465 32.353 1.00 0.00 H new ATOM 0 HH TYR B 211 43.158 44.278 33.419 1.00 0.00 H new ATOM 1639 N LEU B 212 42.558 40.850 27.653 1.00 0.00 N ATOM 1640 CA LEU B 212 43.800 40.217 27.973 1.00 0.00 C ATOM 1641 C LEU B 212 44.706 39.954 26.820 1.00 0.00 C ATOM 1642 O LEU B 212 45.908 39.769 27.000 1.00 0.00 O ATOM 1643 CB LEU B 212 43.553 38.914 28.752 1.00 0.00 C ATOM 1644 CG LEU B 212 43.749 39.093 30.267 1.00 0.00 C ATOM 1645 CD1 LEU B 212 43.135 37.852 30.936 1.00 0.00 C ATOM 1646 CD2 LEU B 212 45.220 39.298 30.669 1.00 0.00 C ATOM 0 H LEU B 212 41.754 40.227 27.731 1.00 0.00 H new ATOM 0 HA LEU B 212 44.328 40.945 28.589 1.00 0.00 H new ATOM 0 HB2 LEU B 212 42.539 38.564 28.558 1.00 0.00 H new ATOM 0 HB3 LEU B 212 44.232 38.142 28.389 1.00 0.00 H new ATOM 0 HG LEU B 212 43.254 40.005 30.600 1.00 0.00 H new ATOM 0 HD11 LEU B 212 43.248 37.928 32.017 1.00 0.00 H new ATOM 0 HD12 LEU B 212 42.076 37.790 30.685 1.00 0.00 H new ATOM 0 HD13 LEU B 212 43.645 36.957 30.580 1.00 0.00 H new ATOM 0 HD21 LEU B 212 45.288 39.418 31.750 1.00 0.00 H new ATOM 0 HD22 LEU B 212 45.805 38.431 30.362 1.00 0.00 H new ATOM 0 HD23 LEU B 212 45.610 40.191 30.180 1.00 0.00 H new ATOM 1658 N GLU B 213 44.179 39.947 25.582 1.00 0.00 N ATOM 1659 CA GLU B 213 44.956 40.055 24.387 1.00 0.00 C ATOM 1660 C GLU B 213 45.618 41.386 24.270 1.00 0.00 C ATOM 1661 O GLU B 213 46.830 41.500 24.095 1.00 0.00 O ATOM 1662 CB GLU B 213 44.119 39.809 23.121 1.00 0.00 C ATOM 1663 CG GLU B 213 43.743 38.347 22.866 1.00 0.00 C ATOM 1664 CD GLU B 213 43.251 38.156 21.439 1.00 0.00 C ATOM 1665 OE1 GLU B 213 44.024 38.476 20.497 1.00 0.00 O ATOM 1666 OE2 GLU B 213 42.093 37.709 21.225 1.00 0.00 O ATOM 0 H GLU B 213 43.178 39.863 25.408 1.00 0.00 H new ATOM 0 HA GLU B 213 45.717 39.279 24.465 1.00 0.00 H new ATOM 0 HB2 GLU B 213 43.204 40.397 23.189 1.00 0.00 H new ATOM 0 HB3 GLU B 213 44.673 40.181 22.259 1.00 0.00 H new ATOM 0 HG2 GLU B 213 44.607 37.708 23.046 1.00 0.00 H new ATOM 0 HG3 GLU B 213 42.967 38.039 23.567 1.00 0.00 H new ATOM 1673 N ARG B 214 44.834 42.471 24.403 1.00 0.00 N ATOM 1674 CA ARG B 214 45.282 43.824 24.287 1.00 0.00 C ATOM 1675 C ARG B 214 46.287 44.248 25.301 1.00 0.00 C ATOM 1676 O ARG B 214 47.140 45.083 25.010 1.00 0.00 O ATOM 1677 CB ARG B 214 44.086 44.791 24.305 1.00 0.00 C ATOM 1678 CG ARG B 214 43.208 44.675 23.058 1.00 0.00 C ATOM 1679 CD ARG B 214 42.139 45.768 22.986 1.00 0.00 C ATOM 1680 NE ARG B 214 41.317 45.479 21.776 1.00 0.00 N ATOM 1681 CZ ARG B 214 40.609 46.403 21.065 1.00 0.00 C ATOM 1682 NH1 ARG B 214 40.698 47.747 21.288 1.00 0.00 N ATOM 1683 NH2 ARG B 214 39.793 45.933 20.076 1.00 0.00 N ATOM 0 H ARG B 214 43.836 42.400 24.602 1.00 0.00 H new ATOM 0 HA ARG B 214 45.798 43.865 23.328 1.00 0.00 H new ATOM 0 HB2 ARG B 214 43.480 44.595 25.189 1.00 0.00 H new ATOM 0 HB3 ARG B 214 44.453 45.814 24.391 1.00 0.00 H new ATOM 0 HG2 ARG B 214 43.837 44.728 22.169 1.00 0.00 H new ATOM 0 HG3 ARG B 214 42.725 43.698 23.048 1.00 0.00 H new ATOM 0 HD2 ARG B 214 41.521 45.766 23.884 1.00 0.00 H new ATOM 0 HD3 ARG B 214 42.597 46.755 22.917 1.00 0.00 H new ATOM 0 HE ARG B 214 41.281 44.512 21.454 1.00 0.00 H new ATOM 0 HH11 ARG B 214 41.317 48.103 22.016 1.00 0.00 H new ATOM 0 HH12 ARG B 214 40.145 48.395 20.726 1.00 0.00 H new ATOM 0 HH21 ARG B 214 39.734 44.931 19.897 1.00 0.00 H new ATOM 0 HH22 ARG B 214 39.243 46.584 19.516 1.00 0.00 H new ATOM 1697 N ARG B 215 46.271 43.652 26.508 1.00 0.00 N ATOM 1698 CA ARG B 215 47.257 43.824 27.530 1.00 0.00 C ATOM 1699 C ARG B 215 48.655 43.499 27.128 1.00 0.00 C ATOM 1700 O ARG B 215 49.605 44.099 27.630 1.00 0.00 O ATOM 1701 CB ARG B 215 46.907 43.038 28.805 1.00 0.00 C ATOM 1702 CG ARG B 215 45.942 43.791 29.722 1.00 0.00 C ATOM 1703 CD ARG B 215 45.939 43.368 31.193 1.00 0.00 C ATOM 1704 NE ARG B 215 47.308 43.621 31.726 1.00 0.00 N ATOM 1705 CZ ARG B 215 47.661 43.703 33.041 1.00 0.00 C ATOM 1706 NH1 ARG B 215 46.793 43.494 34.073 1.00 0.00 N ATOM 1707 NH2 ARG B 215 48.962 44.003 33.325 1.00 0.00 N ATOM 0 H ARG B 215 45.526 43.013 26.785 1.00 0.00 H new ATOM 0 HA ARG B 215 47.230 44.896 27.726 1.00 0.00 H new ATOM 0 HB2 ARG B 215 46.464 42.082 28.526 1.00 0.00 H new ATOM 0 HB3 ARG B 215 47.823 42.817 29.353 1.00 0.00 H new ATOM 0 HG2 ARG B 215 46.180 44.853 29.672 1.00 0.00 H new ATOM 0 HG3 ARG B 215 44.932 43.672 29.329 1.00 0.00 H new ATOM 0 HD2 ARG B 215 45.196 43.934 31.755 1.00 0.00 H new ATOM 0 HD3 ARG B 215 45.677 42.314 31.290 1.00 0.00 H new ATOM 0 HE ARG B 215 48.053 43.745 31.041 1.00 0.00 H new ATOM 0 HH11 ARG B 215 45.819 43.262 33.881 1.00 0.00 H new ATOM 0 HH12 ARG B 215 47.119 43.570 35.037 1.00 0.00 H new ATOM 0 HH21 ARG B 215 49.627 44.156 32.567 1.00 0.00 H new ATOM 0 HH22 ARG B 215 49.269 44.074 34.295 1.00 0.00 H new