USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 804 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 Single : A 1 MET CE :methyl -133:sc=-0.00838 (180deg=-0.0884) USER MOD Single : A 1 MET N :NH3+ -114:sc= 0 (180deg=-0.0922) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00143 USER MOD Single : A 3 GLN : amide:sc= 0.672 K(o=0.67,f=-0.017) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 30:sc= 0 USER MOD Single : A 7 THR OG1 : rot 95:sc= 1.15 USER MOD Single : A 9 ASN : amide:sc= -0.657 K(o=-0.66,f=-2.3) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -150:sc= -0.0339 (180deg=-0.297) USER MOD Single : A 23 ASN : amide:sc= -0.535 K(o=-0.53,f=-6.3!) USER MOD Single : A 25 ASN : amide:sc=-0.00318 K(o=-0.0032,f=-3!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 165:sc= -4.28! USER MOD Single : A 41 ASN : amide:sc= -1.52 K(o=-1.5,f=-3!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0196 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -1.09 K(o=-1.1,f=-1.8!) USER MOD Single : A 69 GLN : amide:sc= -0.129 K(o=-0.13,f=-2!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0.00936 X(o=0.0094,f=0) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.0639 K(o=-0.064,f=-1.1) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN :FLIP amide:sc= -0.0106 F(o=-1.9!,f=-0.011) USER MOD Single : A 97 GLN : amide:sc= -0.0505 K(o=-0.05,f=-1.4!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.515 8.397 -22.086 1.00 0.00 N ATOM 2 CA MET A 1 -5.429 7.087 -21.380 1.00 0.00 C ATOM 3 C MET A 1 -5.004 7.297 -19.918 1.00 0.00 C ATOM 4 O MET A 1 -3.843 7.526 -19.637 1.00 0.00 O ATOM 5 CB MET A 1 -4.363 6.296 -22.139 1.00 0.00 C ATOM 6 CG MET A 1 -4.982 5.682 -23.397 1.00 0.00 C ATOM 7 SD MET A 1 -3.719 4.746 -24.294 1.00 0.00 S ATOM 8 CE MET A 1 -3.826 3.226 -23.317 1.00 0.00 C ATOM 0 H1 MET A 1 -6.504 8.587 -22.345 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.170 9.152 -21.460 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.931 8.367 -22.946 1.00 0.00 H new ATOM 0 HA MET A 1 -6.386 6.566 -21.360 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.534 6.950 -22.411 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.954 5.512 -21.502 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.811 5.028 -23.126 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.390 6.466 -24.035 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.823 2.893 -23.051 1.00 0.00 H new ATOM 0 HE2 MET A 1 -4.397 3.417 -22.409 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.322 2.452 -23.902 1.00 0.00 H new ATOM 20 N SER A 2 -5.931 7.221 -18.984 1.00 0.00 N ATOM 21 CA SER A 2 -5.566 7.419 -17.549 1.00 0.00 C ATOM 22 C SER A 2 -5.925 6.167 -16.733 1.00 0.00 C ATOM 23 O SER A 2 -6.702 5.340 -17.175 1.00 0.00 O ATOM 24 CB SER A 2 -6.401 8.615 -17.090 1.00 0.00 C ATOM 25 OG SER A 2 -7.735 8.460 -17.553 1.00 0.00 O ATOM 0 H SER A 2 -6.918 7.031 -19.158 1.00 0.00 H new ATOM 0 HA SER A 2 -4.498 7.591 -17.414 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.387 8.687 -16.002 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.975 9.541 -17.476 1.00 0.00 H new ATOM 0 HG SER A 2 -8.274 9.224 -17.259 1.00 0.00 H new ATOM 31 N GLN A 3 -5.370 6.017 -15.547 1.00 0.00 N ATOM 32 CA GLN A 3 -5.689 4.815 -14.718 1.00 0.00 C ATOM 33 C GLN A 3 -6.059 5.240 -13.287 1.00 0.00 C ATOM 34 O GLN A 3 -5.282 5.067 -12.365 1.00 0.00 O ATOM 35 CB GLN A 3 -4.405 3.982 -14.719 1.00 0.00 C ATOM 36 CG GLN A 3 -4.134 3.463 -16.132 1.00 0.00 C ATOM 37 CD GLN A 3 -5.064 2.281 -16.432 1.00 0.00 C ATOM 38 OE1 GLN A 3 -4.748 1.153 -16.110 1.00 0.00 O ATOM 39 NE2 GLN A 3 -6.208 2.487 -17.040 1.00 0.00 N ATOM 0 H GLN A 3 -4.714 6.674 -15.124 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.538 4.254 -15.110 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.566 4.587 -14.375 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.500 3.147 -14.025 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.294 4.259 -16.860 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.093 3.152 -16.223 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -6.478 3.432 -17.312 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -6.828 1.702 -17.240 1.00 0.00 H new ATOM 48 N GLU A 4 -7.240 5.792 -13.089 1.00 0.00 N ATOM 49 CA GLU A 4 -7.644 6.216 -11.705 1.00 0.00 C ATOM 50 C GLU A 4 -8.483 5.118 -11.035 1.00 0.00 C ATOM 51 O GLU A 4 -8.332 4.861 -9.854 1.00 0.00 O ATOM 52 CB GLU A 4 -8.469 7.498 -11.876 1.00 0.00 C ATOM 53 CG GLU A 4 -8.549 8.237 -10.539 1.00 0.00 C ATOM 54 CD GLU A 4 -8.985 9.683 -10.780 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.290 10.379 -11.502 1.00 0.00 O ATOM 56 OE2 GLU A 4 -10.008 10.071 -10.237 1.00 0.00 O ATOM 0 H GLU A 4 -7.933 5.965 -13.817 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.775 6.388 -11.070 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.013 8.139 -12.631 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.471 7.254 -12.229 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.257 7.738 -9.878 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.579 8.217 -10.042 1.00 0.00 H new ATOM 63 N GLN A 5 -9.361 4.458 -11.768 1.00 0.00 N ATOM 64 CA GLN A 5 -10.190 3.364 -11.134 1.00 0.00 C ATOM 65 C GLN A 5 -9.265 2.335 -10.459 1.00 0.00 C ATOM 66 O GLN A 5 -9.558 1.846 -9.383 1.00 0.00 O ATOM 67 CB GLN A 5 -11.029 2.713 -12.255 1.00 0.00 C ATOM 68 CG GLN A 5 -10.118 2.042 -13.289 1.00 0.00 C ATOM 69 CD GLN A 5 -10.976 1.382 -14.376 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.690 0.438 -14.105 1.00 0.00 O ATOM 71 NE2 GLN A 5 -10.940 1.838 -15.605 1.00 0.00 N ATOM 0 H GLN A 5 -9.539 4.623 -12.759 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.850 3.763 -10.364 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.708 1.975 -11.827 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.645 3.469 -12.741 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.451 2.780 -13.735 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.489 1.296 -12.805 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -10.342 2.631 -15.838 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -11.510 1.400 -16.328 1.00 0.00 H new ATOM 80 N TYR A 6 -8.130 2.035 -11.060 1.00 0.00 N ATOM 81 CA TYR A 6 -7.177 1.076 -10.406 1.00 0.00 C ATOM 82 C TYR A 6 -6.503 1.794 -9.228 1.00 0.00 C ATOM 83 O TYR A 6 -6.304 1.221 -8.175 1.00 0.00 O ATOM 84 CB TYR A 6 -6.124 0.695 -11.460 1.00 0.00 C ATOM 85 CG TYR A 6 -6.712 -0.289 -12.442 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.417 0.173 -13.560 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.545 -1.664 -12.239 1.00 0.00 C ATOM 88 CE1 TYR A 6 -7.957 -0.740 -14.472 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.084 -2.577 -13.152 1.00 0.00 C ATOM 90 CZ TYR A 6 -7.791 -2.115 -14.269 1.00 0.00 C ATOM 91 OH TYR A 6 -8.323 -3.015 -15.169 1.00 0.00 O ATOM 0 H TYR A 6 -7.828 2.407 -11.960 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.685 0.184 -10.039 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -5.784 1.587 -11.986 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.251 0.259 -10.974 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -7.544 1.234 -13.718 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -6.000 -2.020 -11.377 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -8.502 -0.384 -15.333 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -6.955 -3.638 -12.995 1.00 0.00 H new ATOM 0 HH TYR A 6 -8.346 -2.611 -16.061 1.00 0.00 H new ATOM 101 N THR A 7 -6.159 3.057 -9.400 1.00 0.00 N ATOM 102 CA THR A 7 -5.506 3.819 -8.280 1.00 0.00 C ATOM 103 C THR A 7 -6.460 3.906 -7.080 1.00 0.00 C ATOM 104 O THR A 7 -6.044 3.759 -5.946 1.00 0.00 O ATOM 105 CB THR A 7 -5.211 5.227 -8.830 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.351 5.121 -9.956 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.545 6.092 -7.759 1.00 0.00 C ATOM 0 H THR A 7 -6.301 3.587 -10.260 1.00 0.00 H new ATOM 0 HA THR A 7 -4.593 3.329 -7.942 1.00 0.00 H new ATOM 0 HB THR A 7 -6.151 5.695 -9.123 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.886 5.114 -10.777 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.344 7.083 -8.165 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.208 6.180 -6.898 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.608 5.630 -7.449 1.00 0.00 H new ATOM 115 N GLU A 8 -7.735 4.144 -7.316 1.00 0.00 N ATOM 116 CA GLU A 8 -8.694 4.235 -6.158 1.00 0.00 C ATOM 117 C GLU A 8 -8.796 2.872 -5.468 1.00 0.00 C ATOM 118 O GLU A 8 -8.782 2.789 -4.255 1.00 0.00 O ATOM 119 CB GLU A 8 -10.057 4.652 -6.732 1.00 0.00 C ATOM 120 CG GLU A 8 -10.908 5.278 -5.625 1.00 0.00 C ATOM 121 CD GLU A 8 -12.330 5.504 -6.141 1.00 0.00 C ATOM 122 OE1 GLU A 8 -12.471 5.844 -7.304 1.00 0.00 O ATOM 123 OE2 GLU A 8 -13.254 5.333 -5.363 1.00 0.00 O ATOM 0 H GLU A 8 -8.147 4.277 -8.240 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.355 4.961 -5.419 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.918 5.364 -7.545 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.567 3.785 -7.151 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -10.926 4.625 -4.752 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -10.471 6.224 -5.306 1.00 0.00 H new ATOM 130 N ASN A 9 -8.870 1.802 -6.228 1.00 0.00 N ATOM 131 CA ASN A 9 -8.937 0.446 -5.583 1.00 0.00 C ATOM 132 C ASN A 9 -7.559 0.105 -5.006 1.00 0.00 C ATOM 133 O ASN A 9 -7.452 -0.426 -3.917 1.00 0.00 O ATOM 134 CB ASN A 9 -9.329 -0.557 -6.680 1.00 0.00 C ATOM 135 CG ASN A 9 -10.796 -0.337 -7.074 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.165 0.743 -7.489 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.657 -1.320 -6.963 1.00 0.00 N ATOM 0 H ASN A 9 -8.887 1.805 -7.248 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.665 0.417 -4.773 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.685 -0.431 -7.550 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.186 -1.577 -6.323 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.632 -1.176 -7.225 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.351 -2.229 -6.615 1.00 0.00 H new ATOM 144 N LEU A 10 -6.497 0.426 -5.719 1.00 0.00 N ATOM 145 CA LEU A 10 -5.123 0.135 -5.181 1.00 0.00 C ATOM 146 C LEU A 10 -4.910 0.894 -3.867 1.00 0.00 C ATOM 147 O LEU A 10 -4.308 0.378 -2.945 1.00 0.00 O ATOM 148 CB LEU A 10 -4.114 0.616 -6.234 1.00 0.00 C ATOM 149 CG LEU A 10 -3.775 -0.536 -7.176 1.00 0.00 C ATOM 150 CD1 LEU A 10 -3.043 0.008 -8.402 1.00 0.00 C ATOM 151 CD2 LEU A 10 -2.877 -1.537 -6.444 1.00 0.00 C ATOM 0 H LEU A 10 -6.522 0.870 -6.637 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.998 -0.930 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.530 1.451 -6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.209 0.980 -5.747 1.00 0.00 H new ATOM 0 HG LEU A 10 -4.692 -1.033 -7.494 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.800 -0.814 -9.075 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.682 0.724 -8.919 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.124 0.502 -8.087 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.632 -2.362 -7.112 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.959 -1.040 -6.129 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.400 -1.922 -5.569 1.00 0.00 H new ATOM 163 N LYS A 11 -5.405 2.115 -3.761 1.00 0.00 N ATOM 164 CA LYS A 11 -5.218 2.882 -2.476 1.00 0.00 C ATOM 165 C LYS A 11 -5.755 2.076 -1.281 1.00 0.00 C ATOM 166 O LYS A 11 -5.251 2.201 -0.180 1.00 0.00 O ATOM 167 CB LYS A 11 -5.997 4.199 -2.622 1.00 0.00 C ATOM 168 CG LYS A 11 -5.760 5.073 -1.388 1.00 0.00 C ATOM 169 CD LYS A 11 -6.292 6.483 -1.651 1.00 0.00 C ATOM 170 CE LYS A 11 -7.822 6.451 -1.701 1.00 0.00 C ATOM 171 NZ LYS A 11 -8.258 6.803 -0.321 1.00 0.00 N ATOM 0 H LYS A 11 -5.920 2.604 -4.493 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.160 3.072 -2.292 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.676 4.726 -3.521 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.061 3.993 -2.736 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.260 4.640 -0.521 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.696 5.112 -1.156 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.957 7.162 -0.866 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.895 6.863 -2.592 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -8.208 7.162 -2.431 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -8.187 5.466 -1.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -9.297 6.802 -0.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.881 6.105 0.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.901 7.748 -0.075 1.00 0.00 H new ATOM 185 N VAL A 12 -6.752 1.234 -1.483 1.00 0.00 N ATOM 186 CA VAL A 12 -7.268 0.422 -0.330 1.00 0.00 C ATOM 187 C VAL A 12 -6.349 -0.788 -0.129 1.00 0.00 C ATOM 188 O VAL A 12 -5.982 -1.113 0.985 1.00 0.00 O ATOM 189 CB VAL A 12 -8.686 -0.029 -0.709 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.255 -0.927 0.394 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.582 1.200 -0.878 1.00 0.00 C ATOM 0 H VAL A 12 -7.219 1.078 -2.376 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.289 0.992 0.599 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.649 -0.587 -1.645 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.261 -1.245 0.121 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.618 -1.803 0.515 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.291 -0.373 1.332 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.589 0.882 -1.147 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.616 1.757 0.058 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.180 1.838 -1.666 1.00 0.00 H new ATOM 201 N ILE A 13 -5.964 -1.446 -1.200 1.00 0.00 N ATOM 202 CA ILE A 13 -5.050 -2.627 -1.051 1.00 0.00 C ATOM 203 C ILE A 13 -3.650 -2.156 -0.610 1.00 0.00 C ATOM 204 O ILE A 13 -2.967 -2.854 0.116 1.00 0.00 O ATOM 205 CB ILE A 13 -4.994 -3.320 -2.426 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.411 -3.767 -2.828 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.071 -4.541 -2.351 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.703 -3.351 -4.274 1.00 0.00 C ATOM 0 H ILE A 13 -6.238 -1.221 -2.156 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.411 -3.319 -0.291 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.606 -2.623 -3.169 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.502 -4.848 -2.727 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.146 -3.321 -2.157 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.033 -5.029 -3.325 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.068 -4.222 -2.066 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.454 -5.241 -1.609 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.708 -3.672 -4.549 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.631 -2.267 -4.362 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -5.978 -3.818 -4.940 1.00 0.00 H new ATOM 220 N VAL A 14 -3.221 -0.974 -1.019 1.00 0.00 N ATOM 221 CA VAL A 14 -1.867 -0.486 -0.579 1.00 0.00 C ATOM 222 C VAL A 14 -1.946 -0.012 0.883 1.00 0.00 C ATOM 223 O VAL A 14 -1.039 -0.246 1.660 1.00 0.00 O ATOM 224 CB VAL A 14 -1.491 0.682 -1.509 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.109 1.219 -1.124 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.468 0.194 -2.967 1.00 0.00 C ATOM 0 H VAL A 14 -3.740 -0.340 -1.626 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.116 -1.274 -0.636 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.229 1.478 -1.407 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.157 2.046 -1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.129 1.569 -0.092 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.631 0.424 -1.223 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.202 1.022 -3.624 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.732 -0.604 -3.072 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.454 -0.183 -3.240 1.00 0.00 H new ATOM 236 N ALA A 15 -3.029 0.638 1.273 1.00 0.00 N ATOM 237 CA ALA A 15 -3.146 1.098 2.703 1.00 0.00 C ATOM 238 C ALA A 15 -3.378 -0.108 3.635 1.00 0.00 C ATOM 239 O ALA A 15 -2.958 -0.095 4.776 1.00 0.00 O ATOM 240 CB ALA A 15 -4.348 2.055 2.764 1.00 0.00 C ATOM 0 H ALA A 15 -3.822 0.866 0.674 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.232 1.595 3.029 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.474 2.416 3.785 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.174 2.901 2.098 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.249 1.527 2.452 1.00 0.00 H new ATOM 246 N GLU A 16 -4.040 -1.157 3.167 1.00 0.00 N ATOM 247 CA GLU A 16 -4.279 -2.355 4.057 1.00 0.00 C ATOM 248 C GLU A 16 -2.953 -2.854 4.658 1.00 0.00 C ATOM 249 O GLU A 16 -2.915 -3.291 5.794 1.00 0.00 O ATOM 250 CB GLU A 16 -4.893 -3.448 3.165 1.00 0.00 C ATOM 251 CG GLU A 16 -5.250 -4.668 4.018 1.00 0.00 C ATOM 252 CD GLU A 16 -5.358 -5.904 3.123 1.00 0.00 C ATOM 253 OE1 GLU A 16 -4.571 -6.009 2.196 1.00 0.00 O ATOM 254 OE2 GLU A 16 -6.225 -6.723 3.378 1.00 0.00 O ATOM 0 H GLU A 16 -4.419 -1.234 2.223 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.939 -2.097 4.885 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.784 -3.067 2.667 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.188 -3.732 2.384 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.489 -4.825 4.783 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.193 -4.498 4.537 1.00 0.00 H new ATOM 261 N LYS A 17 -1.865 -2.788 3.913 1.00 0.00 N ATOM 262 CA LYS A 17 -0.553 -3.261 4.478 1.00 0.00 C ATOM 263 C LYS A 17 0.110 -2.123 5.269 1.00 0.00 C ATOM 264 O LYS A 17 0.636 -2.342 6.343 1.00 0.00 O ATOM 265 CB LYS A 17 0.319 -3.665 3.280 1.00 0.00 C ATOM 266 CG LYS A 17 -0.019 -5.099 2.862 1.00 0.00 C ATOM 267 CD LYS A 17 0.574 -6.086 3.870 1.00 0.00 C ATOM 268 CE LYS A 17 2.102 -6.010 3.827 1.00 0.00 C ATOM 269 NZ LYS A 17 2.563 -7.393 4.135 1.00 0.00 N ATOM 0 H LYS A 17 -1.829 -2.434 2.957 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.688 -4.102 5.158 1.00 0.00 H new ATOM 0 HB2 LYS A 17 0.150 -2.983 2.447 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.374 -3.591 3.543 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -1.100 -5.226 2.807 1.00 0.00 H new ATOM 0 HG3 LYS A 17 0.376 -5.300 1.866 1.00 0.00 H new ATOM 0 HD2 LYS A 17 0.217 -5.855 4.873 1.00 0.00 H new ATOM 0 HD3 LYS A 17 0.244 -7.099 3.639 1.00 0.00 H new ATOM 0 HE2 LYS A 17 2.454 -5.685 2.848 1.00 0.00 H new ATOM 0 HE3 LYS A 17 2.483 -5.295 4.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 3.486 -7.353 4.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.871 -7.859 4.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.654 -7.933 3.251 1.00 0.00 H new ATOM 283 N LEU A 18 0.081 -0.907 4.757 1.00 0.00 N ATOM 284 CA LEU A 18 0.710 0.231 5.518 1.00 0.00 C ATOM 285 C LEU A 18 -0.026 0.418 6.851 1.00 0.00 C ATOM 286 O LEU A 18 0.588 0.467 7.901 1.00 0.00 O ATOM 287 CB LEU A 18 0.556 1.487 4.650 1.00 0.00 C ATOM 288 CG LEU A 18 1.500 1.398 3.455 1.00 0.00 C ATOM 289 CD1 LEU A 18 0.959 2.260 2.310 1.00 0.00 C ATOM 290 CD2 LEU A 18 2.886 1.902 3.866 1.00 0.00 C ATOM 0 H LEU A 18 -0.342 -0.657 3.863 1.00 0.00 H new ATOM 0 HA LEU A 18 1.761 0.036 5.731 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.474 1.581 4.307 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.779 2.378 5.238 1.00 0.00 H new ATOM 0 HG LEU A 18 1.573 0.362 3.123 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.634 2.196 1.456 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.028 1.901 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.886 3.297 2.638 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.563 1.840 3.014 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.813 2.938 4.197 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.270 1.287 4.680 1.00 0.00 H new ATOM 302 N ALA A 19 -1.342 0.507 6.822 1.00 0.00 N ATOM 303 CA ALA A 19 -2.105 0.671 8.109 1.00 0.00 C ATOM 304 C ALA A 19 -1.890 -0.559 9.014 1.00 0.00 C ATOM 305 O ALA A 19 -1.958 -0.452 10.225 1.00 0.00 O ATOM 306 CB ALA A 19 -3.591 0.797 7.735 1.00 0.00 C ATOM 0 H ALA A 19 -1.912 0.474 5.977 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.763 1.551 8.655 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.185 0.918 8.641 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.732 1.664 7.090 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.911 -0.102 7.209 1.00 0.00 H new ATOM 312 N GLY A 20 -1.636 -1.729 8.448 1.00 0.00 N ATOM 313 CA GLY A 20 -1.427 -2.942 9.294 1.00 0.00 C ATOM 314 C GLY A 20 -0.020 -2.922 9.914 1.00 0.00 C ATOM 315 O GLY A 20 0.162 -3.338 11.042 1.00 0.00 O ATOM 0 H GLY A 20 -1.567 -1.885 7.442 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.179 -2.978 10.082 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.554 -3.841 8.691 1.00 0.00 H new ATOM 319 N ILE A 21 0.985 -2.450 9.193 1.00 0.00 N ATOM 320 CA ILE A 21 2.380 -2.426 9.778 1.00 0.00 C ATOM 321 C ILE A 21 2.374 -1.682 11.134 1.00 0.00 C ATOM 322 O ILE A 21 2.204 -0.479 11.167 1.00 0.00 O ATOM 323 CB ILE A 21 3.274 -1.686 8.755 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.380 -2.523 7.475 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.681 -1.481 9.329 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.551 -1.603 6.261 1.00 0.00 C ATOM 0 H ILE A 21 0.903 -2.087 8.243 1.00 0.00 H new ATOM 0 HA ILE A 21 2.752 -3.434 9.961 1.00 0.00 H new ATOM 0 HB ILE A 21 2.828 -0.716 8.536 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.226 -3.206 7.546 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.486 -3.135 7.355 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.299 -0.959 8.599 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.619 -0.888 10.242 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.126 -2.450 9.555 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.626 -2.205 5.356 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.691 -0.938 6.185 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.458 -1.011 6.378 1.00 0.00 H new ATOM 338 N PRO A 22 2.558 -2.416 12.215 1.00 0.00 N ATOM 339 CA PRO A 22 2.569 -1.784 13.564 1.00 0.00 C ATOM 340 C PRO A 22 3.828 -0.918 13.794 1.00 0.00 C ATOM 341 O PRO A 22 3.865 -0.137 14.727 1.00 0.00 O ATOM 342 CB PRO A 22 2.561 -2.973 14.519 1.00 0.00 C ATOM 343 CG PRO A 22 3.147 -4.103 13.737 1.00 0.00 C ATOM 344 CD PRO A 22 2.773 -3.873 12.299 1.00 0.00 C ATOM 0 HA PRO A 22 1.726 -1.107 13.701 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.149 -2.765 15.413 1.00 0.00 H new ATOM 0 HB3 PRO A 22 1.549 -3.206 14.851 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.230 -4.134 13.855 1.00 0.00 H new ATOM 0 HG3 PRO A 22 2.760 -5.059 14.089 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.564 -4.199 11.624 1.00 0.00 H new ATOM 0 HD3 PRO A 22 1.874 -4.426 12.027 1.00 0.00 H new ATOM 352 N ASN A 23 4.854 -1.033 12.969 1.00 0.00 N ATOM 353 CA ASN A 23 6.078 -0.196 13.184 1.00 0.00 C ATOM 354 C ASN A 23 6.140 0.943 12.151 1.00 0.00 C ATOM 355 O ASN A 23 7.212 1.340 11.732 1.00 0.00 O ATOM 356 CB ASN A 23 7.267 -1.147 13.005 1.00 0.00 C ATOM 357 CG ASN A 23 7.291 -2.159 14.156 1.00 0.00 C ATOM 358 OD1 ASN A 23 6.256 -2.505 14.692 1.00 0.00 O ATOM 359 ND2 ASN A 23 8.432 -2.656 14.568 1.00 0.00 N ATOM 0 H ASN A 23 4.892 -1.663 12.168 1.00 0.00 H new ATOM 0 HA ASN A 23 6.079 0.269 14.170 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.189 -1.668 12.051 1.00 0.00 H new ATOM 0 HB3 ASN A 23 8.199 -0.581 12.985 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.448 -3.329 15.334 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.304 -2.370 14.122 1.00 0.00 H new ATOM 366 N PHE A 24 5.007 1.483 11.745 1.00 0.00 N ATOM 367 CA PHE A 24 5.030 2.607 10.751 1.00 0.00 C ATOM 368 C PHE A 24 4.848 3.946 11.484 1.00 0.00 C ATOM 369 O PHE A 24 3.769 4.253 11.956 1.00 0.00 O ATOM 370 CB PHE A 24 3.855 2.349 9.794 1.00 0.00 C ATOM 371 CG PHE A 24 4.263 2.709 8.385 1.00 0.00 C ATOM 372 CD1 PHE A 24 5.227 1.946 7.718 1.00 0.00 C ATOM 373 CD2 PHE A 24 3.673 3.807 7.746 1.00 0.00 C ATOM 374 CE1 PHE A 24 5.605 2.280 6.412 1.00 0.00 C ATOM 375 CE2 PHE A 24 4.050 4.142 6.439 1.00 0.00 C ATOM 376 CZ PHE A 24 5.016 3.378 5.772 1.00 0.00 C ATOM 0 H PHE A 24 4.079 1.196 12.057 1.00 0.00 H new ATOM 0 HA PHE A 24 5.974 2.655 10.208 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.557 1.302 9.841 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.990 2.940 10.096 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.680 1.099 8.211 1.00 0.00 H new ATOM 0 HD2 PHE A 24 2.928 4.395 8.261 1.00 0.00 H new ATOM 0 HE1 PHE A 24 6.350 1.691 5.898 1.00 0.00 H new ATOM 0 HE2 PHE A 24 3.596 4.989 5.946 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.307 3.635 4.764 1.00 0.00 H new ATOM 386 N ASN A 25 5.893 4.744 11.591 1.00 0.00 N ATOM 387 CA ASN A 25 5.762 6.055 12.303 1.00 0.00 C ATOM 388 C ASN A 25 5.801 7.218 11.300 1.00 0.00 C ATOM 389 O ASN A 25 6.400 8.244 11.561 1.00 0.00 O ATOM 390 CB ASN A 25 6.961 6.126 13.254 1.00 0.00 C ATOM 391 CG ASN A 25 6.651 5.334 14.531 1.00 0.00 C ATOM 392 OD1 ASN A 25 5.853 4.418 14.506 1.00 0.00 O ATOM 393 ND2 ASN A 25 7.247 5.647 15.655 1.00 0.00 N ATOM 0 H ASN A 25 6.821 4.542 11.218 1.00 0.00 H new ATOM 0 HA ASN A 25 4.816 6.131 12.839 1.00 0.00 H new ATOM 0 HB2 ASN A 25 7.848 5.720 12.768 1.00 0.00 H new ATOM 0 HB3 ASN A 25 7.181 7.164 13.502 1.00 0.00 H new ATOM 0 HD21 ASN A 25 7.041 5.122 16.505 1.00 0.00 H new ATOM 0 HD22 ASN A 25 7.917 6.415 15.680 1.00 0.00 H new ATOM 400 N GLU A 26 5.164 7.071 10.157 1.00 0.00 N ATOM 401 CA GLU A 26 5.164 8.175 9.149 1.00 0.00 C ATOM 402 C GLU A 26 3.765 8.307 8.527 1.00 0.00 C ATOM 403 O GLU A 26 2.829 7.669 8.976 1.00 0.00 O ATOM 404 CB GLU A 26 6.195 7.761 8.091 1.00 0.00 C ATOM 405 CG GLU A 26 5.823 6.397 7.493 1.00 0.00 C ATOM 406 CD GLU A 26 6.663 5.301 8.151 1.00 0.00 C ATOM 407 OE1 GLU A 26 7.819 5.169 7.783 1.00 0.00 O ATOM 408 OE2 GLU A 26 6.137 4.613 9.010 1.00 0.00 O ATOM 0 H GLU A 26 4.647 6.235 9.884 1.00 0.00 H new ATOM 0 HA GLU A 26 5.414 9.141 9.589 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.239 8.512 7.302 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.187 7.711 8.540 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.762 6.198 7.647 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.993 6.402 6.416 1.00 0.00 H new ATOM 415 N ASP A 27 3.605 9.120 7.501 1.00 0.00 N ATOM 416 CA ASP A 27 2.242 9.257 6.878 1.00 0.00 C ATOM 417 C ASP A 27 1.805 7.904 6.295 1.00 0.00 C ATOM 418 O ASP A 27 2.536 7.289 5.545 1.00 0.00 O ATOM 419 CB ASP A 27 2.360 10.304 5.760 1.00 0.00 C ATOM 420 CG ASP A 27 2.814 11.640 6.355 1.00 0.00 C ATOM 421 OD1 ASP A 27 2.117 12.149 7.217 1.00 0.00 O ATOM 422 OD2 ASP A 27 3.850 12.129 5.937 1.00 0.00 O ATOM 0 H ASP A 27 4.342 9.683 7.076 1.00 0.00 H new ATOM 0 HA ASP A 27 1.500 9.565 7.615 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.073 9.968 5.007 1.00 0.00 H new ATOM 0 HB3 ASP A 27 1.400 10.425 5.258 1.00 0.00 H new ATOM 427 N ILE A 28 0.628 7.427 6.643 1.00 0.00 N ATOM 428 CA ILE A 28 0.169 6.103 6.104 1.00 0.00 C ATOM 429 C ILE A 28 -0.814 6.297 4.925 1.00 0.00 C ATOM 430 O ILE A 28 -0.818 5.512 3.993 1.00 0.00 O ATOM 431 CB ILE A 28 -0.465 5.365 7.312 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.530 3.854 7.036 1.00 0.00 C ATOM 433 CG2 ILE A 28 -1.872 5.898 7.626 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.443 3.556 5.841 1.00 0.00 C ATOM 0 H ILE A 28 -0.028 7.893 7.270 1.00 0.00 H new ATOM 0 HA ILE A 28 0.987 5.514 5.688 1.00 0.00 H new ATOM 0 HB ILE A 28 0.167 5.550 8.180 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.472 3.473 6.838 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.900 3.334 7.920 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.284 5.357 8.478 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.814 6.960 7.864 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.517 5.755 6.759 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.473 2.481 5.665 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.449 3.917 6.053 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.057 4.058 4.954 1.00 0.00 H new ATOM 446 N LYS A 29 -1.621 7.334 4.932 1.00 0.00 N ATOM 447 CA LYS A 29 -2.551 7.549 3.770 1.00 0.00 C ATOM 448 C LYS A 29 -1.776 8.243 2.640 1.00 0.00 C ATOM 449 O LYS A 29 -1.965 7.934 1.478 1.00 0.00 O ATOM 450 CB LYS A 29 -3.697 8.439 4.274 1.00 0.00 C ATOM 451 CG LYS A 29 -4.528 7.667 5.302 1.00 0.00 C ATOM 452 CD LYS A 29 -5.937 8.261 5.369 1.00 0.00 C ATOM 453 CE LYS A 29 -5.917 9.529 6.226 1.00 0.00 C ATOM 454 NZ LYS A 29 -7.210 9.512 6.965 1.00 0.00 N ATOM 0 H LYS A 29 -1.678 8.030 5.676 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.949 6.611 3.384 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.296 9.347 4.723 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.326 8.747 3.439 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.579 6.613 5.027 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.053 7.718 6.282 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.293 8.493 4.365 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.630 7.534 5.793 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -5.070 9.529 6.912 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.827 10.422 5.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.272 10.351 7.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.998 9.519 6.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -7.264 8.654 7.550 1.00 0.00 H new ATOM 468 N TYR A 30 -0.886 9.161 2.968 1.00 0.00 N ATOM 469 CA TYR A 30 -0.086 9.840 1.891 1.00 0.00 C ATOM 470 C TYR A 30 0.957 8.864 1.317 1.00 0.00 C ATOM 471 O TYR A 30 1.279 8.930 0.145 1.00 0.00 O ATOM 472 CB TYR A 30 0.608 11.046 2.551 1.00 0.00 C ATOM 473 CG TYR A 30 1.419 11.800 1.525 1.00 0.00 C ATOM 474 CD1 TYR A 30 0.814 12.250 0.345 1.00 0.00 C ATOM 475 CD2 TYR A 30 2.777 12.049 1.756 1.00 0.00 C ATOM 476 CE1 TYR A 30 1.569 12.949 -0.605 1.00 0.00 C ATOM 477 CE2 TYR A 30 3.532 12.748 0.806 1.00 0.00 C ATOM 478 CZ TYR A 30 2.928 13.199 -0.374 1.00 0.00 C ATOM 479 OH TYR A 30 3.671 13.888 -1.310 1.00 0.00 O ATOM 0 H TYR A 30 -0.683 9.464 3.920 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.722 10.163 1.067 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -0.137 11.707 2.995 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.255 10.706 3.360 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.234 12.058 0.168 1.00 0.00 H new ATOM 0 HD2 TYR A 30 3.242 11.702 2.667 1.00 0.00 H new ATOM 0 HE1 TYR A 30 1.104 13.295 -1.516 1.00 0.00 H new ATOM 0 HE2 TYR A 30 4.580 12.939 0.983 1.00 0.00 H new ATOM 0 HH TYR A 30 4.594 13.976 -0.994 1.00 0.00 H new ATOM 489 N VAL A 31 1.487 7.956 2.120 1.00 0.00 N ATOM 490 CA VAL A 31 2.502 6.993 1.567 1.00 0.00 C ATOM 491 C VAL A 31 1.819 6.003 0.602 1.00 0.00 C ATOM 492 O VAL A 31 2.384 5.638 -0.411 1.00 0.00 O ATOM 493 CB VAL A 31 3.150 6.270 2.777 1.00 0.00 C ATOM 494 CG1 VAL A 31 2.186 5.256 3.396 1.00 0.00 C ATOM 495 CG2 VAL A 31 4.419 5.546 2.313 1.00 0.00 C ATOM 0 H VAL A 31 1.266 7.844 3.109 1.00 0.00 H new ATOM 0 HA VAL A 31 3.272 7.508 0.993 1.00 0.00 H new ATOM 0 HB VAL A 31 3.395 7.016 3.533 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.668 4.765 4.242 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.288 5.770 3.738 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.915 4.509 2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.878 5.036 3.160 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.161 4.815 1.546 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.122 6.271 1.902 1.00 0.00 H new ATOM 505 N ALA A 32 0.604 5.578 0.897 1.00 0.00 N ATOM 506 CA ALA A 32 -0.092 4.622 -0.039 1.00 0.00 C ATOM 507 C ALA A 32 -0.370 5.322 -1.375 1.00 0.00 C ATOM 508 O ALA A 32 -0.209 4.734 -2.429 1.00 0.00 O ATOM 509 CB ALA A 32 -1.412 4.216 0.636 1.00 0.00 C ATOM 0 H ALA A 32 0.074 5.845 1.727 1.00 0.00 H new ATOM 0 HA ALA A 32 0.523 3.744 -0.239 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.952 3.522 -0.008 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.200 3.735 1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.022 5.103 0.805 1.00 0.00 H new ATOM 515 N GLU A 33 -0.775 6.578 -1.350 1.00 0.00 N ATOM 516 CA GLU A 33 -1.045 7.300 -2.647 1.00 0.00 C ATOM 517 C GLU A 33 0.240 7.336 -3.484 1.00 0.00 C ATOM 518 O GLU A 33 0.219 7.062 -4.671 1.00 0.00 O ATOM 519 CB GLU A 33 -1.484 8.728 -2.283 1.00 0.00 C ATOM 520 CG GLU A 33 -2.876 8.689 -1.651 1.00 0.00 C ATOM 521 CD GLU A 33 -3.289 10.103 -1.237 1.00 0.00 C ATOM 522 OE1 GLU A 33 -3.061 11.016 -2.013 1.00 0.00 O ATOM 523 OE2 GLU A 33 -3.823 10.248 -0.149 1.00 0.00 O ATOM 0 H GLU A 33 -0.928 7.127 -0.504 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.818 6.799 -3.229 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.771 9.173 -1.590 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.495 9.355 -3.175 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.597 8.281 -2.359 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.874 8.030 -0.783 1.00 0.00 H new ATOM 530 N TYR A 34 1.362 7.646 -2.872 1.00 0.00 N ATOM 531 CA TYR A 34 2.653 7.666 -3.648 1.00 0.00 C ATOM 532 C TYR A 34 2.955 6.246 -4.147 1.00 0.00 C ATOM 533 O TYR A 34 3.375 6.057 -5.273 1.00 0.00 O ATOM 534 CB TYR A 34 3.747 8.146 -2.674 1.00 0.00 C ATOM 535 CG TYR A 34 5.122 8.149 -3.329 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.274 8.305 -4.721 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.256 8.012 -2.519 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.554 8.321 -5.286 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.533 8.032 -3.087 1.00 0.00 C ATOM 540 CZ TYR A 34 7.683 8.187 -4.470 1.00 0.00 C ATOM 541 OH TYR A 34 8.944 8.211 -5.030 1.00 0.00 O ATOM 0 H TYR A 34 1.443 7.883 -1.883 1.00 0.00 H new ATOM 0 HA TYR A 34 2.601 8.326 -4.514 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.508 9.150 -2.325 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.763 7.499 -1.797 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.404 8.412 -5.351 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.144 7.890 -1.452 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.671 8.437 -6.353 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.405 7.928 -2.458 1.00 0.00 H new ATOM 0 HH TYR A 34 9.612 8.348 -4.326 1.00 0.00 H new ATOM 551 N ILE A 35 2.722 5.241 -3.325 1.00 0.00 N ATOM 552 CA ILE A 35 2.977 3.826 -3.777 1.00 0.00 C ATOM 553 C ILE A 35 2.094 3.534 -5.005 1.00 0.00 C ATOM 554 O ILE A 35 2.571 3.041 -6.010 1.00 0.00 O ATOM 555 CB ILE A 35 2.614 2.923 -2.578 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.677 3.106 -1.490 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.571 1.448 -2.989 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.231 2.400 -0.209 1.00 0.00 C ATOM 0 H ILE A 35 2.371 5.337 -2.372 1.00 0.00 H new ATOM 0 HA ILE A 35 4.012 3.652 -4.072 1.00 0.00 H new ATOM 0 HB ILE A 35 1.627 3.206 -2.212 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.630 2.699 -1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.834 4.167 -1.296 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.313 0.837 -2.124 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.822 1.309 -3.768 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.548 1.147 -3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.990 2.532 0.562 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.288 2.827 0.132 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.097 1.337 -0.407 1.00 0.00 H new ATOM 570 N VAL A 36 0.821 3.870 -4.945 1.00 0.00 N ATOM 571 CA VAL A 36 -0.067 3.639 -6.142 1.00 0.00 C ATOM 572 C VAL A 36 0.468 4.471 -7.319 1.00 0.00 C ATOM 573 O VAL A 36 0.526 3.999 -8.438 1.00 0.00 O ATOM 574 CB VAL A 36 -1.482 4.102 -5.745 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.433 3.961 -6.938 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.990 3.238 -4.587 1.00 0.00 C ATOM 0 H VAL A 36 0.363 4.287 -4.135 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.086 2.592 -6.443 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.445 5.147 -5.439 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.431 4.290 -6.649 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.074 4.574 -7.764 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.472 2.918 -7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.991 3.562 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.022 2.194 -4.899 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.319 3.342 -3.734 1.00 0.00 H new ATOM 586 N LEU A 37 0.886 5.700 -7.070 1.00 0.00 N ATOM 587 CA LEU A 37 1.447 6.537 -8.192 1.00 0.00 C ATOM 588 C LEU A 37 2.666 5.816 -8.792 1.00 0.00 C ATOM 589 O LEU A 37 2.847 5.792 -9.995 1.00 0.00 O ATOM 590 CB LEU A 37 1.870 7.884 -7.583 1.00 0.00 C ATOM 591 CG LEU A 37 1.736 8.985 -8.635 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.337 9.600 -8.555 1.00 0.00 C ATOM 593 CD2 LEU A 37 2.784 10.069 -8.374 1.00 0.00 C ATOM 0 H LEU A 37 0.864 6.152 -6.156 1.00 0.00 H new ATOM 0 HA LEU A 37 0.713 6.693 -8.983 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.248 8.115 -6.718 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.900 7.828 -7.229 1.00 0.00 H new ATOM 0 HG LEU A 37 1.890 8.560 -9.627 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.241 10.385 -9.305 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.411 8.829 -8.740 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.183 10.025 -7.563 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.689 10.855 -9.124 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.629 10.493 -7.382 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.781 9.632 -8.430 1.00 0.00 H new ATOM 605 N LEU A 38 3.486 5.191 -7.969 1.00 0.00 N ATOM 606 CA LEU A 38 4.654 4.436 -8.535 1.00 0.00 C ATOM 607 C LEU A 38 4.106 3.227 -9.314 1.00 0.00 C ATOM 608 O LEU A 38 4.596 2.884 -10.373 1.00 0.00 O ATOM 609 CB LEU A 38 5.509 3.959 -7.349 1.00 0.00 C ATOM 610 CG LEU A 38 6.056 5.166 -6.588 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.419 4.747 -5.161 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.307 5.690 -7.298 1.00 0.00 C ATOM 0 H LEU A 38 3.399 5.172 -6.953 1.00 0.00 H new ATOM 0 HA LEU A 38 5.255 5.053 -9.203 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.910 3.338 -6.683 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.331 3.340 -7.707 1.00 0.00 H new ATOM 0 HG LEU A 38 5.299 5.950 -6.556 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.809 5.607 -4.617 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.530 4.371 -4.655 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.177 3.964 -5.193 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.699 6.551 -6.757 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.063 4.906 -7.329 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.051 5.987 -8.315 1.00 0.00 H new ATOM 624 N ILE A 39 3.074 2.585 -8.795 1.00 0.00 N ATOM 625 CA ILE A 39 2.473 1.403 -9.509 1.00 0.00 C ATOM 626 C ILE A 39 1.867 1.863 -10.845 1.00 0.00 C ATOM 627 O ILE A 39 2.161 1.300 -11.884 1.00 0.00 O ATOM 628 CB ILE A 39 1.378 0.852 -8.563 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.041 0.266 -7.301 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.528 -0.221 -9.261 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.796 -1.028 -7.633 1.00 0.00 C ATOM 0 H ILE A 39 2.625 2.829 -7.912 1.00 0.00 H new ATOM 0 HA ILE A 39 3.213 0.636 -9.737 1.00 0.00 H new ATOM 0 HB ILE A 39 0.716 1.671 -8.284 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.730 0.995 -6.875 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.281 0.066 -6.545 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.232 -0.589 -8.571 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.045 0.211 -10.137 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.168 -1.048 -9.570 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.256 -1.424 -6.727 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.099 -1.762 -8.037 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.570 -0.818 -8.371 1.00 0.00 H new ATOM 643 N VAL A 40 1.029 2.878 -10.831 1.00 0.00 N ATOM 644 CA VAL A 40 0.423 3.351 -12.126 1.00 0.00 C ATOM 645 C VAL A 40 1.534 3.797 -13.104 1.00 0.00 C ATOM 646 O VAL A 40 1.386 3.670 -14.305 1.00 0.00 O ATOM 647 CB VAL A 40 -0.558 4.506 -11.780 1.00 0.00 C ATOM 648 CG1 VAL A 40 0.179 5.830 -11.542 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.550 4.685 -12.932 1.00 0.00 C ATOM 0 H VAL A 40 0.742 3.391 -9.998 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.123 2.552 -12.627 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.078 4.240 -10.860 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.543 6.611 -11.303 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.876 5.714 -10.712 1.00 0.00 H new ATOM 0 HG13 VAL A 40 0.729 6.107 -12.442 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.241 5.494 -12.695 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.007 4.928 -13.845 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.110 3.761 -13.077 1.00 0.00 H new ATOM 659 N ASN A 41 2.641 4.317 -12.603 1.00 0.00 N ATOM 660 CA ASN A 41 3.741 4.758 -13.532 1.00 0.00 C ATOM 661 C ASN A 41 4.297 3.557 -14.312 1.00 0.00 C ATOM 662 O ASN A 41 4.623 3.677 -15.478 1.00 0.00 O ATOM 663 CB ASN A 41 4.843 5.379 -12.658 1.00 0.00 C ATOM 664 CG ASN A 41 4.364 6.731 -12.113 1.00 0.00 C ATOM 665 OD1 ASN A 41 3.495 7.355 -12.690 1.00 0.00 O ATOM 666 ND2 ASN A 41 4.895 7.219 -11.017 1.00 0.00 N ATOM 0 H ASN A 41 2.827 4.453 -11.609 1.00 0.00 H new ATOM 0 HA ASN A 41 3.367 5.478 -14.260 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.089 4.709 -11.834 1.00 0.00 H new ATOM 0 HB3 ASN A 41 5.753 5.513 -13.242 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.578 8.118 -10.653 1.00 0.00 H new ATOM 0 HD22 ASN A 41 5.625 6.700 -10.529 1.00 0.00 H new ATOM 673 N GLY A 42 4.413 2.401 -13.687 1.00 0.00 N ATOM 674 CA GLY A 42 4.958 1.213 -14.428 1.00 0.00 C ATOM 675 C GLY A 42 4.705 -0.078 -13.633 1.00 0.00 C ATOM 676 O GLY A 42 3.993 -0.956 -14.082 1.00 0.00 O ATOM 0 H GLY A 42 4.158 2.232 -12.714 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.488 1.141 -15.409 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.027 1.340 -14.596 1.00 0.00 H new ATOM 680 N GLY A 43 5.281 -0.200 -12.456 1.00 0.00 N ATOM 681 CA GLY A 43 5.069 -1.433 -11.644 1.00 0.00 C ATOM 682 C GLY A 43 6.394 -2.197 -11.495 1.00 0.00 C ATOM 683 O GLY A 43 6.472 -3.372 -11.799 1.00 0.00 O ATOM 0 H GLY A 43 5.886 0.502 -12.029 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.679 -1.169 -10.661 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.324 -2.070 -12.122 1.00 0.00 H new ATOM 687 N THR A 44 7.433 -1.546 -11.011 1.00 0.00 N ATOM 688 CA THR A 44 8.738 -2.242 -10.823 1.00 0.00 C ATOM 689 C THR A 44 9.080 -2.247 -9.325 1.00 0.00 C ATOM 690 O THR A 44 9.475 -1.239 -8.776 1.00 0.00 O ATOM 691 CB THR A 44 9.745 -1.414 -11.624 1.00 0.00 C ATOM 692 OG1 THR A 44 9.543 -0.032 -11.346 1.00 0.00 O ATOM 693 CG2 THR A 44 9.539 -1.674 -13.119 1.00 0.00 C ATOM 0 H THR A 44 7.426 -0.563 -10.740 1.00 0.00 H new ATOM 0 HA THR A 44 8.732 -3.279 -11.159 1.00 0.00 H new ATOM 0 HB THR A 44 10.760 -1.696 -11.344 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.187 0.502 -11.856 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.255 -1.085 -13.693 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.689 -2.733 -13.328 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.526 -1.389 -13.402 1.00 0.00 H new ATOM 701 N VAL A 45 8.888 -3.366 -8.648 1.00 0.00 N ATOM 702 CA VAL A 45 9.164 -3.414 -7.159 1.00 0.00 C ATOM 703 C VAL A 45 10.541 -2.810 -6.816 1.00 0.00 C ATOM 704 O VAL A 45 10.697 -2.195 -5.778 1.00 0.00 O ATOM 705 CB VAL A 45 9.105 -4.900 -6.738 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.438 -5.040 -5.247 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.694 -5.443 -6.979 1.00 0.00 C ATOM 0 H VAL A 45 8.556 -4.240 -9.055 1.00 0.00 H new ATOM 0 HA VAL A 45 8.424 -2.821 -6.622 1.00 0.00 H new ATOM 0 HB VAL A 45 9.830 -5.461 -7.328 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.393 -6.091 -4.961 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.441 -4.655 -5.060 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.717 -4.473 -4.658 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.652 -6.491 -6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 45 6.978 -4.870 -6.390 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.446 -5.355 -8.037 1.00 0.00 H new ATOM 717 N GLU A 46 11.534 -2.973 -7.658 1.00 0.00 N ATOM 718 CA GLU A 46 12.880 -2.388 -7.321 1.00 0.00 C ATOM 719 C GLU A 46 12.819 -0.861 -7.402 1.00 0.00 C ATOM 720 O GLU A 46 13.122 -0.181 -6.438 1.00 0.00 O ATOM 721 CB GLU A 46 13.883 -2.947 -8.342 1.00 0.00 C ATOM 722 CG GLU A 46 14.108 -4.437 -8.076 1.00 0.00 C ATOM 723 CD GLU A 46 14.837 -4.612 -6.741 1.00 0.00 C ATOM 724 OE1 GLU A 46 16.052 -4.507 -6.734 1.00 0.00 O ATOM 725 OE2 GLU A 46 14.167 -4.850 -5.750 1.00 0.00 O ATOM 0 H GLU A 46 11.479 -3.473 -8.545 1.00 0.00 H new ATOM 0 HA GLU A 46 13.182 -2.652 -6.308 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.507 -2.801 -9.354 1.00 0.00 H new ATOM 0 HB3 GLU A 46 14.828 -2.408 -8.272 1.00 0.00 H new ATOM 0 HG2 GLU A 46 13.153 -4.962 -8.053 1.00 0.00 H new ATOM 0 HG3 GLU A 46 14.694 -4.877 -8.883 1.00 0.00 H new ATOM 732 N SER A 47 12.413 -0.308 -8.524 1.00 0.00 N ATOM 733 CA SER A 47 12.323 1.192 -8.608 1.00 0.00 C ATOM 734 C SER A 47 11.196 1.689 -7.689 1.00 0.00 C ATOM 735 O SER A 47 11.294 2.756 -7.113 1.00 0.00 O ATOM 736 CB SER A 47 12.021 1.554 -10.070 1.00 0.00 C ATOM 737 OG SER A 47 12.787 2.694 -10.437 1.00 0.00 O ATOM 0 H SER A 47 12.145 -0.815 -9.368 1.00 0.00 H new ATOM 0 HA SER A 47 13.254 1.660 -8.289 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.261 0.714 -10.722 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.958 1.760 -10.194 1.00 0.00 H new ATOM 0 HG SER A 47 12.599 2.928 -11.370 1.00 0.00 H new ATOM 743 N VAL A 48 10.129 0.925 -7.535 1.00 0.00 N ATOM 744 CA VAL A 48 9.016 1.379 -6.636 1.00 0.00 C ATOM 745 C VAL A 48 9.479 1.342 -5.175 1.00 0.00 C ATOM 746 O VAL A 48 9.206 2.257 -4.424 1.00 0.00 O ATOM 747 CB VAL A 48 7.830 0.417 -6.858 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.657 0.823 -5.960 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.386 0.483 -8.321 1.00 0.00 C ATOM 0 H VAL A 48 9.986 0.022 -7.987 1.00 0.00 H new ATOM 0 HA VAL A 48 8.720 2.403 -6.863 1.00 0.00 H new ATOM 0 HB VAL A 48 8.143 -0.598 -6.612 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.822 0.141 -6.121 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.966 0.779 -4.916 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.347 1.839 -6.204 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.548 -0.196 -8.478 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.078 1.500 -8.562 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.215 0.192 -8.966 1.00 0.00 H new ATOM 759 N VAL A 49 10.190 0.311 -4.761 1.00 0.00 N ATOM 760 CA VAL A 49 10.658 0.278 -3.329 1.00 0.00 C ATOM 761 C VAL A 49 11.715 1.373 -3.119 1.00 0.00 C ATOM 762 O VAL A 49 11.728 2.033 -2.095 1.00 0.00 O ATOM 763 CB VAL A 49 11.241 -1.129 -3.074 1.00 0.00 C ATOM 764 CG1 VAL A 49 11.903 -1.189 -1.691 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.109 -2.159 -3.124 1.00 0.00 C ATOM 0 H VAL A 49 10.461 -0.488 -5.334 1.00 0.00 H new ATOM 0 HA VAL A 49 9.844 0.468 -2.630 1.00 0.00 H new ATOM 0 HB VAL A 49 11.986 -1.346 -3.839 1.00 0.00 H new ATOM 0 HG11 VAL A 49 12.309 -2.187 -1.525 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.708 -0.456 -1.641 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.162 -0.967 -0.923 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.515 -3.155 -2.945 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.370 -1.925 -2.358 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.635 -2.132 -4.105 1.00 0.00 H new ATOM 775 N ASP A 50 12.591 1.588 -4.080 1.00 0.00 N ATOM 776 CA ASP A 50 13.628 2.671 -3.911 1.00 0.00 C ATOM 777 C ASP A 50 12.940 4.031 -3.697 1.00 0.00 C ATOM 778 O ASP A 50 13.435 4.865 -2.960 1.00 0.00 O ATOM 779 CB ASP A 50 14.461 2.696 -5.202 1.00 0.00 C ATOM 780 CG ASP A 50 15.532 1.605 -5.141 1.00 0.00 C ATOM 781 OD1 ASP A 50 15.192 0.489 -4.788 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.674 1.905 -5.449 1.00 0.00 O ATOM 0 H ASP A 50 12.635 1.072 -4.959 1.00 0.00 H new ATOM 0 HA ASP A 50 14.259 2.477 -3.044 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.816 2.539 -6.066 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.929 3.673 -5.327 1.00 0.00 H new ATOM 787 N GLU A 51 11.804 4.268 -4.329 1.00 0.00 N ATOM 788 CA GLU A 51 11.109 5.591 -4.136 1.00 0.00 C ATOM 789 C GLU A 51 10.613 5.725 -2.691 1.00 0.00 C ATOM 790 O GLU A 51 10.731 6.779 -2.093 1.00 0.00 O ATOM 791 CB GLU A 51 9.920 5.630 -5.114 1.00 0.00 C ATOM 792 CG GLU A 51 10.319 6.405 -6.373 1.00 0.00 C ATOM 793 CD GLU A 51 10.790 5.427 -7.451 1.00 0.00 C ATOM 794 OE1 GLU A 51 11.972 5.127 -7.474 1.00 0.00 O ATOM 795 OE2 GLU A 51 9.961 4.997 -8.236 1.00 0.00 O ATOM 0 H GLU A 51 11.336 3.615 -4.958 1.00 0.00 H new ATOM 0 HA GLU A 51 11.794 6.417 -4.329 1.00 0.00 H new ATOM 0 HB2 GLU A 51 9.619 4.616 -5.378 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.061 6.104 -4.640 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.472 6.985 -6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.113 7.114 -6.139 1.00 0.00 H new ATOM 802 N LEU A 52 10.074 4.671 -2.113 1.00 0.00 N ATOM 803 CA LEU A 52 9.596 4.777 -0.690 1.00 0.00 C ATOM 804 C LEU A 52 10.813 4.900 0.231 1.00 0.00 C ATOM 805 O LEU A 52 10.814 5.692 1.152 1.00 0.00 O ATOM 806 CB LEU A 52 8.816 3.488 -0.353 1.00 0.00 C ATOM 807 CG LEU A 52 7.363 3.557 -0.858 1.00 0.00 C ATOM 808 CD1 LEU A 52 6.663 4.819 -0.340 1.00 0.00 C ATOM 809 CD2 LEU A 52 7.352 3.553 -2.386 1.00 0.00 C ATOM 0 H LEU A 52 9.946 3.760 -2.554 1.00 0.00 H new ATOM 0 HA LEU A 52 8.955 5.648 -0.557 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.318 2.631 -0.802 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.820 3.331 0.726 1.00 0.00 H new ATOM 0 HG LEU A 52 6.825 2.687 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.638 4.845 -0.710 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.655 4.809 0.750 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.198 5.702 -0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.323 3.602 -2.743 1.00 0.00 H new ATOM 0 HD22 LEU A 52 7.906 4.416 -2.756 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.819 2.638 -2.751 1.00 0.00 H new ATOM 821 N ALA A 53 11.854 4.132 -0.013 1.00 0.00 N ATOM 822 CA ALA A 53 13.075 4.234 0.864 1.00 0.00 C ATOM 823 C ALA A 53 13.654 5.657 0.790 1.00 0.00 C ATOM 824 O ALA A 53 14.110 6.192 1.782 1.00 0.00 O ATOM 825 CB ALA A 53 14.096 3.217 0.328 1.00 0.00 C ATOM 0 H ALA A 53 11.913 3.449 -0.768 1.00 0.00 H new ATOM 0 HA ALA A 53 12.830 4.025 1.905 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.001 3.255 0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.670 2.215 0.375 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.342 3.459 -0.706 1.00 0.00 H new ATOM 831 N SER A 54 13.636 6.277 -0.375 1.00 0.00 N ATOM 832 CA SER A 54 14.191 7.677 -0.484 1.00 0.00 C ATOM 833 C SER A 54 13.443 8.624 0.469 1.00 0.00 C ATOM 834 O SER A 54 14.037 9.512 1.052 1.00 0.00 O ATOM 835 CB SER A 54 13.987 8.124 -1.938 1.00 0.00 C ATOM 836 OG SER A 54 14.809 9.254 -2.202 1.00 0.00 O ATOM 0 H SER A 54 13.268 5.884 -1.241 1.00 0.00 H new ATOM 0 HA SER A 54 15.246 7.698 -0.211 1.00 0.00 H new ATOM 0 HB2 SER A 54 14.237 7.311 -2.619 1.00 0.00 H new ATOM 0 HB3 SER A 54 12.940 8.373 -2.110 1.00 0.00 H new ATOM 0 HG SER A 54 14.682 9.541 -3.130 1.00 0.00 H new ATOM 842 N LEU A 55 12.148 8.445 0.638 1.00 0.00 N ATOM 843 CA LEU A 55 11.384 9.349 1.567 1.00 0.00 C ATOM 844 C LEU A 55 11.272 8.710 2.960 1.00 0.00 C ATOM 845 O LEU A 55 11.393 9.384 3.966 1.00 0.00 O ATOM 846 CB LEU A 55 9.994 9.525 0.942 1.00 0.00 C ATOM 847 CG LEU A 55 10.066 10.559 -0.182 1.00 0.00 C ATOM 848 CD1 LEU A 55 8.798 10.476 -1.034 1.00 0.00 C ATOM 849 CD2 LEU A 55 10.180 11.960 0.423 1.00 0.00 C ATOM 0 H LEU A 55 11.594 7.722 0.179 1.00 0.00 H new ATOM 0 HA LEU A 55 11.885 10.309 1.693 1.00 0.00 H new ATOM 0 HB2 LEU A 55 9.636 8.572 0.551 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.281 9.847 1.701 1.00 0.00 H new ATOM 0 HG LEU A 55 10.937 10.358 -0.806 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.849 11.213 -1.835 1.00 0.00 H new ATOM 0 HD12 LEU A 55 8.713 9.478 -1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 55 7.927 10.678 -0.411 1.00 0.00 H new ATOM 0 HD21 LEU A 55 10.231 12.699 -0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.308 12.160 1.046 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.082 12.021 1.032 1.00 0.00 H new ATOM 861 N PHE A 56 11.051 7.416 3.030 1.00 0.00 N ATOM 862 CA PHE A 56 10.942 6.738 4.359 1.00 0.00 C ATOM 863 C PHE A 56 12.217 5.925 4.622 1.00 0.00 C ATOM 864 O PHE A 56 12.205 4.710 4.574 1.00 0.00 O ATOM 865 CB PHE A 56 9.714 5.821 4.259 1.00 0.00 C ATOM 866 CG PHE A 56 8.492 6.656 3.946 1.00 0.00 C ATOM 867 CD1 PHE A 56 7.971 7.522 4.913 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.893 6.577 2.682 1.00 0.00 C ATOM 869 CE1 PHE A 56 6.847 8.305 4.620 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.774 7.361 2.389 1.00 0.00 C ATOM 871 CZ PHE A 56 6.250 8.223 3.356 1.00 0.00 C ATOM 0 H PHE A 56 10.942 6.802 2.223 1.00 0.00 H new ATOM 0 HA PHE A 56 10.833 7.446 5.181 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.867 5.073 3.481 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.571 5.282 5.196 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.435 7.587 5.886 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.296 5.910 1.934 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.442 8.971 5.368 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.314 7.301 1.414 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.384 8.827 3.128 1.00 0.00 H new ATOM 881 N ASP A 57 13.323 6.590 4.899 1.00 0.00 N ATOM 882 CA ASP A 57 14.604 5.839 5.165 1.00 0.00 C ATOM 883 C ASP A 57 14.645 5.234 6.587 1.00 0.00 C ATOM 884 O ASP A 57 15.577 4.524 6.914 1.00 0.00 O ATOM 885 CB ASP A 57 15.744 6.854 4.994 1.00 0.00 C ATOM 886 CG ASP A 57 16.974 6.150 4.419 1.00 0.00 C ATOM 887 OD1 ASP A 57 17.777 5.669 5.200 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.091 6.103 3.205 1.00 0.00 O ATOM 0 H ASP A 57 13.395 7.606 4.952 1.00 0.00 H new ATOM 0 HA ASP A 57 14.692 5.000 4.474 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.430 7.660 4.331 1.00 0.00 H new ATOM 0 HB3 ASP A 57 15.988 7.308 5.955 1.00 0.00 H new ATOM 893 N SER A 58 13.659 5.484 7.438 1.00 0.00 N ATOM 894 CA SER A 58 13.702 4.880 8.813 1.00 0.00 C ATOM 895 C SER A 58 12.811 3.622 8.893 1.00 0.00 C ATOM 896 O SER A 58 12.363 3.255 9.964 1.00 0.00 O ATOM 897 CB SER A 58 13.181 5.964 9.762 1.00 0.00 C ATOM 898 OG SER A 58 13.852 5.857 11.011 1.00 0.00 O ATOM 0 H SER A 58 12.846 6.068 7.240 1.00 0.00 H new ATOM 0 HA SER A 58 14.713 4.565 9.074 1.00 0.00 H new ATOM 0 HB2 SER A 58 13.346 6.951 9.331 1.00 0.00 H new ATOM 0 HB3 SER A 58 12.106 5.854 9.903 1.00 0.00 H new ATOM 0 HG SER A 58 13.522 6.550 11.620 1.00 0.00 H new ATOM 904 N VAL A 59 12.553 2.948 7.784 1.00 0.00 N ATOM 905 CA VAL A 59 11.704 1.719 7.833 1.00 0.00 C ATOM 906 C VAL A 59 12.495 0.522 7.281 1.00 0.00 C ATOM 907 O VAL A 59 13.280 0.668 6.362 1.00 0.00 O ATOM 908 CB VAL A 59 10.499 2.030 6.940 1.00 0.00 C ATOM 909 CG1 VAL A 59 9.565 0.817 6.888 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.738 3.230 7.511 1.00 0.00 C ATOM 0 H VAL A 59 12.895 3.201 6.857 1.00 0.00 H new ATOM 0 HA VAL A 59 11.396 1.462 8.847 1.00 0.00 H new ATOM 0 HB VAL A 59 10.848 2.261 5.934 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.710 1.043 6.252 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.103 -0.039 6.482 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.217 0.583 7.894 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.880 3.452 6.876 1.00 0.00 H new ATOM 0 HG22 VAL A 59 9.393 2.996 8.518 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.398 4.097 7.545 1.00 0.00 H new ATOM 920 N SER A 60 12.298 -0.660 7.829 1.00 0.00 N ATOM 921 CA SER A 60 13.057 -1.855 7.309 1.00 0.00 C ATOM 922 C SER A 60 12.712 -2.090 5.830 1.00 0.00 C ATOM 923 O SER A 60 11.577 -1.927 5.426 1.00 0.00 O ATOM 924 CB SER A 60 12.618 -3.062 8.152 1.00 0.00 C ATOM 925 OG SER A 60 13.296 -3.033 9.401 1.00 0.00 O ATOM 0 H SER A 60 11.657 -0.849 8.600 1.00 0.00 H new ATOM 0 HA SER A 60 14.133 -1.700 7.382 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.540 -3.037 8.310 1.00 0.00 H new ATOM 0 HB3 SER A 60 12.842 -3.989 7.625 1.00 0.00 H new ATOM 0 HG SER A 60 13.017 -3.801 9.942 1.00 0.00 H new ATOM 931 N ARG A 61 13.678 -2.476 5.016 1.00 0.00 N ATOM 932 CA ARG A 61 13.381 -2.720 3.554 1.00 0.00 C ATOM 933 C ARG A 61 12.204 -3.697 3.397 1.00 0.00 C ATOM 934 O ARG A 61 11.405 -3.566 2.488 1.00 0.00 O ATOM 935 CB ARG A 61 14.652 -3.331 2.942 1.00 0.00 C ATOM 936 CG ARG A 61 15.589 -2.210 2.484 1.00 0.00 C ATOM 937 CD ARG A 61 16.549 -1.852 3.621 1.00 0.00 C ATOM 938 NE ARG A 61 17.684 -1.153 2.957 1.00 0.00 N ATOM 939 CZ ARG A 61 18.829 -1.762 2.810 1.00 0.00 C ATOM 940 NH1 ARG A 61 18.893 -2.875 2.129 1.00 0.00 N ATOM 941 NH2 ARG A 61 19.909 -1.260 3.341 1.00 0.00 N ATOM 0 H ARG A 61 14.647 -2.631 5.294 1.00 0.00 H new ATOM 0 HA ARG A 61 13.106 -1.790 3.056 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.154 -3.962 3.675 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.391 -3.969 2.098 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.151 -2.527 1.605 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.010 -1.334 2.193 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.067 -1.210 4.358 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.888 -2.744 4.148 1.00 0.00 H new ATOM 0 HE ARG A 61 17.567 -0.198 2.617 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.049 -3.267 1.713 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.787 -3.352 2.014 1.00 0.00 H new ATOM 0 HH21 ARG A 61 19.860 -0.390 3.872 1.00 0.00 H new ATOM 0 HH22 ARG A 61 20.803 -1.737 3.225 1.00 0.00 H new ATOM 955 N ASP A 62 12.085 -4.673 4.274 1.00 0.00 N ATOM 956 CA ASP A 62 10.941 -5.647 4.155 1.00 0.00 C ATOM 957 C ASP A 62 9.595 -4.943 4.397 1.00 0.00 C ATOM 958 O ASP A 62 8.594 -5.313 3.811 1.00 0.00 O ATOM 959 CB ASP A 62 11.169 -6.734 5.217 1.00 0.00 C ATOM 960 CG ASP A 62 12.457 -7.497 4.900 1.00 0.00 C ATOM 961 OD1 ASP A 62 13.477 -6.852 4.727 1.00 0.00 O ATOM 962 OD2 ASP A 62 12.400 -8.715 4.836 1.00 0.00 O ATOM 0 H ASP A 62 12.719 -4.837 5.056 1.00 0.00 H new ATOM 0 HA ASP A 62 10.906 -6.075 3.153 1.00 0.00 H new ATOM 0 HB2 ASP A 62 11.236 -6.282 6.207 1.00 0.00 H new ATOM 0 HB3 ASP A 62 10.323 -7.421 5.237 1.00 0.00 H new ATOM 967 N THR A 63 9.552 -3.931 5.244 1.00 0.00 N ATOM 968 CA THR A 63 8.242 -3.230 5.488 1.00 0.00 C ATOM 969 C THR A 63 7.856 -2.406 4.251 1.00 0.00 C ATOM 970 O THR A 63 6.702 -2.374 3.866 1.00 0.00 O ATOM 971 CB THR A 63 8.448 -2.315 6.715 1.00 0.00 C ATOM 972 OG1 THR A 63 8.797 -3.104 7.859 1.00 0.00 O ATOM 973 CG2 THR A 63 7.165 -1.519 6.996 1.00 0.00 C ATOM 0 H THR A 63 10.349 -3.567 5.766 1.00 0.00 H new ATOM 0 HA THR A 63 7.437 -3.941 5.673 1.00 0.00 H new ATOM 0 HB THR A 63 9.258 -1.617 6.506 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.928 -2.518 8.633 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.318 -0.876 7.863 1.00 0.00 H new ATOM 0 HG22 THR A 63 6.920 -0.906 6.129 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.345 -2.209 7.196 1.00 0.00 H new ATOM 981 N LEU A 64 8.806 -1.755 3.615 1.00 0.00 N ATOM 982 CA LEU A 64 8.456 -0.956 2.389 1.00 0.00 C ATOM 983 C LEU A 64 8.175 -1.917 1.227 1.00 0.00 C ATOM 984 O LEU A 64 7.241 -1.722 0.472 1.00 0.00 O ATOM 985 CB LEU A 64 9.664 -0.054 2.065 1.00 0.00 C ATOM 986 CG LEU A 64 10.058 0.771 3.306 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.420 0.303 3.828 1.00 0.00 C ATOM 988 CD2 LEU A 64 10.147 2.257 2.938 1.00 0.00 C ATOM 0 H LEU A 64 9.790 -1.740 3.884 1.00 0.00 H new ATOM 0 HA LEU A 64 7.568 -0.345 2.552 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.507 -0.665 1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.418 0.613 1.239 1.00 0.00 H new ATOM 0 HG LEU A 64 9.301 0.630 4.077 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.694 0.889 4.705 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.363 -0.751 4.099 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.173 0.438 3.052 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.426 2.834 3.820 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.899 2.395 2.161 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.179 2.600 2.571 1.00 0.00 H new ATOM 1000 N ALA A 65 8.955 -2.969 1.092 1.00 0.00 N ATOM 1001 CA ALA A 65 8.689 -3.951 -0.018 1.00 0.00 C ATOM 1002 C ALA A 65 7.362 -4.681 0.246 1.00 0.00 C ATOM 1003 O ALA A 65 6.638 -5.002 -0.678 1.00 0.00 O ATOM 1004 CB ALA A 65 9.858 -4.949 -0.022 1.00 0.00 C ATOM 0 H ALA A 65 9.751 -3.189 1.690 1.00 0.00 H new ATOM 0 HA ALA A 65 8.610 -3.449 -0.982 1.00 0.00 H new ATOM 0 HB1 ALA A 65 9.707 -5.683 -0.814 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.792 -4.415 -0.195 1.00 0.00 H new ATOM 0 HB3 ALA A 65 9.905 -5.458 0.941 1.00 0.00 H new ATOM 1010 N ASN A 66 7.030 -4.946 1.498 1.00 0.00 N ATOM 1011 CA ASN A 66 5.733 -5.657 1.789 1.00 0.00 C ATOM 1012 C ASN A 66 4.549 -4.836 1.258 1.00 0.00 C ATOM 1013 O ASN A 66 3.603 -5.391 0.731 1.00 0.00 O ATOM 1014 CB ASN A 66 5.633 -5.800 3.317 1.00 0.00 C ATOM 1015 CG ASN A 66 6.285 -7.118 3.752 1.00 0.00 C ATOM 1016 OD1 ASN A 66 6.170 -8.115 3.067 1.00 0.00 O ATOM 1017 ND2 ASN A 66 6.968 -7.173 4.870 1.00 0.00 N ATOM 0 H ASN A 66 7.590 -4.705 2.316 1.00 0.00 H new ATOM 0 HA ASN A 66 5.707 -6.632 1.303 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.127 -4.960 3.804 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.588 -5.779 3.627 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.400 -8.050 5.161 1.00 0.00 H new ATOM 0 HD22 ASN A 66 7.067 -6.339 5.448 1.00 0.00 H new ATOM 1024 N VAL A 67 4.588 -3.520 1.379 1.00 0.00 N ATOM 1025 CA VAL A 67 3.437 -2.703 0.850 1.00 0.00 C ATOM 1026 C VAL A 67 3.492 -2.671 -0.688 1.00 0.00 C ATOM 1027 O VAL A 67 2.470 -2.741 -1.344 1.00 0.00 O ATOM 1028 CB VAL A 67 3.581 -1.292 1.439 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.434 -0.410 0.940 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.525 -1.374 2.968 1.00 0.00 C ATOM 0 H VAL A 67 5.346 -2.990 1.809 1.00 0.00 H new ATOM 0 HA VAL A 67 2.476 -3.131 1.135 1.00 0.00 H new ATOM 0 HB VAL A 67 4.533 -0.863 1.127 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.537 0.591 1.358 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.465 -0.354 -0.148 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.482 -0.839 1.254 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.627 -0.374 3.390 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.571 -1.802 3.275 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.338 -2.005 3.329 1.00 0.00 H new ATOM 1040 N VAL A 68 4.671 -2.595 -1.274 1.00 0.00 N ATOM 1041 CA VAL A 68 4.747 -2.601 -2.778 1.00 0.00 C ATOM 1042 C VAL A 68 4.367 -4.001 -3.298 1.00 0.00 C ATOM 1043 O VAL A 68 3.760 -4.127 -4.346 1.00 0.00 O ATOM 1044 CB VAL A 68 6.199 -2.257 -3.155 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.350 -2.256 -4.679 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.550 -0.868 -2.614 1.00 0.00 C ATOM 0 H VAL A 68 5.566 -2.530 -0.788 1.00 0.00 H new ATOM 0 HA VAL A 68 4.061 -1.878 -3.220 1.00 0.00 H new ATOM 0 HB VAL A 68 6.868 -3.001 -2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.379 -2.012 -4.942 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.099 -3.242 -5.070 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.679 -1.513 -5.111 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.578 -0.623 -2.880 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.877 -0.128 -3.047 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.445 -0.863 -1.529 1.00 0.00 H new ATOM 1056 N GLN A 69 4.708 -5.058 -2.576 1.00 0.00 N ATOM 1057 CA GLN A 69 4.342 -6.438 -3.058 1.00 0.00 C ATOM 1058 C GLN A 69 2.814 -6.593 -3.084 1.00 0.00 C ATOM 1059 O GLN A 69 2.268 -7.161 -4.012 1.00 0.00 O ATOM 1060 CB GLN A 69 4.961 -7.438 -2.067 1.00 0.00 C ATOM 1061 CG GLN A 69 6.431 -7.664 -2.422 1.00 0.00 C ATOM 1062 CD GLN A 69 6.921 -8.964 -1.770 1.00 0.00 C ATOM 1063 OE1 GLN A 69 6.142 -9.867 -1.541 1.00 0.00 O ATOM 1064 NE2 GLN A 69 8.187 -9.101 -1.457 1.00 0.00 N ATOM 0 H GLN A 69 5.214 -5.024 -1.691 1.00 0.00 H new ATOM 0 HA GLN A 69 4.714 -6.613 -4.067 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.876 -7.057 -1.049 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.418 -8.383 -2.100 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.550 -7.720 -3.504 1.00 0.00 H new ATOM 0 HG3 GLN A 69 7.033 -6.823 -2.078 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.844 -8.345 -1.648 1.00 0.00 H new ATOM 0 HE22 GLN A 69 8.514 -9.964 -1.023 1.00 0.00 H new ATOM 1073 N THR A 70 2.117 -6.091 -2.084 1.00 0.00 N ATOM 1074 CA THR A 70 0.615 -6.225 -2.094 1.00 0.00 C ATOM 1075 C THR A 70 0.005 -5.353 -3.208 1.00 0.00 C ATOM 1076 O THR A 70 -1.021 -5.698 -3.764 1.00 0.00 O ATOM 1077 CB THR A 70 0.098 -5.800 -0.703 1.00 0.00 C ATOM 1078 OG1 THR A 70 -1.312 -5.969 -0.658 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.441 -4.336 -0.422 1.00 0.00 C ATOM 0 H THR A 70 2.511 -5.605 -1.278 1.00 0.00 H new ATOM 0 HA THR A 70 0.322 -7.255 -2.298 1.00 0.00 H new ATOM 0 HB THR A 70 0.576 -6.421 0.054 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.645 -5.702 0.224 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.067 -4.057 0.563 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.523 -4.204 -0.451 1.00 0.00 H new ATOM 0 HG23 THR A 70 -0.022 -3.702 -1.178 1.00 0.00 H new ATOM 1087 N ALA A 71 0.630 -4.244 -3.566 1.00 0.00 N ATOM 1088 CA ALA A 71 0.061 -3.400 -4.677 1.00 0.00 C ATOM 1089 C ALA A 71 0.257 -4.123 -6.022 1.00 0.00 C ATOM 1090 O ALA A 71 -0.585 -4.038 -6.898 1.00 0.00 O ATOM 1091 CB ALA A 71 0.826 -2.065 -4.675 1.00 0.00 C ATOM 0 H ALA A 71 1.491 -3.894 -3.146 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.006 -3.227 -4.533 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.441 -1.424 -5.468 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.693 -1.571 -3.713 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.887 -2.253 -4.842 1.00 0.00 H new ATOM 1097 N PHE A 72 1.350 -4.850 -6.193 1.00 0.00 N ATOM 1098 CA PHE A 72 1.557 -5.585 -7.491 1.00 0.00 C ATOM 1099 C PHE A 72 0.491 -6.679 -7.611 1.00 0.00 C ATOM 1100 O PHE A 72 -0.162 -6.805 -8.630 1.00 0.00 O ATOM 1101 CB PHE A 72 2.960 -6.213 -7.433 1.00 0.00 C ATOM 1102 CG PHE A 72 3.993 -5.211 -7.896 1.00 0.00 C ATOM 1103 CD1 PHE A 72 4.066 -3.946 -7.299 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.885 -5.553 -8.919 1.00 0.00 C ATOM 1105 CE1 PHE A 72 5.028 -3.026 -7.726 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.846 -4.630 -9.347 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.916 -3.367 -8.749 1.00 0.00 C ATOM 0 H PHE A 72 2.092 -4.963 -5.503 1.00 0.00 H new ATOM 0 HA PHE A 72 1.474 -4.921 -8.351 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.182 -6.533 -6.415 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.996 -7.102 -8.062 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.379 -3.681 -6.509 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.832 -6.529 -9.378 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.085 -2.051 -7.265 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.533 -4.892 -10.138 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.658 -2.655 -9.079 1.00 0.00 H new ATOM 1117 N PHE A 73 0.289 -7.462 -6.566 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.768 -8.533 -6.633 1.00 0.00 C ATOM 1119 C PHE A 73 -2.138 -7.872 -6.859 1.00 0.00 C ATOM 1120 O PHE A 73 -2.947 -8.364 -7.622 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.748 -9.267 -5.283 1.00 0.00 C ATOM 1122 CG PHE A 73 0.424 -10.219 -5.244 1.00 0.00 C ATOM 1123 CD1 PHE A 73 0.543 -11.224 -6.212 1.00 0.00 C ATOM 1124 CD2 PHE A 73 1.393 -10.094 -4.241 1.00 0.00 C ATOM 1125 CE1 PHE A 73 1.629 -12.106 -6.176 1.00 0.00 C ATOM 1126 CE2 PHE A 73 2.480 -10.977 -4.206 1.00 0.00 C ATOM 1127 CZ PHE A 73 2.598 -11.982 -5.173 1.00 0.00 C ATOM 0 H PHE A 73 0.801 -7.407 -5.686 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.583 -9.231 -7.450 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.673 -8.548 -4.467 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.680 -9.815 -5.141 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.204 -11.318 -6.987 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.303 -9.318 -3.495 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.720 -12.882 -6.922 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.228 -10.882 -3.432 1.00 0.00 H new ATOM 0 HZ PHE A 73 3.437 -12.662 -5.145 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.399 -6.748 -6.211 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.724 -6.058 -6.420 1.00 0.00 C ATOM 1139 C ALA A 74 -3.919 -5.735 -7.911 1.00 0.00 C ATOM 1140 O ALA A 74 -5.016 -5.828 -8.425 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.685 -4.759 -5.598 1.00 0.00 C ATOM 0 H ALA A 74 -1.764 -6.287 -5.559 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.551 -6.694 -6.105 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.627 -4.224 -5.719 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.536 -4.999 -4.545 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.864 -4.132 -5.947 1.00 0.00 H new ATOM 1147 N LEU A 75 -2.863 -5.363 -8.616 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.022 -5.047 -10.087 1.00 0.00 C ATOM 1149 C LEU A 75 -3.667 -6.240 -10.808 1.00 0.00 C ATOM 1150 O LEU A 75 -4.533 -6.067 -11.645 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.608 -4.785 -10.660 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.399 -3.283 -10.900 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.451 -2.749 -11.885 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.505 -2.532 -9.567 1.00 0.00 C ATOM 0 H LEU A 75 -1.917 -5.266 -8.247 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.661 -4.175 -10.229 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.853 -5.158 -9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.480 -5.331 -11.595 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.409 -3.126 -11.328 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.291 -1.683 -12.046 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.361 -3.277 -12.835 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.448 -2.908 -11.474 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.357 -1.466 -9.737 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.492 -2.696 -9.134 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.742 -2.899 -8.881 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.269 -7.450 -10.475 1.00 0.00 N ATOM 1167 CA GLU A 76 -3.894 -8.645 -11.139 1.00 0.00 C ATOM 1168 C GLU A 76 -5.317 -8.838 -10.594 1.00 0.00 C ATOM 1169 O GLU A 76 -6.233 -9.138 -11.338 1.00 0.00 O ATOM 1170 CB GLU A 76 -3.017 -9.859 -10.796 1.00 0.00 C ATOM 1171 CG GLU A 76 -3.254 -10.968 -11.823 1.00 0.00 C ATOM 1172 CD GLU A 76 -2.000 -11.837 -11.937 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -1.802 -12.673 -11.071 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -1.259 -11.648 -12.887 1.00 0.00 O ATOM 0 H GLU A 76 -2.550 -7.660 -9.783 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.958 -8.517 -12.220 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.966 -9.572 -10.792 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.253 -10.220 -9.795 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.106 -11.579 -11.524 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.497 -10.534 -12.793 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.515 -8.650 -9.305 1.00 0.00 N ATOM 1182 CA ALA A 77 -6.898 -8.808 -8.733 1.00 0.00 C ATOM 1183 C ALA A 77 -7.815 -7.690 -9.259 1.00 0.00 C ATOM 1184 O ALA A 77 -8.990 -7.914 -9.488 1.00 0.00 O ATOM 1185 CB ALA A 77 -6.763 -8.710 -7.205 1.00 0.00 C ATOM 0 H ALA A 77 -4.790 -8.398 -8.633 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.336 -9.763 -9.023 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.745 -8.819 -6.745 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.104 -9.501 -6.846 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.344 -7.740 -6.938 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.296 -6.492 -9.465 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.177 -5.387 -9.992 1.00 0.00 C ATOM 1193 C LEU A 78 -8.562 -5.686 -11.450 1.00 0.00 C ATOM 1194 O LEU A 78 -9.684 -5.449 -11.856 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.372 -4.068 -9.908 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.074 -3.093 -8.960 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -7.034 -2.191 -8.292 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -9.060 -2.232 -9.754 1.00 0.00 C ATOM 0 H LEU A 78 -6.323 -6.236 -9.295 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.093 -5.307 -9.407 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.361 -4.270 -9.554 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.280 -3.624 -10.899 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.612 -3.654 -8.196 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -7.534 -1.497 -7.617 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.331 -2.803 -7.727 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -6.495 -1.630 -9.055 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.561 -1.537 -9.080 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.521 -1.672 -10.518 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.801 -2.873 -10.230 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.645 -6.210 -12.244 1.00 0.00 N ATOM 1211 CA GLN A 79 -7.994 -6.521 -13.679 1.00 0.00 C ATOM 1212 C GLN A 79 -9.066 -7.623 -13.747 1.00 0.00 C ATOM 1213 O GLN A 79 -9.904 -7.615 -14.630 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.701 -6.999 -14.358 1.00 0.00 C ATOM 1215 CG GLN A 79 -5.859 -5.787 -14.763 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.483 -6.258 -15.249 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.377 -6.874 -16.290 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -3.414 -5.995 -14.537 1.00 0.00 N ATOM 0 H GLN A 79 -6.689 -6.432 -11.968 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.398 -5.640 -14.178 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -6.136 -7.637 -13.679 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -6.939 -7.599 -15.236 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.363 -5.228 -15.551 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.745 -5.111 -13.916 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -3.499 -5.478 -13.662 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -2.498 -6.308 -14.858 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.055 -8.572 -12.829 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.094 -9.663 -12.875 1.00 0.00 C ATOM 1229 C GLN A 80 -11.445 -9.126 -12.382 1.00 0.00 C ATOM 1230 O GLN A 80 -12.480 -9.444 -12.938 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.597 -10.787 -11.951 1.00 0.00 C ATOM 1232 CG GLN A 80 -8.651 -11.705 -12.729 1.00 0.00 C ATOM 1233 CD GLN A 80 -8.372 -12.968 -11.906 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -7.454 -12.992 -11.108 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -9.126 -14.030 -12.059 1.00 0.00 N ATOM 0 H GLN A 80 -8.384 -8.638 -12.063 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.235 -10.029 -13.892 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.082 -10.363 -11.089 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.443 -11.358 -11.568 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.095 -11.974 -13.688 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -7.718 -11.185 -12.944 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -9.897 -14.016 -12.726 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.941 -14.870 -11.511 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.448 -8.312 -11.348 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.736 -7.760 -10.833 1.00 0.00 C ATOM 1246 C GLY A 81 -12.889 -8.094 -9.343 1.00 0.00 C ATOM 1247 O GLY A 81 -13.640 -8.979 -8.978 1.00 0.00 O ATOM 0 H GLY A 81 -10.615 -8.010 -10.844 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.762 -6.680 -10.977 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.571 -8.177 -11.396 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.189 -7.393 -8.472 1.00 0.00 N ATOM 1252 CA GLU A 82 -12.309 -7.677 -7.011 1.00 0.00 C ATOM 1253 C GLU A 82 -12.848 -6.439 -6.277 1.00 0.00 C ATOM 1254 O GLU A 82 -13.096 -5.417 -6.888 1.00 0.00 O ATOM 1255 CB GLU A 82 -10.886 -8.000 -6.550 1.00 0.00 C ATOM 1256 CG GLU A 82 -10.601 -9.486 -6.779 1.00 0.00 C ATOM 1257 CD GLU A 82 -11.463 -10.323 -5.830 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -11.067 -10.485 -4.689 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -12.505 -10.788 -6.264 1.00 0.00 O ATOM 0 H GLU A 82 -11.544 -6.641 -8.715 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.997 -8.496 -6.803 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.167 -7.392 -7.099 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.770 -7.755 -5.494 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.816 -9.753 -7.814 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.545 -9.695 -6.608 1.00 0.00 H new ATOM 1266 N SER A 83 -13.033 -6.517 -4.973 1.00 0.00 N ATOM 1267 CA SER A 83 -13.557 -5.334 -4.224 1.00 0.00 C ATOM 1268 C SER A 83 -12.514 -4.830 -3.215 1.00 0.00 C ATOM 1269 O SER A 83 -11.906 -5.611 -2.507 1.00 0.00 O ATOM 1270 CB SER A 83 -14.799 -5.839 -3.491 1.00 0.00 C ATOM 1271 OG SER A 83 -15.864 -5.990 -4.420 1.00 0.00 O ATOM 0 H SER A 83 -12.844 -7.343 -4.405 1.00 0.00 H new ATOM 0 HA SER A 83 -13.784 -4.502 -4.890 1.00 0.00 H new ATOM 0 HB2 SER A 83 -14.587 -6.792 -3.006 1.00 0.00 H new ATOM 0 HB3 SER A 83 -15.082 -5.138 -2.706 1.00 0.00 H new ATOM 0 HG SER A 83 -16.662 -6.316 -3.953 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.310 -3.532 -3.134 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.308 -2.992 -2.152 1.00 0.00 C ATOM 1279 C ALA A 84 -12.007 -2.524 -0.859 1.00 0.00 C ATOM 1280 O ALA A 84 -11.447 -2.631 0.214 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.621 -1.808 -2.850 1.00 0.00 C ATOM 0 H ALA A 84 -12.788 -2.830 -3.699 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.588 -3.758 -1.864 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.878 -1.373 -2.181 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.131 -2.156 -3.759 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.366 -1.054 -3.105 1.00 0.00 H new ATOM 1287 N GLU A 85 -13.223 -2.006 -0.940 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.928 -1.536 0.313 1.00 0.00 C ATOM 1289 C GLU A 85 -13.944 -2.645 1.379 1.00 0.00 C ATOM 1290 O GLU A 85 -13.824 -2.373 2.559 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.367 -1.181 -0.094 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.998 -0.293 0.979 1.00 0.00 C ATOM 1293 CD GLU A 85 -15.688 1.174 0.675 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -14.519 1.522 0.663 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -16.625 1.925 0.459 1.00 0.00 O ATOM 0 H GLU A 85 -13.750 -1.890 -1.805 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.412 -0.677 0.742 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.368 -0.665 -1.054 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.955 -2.090 -0.220 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.076 -0.449 1.008 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -15.611 -0.561 1.962 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.087 -3.892 0.977 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.102 -5.006 1.996 1.00 0.00 C ATOM 1304 C ASN A 86 -12.799 -4.992 2.811 1.00 0.00 C ATOM 1305 O ASN A 86 -12.816 -5.207 4.009 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.225 -6.324 1.215 1.00 0.00 C ATOM 1307 CG ASN A 86 -15.686 -6.543 0.805 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.587 -6.269 1.573 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -15.967 -7.028 -0.381 1.00 0.00 N ATOM 0 H ASN A 86 -14.192 -4.186 0.006 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.932 -4.888 2.693 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.589 -6.295 0.330 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.880 -7.156 1.829 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -16.939 -7.174 -0.655 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.214 -7.259 -1.029 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.672 -4.729 2.181 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.381 -4.694 2.956 1.00 0.00 C ATOM 1318 C ILE A 87 -10.419 -3.541 3.976 1.00 0.00 C ATOM 1319 O ILE A 87 -9.907 -3.670 5.072 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.251 -4.477 1.930 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.219 -5.659 0.952 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.903 -4.387 2.650 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -8.773 -5.179 -0.435 1.00 0.00 C ATOM 0 H ILE A 87 -11.589 -4.540 1.182 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.222 -5.620 3.509 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.434 -3.550 1.388 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.536 -6.426 1.318 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.207 -6.116 0.888 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.109 -4.234 1.919 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.919 -3.551 3.349 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.720 -5.312 3.196 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -8.753 -6.024 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -9.472 -4.428 -0.802 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.776 -4.743 -0.366 1.00 0.00 H new ATOM 1335 N VAL A 88 -11.024 -2.414 3.636 1.00 0.00 N ATOM 1336 CA VAL A 88 -11.078 -1.274 4.623 1.00 0.00 C ATOM 1337 C VAL A 88 -11.811 -1.716 5.900 1.00 0.00 C ATOM 1338 O VAL A 88 -11.432 -1.335 6.992 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.835 -0.115 3.946 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.903 1.082 4.902 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -11.104 0.302 2.664 1.00 0.00 C ATOM 0 H VAL A 88 -11.473 -2.238 2.737 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.073 -0.960 4.906 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.844 -0.443 3.698 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.439 1.901 4.422 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.426 0.791 5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.893 1.406 5.152 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.642 1.122 2.188 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -10.093 0.627 2.911 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -11.056 -0.546 1.980 1.00 0.00 H new ATOM 1351 N SER A 89 -12.852 -2.521 5.783 1.00 0.00 N ATOM 1352 CA SER A 89 -13.584 -2.976 7.024 1.00 0.00 C ATOM 1353 C SER A 89 -12.599 -3.666 7.979 1.00 0.00 C ATOM 1354 O SER A 89 -12.629 -3.440 9.173 1.00 0.00 O ATOM 1355 CB SER A 89 -14.666 -3.967 6.567 1.00 0.00 C ATOM 1356 OG SER A 89 -15.730 -3.967 7.509 1.00 0.00 O ATOM 0 H SER A 89 -13.221 -2.877 4.901 1.00 0.00 H new ATOM 0 HA SER A 89 -14.032 -2.134 7.552 1.00 0.00 H new ATOM 0 HB2 SER A 89 -15.038 -3.688 5.581 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.244 -4.968 6.477 1.00 0.00 H new ATOM 0 HG SER A 89 -16.423 -4.597 7.220 1.00 0.00 H new ATOM 1362 N LYS A 90 -11.709 -4.488 7.458 1.00 0.00 N ATOM 1363 CA LYS A 90 -10.707 -5.161 8.358 1.00 0.00 C ATOM 1364 C LYS A 90 -9.703 -4.123 8.882 1.00 0.00 C ATOM 1365 O LYS A 90 -9.253 -4.215 10.010 1.00 0.00 O ATOM 1366 CB LYS A 90 -9.987 -6.223 7.510 1.00 0.00 C ATOM 1367 CG LYS A 90 -10.842 -7.490 7.446 1.00 0.00 C ATOM 1368 CD LYS A 90 -9.953 -8.690 7.115 1.00 0.00 C ATOM 1369 CE LYS A 90 -9.018 -8.974 8.293 1.00 0.00 C ATOM 1370 NZ LYS A 90 -8.821 -10.451 8.279 1.00 0.00 N ATOM 0 H LYS A 90 -11.633 -4.719 6.467 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.193 -5.621 9.218 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.808 -5.841 6.505 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.013 -6.450 7.943 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.346 -7.650 8.399 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.619 -7.380 6.689 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -10.568 -9.565 6.906 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.371 -8.488 6.216 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.070 -8.448 8.181 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.457 -8.643 9.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -8.190 -10.724 9.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -9.740 -10.925 8.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.396 -10.736 7.374 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.355 -3.125 8.089 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.388 -2.086 8.587 1.00 0.00 C ATOM 1386 C ILE A 91 -9.080 -1.204 9.634 1.00 0.00 C ATOM 1387 O ILE A 91 -8.482 -0.838 10.628 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.957 -1.249 7.365 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.286 -2.150 6.314 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.967 -0.167 7.804 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -6.092 -2.890 6.933 1.00 0.00 C ATOM 0 H ILE A 91 -9.693 -2.988 7.136 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.517 -2.542 9.058 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.842 -0.785 6.929 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -8.008 -2.869 5.927 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.952 -1.548 5.469 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.665 0.422 6.938 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.441 0.484 8.538 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.089 -0.636 8.248 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.626 -3.524 6.179 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.364 -2.165 7.298 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.437 -3.507 7.763 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.338 -0.864 9.431 1.00 0.00 N ATOM 1404 CA ARG A 92 -11.047 -0.009 10.447 1.00 0.00 C ATOM 1405 C ARG A 92 -11.153 -0.763 11.779 1.00 0.00 C ATOM 1406 O ARG A 92 -10.994 -0.178 12.835 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.446 0.291 9.887 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.961 1.607 10.475 1.00 0.00 C ATOM 1409 CD ARG A 92 -13.977 2.232 9.515 1.00 0.00 C ATOM 1410 NE ARG A 92 -13.773 3.702 9.644 1.00 0.00 N ATOM 1411 CZ ARG A 92 -14.730 4.453 10.117 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -14.851 4.622 11.405 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -15.564 5.038 9.301 1.00 0.00 N ATOM 0 H ARG A 92 -10.895 -1.136 8.621 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.502 0.917 10.630 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.407 0.357 8.800 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -13.130 -0.522 10.133 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -13.424 1.428 11.445 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.131 2.294 10.640 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.810 1.898 8.491 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -14.996 1.950 9.780 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.887 4.121 9.363 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -14.198 4.167 12.043 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -15.599 5.209 11.774 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.468 4.908 8.294 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.312 5.625 9.670 1.00 0.00 H new ATOM 1427 N MET A 93 -11.403 -2.057 11.746 1.00 0.00 N ATOM 1428 CA MET A 93 -11.492 -2.823 13.038 1.00 0.00 C ATOM 1429 C MET A 93 -10.086 -2.993 13.628 1.00 0.00 C ATOM 1430 O MET A 93 -9.895 -2.865 14.823 1.00 0.00 O ATOM 1431 CB MET A 93 -12.108 -4.192 12.706 1.00 0.00 C ATOM 1432 CG MET A 93 -12.779 -4.767 13.956 1.00 0.00 C ATOM 1433 SD MET A 93 -13.868 -6.133 13.481 1.00 0.00 S ATOM 1434 CE MET A 93 -12.983 -7.443 14.362 1.00 0.00 C ATOM 0 H MET A 93 -11.547 -2.606 10.899 1.00 0.00 H new ATOM 0 HA MET A 93 -12.104 -2.299 13.772 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.838 -4.089 11.903 1.00 0.00 H new ATOM 0 HB3 MET A 93 -11.336 -4.873 12.349 1.00 0.00 H new ATOM 0 HG2 MET A 93 -12.023 -5.118 14.659 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.351 -3.991 14.464 1.00 0.00 H new ATOM 0 HE1 MET A 93 -13.491 -8.395 14.205 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.962 -7.510 13.985 1.00 0.00 H new ATOM 0 HE3 MET A 93 -12.962 -7.215 15.428 1.00 0.00 H new ATOM 1444 N MET A 94 -9.097 -3.260 12.801 1.00 0.00 N ATOM 1445 CA MET A 94 -7.700 -3.409 13.338 1.00 0.00 C ATOM 1446 C MET A 94 -7.165 -2.038 13.778 1.00 0.00 C ATOM 1447 O MET A 94 -6.469 -1.937 14.772 1.00 0.00 O ATOM 1448 CB MET A 94 -6.840 -3.982 12.200 1.00 0.00 C ATOM 1449 CG MET A 94 -7.185 -5.457 11.991 1.00 0.00 C ATOM 1450 SD MET A 94 -5.884 -6.248 11.011 1.00 0.00 S ATOM 1451 CE MET A 94 -5.970 -7.878 11.794 1.00 0.00 C ATOM 0 H MET A 94 -9.193 -3.380 11.793 1.00 0.00 H new ATOM 0 HA MET A 94 -7.677 -4.070 14.204 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.015 -3.423 11.281 1.00 0.00 H new ATOM 0 HB3 MET A 94 -5.782 -3.876 12.441 1.00 0.00 H new ATOM 0 HG2 MET A 94 -7.285 -5.958 12.954 1.00 0.00 H new ATOM 0 HG3 MET A 94 -8.145 -5.549 11.482 1.00 0.00 H new ATOM 0 HE1 MET A 94 -5.237 -8.541 11.335 1.00 0.00 H new ATOM 0 HE2 MET A 94 -5.756 -7.782 12.858 1.00 0.00 H new ATOM 0 HE3 MET A 94 -6.969 -8.293 11.661 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.491 -0.978 13.061 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.992 0.379 13.481 1.00 0.00 C ATOM 1463 C ASN A 95 -7.699 0.813 14.775 1.00 0.00 C ATOM 1464 O ASN A 95 -7.092 1.427 15.633 1.00 0.00 O ATOM 1465 CB ASN A 95 -7.319 1.356 12.338 1.00 0.00 C ATOM 1466 CG ASN A 95 -6.150 1.389 11.344 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.870 0.329 10.625 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -5.480 2.396 11.219 1.00 0.00 N flip ATOM 0 H ASN A 95 -8.069 -0.993 12.221 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.919 0.362 13.673 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.233 1.047 11.831 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.499 2.354 12.738 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.694 3.223 11.776 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.704 2.413 10.557 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.969 0.491 14.934 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.681 0.892 16.200 1.00 0.00 C ATOM 1477 C ALA A 96 -9.099 0.115 17.389 1.00 0.00 C ATOM 1478 O ALA A 96 -8.924 0.662 18.461 1.00 0.00 O ATOM 1479 CB ALA A 96 -11.166 0.544 16.008 1.00 0.00 C ATOM 0 H ALA A 96 -9.533 -0.022 14.257 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.559 1.956 16.403 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.723 0.818 16.904 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.561 1.093 15.153 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.269 -0.527 15.830 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.788 -1.154 17.210 1.00 0.00 N ATOM 1486 CA GLN A 97 -8.205 -1.943 18.354 1.00 0.00 C ATOM 1487 C GLN A 97 -6.863 -1.328 18.781 1.00 0.00 C ATOM 1488 O GLN A 97 -6.558 -1.257 19.957 1.00 0.00 O ATOM 1489 CB GLN A 97 -7.993 -3.378 17.846 1.00 0.00 C ATOM 1490 CG GLN A 97 -9.347 -4.078 17.713 1.00 0.00 C ATOM 1491 CD GLN A 97 -9.187 -5.350 16.871 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -9.900 -5.543 15.908 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -8.274 -6.235 17.191 1.00 0.00 N ATOM 0 H GLN A 97 -8.909 -1.670 16.339 1.00 0.00 H new ATOM 0 HA GLN A 97 -8.870 -1.932 19.218 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.484 -3.362 16.882 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.353 -3.928 18.536 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -9.737 -4.329 18.700 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -10.070 -3.409 17.246 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -7.672 -6.077 17.999 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.165 -7.081 16.632 1.00 0.00 H new ATOM 1502 N SER A 98 -6.056 -0.880 17.839 1.00 0.00 N ATOM 1503 CA SER A 98 -4.730 -0.268 18.216 1.00 0.00 C ATOM 1504 C SER A 98 -4.938 0.930 19.158 1.00 0.00 C ATOM 1505 O SER A 98 -4.149 1.152 20.059 1.00 0.00 O ATOM 1506 CB SER A 98 -4.068 0.198 16.911 1.00 0.00 C ATOM 1507 OG SER A 98 -2.655 0.160 17.062 1.00 0.00 O ATOM 0 H SER A 98 -6.253 -0.910 16.839 1.00 0.00 H new ATOM 0 HA SER A 98 -4.105 -0.993 18.738 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.374 -0.444 16.085 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.392 1.209 16.666 1.00 0.00 H new ATOM 0 HG SER A 98 -2.229 0.455 16.230 1.00 0.00 H new ATOM 1513 N LEU A 99 -5.987 1.704 18.966 1.00 0.00 N ATOM 1514 CA LEU A 99 -6.219 2.883 19.869 1.00 0.00 C ATOM 1515 C LEU A 99 -7.189 2.509 21.001 1.00 0.00 C ATOM 1516 O LEU A 99 -7.004 2.911 22.134 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.824 3.986 18.981 1.00 0.00 C ATOM 1518 CG LEU A 99 -6.135 5.332 19.255 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -6.318 5.725 20.724 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -4.640 5.223 18.939 1.00 0.00 C ATOM 0 H LEU A 99 -6.684 1.572 18.233 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.293 3.215 20.339 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.710 3.719 17.930 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -7.893 4.072 19.174 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.586 6.095 18.620 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -5.826 6.680 20.909 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.381 5.815 20.947 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.877 4.960 21.363 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.156 6.180 19.135 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.191 4.454 19.567 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.508 4.958 17.890 1.00 0.00 H new ATOM 1532 N GLY A 100 -8.218 1.743 20.709 1.00 0.00 N ATOM 1533 CA GLY A 100 -9.188 1.350 21.774 1.00 0.00 C ATOM 1534 C GLY A 100 -10.397 2.296 21.743 1.00 0.00 C ATOM 1535 O GLY A 100 -10.397 3.325 22.393 1.00 0.00 O ATOM 0 H GLY A 100 -8.424 1.376 19.780 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.514 0.321 21.621 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -8.707 1.390 22.751 1.00 0.00 H new ATOM 1539 N GLN A 101 -11.429 1.959 20.995 1.00 0.00 N ATOM 1540 CA GLN A 101 -12.629 2.847 20.934 1.00 0.00 C ATOM 1541 C GLN A 101 -13.891 2.059 21.317 1.00 0.00 C ATOM 1542 O GLN A 101 -14.576 1.527 20.464 1.00 0.00 O ATOM 1543 CB GLN A 101 -12.707 3.308 19.479 1.00 0.00 C ATOM 1544 CG GLN A 101 -13.222 4.747 19.426 1.00 0.00 C ATOM 1545 CD GLN A 101 -12.706 5.431 18.154 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -12.149 6.509 18.218 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -12.864 4.850 16.989 1.00 0.00 N ATOM 0 H GLN A 101 -11.486 1.112 20.430 1.00 0.00 H new ATOM 0 HA GLN A 101 -12.557 3.687 21.624 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -11.723 3.245 19.013 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -13.370 2.652 18.914 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -14.312 4.755 19.439 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -12.889 5.296 20.307 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -13.331 3.945 16.930 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -12.520 5.303 16.142 1.00 0.00 H new ATOM 1556 N SER A 102 -14.210 1.974 22.597 1.00 0.00 N ATOM 1557 CA SER A 102 -15.432 1.218 23.032 1.00 0.00 C ATOM 1558 C SER A 102 -15.425 -0.209 22.454 1.00 0.00 C ATOM 1559 O SER A 102 -16.437 -0.691 21.980 1.00 0.00 O ATOM 1560 CB SER A 102 -16.620 2.013 22.485 1.00 0.00 C ATOM 1561 OG SER A 102 -16.934 3.067 23.386 1.00 0.00 O ATOM 0 H SER A 102 -13.674 2.397 23.355 1.00 0.00 H new ATOM 0 HA SER A 102 -15.477 1.116 24.116 1.00 0.00 H new ATOM 0 HB2 SER A 102 -16.380 2.419 21.502 1.00 0.00 H new ATOM 0 HB3 SER A 102 -17.483 1.359 22.358 1.00 0.00 H new ATOM 0 HG SER A 102 -17.693 3.579 23.038 1.00 0.00 H new ATOM 1567 N ASP A 103 -14.295 -0.887 22.486 1.00 0.00 N ATOM 1568 CA ASP A 103 -14.239 -2.275 21.937 1.00 0.00 C ATOM 1569 C ASP A 103 -13.576 -3.222 22.951 1.00 0.00 C ATOM 1570 O ASP A 103 -12.444 -3.635 22.770 1.00 0.00 O ATOM 1571 CB ASP A 103 -13.392 -2.163 20.667 1.00 0.00 C ATOM 1572 CG ASP A 103 -14.287 -1.777 19.488 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -15.018 -0.809 19.616 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -14.225 -2.457 18.477 1.00 0.00 O ATOM 0 H ASP A 103 -13.417 -0.536 22.868 1.00 0.00 H new ATOM 0 HA ASP A 103 -15.230 -2.679 21.731 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -12.610 -1.416 20.803 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -12.895 -3.111 20.464 1.00 0.00 H new ATOM 1579 N ILE A 104 -14.267 -3.571 24.019 1.00 0.00 N ATOM 1580 CA ILE A 104 -13.664 -4.488 25.032 1.00 0.00 C ATOM 1581 C ILE A 104 -14.738 -5.442 25.589 1.00 0.00 C ATOM 1582 O ILE A 104 -15.879 -5.057 25.764 1.00 0.00 O ATOM 1583 CB ILE A 104 -13.121 -3.565 26.132 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -12.469 -4.408 27.232 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -14.261 -2.737 26.733 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -11.478 -3.546 28.017 1.00 0.00 C ATOM 0 H ILE A 104 -15.216 -3.259 24.226 1.00 0.00 H new ATOM 0 HA ILE A 104 -12.878 -5.115 24.611 1.00 0.00 H new ATOM 0 HB ILE A 104 -12.381 -2.892 25.698 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -13.232 -4.804 27.902 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -11.955 -5.263 26.793 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -13.866 -2.085 27.512 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -14.721 -2.131 25.952 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -15.008 -3.404 27.162 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -11.014 -4.146 28.800 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -10.708 -3.171 27.343 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -12.005 -2.705 28.469 1.00 0.00 H new ATOM 1598 N ALA A 105 -14.384 -6.681 25.870 1.00 0.00 N ATOM 1599 CA ALA A 105 -15.391 -7.642 26.412 1.00 0.00 C ATOM 1600 C ALA A 105 -14.745 -8.547 27.466 1.00 0.00 C ATOM 1601 O ALA A 105 -15.217 -9.659 27.632 1.00 0.00 O ATOM 1602 CB ALA A 105 -15.842 -8.464 25.204 1.00 0.00 C ATOM 1603 OXT ALA A 105 -13.791 -8.110 28.088 1.00 0.00 O ATOM 0 H ALA A 105 -13.445 -7.060 25.746 1.00 0.00 H new ATOM 0 HA ALA A 105 -16.226 -7.136 26.897 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -16.585 -9.196 25.519 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -16.279 -7.802 24.456 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -14.984 -8.980 24.774 1.00 0.00 H new TER 1609 ALA A 105