USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 985 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: B 236 HIS : no HD1:sc= -0.0447 X(o=-0.088,f=-0.15) USER MOD Set 1.2: B 238 SER OG : rot 180:sc= -0.0438 USER MOD Set 2.1: A 54 TYR OH : rot -2:sc= 0.58 USER MOD Set 2.2: A 91 ASN :FLIP amide:sc= -1.85! F(o=-2.3,f=-1.3!) USER MOD Set 3.1: A 85 THR OG1 : rot -49:sc= 1.87 USER MOD Set 3.2: A 106 HIS : no HD1:sc= -0.135 K(o=1.7,f=-4.2!) USER MOD Set 4.1: A 32 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 78 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0377) USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0.914 K(o=0.91,f=-0.43) USER MOD Single : A 39 ASN : amide:sc= -3.76! C(o=-3.8!,f=-8!) USER MOD Single : A 43 THR OG1 : rot -64:sc= 1.23 USER MOD Single : A 49 THR OG1 : rot -56:sc= 0.677 USER MOD Single : A 52 SER OG : rot 61:sc= -0.416! USER MOD Single : A 63 SER OG : rot 171:sc= 0.972 USER MOD Single : A 67 ASN : amide:sc= 1.22 K(o=1.2,f=-0.1) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.177 USER MOD Single : A 71 SER OG : rot 140:sc= 0.53 USER MOD Single : A 72 GLN : amide:sc= -0.833 K(o=-0.83,f=-4.2!) USER MOD Single : A 76 TYR OH : rot -4:sc= 0.424 USER MOD Single : A 79 TYR OH : rot -21:sc= 0.309 USER MOD Single : A 82 GLN : amide:sc= -2.5! C(o=-2.5!,f=-7.1!) USER MOD Single : A 84 SER OG : rot 170:sc= -1.97! USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 96 LYS NZ :NH3+ -169:sc= 1.25 (180deg=1.23) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 147:sc= 1.24 (180deg=1.12) USER MOD Single : B 222 ASN : amide:sc= 1.43 K(o=1.4,f=-4.7!) USER MOD Single : B 227 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 239 ASN : amide:sc= -0.0755 K(o=-0.076,f=-3.7!) USER MOD Single : B 244 LYS NZ :NH3+ -147:sc= 1.17 (180deg=0.415) USER MOD Single : B 248 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 249 GLN :FLIP amide:sc= -2.04! C(o=-3.1!,f=-2!) USER MOD Single : B 250 ASN : amide:sc= 1.18 K(o=1.2,f=-0.26) USER MOD Single : B 253 ASN : amide:sc= -0.127 X(o=-0.13,f=-0.11) USER MOD Single : B 255 LYS NZ :NH3+ -168:sc= -0.0262 (180deg=-0.218) USER MOD Single : B 256 LYS NZ :NH3+ -110:sc= 1.05 (180deg=0.604) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 25 3.245 14.970 -0.393 1.00 0.00 N ATOM 2 CA ASN A 25 4.590 15.409 -0.028 1.00 0.00 C ATOM 3 C ASN A 25 5.500 14.204 -0.061 1.00 0.00 C ATOM 4 O ASN A 25 5.375 13.294 0.766 1.00 0.00 O ATOM 5 CB ASN A 25 4.580 16.036 1.370 1.00 0.00 C ATOM 6 CG ASN A 25 3.672 17.239 1.450 1.00 0.00 C ATOM 7 OD1 ASN A 25 3.503 17.968 0.477 1.00 0.00 O ATOM 8 ND2 ASN A 25 3.045 17.427 2.576 1.00 0.00 N ATOM 0 HA ASN A 25 4.945 16.164 -0.730 1.00 0.00 H new ATOM 0 HB2 ASN A 25 4.258 15.291 2.098 1.00 0.00 H new ATOM 0 HB3 ASN A 25 5.594 16.330 1.642 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.388 18.201 2.671 1.00 0.00 H new ATOM 0 HD22 ASN A 25 3.211 16.800 3.363 1.00 0.00 H new ATOM 17 N GLU A 26 6.405 14.176 -1.017 1.00 0.00 N ATOM 18 CA GLU A 26 7.263 13.035 -1.224 1.00 0.00 C ATOM 19 C GLU A 26 8.484 13.017 -0.321 1.00 0.00 C ATOM 20 O GLU A 26 9.260 12.057 -0.314 1.00 0.00 O ATOM 21 CB GLU A 26 7.647 12.871 -2.666 1.00 0.00 C ATOM 22 CG GLU A 26 8.479 13.928 -3.241 1.00 0.00 C ATOM 23 CD GLU A 26 7.749 15.203 -3.592 1.00 0.00 C ATOM 24 OE1 GLU A 26 7.580 16.079 -2.719 1.00 0.00 O ATOM 25 OE2 GLU A 26 7.347 15.361 -4.751 1.00 0.00 O ATOM 0 H GLU A 26 6.564 14.943 -1.670 1.00 0.00 H new ATOM 0 HA GLU A 26 6.663 12.171 -0.937 1.00 0.00 H new ATOM 0 HB2 GLU A 26 8.175 11.924 -2.773 1.00 0.00 H new ATOM 0 HB3 GLU A 26 6.734 12.795 -3.256 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.274 14.166 -2.535 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.957 13.542 -4.142 1.00 0.00 H new ATOM 32 N TYR A 27 8.649 14.069 0.441 1.00 0.00 N ATOM 33 CA TYR A 27 9.754 14.183 1.371 1.00 0.00 C ATOM 34 C TYR A 27 9.262 14.190 2.798 1.00 0.00 C ATOM 35 O TYR A 27 9.930 14.682 3.708 1.00 0.00 O ATOM 36 CB TYR A 27 10.618 15.403 1.047 1.00 0.00 C ATOM 37 CG TYR A 27 11.451 15.203 -0.199 1.00 0.00 C ATOM 38 CD1 TYR A 27 10.904 15.360 -1.463 1.00 0.00 C ATOM 39 CD2 TYR A 27 12.786 14.835 -0.107 1.00 0.00 C ATOM 40 CE1 TYR A 27 11.659 15.150 -2.594 1.00 0.00 C ATOM 41 CE2 TYR A 27 13.550 14.627 -1.238 1.00 0.00 C ATOM 42 CZ TYR A 27 12.977 14.785 -2.479 1.00 0.00 C ATOM 43 OH TYR A 27 13.724 14.560 -3.620 1.00 0.00 O ATOM 0 H TYR A 27 8.022 14.874 0.437 1.00 0.00 H new ATOM 0 HA TYR A 27 10.390 13.305 1.260 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.977 16.275 0.916 1.00 0.00 H new ATOM 0 HB3 TYR A 27 11.275 15.614 1.891 1.00 0.00 H new ATOM 0 HD1 TYR A 27 9.869 15.652 -1.562 1.00 0.00 H new ATOM 0 HD2 TYR A 27 13.235 14.709 0.867 1.00 0.00 H new ATOM 0 HE1 TYR A 27 11.215 15.272 -3.571 1.00 0.00 H new ATOM 0 HE2 TYR A 27 14.588 14.343 -1.149 1.00 0.00 H new ATOM 0 HH TYR A 27 14.638 14.311 -3.369 1.00 0.00 H new ATOM 53 N LYS A 28 8.096 13.632 2.987 1.00 0.00 N ATOM 54 CA LYS A 28 7.534 13.440 4.296 1.00 0.00 C ATOM 55 C LYS A 28 7.255 11.982 4.460 1.00 0.00 C ATOM 56 O LYS A 28 6.930 11.293 3.480 1.00 0.00 O ATOM 57 CB LYS A 28 6.269 14.262 4.508 1.00 0.00 C ATOM 58 CG LYS A 28 6.498 15.760 4.486 1.00 0.00 C ATOM 59 CD LYS A 28 7.418 16.210 5.606 1.00 0.00 C ATOM 60 CE LYS A 28 7.575 17.721 5.627 1.00 0.00 C ATOM 61 NZ LYS A 28 8.531 18.153 6.668 1.00 0.00 N ATOM 0 H LYS A 28 7.504 13.295 2.228 1.00 0.00 H new ATOM 0 HA LYS A 28 8.245 13.784 5.047 1.00 0.00 H new ATOM 0 HB2 LYS A 28 5.546 14.004 3.734 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.825 13.986 5.464 1.00 0.00 H new ATOM 0 HG2 LYS A 28 6.928 16.047 3.526 1.00 0.00 H new ATOM 0 HG3 LYS A 28 5.541 16.275 4.574 1.00 0.00 H new ATOM 0 HD2 LYS A 28 7.020 15.872 6.563 1.00 0.00 H new ATOM 0 HD3 LYS A 28 8.396 15.744 5.484 1.00 0.00 H new ATOM 0 HE2 LYS A 28 7.918 18.066 4.651 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.606 18.186 5.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 8.614 19.190 6.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.191 17.845 7.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 9.462 17.729 6.482 1.00 0.00 H new ATOM 75 N ASP A 29 7.350 11.503 5.658 1.00 0.00 N ATOM 76 CA ASP A 29 7.252 10.061 5.878 1.00 0.00 C ATOM 77 C ASP A 29 5.910 9.610 6.418 1.00 0.00 C ATOM 78 O ASP A 29 5.711 8.437 6.687 1.00 0.00 O ATOM 79 CB ASP A 29 8.446 9.478 6.681 1.00 0.00 C ATOM 80 CG ASP A 29 8.524 9.870 8.152 1.00 0.00 C ATOM 81 OD1 ASP A 29 8.410 11.068 8.482 1.00 0.00 O ATOM 82 OD2 ASP A 29 8.755 8.978 9.006 1.00 0.00 O ATOM 0 H ASP A 29 7.493 12.062 6.499 1.00 0.00 H new ATOM 0 HA ASP A 29 7.320 9.629 4.880 1.00 0.00 H new ATOM 0 HB2 ASP A 29 8.403 8.391 6.618 1.00 0.00 H new ATOM 0 HB3 ASP A 29 9.370 9.789 6.194 1.00 0.00 H new ATOM 87 N ASN A 30 4.952 10.520 6.471 1.00 0.00 N ATOM 88 CA ASN A 30 3.561 10.176 6.884 1.00 0.00 C ATOM 89 C ASN A 30 2.805 9.554 5.700 1.00 0.00 C ATOM 90 O ASN A 30 1.570 9.568 5.652 1.00 0.00 O ATOM 91 CB ASN A 30 2.772 11.426 7.323 1.00 0.00 C ATOM 92 CG ASN A 30 3.295 12.126 8.546 1.00 0.00 C ATOM 93 OD1 ASN A 30 3.909 11.523 9.424 1.00 0.00 O ATOM 94 ND2 ASN A 30 3.051 13.399 8.628 1.00 0.00 N ATOM 0 H ASN A 30 5.090 11.504 6.239 1.00 0.00 H new ATOM 0 HA ASN A 30 3.639 9.480 7.719 1.00 0.00 H new ATOM 0 HB2 ASN A 30 2.761 12.136 6.496 1.00 0.00 H new ATOM 0 HB3 ASN A 30 1.738 11.135 7.507 1.00 0.00 H new ATOM 0 HD21 ASN A 30 3.372 13.929 9.439 1.00 0.00 H new ATOM 0 HD22 ASN A 30 2.539 13.869 7.882 1.00 0.00 H new ATOM 101 N ALA A 31 3.547 8.995 4.766 1.00 0.00 N ATOM 102 CA ALA A 31 2.987 8.476 3.540 1.00 0.00 C ATOM 103 C ALA A 31 2.826 6.969 3.586 1.00 0.00 C ATOM 104 O ALA A 31 2.406 6.357 2.596 1.00 0.00 O ATOM 105 CB ALA A 31 3.883 8.833 2.371 1.00 0.00 C ATOM 0 H ALA A 31 4.559 8.889 4.838 1.00 0.00 H new ATOM 0 HA ALA A 31 2.002 8.926 3.418 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.454 8.438 1.450 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.969 9.917 2.296 1.00 0.00 H new ATOM 0 HB3 ALA A 31 4.872 8.401 2.525 1.00 0.00 H new ATOM 111 N TYR A 32 3.165 6.368 4.705 1.00 0.00 N ATOM 112 CA TYR A 32 3.125 4.922 4.800 1.00 0.00 C ATOM 113 C TYR A 32 1.852 4.488 5.485 1.00 0.00 C ATOM 114 O TYR A 32 1.382 5.158 6.410 1.00 0.00 O ATOM 115 CB TYR A 32 4.336 4.408 5.600 1.00 0.00 C ATOM 116 CG TYR A 32 5.670 4.932 5.113 1.00 0.00 C ATOM 117 CD1 TYR A 32 5.953 5.000 3.767 1.00 0.00 C ATOM 118 CD2 TYR A 32 6.636 5.383 6.005 1.00 0.00 C ATOM 119 CE1 TYR A 32 7.146 5.489 3.313 1.00 0.00 C ATOM 120 CE2 TYR A 32 7.840 5.881 5.550 1.00 0.00 C ATOM 121 CZ TYR A 32 8.083 5.926 4.198 1.00 0.00 C ATOM 122 OH TYR A 32 9.265 6.432 3.723 1.00 0.00 O ATOM 0 H TYR A 32 3.468 6.848 5.552 1.00 0.00 H new ATOM 0 HA TYR A 32 3.157 4.505 3.793 1.00 0.00 H new ATOM 0 HB2 TYR A 32 4.210 4.685 6.647 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.349 3.319 5.558 1.00 0.00 H new ATOM 0 HD1 TYR A 32 5.216 4.660 3.055 1.00 0.00 H new ATOM 0 HD2 TYR A 32 6.442 5.343 7.067 1.00 0.00 H new ATOM 0 HE1 TYR A 32 7.345 5.529 2.252 1.00 0.00 H new ATOM 0 HE2 TYR A 32 8.584 6.232 6.250 1.00 0.00 H new ATOM 0 HH TYR A 32 9.831 6.703 4.476 1.00 0.00 H new ATOM 132 N ILE A 33 1.307 3.379 5.060 1.00 0.00 N ATOM 133 CA ILE A 33 0.111 2.838 5.661 1.00 0.00 C ATOM 134 C ILE A 33 0.223 1.348 5.813 1.00 0.00 C ATOM 135 O ILE A 33 1.011 0.691 5.118 1.00 0.00 O ATOM 136 CB ILE A 33 -1.181 3.152 4.865 1.00 0.00 C ATOM 137 CG1 ILE A 33 -1.047 2.701 3.415 1.00 0.00 C ATOM 138 CG2 ILE A 33 -1.536 4.627 4.949 1.00 0.00 C ATOM 139 CD1 ILE A 33 -2.314 2.814 2.629 1.00 0.00 C ATOM 0 H ILE A 33 1.677 2.824 4.289 1.00 0.00 H new ATOM 0 HA ILE A 33 0.030 3.324 6.633 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.998 2.591 5.319 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.274 3.297 2.929 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.710 1.665 3.396 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.447 4.815 4.381 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.695 4.904 5.991 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -0.721 5.221 4.536 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.140 2.475 1.608 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -3.085 2.196 3.090 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -2.642 3.853 2.615 1.00 0.00 H new ATOM 151 N TYR A 34 -0.541 0.838 6.724 1.00 0.00 N ATOM 152 CA TYR A 34 -0.619 -0.547 7.014 1.00 0.00 C ATOM 153 C TYR A 34 -1.936 -1.065 6.509 1.00 0.00 C ATOM 154 O TYR A 34 -2.992 -0.558 6.893 1.00 0.00 O ATOM 155 CB TYR A 34 -0.514 -0.742 8.537 1.00 0.00 C ATOM 156 CG TYR A 34 -0.946 -2.093 9.048 1.00 0.00 C ATOM 157 CD1 TYR A 34 -0.127 -3.202 8.949 1.00 0.00 C ATOM 158 CD2 TYR A 34 -2.191 -2.241 9.632 1.00 0.00 C ATOM 159 CE1 TYR A 34 -0.543 -4.434 9.422 1.00 0.00 C ATOM 160 CE2 TYR A 34 -2.620 -3.451 10.107 1.00 0.00 C ATOM 161 CZ TYR A 34 -1.793 -4.556 10.000 1.00 0.00 C ATOM 162 OH TYR A 34 -2.214 -5.789 10.480 1.00 0.00 O ATOM 0 H TYR A 34 -1.153 1.406 7.310 1.00 0.00 H new ATOM 0 HA TYR A 34 0.192 -1.092 6.531 1.00 0.00 H new ATOM 0 HB2 TYR A 34 0.520 -0.573 8.837 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -1.117 0.023 9.026 1.00 0.00 H new ATOM 0 HD1 TYR A 34 0.849 -3.106 8.497 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -2.840 -1.382 9.715 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.104 -5.295 9.340 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -3.595 -3.543 10.561 1.00 0.00 H new ATOM 0 HH TYR A 34 -3.115 -5.703 10.856 1.00 0.00 H new ATOM 172 N ILE A 35 -1.884 -2.017 5.636 1.00 0.00 N ATOM 173 CA ILE A 35 -3.075 -2.650 5.153 1.00 0.00 C ATOM 174 C ILE A 35 -3.101 -4.041 5.749 1.00 0.00 C ATOM 175 O ILE A 35 -2.123 -4.776 5.648 1.00 0.00 O ATOM 176 CB ILE A 35 -3.057 -2.795 3.618 1.00 0.00 C ATOM 177 CG1 ILE A 35 -2.667 -1.488 2.957 1.00 0.00 C ATOM 178 CG2 ILE A 35 -4.454 -3.188 3.141 1.00 0.00 C ATOM 179 CD1 ILE A 35 -2.024 -1.678 1.609 1.00 0.00 C ATOM 0 H ILE A 35 -1.019 -2.380 5.236 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.942 -2.050 5.431 1.00 0.00 H new ATOM 0 HB ILE A 35 -2.327 -3.558 3.348 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.554 -0.865 2.845 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.979 -0.949 3.609 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.452 -3.293 2.056 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.741 -4.136 3.597 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -5.167 -2.416 3.429 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.768 -0.706 1.188 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.119 -2.276 1.719 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.719 -2.190 0.943 1.00 0.00 H new ATOM 191 N GLY A 36 -4.177 -4.383 6.361 1.00 0.00 N ATOM 192 CA GLY A 36 -4.318 -5.660 6.972 1.00 0.00 C ATOM 193 C GLY A 36 -5.603 -6.318 6.565 1.00 0.00 C ATOM 194 O GLY A 36 -6.509 -5.644 6.052 1.00 0.00 O ATOM 0 H GLY A 36 -4.994 -3.780 6.454 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.477 -6.295 6.692 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -4.289 -5.552 8.056 1.00 0.00 H new ATOM 198 N ASN A 37 -5.667 -7.617 6.802 1.00 0.00 N ATOM 199 CA ASN A 37 -6.802 -8.498 6.471 1.00 0.00 C ATOM 200 C ASN A 37 -6.851 -8.750 4.979 1.00 0.00 C ATOM 201 O ASN A 37 -7.915 -8.826 4.374 1.00 0.00 O ATOM 202 CB ASN A 37 -8.174 -7.985 6.975 1.00 0.00 C ATOM 203 CG ASN A 37 -8.258 -7.762 8.475 1.00 0.00 C ATOM 204 OD1 ASN A 37 -7.512 -8.349 9.266 1.00 0.00 O ATOM 205 ND2 ASN A 37 -9.206 -6.967 8.882 1.00 0.00 N ATOM 0 H ASN A 37 -4.901 -8.120 7.250 1.00 0.00 H new ATOM 0 HA ASN A 37 -6.620 -9.431 7.004 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -8.404 -7.047 6.469 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -8.943 -8.701 6.685 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -9.350 -6.814 9.880 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.805 -6.497 8.203 1.00 0.00 H new ATOM 212 N LEU A 38 -5.683 -8.905 4.393 1.00 0.00 N ATOM 213 CA LEU A 38 -5.563 -9.179 2.970 1.00 0.00 C ATOM 214 C LEU A 38 -6.068 -10.550 2.608 1.00 0.00 C ATOM 215 O LEU A 38 -5.927 -11.509 3.376 1.00 0.00 O ATOM 216 CB LEU A 38 -4.121 -9.012 2.459 1.00 0.00 C ATOM 217 CG LEU A 38 -3.730 -7.637 1.923 1.00 0.00 C ATOM 218 CD1 LEU A 38 -4.551 -7.310 0.697 1.00 0.00 C ATOM 219 CD2 LEU A 38 -3.912 -6.571 2.965 1.00 0.00 C ATOM 0 H LEU A 38 -4.791 -8.846 4.884 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.191 -8.436 2.479 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -3.442 -9.264 3.274 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -3.955 -9.744 1.668 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.674 -7.666 1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.267 -6.328 0.320 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.370 -8.060 -0.073 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.609 -7.306 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.625 -5.605 2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.957 -6.538 3.273 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.286 -6.796 3.829 1.00 0.00 H new ATOM 231 N ASN A 39 -6.659 -10.631 1.448 1.00 0.00 N ATOM 232 CA ASN A 39 -7.161 -11.875 0.907 1.00 0.00 C ATOM 233 C ASN A 39 -6.031 -12.503 0.121 1.00 0.00 C ATOM 234 O ASN A 39 -5.180 -11.787 -0.409 1.00 0.00 O ATOM 235 CB ASN A 39 -8.320 -11.590 -0.060 1.00 0.00 C ATOM 236 CG ASN A 39 -9.172 -12.807 -0.397 1.00 0.00 C ATOM 237 OD1 ASN A 39 -8.752 -13.956 -0.272 1.00 0.00 O ATOM 238 ND2 ASN A 39 -10.325 -12.558 -0.923 1.00 0.00 N ATOM 0 H ASN A 39 -6.810 -9.827 0.839 1.00 0.00 H new ATOM 0 HA ASN A 39 -7.512 -12.526 1.708 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -8.960 -10.823 0.376 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.913 -11.179 -0.984 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -10.914 -13.325 -1.248 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -10.647 -11.594 -1.014 1.00 0.00 H new ATOM 245 N ARG A 40 -6.027 -13.810 0.034 1.00 0.00 N ATOM 246 CA ARG A 40 -5.036 -14.551 -0.725 1.00 0.00 C ATOM 247 C ARG A 40 -5.043 -14.159 -2.207 1.00 0.00 C ATOM 248 O ARG A 40 -4.026 -14.225 -2.879 1.00 0.00 O ATOM 249 CB ARG A 40 -5.211 -16.085 -0.503 1.00 0.00 C ATOM 250 CG ARG A 40 -6.585 -16.700 -0.848 1.00 0.00 C ATOM 251 CD ARG A 40 -6.829 -16.805 -2.343 1.00 0.00 C ATOM 252 NE ARG A 40 -8.091 -17.481 -2.663 1.00 0.00 N ATOM 253 CZ ARG A 40 -8.457 -17.908 -3.880 1.00 0.00 C ATOM 254 NH1 ARG A 40 -7.658 -17.730 -4.931 1.00 0.00 N ATOM 255 NH2 ARG A 40 -9.632 -18.513 -4.039 1.00 0.00 N ATOM 0 H ARG A 40 -6.719 -14.402 0.493 1.00 0.00 H new ATOM 0 HA ARG A 40 -4.048 -14.282 -0.352 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -4.453 -16.600 -1.094 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -4.999 -16.300 0.544 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.655 -17.693 -0.403 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -7.372 -16.094 -0.399 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -6.837 -15.805 -2.777 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -6.004 -17.347 -2.805 1.00 0.00 H new ATOM 0 HE ARG A 40 -8.744 -17.639 -1.896 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -6.758 -17.265 -4.814 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.946 -18.059 -5.852 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.248 -18.649 -3.238 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -9.916 -18.840 -4.962 1.00 0.00 H new ATOM 269 N GLU A 41 -6.192 -13.691 -2.684 1.00 0.00 N ATOM 270 CA GLU A 41 -6.338 -13.332 -4.092 1.00 0.00 C ATOM 271 C GLU A 41 -5.968 -11.873 -4.349 1.00 0.00 C ATOM 272 O GLU A 41 -6.042 -11.397 -5.485 1.00 0.00 O ATOM 273 CB GLU A 41 -7.761 -13.610 -4.599 1.00 0.00 C ATOM 274 CG GLU A 41 -8.835 -12.865 -3.847 1.00 0.00 C ATOM 275 CD GLU A 41 -10.204 -13.002 -4.464 1.00 0.00 C ATOM 276 OE1 GLU A 41 -10.719 -14.131 -4.579 1.00 0.00 O ATOM 277 OE2 GLU A 41 -10.813 -11.964 -4.821 1.00 0.00 O ATOM 0 H GLU A 41 -7.031 -13.552 -2.121 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.642 -13.962 -4.647 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -7.819 -13.343 -5.654 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -7.958 -14.680 -4.530 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -8.869 -13.230 -2.821 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -8.570 -11.809 -3.801 1.00 0.00 H new ATOM 284 N LEU A 42 -5.567 -11.170 -3.318 1.00 0.00 N ATOM 285 CA LEU A 42 -5.228 -9.778 -3.464 1.00 0.00 C ATOM 286 C LEU A 42 -3.753 -9.594 -3.618 1.00 0.00 C ATOM 287 O LEU A 42 -2.975 -9.834 -2.698 1.00 0.00 O ATOM 288 CB LEU A 42 -5.791 -8.925 -2.331 1.00 0.00 C ATOM 289 CG LEU A 42 -7.309 -8.756 -2.326 1.00 0.00 C ATOM 290 CD1 LEU A 42 -7.759 -7.953 -1.120 1.00 0.00 C ATOM 291 CD2 LEU A 42 -7.769 -8.080 -3.608 1.00 0.00 C ATOM 0 H LEU A 42 -5.468 -11.538 -2.372 1.00 0.00 H new ATOM 0 HA LEU A 42 -5.701 -9.426 -4.381 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -5.489 -9.368 -1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -5.333 -7.937 -2.382 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.762 -9.746 -2.267 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.844 -7.846 -1.138 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -7.461 -8.469 -0.207 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -7.297 -6.966 -1.147 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.853 -7.966 -3.591 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -7.302 -7.098 -3.689 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.482 -8.690 -4.464 1.00 0.00 H new ATOM 303 N THR A 43 -3.387 -9.184 -4.786 1.00 0.00 N ATOM 304 CA THR A 43 -2.023 -8.975 -5.145 1.00 0.00 C ATOM 305 C THR A 43 -1.722 -7.487 -5.143 1.00 0.00 C ATOM 306 O THR A 43 -2.640 -6.656 -4.945 1.00 0.00 O ATOM 307 CB THR A 43 -1.717 -9.566 -6.543 1.00 0.00 C ATOM 308 OG1 THR A 43 -2.534 -8.931 -7.553 1.00 0.00 O ATOM 309 CG2 THR A 43 -1.974 -11.067 -6.564 1.00 0.00 C ATOM 0 H THR A 43 -4.045 -8.979 -5.538 1.00 0.00 H new ATOM 0 HA THR A 43 -1.393 -9.483 -4.415 1.00 0.00 H new ATOM 0 HB THR A 43 -0.665 -9.380 -6.758 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.478 -9.135 -7.386 1.00 0.00 H new ATOM 0 HG21 THR A 43 -1.752 -11.460 -7.556 1.00 0.00 H new ATOM 0 HG22 THR A 43 -1.335 -11.556 -5.829 1.00 0.00 H new ATOM 0 HG23 THR A 43 -3.019 -11.261 -6.322 1.00 0.00 H new ATOM 317 N GLU A 44 -0.457 -7.147 -5.350 1.00 0.00 N ATOM 318 CA GLU A 44 0.002 -5.775 -5.428 1.00 0.00 C ATOM 319 C GLU A 44 -0.797 -5.031 -6.479 1.00 0.00 C ATOM 320 O GLU A 44 -1.197 -3.903 -6.263 1.00 0.00 O ATOM 321 CB GLU A 44 1.498 -5.694 -5.818 1.00 0.00 C ATOM 322 CG GLU A 44 2.469 -6.478 -4.940 1.00 0.00 C ATOM 323 CD GLU A 44 2.555 -7.965 -5.269 1.00 0.00 C ATOM 324 OE1 GLU A 44 1.616 -8.717 -4.991 1.00 0.00 O ATOM 325 OE2 GLU A 44 3.592 -8.400 -5.797 1.00 0.00 O ATOM 0 H GLU A 44 0.289 -7.832 -5.470 1.00 0.00 H new ATOM 0 HA GLU A 44 -0.133 -5.329 -4.443 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.604 -6.046 -6.844 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.798 -4.646 -5.808 1.00 0.00 H new ATOM 0 HG2 GLU A 44 3.462 -6.039 -5.036 1.00 0.00 H new ATOM 0 HG3 GLU A 44 2.170 -6.365 -3.898 1.00 0.00 H new ATOM 332 N GLY A 45 -1.057 -5.703 -7.594 1.00 0.00 N ATOM 333 CA GLY A 45 -1.810 -5.121 -8.681 1.00 0.00 C ATOM 334 C GLY A 45 -3.207 -4.691 -8.276 1.00 0.00 C ATOM 335 O GLY A 45 -3.654 -3.602 -8.650 1.00 0.00 O ATOM 0 H GLY A 45 -0.751 -6.661 -7.763 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -1.269 -4.258 -9.068 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -1.880 -5.844 -9.494 1.00 0.00 H new ATOM 339 N ASP A 46 -3.882 -5.517 -7.479 1.00 0.00 N ATOM 340 CA ASP A 46 -5.240 -5.212 -7.028 1.00 0.00 C ATOM 341 C ASP A 46 -5.187 -4.019 -6.125 1.00 0.00 C ATOM 342 O ASP A 46 -5.919 -3.043 -6.317 1.00 0.00 O ATOM 343 CB ASP A 46 -5.848 -6.378 -6.239 1.00 0.00 C ATOM 344 CG ASP A 46 -5.928 -7.662 -7.008 1.00 0.00 C ATOM 345 OD1 ASP A 46 -6.914 -7.876 -7.737 1.00 0.00 O ATOM 346 OD2 ASP A 46 -5.011 -8.503 -6.879 1.00 0.00 O ATOM 0 H ASP A 46 -3.512 -6.402 -7.132 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.856 -5.025 -7.907 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.255 -6.542 -5.339 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.850 -6.099 -5.914 1.00 0.00 H new ATOM 351 N ILE A 47 -4.271 -4.082 -5.165 1.00 0.00 N ATOM 352 CA ILE A 47 -4.073 -3.020 -4.205 1.00 0.00 C ATOM 353 C ILE A 47 -3.734 -1.710 -4.918 1.00 0.00 C ATOM 354 O ILE A 47 -4.342 -0.695 -4.658 1.00 0.00 O ATOM 355 CB ILE A 47 -2.956 -3.383 -3.169 1.00 0.00 C ATOM 356 CG1 ILE A 47 -3.384 -4.572 -2.286 1.00 0.00 C ATOM 357 CG2 ILE A 47 -2.584 -2.185 -2.312 1.00 0.00 C ATOM 358 CD1 ILE A 47 -2.365 -4.944 -1.218 1.00 0.00 C ATOM 0 H ILE A 47 -3.646 -4.878 -5.036 1.00 0.00 H new ATOM 0 HA ILE A 47 -5.006 -2.891 -3.657 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.071 -3.678 -3.733 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -4.331 -4.331 -1.803 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -3.562 -5.439 -2.922 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -1.806 -2.472 -1.604 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.216 -1.382 -2.950 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.463 -1.841 -1.766 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.738 -5.788 -0.638 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -1.423 -5.218 -1.693 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -2.204 -4.093 -0.557 1.00 0.00 H new ATOM 370 N LEU A 48 -2.835 -1.774 -5.874 1.00 0.00 N ATOM 371 CA LEU A 48 -2.377 -0.598 -6.596 1.00 0.00 C ATOM 372 C LEU A 48 -3.498 0.089 -7.318 1.00 0.00 C ATOM 373 O LEU A 48 -3.622 1.298 -7.234 1.00 0.00 O ATOM 374 CB LEU A 48 -1.270 -0.947 -7.575 1.00 0.00 C ATOM 375 CG LEU A 48 0.120 -1.120 -6.989 1.00 0.00 C ATOM 376 CD1 LEU A 48 1.049 -1.696 -8.037 1.00 0.00 C ATOM 377 CD2 LEU A 48 0.657 0.221 -6.498 1.00 0.00 C ATOM 0 H LEU A 48 -2.397 -2.644 -6.177 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.982 0.091 -5.849 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.543 -1.871 -8.084 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.226 -0.166 -8.334 1.00 0.00 H new ATOM 0 HG LEU A 48 0.064 -1.805 -6.143 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.045 -1.818 -7.612 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.672 -2.665 -8.364 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.099 -1.020 -8.890 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.654 0.083 -6.080 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.707 0.920 -7.332 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.006 0.619 -5.730 1.00 0.00 H new ATOM 389 N THR A 49 -4.320 -0.675 -8.002 1.00 0.00 N ATOM 390 CA THR A 49 -5.437 -0.120 -8.719 1.00 0.00 C ATOM 391 C THR A 49 -6.433 0.553 -7.774 1.00 0.00 C ATOM 392 O THR A 49 -6.868 1.685 -8.017 1.00 0.00 O ATOM 393 CB THR A 49 -6.138 -1.197 -9.552 1.00 0.00 C ATOM 394 OG1 THR A 49 -5.220 -1.700 -10.540 1.00 0.00 O ATOM 395 CG2 THR A 49 -7.330 -0.612 -10.251 1.00 0.00 C ATOM 0 H THR A 49 -4.232 -1.689 -8.075 1.00 0.00 H new ATOM 0 HA THR A 49 -5.046 0.643 -9.392 1.00 0.00 H new ATOM 0 HB THR A 49 -6.464 -2.002 -8.893 1.00 0.00 H new ATOM 0 HG1 THR A 49 -4.887 -0.957 -11.085 1.00 0.00 H new ATOM 0 HG21 THR A 49 -7.822 -1.386 -10.841 1.00 0.00 H new ATOM 0 HG22 THR A 49 -8.029 -0.220 -9.512 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.006 0.195 -10.909 1.00 0.00 H new ATOM 403 N VAL A 50 -6.741 -0.125 -6.697 1.00 0.00 N ATOM 404 CA VAL A 50 -7.681 0.368 -5.716 1.00 0.00 C ATOM 405 C VAL A 50 -7.142 1.619 -5.019 1.00 0.00 C ATOM 406 O VAL A 50 -7.822 2.631 -4.929 1.00 0.00 O ATOM 407 CB VAL A 50 -8.014 -0.745 -4.693 1.00 0.00 C ATOM 408 CG1 VAL A 50 -8.840 -0.211 -3.559 1.00 0.00 C ATOM 409 CG2 VAL A 50 -8.770 -1.858 -5.386 1.00 0.00 C ATOM 0 H VAL A 50 -6.346 -1.038 -6.473 1.00 0.00 H new ATOM 0 HA VAL A 50 -8.601 0.651 -6.227 1.00 0.00 H new ATOM 0 HB VAL A 50 -7.078 -1.126 -4.285 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -9.058 -1.016 -2.857 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -8.289 0.578 -3.047 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -9.774 0.194 -3.948 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -9.005 -2.642 -4.666 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -9.695 -1.463 -5.806 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -8.156 -2.272 -6.186 1.00 0.00 H new ATOM 419 N PHE A 51 -5.907 1.550 -4.598 1.00 0.00 N ATOM 420 CA PHE A 51 -5.246 2.612 -3.907 1.00 0.00 C ATOM 421 C PHE A 51 -5.013 3.828 -4.806 1.00 0.00 C ATOM 422 O PHE A 51 -4.938 4.959 -4.342 1.00 0.00 O ATOM 423 CB PHE A 51 -3.978 2.081 -3.245 1.00 0.00 C ATOM 424 CG PHE A 51 -4.269 1.262 -1.977 1.00 0.00 C ATOM 425 CD1 PHE A 51 -5.204 0.232 -1.969 1.00 0.00 C ATOM 426 CD2 PHE A 51 -3.616 1.544 -0.801 1.00 0.00 C ATOM 427 CE1 PHE A 51 -5.463 -0.489 -0.823 1.00 0.00 C ATOM 428 CE2 PHE A 51 -3.872 0.829 0.340 1.00 0.00 C ATOM 429 CZ PHE A 51 -4.790 -0.184 0.339 1.00 0.00 C ATOM 0 H PHE A 51 -5.321 0.726 -4.733 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.895 2.981 -3.113 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -3.434 1.460 -3.957 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -3.328 2.918 -2.991 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -5.737 -0.007 -2.877 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -2.889 2.342 -0.776 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -6.189 -1.288 -0.836 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -3.342 1.069 1.250 1.00 0.00 H new ATOM 0 HZ PHE A 51 -4.986 -0.741 1.243 1.00 0.00 H new ATOM 439 N SER A 52 -4.992 3.597 -6.104 1.00 0.00 N ATOM 440 CA SER A 52 -4.867 4.672 -7.065 1.00 0.00 C ATOM 441 C SER A 52 -6.126 5.552 -7.109 1.00 0.00 C ATOM 442 O SER A 52 -6.076 6.663 -7.616 1.00 0.00 O ATOM 443 CB SER A 52 -4.541 4.134 -8.443 1.00 0.00 C ATOM 444 OG SER A 52 -3.251 3.554 -8.486 1.00 0.00 O ATOM 0 H SER A 52 -5.060 2.667 -6.518 1.00 0.00 H new ATOM 0 HA SER A 52 -4.040 5.301 -6.736 1.00 0.00 H new ATOM 0 HB2 SER A 52 -5.284 3.390 -8.728 1.00 0.00 H new ATOM 0 HB3 SER A 52 -4.602 4.941 -9.173 1.00 0.00 H new ATOM 0 HG SER A 52 -3.208 2.806 -7.855 1.00 0.00 H new ATOM 450 N GLU A 53 -7.245 5.061 -6.575 1.00 0.00 N ATOM 451 CA GLU A 53 -8.462 5.877 -6.483 1.00 0.00 C ATOM 452 C GLU A 53 -8.236 7.037 -5.488 1.00 0.00 C ATOM 453 O GLU A 53 -8.838 8.113 -5.608 1.00 0.00 O ATOM 454 CB GLU A 53 -9.675 5.025 -6.007 1.00 0.00 C ATOM 455 CG GLU A 53 -10.973 5.831 -5.851 1.00 0.00 C ATOM 456 CD GLU A 53 -12.114 5.075 -5.191 1.00 0.00 C ATOM 457 OE1 GLU A 53 -12.121 4.942 -3.962 1.00 0.00 O ATOM 458 OE2 GLU A 53 -13.072 4.668 -5.890 1.00 0.00 O ATOM 0 H GLU A 53 -7.337 4.116 -6.203 1.00 0.00 H new ATOM 0 HA GLU A 53 -8.681 6.271 -7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -9.843 4.218 -6.720 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.429 4.561 -5.052 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -10.761 6.726 -5.265 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -11.298 6.165 -6.836 1.00 0.00 H new ATOM 465 N TYR A 54 -7.337 6.824 -4.543 1.00 0.00 N ATOM 466 CA TYR A 54 -7.119 7.762 -3.452 1.00 0.00 C ATOM 467 C TYR A 54 -5.982 8.708 -3.728 1.00 0.00 C ATOM 468 O TYR A 54 -5.828 9.735 -3.062 1.00 0.00 O ATOM 469 CB TYR A 54 -6.870 6.985 -2.185 1.00 0.00 C ATOM 470 CG TYR A 54 -7.964 5.998 -1.975 1.00 0.00 C ATOM 471 CD1 TYR A 54 -9.222 6.404 -1.603 1.00 0.00 C ATOM 472 CD2 TYR A 54 -7.747 4.664 -2.202 1.00 0.00 C ATOM 473 CE1 TYR A 54 -10.230 5.500 -1.467 1.00 0.00 C ATOM 474 CE2 TYR A 54 -8.746 3.746 -2.061 1.00 0.00 C ATOM 475 CZ TYR A 54 -9.990 4.171 -1.695 1.00 0.00 C ATOM 476 OH TYR A 54 -11.008 3.275 -1.566 1.00 0.00 O ATOM 0 H TYR A 54 -6.738 5.999 -4.509 1.00 0.00 H new ATOM 0 HA TYR A 54 -8.012 8.378 -3.345 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.911 6.471 -2.246 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -6.814 7.666 -1.335 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -9.413 7.450 -1.417 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -6.763 4.332 -2.499 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -11.217 5.830 -1.180 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -8.555 2.698 -2.237 1.00 0.00 H new ATOM 0 HH TYR A 54 -11.821 3.742 -1.282 1.00 0.00 H new ATOM 486 N GLY A 55 -5.194 8.375 -4.697 1.00 0.00 N ATOM 487 CA GLY A 55 -4.087 9.183 -5.042 1.00 0.00 C ATOM 488 C GLY A 55 -3.103 8.399 -5.811 1.00 0.00 C ATOM 489 O GLY A 55 -3.464 7.418 -6.455 1.00 0.00 O ATOM 0 H GLY A 55 -5.305 7.536 -5.266 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.421 10.038 -5.630 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.622 9.579 -4.139 1.00 0.00 H new ATOM 493 N VAL A 56 -1.875 8.778 -5.719 1.00 0.00 N ATOM 494 CA VAL A 56 -0.834 8.147 -6.468 1.00 0.00 C ATOM 495 C VAL A 56 -0.006 7.244 -5.570 1.00 0.00 C ATOM 496 O VAL A 56 0.716 7.731 -4.680 1.00 0.00 O ATOM 497 CB VAL A 56 0.086 9.202 -7.128 1.00 0.00 C ATOM 498 CG1 VAL A 56 1.204 8.544 -7.925 1.00 0.00 C ATOM 499 CG2 VAL A 56 -0.727 10.118 -8.018 1.00 0.00 C ATOM 0 H VAL A 56 -1.559 9.540 -5.119 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.301 7.547 -7.249 1.00 0.00 H new ATOM 0 HB VAL A 56 0.546 9.791 -6.335 1.00 0.00 H new ATOM 0 HG11 VAL A 56 1.831 9.313 -8.375 1.00 0.00 H new ATOM 0 HG12 VAL A 56 1.808 7.925 -7.262 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.774 7.922 -8.710 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -0.070 10.856 -8.477 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.213 9.531 -8.797 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.484 10.627 -7.421 1.00 0.00 H new ATOM 509 N PRO A 57 -0.125 5.924 -5.734 1.00 0.00 N ATOM 510 CA PRO A 57 0.706 5.001 -5.016 1.00 0.00 C ATOM 511 C PRO A 57 2.080 4.970 -5.675 1.00 0.00 C ATOM 512 O PRO A 57 2.190 4.915 -6.908 1.00 0.00 O ATOM 513 CB PRO A 57 -0.021 3.663 -5.208 1.00 0.00 C ATOM 514 CG PRO A 57 -0.713 3.794 -6.510 1.00 0.00 C ATOM 515 CD PRO A 57 -1.082 5.240 -6.630 1.00 0.00 C ATOM 0 HA PRO A 57 0.856 5.248 -3.965 1.00 0.00 H new ATOM 0 HB2 PRO A 57 0.680 2.829 -5.215 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -0.729 3.478 -4.400 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -0.065 3.486 -7.330 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.599 3.160 -6.548 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -0.990 5.592 -7.657 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -2.113 5.416 -6.324 1.00 0.00 H new ATOM 523 N VAL A 58 3.116 5.002 -4.892 1.00 0.00 N ATOM 524 CA VAL A 58 4.440 5.024 -5.471 1.00 0.00 C ATOM 525 C VAL A 58 5.176 3.719 -5.243 1.00 0.00 C ATOM 526 O VAL A 58 6.079 3.371 -5.998 1.00 0.00 O ATOM 527 CB VAL A 58 5.301 6.246 -5.006 1.00 0.00 C ATOM 528 CG1 VAL A 58 4.667 7.549 -5.425 1.00 0.00 C ATOM 529 CG2 VAL A 58 5.495 6.258 -3.518 1.00 0.00 C ATOM 0 H VAL A 58 3.082 5.013 -3.873 1.00 0.00 H new ATOM 0 HA VAL A 58 4.289 5.145 -6.544 1.00 0.00 H new ATOM 0 HB VAL A 58 6.273 6.141 -5.488 1.00 0.00 H new ATOM 0 HG11 VAL A 58 5.287 8.380 -5.088 1.00 0.00 H new ATOM 0 HG12 VAL A 58 4.579 7.578 -6.511 1.00 0.00 H new ATOM 0 HG13 VAL A 58 3.676 7.632 -4.979 1.00 0.00 H new ATOM 0 HG21 VAL A 58 6.098 7.122 -3.237 1.00 0.00 H new ATOM 0 HG22 VAL A 58 4.525 6.316 -3.025 1.00 0.00 H new ATOM 0 HG23 VAL A 58 6.004 5.345 -3.210 1.00 0.00 H new ATOM 539 N ASP A 59 4.777 2.983 -4.222 1.00 0.00 N ATOM 540 CA ASP A 59 5.417 1.716 -3.916 1.00 0.00 C ATOM 541 C ASP A 59 4.477 0.880 -3.093 1.00 0.00 C ATOM 542 O ASP A 59 3.724 1.428 -2.270 1.00 0.00 O ATOM 543 CB ASP A 59 6.717 1.938 -3.136 1.00 0.00 C ATOM 544 CG ASP A 59 7.540 0.679 -3.011 1.00 0.00 C ATOM 545 OD1 ASP A 59 8.112 0.222 -4.022 1.00 0.00 O ATOM 546 OD2 ASP A 59 7.662 0.139 -1.904 1.00 0.00 O ATOM 0 H ASP A 59 4.016 3.239 -3.593 1.00 0.00 H new ATOM 0 HA ASP A 59 5.657 1.207 -4.849 1.00 0.00 H new ATOM 0 HB2 ASP A 59 7.308 2.707 -3.634 1.00 0.00 H new ATOM 0 HB3 ASP A 59 6.480 2.313 -2.140 1.00 0.00 H new ATOM 551 N VAL A 60 4.476 -0.408 -3.328 1.00 0.00 N ATOM 552 CA VAL A 60 3.641 -1.325 -2.592 1.00 0.00 C ATOM 553 C VAL A 60 4.425 -2.618 -2.316 1.00 0.00 C ATOM 554 O VAL A 60 5.159 -3.102 -3.178 1.00 0.00 O ATOM 555 CB VAL A 60 2.316 -1.632 -3.374 1.00 0.00 C ATOM 556 CG1 VAL A 60 2.582 -2.347 -4.685 1.00 0.00 C ATOM 557 CG2 VAL A 60 1.318 -2.405 -2.530 1.00 0.00 C ATOM 0 H VAL A 60 5.057 -0.853 -4.039 1.00 0.00 H new ATOM 0 HA VAL A 60 3.361 -0.866 -1.644 1.00 0.00 H new ATOM 0 HB VAL A 60 1.869 -0.666 -3.608 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.637 -2.540 -5.193 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.213 -1.723 -5.318 1.00 0.00 H new ATOM 0 HG13 VAL A 60 3.087 -3.293 -4.488 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.417 -2.594 -3.114 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.758 -3.354 -2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.061 -1.822 -1.645 1.00 0.00 H new ATOM 567 N ILE A 61 4.349 -3.113 -1.110 1.00 0.00 N ATOM 568 CA ILE A 61 4.976 -4.366 -0.749 1.00 0.00 C ATOM 569 C ILE A 61 3.926 -5.324 -0.257 1.00 0.00 C ATOM 570 O ILE A 61 3.187 -5.016 0.686 1.00 0.00 O ATOM 571 CB ILE A 61 6.055 -4.184 0.345 1.00 0.00 C ATOM 572 CG1 ILE A 61 7.140 -3.241 -0.149 1.00 0.00 C ATOM 573 CG2 ILE A 61 6.668 -5.538 0.744 1.00 0.00 C ATOM 574 CD1 ILE A 61 8.116 -2.844 0.918 1.00 0.00 C ATOM 0 H ILE A 61 3.850 -2.661 -0.344 1.00 0.00 H new ATOM 0 HA ILE A 61 5.468 -4.759 -1.639 1.00 0.00 H new ATOM 0 HB ILE A 61 5.581 -3.753 1.227 1.00 0.00 H new ATOM 0 HG12 ILE A 61 7.681 -3.718 -0.966 1.00 0.00 H new ATOM 0 HG13 ILE A 61 6.673 -2.344 -0.556 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.423 -5.383 1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.886 -6.192 1.130 1.00 0.00 H new ATOM 0 HG23 ILE A 61 7.129 -6.000 -0.129 1.00 0.00 H new ATOM 0 HD11 ILE A 61 8.862 -2.171 0.496 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.587 -2.338 1.726 1.00 0.00 H new ATOM 0 HD13 ILE A 61 8.610 -3.734 1.309 1.00 0.00 H new ATOM 586 N LEU A 62 3.838 -6.461 -0.881 1.00 0.00 N ATOM 587 CA LEU A 62 2.910 -7.462 -0.452 1.00 0.00 C ATOM 588 C LEU A 62 3.689 -8.441 0.379 1.00 0.00 C ATOM 589 O LEU A 62 4.657 -9.042 -0.103 1.00 0.00 O ATOM 590 CB LEU A 62 2.315 -8.213 -1.647 1.00 0.00 C ATOM 591 CG LEU A 62 0.845 -8.685 -1.537 1.00 0.00 C ATOM 592 CD1 LEU A 62 0.559 -9.471 -0.262 1.00 0.00 C ATOM 593 CD2 LEU A 62 -0.090 -7.513 -1.667 1.00 0.00 C ATOM 0 H LEU A 62 4.401 -6.718 -1.692 1.00 0.00 H new ATOM 0 HA LEU A 62 2.093 -6.998 0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 62 2.396 -7.569 -2.523 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.936 -9.089 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 62 0.674 -9.376 -2.362 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.489 -9.772 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.192 -10.358 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.769 -8.846 0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.121 -7.859 -1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.114 -6.795 -0.872 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.059 -7.035 -2.635 1.00 0.00 H new ATOM 605 N SER A 63 3.322 -8.591 1.602 1.00 0.00 N ATOM 606 CA SER A 63 3.958 -9.548 2.408 1.00 0.00 C ATOM 607 C SER A 63 3.279 -10.875 2.129 1.00 0.00 C ATOM 608 O SER A 63 2.074 -11.023 2.345 1.00 0.00 O ATOM 609 CB SER A 63 3.825 -9.114 3.839 1.00 0.00 C ATOM 610 OG SER A 63 4.360 -7.796 3.965 1.00 0.00 O ATOM 0 H SER A 63 2.582 -8.058 2.059 1.00 0.00 H new ATOM 0 HA SER A 63 5.023 -9.651 2.198 1.00 0.00 H new ATOM 0 HB2 SER A 63 2.778 -9.129 4.143 1.00 0.00 H new ATOM 0 HB3 SER A 63 4.357 -9.803 4.495 1.00 0.00 H new ATOM 0 HG SER A 63 4.156 -7.444 4.856 1.00 0.00 H new ATOM 616 N ARG A 64 4.026 -11.806 1.603 1.00 0.00 N ATOM 617 CA ARG A 64 3.490 -13.078 1.203 1.00 0.00 C ATOM 618 C ARG A 64 4.223 -14.176 1.900 1.00 0.00 C ATOM 619 O ARG A 64 5.453 -14.168 1.951 1.00 0.00 O ATOM 620 CB ARG A 64 3.614 -13.298 -0.308 1.00 0.00 C ATOM 621 CG ARG A 64 2.897 -12.292 -1.190 1.00 0.00 C ATOM 622 CD ARG A 64 3.041 -12.688 -2.648 1.00 0.00 C ATOM 623 NE ARG A 64 2.360 -11.774 -3.572 1.00 0.00 N ATOM 624 CZ ARG A 64 1.671 -12.167 -4.656 1.00 0.00 C ATOM 625 NH1 ARG A 64 1.330 -13.452 -4.813 1.00 0.00 N ATOM 626 NH2 ARG A 64 1.268 -11.271 -5.534 1.00 0.00 N ATOM 0 H ARG A 64 5.028 -11.704 1.439 1.00 0.00 H new ATOM 0 HA ARG A 64 2.434 -13.085 1.472 1.00 0.00 H new ATOM 0 HB2 ARG A 64 4.672 -13.291 -0.570 1.00 0.00 H new ATOM 0 HB3 ARG A 64 3.234 -14.292 -0.542 1.00 0.00 H new ATOM 0 HG2 ARG A 64 1.842 -12.245 -0.919 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.311 -11.296 -1.032 1.00 0.00 H new ATOM 0 HD2 ARG A 64 4.100 -12.727 -2.903 1.00 0.00 H new ATOM 0 HD3 ARG A 64 2.643 -13.693 -2.784 1.00 0.00 H new ATOM 0 HE ARG A 64 2.413 -10.774 -3.378 1.00 0.00 H new ATOM 0 HH11 ARG A 64 1.593 -14.139 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 64 0.807 -13.744 -5.639 1.00 0.00 H new ATOM 0 HH21 ARG A 64 1.480 -10.284 -5.389 1.00 0.00 H new ATOM 0 HH22 ARG A 64 0.745 -11.565 -6.359 1.00 0.00 H new ATOM 640 N ASP A 65 3.482 -15.089 2.459 1.00 0.00 N ATOM 641 CA ASP A 65 4.045 -16.253 3.087 1.00 0.00 C ATOM 642 C ASP A 65 4.687 -17.087 2.019 1.00 0.00 C ATOM 643 O ASP A 65 4.049 -17.388 1.019 1.00 0.00 O ATOM 644 CB ASP A 65 2.950 -17.051 3.761 1.00 0.00 C ATOM 645 CG ASP A 65 3.506 -18.172 4.584 1.00 0.00 C ATOM 646 OD1 ASP A 65 3.718 -19.265 4.042 1.00 0.00 O ATOM 647 OD2 ASP A 65 3.741 -17.974 5.793 1.00 0.00 O ATOM 0 H ASP A 65 2.463 -15.048 2.493 1.00 0.00 H new ATOM 0 HA ASP A 65 4.779 -15.961 3.838 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.358 -16.392 4.397 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.276 -17.454 3.005 1.00 0.00 H new ATOM 652 N GLU A 66 5.933 -17.431 2.209 1.00 0.00 N ATOM 653 CA GLU A 66 6.698 -18.182 1.219 1.00 0.00 C ATOM 654 C GLU A 66 6.106 -19.556 0.902 1.00 0.00 C ATOM 655 O GLU A 66 6.385 -20.128 -0.162 1.00 0.00 O ATOM 656 CB GLU A 66 8.159 -18.316 1.637 1.00 0.00 C ATOM 657 CG GLU A 66 8.376 -18.866 3.032 1.00 0.00 C ATOM 658 CD GLU A 66 9.828 -19.110 3.319 1.00 0.00 C ATOM 659 OE1 GLU A 66 10.644 -18.157 3.239 1.00 0.00 O ATOM 660 OE2 GLU A 66 10.187 -20.247 3.639 1.00 0.00 O ATOM 0 H GLU A 66 6.458 -17.203 3.053 1.00 0.00 H new ATOM 0 HA GLU A 66 6.641 -17.600 0.299 1.00 0.00 H new ATOM 0 HB2 GLU A 66 8.668 -18.964 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 66 8.632 -17.336 1.571 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.974 -18.166 3.764 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.822 -19.798 3.145 1.00 0.00 H new ATOM 667 N ASN A 67 5.286 -20.075 1.785 1.00 0.00 N ATOM 668 CA ASN A 67 4.729 -21.403 1.573 1.00 0.00 C ATOM 669 C ASN A 67 3.564 -21.321 0.636 1.00 0.00 C ATOM 670 O ASN A 67 3.498 -22.053 -0.351 1.00 0.00 O ATOM 671 CB ASN A 67 4.277 -22.065 2.878 1.00 0.00 C ATOM 672 CG ASN A 67 5.375 -22.179 3.896 1.00 0.00 C ATOM 673 OD1 ASN A 67 6.111 -23.155 3.933 1.00 0.00 O ATOM 674 ND2 ASN A 67 5.478 -21.195 4.739 1.00 0.00 N ATOM 0 H ASN A 67 4.990 -19.613 2.645 1.00 0.00 H new ATOM 0 HA ASN A 67 5.522 -22.017 1.146 1.00 0.00 H new ATOM 0 HB2 ASN A 67 3.455 -21.490 3.303 1.00 0.00 H new ATOM 0 HB3 ASN A 67 3.890 -23.060 2.658 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.193 -21.219 5.466 1.00 0.00 H new ATOM 0 HD22 ASN A 67 4.844 -20.399 4.674 1.00 0.00 H new ATOM 681 N THR A 68 2.662 -20.407 0.906 1.00 0.00 N ATOM 682 CA THR A 68 1.465 -20.307 0.103 1.00 0.00 C ATOM 683 C THR A 68 1.673 -19.392 -1.101 1.00 0.00 C ATOM 684 O THR A 68 0.999 -19.528 -2.127 1.00 0.00 O ATOM 685 CB THR A 68 0.308 -19.759 0.961 1.00 0.00 C ATOM 686 OG1 THR A 68 0.665 -18.459 1.485 1.00 0.00 O ATOM 687 CG2 THR A 68 0.040 -20.694 2.123 1.00 0.00 C ATOM 0 H THR A 68 2.731 -19.730 1.665 1.00 0.00 H new ATOM 0 HA THR A 68 1.224 -21.305 -0.262 1.00 0.00 H new ATOM 0 HB THR A 68 -0.584 -19.679 0.339 1.00 0.00 H new ATOM 0 HG1 THR A 68 -0.073 -18.112 2.029 1.00 0.00 H new ATOM 0 HG21 THR A 68 -0.779 -20.301 2.725 1.00 0.00 H new ATOM 0 HG22 THR A 68 -0.230 -21.679 1.743 1.00 0.00 H new ATOM 0 HG23 THR A 68 0.936 -20.776 2.738 1.00 0.00 H new ATOM 695 N GLY A 69 2.625 -18.479 -0.983 1.00 0.00 N ATOM 696 CA GLY A 69 2.920 -17.525 -2.040 1.00 0.00 C ATOM 697 C GLY A 69 1.790 -16.520 -2.250 1.00 0.00 C ATOM 698 O GLY A 69 1.844 -15.699 -3.172 1.00 0.00 O ATOM 0 H GLY A 69 3.212 -18.379 -0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 69 3.838 -16.990 -1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.102 -18.063 -2.971 1.00 0.00 H new ATOM 702 N GLU A 70 0.794 -16.563 -1.377 1.00 0.00 N ATOM 703 CA GLU A 70 -0.403 -15.756 -1.530 1.00 0.00 C ATOM 704 C GLU A 70 -0.264 -14.422 -0.835 1.00 0.00 C ATOM 705 O GLU A 70 -0.051 -13.407 -1.469 1.00 0.00 O ATOM 706 CB GLU A 70 -1.626 -16.515 -0.999 1.00 0.00 C ATOM 707 CG GLU A 70 -2.021 -17.730 -1.826 1.00 0.00 C ATOM 708 CD GLU A 70 -2.559 -17.352 -3.188 1.00 0.00 C ATOM 709 OE1 GLU A 70 -1.763 -17.088 -4.113 1.00 0.00 O ATOM 710 OE2 GLU A 70 -3.787 -17.324 -3.363 1.00 0.00 O ATOM 0 H GLU A 70 0.794 -17.156 -0.547 1.00 0.00 H new ATOM 0 HA GLU A 70 -0.542 -15.561 -2.593 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -1.423 -16.837 0.023 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -2.473 -15.830 -0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -1.154 -18.380 -1.949 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -2.775 -18.303 -1.287 1.00 0.00 H new ATOM 717 N SER A 71 -0.346 -14.445 0.468 1.00 0.00 N ATOM 718 CA SER A 71 -0.263 -13.260 1.261 1.00 0.00 C ATOM 719 C SER A 71 -0.062 -13.689 2.698 1.00 0.00 C ATOM 720 O SER A 71 -0.258 -14.863 3.024 1.00 0.00 O ATOM 721 CB SER A 71 -1.577 -12.443 1.127 1.00 0.00 C ATOM 722 OG SER A 71 -1.525 -11.215 1.860 1.00 0.00 O ATOM 0 H SER A 71 -0.474 -15.300 1.010 1.00 0.00 H new ATOM 0 HA SER A 71 0.564 -12.631 0.931 1.00 0.00 H new ATOM 0 HB2 SER A 71 -1.764 -12.229 0.075 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.414 -13.043 1.484 1.00 0.00 H new ATOM 0 HG SER A 71 -1.948 -10.503 1.336 1.00 0.00 H new ATOM 728 N GLN A 72 0.395 -12.785 3.520 1.00 0.00 N ATOM 729 CA GLN A 72 0.483 -13.009 4.945 1.00 0.00 C ATOM 730 C GLN A 72 -0.693 -12.348 5.615 1.00 0.00 C ATOM 731 O GLN A 72 -0.839 -12.386 6.833 1.00 0.00 O ATOM 732 CB GLN A 72 1.768 -12.454 5.499 1.00 0.00 C ATOM 733 CG GLN A 72 2.964 -13.089 4.884 1.00 0.00 C ATOM 734 CD GLN A 72 4.210 -12.807 5.617 1.00 0.00 C ATOM 735 OE1 GLN A 72 4.891 -11.824 5.365 1.00 0.00 O ATOM 736 NE2 GLN A 72 4.528 -13.669 6.514 1.00 0.00 N ATOM 0 H GLN A 72 0.720 -11.865 3.223 1.00 0.00 H new ATOM 0 HA GLN A 72 0.470 -14.082 5.138 1.00 0.00 H new ATOM 0 HB2 GLN A 72 1.801 -11.378 5.328 1.00 0.00 H new ATOM 0 HB3 GLN A 72 1.792 -12.606 6.578 1.00 0.00 H new ATOM 0 HG2 GLN A 72 2.812 -14.167 4.839 1.00 0.00 H new ATOM 0 HG3 GLN A 72 3.066 -12.738 3.857 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.924 -14.473 6.686 1.00 0.00 H new ATOM 0 HE22 GLN A 72 5.384 -13.550 7.055 1.00 0.00 H new ATOM 745 N GLY A 73 -1.525 -11.729 4.797 1.00 0.00 N ATOM 746 CA GLY A 73 -2.700 -11.083 5.284 1.00 0.00 C ATOM 747 C GLY A 73 -2.488 -9.622 5.534 1.00 0.00 C ATOM 748 O GLY A 73 -3.364 -8.958 6.056 1.00 0.00 O ATOM 0 H GLY A 73 -1.395 -11.668 3.787 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.507 -11.212 4.563 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.019 -11.564 6.209 1.00 0.00 H new ATOM 752 N PHE A 74 -1.356 -9.100 5.130 1.00 0.00 N ATOM 753 CA PHE A 74 -1.079 -7.700 5.317 1.00 0.00 C ATOM 754 C PHE A 74 -0.172 -7.224 4.206 1.00 0.00 C ATOM 755 O PHE A 74 0.548 -8.036 3.590 1.00 0.00 O ATOM 756 CB PHE A 74 -0.460 -7.408 6.713 1.00 0.00 C ATOM 757 CG PHE A 74 0.946 -7.902 6.913 1.00 0.00 C ATOM 758 CD1 PHE A 74 1.198 -9.215 7.269 1.00 0.00 C ATOM 759 CD2 PHE A 74 2.016 -7.039 6.745 1.00 0.00 C ATOM 760 CE1 PHE A 74 2.492 -9.661 7.446 1.00 0.00 C ATOM 761 CE2 PHE A 74 3.310 -7.478 6.925 1.00 0.00 C ATOM 762 CZ PHE A 74 3.548 -8.792 7.274 1.00 0.00 C ATOM 0 H PHE A 74 -0.612 -9.625 4.670 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.020 -7.151 5.279 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.475 -6.331 6.880 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -1.097 -7.858 7.475 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.373 -9.898 7.410 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.834 -6.011 6.470 1.00 0.00 H new ATOM 0 HE1 PHE A 74 2.677 -10.689 7.719 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.136 -6.795 6.793 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.561 -9.139 7.412 1.00 0.00 H new ATOM 772 N ALA A 75 -0.223 -5.953 3.921 1.00 0.00 N ATOM 773 CA ALA A 75 0.596 -5.365 2.911 1.00 0.00 C ATOM 774 C ALA A 75 0.897 -3.917 3.255 1.00 0.00 C ATOM 775 O ALA A 75 0.311 -3.349 4.187 1.00 0.00 O ATOM 776 CB ALA A 75 -0.087 -5.465 1.564 1.00 0.00 C ATOM 0 H ALA A 75 -0.843 -5.293 4.391 1.00 0.00 H new ATOM 0 HA ALA A 75 1.540 -5.908 2.860 1.00 0.00 H new ATOM 0 HB1 ALA A 75 0.546 -5.013 0.800 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -0.258 -6.513 1.320 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.042 -4.940 1.600 1.00 0.00 H new ATOM 782 N TYR A 76 1.790 -3.340 2.508 1.00 0.00 N ATOM 783 CA TYR A 76 2.225 -1.979 2.690 1.00 0.00 C ATOM 784 C TYR A 76 2.137 -1.244 1.374 1.00 0.00 C ATOM 785 O TYR A 76 2.427 -1.816 0.339 1.00 0.00 O ATOM 786 CB TYR A 76 3.682 -1.987 3.201 1.00 0.00 C ATOM 787 CG TYR A 76 4.505 -0.754 2.862 1.00 0.00 C ATOM 788 CD1 TYR A 76 4.397 0.431 3.574 1.00 0.00 C ATOM 789 CD2 TYR A 76 5.413 -0.807 1.821 1.00 0.00 C ATOM 790 CE1 TYR A 76 5.185 1.521 3.244 1.00 0.00 C ATOM 791 CE2 TYR A 76 6.187 0.264 1.485 1.00 0.00 C ATOM 792 CZ TYR A 76 6.078 1.424 2.193 1.00 0.00 C ATOM 793 OH TYR A 76 6.884 2.484 1.876 1.00 0.00 O ATOM 0 H TYR A 76 2.252 -3.813 1.731 1.00 0.00 H new ATOM 0 HA TYR A 76 1.589 -1.474 3.417 1.00 0.00 H new ATOM 0 HB2 TYR A 76 3.667 -2.105 4.284 1.00 0.00 H new ATOM 0 HB3 TYR A 76 4.187 -2.862 2.792 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.694 0.504 4.391 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.512 -1.723 1.258 1.00 0.00 H new ATOM 0 HE1 TYR A 76 5.102 2.441 3.804 1.00 0.00 H new ATOM 0 HE2 TYR A 76 6.883 0.194 0.662 1.00 0.00 H new ATOM 0 HH TYR A 76 6.656 3.249 2.444 1.00 0.00 H new ATOM 803 N LEU A 77 1.746 0.001 1.421 1.00 0.00 N ATOM 804 CA LEU A 77 1.706 0.840 0.253 1.00 0.00 C ATOM 805 C LEU A 77 1.976 2.259 0.699 1.00 0.00 C ATOM 806 O LEU A 77 1.572 2.651 1.789 1.00 0.00 O ATOM 807 CB LEU A 77 0.360 0.704 -0.529 1.00 0.00 C ATOM 808 CG LEU A 77 0.286 1.420 -1.909 1.00 0.00 C ATOM 809 CD1 LEU A 77 -0.730 0.752 -2.807 1.00 0.00 C ATOM 810 CD2 LEU A 77 -0.123 2.858 -1.746 1.00 0.00 C ATOM 0 H LEU A 77 1.444 0.465 2.277 1.00 0.00 H new ATOM 0 HA LEU A 77 2.472 0.526 -0.456 1.00 0.00 H new ATOM 0 HB2 LEU A 77 0.160 -0.356 -0.683 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.441 1.091 0.100 1.00 0.00 H new ATOM 0 HG LEU A 77 1.280 1.360 -2.353 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.764 1.270 -3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.447 -0.288 -2.966 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.713 0.792 -2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -0.168 3.337 -2.724 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.104 2.906 -1.274 1.00 0.00 H new ATOM 0 HD23 LEU A 77 0.606 3.375 -1.122 1.00 0.00 H new ATOM 822 N LYS A 78 2.720 2.986 -0.079 1.00 0.00 N ATOM 823 CA LYS A 78 3.013 4.350 0.236 1.00 0.00 C ATOM 824 C LYS A 78 2.560 5.238 -0.903 1.00 0.00 C ATOM 825 O LYS A 78 2.635 4.847 -2.094 1.00 0.00 O ATOM 826 CB LYS A 78 4.498 4.580 0.528 1.00 0.00 C ATOM 827 CG LYS A 78 5.411 4.400 -0.661 1.00 0.00 C ATOM 828 CD LYS A 78 6.831 4.875 -0.375 1.00 0.00 C ATOM 829 CE LYS A 78 6.898 6.382 -0.106 1.00 0.00 C ATOM 830 NZ LYS A 78 8.278 6.832 0.209 1.00 0.00 N ATOM 0 H LYS A 78 3.139 2.651 -0.947 1.00 0.00 H new ATOM 0 HA LYS A 78 2.470 4.603 1.147 1.00 0.00 H new ATOM 0 HB2 LYS A 78 4.625 5.590 0.917 1.00 0.00 H new ATOM 0 HB3 LYS A 78 4.810 3.894 1.315 1.00 0.00 H new ATOM 0 HG2 LYS A 78 5.432 3.348 -0.944 1.00 0.00 H new ATOM 0 HG3 LYS A 78 5.010 4.951 -1.511 1.00 0.00 H new ATOM 0 HD2 LYS A 78 7.225 4.337 0.487 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.471 4.631 -1.223 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.531 6.922 -0.979 1.00 0.00 H new ATOM 0 HE3 LYS A 78 6.237 6.631 0.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 8.254 7.815 0.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.682 6.221 0.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 8.866 6.776 -0.647 1.00 0.00 H new ATOM 844 N TYR A 79 2.082 6.388 -0.566 1.00 0.00 N ATOM 845 CA TYR A 79 1.599 7.326 -1.546 1.00 0.00 C ATOM 846 C TYR A 79 2.560 8.444 -1.754 1.00 0.00 C ATOM 847 O TYR A 79 3.485 8.643 -0.965 1.00 0.00 O ATOM 848 CB TYR A 79 0.266 7.915 -1.146 1.00 0.00 C ATOM 849 CG TYR A 79 -0.883 6.979 -1.236 1.00 0.00 C ATOM 850 CD1 TYR A 79 -1.070 5.984 -0.302 1.00 0.00 C ATOM 851 CD2 TYR A 79 -1.806 7.113 -2.248 1.00 0.00 C ATOM 852 CE1 TYR A 79 -2.139 5.153 -0.376 1.00 0.00 C ATOM 853 CE2 TYR A 79 -2.876 6.283 -2.334 1.00 0.00 C ATOM 854 CZ TYR A 79 -3.042 5.308 -1.398 1.00 0.00 C ATOM 855 OH TYR A 79 -4.110 4.497 -1.470 1.00 0.00 O ATOM 0 H TYR A 79 2.011 6.714 0.398 1.00 0.00 H new ATOM 0 HA TYR A 79 1.485 6.763 -2.473 1.00 0.00 H new ATOM 0 HB2 TYR A 79 0.339 8.280 -0.122 1.00 0.00 H new ATOM 0 HB3 TYR A 79 0.062 8.779 -1.778 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -0.356 5.864 0.499 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -1.677 7.891 -2.986 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -2.278 4.377 0.362 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -3.589 6.395 -3.137 1.00 0.00 H new ATOM 0 HH TYR A 79 -3.934 3.678 -0.961 1.00 0.00 H new ATOM 865 N GLU A 80 2.349 9.155 -2.827 1.00 0.00 N ATOM 866 CA GLU A 80 3.101 10.332 -3.145 1.00 0.00 C ATOM 867 C GLU A 80 2.696 11.454 -2.167 1.00 0.00 C ATOM 868 O GLU A 80 3.539 12.236 -1.691 1.00 0.00 O ATOM 869 CB GLU A 80 2.794 10.732 -4.591 1.00 0.00 C ATOM 870 CG GLU A 80 3.592 11.901 -5.114 1.00 0.00 C ATOM 871 CD GLU A 80 3.189 12.278 -6.514 1.00 0.00 C ATOM 872 OE1 GLU A 80 2.260 13.094 -6.669 1.00 0.00 O ATOM 873 OE2 GLU A 80 3.816 11.788 -7.489 1.00 0.00 O ATOM 0 H GLU A 80 1.634 8.926 -3.518 1.00 0.00 H new ATOM 0 HA GLU A 80 4.172 10.151 -3.049 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.974 9.872 -5.236 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.734 10.972 -4.668 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.455 12.758 -4.454 1.00 0.00 H new ATOM 0 HG3 GLU A 80 4.653 11.652 -5.097 1.00 0.00 H new ATOM 880 N ASP A 81 1.412 11.500 -1.831 1.00 0.00 N ATOM 881 CA ASP A 81 0.911 12.527 -0.933 1.00 0.00 C ATOM 882 C ASP A 81 0.173 11.923 0.263 1.00 0.00 C ATOM 883 O ASP A 81 -0.512 10.910 0.145 1.00 0.00 O ATOM 884 CB ASP A 81 0.005 13.523 -1.660 1.00 0.00 C ATOM 885 CG ASP A 81 -0.212 14.766 -0.838 1.00 0.00 C ATOM 886 OD1 ASP A 81 -1.129 14.808 -0.015 1.00 0.00 O ATOM 887 OD2 ASP A 81 0.574 15.721 -0.979 1.00 0.00 O ATOM 0 H ASP A 81 0.706 10.843 -2.165 1.00 0.00 H new ATOM 0 HA ASP A 81 1.783 13.065 -0.561 1.00 0.00 H new ATOM 0 HB2 ASP A 81 0.451 13.791 -2.618 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -0.955 13.054 -1.875 1.00 0.00 H new ATOM 892 N GLN A 82 0.336 12.558 1.399 1.00 0.00 N ATOM 893 CA GLN A 82 -0.232 12.145 2.672 1.00 0.00 C ATOM 894 C GLN A 82 -1.760 12.317 2.731 1.00 0.00 C ATOM 895 O GLN A 82 -2.437 11.659 3.515 1.00 0.00 O ATOM 896 CB GLN A 82 0.428 12.909 3.811 1.00 0.00 C ATOM 897 CG GLN A 82 1.873 12.551 4.122 1.00 0.00 C ATOM 898 CD GLN A 82 2.869 12.813 3.010 1.00 0.00 C ATOM 899 OE1 GLN A 82 2.694 13.702 2.163 1.00 0.00 O ATOM 900 NE2 GLN A 82 3.923 12.063 3.012 1.00 0.00 N ATOM 0 H GLN A 82 0.889 13.412 1.471 1.00 0.00 H new ATOM 0 HA GLN A 82 -0.032 11.079 2.778 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.383 13.973 3.579 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -0.163 12.754 4.713 1.00 0.00 H new ATOM 0 HG2 GLN A 82 2.185 13.111 5.004 1.00 0.00 H new ATOM 0 HG3 GLN A 82 1.918 11.494 4.383 1.00 0.00 H new ATOM 0 HE21 GLN A 82 4.034 11.341 3.724 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.643 12.193 2.301 1.00 0.00 H new ATOM 909 N ARG A 83 -2.294 13.202 1.927 1.00 0.00 N ATOM 910 CA ARG A 83 -3.737 13.379 1.839 1.00 0.00 C ATOM 911 C ARG A 83 -4.362 12.150 1.214 1.00 0.00 C ATOM 912 O ARG A 83 -5.464 11.742 1.547 1.00 0.00 O ATOM 913 CB ARG A 83 -4.081 14.654 1.101 1.00 0.00 C ATOM 914 CG ARG A 83 -3.791 15.896 1.925 1.00 0.00 C ATOM 915 CD ARG A 83 -3.717 17.130 1.064 1.00 0.00 C ATOM 916 NE ARG A 83 -2.527 17.103 0.208 1.00 0.00 N ATOM 917 CZ ARG A 83 -1.983 18.167 -0.375 1.00 0.00 C ATOM 918 NH1 ARG A 83 -2.597 19.340 -0.323 1.00 0.00 N ATOM 919 NH2 ARG A 83 -0.828 18.050 -1.021 1.00 0.00 N ATOM 0 H ARG A 83 -1.755 13.818 1.318 1.00 0.00 H new ATOM 0 HA ARG A 83 -4.155 13.487 2.840 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.513 14.697 0.172 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -5.136 14.640 0.829 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.569 16.023 2.678 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.849 15.767 2.459 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.612 17.201 0.446 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -3.695 18.018 1.696 1.00 0.00 H new ATOM 0 HE ARG A 83 -2.083 16.199 0.047 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.488 19.428 0.165 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.178 20.155 -0.771 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -0.360 17.145 -1.069 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.409 18.865 -1.469 1.00 0.00 H new ATOM 933 N SER A 84 -3.646 11.581 0.310 1.00 0.00 N ATOM 934 CA SER A 84 -4.026 10.358 -0.334 1.00 0.00 C ATOM 935 C SER A 84 -4.037 9.177 0.653 1.00 0.00 C ATOM 936 O SER A 84 -4.908 8.306 0.568 1.00 0.00 O ATOM 937 CB SER A 84 -3.093 10.095 -1.486 1.00 0.00 C ATOM 938 OG SER A 84 -3.126 11.170 -2.397 1.00 0.00 O ATOM 0 H SER A 84 -2.756 11.957 -0.016 1.00 0.00 H new ATOM 0 HA SER A 84 -5.043 10.461 -0.711 1.00 0.00 H new ATOM 0 HB2 SER A 84 -2.078 9.954 -1.116 1.00 0.00 H new ATOM 0 HB3 SER A 84 -3.379 9.172 -1.991 1.00 0.00 H new ATOM 0 HG SER A 84 -2.405 11.066 -3.052 1.00 0.00 H new ATOM 944 N THR A 85 -3.082 9.142 1.587 1.00 0.00 N ATOM 945 CA THR A 85 -3.015 8.031 2.520 1.00 0.00 C ATOM 946 C THR A 85 -4.244 8.026 3.440 1.00 0.00 C ATOM 947 O THR A 85 -4.890 7.003 3.607 1.00 0.00 O ATOM 948 CB THR A 85 -1.715 8.044 3.368 1.00 0.00 C ATOM 949 OG1 THR A 85 -1.672 9.188 4.185 1.00 0.00 O ATOM 950 CG2 THR A 85 -0.503 8.079 2.503 1.00 0.00 C ATOM 0 H THR A 85 -2.364 9.855 1.711 1.00 0.00 H new ATOM 0 HA THR A 85 -3.004 7.119 1.924 1.00 0.00 H new ATOM 0 HB THR A 85 -1.722 7.134 3.968 1.00 0.00 H new ATOM 0 HG1 THR A 85 -1.874 9.982 3.647 1.00 0.00 H new ATOM 0 HG21 THR A 85 0.390 8.087 3.128 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.488 7.198 1.861 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.522 8.977 1.886 1.00 0.00 H new ATOM 958 N ILE A 86 -4.601 9.197 3.965 1.00 0.00 N ATOM 959 CA ILE A 86 -5.778 9.349 4.813 1.00 0.00 C ATOM 960 C ILE A 86 -7.055 9.063 4.035 1.00 0.00 C ATOM 961 O ILE A 86 -8.006 8.484 4.578 1.00 0.00 O ATOM 962 CB ILE A 86 -5.831 10.715 5.532 1.00 0.00 C ATOM 963 CG1 ILE A 86 -5.743 11.850 4.526 1.00 0.00 C ATOM 964 CG2 ILE A 86 -4.727 10.811 6.573 1.00 0.00 C ATOM 965 CD1 ILE A 86 -5.576 13.205 5.125 1.00 0.00 C ATOM 0 H ILE A 86 -4.084 10.063 3.814 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.695 8.603 5.603 1.00 0.00 H new ATOM 0 HB ILE A 86 -6.787 10.802 6.049 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -4.905 11.659 3.856 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -6.646 11.847 3.916 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.779 11.780 7.070 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.852 10.018 7.310 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -3.758 10.704 6.086 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.523 13.950 4.331 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.426 13.424 5.772 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -4.657 13.233 5.711 1.00 0.00 H new ATOM 977 N LEU A 87 -7.076 9.481 2.762 1.00 0.00 N ATOM 978 CA LEU A 87 -8.189 9.184 1.863 1.00 0.00 C ATOM 979 C LEU A 87 -8.377 7.697 1.743 1.00 0.00 C ATOM 980 O LEU A 87 -9.495 7.195 1.841 1.00 0.00 O ATOM 981 CB LEU A 87 -7.887 9.724 0.459 1.00 0.00 C ATOM 982 CG LEU A 87 -8.395 11.106 0.127 1.00 0.00 C ATOM 983 CD1 LEU A 87 -7.821 11.574 -1.205 1.00 0.00 C ATOM 984 CD2 LEU A 87 -9.894 11.043 0.029 1.00 0.00 C ATOM 0 H LEU A 87 -6.329 10.028 2.334 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.085 9.651 2.271 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.806 9.719 0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.304 9.027 -0.268 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.089 11.808 0.903 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.196 12.572 -1.432 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.733 11.600 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.123 10.885 -1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.285 12.032 -0.211 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -10.178 10.341 -0.755 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -10.307 10.710 0.981 1.00 0.00 H new ATOM 996 N ALA A 88 -7.280 6.998 1.592 1.00 0.00 N ATOM 997 CA ALA A 88 -7.320 5.572 1.450 1.00 0.00 C ATOM 998 C ALA A 88 -7.680 4.888 2.741 1.00 0.00 C ATOM 999 O ALA A 88 -8.557 4.050 2.755 1.00 0.00 O ATOM 1000 CB ALA A 88 -6.026 5.046 0.871 1.00 0.00 C ATOM 0 H ALA A 88 -6.343 7.401 1.565 1.00 0.00 H new ATOM 0 HA ALA A 88 -8.114 5.335 0.742 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.085 3.962 0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -5.860 5.489 -0.111 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -5.199 5.307 1.531 1.00 0.00 H new ATOM 1006 N VAL A 89 -7.048 5.288 3.835 1.00 0.00 N ATOM 1007 CA VAL A 89 -7.299 4.665 5.131 1.00 0.00 C ATOM 1008 C VAL A 89 -8.772 4.736 5.506 1.00 0.00 C ATOM 1009 O VAL A 89 -9.396 3.734 5.754 1.00 0.00 O ATOM 1010 CB VAL A 89 -6.454 5.316 6.275 1.00 0.00 C ATOM 1011 CG1 VAL A 89 -6.828 4.728 7.626 1.00 0.00 C ATOM 1012 CG2 VAL A 89 -4.969 5.127 6.034 1.00 0.00 C ATOM 0 H VAL A 89 -6.359 6.039 3.854 1.00 0.00 H new ATOM 0 HA VAL A 89 -6.999 3.622 5.026 1.00 0.00 H new ATOM 0 HB VAL A 89 -6.676 6.383 6.277 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -6.227 5.196 8.406 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.884 4.911 7.823 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -6.641 3.654 7.620 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.407 5.590 6.845 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -4.739 4.062 5.995 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.692 5.593 5.088 1.00 0.00 H new ATOM 1022 N ASP A 90 -9.328 5.898 5.407 1.00 0.00 N ATOM 1023 CA ASP A 90 -10.691 6.146 5.872 1.00 0.00 C ATOM 1024 C ASP A 90 -11.747 5.534 4.957 1.00 0.00 C ATOM 1025 O ASP A 90 -12.829 5.138 5.404 1.00 0.00 O ATOM 1026 CB ASP A 90 -10.912 7.644 6.043 1.00 0.00 C ATOM 1027 CG ASP A 90 -12.299 8.004 6.522 1.00 0.00 C ATOM 1028 OD1 ASP A 90 -12.766 7.444 7.545 1.00 0.00 O ATOM 1029 OD2 ASP A 90 -12.933 8.884 5.908 1.00 0.00 O ATOM 0 H ASP A 90 -8.868 6.714 5.005 1.00 0.00 H new ATOM 0 HA ASP A 90 -10.805 5.652 6.837 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.181 8.031 6.752 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -10.726 8.140 5.091 1.00 0.00 H new ATOM 1034 N ASN A 91 -11.425 5.414 3.700 1.00 0.00 N ATOM 1035 CA ASN A 91 -12.387 4.888 2.720 1.00 0.00 C ATOM 1036 C ASN A 91 -12.303 3.354 2.650 1.00 0.00 C ATOM 1037 O ASN A 91 -13.311 2.670 2.442 1.00 0.00 O ATOM 1038 CB ASN A 91 -12.099 5.476 1.325 1.00 0.00 C ATOM 1039 CG ASN A 91 -13.234 5.311 0.297 1.00 0.00 C ATOM 1040 OD1 ASN A 91 -13.285 4.204 -0.386 1.00 0.00 O flip ATOM 1041 ND2 ASN A 91 -14.056 6.208 0.118 1.00 0.00 N flip ATOM 0 H ASN A 91 -10.516 5.666 3.313 1.00 0.00 H new ATOM 0 HA ASN A 91 -13.389 5.177 3.038 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.881 6.538 1.434 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -11.200 5.005 0.928 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.999 7.068 0.663 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -14.795 6.092 -0.576 1.00 0.00 H new ATOM 1048 N LEU A 92 -11.111 2.827 2.876 1.00 0.00 N ATOM 1049 CA LEU A 92 -10.833 1.396 2.715 1.00 0.00 C ATOM 1050 C LEU A 92 -10.973 0.638 4.003 1.00 0.00 C ATOM 1051 O LEU A 92 -11.281 -0.550 4.001 1.00 0.00 O ATOM 1052 CB LEU A 92 -9.429 1.203 2.183 1.00 0.00 C ATOM 1053 CG LEU A 92 -9.233 1.332 0.694 1.00 0.00 C ATOM 1054 CD1 LEU A 92 -7.803 1.733 0.418 1.00 0.00 C ATOM 1055 CD2 LEU A 92 -9.512 -0.007 0.043 1.00 0.00 C ATOM 0 H LEU A 92 -10.304 3.373 3.177 1.00 0.00 H new ATOM 0 HA LEU A 92 -11.568 1.005 2.012 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.779 1.928 2.673 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.087 0.213 2.484 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.910 2.086 0.292 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -7.653 1.828 -0.657 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -7.593 2.688 0.900 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -7.129 0.972 0.812 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.373 0.076 -1.035 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -8.826 -0.755 0.441 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.538 -0.307 0.254 1.00 0.00 H new ATOM 1067 N ASN A 93 -10.705 1.290 5.098 1.00 0.00 N ATOM 1068 CA ASN A 93 -10.830 0.652 6.382 1.00 0.00 C ATOM 1069 C ASN A 93 -12.291 0.327 6.627 1.00 0.00 C ATOM 1070 O ASN A 93 -13.174 1.204 6.514 1.00 0.00 O ATOM 1071 CB ASN A 93 -10.275 1.572 7.460 1.00 0.00 C ATOM 1072 CG ASN A 93 -10.318 1.014 8.856 1.00 0.00 C ATOM 1073 OD1 ASN A 93 -10.284 -0.199 9.071 1.00 0.00 O ATOM 1074 ND2 ASN A 93 -10.327 1.887 9.809 1.00 0.00 N ATOM 0 H ASN A 93 -10.399 2.262 5.130 1.00 0.00 H new ATOM 0 HA ASN A 93 -10.260 -0.277 6.407 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -9.241 1.814 7.213 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -10.834 2.507 7.441 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -10.306 1.580 10.782 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -10.355 2.882 9.588 1.00 0.00 H new ATOM 1081 N GLY A 94 -12.552 -0.921 6.906 1.00 0.00 N ATOM 1082 CA GLY A 94 -13.898 -1.373 7.119 1.00 0.00 C ATOM 1083 C GLY A 94 -14.574 -1.801 5.825 1.00 0.00 C ATOM 1084 O GLY A 94 -15.658 -2.364 5.852 1.00 0.00 O ATOM 0 H GLY A 94 -11.842 -1.648 6.992 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.892 -2.210 7.817 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -14.478 -0.575 7.583 1.00 0.00 H new ATOM 1088 N PHE A 95 -13.925 -1.560 4.700 1.00 0.00 N ATOM 1089 CA PHE A 95 -14.485 -1.886 3.398 1.00 0.00 C ATOM 1090 C PHE A 95 -14.241 -3.360 3.121 1.00 0.00 C ATOM 1091 O PHE A 95 -13.176 -3.876 3.432 1.00 0.00 O ATOM 1092 CB PHE A 95 -13.835 -0.999 2.312 1.00 0.00 C ATOM 1093 CG PHE A 95 -14.418 -1.133 0.934 1.00 0.00 C ATOM 1094 CD1 PHE A 95 -15.494 -0.366 0.551 1.00 0.00 C ATOM 1095 CD2 PHE A 95 -13.887 -2.020 0.026 1.00 0.00 C ATOM 1096 CE1 PHE A 95 -16.032 -0.486 -0.713 1.00 0.00 C ATOM 1097 CE2 PHE A 95 -14.422 -2.143 -1.235 1.00 0.00 C ATOM 1098 CZ PHE A 95 -15.496 -1.376 -1.604 1.00 0.00 C ATOM 0 H PHE A 95 -12.999 -1.135 4.661 1.00 0.00 H new ATOM 0 HA PHE A 95 -15.558 -1.695 3.387 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.916 0.043 2.622 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -12.772 -1.235 2.263 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -15.922 0.338 1.249 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -13.039 -2.627 0.307 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -16.877 0.123 -1.000 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -13.995 -2.845 -1.936 1.00 0.00 H new ATOM 0 HZ PHE A 95 -15.918 -1.473 -2.594 1.00 0.00 H new ATOM 1108 N LYS A 96 -15.214 -4.033 2.568 1.00 0.00 N ATOM 1109 CA LYS A 96 -15.090 -5.444 2.324 1.00 0.00 C ATOM 1110 C LYS A 96 -14.719 -5.731 0.891 1.00 0.00 C ATOM 1111 O LYS A 96 -15.379 -5.266 -0.046 1.00 0.00 O ATOM 1112 CB LYS A 96 -16.362 -6.241 2.710 1.00 0.00 C ATOM 1113 CG LYS A 96 -16.685 -6.324 4.212 1.00 0.00 C ATOM 1114 CD LYS A 96 -17.132 -4.994 4.796 1.00 0.00 C ATOM 1115 CE LYS A 96 -17.371 -5.089 6.290 1.00 0.00 C ATOM 1116 NZ LYS A 96 -17.793 -3.801 6.857 1.00 0.00 N ATOM 0 H LYS A 96 -16.103 -3.626 2.278 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.283 -5.783 2.973 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -17.215 -5.792 2.201 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.260 -7.256 2.325 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.468 -7.066 4.369 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -15.803 -6.673 4.749 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -16.375 -4.236 4.596 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -18.047 -4.669 4.301 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -18.134 -5.841 6.489 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.458 -5.422 6.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.767 -3.854 7.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.150 -3.051 6.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.762 -3.585 6.546 1.00 0.00 H new ATOM 1130 N ILE A 97 -13.650 -6.461 0.729 1.00 0.00 N ATOM 1131 CA ILE A 97 -13.217 -6.940 -0.558 1.00 0.00 C ATOM 1132 C ILE A 97 -13.027 -8.438 -0.398 1.00 0.00 C ATOM 1133 O ILE A 97 -12.553 -8.882 0.650 1.00 0.00 O ATOM 1134 CB ILE A 97 -11.853 -6.286 -0.985 1.00 0.00 C ATOM 1135 CG1 ILE A 97 -11.971 -4.758 -1.047 1.00 0.00 C ATOM 1136 CG2 ILE A 97 -11.376 -6.826 -2.323 1.00 0.00 C ATOM 1137 CD1 ILE A 97 -10.703 -4.043 -1.466 1.00 0.00 C ATOM 0 H ILE A 97 -13.044 -6.745 1.499 1.00 0.00 H new ATOM 0 HA ILE A 97 -13.948 -6.689 -1.326 1.00 0.00 H new ATOM 0 HB ILE A 97 -11.116 -6.549 -0.226 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -12.767 -4.496 -1.744 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -12.273 -4.390 -0.066 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.431 -6.354 -2.590 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -11.235 -7.904 -2.251 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -12.120 -6.608 -3.089 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -10.880 -2.968 -1.482 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -9.907 -4.269 -0.757 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -10.409 -4.377 -2.461 1.00 0.00 H new ATOM 1149 N GLY A 98 -13.391 -9.219 -1.401 1.00 0.00 N ATOM 1150 CA GLY A 98 -13.223 -10.666 -1.329 1.00 0.00 C ATOM 1151 C GLY A 98 -14.059 -11.344 -0.241 1.00 0.00 C ATOM 1152 O GLY A 98 -13.900 -12.545 0.013 1.00 0.00 O ATOM 0 H GLY A 98 -13.803 -8.881 -2.271 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -13.485 -11.099 -2.295 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -12.171 -10.890 -1.154 1.00 0.00 H new ATOM 1156 N GLY A 99 -14.935 -10.594 0.398 1.00 0.00 N ATOM 1157 CA GLY A 99 -15.719 -11.125 1.478 1.00 0.00 C ATOM 1158 C GLY A 99 -15.128 -10.801 2.839 1.00 0.00 C ATOM 1159 O GLY A 99 -15.689 -11.178 3.870 1.00 0.00 O ATOM 0 H GLY A 99 -15.117 -9.614 0.182 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -16.731 -10.724 1.420 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -15.798 -12.207 1.368 1.00 0.00 H new ATOM 1163 N ARG A 100 -14.014 -10.098 2.862 1.00 0.00 N ATOM 1164 CA ARG A 100 -13.369 -9.749 4.116 1.00 0.00 C ATOM 1165 C ARG A 100 -13.178 -8.247 4.230 1.00 0.00 C ATOM 1166 O ARG A 100 -13.059 -7.553 3.226 1.00 0.00 O ATOM 1167 CB ARG A 100 -12.045 -10.506 4.307 1.00 0.00 C ATOM 1168 CG ARG A 100 -11.017 -10.308 3.200 1.00 0.00 C ATOM 1169 CD ARG A 100 -9.756 -11.112 3.475 1.00 0.00 C ATOM 1170 NE ARG A 100 -10.012 -12.556 3.553 1.00 0.00 N ATOM 1171 CZ ARG A 100 -9.198 -13.448 4.138 1.00 0.00 C ATOM 1172 NH1 ARG A 100 -8.028 -13.066 4.640 1.00 0.00 N ATOM 1173 NH2 ARG A 100 -9.550 -14.723 4.204 1.00 0.00 N ATOM 0 H ARG A 100 -13.535 -9.756 2.029 1.00 0.00 H new ATOM 0 HA ARG A 100 -14.030 -10.061 4.924 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -11.601 -10.195 5.253 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -12.263 -11.571 4.392 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -11.444 -10.611 2.244 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -10.767 -9.250 3.116 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -9.027 -10.918 2.688 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -9.311 -10.775 4.411 1.00 0.00 H new ATOM 0 HE ARG A 100 -10.872 -12.907 3.131 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.743 -12.088 4.582 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -7.415 -13.751 5.083 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.440 -15.027 3.810 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.931 -15.401 4.649 1.00 0.00 H new ATOM 1187 N ALA A 101 -13.165 -7.760 5.440 1.00 0.00 N ATOM 1188 CA ALA A 101 -13.070 -6.347 5.708 1.00 0.00 C ATOM 1189 C ALA A 101 -11.636 -5.903 5.829 1.00 0.00 C ATOM 1190 O ALA A 101 -10.906 -6.377 6.698 1.00 0.00 O ATOM 1191 CB ALA A 101 -13.822 -6.007 6.976 1.00 0.00 C ATOM 0 H ALA A 101 -13.221 -8.338 6.279 1.00 0.00 H new ATOM 0 HA ALA A 101 -13.517 -5.818 4.867 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -13.744 -4.937 7.170 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -14.871 -6.279 6.861 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -13.393 -6.559 7.812 1.00 0.00 H new ATOM 1197 N LEU A 102 -11.245 -4.996 4.975 1.00 0.00 N ATOM 1198 CA LEU A 102 -9.919 -4.441 5.001 1.00 0.00 C ATOM 1199 C LEU A 102 -9.683 -3.580 6.212 1.00 0.00 C ATOM 1200 O LEU A 102 -10.598 -2.901 6.723 1.00 0.00 O ATOM 1201 CB LEU A 102 -9.604 -3.644 3.734 1.00 0.00 C ATOM 1202 CG LEU A 102 -8.962 -4.410 2.583 1.00 0.00 C ATOM 1203 CD1 LEU A 102 -8.725 -3.474 1.417 1.00 0.00 C ATOM 1204 CD2 LEU A 102 -7.642 -4.996 3.048 1.00 0.00 C ATOM 0 H LEU A 102 -11.841 -4.619 4.238 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.243 -5.295 5.051 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -10.532 -3.201 3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.943 -2.821 4.006 1.00 0.00 H new ATOM 0 HG LEU A 102 -9.625 -5.214 2.264 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -8.266 -4.025 0.596 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -9.676 -3.056 1.087 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -8.062 -2.666 1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -7.179 -5.545 2.228 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -6.979 -4.192 3.367 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -7.819 -5.673 3.884 1.00 0.00 H new ATOM 1216 N LYS A 103 -8.484 -3.630 6.687 1.00 0.00 N ATOM 1217 CA LYS A 103 -8.068 -2.826 7.777 1.00 0.00 C ATOM 1218 C LYS A 103 -6.913 -1.968 7.345 1.00 0.00 C ATOM 1219 O LYS A 103 -5.883 -2.471 6.971 1.00 0.00 O ATOM 1220 CB LYS A 103 -7.720 -3.691 9.004 1.00 0.00 C ATOM 1221 CG LYS A 103 -7.006 -2.959 10.145 1.00 0.00 C ATOM 1222 CD LYS A 103 -7.773 -1.740 10.647 1.00 0.00 C ATOM 1223 CE LYS A 103 -6.995 -1.053 11.750 1.00 0.00 C ATOM 1224 NZ LYS A 103 -7.641 0.182 12.223 1.00 0.00 N ATOM 0 H LYS A 103 -7.756 -4.243 6.319 1.00 0.00 H new ATOM 0 HA LYS A 103 -8.887 -2.175 8.082 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -8.641 -4.125 9.394 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -7.091 -4.519 8.677 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.853 -3.651 10.973 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.019 -2.645 9.806 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -7.944 -1.045 9.825 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -8.752 -2.044 11.017 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.879 -1.740 12.588 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.994 -0.818 11.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.065 0.608 12.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -7.729 0.852 11.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -8.586 -0.041 12.594 1.00 0.00 H new ATOM 1238 N ILE A 104 -7.099 -0.682 7.357 1.00 0.00 N ATOM 1239 CA ILE A 104 -6.039 0.212 6.966 1.00 0.00 C ATOM 1240 C ILE A 104 -5.742 1.079 8.151 1.00 0.00 C ATOM 1241 O ILE A 104 -6.671 1.530 8.826 1.00 0.00 O ATOM 1242 CB ILE A 104 -6.437 1.155 5.807 1.00 0.00 C ATOM 1243 CG1 ILE A 104 -7.372 0.477 4.807 1.00 0.00 C ATOM 1244 CG2 ILE A 104 -5.178 1.635 5.086 1.00 0.00 C ATOM 1245 CD1 ILE A 104 -6.788 -0.712 4.073 1.00 0.00 C ATOM 0 H ILE A 104 -7.969 -0.225 7.631 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.194 -0.392 6.634 1.00 0.00 H new ATOM 0 HB ILE A 104 -6.973 2.000 6.238 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.268 0.151 5.336 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -7.688 1.217 4.072 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -5.458 2.300 4.269 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.539 2.171 5.788 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -4.638 0.777 4.687 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.533 -1.119 3.389 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -5.911 -0.396 3.508 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -6.500 -1.478 4.793 1.00 0.00 H new ATOM 1257 N ASP A 105 -4.495 1.253 8.457 1.00 0.00 N ATOM 1258 CA ASP A 105 -4.104 2.118 9.551 1.00 0.00 C ATOM 1259 C ASP A 105 -2.802 2.820 9.203 1.00 0.00 C ATOM 1260 O ASP A 105 -2.071 2.348 8.341 1.00 0.00 O ATOM 1261 CB ASP A 105 -3.959 1.304 10.833 1.00 0.00 C ATOM 1262 CG ASP A 105 -3.889 2.187 12.057 1.00 0.00 C ATOM 1263 OD1 ASP A 105 -4.862 2.921 12.335 1.00 0.00 O ATOM 1264 OD2 ASP A 105 -2.880 2.161 12.766 1.00 0.00 O ATOM 0 H ASP A 105 -3.718 0.809 7.968 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.873 2.873 9.713 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -4.803 0.621 10.926 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.059 0.692 10.775 1.00 0.00 H new ATOM 1269 N HIS A 106 -2.516 3.937 9.825 1.00 0.00 N ATOM 1270 CA HIS A 106 -1.260 4.624 9.587 1.00 0.00 C ATOM 1271 C HIS A 106 -0.126 4.032 10.392 1.00 0.00 C ATOM 1272 O HIS A 106 -0.243 3.819 11.598 1.00 0.00 O ATOM 1273 CB HIS A 106 -1.362 6.127 9.817 1.00 0.00 C ATOM 1274 CG HIS A 106 -1.618 6.889 8.565 1.00 0.00 C ATOM 1275 ND1 HIS A 106 -2.792 7.522 8.256 1.00 0.00 N ATOM 1276 CD2 HIS A 106 -0.786 7.134 7.539 1.00 0.00 C ATOM 1277 CE1 HIS A 106 -2.636 8.115 7.078 1.00 0.00 C ATOM 1278 NE2 HIS A 106 -1.432 7.907 6.604 1.00 0.00 N ATOM 0 H HIS A 106 -3.131 4.393 10.499 1.00 0.00 H new ATOM 0 HA HIS A 106 -1.033 4.473 8.532 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -2.163 6.327 10.528 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -0.437 6.484 10.271 1.00 0.00 H new ATOM 0 HD2 HIS A 106 0.231 6.779 7.461 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -3.400 8.692 6.577 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -1.052 8.249 5.721 1.00 0.00 H new ATOM 1286 N THR A 107 0.965 3.781 9.728 1.00 0.00 N ATOM 1287 CA THR A 107 2.120 3.174 10.330 1.00 0.00 C ATOM 1288 C THR A 107 3.339 3.773 9.640 1.00 0.00 C ATOM 1289 O THR A 107 3.194 4.399 8.589 1.00 0.00 O ATOM 1290 CB THR A 107 2.100 1.611 10.088 1.00 0.00 C ATOM 1291 OG1 THR A 107 3.099 0.957 10.879 1.00 0.00 O ATOM 1292 CG2 THR A 107 2.367 1.283 8.617 1.00 0.00 C ATOM 0 H THR A 107 1.080 3.995 8.737 1.00 0.00 H new ATOM 0 HA THR A 107 2.137 3.355 11.405 1.00 0.00 H new ATOM 0 HB THR A 107 1.110 1.256 10.374 1.00 0.00 H new ATOM 0 HG1 THR A 107 3.067 -0.008 10.714 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.348 0.202 8.476 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.598 1.743 7.996 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.345 1.669 8.330 1.00 0.00 H new ATOM 1300 N PHE A 108 4.494 3.652 10.214 1.00 0.00 N ATOM 1301 CA PHE A 108 5.670 4.032 9.501 1.00 0.00 C ATOM 1302 C PHE A 108 6.424 2.766 9.186 1.00 0.00 C ATOM 1303 O PHE A 108 6.947 2.100 10.080 1.00 0.00 O ATOM 1304 CB PHE A 108 6.541 4.987 10.320 1.00 0.00 C ATOM 1305 CG PHE A 108 5.867 6.280 10.679 1.00 0.00 C ATOM 1306 CD1 PHE A 108 5.779 7.303 9.757 1.00 0.00 C ATOM 1307 CD2 PHE A 108 5.318 6.468 11.937 1.00 0.00 C ATOM 1308 CE1 PHE A 108 5.160 8.492 10.078 1.00 0.00 C ATOM 1309 CE2 PHE A 108 4.698 7.655 12.265 1.00 0.00 C ATOM 1310 CZ PHE A 108 4.618 8.669 11.333 1.00 0.00 C ATOM 0 H PHE A 108 4.647 3.299 11.159 1.00 0.00 H new ATOM 0 HA PHE A 108 5.399 4.565 8.589 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.849 4.484 11.237 1.00 0.00 H new ATOM 0 HB3 PHE A 108 7.448 5.207 9.757 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.200 7.170 8.772 1.00 0.00 H new ATOM 0 HD2 PHE A 108 5.376 5.676 12.669 1.00 0.00 H new ATOM 0 HE1 PHE A 108 5.100 9.284 9.347 1.00 0.00 H new ATOM 0 HE2 PHE A 108 4.276 7.791 13.250 1.00 0.00 H new ATOM 0 HZ PHE A 108 4.132 9.600 11.586 1.00 0.00 H new ATOM 1320 N TYR A 109 6.460 2.426 7.938 1.00 0.00 N ATOM 1321 CA TYR A 109 7.125 1.238 7.511 1.00 0.00 C ATOM 1322 C TYR A 109 8.414 1.587 6.799 1.00 0.00 C ATOM 1323 O TYR A 109 8.459 2.551 6.041 1.00 0.00 O ATOM 1324 CB TYR A 109 6.194 0.388 6.625 1.00 0.00 C ATOM 1325 CG TYR A 109 6.805 -0.912 6.141 1.00 0.00 C ATOM 1326 CD1 TYR A 109 6.747 -2.067 6.909 1.00 0.00 C ATOM 1327 CD2 TYR A 109 7.452 -0.976 4.922 1.00 0.00 C ATOM 1328 CE1 TYR A 109 7.319 -3.247 6.467 1.00 0.00 C ATOM 1329 CE2 TYR A 109 8.024 -2.134 4.476 1.00 0.00 C ATOM 1330 CZ TYR A 109 7.961 -3.273 5.247 1.00 0.00 C ATOM 1331 OH TYR A 109 8.550 -4.441 4.799 1.00 0.00 O ATOM 0 H TYR A 109 6.029 2.964 7.186 1.00 0.00 H new ATOM 0 HA TYR A 109 7.381 0.639 8.385 1.00 0.00 H new ATOM 0 HB2 TYR A 109 5.286 0.162 7.185 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.896 0.980 5.759 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.248 -2.044 7.866 1.00 0.00 H new ATOM 0 HD2 TYR A 109 7.507 -0.090 4.307 1.00 0.00 H new ATOM 0 HE1 TYR A 109 7.263 -4.140 7.072 1.00 0.00 H new ATOM 0 HE2 TYR A 109 8.525 -2.156 3.520 1.00 0.00 H new ATOM 0 HH TYR A 109 8.958 -4.286 3.921 1.00 0.00 H new ATOM 1341 N ARG A 110 9.458 0.837 7.059 1.00 0.00 N ATOM 1342 CA ARG A 110 10.697 1.006 6.332 1.00 0.00 C ATOM 1343 C ARG A 110 10.959 -0.261 5.532 1.00 0.00 C ATOM 1344 O ARG A 110 11.099 -1.333 6.106 1.00 0.00 O ATOM 1345 CB ARG A 110 11.907 1.357 7.240 1.00 0.00 C ATOM 1346 CG ARG A 110 11.854 2.750 7.887 1.00 0.00 C ATOM 1347 CD ARG A 110 10.810 2.834 8.985 1.00 0.00 C ATOM 1348 NE ARG A 110 10.610 4.197 9.471 1.00 0.00 N ATOM 1349 CZ ARG A 110 10.096 4.514 10.658 1.00 0.00 C ATOM 1350 NH1 ARG A 110 9.805 3.561 11.548 1.00 0.00 N ATOM 1351 NH2 ARG A 110 9.877 5.780 10.952 1.00 0.00 N ATOM 0 H ARG A 110 9.476 0.104 7.768 1.00 0.00 H new ATOM 0 HA ARG A 110 10.585 1.863 5.667 1.00 0.00 H new ATOM 0 HB2 ARG A 110 11.978 0.609 8.030 1.00 0.00 H new ATOM 0 HB3 ARG A 110 12.819 1.283 6.648 1.00 0.00 H new ATOM 0 HG2 ARG A 110 12.833 2.994 8.300 1.00 0.00 H new ATOM 0 HG3 ARG A 110 11.635 3.495 7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 110 9.863 2.444 8.611 1.00 0.00 H new ATOM 0 HD3 ARG A 110 11.111 2.197 9.817 1.00 0.00 H new ATOM 0 HE ARG A 110 10.884 4.963 8.856 1.00 0.00 H new ATOM 0 HH11 ARG A 110 9.976 2.581 11.321 1.00 0.00 H new ATOM 0 HH12 ARG A 110 9.412 3.813 12.455 1.00 0.00 H new ATOM 0 HH21 ARG A 110 10.101 6.507 10.273 1.00 0.00 H new ATOM 0 HH22 ARG A 110 9.484 6.032 11.859 1.00 0.00 H new ATOM 1365 N PRO A 111 10.955 -0.167 4.200 1.00 0.00 N ATOM 1366 CA PRO A 111 11.148 -1.318 3.310 1.00 0.00 C ATOM 1367 C PRO A 111 12.507 -2.003 3.423 1.00 0.00 C ATOM 1368 O PRO A 111 13.550 -1.358 3.623 1.00 0.00 O ATOM 1369 CB PRO A 111 10.971 -0.719 1.909 1.00 0.00 C ATOM 1370 CG PRO A 111 11.257 0.724 2.086 1.00 0.00 C ATOM 1371 CD PRO A 111 10.705 1.062 3.428 1.00 0.00 C ATOM 0 HA PRO A 111 10.445 -2.111 3.564 1.00 0.00 H new ATOM 0 HB2 PRO A 111 11.655 -1.175 1.193 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.961 -0.881 1.533 1.00 0.00 H new ATOM 0 HG2 PRO A 111 12.327 0.924 2.037 1.00 0.00 H new ATOM 0 HG3 PRO A 111 10.786 1.319 1.304 1.00 0.00 H new ATOM 0 HD2 PRO A 111 11.207 1.925 3.867 1.00 0.00 H new ATOM 0 HD3 PRO A 111 9.643 1.301 3.380 1.00 0.00 H new ATOM 1379 N LYS A 112 12.463 -3.311 3.331 1.00 0.00 N ATOM 1380 CA LYS A 112 13.626 -4.154 3.258 1.00 0.00 C ATOM 1381 C LYS A 112 13.493 -4.912 1.949 1.00 0.00 C ATOM 1382 O LYS A 112 12.414 -5.416 1.648 1.00 0.00 O ATOM 1383 CB LYS A 112 13.678 -5.117 4.491 1.00 0.00 C ATOM 1384 CG LYS A 112 14.922 -6.032 4.600 1.00 0.00 C ATOM 1385 CD LYS A 112 14.908 -7.174 3.588 1.00 0.00 C ATOM 1386 CE LYS A 112 16.198 -7.969 3.597 1.00 0.00 C ATOM 1387 NZ LYS A 112 16.177 -9.057 2.589 1.00 0.00 N ATOM 0 H LYS A 112 11.586 -3.832 3.304 1.00 0.00 H new ATOM 0 HA LYS A 112 14.555 -3.585 3.283 1.00 0.00 H new ATOM 0 HB2 LYS A 112 13.617 -4.515 5.397 1.00 0.00 H new ATOM 0 HB3 LYS A 112 12.790 -5.749 4.468 1.00 0.00 H new ATOM 0 HG2 LYS A 112 15.821 -5.434 4.453 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.976 -6.446 5.607 1.00 0.00 H new ATOM 0 HD2 LYS A 112 14.073 -7.839 3.806 1.00 0.00 H new ATOM 0 HD3 LYS A 112 14.741 -6.769 2.590 1.00 0.00 H new ATOM 0 HE2 LYS A 112 17.038 -7.303 3.397 1.00 0.00 H new ATOM 0 HE3 LYS A 112 16.357 -8.394 4.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 17.137 -9.204 2.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 15.839 -9.935 3.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 15.540 -8.796 1.809 1.00 0.00 H new ATOM 1401 N ARG A 113 14.532 -4.951 1.163 1.00 0.00 N ATOM 1402 CA ARG A 113 14.493 -5.658 -0.102 1.00 0.00 C ATOM 1403 C ARG A 113 15.411 -6.868 -0.023 1.00 0.00 C ATOM 1404 O ARG A 113 16.606 -6.731 -0.309 1.00 0.00 O ATOM 1405 CB ARG A 113 14.920 -4.734 -1.259 1.00 0.00 C ATOM 1406 CG ARG A 113 14.153 -3.420 -1.332 1.00 0.00 C ATOM 1407 CD ARG A 113 12.658 -3.625 -1.505 1.00 0.00 C ATOM 1408 NE ARG A 113 11.937 -2.347 -1.476 1.00 0.00 N ATOM 1409 CZ ARG A 113 10.649 -2.180 -1.794 1.00 0.00 C ATOM 1410 NH1 ARG A 113 9.929 -3.203 -2.248 1.00 0.00 N ATOM 1411 NH2 ARG A 113 10.092 -0.986 -1.664 1.00 0.00 N ATOM 1412 OXT ARG A 113 14.958 -7.957 0.379 1.00 0.00 O ATOM 0 H ARG A 113 15.424 -4.502 1.371 1.00 0.00 H new ATOM 0 HA ARG A 113 13.472 -5.986 -0.297 1.00 0.00 H new ATOM 0 HB2 ARG A 113 15.983 -4.515 -1.159 1.00 0.00 H new ATOM 0 HB3 ARG A 113 14.792 -5.268 -2.200 1.00 0.00 H new ATOM 0 HG2 ARG A 113 14.335 -2.847 -0.423 1.00 0.00 H new ATOM 0 HG3 ARG A 113 14.533 -2.827 -2.164 1.00 0.00 H new ATOM 0 HD2 ARG A 113 12.465 -4.132 -2.450 1.00 0.00 H new ATOM 0 HD3 ARG A 113 12.284 -4.274 -0.713 1.00 0.00 H new ATOM 0 HE ARG A 113 12.461 -1.520 -1.190 1.00 0.00 H new ATOM 0 HH11 ARG A 113 10.359 -4.122 -2.355 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.947 -3.068 -2.489 1.00 0.00 H new ATOM 0 HH21 ARG A 113 10.645 -0.200 -1.323 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.110 -0.852 -1.905 1.00 0.00 H new TER 1426 ARG A 113 ATOM 1427 N ASN B 222 -14.115 11.558 -0.836 1.00 0.00 N ATOM 1428 CA ASN B 222 -14.143 11.725 0.616 1.00 0.00 C ATOM 1429 C ASN B 222 -13.735 13.161 1.036 1.00 0.00 C ATOM 1430 O ASN B 222 -13.203 13.342 2.105 1.00 0.00 O ATOM 1431 CB ASN B 222 -13.243 10.655 1.280 1.00 0.00 C ATOM 1432 CG ASN B 222 -13.417 10.544 2.798 1.00 0.00 C ATOM 1433 OD1 ASN B 222 -14.484 10.860 3.347 1.00 0.00 O ATOM 1434 ND2 ASN B 222 -12.400 10.075 3.478 1.00 0.00 N ATOM 0 HA ASN B 222 -15.166 11.582 0.964 1.00 0.00 H new ATOM 0 HB2 ASN B 222 -13.456 9.686 0.829 1.00 0.00 H new ATOM 0 HB3 ASN B 222 -12.201 10.886 1.061 1.00 0.00 H new ATOM 0 HD21 ASN B 222 -12.472 9.960 4.489 1.00 0.00 H new ATOM 0 HD22 ASN B 222 -11.536 9.824 2.996 1.00 0.00 H new ATOM 1443 N ARG B 223 -14.057 14.182 0.175 1.00 0.00 N ATOM 1444 CA ARG B 223 -13.881 15.674 0.433 1.00 0.00 C ATOM 1445 C ARG B 223 -12.477 16.220 0.064 1.00 0.00 C ATOM 1446 O ARG B 223 -12.157 17.386 0.318 1.00 0.00 O ATOM 1447 CB ARG B 223 -14.307 16.082 1.890 1.00 0.00 C ATOM 1448 CG ARG B 223 -13.171 16.168 2.927 1.00 0.00 C ATOM 1449 CD ARG B 223 -13.672 15.900 4.329 1.00 0.00 C ATOM 1450 NE ARG B 223 -14.049 14.485 4.492 1.00 0.00 N ATOM 1451 CZ ARG B 223 -14.634 13.955 5.571 1.00 0.00 C ATOM 1452 NH1 ARG B 223 -14.954 14.725 6.604 1.00 0.00 N ATOM 1453 NH2 ARG B 223 -14.900 12.649 5.610 1.00 0.00 N ATOM 0 H ARG B 223 -14.457 13.996 -0.745 1.00 0.00 H new ATOM 0 HA ARG B 223 -14.570 16.161 -0.257 1.00 0.00 H new ATOM 0 HB2 ARG B 223 -14.804 17.051 1.844 1.00 0.00 H new ATOM 0 HB3 ARG B 223 -15.044 15.362 2.247 1.00 0.00 H new ATOM 0 HG2 ARG B 223 -12.393 15.448 2.675 1.00 0.00 H new ATOM 0 HG3 ARG B 223 -12.715 17.157 2.886 1.00 0.00 H new ATOM 0 HD2 ARG B 223 -12.898 16.160 5.052 1.00 0.00 H new ATOM 0 HD3 ARG B 223 -14.532 16.536 4.540 1.00 0.00 H new ATOM 0 HE ARG B 223 -13.846 13.856 3.715 1.00 0.00 H new ATOM 0 HH11 ARG B 223 -14.754 15.725 6.576 1.00 0.00 H new ATOM 0 HH12 ARG B 223 -15.400 14.317 7.425 1.00 0.00 H new ATOM 0 HH21 ARG B 223 -14.657 12.055 4.817 1.00 0.00 H new ATOM 0 HH22 ARG B 223 -15.346 12.244 6.433 1.00 0.00 H new ATOM 1467 N PHE B 224 -11.681 15.413 -0.579 1.00 0.00 N ATOM 1468 CA PHE B 224 -10.326 15.813 -0.967 1.00 0.00 C ATOM 1469 C PHE B 224 -10.246 15.917 -2.473 1.00 0.00 C ATOM 1470 O PHE B 224 -11.114 15.386 -3.175 1.00 0.00 O ATOM 1471 CB PHE B 224 -9.307 14.779 -0.489 1.00 0.00 C ATOM 1472 CG PHE B 224 -9.241 14.582 1.004 1.00 0.00 C ATOM 1473 CD1 PHE B 224 -10.238 13.891 1.656 1.00 0.00 C ATOM 1474 CD2 PHE B 224 -8.178 15.056 1.739 1.00 0.00 C ATOM 1475 CE1 PHE B 224 -10.199 13.665 2.998 1.00 0.00 C ATOM 1476 CE2 PHE B 224 -8.121 14.843 3.101 1.00 0.00 C ATOM 1477 CZ PHE B 224 -9.135 14.142 3.735 1.00 0.00 C ATOM 0 H PHE B 224 -11.935 14.464 -0.855 1.00 0.00 H new ATOM 0 HA PHE B 224 -10.102 16.776 -0.509 1.00 0.00 H new ATOM 0 HB2 PHE B 224 -9.539 13.822 -0.955 1.00 0.00 H new ATOM 0 HB3 PHE B 224 -8.320 15.075 -0.844 1.00 0.00 H new ATOM 0 HD1 PHE B 224 -11.076 13.517 1.086 1.00 0.00 H new ATOM 0 HD2 PHE B 224 -7.384 15.598 1.247 1.00 0.00 H new ATOM 0 HE1 PHE B 224 -10.994 13.117 3.481 1.00 0.00 H new ATOM 0 HE2 PHE B 224 -7.287 15.222 3.673 1.00 0.00 H new ATOM 0 HZ PHE B 224 -9.092 13.970 4.800 1.00 0.00 H new ATOM 1487 N ALA B 225 -9.223 16.565 -2.972 1.00 0.00 N ATOM 1488 CA ALA B 225 -9.048 16.699 -4.395 1.00 0.00 C ATOM 1489 C ALA B 225 -7.634 16.342 -4.791 1.00 0.00 C ATOM 1490 O ALA B 225 -6.759 17.204 -4.882 1.00 0.00 O ATOM 1491 CB ALA B 225 -9.420 18.093 -4.885 1.00 0.00 C ATOM 0 H ALA B 225 -8.497 17.009 -2.410 1.00 0.00 H new ATOM 0 HA ALA B 225 -9.729 15.999 -4.879 1.00 0.00 H new ATOM 0 HB1 ALA B 225 -9.273 18.151 -5.964 1.00 0.00 H new ATOM 0 HB2 ALA B 225 -10.465 18.295 -4.650 1.00 0.00 H new ATOM 0 HB3 ALA B 225 -8.788 18.832 -4.393 1.00 0.00 H new ATOM 1497 N ILE B 226 -7.398 15.065 -4.916 1.00 0.00 N ATOM 1498 CA ILE B 226 -6.129 14.552 -5.356 1.00 0.00 C ATOM 1499 C ILE B 226 -6.364 13.718 -6.605 1.00 0.00 C ATOM 1500 O ILE B 226 -7.364 12.971 -6.688 1.00 0.00 O ATOM 1501 CB ILE B 226 -5.375 13.694 -4.255 1.00 0.00 C ATOM 1502 CG1 ILE B 226 -4.912 14.537 -3.058 1.00 0.00 C ATOM 1503 CG2 ILE B 226 -4.191 12.950 -4.822 1.00 0.00 C ATOM 1504 CD1 ILE B 226 -5.949 14.765 -2.002 1.00 0.00 C ATOM 0 H ILE B 226 -8.089 14.343 -4.713 1.00 0.00 H new ATOM 0 HA ILE B 226 -5.478 15.401 -5.563 1.00 0.00 H new ATOM 0 HB ILE B 226 -6.113 12.973 -3.904 1.00 0.00 H new ATOM 0 HG12 ILE B 226 -4.052 14.049 -2.601 1.00 0.00 H new ATOM 0 HG13 ILE B 226 -4.571 15.505 -3.425 1.00 0.00 H new ATOM 0 HG21 ILE B 226 -3.708 12.378 -4.030 1.00 0.00 H new ATOM 0 HG22 ILE B 226 -4.529 12.272 -5.606 1.00 0.00 H new ATOM 0 HG23 ILE B 226 -3.480 13.662 -5.240 1.00 0.00 H new ATOM 0 HD11 ILE B 226 -5.525 15.370 -1.200 1.00 0.00 H new ATOM 0 HD12 ILE B 226 -6.803 15.285 -2.437 1.00 0.00 H new ATOM 0 HD13 ILE B 226 -6.275 13.806 -1.599 1.00 0.00 H new ATOM 1516 N MET B 227 -5.493 13.878 -7.572 1.00 0.00 N ATOM 1517 CA MET B 227 -5.573 13.156 -8.818 1.00 0.00 C ATOM 1518 C MET B 227 -5.268 11.687 -8.591 1.00 0.00 C ATOM 1519 O MET B 227 -4.350 11.346 -7.841 1.00 0.00 O ATOM 1520 CB MET B 227 -4.590 13.719 -9.840 1.00 0.00 C ATOM 1521 CG MET B 227 -4.817 15.162 -10.199 1.00 0.00 C ATOM 1522 SD MET B 227 -3.591 15.777 -11.371 1.00 0.00 S ATOM 1523 CE MET B 227 -4.098 17.484 -11.491 1.00 0.00 C ATOM 0 H MET B 227 -4.702 14.519 -7.515 1.00 0.00 H new ATOM 0 HA MET B 227 -6.586 13.267 -9.205 1.00 0.00 H new ATOM 0 HB2 MET B 227 -3.578 13.610 -9.449 1.00 0.00 H new ATOM 0 HB3 MET B 227 -4.647 13.119 -10.748 1.00 0.00 H new ATOM 0 HG2 MET B 227 -5.813 15.275 -10.626 1.00 0.00 H new ATOM 0 HG3 MET B 227 -4.787 15.768 -9.294 1.00 0.00 H new ATOM 0 HE1 MET B 227 -3.440 18.011 -12.181 1.00 0.00 H new ATOM 0 HE2 MET B 227 -5.123 17.534 -11.858 1.00 0.00 H new ATOM 0 HE3 MET B 227 -4.041 17.950 -10.507 1.00 0.00 H new ATOM 1533 N PRO B 228 -6.034 10.806 -9.220 1.00 0.00 N ATOM 1534 CA PRO B 228 -5.845 9.365 -9.097 1.00 0.00 C ATOM 1535 C PRO B 228 -4.528 8.893 -9.737 1.00 0.00 C ATOM 1536 O PRO B 228 -3.989 9.541 -10.658 1.00 0.00 O ATOM 1537 CB PRO B 228 -7.047 8.785 -9.849 1.00 0.00 C ATOM 1538 CG PRO B 228 -7.435 9.852 -10.811 1.00 0.00 C ATOM 1539 CD PRO B 228 -7.166 11.140 -10.102 1.00 0.00 C ATOM 0 HA PRO B 228 -5.784 9.047 -8.056 1.00 0.00 H new ATOM 0 HB2 PRO B 228 -6.784 7.862 -10.365 1.00 0.00 H new ATOM 0 HB3 PRO B 228 -7.865 8.548 -9.168 1.00 0.00 H new ATOM 0 HG2 PRO B 228 -6.855 9.781 -11.731 1.00 0.00 H new ATOM 0 HG3 PRO B 228 -8.486 9.768 -11.089 1.00 0.00 H new ATOM 0 HD2 PRO B 228 -6.912 11.938 -10.799 1.00 0.00 H new ATOM 0 HD3 PRO B 228 -8.034 11.477 -9.534 1.00 0.00 H new ATOM 1547 N GLY B 229 -4.022 7.786 -9.242 1.00 0.00 N ATOM 1548 CA GLY B 229 -2.786 7.215 -9.729 1.00 0.00 C ATOM 1549 C GLY B 229 -2.931 6.574 -11.087 1.00 0.00 C ATOM 1550 O GLY B 229 -4.043 6.343 -11.562 1.00 0.00 O ATOM 0 H GLY B 229 -4.457 7.255 -8.488 1.00 0.00 H new ATOM 0 HA2 GLY B 229 -2.026 7.995 -9.780 1.00 0.00 H new ATOM 0 HA3 GLY B 229 -2.430 6.470 -9.017 1.00 0.00 H new ATOM 1554 N SER B 230 -1.818 6.239 -11.683 1.00 0.00 N ATOM 1555 CA SER B 230 -1.768 5.701 -13.025 1.00 0.00 C ATOM 1556 C SER B 230 -2.187 4.226 -13.073 1.00 0.00 C ATOM 1557 O SER B 230 -2.469 3.689 -14.140 1.00 0.00 O ATOM 1558 CB SER B 230 -0.356 5.891 -13.581 1.00 0.00 C ATOM 1559 OG SER B 230 0.021 7.270 -13.506 1.00 0.00 O ATOM 0 H SER B 230 -0.901 6.332 -11.245 1.00 0.00 H new ATOM 0 HA SER B 230 -2.484 6.242 -13.644 1.00 0.00 H new ATOM 0 HB2 SER B 230 0.350 5.282 -13.017 1.00 0.00 H new ATOM 0 HB3 SER B 230 -0.315 5.551 -14.616 1.00 0.00 H new ATOM 0 HG SER B 230 0.927 7.381 -13.863 1.00 0.00 H new ATOM 1565 N ARG B 231 -2.250 3.586 -11.917 1.00 0.00 N ATOM 1566 CA ARG B 231 -2.603 2.164 -11.838 1.00 0.00 C ATOM 1567 C ARG B 231 -4.123 2.003 -11.762 1.00 0.00 C ATOM 1568 O ARG B 231 -4.639 0.886 -11.665 1.00 0.00 O ATOM 1569 CB ARG B 231 -1.997 1.542 -10.580 1.00 0.00 C ATOM 1570 CG ARG B 231 -0.506 1.756 -10.401 1.00 0.00 C ATOM 1571 CD ARG B 231 0.326 1.040 -11.449 1.00 0.00 C ATOM 1572 NE ARG B 231 1.758 1.233 -11.194 1.00 0.00 N ATOM 1573 CZ ARG B 231 2.725 0.340 -11.452 1.00 0.00 C ATOM 1574 NH1 ARG B 231 2.439 -0.813 -12.033 1.00 0.00 N ATOM 1575 NH2 ARG B 231 3.974 0.614 -11.137 1.00 0.00 N ATOM 0 H ARG B 231 -2.062 4.023 -11.015 1.00 0.00 H new ATOM 0 HA ARG B 231 -2.216 1.667 -12.728 1.00 0.00 H new ATOM 0 HB2 ARG B 231 -2.512 1.949 -9.710 1.00 0.00 H new ATOM 0 HB3 ARG B 231 -2.194 0.470 -10.594 1.00 0.00 H new ATOM 0 HG2 ARG B 231 -0.290 2.824 -10.441 1.00 0.00 H new ATOM 0 HG3 ARG B 231 -0.211 1.408 -9.411 1.00 0.00 H new ATOM 0 HD2 ARG B 231 0.091 -0.024 -11.443 1.00 0.00 H new ATOM 0 HD3 ARG B 231 0.074 1.417 -12.440 1.00 0.00 H new ATOM 0 HE ARG B 231 2.043 2.123 -10.785 1.00 0.00 H new ATOM 0 HH11 ARG B 231 1.476 -1.030 -12.289 1.00 0.00 H new ATOM 0 HH12 ARG B 231 3.182 -1.485 -12.225 1.00 0.00 H new ATOM 0 HH21 ARG B 231 4.205 1.505 -10.697 1.00 0.00 H new ATOM 0 HH22 ARG B 231 4.710 -0.065 -11.333 1.00 0.00 H new ATOM 1589 N TRP B 232 -4.816 3.121 -11.779 1.00 0.00 N ATOM 1590 CA TRP B 232 -6.242 3.142 -11.639 1.00 0.00 C ATOM 1591 C TRP B 232 -6.946 2.751 -12.904 1.00 0.00 C ATOM 1592 O TRP B 232 -6.721 3.306 -13.988 1.00 0.00 O ATOM 1593 CB TRP B 232 -6.749 4.507 -11.134 1.00 0.00 C ATOM 1594 CG TRP B 232 -8.224 4.549 -10.810 1.00 0.00 C ATOM 1595 CD1 TRP B 232 -8.933 3.633 -10.086 1.00 0.00 C ATOM 1596 CD2 TRP B 232 -9.157 5.574 -11.163 1.00 0.00 C ATOM 1597 NE1 TRP B 232 -10.238 4.020 -9.977 1.00 0.00 N ATOM 1598 CE2 TRP B 232 -10.405 5.205 -10.623 1.00 0.00 C ATOM 1599 CE3 TRP B 232 -9.063 6.763 -11.882 1.00 0.00 C ATOM 1600 CZ2 TRP B 232 -11.541 5.981 -10.780 1.00 0.00 C ATOM 1601 CZ3 TRP B 232 -10.197 7.537 -12.034 1.00 0.00 C ATOM 1602 CH2 TRP B 232 -11.419 7.139 -11.486 1.00 0.00 C ATOM 0 H TRP B 232 -4.396 4.043 -11.892 1.00 0.00 H new ATOM 0 HA TRP B 232 -6.484 2.392 -10.885 1.00 0.00 H new ATOM 0 HB2 TRP B 232 -6.186 4.781 -10.242 1.00 0.00 H new ATOM 0 HB3 TRP B 232 -6.535 5.262 -11.890 1.00 0.00 H new ATOM 0 HD1 TRP B 232 -8.520 2.731 -9.660 1.00 0.00 H new ATOM 0 HE1 TRP B 232 -10.970 3.503 -9.489 1.00 0.00 H new ATOM 0 HE3 TRP B 232 -8.122 7.074 -12.312 1.00 0.00 H new ATOM 0 HZ2 TRP B 232 -12.488 5.679 -10.358 1.00 0.00 H new ATOM 0 HZ3 TRP B 232 -10.138 8.464 -12.585 1.00 0.00 H new ATOM 0 HH2 TRP B 232 -12.288 7.765 -11.626 1.00 0.00 H new ATOM 1613 N ASP B 233 -7.773 1.811 -12.728 1.00 0.00 N ATOM 1614 CA ASP B 233 -8.699 1.333 -13.675 1.00 0.00 C ATOM 1615 C ASP B 233 -9.976 1.524 -12.971 1.00 0.00 C ATOM 1616 O ASP B 233 -9.945 1.430 -11.778 1.00 0.00 O ATOM 1617 CB ASP B 233 -8.491 -0.156 -13.944 1.00 0.00 C ATOM 1618 CG ASP B 233 -9.532 -0.723 -14.884 1.00 0.00 C ATOM 1619 OD1 ASP B 233 -9.433 -0.494 -16.118 1.00 0.00 O ATOM 1620 OD2 ASP B 233 -10.477 -1.389 -14.416 1.00 0.00 O ATOM 0 H ASP B 233 -7.830 1.307 -11.843 1.00 0.00 H new ATOM 0 HA ASP B 233 -8.625 1.834 -14.640 1.00 0.00 H new ATOM 0 HB2 ASP B 233 -7.499 -0.311 -14.369 1.00 0.00 H new ATOM 0 HB3 ASP B 233 -8.522 -0.701 -13.000 1.00 0.00 H new ATOM 1625 N GLY B 234 -11.019 1.874 -13.694 1.00 0.00 N ATOM 1626 CA GLY B 234 -12.405 2.148 -13.231 1.00 0.00 C ATOM 1627 C GLY B 234 -12.927 1.255 -12.130 1.00 0.00 C ATOM 1628 O GLY B 234 -13.802 0.407 -12.324 1.00 0.00 O ATOM 0 H GLY B 234 -10.936 1.989 -14.704 1.00 0.00 H new ATOM 0 HA2 GLY B 234 -12.454 3.181 -12.887 1.00 0.00 H new ATOM 0 HA3 GLY B 234 -13.075 2.065 -14.087 1.00 0.00 H new ATOM 1632 N VAL B 235 -12.324 1.412 -11.041 1.00 0.00 N ATOM 1633 CA VAL B 235 -12.637 0.795 -9.802 1.00 0.00 C ATOM 1634 C VAL B 235 -13.144 1.857 -8.874 1.00 0.00 C ATOM 1635 O VAL B 235 -12.472 2.874 -8.655 1.00 0.00 O ATOM 1636 CB VAL B 235 -11.370 0.123 -9.188 1.00 0.00 C ATOM 1637 CG1 VAL B 235 -11.624 -0.381 -7.782 1.00 0.00 C ATOM 1638 CG2 VAL B 235 -10.901 -1.020 -10.061 1.00 0.00 C ATOM 0 H VAL B 235 -11.518 2.032 -10.966 1.00 0.00 H new ATOM 0 HA VAL B 235 -13.390 0.022 -9.954 1.00 0.00 H new ATOM 0 HB VAL B 235 -10.593 0.886 -9.139 1.00 0.00 H new ATOM 0 HG11 VAL B 235 -10.717 -0.842 -7.391 1.00 0.00 H new ATOM 0 HG12 VAL B 235 -11.911 0.454 -7.143 1.00 0.00 H new ATOM 0 HG13 VAL B 235 -12.427 -1.118 -7.799 1.00 0.00 H new ATOM 0 HG21 VAL B 235 -10.016 -1.477 -9.618 1.00 0.00 H new ATOM 0 HG22 VAL B 235 -11.693 -1.765 -10.142 1.00 0.00 H new ATOM 0 HG23 VAL B 235 -10.655 -0.643 -11.054 1.00 0.00 H new ATOM 1648 N HIS B 236 -14.317 1.661 -8.394 1.00 0.00 N ATOM 1649 CA HIS B 236 -14.915 2.564 -7.470 1.00 0.00 C ATOM 1650 C HIS B 236 -15.044 1.858 -6.125 1.00 0.00 C ATOM 1651 O HIS B 236 -15.613 0.772 -6.058 1.00 0.00 O ATOM 1652 CB HIS B 236 -16.293 2.993 -7.990 1.00 0.00 C ATOM 1653 CG HIS B 236 -16.976 4.017 -7.144 1.00 0.00 C ATOM 1654 ND1 HIS B 236 -17.747 3.711 -6.053 1.00 0.00 N ATOM 1655 CD2 HIS B 236 -16.976 5.364 -7.235 1.00 0.00 C ATOM 1656 CE1 HIS B 236 -18.175 4.844 -5.519 1.00 0.00 C ATOM 1657 NE2 HIS B 236 -17.738 5.887 -6.200 1.00 0.00 N ATOM 0 H HIS B 236 -14.900 0.859 -8.633 1.00 0.00 H new ATOM 0 HA HIS B 236 -14.300 3.457 -7.355 1.00 0.00 H new ATOM 0 HB2 HIS B 236 -16.181 3.389 -8.999 1.00 0.00 H new ATOM 0 HB3 HIS B 236 -16.932 2.113 -8.062 1.00 0.00 H new ATOM 0 HD2 HIS B 236 -16.465 5.941 -7.991 1.00 0.00 H new ATOM 0 HE1 HIS B 236 -18.800 4.907 -4.641 1.00 0.00 H new ATOM 0 HE2 HIS B 236 -17.922 6.871 -6.006 1.00 0.00 H new ATOM 1665 N ARG B 237 -14.466 2.416 -5.089 1.00 0.00 N ATOM 1666 CA ARG B 237 -14.605 1.853 -3.747 1.00 0.00 C ATOM 1667 C ARG B 237 -15.469 2.798 -2.912 1.00 0.00 C ATOM 1668 O ARG B 237 -15.080 3.940 -2.641 1.00 0.00 O ATOM 1669 CB ARG B 237 -13.257 1.712 -3.049 1.00 0.00 C ATOM 1670 CG ARG B 237 -12.153 0.930 -3.766 1.00 0.00 C ATOM 1671 CD ARG B 237 -12.402 -0.584 -3.897 1.00 0.00 C ATOM 1672 NE ARG B 237 -13.381 -0.897 -4.921 1.00 0.00 N ATOM 1673 CZ ARG B 237 -14.149 -1.994 -4.962 1.00 0.00 C ATOM 1674 NH1 ARG B 237 -13.796 -3.091 -4.300 1.00 0.00 N ATOM 1675 NH2 ARG B 237 -15.209 -2.014 -5.739 1.00 0.00 N ATOM 0 H ARG B 237 -13.893 3.259 -5.138 1.00 0.00 H new ATOM 0 HA ARG B 237 -15.054 0.864 -3.840 1.00 0.00 H new ATOM 0 HB2 ARG B 237 -12.879 2.714 -2.848 1.00 0.00 H new ATOM 0 HB3 ARG B 237 -13.429 1.237 -2.083 1.00 0.00 H new ATOM 0 HG2 ARG B 237 -12.023 1.348 -4.764 1.00 0.00 H new ATOM 0 HG3 ARG B 237 -11.215 1.083 -3.231 1.00 0.00 H new ATOM 0 HD2 ARG B 237 -11.463 -1.085 -4.131 1.00 0.00 H new ATOM 0 HD3 ARG B 237 -12.743 -0.978 -2.940 1.00 0.00 H new ATOM 0 HE ARG B 237 -13.495 -0.222 -5.677 1.00 0.00 H new ATOM 0 HH11 ARG B 237 -12.934 -3.102 -3.755 1.00 0.00 H new ATOM 0 HH12 ARG B 237 -14.387 -3.921 -4.337 1.00 0.00 H new ATOM 0 HH21 ARG B 237 -15.442 -1.198 -6.305 1.00 0.00 H new ATOM 0 HH22 ARG B 237 -15.799 -2.845 -5.776 1.00 0.00 H new ATOM 1689 N SER B 238 -16.598 2.345 -2.504 1.00 0.00 N ATOM 1690 CA SER B 238 -17.527 3.182 -1.762 1.00 0.00 C ATOM 1691 C SER B 238 -17.330 3.065 -0.243 1.00 0.00 C ATOM 1692 O SER B 238 -17.565 2.010 0.342 1.00 0.00 O ATOM 1693 CB SER B 238 -18.959 2.793 -2.112 1.00 0.00 C ATOM 1694 OG SER B 238 -19.176 2.801 -3.505 1.00 0.00 O ATOM 0 H SER B 238 -16.922 1.391 -2.663 1.00 0.00 H new ATOM 0 HA SER B 238 -17.331 4.216 -2.046 1.00 0.00 H new ATOM 0 HB2 SER B 238 -19.174 1.800 -1.716 1.00 0.00 H new ATOM 0 HB3 SER B 238 -19.652 3.484 -1.632 1.00 0.00 H new ATOM 0 HG SER B 238 -20.103 2.546 -3.693 1.00 0.00 H new ATOM 1700 N ASN B 239 -16.904 4.150 0.373 1.00 0.00 N ATOM 1701 CA ASN B 239 -16.794 4.235 1.832 1.00 0.00 C ATOM 1702 C ASN B 239 -18.167 4.108 2.484 1.00 0.00 C ATOM 1703 O ASN B 239 -19.029 4.985 2.335 1.00 0.00 O ATOM 1704 CB ASN B 239 -16.086 5.541 2.288 1.00 0.00 C ATOM 1705 CG ASN B 239 -16.721 6.854 1.786 1.00 0.00 C ATOM 1706 OD1 ASN B 239 -17.327 6.916 0.709 1.00 0.00 O ATOM 1707 ND2 ASN B 239 -16.559 7.910 2.537 1.00 0.00 N ATOM 0 H ASN B 239 -16.623 5.001 -0.115 1.00 0.00 H new ATOM 0 HA ASN B 239 -16.174 3.401 2.160 1.00 0.00 H new ATOM 0 HB2 ASN B 239 -16.067 5.561 3.378 1.00 0.00 H new ATOM 0 HB3 ASN B 239 -15.050 5.508 1.952 1.00 0.00 H new ATOM 0 HD21 ASN B 239 -16.936 8.810 2.240 1.00 0.00 H new ATOM 0 HD22 ASN B 239 -16.056 7.835 3.421 1.00 0.00 H new ATOM 1714 N GLY B 240 -18.379 3.002 3.169 1.00 0.00 N ATOM 1715 CA GLY B 240 -19.647 2.753 3.794 1.00 0.00 C ATOM 1716 C GLY B 240 -20.679 2.386 2.762 1.00 0.00 C ATOM 1717 O GLY B 240 -21.720 2.977 2.698 1.00 0.00 O ATOM 0 H GLY B 240 -17.685 2.266 3.303 1.00 0.00 H new ATOM 0 HA2 GLY B 240 -19.549 1.947 4.521 1.00 0.00 H new ATOM 0 HA3 GLY B 240 -19.970 3.639 4.341 1.00 0.00 H new ATOM 1721 N PHE B 241 -20.369 1.409 1.954 1.00 0.00 N ATOM 1722 CA PHE B 241 -21.241 0.988 0.861 1.00 0.00 C ATOM 1723 C PHE B 241 -22.580 0.417 1.345 1.00 0.00 C ATOM 1724 O PHE B 241 -23.610 0.630 0.711 1.00 0.00 O ATOM 1725 CB PHE B 241 -20.517 -0.021 -0.056 1.00 0.00 C ATOM 1726 CG PHE B 241 -20.026 -1.276 0.635 1.00 0.00 C ATOM 1727 CD1 PHE B 241 -18.782 -1.313 1.231 1.00 0.00 C ATOM 1728 CD2 PHE B 241 -20.808 -2.411 0.678 1.00 0.00 C ATOM 1729 CE1 PHE B 241 -18.331 -2.453 1.856 1.00 0.00 C ATOM 1730 CE2 PHE B 241 -20.363 -3.555 1.300 1.00 0.00 C ATOM 1731 CZ PHE B 241 -19.124 -3.576 1.889 1.00 0.00 C ATOM 0 H PHE B 241 -19.504 0.873 2.025 1.00 0.00 H new ATOM 0 HA PHE B 241 -21.476 1.886 0.289 1.00 0.00 H new ATOM 0 HB2 PHE B 241 -21.194 -0.308 -0.861 1.00 0.00 H new ATOM 0 HB3 PHE B 241 -19.665 0.478 -0.519 1.00 0.00 H new ATOM 0 HD1 PHE B 241 -18.154 -0.435 1.207 1.00 0.00 H new ATOM 0 HD2 PHE B 241 -21.784 -2.402 0.217 1.00 0.00 H new ATOM 0 HE1 PHE B 241 -17.356 -2.466 2.320 1.00 0.00 H new ATOM 0 HE2 PHE B 241 -20.988 -4.435 1.325 1.00 0.00 H new ATOM 0 HZ PHE B 241 -18.772 -4.473 2.378 1.00 0.00 H new ATOM 1741 N GLU B 242 -22.569 -0.257 2.479 1.00 0.00 N ATOM 1742 CA GLU B 242 -23.750 -0.942 2.971 1.00 0.00 C ATOM 1743 C GLU B 242 -24.887 0.033 3.292 1.00 0.00 C ATOM 1744 O GLU B 242 -26.036 -0.222 2.944 1.00 0.00 O ATOM 1745 CB GLU B 242 -23.411 -1.802 4.172 1.00 0.00 C ATOM 1746 CG GLU B 242 -24.562 -2.658 4.648 1.00 0.00 C ATOM 1747 CD GLU B 242 -24.206 -3.451 5.853 1.00 0.00 C ATOM 1748 OE1 GLU B 242 -23.681 -4.565 5.708 1.00 0.00 O ATOM 1749 OE2 GLU B 242 -24.440 -2.970 6.978 1.00 0.00 O ATOM 0 H GLU B 242 -21.750 -0.345 3.081 1.00 0.00 H new ATOM 0 HA GLU B 242 -24.105 -1.594 2.173 1.00 0.00 H new ATOM 0 HB2 GLU B 242 -22.569 -2.447 3.920 1.00 0.00 H new ATOM 0 HB3 GLU B 242 -23.086 -1.158 4.989 1.00 0.00 H new ATOM 0 HG2 GLU B 242 -25.418 -2.022 4.873 1.00 0.00 H new ATOM 0 HG3 GLU B 242 -24.867 -3.332 3.848 1.00 0.00 H new ATOM 1756 N GLU B 243 -24.559 1.156 3.921 1.00 0.00 N ATOM 1757 CA GLU B 243 -25.556 2.174 4.245 1.00 0.00 C ATOM 1758 C GLU B 243 -26.160 2.742 2.983 1.00 0.00 C ATOM 1759 O GLU B 243 -27.326 3.058 2.951 1.00 0.00 O ATOM 1760 CB GLU B 243 -24.978 3.301 5.110 1.00 0.00 C ATOM 1761 CG GLU B 243 -23.772 3.981 4.503 1.00 0.00 C ATOM 1762 CD GLU B 243 -23.181 5.049 5.365 1.00 0.00 C ATOM 1763 OE1 GLU B 243 -22.714 4.734 6.483 1.00 0.00 O ATOM 1764 OE2 GLU B 243 -23.101 6.215 4.922 1.00 0.00 O ATOM 0 H GLU B 243 -23.611 1.386 4.217 1.00 0.00 H new ATOM 0 HA GLU B 243 -26.335 1.684 4.829 1.00 0.00 H new ATOM 0 HB2 GLU B 243 -25.754 4.046 5.284 1.00 0.00 H new ATOM 0 HB3 GLU B 243 -24.702 2.894 6.083 1.00 0.00 H new ATOM 0 HG2 GLU B 243 -23.009 3.230 4.297 1.00 0.00 H new ATOM 0 HG3 GLU B 243 -24.057 4.417 3.545 1.00 0.00 H new ATOM 1771 N LYS B 244 -25.350 2.849 1.943 1.00 0.00 N ATOM 1772 CA LYS B 244 -25.777 3.391 0.678 1.00 0.00 C ATOM 1773 C LYS B 244 -26.771 2.443 0.052 1.00 0.00 C ATOM 1774 O LYS B 244 -27.824 2.853 -0.432 1.00 0.00 O ATOM 1775 CB LYS B 244 -24.574 3.548 -0.231 1.00 0.00 C ATOM 1776 CG LYS B 244 -23.373 4.157 0.460 1.00 0.00 C ATOM 1777 CD LYS B 244 -23.642 5.533 1.013 1.00 0.00 C ATOM 1778 CE LYS B 244 -22.394 6.104 1.649 1.00 0.00 C ATOM 1779 NZ LYS B 244 -22.666 7.347 2.392 1.00 0.00 N ATOM 0 H LYS B 244 -24.372 2.558 1.960 1.00 0.00 H new ATOM 0 HA LYS B 244 -26.244 4.365 0.826 1.00 0.00 H new ATOM 0 HB2 LYS B 244 -24.298 2.571 -0.628 1.00 0.00 H new ATOM 0 HB3 LYS B 244 -24.850 4.172 -1.081 1.00 0.00 H new ATOM 0 HG2 LYS B 244 -23.058 3.501 1.272 1.00 0.00 H new ATOM 0 HG3 LYS B 244 -22.544 4.212 -0.246 1.00 0.00 H new ATOM 0 HD2 LYS B 244 -23.984 6.191 0.214 1.00 0.00 H new ATOM 0 HD3 LYS B 244 -24.443 5.484 1.751 1.00 0.00 H new ATOM 0 HE2 LYS B 244 -21.963 5.366 2.325 1.00 0.00 H new ATOM 0 HE3 LYS B 244 -21.651 6.300 0.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 244 -21.841 7.977 2.329 1.00 0.00 H new ATOM 0 HZ2 LYS B 244 -23.496 7.822 1.982 1.00 0.00 H new ATOM 0 HZ3 LYS B 244 -22.854 7.121 3.390 1.00 0.00 H new ATOM 1793 N TRP B 245 -26.441 1.160 0.102 1.00 0.00 N ATOM 1794 CA TRP B 245 -27.302 0.122 -0.414 1.00 0.00 C ATOM 1795 C TRP B 245 -28.604 0.109 0.356 1.00 0.00 C ATOM 1796 O TRP B 245 -29.674 0.013 -0.224 1.00 0.00 O ATOM 1797 CB TRP B 245 -26.624 -1.245 -0.334 1.00 0.00 C ATOM 1798 CG TRP B 245 -25.381 -1.364 -1.171 1.00 0.00 C ATOM 1799 CD1 TRP B 245 -24.902 -0.461 -2.069 1.00 0.00 C ATOM 1800 CD2 TRP B 245 -24.476 -2.461 -1.191 1.00 0.00 C ATOM 1801 NE1 TRP B 245 -23.750 -0.920 -2.638 1.00 0.00 N ATOM 1802 CE2 TRP B 245 -23.465 -2.153 -2.122 1.00 0.00 C ATOM 1803 CE3 TRP B 245 -24.422 -3.669 -0.510 1.00 0.00 C ATOM 1804 CZ2 TRP B 245 -22.413 -3.020 -2.390 1.00 0.00 C ATOM 1805 CZ3 TRP B 245 -23.380 -4.531 -0.771 1.00 0.00 C ATOM 1806 CH2 TRP B 245 -22.388 -4.204 -1.704 1.00 0.00 C ATOM 0 H TRP B 245 -25.568 0.817 0.502 1.00 0.00 H new ATOM 0 HA TRP B 245 -27.507 0.333 -1.464 1.00 0.00 H new ATOM 0 HB2 TRP B 245 -26.370 -1.452 0.706 1.00 0.00 H new ATOM 0 HB3 TRP B 245 -27.335 -2.010 -0.647 1.00 0.00 H new ATOM 0 HD1 TRP B 245 -25.368 0.486 -2.299 1.00 0.00 H new ATOM 0 HE1 TRP B 245 -23.193 -0.424 -3.334 1.00 0.00 H new ATOM 0 HE3 TRP B 245 -25.183 -3.928 0.211 1.00 0.00 H new ATOM 0 HZ2 TRP B 245 -21.647 -2.770 -3.109 1.00 0.00 H new ATOM 0 HZ3 TRP B 245 -23.327 -5.474 -0.248 1.00 0.00 H new ATOM 0 HH2 TRP B 245 -21.585 -4.902 -1.886 1.00 0.00 H new ATOM 1817 N PHE B 246 -28.490 0.269 1.651 1.00 0.00 N ATOM 1818 CA PHE B 246 -29.613 0.332 2.552 1.00 0.00 C ATOM 1819 C PHE B 246 -30.466 1.585 2.280 1.00 0.00 C ATOM 1820 O PHE B 246 -31.697 1.555 2.362 1.00 0.00 O ATOM 1821 CB PHE B 246 -29.082 0.285 4.003 1.00 0.00 C ATOM 1822 CG PHE B 246 -29.967 0.906 5.034 1.00 0.00 C ATOM 1823 CD1 PHE B 246 -31.003 0.205 5.614 1.00 0.00 C ATOM 1824 CD2 PHE B 246 -29.749 2.216 5.410 1.00 0.00 C ATOM 1825 CE1 PHE B 246 -31.814 0.804 6.558 1.00 0.00 C ATOM 1826 CE2 PHE B 246 -30.549 2.827 6.344 1.00 0.00 C ATOM 1827 CZ PHE B 246 -31.588 2.120 6.925 1.00 0.00 C ATOM 0 H PHE B 246 -27.589 0.361 2.120 1.00 0.00 H new ATOM 0 HA PHE B 246 -30.271 -0.523 2.394 1.00 0.00 H new ATOM 0 HB2 PHE B 246 -28.912 -0.757 4.275 1.00 0.00 H new ATOM 0 HB3 PHE B 246 -28.113 0.784 4.033 1.00 0.00 H new ATOM 0 HD1 PHE B 246 -31.182 -0.821 5.328 1.00 0.00 H new ATOM 0 HD2 PHE B 246 -28.936 2.769 4.963 1.00 0.00 H new ATOM 0 HE1 PHE B 246 -32.622 0.247 7.009 1.00 0.00 H new ATOM 0 HE2 PHE B 246 -30.369 3.854 6.624 1.00 0.00 H new ATOM 0 HZ PHE B 246 -32.220 2.593 7.662 1.00 0.00 H new ATOM 1837 N ALA B 247 -29.813 2.656 1.936 1.00 0.00 N ATOM 1838 CA ALA B 247 -30.470 3.899 1.656 1.00 0.00 C ATOM 1839 C ALA B 247 -31.227 3.837 0.335 1.00 0.00 C ATOM 1840 O ALA B 247 -32.304 4.394 0.213 1.00 0.00 O ATOM 1841 CB ALA B 247 -29.464 5.039 1.664 1.00 0.00 C ATOM 0 H ALA B 247 -28.798 2.692 1.841 1.00 0.00 H new ATOM 0 HA ALA B 247 -31.204 4.085 2.440 1.00 0.00 H new ATOM 0 HB1 ALA B 247 -29.976 5.977 1.450 1.00 0.00 H new ATOM 0 HB2 ALA B 247 -28.990 5.099 2.644 1.00 0.00 H new ATOM 0 HB3 ALA B 247 -28.704 4.859 0.904 1.00 0.00 H new ATOM 1847 N LYS B 248 -30.685 3.132 -0.638 1.00 0.00 N ATOM 1848 CA LYS B 248 -31.317 3.036 -1.945 1.00 0.00 C ATOM 1849 C LYS B 248 -32.306 1.887 -2.007 1.00 0.00 C ATOM 1850 O LYS B 248 -33.144 1.819 -2.908 1.00 0.00 O ATOM 1851 CB LYS B 248 -30.264 2.950 -3.066 1.00 0.00 C ATOM 1852 CG LYS B 248 -29.318 1.749 -3.014 1.00 0.00 C ATOM 1853 CD LYS B 248 -29.900 0.486 -3.650 1.00 0.00 C ATOM 1854 CE LYS B 248 -28.894 -0.660 -3.626 1.00 0.00 C ATOM 1855 NZ LYS B 248 -29.407 -1.865 -4.304 1.00 0.00 N ATOM 0 H LYS B 248 -29.809 2.616 -0.552 1.00 0.00 H new ATOM 0 HA LYS B 248 -31.888 3.951 -2.104 1.00 0.00 H new ATOM 0 HB2 LYS B 248 -30.784 2.935 -4.024 1.00 0.00 H new ATOM 0 HB3 LYS B 248 -29.664 3.860 -3.043 1.00 0.00 H new ATOM 0 HG2 LYS B 248 -28.388 2.007 -3.522 1.00 0.00 H new ATOM 0 HG3 LYS B 248 -29.066 1.540 -1.974 1.00 0.00 H new ATOM 0 HD2 LYS B 248 -30.804 0.191 -3.117 1.00 0.00 H new ATOM 0 HD3 LYS B 248 -30.191 0.696 -4.679 1.00 0.00 H new ATOM 0 HE2 LYS B 248 -27.970 -0.340 -4.107 1.00 0.00 H new ATOM 0 HE3 LYS B 248 -28.648 -0.904 -2.593 1.00 0.00 H new ATOM 0 HZ1 LYS B 248 -28.691 -2.618 -4.263 1.00 0.00 H new ATOM 0 HZ2 LYS B 248 -30.275 -2.187 -3.830 1.00 0.00 H new ATOM 0 HZ3 LYS B 248 -29.618 -1.641 -5.297 1.00 0.00 H new ATOM 1869 N GLN B 249 -32.223 0.996 -1.050 1.00 0.00 N ATOM 1870 CA GLN B 249 -33.120 -0.138 -0.998 1.00 0.00 C ATOM 1871 C GLN B 249 -34.449 0.267 -0.375 1.00 0.00 C ATOM 1872 O GLN B 249 -35.339 -0.555 -0.199 1.00 0.00 O ATOM 1873 CB GLN B 249 -32.489 -1.333 -0.275 1.00 0.00 C ATOM 1874 CG GLN B 249 -32.373 -1.208 1.220 1.00 0.00 C ATOM 1875 CD GLN B 249 -31.640 -2.377 1.873 1.00 0.00 C ATOM 1876 OE1 GLN B 249 -30.690 -2.955 1.179 1.00 0.00 O flip ATOM 1877 NE2 GLN B 249 -31.919 -2.737 3.015 1.00 0.00 N flip ATOM 0 H GLN B 249 -31.541 1.032 -0.292 1.00 0.00 H new ATOM 0 HA GLN B 249 -33.312 -0.465 -2.020 1.00 0.00 H new ATOM 0 HB2 GLN B 249 -33.077 -2.222 -0.502 1.00 0.00 H new ATOM 0 HB3 GLN B 249 -31.493 -1.497 -0.685 1.00 0.00 H new ATOM 0 HG2 GLN B 249 -31.850 -0.282 1.460 1.00 0.00 H new ATOM 0 HG3 GLN B 249 -33.372 -1.131 1.649 1.00 0.00 H new ATOM 0 HE21 GLN B 249 -32.664 -2.268 3.530 1.00 0.00 H new ATOM 0 HE22 GLN B 249 -31.406 -3.505 3.447 1.00 0.00 H new ATOM 1886 N ASN B 250 -34.556 1.564 -0.063 1.00 0.00 N ATOM 1887 CA ASN B 250 -35.778 2.177 0.507 1.00 0.00 C ATOM 1888 C ASN B 250 -36.997 1.881 -0.369 1.00 0.00 C ATOM 1889 O ASN B 250 -38.137 1.864 0.099 1.00 0.00 O ATOM 1890 CB ASN B 250 -35.638 3.704 0.677 1.00 0.00 C ATOM 1891 CG ASN B 250 -35.683 4.475 -0.629 1.00 0.00 C ATOM 1892 OD1 ASN B 250 -36.741 4.896 -1.090 1.00 0.00 O ATOM 1893 ND2 ASN B 250 -34.557 4.679 -1.206 1.00 0.00 N ATOM 0 H ASN B 250 -33.795 2.229 -0.197 1.00 0.00 H new ATOM 0 HA ASN B 250 -35.916 1.732 1.492 1.00 0.00 H new ATOM 0 HB2 ASN B 250 -36.437 4.062 1.327 1.00 0.00 H new ATOM 0 HB3 ASN B 250 -34.696 3.919 1.182 1.00 0.00 H new ATOM 0 HD21 ASN B 250 -34.519 5.207 -2.078 1.00 0.00 H new ATOM 0 HD22 ASN B 250 -33.699 4.314 -0.793 1.00 0.00 H new ATOM 1900 N GLU B 251 -36.740 1.691 -1.648 1.00 0.00 N ATOM 1901 CA GLU B 251 -37.749 1.322 -2.599 1.00 0.00 C ATOM 1902 C GLU B 251 -37.990 -0.171 -2.492 1.00 0.00 C ATOM 1903 O GLU B 251 -37.123 -0.985 -2.837 1.00 0.00 O ATOM 1904 CB GLU B 251 -37.311 1.706 -3.997 1.00 0.00 C ATOM 1905 CG GLU B 251 -37.057 3.201 -4.150 1.00 0.00 C ATOM 1906 CD GLU B 251 -36.554 3.611 -5.518 1.00 0.00 C ATOM 1907 OE1 GLU B 251 -35.321 3.504 -5.777 1.00 0.00 O ATOM 1908 OE2 GLU B 251 -37.352 4.085 -6.343 1.00 0.00 O ATOM 0 H GLU B 251 -35.809 1.792 -2.053 1.00 0.00 H new ATOM 0 HA GLU B 251 -38.678 1.851 -2.387 1.00 0.00 H new ATOM 0 HB2 GLU B 251 -36.402 1.161 -4.250 1.00 0.00 H new ATOM 0 HB3 GLU B 251 -38.076 1.398 -4.709 1.00 0.00 H new ATOM 0 HG2 GLU B 251 -37.982 3.738 -3.940 1.00 0.00 H new ATOM 0 HG3 GLU B 251 -36.330 3.513 -3.400 1.00 0.00 H new ATOM 1915 N ILE B 252 -39.136 -0.525 -1.996 1.00 0.00 N ATOM 1916 CA ILE B 252 -39.444 -1.899 -1.709 1.00 0.00 C ATOM 1917 C ILE B 252 -40.534 -2.444 -2.617 1.00 0.00 C ATOM 1918 O ILE B 252 -40.516 -3.606 -2.998 1.00 0.00 O ATOM 1919 CB ILE B 252 -39.842 -2.122 -0.213 1.00 0.00 C ATOM 1920 CG1 ILE B 252 -41.116 -1.330 0.230 1.00 0.00 C ATOM 1921 CG2 ILE B 252 -38.670 -1.834 0.719 1.00 0.00 C ATOM 1922 CD1 ILE B 252 -40.998 0.183 0.360 1.00 0.00 C ATOM 0 H ILE B 252 -39.887 0.129 -1.777 1.00 0.00 H new ATOM 0 HA ILE B 252 -38.524 -2.451 -1.902 1.00 0.00 H new ATOM 0 HB ILE B 252 -40.105 -3.177 -0.135 1.00 0.00 H new ATOM 0 HG12 ILE B 252 -41.910 -1.544 -0.485 1.00 0.00 H new ATOM 0 HG13 ILE B 252 -41.439 -1.725 1.193 1.00 0.00 H new ATOM 0 HG21 ILE B 252 -38.978 -1.998 1.752 1.00 0.00 H new ATOM 0 HG22 ILE B 252 -37.841 -2.499 0.477 1.00 0.00 H new ATOM 0 HG23 ILE B 252 -38.352 -0.799 0.595 1.00 0.00 H new ATOM 0 HD11 ILE B 252 -41.956 0.597 0.674 1.00 0.00 H new ATOM 0 HD12 ILE B 252 -40.237 0.426 1.102 1.00 0.00 H new ATOM 0 HD13 ILE B 252 -40.716 0.610 -0.602 1.00 0.00 H new ATOM 1934 N ASN B 253 -41.462 -1.599 -2.978 1.00 0.00 N ATOM 1935 CA ASN B 253 -42.596 -2.011 -3.822 1.00 0.00 C ATOM 1936 C ASN B 253 -42.528 -1.200 -5.091 1.00 0.00 C ATOM 1937 O ASN B 253 -43.306 -1.373 -6.039 1.00 0.00 O ATOM 1938 CB ASN B 253 -43.911 -1.706 -3.101 1.00 0.00 C ATOM 1939 CG ASN B 253 -44.181 -0.226 -3.055 1.00 0.00 C ATOM 1940 OD1 ASN B 253 -44.879 0.326 -3.912 1.00 0.00 O ATOM 1941 ND2 ASN B 253 -43.639 0.427 -2.079 1.00 0.00 N ATOM 0 H ASN B 253 -41.472 -0.615 -2.710 1.00 0.00 H new ATOM 0 HA ASN B 253 -42.550 -3.079 -4.035 1.00 0.00 H new ATOM 0 HB2 ASN B 253 -44.732 -2.212 -3.609 1.00 0.00 H new ATOM 0 HB3 ASN B 253 -43.872 -2.102 -2.086 1.00 0.00 H new ATOM 0 HD21 ASN B 253 -43.782 1.434 -1.997 1.00 0.00 H new ATOM 0 HD22 ASN B 253 -43.069 -0.065 -1.391 1.00 0.00 H new ATOM 1948 N GLU B 254 -41.605 -0.294 -5.052 1.00 0.00 N ATOM 1949 CA GLU B 254 -41.303 0.641 -6.087 1.00 0.00 C ATOM 1950 C GLU B 254 -40.561 -0.009 -7.240 1.00 0.00 C ATOM 1951 O GLU B 254 -40.417 -1.237 -7.308 1.00 0.00 O ATOM 1952 CB GLU B 254 -40.456 1.754 -5.505 1.00 0.00 C ATOM 1953 CG GLU B 254 -41.172 2.857 -4.811 1.00 0.00 C ATOM 1954 CD GLU B 254 -41.749 2.445 -3.506 1.00 0.00 C ATOM 1955 OE1 GLU B 254 -41.098 1.637 -2.766 1.00 0.00 O ATOM 1956 OE2 GLU B 254 -42.861 2.910 -3.179 1.00 0.00 O ATOM 0 H GLU B 254 -41.000 -0.180 -4.239 1.00 0.00 H new ATOM 0 HA GLU B 254 -42.242 1.032 -6.479 1.00 0.00 H new ATOM 0 HB2 GLU B 254 -39.753 1.311 -4.800 1.00 0.00 H new ATOM 0 HB3 GLU B 254 -39.867 2.188 -6.313 1.00 0.00 H new ATOM 0 HG2 GLU B 254 -40.483 3.686 -4.651 1.00 0.00 H new ATOM 0 HG3 GLU B 254 -41.971 3.226 -5.455 1.00 0.00 H new ATOM 1963 N LYS B 255 -40.074 0.818 -8.122 1.00 0.00 N ATOM 1964 CA LYS B 255 -39.404 0.372 -9.308 1.00 0.00 C ATOM 1965 C LYS B 255 -37.952 0.069 -8.996 1.00 0.00 C ATOM 1966 O LYS B 255 -37.111 0.977 -8.897 1.00 0.00 O ATOM 1967 CB LYS B 255 -39.527 1.441 -10.382 1.00 0.00 C ATOM 1968 CG LYS B 255 -40.960 1.900 -10.572 1.00 0.00 C ATOM 1969 CD LYS B 255 -41.082 2.993 -11.606 1.00 0.00 C ATOM 1970 CE LYS B 255 -42.517 3.486 -11.707 1.00 0.00 C ATOM 1971 NZ LYS B 255 -43.464 2.411 -12.083 1.00 0.00 N ATOM 0 H LYS B 255 -40.133 1.833 -8.035 1.00 0.00 H new ATOM 0 HA LYS B 255 -39.865 -0.545 -9.676 1.00 0.00 H new ATOM 0 HB2 LYS B 255 -38.906 2.296 -10.114 1.00 0.00 H new ATOM 0 HB3 LYS B 255 -39.144 1.052 -11.325 1.00 0.00 H new ATOM 0 HG2 LYS B 255 -41.574 1.051 -10.871 1.00 0.00 H new ATOM 0 HG3 LYS B 255 -41.353 2.258 -9.621 1.00 0.00 H new ATOM 0 HD2 LYS B 255 -40.426 3.823 -11.343 1.00 0.00 H new ATOM 0 HD3 LYS B 255 -40.752 2.620 -12.576 1.00 0.00 H new ATOM 0 HE2 LYS B 255 -42.819 3.913 -10.750 1.00 0.00 H new ATOM 0 HE3 LYS B 255 -42.571 4.287 -12.444 1.00 0.00 H new ATOM 0 HZ1 LYS B 255 -44.382 2.830 -12.336 1.00 0.00 H new ATOM 0 HZ2 LYS B 255 -43.087 1.886 -12.898 1.00 0.00 H new ATOM 0 HZ3 LYS B 255 -43.589 1.762 -11.280 1.00 0.00 H new ATOM 1985 N LYS B 256 -37.680 -1.177 -8.764 1.00 0.00 N ATOM 1986 CA LYS B 256 -36.356 -1.612 -8.463 1.00 0.00 C ATOM 1987 C LYS B 256 -35.699 -2.054 -9.745 1.00 0.00 C ATOM 1988 O LYS B 256 -36.030 -3.147 -10.249 1.00 0.00 O ATOM 1989 CB LYS B 256 -36.383 -2.734 -7.423 1.00 0.00 C ATOM 1990 CG LYS B 256 -35.005 -3.163 -6.919 1.00 0.00 C ATOM 1991 CD LYS B 256 -35.106 -4.260 -5.857 1.00 0.00 C ATOM 1992 CE LYS B 256 -35.908 -3.809 -4.631 1.00 0.00 C ATOM 1993 NZ LYS B 256 -35.292 -2.664 -3.934 1.00 0.00 N ATOM 1994 OXT LYS B 256 -34.879 -1.282 -10.297 1.00 0.00 O ATOM 0 H LYS B 256 -38.375 -1.923 -8.779 1.00 0.00 H new ATOM 0 HA LYS B 256 -35.778 -0.795 -8.030 1.00 0.00 H new ATOM 0 HB2 LYS B 256 -36.982 -2.410 -6.572 1.00 0.00 H new ATOM 0 HB3 LYS B 256 -36.884 -3.600 -7.854 1.00 0.00 H new ATOM 0 HG2 LYS B 256 -34.407 -3.522 -7.757 1.00 0.00 H new ATOM 0 HG3 LYS B 256 -34.485 -2.300 -6.502 1.00 0.00 H new ATOM 0 HD2 LYS B 256 -35.576 -5.142 -6.292 1.00 0.00 H new ATOM 0 HD3 LYS B 256 -34.104 -4.554 -5.545 1.00 0.00 H new ATOM 0 HE2 LYS B 256 -36.917 -3.539 -4.942 1.00 0.00 H new ATOM 0 HE3 LYS B 256 -36.001 -4.644 -3.936 1.00 0.00 H new ATOM 0 HZ1 LYS B 256 -34.915 -2.978 -3.017 1.00 0.00 H new ATOM 0 HZ2 LYS B 256 -34.519 -2.280 -4.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 256 -36.008 -1.926 -3.779 1.00 0.00 H new TER 2008 LYS B 256