USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=21 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 Set 1.1: A 60 SER OG : rot 180:sc= 0.149 USER MOD Set 1.2: A 63 THR OG1 : rot 100:sc= 0.0939 USER MOD Set 2.1: A 44 THR OG1 : rot -130:sc= 1.19 USER MOD Set 2.2: A 47 SER OG : rot -107:sc= 0.347! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 130:sc= 0.0768 (180deg=0) USER MOD Single : A 2 SER OG : rot 32:sc= 0.265 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 6 TYR OH : rot 110:sc= -0.735 USER MOD Single : A 7 THR OG1 : rot 76:sc= -1.04! USER MOD Single : A 9 ASN :FLIP amide:sc= -0.199 F(o=-0.92,f=-0.2) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ -170:sc= -0.0192 (180deg=-0.182) USER MOD Single : A 23 ASN : amide:sc= -0.0972 K(o=-0.097,f=-0.83) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) 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 155:sc= -4.44! USER MOD Single : A 41 ASN : amide:sc= 0.55 K(o=0.55,f=-0.097) USER MOD Single : A 54 SER OG : rot -73:sc= 0.383 USER MOD Single : A 58 SER OG : rot 180:sc= -0.14 USER MOD Single : A 66 ASN : amide:sc= -0.134 K(o=-0.13,f=-2.3!) USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0.037 X(o=0.037,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= -0.0652 K(o=-0.065,f=-1.1) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.24) 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 F(o=-1.2,f=0) USER MOD Single : A 97 GLN : amide:sc= -0.261 K(o=-0.26,f=-1) USER MOD Single : A 98 SER OG : rot -55:sc= 0.951 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 -3.886 7.047 -21.542 1.00 0.00 N ATOM 2 CA MET A 1 -5.029 6.315 -20.926 1.00 0.00 C ATOM 3 C MET A 1 -5.171 6.701 -19.445 1.00 0.00 C ATOM 4 O MET A 1 -4.233 7.181 -18.837 1.00 0.00 O ATOM 5 CB MET A 1 -4.669 4.834 -21.062 1.00 0.00 C ATOM 6 CG MET A 1 -5.174 4.308 -22.407 1.00 0.00 C ATOM 7 SD MET A 1 -5.215 2.498 -22.369 1.00 0.00 S ATOM 8 CE MET A 1 -4.849 2.226 -24.120 1.00 0.00 C ATOM 0 H1 MET A 1 -3.274 6.374 -22.046 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.248 7.755 -22.212 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.337 7.523 -20.798 1.00 0.00 H new ATOM 0 HA MET A 1 -5.978 6.550 -21.407 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.589 4.703 -20.990 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.114 4.264 -20.246 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.170 4.701 -22.613 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.523 4.651 -23.211 1.00 0.00 H new ATOM 0 HE1 MET A 1 -4.825 1.156 -24.325 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.621 2.695 -24.730 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.880 2.663 -24.361 1.00 0.00 H new ATOM 20 N SER A 2 -6.334 6.498 -18.859 1.00 0.00 N ATOM 21 CA SER A 2 -6.520 6.858 -17.420 1.00 0.00 C ATOM 22 C SER A 2 -6.828 5.599 -16.594 1.00 0.00 C ATOM 23 O SER A 2 -7.634 4.780 -16.991 1.00 0.00 O ATOM 24 CB SER A 2 -7.712 7.815 -17.403 1.00 0.00 C ATOM 25 OG SER A 2 -8.826 7.187 -18.024 1.00 0.00 O ATOM 0 H SER A 2 -7.155 6.101 -19.316 1.00 0.00 H new ATOM 0 HA SER A 2 -5.627 7.311 -16.988 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.959 8.089 -16.377 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.461 8.737 -17.927 1.00 0.00 H new ATOM 0 HG SER A 2 -8.786 6.221 -17.867 1.00 0.00 H new ATOM 31 N GLN A 3 -6.195 5.437 -15.449 1.00 0.00 N ATOM 32 CA GLN A 3 -6.462 4.227 -14.613 1.00 0.00 C ATOM 33 C GLN A 3 -6.820 4.638 -13.176 1.00 0.00 C ATOM 34 O GLN A 3 -6.401 3.999 -12.229 1.00 0.00 O ATOM 35 CB GLN A 3 -5.155 3.435 -14.634 1.00 0.00 C ATOM 36 CG GLN A 3 -4.956 2.811 -16.017 1.00 0.00 C ATOM 37 CD GLN A 3 -5.735 1.493 -16.101 1.00 0.00 C ATOM 38 OE1 GLN A 3 -5.256 0.467 -15.662 1.00 0.00 O ATOM 39 NE2 GLN A 3 -6.927 1.472 -16.648 1.00 0.00 N ATOM 0 H GLN A 3 -5.511 6.089 -15.064 1.00 0.00 H new ATOM 0 HA GLN A 3 -7.300 3.642 -14.992 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -4.317 4.090 -14.395 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -5.178 2.656 -13.872 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -5.299 3.498 -16.790 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.896 2.631 -16.197 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -7.334 2.331 -17.018 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -7.447 0.596 -16.703 1.00 0.00 H new ATOM 48 N GLU A 4 -7.593 5.692 -13.000 1.00 0.00 N ATOM 49 CA GLU A 4 -7.965 6.114 -11.601 1.00 0.00 C ATOM 50 C GLU A 4 -8.787 5.006 -10.928 1.00 0.00 C ATOM 51 O GLU A 4 -8.599 4.719 -9.761 1.00 0.00 O ATOM 52 CB GLU A 4 -8.801 7.398 -11.726 1.00 0.00 C ATOM 53 CG GLU A 4 -8.729 8.184 -10.415 1.00 0.00 C ATOM 54 CD GLU A 4 -7.350 8.834 -10.284 1.00 0.00 C ATOM 55 OE1 GLU A 4 -6.865 9.352 -11.276 1.00 0.00 O ATOM 56 OE2 GLU A 4 -6.805 8.803 -9.193 1.00 0.00 O ATOM 0 H GLU A 4 -7.977 6.269 -13.748 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.078 6.291 -10.993 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.429 8.008 -12.549 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.837 7.149 -11.957 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.506 8.948 -10.394 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.911 7.520 -9.570 1.00 0.00 H new ATOM 63 N GLN A 5 -9.691 4.368 -11.651 1.00 0.00 N ATOM 64 CA GLN A 5 -10.506 3.263 -11.018 1.00 0.00 C ATOM 65 C GLN A 5 -9.564 2.209 -10.408 1.00 0.00 C ATOM 66 O GLN A 5 -9.822 1.693 -9.336 1.00 0.00 O ATOM 67 CB GLN A 5 -11.391 2.650 -12.126 1.00 0.00 C ATOM 68 CG GLN A 5 -10.524 1.992 -13.207 1.00 0.00 C ATOM 69 CD GLN A 5 -11.383 1.701 -14.443 1.00 0.00 C ATOM 70 OE1 GLN A 5 -12.532 1.324 -14.318 1.00 0.00 O ATOM 71 NE2 GLN A 5 -10.880 1.858 -15.643 1.00 0.00 N ATOM 0 H GLN A 5 -9.898 4.558 -12.632 1.00 0.00 H new ATOM 0 HA GLN A 5 -11.135 3.644 -10.213 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -12.065 1.911 -11.693 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -12.013 3.426 -12.573 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.695 2.648 -13.473 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -10.089 1.067 -12.827 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -9.917 2.174 -15.755 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -11.452 1.664 -16.465 1.00 0.00 H new ATOM 80 N TYR A 6 -8.454 1.921 -11.058 1.00 0.00 N ATOM 81 CA TYR A 6 -7.484 0.938 -10.468 1.00 0.00 C ATOM 82 C TYR A 6 -6.751 1.620 -9.303 1.00 0.00 C ATOM 83 O TYR A 6 -6.490 1.009 -8.285 1.00 0.00 O ATOM 84 CB TYR A 6 -6.487 0.568 -11.578 1.00 0.00 C ATOM 85 CG TYR A 6 -7.060 -0.535 -12.434 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.989 -0.233 -13.436 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.659 -1.860 -12.228 1.00 0.00 C ATOM 88 CE1 TYR A 6 -8.517 -1.255 -14.233 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.188 -2.883 -13.023 1.00 0.00 C ATOM 90 CZ TYR A 6 -8.118 -2.581 -14.026 1.00 0.00 C ATOM 91 OH TYR A 6 -8.638 -3.589 -14.811 1.00 0.00 O ATOM 0 H TYR A 6 -8.182 2.318 -11.957 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.984 0.044 -10.096 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -6.272 1.442 -12.192 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.543 0.246 -11.139 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -8.299 0.789 -13.594 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -5.941 -2.093 -11.455 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -9.232 -1.021 -15.008 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -6.879 -3.905 -12.863 1.00 0.00 H new ATOM 0 HH TYR A 6 -7.940 -3.933 -15.407 1.00 0.00 H new ATOM 101 N THR A 7 -6.425 2.892 -9.444 1.00 0.00 N ATOM 102 CA THR A 7 -5.718 3.615 -8.331 1.00 0.00 C ATOM 103 C THR A 7 -6.629 3.685 -7.097 1.00 0.00 C ATOM 104 O THR A 7 -6.175 3.507 -5.982 1.00 0.00 O ATOM 105 CB THR A 7 -5.422 5.033 -8.859 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.587 4.942 -10.005 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.723 5.873 -7.786 1.00 0.00 C ATOM 0 H THR A 7 -6.617 3.454 -10.274 1.00 0.00 H new ATOM 0 HA THR A 7 -4.801 3.105 -8.037 1.00 0.00 H new ATOM 0 HB THR A 7 -6.364 5.514 -9.121 1.00 0.00 H new ATOM 0 HG1 THR A 7 -5.119 4.652 -10.775 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.523 6.870 -8.178 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.365 5.950 -6.909 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.783 5.397 -7.507 1.00 0.00 H new ATOM 115 N GLU A 8 -7.907 3.944 -7.282 1.00 0.00 N ATOM 116 CA GLU A 8 -8.824 4.021 -6.089 1.00 0.00 C ATOM 117 C GLU A 8 -8.928 2.645 -5.428 1.00 0.00 C ATOM 118 O GLU A 8 -8.893 2.535 -4.215 1.00 0.00 O ATOM 119 CB GLU A 8 -10.198 4.476 -6.604 1.00 0.00 C ATOM 120 CG GLU A 8 -10.962 5.173 -5.476 1.00 0.00 C ATOM 121 CD GLU A 8 -12.414 5.393 -5.903 1.00 0.00 C ATOM 122 OE1 GLU A 8 -13.003 4.465 -6.433 1.00 0.00 O ATOM 123 OE2 GLU A 8 -12.914 6.486 -5.692 1.00 0.00 O ATOM 0 H GLU A 8 -8.349 4.103 -8.187 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.445 4.722 -5.345 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -10.075 5.155 -7.448 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.765 3.618 -6.965 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -10.926 4.568 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -10.492 6.128 -5.240 1.00 0.00 H new ATOM 130 N ASN A 9 -9.030 1.590 -6.206 1.00 0.00 N ATOM 131 CA ASN A 9 -9.103 0.223 -5.586 1.00 0.00 C ATOM 132 C ASN A 9 -7.707 -0.174 -5.099 1.00 0.00 C ATOM 133 O ASN A 9 -7.555 -0.721 -4.022 1.00 0.00 O ATOM 134 CB ASN A 9 -9.594 -0.741 -6.677 1.00 0.00 C ATOM 135 CG ASN A 9 -11.051 -0.415 -7.031 1.00 0.00 C ATOM 136 OD1 ASN A 9 -12.014 -1.212 -6.637 1.00 0.00 O flip ATOM 137 ND2 ASN A 9 -11.318 0.580 -7.675 1.00 0.00 N flip ATOM 0 H ASN A 9 -9.065 1.613 -7.225 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.782 0.199 -4.734 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.965 -0.655 -7.563 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.515 -1.771 -6.329 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -10.572 1.203 -7.984 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.288 0.792 -7.907 1.00 0.00 H new ATOM 144 N LEU A 10 -6.679 0.120 -5.870 1.00 0.00 N ATOM 145 CA LEU A 10 -5.290 -0.222 -5.413 1.00 0.00 C ATOM 146 C LEU A 10 -4.940 0.622 -4.179 1.00 0.00 C ATOM 147 O LEU A 10 -4.303 0.143 -3.261 1.00 0.00 O ATOM 148 CB LEU A 10 -4.340 0.106 -6.576 1.00 0.00 C ATOM 149 CG LEU A 10 -2.917 -0.327 -6.214 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.866 -1.848 -6.050 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.957 0.097 -7.329 1.00 0.00 C ATOM 0 H LEU A 10 -6.741 0.575 -6.781 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.206 -1.274 -5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.667 -0.405 -7.481 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.363 1.175 -6.787 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.623 0.147 -5.277 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.852 -2.152 -5.792 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.549 -2.151 -5.256 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.162 -2.325 -6.985 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.943 -0.211 -7.073 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.254 -0.376 -8.265 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.989 1.180 -7.444 1.00 0.00 H new ATOM 163 N LYS A 11 -5.363 1.875 -4.135 1.00 0.00 N ATOM 164 CA LYS A 11 -5.047 2.724 -2.928 1.00 0.00 C ATOM 165 C LYS A 11 -5.575 2.050 -1.650 1.00 0.00 C ATOM 166 O LYS A 11 -4.962 2.148 -0.602 1.00 0.00 O ATOM 167 CB LYS A 11 -5.744 4.078 -3.138 1.00 0.00 C ATOM 168 CG LYS A 11 -5.331 5.043 -2.025 1.00 0.00 C ATOM 169 CD LYS A 11 -6.349 4.973 -0.885 1.00 0.00 C ATOM 170 CE LYS A 11 -6.348 6.296 -0.117 1.00 0.00 C ATOM 171 NZ LYS A 11 -7.770 6.522 0.265 1.00 0.00 N ATOM 0 H LYS A 11 -5.902 2.337 -4.867 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.970 2.852 -2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.475 4.491 -4.110 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.826 3.946 -3.137 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.338 4.786 -1.656 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.273 6.060 -2.413 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -7.344 4.772 -1.283 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.103 4.150 -0.214 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.707 6.241 0.763 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.971 7.111 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.849 7.413 0.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -8.355 6.577 -0.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.099 5.734 0.859 1.00 0.00 H new ATOM 185 N VAL A 12 -6.696 1.358 -1.722 1.00 0.00 N ATOM 186 CA VAL A 12 -7.226 0.677 -0.489 1.00 0.00 C ATOM 187 C VAL A 12 -6.370 -0.558 -0.175 1.00 0.00 C ATOM 188 O VAL A 12 -6.049 -0.816 0.970 1.00 0.00 O ATOM 189 CB VAL A 12 -8.674 0.267 -0.801 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.281 -0.453 0.405 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.500 1.516 -1.115 1.00 0.00 C ATOM 0 H VAL A 12 -7.257 1.237 -2.565 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.192 1.334 0.380 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.680 -0.403 -1.661 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.307 -0.741 0.178 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.695 -1.344 0.629 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.274 0.213 1.268 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.527 1.227 -1.337 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.489 2.185 -0.255 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.073 2.027 -1.978 1.00 0.00 H new ATOM 201 N ILE A 13 -5.990 -1.317 -1.181 1.00 0.00 N ATOM 202 CA ILE A 13 -5.140 -2.531 -0.913 1.00 0.00 C ATOM 203 C ILE A 13 -3.716 -2.107 -0.514 1.00 0.00 C ATOM 204 O ILE A 13 -3.068 -2.787 0.258 1.00 0.00 O ATOM 205 CB ILE A 13 -5.132 -3.361 -2.210 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.573 -3.761 -2.565 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.284 -4.622 -2.011 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.809 -3.586 -4.068 1.00 0.00 C ATOM 0 H ILE A 13 -6.226 -1.154 -2.160 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.538 -3.120 -0.087 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.707 -2.767 -3.019 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.753 -4.797 -2.278 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.278 -3.148 -2.004 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.281 -5.207 -2.931 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.263 -4.337 -1.758 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.705 -5.220 -1.202 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.832 -3.872 -4.311 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.648 -2.543 -4.343 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.115 -4.218 -4.621 1.00 0.00 H new ATOM 220 N VAL A 14 -3.226 -0.984 -1.001 1.00 0.00 N ATOM 221 CA VAL A 14 -1.852 -0.543 -0.584 1.00 0.00 C ATOM 222 C VAL A 14 -1.950 0.125 0.797 1.00 0.00 C ATOM 223 O VAL A 14 -1.098 -0.072 1.643 1.00 0.00 O ATOM 224 CB VAL A 14 -1.362 0.453 -1.650 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.014 1.048 -1.231 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.193 -0.282 -2.980 1.00 0.00 C ATOM 0 H VAL A 14 -3.707 -0.367 -1.655 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.154 -1.377 -0.508 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.092 1.256 -1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.325 1.752 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.126 1.568 -0.279 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.719 0.248 -1.124 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.846 0.417 -3.741 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.463 -1.083 -2.863 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.150 -0.705 -3.286 1.00 0.00 H new ATOM 236 N ALA A 15 -2.991 0.901 1.042 1.00 0.00 N ATOM 237 CA ALA A 15 -3.126 1.551 2.390 1.00 0.00 C ATOM 238 C ALA A 15 -3.326 0.474 3.471 1.00 0.00 C ATOM 239 O ALA A 15 -2.842 0.619 4.578 1.00 0.00 O ATOM 240 CB ALA A 15 -4.356 2.472 2.323 1.00 0.00 C ATOM 0 H ALA A 15 -3.738 1.107 0.379 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.231 2.119 2.644 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.493 2.967 3.285 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.207 3.222 1.547 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.241 1.880 2.090 1.00 0.00 H new ATOM 246 N GLU A 16 -4.022 -0.614 3.167 1.00 0.00 N ATOM 247 CA GLU A 16 -4.213 -1.682 4.215 1.00 0.00 C ATOM 248 C GLU A 16 -2.846 -2.208 4.711 1.00 0.00 C ATOM 249 O GLU A 16 -2.741 -2.684 5.826 1.00 0.00 O ATOM 250 CB GLU A 16 -5.065 -2.807 3.577 1.00 0.00 C ATOM 251 CG GLU A 16 -4.246 -3.629 2.569 1.00 0.00 C ATOM 252 CD GLU A 16 -4.081 -5.066 3.078 1.00 0.00 C ATOM 253 OE1 GLU A 16 -5.061 -5.624 3.543 1.00 0.00 O ATOM 254 OE2 GLU A 16 -2.978 -5.580 2.992 1.00 0.00 O ATOM 0 H GLU A 16 -4.454 -0.802 2.262 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.726 -1.283 5.090 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.447 -3.464 4.359 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.929 -2.371 3.076 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.744 -3.632 1.600 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.268 -3.171 2.423 1.00 0.00 H new ATOM 261 N LYS A 17 -1.792 -2.113 3.912 1.00 0.00 N ATOM 262 CA LYS A 17 -0.452 -2.600 4.391 1.00 0.00 C ATOM 263 C LYS A 17 0.212 -1.486 5.217 1.00 0.00 C ATOM 264 O LYS A 17 0.595 -1.699 6.351 1.00 0.00 O ATOM 265 CB LYS A 17 0.376 -2.925 3.136 1.00 0.00 C ATOM 266 CG LYS A 17 1.038 -4.298 3.291 1.00 0.00 C ATOM 267 CD LYS A 17 2.038 -4.260 4.450 1.00 0.00 C ATOM 268 CE LYS A 17 2.019 -5.600 5.189 1.00 0.00 C ATOM 269 NZ LYS A 17 0.872 -5.503 6.132 1.00 0.00 N ATOM 0 H LYS A 17 -1.806 -1.726 2.968 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.536 -3.485 5.022 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.265 -2.918 2.254 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.137 -2.160 2.983 1.00 0.00 H new ATOM 0 HG2 LYS A 17 0.280 -5.059 3.477 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.547 -4.574 2.367 1.00 0.00 H new ATOM 0 HD2 LYS A 17 3.040 -4.056 4.072 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.785 -3.451 5.136 1.00 0.00 H new ATOM 0 HE2 LYS A 17 1.891 -6.431 4.496 1.00 0.00 H new ATOM 0 HE3 LYS A 17 2.955 -5.770 5.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 0.895 -6.308 6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 0.938 -4.615 6.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -0.020 -5.518 5.597 1.00 0.00 H new ATOM 283 N LEU A 18 0.327 -0.286 4.670 1.00 0.00 N ATOM 284 CA LEU A 18 0.946 0.844 5.461 1.00 0.00 C ATOM 285 C LEU A 18 0.178 1.025 6.782 1.00 0.00 C ATOM 286 O LEU A 18 0.769 1.221 7.828 1.00 0.00 O ATOM 287 CB LEU A 18 0.798 2.114 4.594 1.00 0.00 C ATOM 288 CG LEU A 18 2.021 2.361 3.677 1.00 0.00 C ATOM 289 CD1 LEU A 18 2.739 1.058 3.294 1.00 0.00 C ATOM 290 CD2 LEU A 18 1.535 3.051 2.399 1.00 0.00 C ATOM 0 H LEU A 18 0.025 -0.043 3.727 1.00 0.00 H new ATOM 0 HA LEU A 18 1.991 0.644 5.696 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.099 2.027 3.980 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.657 2.978 5.244 1.00 0.00 H new ATOM 0 HG LEU A 18 2.732 2.980 4.223 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.589 1.286 2.651 1.00 0.00 H new ATOM 0 HD12 LEU A 18 3.091 0.558 4.196 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.047 0.404 2.763 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.383 3.234 1.739 1.00 0.00 H new ATOM 0 HD22 LEU A 18 0.812 2.411 1.892 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.063 4.000 2.655 1.00 0.00 H new ATOM 302 N ALA A 19 -1.139 0.941 6.744 1.00 0.00 N ATOM 303 CA ALA A 19 -1.936 1.088 8.013 1.00 0.00 C ATOM 304 C ALA A 19 -1.739 -0.152 8.906 1.00 0.00 C ATOM 305 O ALA A 19 -1.837 -0.063 10.115 1.00 0.00 O ATOM 306 CB ALA A 19 -3.412 1.205 7.595 1.00 0.00 C ATOM 0 H ALA A 19 -1.689 0.779 5.900 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.616 1.963 8.579 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.034 1.314 8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.540 2.076 6.953 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.709 0.308 7.052 1.00 0.00 H new ATOM 312 N GLY A 20 -1.465 -1.313 8.329 1.00 0.00 N ATOM 313 CA GLY A 20 -1.273 -2.538 9.161 1.00 0.00 C ATOM 314 C GLY A 20 0.184 -2.633 9.649 1.00 0.00 C ATOM 315 O GLY A 20 0.437 -3.123 10.732 1.00 0.00 O ATOM 0 H GLY A 20 -1.369 -1.453 7.323 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -1.949 -2.514 10.016 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.527 -3.424 8.579 1.00 0.00 H new ATOM 319 N ILE A 21 1.151 -2.180 8.863 1.00 0.00 N ATOM 320 CA ILE A 21 2.595 -2.270 9.315 1.00 0.00 C ATOM 321 C ILE A 21 2.750 -1.669 10.737 1.00 0.00 C ATOM 322 O ILE A 21 2.329 -0.555 10.975 1.00 0.00 O ATOM 323 CB ILE A 21 3.416 -1.472 8.274 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.423 -2.249 6.953 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.862 -1.283 8.748 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.582 -1.287 5.770 1.00 0.00 C ATOM 0 H ILE A 21 1.008 -1.759 7.945 1.00 0.00 H new ATOM 0 HA ILE A 21 2.941 -3.302 9.373 1.00 0.00 H new ATOM 0 HB ILE A 21 2.961 -0.490 8.143 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.238 -2.973 6.954 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.496 -2.813 6.850 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.419 -0.719 8.000 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.867 -0.737 9.692 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.329 -2.258 8.890 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.585 -1.853 4.839 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.752 -0.580 5.762 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.522 -0.743 5.867 1.00 0.00 H new ATOM 338 N PRO A 22 3.341 -2.431 11.642 1.00 0.00 N ATOM 339 CA PRO A 22 3.524 -1.943 13.037 1.00 0.00 C ATOM 340 C PRO A 22 4.589 -0.829 13.131 1.00 0.00 C ATOM 341 O PRO A 22 4.615 -0.092 14.099 1.00 0.00 O ATOM 342 CB PRO A 22 3.979 -3.184 13.798 1.00 0.00 C ATOM 343 CG PRO A 22 4.600 -4.067 12.767 1.00 0.00 C ATOM 344 CD PRO A 22 3.890 -3.788 11.468 1.00 0.00 C ATOM 0 HA PRO A 22 2.611 -1.500 13.435 1.00 0.00 H new ATOM 0 HB2 PRO A 22 4.694 -2.927 14.579 1.00 0.00 H new ATOM 0 HB3 PRO A 22 3.138 -3.678 14.285 1.00 0.00 H new ATOM 0 HG2 PRO A 22 5.667 -3.863 12.676 1.00 0.00 H new ATOM 0 HG3 PRO A 22 4.499 -5.116 13.045 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.575 -3.835 10.621 1.00 0.00 H new ATOM 0 HD3 PRO A 22 3.101 -4.516 11.281 1.00 0.00 H new ATOM 352 N ASN A 23 5.463 -0.685 12.150 1.00 0.00 N ATOM 353 CA ASN A 23 6.496 0.400 12.230 1.00 0.00 C ATOM 354 C ASN A 23 6.109 1.582 11.323 1.00 0.00 C ATOM 355 O ASN A 23 6.968 2.257 10.787 1.00 0.00 O ATOM 356 CB ASN A 23 7.805 -0.239 11.749 1.00 0.00 C ATOM 357 CG ASN A 23 8.994 0.571 12.282 1.00 0.00 C ATOM 358 OD1 ASN A 23 9.442 1.500 11.642 1.00 0.00 O ATOM 359 ND2 ASN A 23 9.532 0.258 13.437 1.00 0.00 N ATOM 0 H ASN A 23 5.502 -1.265 11.312 1.00 0.00 H new ATOM 0 HA ASN A 23 6.588 0.794 13.242 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.868 -1.270 12.097 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.830 -0.268 10.660 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.323 0.794 13.793 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.159 -0.522 13.979 1.00 0.00 H new ATOM 366 N PHE A 24 4.828 1.846 11.151 1.00 0.00 N ATOM 367 CA PHE A 24 4.406 2.989 10.287 1.00 0.00 C ATOM 368 C PHE A 24 3.597 3.997 11.121 1.00 0.00 C ATOM 369 O PHE A 24 2.446 3.759 11.434 1.00 0.00 O ATOM 370 CB PHE A 24 3.530 2.362 9.193 1.00 0.00 C ATOM 371 CG PHE A 24 3.978 2.852 7.835 1.00 0.00 C ATOM 372 CD1 PHE A 24 3.510 4.075 7.343 1.00 0.00 C ATOM 373 CD2 PHE A 24 4.862 2.081 7.070 1.00 0.00 C ATOM 374 CE1 PHE A 24 3.925 4.529 6.085 1.00 0.00 C ATOM 375 CE2 PHE A 24 5.278 2.535 5.813 1.00 0.00 C ATOM 376 CZ PHE A 24 4.809 3.759 5.321 1.00 0.00 C ATOM 0 H PHE A 24 4.064 1.317 11.573 1.00 0.00 H new ATOM 0 HA PHE A 24 5.253 3.528 9.862 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.598 1.275 9.238 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.485 2.623 9.357 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.828 4.669 7.934 1.00 0.00 H new ATOM 0 HD2 PHE A 24 5.223 1.136 7.450 1.00 0.00 H new ATOM 0 HE1 PHE A 24 3.563 5.473 5.705 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.960 1.941 5.223 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.130 4.109 4.351 1.00 0.00 H new ATOM 386 N ASN A 25 4.188 5.118 11.487 1.00 0.00 N ATOM 387 CA ASN A 25 3.437 6.124 12.304 1.00 0.00 C ATOM 388 C ASN A 25 3.116 7.364 11.456 1.00 0.00 C ATOM 389 O ASN A 25 3.990 7.931 10.828 1.00 0.00 O ATOM 390 CB ASN A 25 4.373 6.491 13.460 1.00 0.00 C ATOM 391 CG ASN A 25 4.029 5.638 14.687 1.00 0.00 C ATOM 392 OD1 ASN A 25 4.576 4.567 14.863 1.00 0.00 O ATOM 393 ND2 ASN A 25 3.143 6.065 15.554 1.00 0.00 N ATOM 0 H ASN A 25 5.148 5.374 11.256 1.00 0.00 H new ATOM 0 HA ASN A 25 2.487 5.730 12.665 1.00 0.00 H new ATOM 0 HB2 ASN A 25 5.410 6.326 13.168 1.00 0.00 H new ATOM 0 HB3 ASN A 25 4.274 7.550 13.700 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.916 5.499 16.372 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.681 6.963 15.411 1.00 0.00 H new ATOM 400 N GLU A 26 1.867 7.795 11.431 1.00 0.00 N ATOM 401 CA GLU A 26 1.488 9.000 10.620 1.00 0.00 C ATOM 402 C GLU A 26 1.895 8.810 9.150 1.00 0.00 C ATOM 403 O GLU A 26 2.564 7.853 8.808 1.00 0.00 O ATOM 404 CB GLU A 26 2.250 10.178 11.244 1.00 0.00 C ATOM 405 CG GLU A 26 1.332 11.400 11.327 1.00 0.00 C ATOM 406 CD GLU A 26 2.172 12.676 11.246 1.00 0.00 C ATOM 407 OE1 GLU A 26 2.716 12.936 10.186 1.00 0.00 O ATOM 408 OE2 GLU A 26 2.255 13.371 12.246 1.00 0.00 O ATOM 0 H GLU A 26 1.097 7.361 11.939 1.00 0.00 H new ATOM 0 HA GLU A 26 0.411 9.169 10.630 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.604 9.909 12.239 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.130 10.412 10.645 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.605 11.378 10.515 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.768 11.382 12.260 1.00 0.00 H new ATOM 415 N ASP A 27 1.495 9.709 8.269 1.00 0.00 N ATOM 416 CA ASP A 27 1.859 9.574 6.820 1.00 0.00 C ATOM 417 C ASP A 27 1.497 8.171 6.293 1.00 0.00 C ATOM 418 O ASP A 27 2.343 7.462 5.781 1.00 0.00 O ATOM 419 CB ASP A 27 3.373 9.798 6.761 1.00 0.00 C ATOM 420 CG ASP A 27 3.698 11.216 7.234 1.00 0.00 C ATOM 421 OD1 ASP A 27 3.361 12.148 6.521 1.00 0.00 O ATOM 422 OD2 ASP A 27 4.278 11.346 8.299 1.00 0.00 O ATOM 0 H ASP A 27 0.932 10.529 8.496 1.00 0.00 H new ATOM 0 HA ASP A 27 1.317 10.288 6.199 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.884 9.068 7.389 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.734 9.651 5.743 1.00 0.00 H new ATOM 427 N ILE A 28 0.252 7.761 6.420 1.00 0.00 N ATOM 428 CA ILE A 28 -0.142 6.404 5.925 1.00 0.00 C ATOM 429 C ILE A 28 -1.015 6.512 4.655 1.00 0.00 C ATOM 430 O ILE A 28 -0.829 5.755 3.719 1.00 0.00 O ATOM 431 CB ILE A 28 -0.868 5.734 7.119 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.899 4.211 6.937 1.00 0.00 C ATOM 433 CG2 ILE A 28 -2.302 6.248 7.288 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.687 3.827 5.676 1.00 0.00 C ATOM 0 H ILE A 28 -0.500 8.305 6.842 1.00 0.00 H new ATOM 0 HA ILE A 28 0.712 5.801 5.616 1.00 0.00 H new ATOM 0 HB ILE A 28 -0.306 5.993 8.016 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.119 3.828 6.865 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -1.354 3.745 7.811 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.770 5.749 8.137 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.285 7.324 7.463 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.873 6.037 6.384 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.695 2.742 5.568 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.711 4.191 5.762 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.215 4.275 4.802 1.00 0.00 H new ATOM 446 N LYS A 29 -1.944 7.442 4.595 1.00 0.00 N ATOM 447 CA LYS A 29 -2.786 7.567 3.351 1.00 0.00 C ATOM 448 C LYS A 29 -1.942 8.177 2.222 1.00 0.00 C ATOM 449 O LYS A 29 -2.045 7.765 1.081 1.00 0.00 O ATOM 450 CB LYS A 29 -3.965 8.490 3.701 1.00 0.00 C ATOM 451 CG LYS A 29 -4.888 7.785 4.697 1.00 0.00 C ATOM 452 CD LYS A 29 -5.694 6.706 3.970 1.00 0.00 C ATOM 453 CE LYS A 29 -7.025 6.490 4.693 1.00 0.00 C ATOM 454 NZ LYS A 29 -7.501 5.157 4.227 1.00 0.00 N ATOM 0 H LYS A 29 -2.155 8.109 5.337 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.148 6.596 3.014 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.596 9.422 4.128 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.518 8.750 2.798 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.301 7.337 5.499 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.561 8.507 5.159 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.873 7.005 2.937 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.129 5.774 3.939 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -6.894 6.507 5.775 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -7.741 7.274 4.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -8.411 4.936 4.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.622 5.173 3.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.802 4.430 4.482 1.00 0.00 H new ATOM 468 N TYR A 30 -1.098 9.145 2.526 1.00 0.00 N ATOM 469 CA TYR A 30 -0.243 9.751 1.444 1.00 0.00 C ATOM 470 C TYR A 30 0.784 8.724 0.939 1.00 0.00 C ATOM 471 O TYR A 30 1.121 8.714 -0.231 1.00 0.00 O ATOM 472 CB TYR A 30 0.474 10.959 2.067 1.00 0.00 C ATOM 473 CG TYR A 30 -0.549 11.966 2.537 1.00 0.00 C ATOM 474 CD1 TYR A 30 -1.313 12.676 1.602 1.00 0.00 C ATOM 475 CD2 TYR A 30 -0.734 12.189 3.906 1.00 0.00 C ATOM 476 CE1 TYR A 30 -2.262 13.608 2.037 1.00 0.00 C ATOM 477 CE2 TYR A 30 -1.684 13.122 4.340 1.00 0.00 C ATOM 478 CZ TYR A 30 -2.447 13.831 3.406 1.00 0.00 C ATOM 479 OH TYR A 30 -3.382 14.751 3.835 1.00 0.00 O ATOM 0 H TYR A 30 -0.966 9.535 3.459 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.850 10.055 0.592 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.093 10.636 2.904 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.141 11.416 1.336 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -1.170 12.504 0.545 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.145 11.642 4.627 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.852 14.155 1.316 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.828 13.294 5.396 1.00 0.00 H new ATOM 0 HH TYR A 30 -3.384 14.783 4.814 1.00 0.00 H new ATOM 489 N VAL A 31 1.282 7.854 1.798 1.00 0.00 N ATOM 490 CA VAL A 31 2.283 6.833 1.323 1.00 0.00 C ATOM 491 C VAL A 31 1.588 5.814 0.407 1.00 0.00 C ATOM 492 O VAL A 31 2.146 5.407 -0.595 1.00 0.00 O ATOM 493 CB VAL A 31 2.859 6.166 2.590 1.00 0.00 C ATOM 494 CG1 VAL A 31 3.807 5.012 2.219 1.00 0.00 C ATOM 495 CG2 VAL A 31 3.636 7.218 3.380 1.00 0.00 C ATOM 0 H VAL A 31 1.044 7.807 2.789 1.00 0.00 H new ATOM 0 HA VAL A 31 3.086 7.284 0.740 1.00 0.00 H new ATOM 0 HB VAL A 31 2.040 5.762 3.184 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.200 4.558 3.128 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.261 4.263 1.646 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.632 5.397 1.620 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.051 6.764 4.280 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.446 7.610 2.765 1.00 0.00 H new ATOM 0 HG23 VAL A 31 2.966 8.031 3.659 1.00 0.00 H new ATOM 505 N ALA A 32 0.375 5.411 0.722 1.00 0.00 N ATOM 506 CA ALA A 32 -0.331 4.431 -0.178 1.00 0.00 C ATOM 507 C ALA A 32 -0.649 5.114 -1.515 1.00 0.00 C ATOM 508 O ALA A 32 -0.483 4.527 -2.567 1.00 0.00 O ATOM 509 CB ALA A 32 -1.627 4.018 0.536 1.00 0.00 C ATOM 0 H ALA A 32 -0.149 5.710 1.545 1.00 0.00 H new ATOM 0 HA ALA A 32 0.286 3.555 -0.380 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.172 3.306 -0.083 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.384 3.556 1.493 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.246 4.899 0.706 1.00 0.00 H new ATOM 515 N GLU A 33 -1.089 6.357 -1.486 1.00 0.00 N ATOM 516 CA GLU A 33 -1.396 7.067 -2.780 1.00 0.00 C ATOM 517 C GLU A 33 -0.115 7.179 -3.615 1.00 0.00 C ATOM 518 O GLU A 33 -0.124 6.922 -4.806 1.00 0.00 O ATOM 519 CB GLU A 33 -1.918 8.466 -2.412 1.00 0.00 C ATOM 520 CG GLU A 33 -3.416 8.390 -2.108 1.00 0.00 C ATOM 521 CD GLU A 33 -3.913 9.762 -1.648 1.00 0.00 C ATOM 522 OE1 GLU A 33 -3.678 10.725 -2.359 1.00 0.00 O ATOM 523 OE2 GLU A 33 -4.520 9.825 -0.592 1.00 0.00 O ATOM 0 H GLU A 33 -1.247 6.903 -0.639 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.138 6.524 -3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.380 8.850 -1.546 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.738 9.160 -3.233 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.963 8.072 -2.996 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.604 7.645 -1.335 1.00 0.00 H new ATOM 530 N TYR A 34 0.993 7.539 -3.000 1.00 0.00 N ATOM 531 CA TYR A 34 2.277 7.636 -3.783 1.00 0.00 C ATOM 532 C TYR A 34 2.647 6.240 -4.301 1.00 0.00 C ATOM 533 O TYR A 34 3.044 6.082 -5.441 1.00 0.00 O ATOM 534 CB TYR A 34 3.353 8.164 -2.809 1.00 0.00 C ATOM 535 CG TYR A 34 4.729 8.179 -3.458 1.00 0.00 C ATOM 536 CD1 TYR A 34 4.883 8.446 -4.831 1.00 0.00 C ATOM 537 CD2 TYR A 34 5.860 7.938 -2.667 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.160 8.467 -5.402 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.136 7.964 -3.239 1.00 0.00 C ATOM 540 CZ TYR A 34 7.287 8.228 -4.606 1.00 0.00 C ATOM 541 OH TYR A 34 8.545 8.257 -5.170 1.00 0.00 O ATOM 0 H TYR A 34 1.066 7.766 -2.008 1.00 0.00 H new ATOM 0 HA TYR A 34 2.186 8.303 -4.640 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.090 9.171 -2.486 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.377 7.539 -1.917 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.015 8.635 -5.445 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.746 7.732 -1.613 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.277 8.668 -6.457 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.006 7.780 -2.626 1.00 0.00 H new ATOM 0 HH TYR A 34 9.208 8.472 -4.481 1.00 0.00 H new ATOM 551 N ILE A 35 2.498 5.220 -3.479 1.00 0.00 N ATOM 552 CA ILE A 35 2.821 3.826 -3.950 1.00 0.00 C ATOM 553 C ILE A 35 1.922 3.495 -5.156 1.00 0.00 C ATOM 554 O ILE A 35 2.402 3.057 -6.186 1.00 0.00 O ATOM 555 CB ILE A 35 2.553 2.898 -2.743 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.684 3.083 -1.727 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.499 1.428 -3.173 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.366 2.303 -0.453 1.00 0.00 C ATOM 0 H ILE A 35 2.171 5.290 -2.515 1.00 0.00 H new ATOM 0 HA ILE A 35 3.853 3.709 -4.280 1.00 0.00 H new ATOM 0 HB ILE A 35 1.590 3.160 -2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.627 2.737 -2.151 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.808 4.141 -1.496 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.309 0.801 -2.302 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.699 1.291 -3.900 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.451 1.145 -3.623 1.00 0.00 H new ATOM 0 HD11 ILE A 35 4.173 2.437 0.267 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.433 2.670 -0.025 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.264 1.244 -0.691 1.00 0.00 H new ATOM 570 N VAL A 36 0.631 3.742 -5.054 1.00 0.00 N ATOM 571 CA VAL A 36 -0.270 3.477 -6.233 1.00 0.00 C ATOM 572 C VAL A 36 0.179 4.375 -7.398 1.00 0.00 C ATOM 573 O VAL A 36 0.228 3.940 -8.534 1.00 0.00 O ATOM 574 CB VAL A 36 -1.707 3.827 -5.793 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.667 3.694 -6.982 1.00 0.00 C ATOM 576 CG2 VAL A 36 -2.145 2.867 -4.682 1.00 0.00 C ATOM 0 H VAL A 36 0.168 4.109 -4.222 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.226 2.438 -6.559 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.728 4.853 -5.427 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.679 3.943 -6.662 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.360 4.375 -7.776 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.646 2.670 -7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -3.160 3.112 -4.369 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.117 1.843 -5.054 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.470 2.963 -3.832 1.00 0.00 H new ATOM 586 N LEU A 37 0.538 5.618 -7.124 1.00 0.00 N ATOM 587 CA LEU A 37 1.019 6.519 -8.236 1.00 0.00 C ATOM 588 C LEU A 37 2.249 5.870 -8.890 1.00 0.00 C ATOM 589 O LEU A 37 2.355 5.815 -10.101 1.00 0.00 O ATOM 590 CB LEU A 37 1.405 7.863 -7.597 1.00 0.00 C ATOM 591 CG LEU A 37 1.119 8.999 -8.581 1.00 0.00 C ATOM 592 CD1 LEU A 37 -0.264 9.588 -8.295 1.00 0.00 C ATOM 593 CD2 LEU A 37 2.180 10.092 -8.422 1.00 0.00 C ATOM 0 H LEU A 37 0.520 6.041 -6.196 1.00 0.00 H new ATOM 0 HA LEU A 37 0.252 6.671 -8.996 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.841 8.015 -6.677 1.00 0.00 H new ATOM 0 HB3 LEU A 37 2.461 7.859 -7.327 1.00 0.00 H new ATOM 0 HG LEU A 37 1.145 8.611 -9.599 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.467 10.397 -8.996 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.021 8.812 -8.408 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.291 9.975 -7.277 1.00 0.00 H new ATOM 0 HD21 LEU A 37 1.976 10.901 -9.123 1.00 0.00 H new ATOM 0 HD22 LEU A 37 2.154 10.479 -7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.166 9.674 -8.626 1.00 0.00 H new ATOM 605 N LEU A 38 3.165 5.343 -8.094 1.00 0.00 N ATOM 606 CA LEU A 38 4.365 4.658 -8.694 1.00 0.00 C ATOM 607 C LEU A 38 3.869 3.459 -9.518 1.00 0.00 C ATOM 608 O LEU A 38 4.288 3.243 -10.639 1.00 0.00 O ATOM 609 CB LEU A 38 5.231 4.159 -7.525 1.00 0.00 C ATOM 610 CG LEU A 38 5.985 5.330 -6.895 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.719 4.844 -5.643 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.000 5.881 -7.899 1.00 0.00 C ATOM 0 H LEU A 38 3.133 5.358 -7.075 1.00 0.00 H new ATOM 0 HA LEU A 38 4.938 5.328 -9.335 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.603 3.676 -6.777 1.00 0.00 H new ATOM 0 HB3 LEU A 38 5.938 3.409 -7.880 1.00 0.00 H new ATOM 0 HG LEU A 38 5.280 6.115 -6.623 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.258 5.677 -5.191 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.997 4.448 -4.929 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.425 4.060 -5.917 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.538 6.716 -7.451 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.707 5.097 -8.169 1.00 0.00 H new ATOM 0 HD23 LEU A 38 6.479 6.223 -8.793 1.00 0.00 H new ATOM 624 N ILE A 39 2.955 2.689 -8.962 1.00 0.00 N ATOM 625 CA ILE A 39 2.397 1.505 -9.710 1.00 0.00 C ATOM 626 C ILE A 39 1.689 2.003 -10.982 1.00 0.00 C ATOM 627 O ILE A 39 1.845 1.435 -12.047 1.00 0.00 O ATOM 628 CB ILE A 39 1.386 0.838 -8.745 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.139 0.232 -7.542 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.569 -0.249 -9.467 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.915 -1.025 -7.956 1.00 0.00 C ATOM 0 H ILE A 39 2.572 2.828 -8.027 1.00 0.00 H new ATOM 0 HA ILE A 39 3.170 0.799 -10.014 1.00 0.00 H new ATOM 0 HB ILE A 39 0.691 1.599 -8.389 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.828 0.970 -7.130 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.430 -0.017 -6.753 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.133 -0.702 -8.767 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.019 0.199 -10.294 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.242 -1.015 -9.852 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.437 -1.432 -7.090 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.221 -1.770 -8.345 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.640 -0.767 -8.728 1.00 0.00 H new ATOM 643 N VAL A 40 0.916 3.062 -10.875 1.00 0.00 N ATOM 644 CA VAL A 40 0.202 3.593 -12.091 1.00 0.00 C ATOM 645 C VAL A 40 1.195 4.219 -13.093 1.00 0.00 C ATOM 646 O VAL A 40 0.863 4.392 -14.252 1.00 0.00 O ATOM 647 CB VAL A 40 -0.787 4.662 -11.588 1.00 0.00 C ATOM 648 CG1 VAL A 40 -1.593 5.216 -12.767 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.744 4.039 -10.563 1.00 0.00 C ATOM 0 H VAL A 40 0.748 3.578 -10.011 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.311 2.786 -12.614 1.00 0.00 H new ATOM 0 HB VAL A 40 -0.229 5.472 -11.118 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.291 5.972 -12.407 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.915 5.665 -13.493 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.147 4.406 -13.241 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.442 4.798 -10.209 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.298 3.225 -11.031 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.172 3.651 -9.720 1.00 0.00 H new ATOM 659 N ASN A 41 2.401 4.568 -12.676 1.00 0.00 N ATOM 660 CA ASN A 41 3.368 5.180 -13.637 1.00 0.00 C ATOM 661 C ASN A 41 4.726 4.449 -13.613 1.00 0.00 C ATOM 662 O ASN A 41 5.732 5.023 -13.989 1.00 0.00 O ATOM 663 CB ASN A 41 3.543 6.624 -13.157 1.00 0.00 C ATOM 664 CG ASN A 41 2.185 7.341 -13.149 1.00 0.00 C ATOM 665 OD1 ASN A 41 1.635 7.627 -14.193 1.00 0.00 O ATOM 666 ND2 ASN A 41 1.616 7.648 -12.007 1.00 0.00 N ATOM 0 H ASN A 41 2.746 4.454 -11.723 1.00 0.00 H new ATOM 0 HA ASN A 41 3.002 5.118 -14.662 1.00 0.00 H new ATOM 0 HB2 ASN A 41 3.975 6.634 -12.156 1.00 0.00 H new ATOM 0 HB3 ASN A 41 4.239 7.151 -13.810 1.00 0.00 H new ATOM 0 HD21 ASN A 41 0.715 8.125 -11.998 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.075 7.409 -11.128 1.00 0.00 H new ATOM 673 N GLY A 42 4.781 3.198 -13.187 1.00 0.00 N ATOM 674 CA GLY A 42 6.098 2.485 -13.167 1.00 0.00 C ATOM 675 C GLY A 42 6.010 1.244 -12.270 1.00 0.00 C ATOM 676 O GLY A 42 6.560 1.224 -11.185 1.00 0.00 O ATOM 0 H GLY A 42 3.983 2.654 -12.859 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.378 2.193 -14.179 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.877 3.154 -12.801 1.00 0.00 H new ATOM 680 N GLY A 43 5.317 0.213 -12.704 1.00 0.00 N ATOM 681 CA GLY A 43 5.193 -1.016 -11.866 1.00 0.00 C ATOM 682 C GLY A 43 6.545 -1.746 -11.782 1.00 0.00 C ATOM 683 O GLY A 43 6.706 -2.824 -12.319 1.00 0.00 O ATOM 0 H GLY A 43 4.834 0.175 -13.602 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.854 -0.749 -10.865 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.440 -1.679 -12.291 1.00 0.00 H new ATOM 687 N THR A 44 7.508 -1.178 -11.087 1.00 0.00 N ATOM 688 CA THR A 44 8.833 -1.842 -10.936 1.00 0.00 C ATOM 689 C THR A 44 9.148 -1.939 -9.437 1.00 0.00 C ATOM 690 O THR A 44 9.487 -0.955 -8.812 1.00 0.00 O ATOM 691 CB THR A 44 9.824 -0.919 -11.648 1.00 0.00 C ATOM 692 OG1 THR A 44 9.445 0.434 -11.433 1.00 0.00 O ATOM 693 CG2 THR A 44 9.818 -1.216 -13.148 1.00 0.00 C ATOM 0 H THR A 44 7.425 -0.276 -10.617 1.00 0.00 H new ATOM 0 HA THR A 44 8.870 -2.848 -11.354 1.00 0.00 H new ATOM 0 HB THR A 44 10.825 -1.087 -11.251 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.422 0.907 -12.291 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.525 -0.557 -13.652 1.00 0.00 H new ATOM 0 HG22 THR A 44 10.107 -2.254 -13.315 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.818 -1.049 -13.548 1.00 0.00 H new ATOM 701 N VAL A 45 9.001 -3.108 -8.841 1.00 0.00 N ATOM 702 CA VAL A 45 9.257 -3.235 -7.353 1.00 0.00 C ATOM 703 C VAL A 45 10.618 -2.625 -6.965 1.00 0.00 C ATOM 704 O VAL A 45 10.745 -2.035 -5.910 1.00 0.00 O ATOM 705 CB VAL A 45 9.217 -4.741 -7.014 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.527 -4.947 -5.526 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.818 -5.290 -7.309 1.00 0.00 C ATOM 0 H VAL A 45 8.719 -3.969 -9.309 1.00 0.00 H new ATOM 0 HA VAL A 45 8.499 -2.689 -6.791 1.00 0.00 H new ATOM 0 HB VAL A 45 9.959 -5.263 -7.618 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.497 -6.011 -5.292 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.519 -4.554 -5.303 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.785 -4.422 -4.924 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.787 -6.353 -7.071 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.084 -4.760 -6.702 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.586 -5.148 -8.365 1.00 0.00 H new ATOM 717 N GLU A 46 11.628 -2.756 -7.792 1.00 0.00 N ATOM 718 CA GLU A 46 12.961 -2.163 -7.417 1.00 0.00 C ATOM 719 C GLU A 46 12.886 -0.634 -7.470 1.00 0.00 C ATOM 720 O GLU A 46 13.204 0.032 -6.500 1.00 0.00 O ATOM 721 CB GLU A 46 13.990 -2.691 -8.429 1.00 0.00 C ATOM 722 CG GLU A 46 14.471 -4.077 -7.991 1.00 0.00 C ATOM 723 CD GLU A 46 15.507 -4.597 -8.989 1.00 0.00 C ATOM 724 OE1 GLU A 46 16.529 -3.949 -9.143 1.00 0.00 O ATOM 725 OE2 GLU A 46 15.260 -5.633 -9.583 1.00 0.00 O ATOM 0 H GLU A 46 11.595 -3.236 -8.692 1.00 0.00 H new ATOM 0 HA GLU A 46 13.245 -2.444 -6.403 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.544 -2.746 -9.422 1.00 0.00 H new ATOM 0 HB3 GLU A 46 14.835 -2.005 -8.496 1.00 0.00 H new ATOM 0 HG2 GLU A 46 14.906 -4.024 -6.993 1.00 0.00 H new ATOM 0 HG3 GLU A 46 13.628 -4.765 -7.934 1.00 0.00 H new ATOM 732 N SER A 47 12.457 -0.064 -8.575 1.00 0.00 N ATOM 733 CA SER A 47 12.359 1.436 -8.636 1.00 0.00 C ATOM 734 C SER A 47 11.253 1.923 -7.683 1.00 0.00 C ATOM 735 O SER A 47 11.367 2.984 -7.099 1.00 0.00 O ATOM 736 CB SER A 47 12.029 1.810 -10.090 1.00 0.00 C ATOM 737 OG SER A 47 10.621 1.976 -10.231 1.00 0.00 O ATOM 0 H SER A 47 12.176 -0.559 -9.421 1.00 0.00 H new ATOM 0 HA SER A 47 13.293 1.906 -8.328 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.544 2.731 -10.366 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.384 1.032 -10.766 1.00 0.00 H new ATOM 0 HG SER A 47 10.250 1.217 -10.729 1.00 0.00 H new ATOM 743 N VAL A 48 10.191 1.158 -7.508 1.00 0.00 N ATOM 744 CA VAL A 48 9.101 1.607 -6.575 1.00 0.00 C ATOM 745 C VAL A 48 9.592 1.523 -5.125 1.00 0.00 C ATOM 746 O VAL A 48 9.342 2.417 -4.342 1.00 0.00 O ATOM 747 CB VAL A 48 7.892 0.675 -6.801 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.747 1.070 -5.864 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.412 0.804 -8.247 1.00 0.00 C ATOM 0 H VAL A 48 10.035 0.258 -7.963 1.00 0.00 H new ATOM 0 HA VAL A 48 8.818 2.642 -6.768 1.00 0.00 H new ATOM 0 HB VAL A 48 8.194 -0.352 -6.598 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.897 0.408 -6.029 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.078 0.985 -4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.450 2.099 -6.066 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.558 0.146 -8.407 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.117 1.835 -8.442 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.218 0.523 -8.924 1.00 0.00 H new ATOM 759 N VAL A 49 10.302 0.474 -4.758 1.00 0.00 N ATOM 760 CA VAL A 49 10.798 0.393 -3.336 1.00 0.00 C ATOM 761 C VAL A 49 11.849 1.491 -3.099 1.00 0.00 C ATOM 762 O VAL A 49 11.889 2.088 -2.039 1.00 0.00 O ATOM 763 CB VAL A 49 11.400 -1.016 -3.148 1.00 0.00 C ATOM 764 CG1 VAL A 49 12.081 -1.126 -1.777 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.277 -2.053 -3.226 1.00 0.00 C ATOM 0 H VAL A 49 10.554 -0.309 -5.361 1.00 0.00 H new ATOM 0 HA VAL A 49 9.995 0.550 -2.616 1.00 0.00 H new ATOM 0 HB VAL A 49 12.138 -1.194 -3.930 1.00 0.00 H new ATOM 0 HG11 VAL A 49 12.501 -2.125 -1.658 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.879 -0.386 -1.707 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.348 -0.945 -0.991 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.694 -3.051 -3.094 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.547 -1.858 -2.441 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.790 -1.989 -4.199 1.00 0.00 H new ATOM 775 N ASP A 50 12.691 1.773 -4.073 1.00 0.00 N ATOM 776 CA ASP A 50 13.722 2.855 -3.872 1.00 0.00 C ATOM 777 C ASP A 50 13.035 4.189 -3.530 1.00 0.00 C ATOM 778 O ASP A 50 13.573 4.983 -2.778 1.00 0.00 O ATOM 779 CB ASP A 50 14.499 2.982 -5.192 1.00 0.00 C ATOM 780 CG ASP A 50 15.597 1.919 -5.242 1.00 0.00 C ATOM 781 OD1 ASP A 50 15.265 0.748 -5.168 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.753 2.295 -5.355 1.00 0.00 O ATOM 0 H ASP A 50 12.711 1.311 -4.982 1.00 0.00 H new ATOM 0 HA ASP A 50 14.391 2.607 -3.048 1.00 0.00 H new ATOM 0 HB2 ASP A 50 13.822 2.861 -6.038 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.937 3.977 -5.274 1.00 0.00 H new ATOM 787 N GLU A 51 11.858 4.451 -4.066 1.00 0.00 N ATOM 788 CA GLU A 51 11.169 5.750 -3.742 1.00 0.00 C ATOM 789 C GLU A 51 10.664 5.736 -2.295 1.00 0.00 C ATOM 790 O GLU A 51 10.771 6.728 -1.596 1.00 0.00 O ATOM 791 CB GLU A 51 9.993 5.893 -4.722 1.00 0.00 C ATOM 792 CG GLU A 51 10.464 6.633 -5.975 1.00 0.00 C ATOM 793 CD GLU A 51 11.339 5.708 -6.821 1.00 0.00 C ATOM 794 OE1 GLU A 51 12.446 5.422 -6.397 1.00 0.00 O ATOM 795 OE2 GLU A 51 10.887 5.300 -7.878 1.00 0.00 O ATOM 0 H GLU A 51 11.353 3.834 -4.702 1.00 0.00 H new ATOM 0 HA GLU A 51 11.856 6.590 -3.841 1.00 0.00 H new ATOM 0 HB2 GLU A 51 9.607 4.910 -4.990 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.176 6.438 -4.250 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.605 6.968 -6.556 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.026 7.524 -5.694 1.00 0.00 H new ATOM 802 N LEU A 52 10.135 4.626 -1.825 1.00 0.00 N ATOM 803 CA LEU A 52 9.657 4.587 -0.400 1.00 0.00 C ATOM 804 C LEU A 52 10.872 4.509 0.530 1.00 0.00 C ATOM 805 O LEU A 52 10.883 5.119 1.580 1.00 0.00 O ATOM 806 CB LEU A 52 8.774 3.331 -0.222 1.00 0.00 C ATOM 807 CG LEU A 52 7.357 3.536 -0.800 1.00 0.00 C ATOM 808 CD1 LEU A 52 6.727 4.837 -0.280 1.00 0.00 C ATOM 809 CD2 LEU A 52 7.427 3.568 -2.326 1.00 0.00 C ATOM 0 H LEU A 52 10.015 3.762 -2.354 1.00 0.00 H new ATOM 0 HA LEU A 52 9.081 5.481 -0.159 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.247 2.482 -0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.702 3.085 0.837 1.00 0.00 H new ATOM 0 HG LEU A 52 6.731 2.704 -0.477 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.730 4.953 -0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.656 4.798 0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.347 5.684 -0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.426 3.713 -2.733 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.070 4.389 -2.644 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.835 2.625 -2.691 1.00 0.00 H new ATOM 821 N ALA A 53 11.904 3.780 0.153 1.00 0.00 N ATOM 822 CA ALA A 53 13.118 3.705 1.039 1.00 0.00 C ATOM 823 C ALA A 53 13.797 5.083 1.101 1.00 0.00 C ATOM 824 O ALA A 53 14.303 5.478 2.135 1.00 0.00 O ATOM 825 CB ALA A 53 14.067 2.668 0.416 1.00 0.00 C ATOM 0 H ALA A 53 11.959 3.244 -0.713 1.00 0.00 H new ATOM 0 HA ALA A 53 12.849 3.416 2.055 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.964 2.581 1.029 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.567 1.701 0.366 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.344 2.986 -0.589 1.00 0.00 H new ATOM 831 N SER A 54 13.812 5.825 0.007 1.00 0.00 N ATOM 832 CA SER A 54 14.464 7.184 0.038 1.00 0.00 C ATOM 833 C SER A 54 13.777 8.081 1.082 1.00 0.00 C ATOM 834 O SER A 54 14.427 8.867 1.746 1.00 0.00 O ATOM 835 CB SER A 54 14.303 7.788 -1.365 1.00 0.00 C ATOM 836 OG SER A 54 13.041 8.438 -1.454 1.00 0.00 O ATOM 0 H SER A 54 13.409 5.554 -0.890 1.00 0.00 H new ATOM 0 HA SER A 54 15.516 7.104 0.311 1.00 0.00 H new ATOM 0 HB2 SER A 54 15.106 8.498 -1.562 1.00 0.00 H new ATOM 0 HB3 SER A 54 14.377 7.006 -2.121 1.00 0.00 H new ATOM 0 HG SER A 54 12.329 7.766 -1.499 1.00 0.00 H new ATOM 842 N LEU A 55 12.472 7.971 1.240 1.00 0.00 N ATOM 843 CA LEU A 55 11.769 8.828 2.255 1.00 0.00 C ATOM 844 C LEU A 55 11.587 8.049 3.565 1.00 0.00 C ATOM 845 O LEU A 55 11.776 8.583 4.642 1.00 0.00 O ATOM 846 CB LEU A 55 10.402 9.173 1.649 1.00 0.00 C ATOM 847 CG LEU A 55 10.598 9.938 0.339 1.00 0.00 C ATOM 848 CD1 LEU A 55 9.468 9.587 -0.630 1.00 0.00 C ATOM 849 CD2 LEU A 55 10.578 11.442 0.621 1.00 0.00 C ATOM 0 H LEU A 55 11.872 7.333 0.717 1.00 0.00 H new ATOM 0 HA LEU A 55 12.340 9.728 2.484 1.00 0.00 H new ATOM 0 HB2 LEU A 55 9.833 8.261 1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.824 9.775 2.350 1.00 0.00 H new ATOM 0 HG LEU A 55 11.555 9.663 -0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.607 10.132 -1.564 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.480 8.516 -0.830 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.511 9.863 -0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 55 10.718 11.989 -0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.620 11.717 1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.382 11.693 1.313 1.00 0.00 H new ATOM 861 N PHE A 56 11.225 6.788 3.484 1.00 0.00 N ATOM 862 CA PHE A 56 11.035 5.973 4.723 1.00 0.00 C ATOM 863 C PHE A 56 12.158 4.928 4.822 1.00 0.00 C ATOM 864 O PHE A 56 11.942 3.757 4.566 1.00 0.00 O ATOM 865 CB PHE A 56 9.669 5.284 4.568 1.00 0.00 C ATOM 866 CG PHE A 56 8.600 6.312 4.275 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.423 7.404 5.133 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.795 6.179 3.135 1.00 0.00 C ATOM 869 CE1 PHE A 56 7.441 8.361 4.856 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.815 7.138 2.858 1.00 0.00 C ATOM 871 CZ PHE A 56 6.638 8.229 3.717 1.00 0.00 C ATOM 0 H PHE A 56 11.053 6.290 2.610 1.00 0.00 H new ATOM 0 HA PHE A 56 11.067 6.582 5.627 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.711 4.552 3.762 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.422 4.740 5.480 1.00 0.00 H new ATOM 0 HD1 PHE A 56 9.045 7.508 6.010 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.931 5.338 2.472 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.302 9.201 5.520 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.194 7.037 1.980 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.882 8.969 3.501 1.00 0.00 H new ATOM 881 N ASP A 57 13.355 5.337 5.191 1.00 0.00 N ATOM 882 CA ASP A 57 14.480 4.349 5.304 1.00 0.00 C ATOM 883 C ASP A 57 14.724 3.953 6.773 1.00 0.00 C ATOM 884 O ASP A 57 15.826 3.586 7.137 1.00 0.00 O ATOM 885 CB ASP A 57 15.713 5.057 4.732 1.00 0.00 C ATOM 886 CG ASP A 57 16.574 4.049 3.970 1.00 0.00 C ATOM 887 OD1 ASP A 57 16.338 3.873 2.785 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.456 3.470 4.582 1.00 0.00 O ATOM 0 H ASP A 57 13.598 6.302 5.416 1.00 0.00 H new ATOM 0 HA ASP A 57 14.252 3.429 4.766 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.406 5.864 4.067 1.00 0.00 H new ATOM 0 HB3 ASP A 57 16.292 5.510 5.537 1.00 0.00 H new ATOM 893 N SER A 58 13.712 4.008 7.622 1.00 0.00 N ATOM 894 CA SER A 58 13.920 3.612 9.056 1.00 0.00 C ATOM 895 C SER A 58 13.462 2.160 9.279 1.00 0.00 C ATOM 896 O SER A 58 14.100 1.412 9.997 1.00 0.00 O ATOM 897 CB SER A 58 13.068 4.577 9.889 1.00 0.00 C ATOM 898 OG SER A 58 11.700 4.204 9.787 1.00 0.00 O ATOM 0 H SER A 58 12.766 4.306 7.385 1.00 0.00 H new ATOM 0 HA SER A 58 14.971 3.666 9.338 1.00 0.00 H new ATOM 0 HB2 SER A 58 13.386 4.554 10.931 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.205 5.599 9.536 1.00 0.00 H new ATOM 0 HG SER A 58 11.153 4.818 10.320 1.00 0.00 H new ATOM 904 N VAL A 59 12.369 1.751 8.667 1.00 0.00 N ATOM 905 CA VAL A 59 11.893 0.335 8.855 1.00 0.00 C ATOM 906 C VAL A 59 12.650 -0.612 7.907 1.00 0.00 C ATOM 907 O VAL A 59 13.164 -0.194 6.887 1.00 0.00 O ATOM 908 CB VAL A 59 10.380 0.329 8.550 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.121 0.670 7.071 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.813 -1.057 8.862 1.00 0.00 C ATOM 0 H VAL A 59 11.793 2.327 8.054 1.00 0.00 H new ATOM 0 HA VAL A 59 12.079 -0.013 9.871 1.00 0.00 H new ATOM 0 HB VAL A 59 9.892 1.082 9.168 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.048 0.660 6.878 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.520 1.660 6.851 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.611 -0.068 6.436 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.744 -1.069 8.649 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.315 -1.803 8.245 1.00 0.00 H new ATOM 0 HG23 VAL A 59 9.976 -1.288 9.915 1.00 0.00 H new ATOM 920 N SER A 60 12.728 -1.885 8.242 1.00 0.00 N ATOM 921 CA SER A 60 13.469 -2.857 7.351 1.00 0.00 C ATOM 922 C SER A 60 12.947 -2.783 5.903 1.00 0.00 C ATOM 923 O SER A 60 11.759 -2.676 5.675 1.00 0.00 O ATOM 924 CB SER A 60 13.215 -4.260 7.923 1.00 0.00 C ATOM 925 OG SER A 60 11.913 -4.307 8.490 1.00 0.00 O ATOM 0 H SER A 60 12.317 -2.292 9.082 1.00 0.00 H new ATOM 0 HA SER A 60 14.532 -2.619 7.328 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.309 -5.009 7.136 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.963 -4.498 8.680 1.00 0.00 H new ATOM 0 HG SER A 60 11.747 -5.201 8.854 1.00 0.00 H new ATOM 931 N ARG A 61 13.830 -2.846 4.923 1.00 0.00 N ATOM 932 CA ARG A 61 13.375 -2.783 3.482 1.00 0.00 C ATOM 933 C ARG A 61 12.278 -3.826 3.207 1.00 0.00 C ATOM 934 O ARG A 61 11.386 -3.591 2.412 1.00 0.00 O ATOM 935 CB ARG A 61 14.608 -3.087 2.616 1.00 0.00 C ATOM 936 CG ARG A 61 15.504 -1.848 2.548 1.00 0.00 C ATOM 937 CD ARG A 61 15.095 -0.987 1.352 1.00 0.00 C ATOM 938 NE ARG A 61 16.376 -0.472 0.794 1.00 0.00 N ATOM 939 CZ ARG A 61 16.873 -0.998 -0.292 1.00 0.00 C ATOM 940 NH1 ARG A 61 17.521 -2.129 -0.232 1.00 0.00 N ATOM 941 NH2 ARG A 61 16.719 -0.394 -1.439 1.00 0.00 N ATOM 0 H ARG A 61 14.837 -2.937 5.055 1.00 0.00 H new ATOM 0 HA ARG A 61 12.958 -1.802 3.257 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.162 -3.927 3.036 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.298 -3.380 1.613 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.418 -1.273 3.470 1.00 0.00 H new ATOM 0 HG3 ARG A 61 16.548 -2.146 2.455 1.00 0.00 H new ATOM 0 HD2 ARG A 61 14.549 -1.572 0.612 1.00 0.00 H new ATOM 0 HD3 ARG A 61 14.441 -0.171 1.658 1.00 0.00 H new ATOM 0 HE ARG A 61 16.865 0.292 1.261 1.00 0.00 H new ATOM 0 HH11 ARG A 61 17.639 -2.602 0.664 1.00 0.00 H new ATOM 0 HH12 ARG A 61 17.909 -2.540 -1.081 1.00 0.00 H new ATOM 0 HH21 ARG A 61 16.210 0.489 -1.486 1.00 0.00 H new ATOM 0 HH22 ARG A 61 17.107 -0.805 -2.288 1.00 0.00 H new ATOM 955 N ASP A 62 12.332 -4.975 3.850 1.00 0.00 N ATOM 956 CA ASP A 62 11.274 -6.023 3.600 1.00 0.00 C ATOM 957 C ASP A 62 9.876 -5.448 3.877 1.00 0.00 C ATOM 958 O ASP A 62 8.932 -5.748 3.169 1.00 0.00 O ATOM 959 CB ASP A 62 11.564 -7.189 4.560 1.00 0.00 C ATOM 960 CG ASP A 62 12.481 -8.201 3.871 1.00 0.00 C ATOM 961 OD1 ASP A 62 13.506 -7.788 3.355 1.00 0.00 O ATOM 962 OD2 ASP A 62 12.141 -9.373 3.870 1.00 0.00 O ATOM 0 H ASP A 62 13.050 -5.232 4.527 1.00 0.00 H new ATOM 0 HA ASP A 62 11.296 -6.355 2.562 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.035 -6.816 5.470 1.00 0.00 H new ATOM 0 HB3 ASP A 62 10.632 -7.670 4.857 1.00 0.00 H new ATOM 967 N THR A 63 9.732 -4.624 4.893 1.00 0.00 N ATOM 968 CA THR A 63 8.374 -4.039 5.186 1.00 0.00 C ATOM 969 C THR A 63 7.957 -3.113 4.035 1.00 0.00 C ATOM 970 O THR A 63 6.823 -3.143 3.594 1.00 0.00 O ATOM 971 CB THR A 63 8.500 -3.253 6.504 1.00 0.00 C ATOM 972 OG1 THR A 63 8.870 -4.148 7.546 1.00 0.00 O ATOM 973 CG2 THR A 63 7.160 -2.594 6.849 1.00 0.00 C ATOM 0 H THR A 63 10.480 -4.334 5.523 1.00 0.00 H new ATOM 0 HA THR A 63 7.614 -4.815 5.280 1.00 0.00 H new ATOM 0 HB THR A 63 9.259 -2.479 6.393 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.833 -4.076 7.713 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.257 -2.040 7.783 1.00 0.00 H new ATOM 0 HG22 THR A 63 6.874 -1.911 6.049 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.395 -3.362 6.961 1.00 0.00 H new ATOM 981 N LEU A 64 8.863 -2.300 3.534 1.00 0.00 N ATOM 982 CA LEU A 64 8.492 -1.390 2.394 1.00 0.00 C ATOM 983 C LEU A 64 8.233 -2.240 1.148 1.00 0.00 C ATOM 984 O LEU A 64 7.258 -2.040 0.447 1.00 0.00 O ATOM 985 CB LEU A 64 9.684 -0.446 2.157 1.00 0.00 C ATOM 986 CG LEU A 64 10.005 0.337 3.444 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.429 0.013 3.905 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.897 1.842 3.176 1.00 0.00 C ATOM 0 H LEU A 64 9.827 -2.226 3.858 1.00 0.00 H new ATOM 0 HA LEU A 64 7.594 -0.814 2.616 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.556 -1.021 1.845 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.453 0.248 1.348 1.00 0.00 H new ATOM 0 HG LEU A 64 9.294 0.051 4.219 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.652 0.569 4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.513 -1.056 4.102 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.137 0.295 3.125 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.125 2.391 4.089 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.605 2.124 2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.885 2.082 2.851 1.00 0.00 H new ATOM 1000 N ALA A 65 9.089 -3.201 0.875 1.00 0.00 N ATOM 1001 CA ALA A 65 8.864 -4.076 -0.329 1.00 0.00 C ATOM 1002 C ALA A 65 7.538 -4.839 -0.175 1.00 0.00 C ATOM 1003 O ALA A 65 6.830 -5.054 -1.140 1.00 0.00 O ATOM 1004 CB ALA A 65 10.042 -5.063 -0.393 1.00 0.00 C ATOM 0 H ALA A 65 9.922 -3.417 1.423 1.00 0.00 H new ATOM 0 HA ALA A 65 8.808 -3.484 -1.242 1.00 0.00 H new ATOM 0 HB1 ALA A 65 9.920 -5.720 -1.254 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.976 -4.509 -0.488 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.066 -5.660 0.518 1.00 0.00 H new ATOM 1010 N ASN A 66 7.189 -5.246 1.032 1.00 0.00 N ATOM 1011 CA ASN A 66 5.894 -5.991 1.223 1.00 0.00 C ATOM 1012 C ASN A 66 4.710 -5.132 0.751 1.00 0.00 C ATOM 1013 O ASN A 66 3.760 -5.648 0.190 1.00 0.00 O ATOM 1014 CB ASN A 66 5.767 -6.284 2.727 1.00 0.00 C ATOM 1015 CG ASN A 66 6.444 -7.622 3.048 1.00 0.00 C ATOM 1016 OD1 ASN A 66 6.526 -8.488 2.199 1.00 0.00 O ATOM 1017 ND2 ASN A 66 6.938 -7.835 4.243 1.00 0.00 N ATOM 0 H ASN A 66 7.736 -5.097 1.880 1.00 0.00 H new ATOM 0 HA ASN A 66 5.887 -6.913 0.642 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.229 -5.483 3.304 1.00 0.00 H new ATOM 0 HB3 ASN A 66 4.716 -6.318 3.014 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.389 -8.724 4.457 1.00 0.00 H new ATOM 0 HD22 ASN A 66 6.872 -7.111 4.959 1.00 0.00 H new ATOM 1024 N VAL A 67 4.749 -3.827 0.966 1.00 0.00 N ATOM 1025 CA VAL A 67 3.596 -2.975 0.504 1.00 0.00 C ATOM 1026 C VAL A 67 3.620 -2.850 -1.028 1.00 0.00 C ATOM 1027 O VAL A 67 2.587 -2.896 -1.668 1.00 0.00 O ATOM 1028 CB VAL A 67 3.748 -1.595 1.161 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.519 -0.751 0.821 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.863 -1.750 2.688 1.00 0.00 C ATOM 0 H VAL A 67 5.509 -3.328 1.429 1.00 0.00 H new ATOM 0 HA VAL A 67 2.644 -3.423 0.788 1.00 0.00 H new ATOM 0 HB VAL A 67 4.649 -1.108 0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.614 0.232 1.282 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.442 -0.639 -0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.623 -1.244 1.199 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.971 -0.767 3.146 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.965 -2.234 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.735 -2.359 2.927 1.00 0.00 H new ATOM 1040 N VAL A 68 4.786 -2.722 -1.630 1.00 0.00 N ATOM 1041 CA VAL A 68 4.832 -2.639 -3.134 1.00 0.00 C ATOM 1042 C VAL A 68 4.518 -4.030 -3.714 1.00 0.00 C ATOM 1043 O VAL A 68 3.867 -4.142 -4.735 1.00 0.00 O ATOM 1044 CB VAL A 68 6.251 -2.196 -3.523 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.341 -2.057 -5.046 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.561 -0.844 -2.874 1.00 0.00 C ATOM 0 H VAL A 68 5.689 -2.672 -1.158 1.00 0.00 H new ATOM 0 HA VAL A 68 4.102 -1.929 -3.524 1.00 0.00 H new ATOM 0 HB VAL A 68 6.970 -2.940 -3.179 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.347 -1.743 -5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.119 -3.017 -5.513 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.621 -1.313 -5.387 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.568 -0.530 -3.150 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.842 -0.101 -3.219 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.495 -0.937 -1.790 1.00 0.00 H new ATOM 1056 N GLN A 69 4.965 -5.095 -3.065 1.00 0.00 N ATOM 1057 CA GLN A 69 4.660 -6.470 -3.598 1.00 0.00 C ATOM 1058 C GLN A 69 3.144 -6.696 -3.599 1.00 0.00 C ATOM 1059 O GLN A 69 2.600 -7.238 -4.544 1.00 0.00 O ATOM 1060 CB GLN A 69 5.350 -7.477 -2.663 1.00 0.00 C ATOM 1061 CG GLN A 69 6.834 -7.575 -3.023 1.00 0.00 C ATOM 1062 CD GLN A 69 7.539 -8.513 -2.036 1.00 0.00 C ATOM 1063 OE1 GLN A 69 7.411 -8.353 -0.838 1.00 0.00 O ATOM 1064 NE2 GLN A 69 8.286 -9.493 -2.483 1.00 0.00 N ATOM 0 H GLN A 69 5.516 -5.070 -2.207 1.00 0.00 H new ATOM 0 HA GLN A 69 5.019 -6.588 -4.620 1.00 0.00 H new ATOM 0 HB2 GLN A 69 5.237 -7.163 -1.626 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.878 -8.455 -2.753 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.948 -7.948 -4.041 1.00 0.00 H new ATOM 0 HG3 GLN A 69 7.293 -6.587 -2.993 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.397 -9.632 -3.487 1.00 0.00 H new ATOM 0 HE22 GLN A 69 8.756 -10.116 -1.827 1.00 0.00 H new ATOM 1073 N THR A 70 2.448 -6.277 -2.559 1.00 0.00 N ATOM 1074 CA THR A 70 0.954 -6.475 -2.547 1.00 0.00 C ATOM 1075 C THR A 70 0.296 -5.573 -3.607 1.00 0.00 C ATOM 1076 O THR A 70 -0.708 -5.941 -4.189 1.00 0.00 O ATOM 1077 CB THR A 70 0.444 -6.147 -1.128 1.00 0.00 C ATOM 1078 OG1 THR A 70 -0.956 -6.380 -1.069 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.727 -4.687 -0.771 1.00 0.00 C ATOM 0 H THR A 70 2.838 -5.817 -1.736 1.00 0.00 H new ATOM 0 HA THR A 70 0.696 -7.505 -2.794 1.00 0.00 H new ATOM 0 HB THR A 70 0.964 -6.787 -0.415 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.284 -6.174 -0.169 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.358 -4.480 0.234 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.801 -4.505 -0.808 1.00 0.00 H new ATOM 0 HG23 THR A 70 0.224 -4.034 -1.484 1.00 0.00 H new ATOM 1087 N ALA A 71 0.860 -4.411 -3.896 1.00 0.00 N ATOM 1088 CA ALA A 71 0.249 -3.535 -4.960 1.00 0.00 C ATOM 1089 C ALA A 71 0.391 -4.230 -6.326 1.00 0.00 C ATOM 1090 O ALA A 71 -0.499 -4.161 -7.152 1.00 0.00 O ATOM 1091 CB ALA A 71 1.022 -2.204 -4.964 1.00 0.00 C ATOM 0 H ALA A 71 1.699 -4.039 -3.451 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.809 -3.357 -4.765 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.605 -1.544 -5.724 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.936 -1.731 -3.986 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.072 -2.394 -5.184 1.00 0.00 H new ATOM 1097 N PHE A 72 1.498 -4.915 -6.566 1.00 0.00 N ATOM 1098 CA PHE A 72 1.663 -5.622 -7.886 1.00 0.00 C ATOM 1099 C PHE A 72 0.589 -6.709 -8.000 1.00 0.00 C ATOM 1100 O PHE A 72 -0.152 -6.754 -8.964 1.00 0.00 O ATOM 1101 CB PHE A 72 3.063 -6.262 -7.878 1.00 0.00 C ATOM 1102 CG PHE A 72 4.103 -5.263 -8.337 1.00 0.00 C ATOM 1103 CD1 PHE A 72 4.165 -3.985 -7.763 1.00 0.00 C ATOM 1104 CD2 PHE A 72 5.015 -5.622 -9.337 1.00 0.00 C ATOM 1105 CE1 PHE A 72 5.135 -3.073 -8.189 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.986 -4.707 -9.760 1.00 0.00 C ATOM 1107 CZ PHE A 72 6.044 -3.434 -9.185 1.00 0.00 C ATOM 0 H PHE A 72 2.279 -5.012 -5.917 1.00 0.00 H new ATOM 0 HA PHE A 72 1.560 -4.938 -8.728 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.304 -6.612 -6.874 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.075 -7.135 -8.531 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.463 -3.705 -6.991 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.969 -6.605 -9.782 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.181 -2.089 -7.747 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.690 -4.984 -10.530 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.794 -2.729 -9.512 1.00 0.00 H new ATOM 1117 N PHE A 73 0.481 -7.578 -7.010 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.579 -8.648 -7.070 1.00 0.00 C ATOM 1119 C PHE A 73 -1.964 -7.988 -7.169 1.00 0.00 C ATOM 1120 O PHE A 73 -2.823 -8.453 -7.893 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.469 -9.458 -5.767 1.00 0.00 C ATOM 1122 CG PHE A 73 0.747 -10.350 -5.832 1.00 0.00 C ATOM 1123 CD1 PHE A 73 0.882 -11.275 -6.875 1.00 0.00 C ATOM 1124 CD2 PHE A 73 1.741 -10.253 -4.851 1.00 0.00 C ATOM 1125 CE1 PHE A 73 2.010 -12.103 -6.935 1.00 0.00 C ATOM 1126 CE2 PHE A 73 2.868 -11.081 -4.911 1.00 0.00 C ATOM 1127 CZ PHE A 73 3.003 -12.006 -5.953 1.00 0.00 C ATOM 0 H PHE A 73 1.070 -7.593 -6.178 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.446 -9.294 -7.938 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.395 -8.785 -4.913 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.367 -10.059 -5.622 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.116 -11.350 -7.633 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.638 -9.539 -4.047 1.00 0.00 H new ATOM 0 HE1 PHE A 73 2.114 -12.817 -7.739 1.00 0.00 H new ATOM 0 HE2 PHE A 73 3.634 -11.006 -4.153 1.00 0.00 H new ATOM 0 HZ PHE A 73 3.873 -12.645 -5.999 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.185 -6.896 -6.455 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.525 -6.212 -6.537 1.00 0.00 C ATOM 1139 C ALA A 74 -3.811 -5.796 -7.987 1.00 0.00 C ATOM 1140 O ALA A 74 -4.931 -5.900 -8.451 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.447 -4.968 -5.635 1.00 0.00 C ATOM 0 H ALA A 74 -1.508 -6.458 -5.831 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.326 -6.877 -6.214 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.399 -4.438 -5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.232 -5.274 -4.611 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.655 -4.309 -5.991 1.00 0.00 H new ATOM 1147 N LEU A 75 -2.810 -5.331 -8.714 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.061 -4.921 -10.147 1.00 0.00 C ATOM 1149 C LEU A 75 -3.645 -6.103 -10.933 1.00 0.00 C ATOM 1150 O LEU A 75 -4.564 -5.937 -11.714 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.701 -4.505 -10.752 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.557 -2.976 -10.752 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.687 -2.340 -11.571 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.609 -2.454 -9.313 1.00 0.00 C ATOM 0 H LEU A 75 -1.850 -5.219 -8.387 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.772 -4.096 -10.195 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.889 -4.953 -10.179 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.618 -4.884 -11.771 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.600 -2.710 -11.201 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.575 -1.256 -11.564 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.641 -2.703 -12.598 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.649 -2.608 -11.134 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.507 -1.369 -9.316 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.562 -2.727 -8.861 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.795 -2.894 -8.737 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.136 -7.298 -10.719 1.00 0.00 N ATOM 1167 CA GLU A 76 -3.700 -8.484 -11.451 1.00 0.00 C ATOM 1168 C GLU A 76 -5.075 -8.828 -10.867 1.00 0.00 C ATOM 1169 O GLU A 76 -6.004 -9.129 -11.594 1.00 0.00 O ATOM 1170 CB GLU A 76 -2.719 -9.648 -11.240 1.00 0.00 C ATOM 1171 CG GLU A 76 -1.466 -9.420 -12.087 1.00 0.00 C ATOM 1172 CD GLU A 76 -1.752 -9.814 -13.537 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -2.006 -10.983 -13.773 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -1.712 -8.940 -14.387 1.00 0.00 O ATOM 0 H GLU A 76 -2.367 -7.502 -10.080 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.823 -8.280 -12.515 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.450 -9.724 -10.187 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.191 -10.590 -11.517 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.165 -8.374 -12.036 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.637 -10.010 -11.695 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.222 -8.766 -9.559 1.00 0.00 N ATOM 1182 CA ALA A 77 -6.561 -9.073 -8.945 1.00 0.00 C ATOM 1183 C ALA A 77 -7.581 -7.999 -9.353 1.00 0.00 C ATOM 1184 O ALA A 77 -8.740 -8.299 -9.573 1.00 0.00 O ATOM 1185 CB ALA A 77 -6.364 -9.068 -7.420 1.00 0.00 C ATOM 0 H ALA A 77 -4.485 -8.520 -8.899 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.938 -10.038 -9.284 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.313 -9.287 -6.930 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.630 -9.826 -7.145 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.009 -8.088 -7.102 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.165 -6.750 -9.471 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.145 -5.681 -9.883 1.00 0.00 C ATOM 1193 C LEU A 78 -8.623 -5.950 -11.320 1.00 0.00 C ATOM 1194 O LEU A 78 -9.789 -5.785 -11.627 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.405 -4.328 -9.814 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.323 -3.246 -9.223 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -9.584 -3.101 -10.082 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -8.714 -3.625 -7.786 1.00 0.00 C ATOM 0 H LEU A 78 -6.211 -6.431 -9.304 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.016 -5.673 -9.227 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.508 -4.427 -9.202 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.079 -4.033 -10.811 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.790 -2.295 -9.212 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.228 -2.332 -9.656 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.303 -2.817 -11.096 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -10.119 -4.050 -10.106 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.365 -2.855 -7.371 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.239 -4.580 -7.792 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.816 -3.709 -7.175 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.736 -6.371 -12.203 1.00 0.00 N ATOM 1211 CA GLN A 79 -8.171 -6.652 -13.620 1.00 0.00 C ATOM 1212 C GLN A 79 -9.276 -7.724 -13.646 1.00 0.00 C ATOM 1213 O GLN A 79 -10.153 -7.685 -14.488 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.930 -7.158 -14.374 1.00 0.00 C ATOM 1215 CG GLN A 79 -6.174 -5.969 -14.971 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.721 -6.371 -15.249 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.463 -7.165 -16.133 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -3.751 -5.859 -14.532 1.00 0.00 N ATOM 0 H GLN A 79 -6.747 -6.530 -12.009 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.576 -5.752 -14.083 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -6.281 -7.712 -13.696 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -7.228 -7.847 -15.164 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.655 -5.645 -15.894 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.203 -5.124 -14.283 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -3.963 -5.193 -13.789 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -2.784 -6.127 -14.717 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.245 -8.682 -12.740 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.314 -9.745 -12.744 1.00 0.00 C ATOM 1229 C GLN A 80 -11.612 -9.193 -12.141 1.00 0.00 C ATOM 1230 O GLN A 80 -12.691 -9.462 -12.635 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.782 -10.910 -11.894 1.00 0.00 C ATOM 1232 CG GLN A 80 -8.683 -11.646 -12.662 1.00 0.00 C ATOM 1233 CD GLN A 80 -9.286 -12.850 -13.395 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -9.540 -12.784 -14.582 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -9.531 -13.960 -12.740 1.00 0.00 N ATOM 0 H GLN A 80 -8.539 -8.774 -12.010 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.538 -10.073 -13.759 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -9.390 -10.534 -10.949 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.593 -11.597 -11.652 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.211 -10.972 -13.376 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -7.905 -11.978 -11.975 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -9.320 -14.022 -11.744 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -9.932 -14.761 -13.227 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.521 -8.422 -11.079 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.755 -7.856 -10.458 1.00 0.00 C ATOM 1246 C GLY A 81 -12.781 -8.183 -8.958 1.00 0.00 C ATOM 1247 O GLY A 81 -13.486 -9.077 -8.529 1.00 0.00 O ATOM 0 H GLY A 81 -10.647 -8.164 -10.621 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.784 -6.776 -10.604 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.639 -8.268 -10.944 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.025 -7.465 -8.151 1.00 0.00 N ATOM 1252 CA GLU A 82 -12.023 -7.742 -6.682 1.00 0.00 C ATOM 1253 C GLU A 82 -12.598 -6.537 -5.921 1.00 0.00 C ATOM 1254 O GLU A 82 -12.905 -5.520 -6.515 1.00 0.00 O ATOM 1255 CB GLU A 82 -10.552 -7.958 -6.316 1.00 0.00 C ATOM 1256 CG GLU A 82 -10.244 -9.458 -6.302 1.00 0.00 C ATOM 1257 CD GLU A 82 -9.229 -9.765 -5.198 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -9.285 -9.113 -4.168 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -8.413 -10.650 -5.401 1.00 0.00 O ATOM 0 H GLU A 82 -11.414 -6.704 -8.450 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.634 -8.607 -6.423 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.909 -7.451 -7.035 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.342 -7.524 -5.339 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.160 -10.026 -6.136 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.848 -9.767 -7.270 1.00 0.00 H new ATOM 1266 N SER A 83 -12.750 -6.636 -4.615 1.00 0.00 N ATOM 1267 CA SER A 83 -13.308 -5.485 -3.841 1.00 0.00 C ATOM 1268 C SER A 83 -12.256 -4.921 -2.876 1.00 0.00 C ATOM 1269 O SER A 83 -11.592 -5.662 -2.175 1.00 0.00 O ATOM 1270 CB SER A 83 -14.489 -6.057 -3.059 1.00 0.00 C ATOM 1271 OG SER A 83 -15.555 -6.341 -3.955 1.00 0.00 O ATOM 0 H SER A 83 -12.512 -7.459 -4.061 1.00 0.00 H new ATOM 0 HA SER A 83 -13.608 -4.668 -4.496 1.00 0.00 H new ATOM 0 HB2 SER A 83 -14.188 -6.964 -2.536 1.00 0.00 H new ATOM 0 HB3 SER A 83 -14.816 -5.346 -2.301 1.00 0.00 H new ATOM 0 HG SER A 83 -16.313 -6.710 -3.455 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.105 -3.613 -2.826 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.095 -3.010 -1.890 1.00 0.00 C ATOM 1279 C ALA A 84 -11.770 -2.524 -0.589 1.00 0.00 C ATOM 1280 O ALA A 84 -11.162 -2.553 0.465 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.471 -1.829 -2.649 1.00 0.00 C ATOM 0 H ALA A 84 -12.632 -2.944 -3.387 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.342 -3.741 -1.596 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.724 -1.345 -2.019 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.997 -2.192 -3.561 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.249 -1.110 -2.906 1.00 0.00 H new ATOM 1287 N GLU A 85 -13.014 -2.076 -0.642 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.691 -1.591 0.620 1.00 0.00 C ATOM 1289 C GLU A 85 -13.664 -2.682 1.704 1.00 0.00 C ATOM 1290 O GLU A 85 -13.511 -2.388 2.874 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.144 -1.260 0.244 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.219 0.167 -0.303 1.00 0.00 C ATOM 1293 CD GLU A 85 -14.878 1.159 0.810 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -15.563 1.145 1.819 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -13.939 1.917 0.634 1.00 0.00 O ATOM 0 H GLU A 85 -13.581 -2.025 -1.488 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.176 -0.718 1.021 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.507 -1.966 -0.503 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.788 -1.360 1.117 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.525 0.286 -1.135 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -16.218 0.367 -0.690 1.00 0.00 H new ATOM 1302 N ASN A 86 -13.810 -3.937 1.330 1.00 0.00 N ATOM 1303 CA ASN A 86 -13.787 -5.034 2.369 1.00 0.00 C ATOM 1304 C ASN A 86 -12.472 -4.984 3.162 1.00 0.00 C ATOM 1305 O ASN A 86 -12.465 -5.187 4.363 1.00 0.00 O ATOM 1306 CB ASN A 86 -13.897 -6.367 1.611 1.00 0.00 C ATOM 1307 CG ASN A 86 -15.363 -6.633 1.252 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.247 -6.370 2.043 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -15.668 -7.150 0.086 1.00 0.00 N ATOM 0 H ASN A 86 -13.942 -4.249 0.368 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.607 -4.918 3.078 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.290 -6.334 0.706 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -13.509 -7.180 2.225 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -16.643 -7.329 -0.153 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -14.930 -7.373 -0.582 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.361 -4.701 2.511 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.060 -4.629 3.267 1.00 0.00 C ATOM 1318 C ILE A 87 -10.113 -3.465 4.275 1.00 0.00 C ATOM 1319 O ILE A 87 -9.596 -3.575 5.372 1.00 0.00 O ATOM 1320 CB ILE A 87 -8.948 -4.400 2.221 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -8.878 -5.609 1.282 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.597 -4.238 2.925 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -8.266 -5.185 -0.054 1.00 0.00 C ATOM 0 H ILE A 87 -11.297 -4.520 1.509 1.00 0.00 H new ATOM 0 HA ILE A 87 -9.870 -5.544 3.828 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.173 -3.498 1.652 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.278 -6.399 1.734 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -9.876 -6.017 1.123 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -6.816 -4.077 2.182 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.638 -3.383 3.599 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.374 -5.139 3.496 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -8.217 -6.046 -0.721 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.883 -4.409 -0.507 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.261 -4.797 0.113 1.00 0.00 H new ATOM 1335 N VAL A 88 -10.736 -2.353 3.924 1.00 0.00 N ATOM 1336 CA VAL A 88 -10.808 -1.201 4.897 1.00 0.00 C ATOM 1337 C VAL A 88 -11.507 -1.649 6.191 1.00 0.00 C ATOM 1338 O VAL A 88 -11.122 -1.245 7.273 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.607 -0.078 4.211 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.734 1.122 5.155 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.875 0.362 2.942 1.00 0.00 C ATOM 0 H VAL A 88 -11.189 -2.195 3.024 1.00 0.00 H new ATOM 0 HA VAL A 88 -9.811 -0.851 5.165 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.600 -0.449 3.959 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.300 1.913 4.664 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.251 0.816 6.064 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.741 1.491 5.410 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.439 1.157 2.454 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.882 0.728 3.203 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.782 -0.486 2.263 1.00 0.00 H new ATOM 1351 N SER A 89 -12.525 -2.486 6.101 1.00 0.00 N ATOM 1352 CA SER A 89 -13.222 -2.949 7.359 1.00 0.00 C ATOM 1353 C SER A 89 -12.200 -3.607 8.298 1.00 0.00 C ATOM 1354 O SER A 89 -12.210 -3.371 9.491 1.00 0.00 O ATOM 1355 CB SER A 89 -14.287 -3.971 6.930 1.00 0.00 C ATOM 1356 OG SER A 89 -15.190 -4.185 8.007 1.00 0.00 O ATOM 0 H SER A 89 -12.898 -2.863 5.230 1.00 0.00 H new ATOM 0 HA SER A 89 -13.682 -2.115 7.889 1.00 0.00 H new ATOM 0 HB2 SER A 89 -14.826 -3.607 6.055 1.00 0.00 H new ATOM 0 HB3 SER A 89 -13.813 -4.910 6.645 1.00 0.00 H new ATOM 0 HG SER A 89 -15.872 -4.835 7.738 1.00 0.00 H new ATOM 1362 N LYS A 90 -11.299 -4.409 7.764 1.00 0.00 N ATOM 1363 CA LYS A 90 -10.260 -5.048 8.647 1.00 0.00 C ATOM 1364 C LYS A 90 -9.271 -3.978 9.136 1.00 0.00 C ATOM 1365 O LYS A 90 -8.797 -4.041 10.256 1.00 0.00 O ATOM 1366 CB LYS A 90 -9.533 -6.101 7.794 1.00 0.00 C ATOM 1367 CG LYS A 90 -9.173 -7.305 8.666 1.00 0.00 C ATOM 1368 CD LYS A 90 -8.178 -8.197 7.920 1.00 0.00 C ATOM 1369 CE LYS A 90 -8.179 -9.596 8.542 1.00 0.00 C ATOM 1370 NZ LYS A 90 -7.541 -9.423 9.877 1.00 0.00 N ATOM 0 H LYS A 90 -11.238 -4.645 6.774 1.00 0.00 H new ATOM 0 HA LYS A 90 -10.714 -5.512 9.523 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.168 -6.415 6.966 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.631 -5.672 7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.740 -6.969 9.608 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.072 -7.871 8.912 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.447 -8.256 6.865 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.178 -7.766 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.193 -9.986 8.636 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.622 -10.302 7.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -7.320 -10.356 10.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.664 -8.874 9.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -8.193 -8.918 10.511 1.00 0.00 H new ATOM 1384 N ILE A 91 -8.966 -2.983 8.321 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.017 -1.912 8.785 1.00 0.00 C ATOM 1386 C ILE A 91 -8.713 -1.034 9.835 1.00 0.00 C ATOM 1387 O ILE A 91 -8.107 -0.645 10.816 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.635 -1.077 7.544 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -6.966 -1.972 6.486 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.664 0.035 7.951 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -5.741 -2.675 7.085 1.00 0.00 C ATOM 0 H ILE A 91 -9.326 -2.869 7.374 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.125 -2.339 9.242 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.540 -0.640 7.123 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.678 -2.713 6.123 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.666 -1.371 5.628 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.396 0.623 7.073 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.139 0.681 8.689 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.765 -0.406 8.381 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.276 -3.305 6.327 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.024 -1.929 7.426 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.052 -3.291 7.929 1.00 0.00 H new ATOM 1403 N ARG A 92 -9.980 -0.726 9.647 1.00 0.00 N ATOM 1404 CA ARG A 92 -10.695 0.122 10.665 1.00 0.00 C ATOM 1405 C ARG A 92 -10.762 -0.621 12.007 1.00 0.00 C ATOM 1406 O ARG A 92 -10.616 -0.018 13.055 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.111 0.380 10.125 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.697 1.621 10.799 1.00 0.00 C ATOM 1409 CD ARG A 92 -12.013 2.874 10.247 1.00 0.00 C ATOM 1410 NE ARG A 92 -12.875 4.007 10.687 1.00 0.00 N ATOM 1411 CZ ARG A 92 -12.401 4.906 11.508 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -11.890 4.540 12.651 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -12.441 6.169 11.184 1.00 0.00 N ATOM 0 H ARG A 92 -10.542 -1.019 8.848 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.171 1.063 10.829 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.079 0.521 9.045 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -12.747 -0.484 10.315 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -13.771 1.672 10.620 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.556 1.562 11.878 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -11.000 2.975 10.636 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.935 2.835 9.160 1.00 0.00 H new ATOM 0 HE ARG A 92 -13.834 4.081 10.348 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -11.861 3.552 12.904 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -11.520 5.242 13.292 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -12.842 6.454 10.290 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -12.071 6.872 11.824 1.00 0.00 H new ATOM 1427 N MET A 93 -10.967 -1.923 11.991 1.00 0.00 N ATOM 1428 CA MET A 93 -11.022 -2.678 13.292 1.00 0.00 C ATOM 1429 C MET A 93 -9.614 -2.755 13.899 1.00 0.00 C ATOM 1430 O MET A 93 -9.446 -2.605 15.094 1.00 0.00 O ATOM 1431 CB MET A 93 -11.550 -4.086 12.975 1.00 0.00 C ATOM 1432 CG MET A 93 -12.447 -4.565 14.118 1.00 0.00 C ATOM 1433 SD MET A 93 -11.439 -5.401 15.368 1.00 0.00 S ATOM 1434 CE MET A 93 -12.803 -6.073 16.347 1.00 0.00 C ATOM 0 H MET A 93 -11.096 -2.486 11.151 1.00 0.00 H new ATOM 0 HA MET A 93 -11.673 -2.182 14.012 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.110 -4.074 12.040 1.00 0.00 H new ATOM 0 HB3 MET A 93 -10.717 -4.776 12.839 1.00 0.00 H new ATOM 0 HG2 MET A 93 -12.969 -3.718 14.564 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.209 -5.245 13.736 1.00 0.00 H new ATOM 0 HE1 MET A 93 -12.403 -6.638 17.189 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.421 -5.256 16.719 1.00 0.00 H new ATOM 0 HE3 MET A 93 -13.409 -6.731 15.724 1.00 0.00 H new ATOM 1444 N MET A 94 -8.599 -2.966 13.085 1.00 0.00 N ATOM 1445 CA MET A 94 -7.203 -3.025 13.644 1.00 0.00 C ATOM 1446 C MET A 94 -6.760 -1.616 14.059 1.00 0.00 C ATOM 1447 O MET A 94 -6.130 -1.442 15.085 1.00 0.00 O ATOM 1448 CB MET A 94 -6.297 -3.567 12.528 1.00 0.00 C ATOM 1449 CG MET A 94 -4.901 -3.838 13.092 1.00 0.00 C ATOM 1450 SD MET A 94 -3.714 -3.969 11.730 1.00 0.00 S ATOM 1451 CE MET A 94 -2.915 -5.499 12.273 1.00 0.00 C ATOM 0 H MET A 94 -8.674 -3.098 12.076 1.00 0.00 H new ATOM 0 HA MET A 94 -7.151 -3.667 14.523 1.00 0.00 H new ATOM 0 HB2 MET A 94 -6.719 -4.484 12.115 1.00 0.00 H new ATOM 0 HB3 MET A 94 -6.238 -2.848 11.711 1.00 0.00 H new ATOM 0 HG2 MET A 94 -4.608 -3.035 13.768 1.00 0.00 H new ATOM 0 HG3 MET A 94 -4.905 -4.759 13.675 1.00 0.00 H new ATOM 0 HE1 MET A 94 -2.133 -5.772 11.565 1.00 0.00 H new ATOM 0 HE2 MET A 94 -2.476 -5.350 13.259 1.00 0.00 H new ATOM 0 HE3 MET A 94 -3.655 -6.298 12.323 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.099 -0.602 13.285 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.699 0.794 13.680 1.00 0.00 C ATOM 1463 C ASN A 95 -7.541 1.245 14.882 1.00 0.00 C ATOM 1464 O ASN A 95 -7.042 1.906 15.774 1.00 0.00 O ATOM 1465 CB ASN A 95 -6.960 1.704 12.467 1.00 0.00 C ATOM 1466 CG ASN A 95 -5.692 1.788 11.606 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.457 0.875 10.694 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -4.902 2.696 11.765 1.00 0.00 N flip ATOM 0 H ASN A 95 -7.625 -0.678 12.414 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.648 0.839 13.966 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -7.788 1.312 11.876 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.251 2.700 12.802 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.080 3.409 12.473 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.060 2.746 11.191 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.809 0.880 14.930 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.652 1.287 16.108 1.00 0.00 C ATOM 1477 C ALA A 96 -9.171 0.546 17.364 1.00 0.00 C ATOM 1478 O ALA A 96 -9.133 1.111 18.441 1.00 0.00 O ATOM 1479 CB ALA A 96 -11.102 0.898 15.779 1.00 0.00 C ATOM 0 H ALA A 96 -9.288 0.328 14.218 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.578 2.358 16.299 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.751 1.176 16.610 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.423 1.420 14.877 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.162 -0.178 15.616 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.794 -0.714 17.238 1.00 0.00 N ATOM 1486 CA GLN A 97 -8.305 -1.467 18.448 1.00 0.00 C ATOM 1487 C GLN A 97 -7.056 -0.779 19.022 1.00 0.00 C ATOM 1488 O GLN A 97 -6.897 -0.688 20.224 1.00 0.00 O ATOM 1489 CB GLN A 97 -7.960 -2.890 17.979 1.00 0.00 C ATOM 1490 CG GLN A 97 -8.173 -3.872 19.133 1.00 0.00 C ATOM 1491 CD GLN A 97 -9.672 -4.001 19.426 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -10.474 -4.067 18.515 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -10.095 -4.040 20.667 1.00 0.00 N ATOM 0 H GLN A 97 -8.803 -1.244 16.367 1.00 0.00 H new ATOM 0 HA GLN A 97 -9.064 -1.490 19.230 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -8.586 -3.167 17.131 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.926 -2.931 17.638 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -7.757 -4.846 18.877 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.647 -3.524 20.022 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -9.427 -3.985 21.436 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -11.092 -4.125 20.863 1.00 0.00 H new ATOM 1502 N SER A 98 -6.171 -0.290 18.174 1.00 0.00 N ATOM 1503 CA SER A 98 -4.935 0.399 18.702 1.00 0.00 C ATOM 1504 C SER A 98 -5.329 1.587 19.595 1.00 0.00 C ATOM 1505 O SER A 98 -4.689 1.851 20.596 1.00 0.00 O ATOM 1506 CB SER A 98 -4.146 0.894 17.481 1.00 0.00 C ATOM 1507 OG SER A 98 -4.872 1.940 16.847 1.00 0.00 O ATOM 0 H SER A 98 -6.246 -0.336 17.158 1.00 0.00 H new ATOM 0 HA SER A 98 -4.336 -0.284 19.305 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.164 1.252 17.789 1.00 0.00 H new ATOM 0 HB3 SER A 98 -3.982 0.074 16.782 1.00 0.00 H new ATOM 0 HG SER A 98 -5.773 1.625 16.626 1.00 0.00 H new ATOM 1513 N LEU A 99 -6.379 2.305 19.248 1.00 0.00 N ATOM 1514 CA LEU A 99 -6.804 3.466 20.085 1.00 0.00 C ATOM 1515 C LEU A 99 -8.196 3.209 20.690 1.00 0.00 C ATOM 1516 O LEU A 99 -8.995 4.119 20.811 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.850 4.653 19.123 1.00 0.00 C ATOM 1518 CG LEU A 99 -5.445 4.927 18.583 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -5.537 5.843 17.361 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -4.607 5.608 19.668 1.00 0.00 C ATOM 0 H LEU A 99 -6.954 2.133 18.423 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.124 3.642 20.919 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -7.533 4.441 18.300 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -7.233 5.536 19.636 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.976 3.986 18.297 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.536 6.038 16.976 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.135 5.360 16.588 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -6.006 6.785 17.647 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.606 5.804 19.285 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.077 6.549 19.954 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.541 4.956 20.539 1.00 0.00 H new ATOM 1532 N GLY A 100 -8.497 1.981 21.068 1.00 0.00 N ATOM 1533 CA GLY A 100 -9.840 1.688 21.659 1.00 0.00 C ATOM 1534 C GLY A 100 -9.726 0.543 22.677 1.00 0.00 C ATOM 1535 O GLY A 100 -10.364 -0.483 22.531 1.00 0.00 O ATOM 0 H GLY A 100 -7.872 1.179 20.991 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.235 2.580 22.145 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.542 1.417 20.871 1.00 0.00 H new ATOM 1539 N GLN A 101 -8.922 0.707 23.709 1.00 0.00 N ATOM 1540 CA GLN A 101 -8.782 -0.379 24.728 1.00 0.00 C ATOM 1541 C GLN A 101 -9.373 0.077 26.069 1.00 0.00 C ATOM 1542 O GLN A 101 -9.414 1.257 26.361 1.00 0.00 O ATOM 1543 CB GLN A 101 -7.276 -0.620 24.857 1.00 0.00 C ATOM 1544 CG GLN A 101 -6.763 -1.332 23.604 1.00 0.00 C ATOM 1545 CD GLN A 101 -5.236 -1.453 23.672 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -4.533 -0.499 23.402 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -4.683 -2.589 24.021 1.00 0.00 N ATOM 0 H GLN A 101 -8.363 1.542 23.884 1.00 0.00 H new ATOM 0 HA GLN A 101 -9.312 -1.286 24.438 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -6.755 0.329 24.988 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -7.068 -1.222 25.741 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -7.213 -2.321 23.525 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -7.055 -0.777 22.712 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -5.269 -3.393 24.249 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.667 -2.669 24.065 1.00 0.00 H new ATOM 1556 N SER A 102 -9.838 -0.845 26.895 1.00 0.00 N ATOM 1557 CA SER A 102 -10.431 -0.456 28.218 1.00 0.00 C ATOM 1558 C SER A 102 -11.531 0.603 28.026 1.00 0.00 C ATOM 1559 O SER A 102 -11.620 1.551 28.783 1.00 0.00 O ATOM 1560 CB SER A 102 -9.269 0.118 29.034 1.00 0.00 C ATOM 1561 OG SER A 102 -8.186 -0.804 29.020 1.00 0.00 O ATOM 0 H SER A 102 -9.830 -1.847 26.706 1.00 0.00 H new ATOM 0 HA SER A 102 -10.895 -1.306 28.718 1.00 0.00 H new ATOM 0 HB2 SER A 102 -8.953 1.074 28.617 1.00 0.00 H new ATOM 0 HB3 SER A 102 -9.588 0.307 30.059 1.00 0.00 H new ATOM 0 HG SER A 102 -7.439 -0.440 29.540 1.00 0.00 H new ATOM 1567 N ASP A 103 -12.369 0.451 27.020 1.00 0.00 N ATOM 1568 CA ASP A 103 -13.455 1.452 26.790 1.00 0.00 C ATOM 1569 C ASP A 103 -14.832 0.766 26.831 1.00 0.00 C ATOM 1570 O ASP A 103 -14.923 -0.434 27.014 1.00 0.00 O ATOM 1571 CB ASP A 103 -13.171 2.047 25.401 1.00 0.00 C ATOM 1572 CG ASP A 103 -13.291 0.967 24.314 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -13.094 -0.195 24.631 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -13.579 1.325 23.185 1.00 0.00 O ATOM 0 H ASP A 103 -12.344 -0.321 26.354 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.473 2.226 27.558 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -13.872 2.856 25.196 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -12.171 2.479 25.382 1.00 0.00 H new ATOM 1579 N ILE A 104 -15.905 1.513 26.664 1.00 0.00 N ATOM 1580 CA ILE A 104 -17.264 0.892 26.695 1.00 0.00 C ATOM 1581 C ILE A 104 -18.050 1.281 25.432 1.00 0.00 C ATOM 1582 O ILE A 104 -18.835 2.211 25.451 1.00 0.00 O ATOM 1583 CB ILE A 104 -17.937 1.462 27.950 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -17.115 1.087 29.188 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -19.347 0.883 28.087 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -17.681 1.806 30.413 1.00 0.00 C ATOM 0 H ILE A 104 -15.893 2.521 26.509 1.00 0.00 H new ATOM 0 HA ILE A 104 -17.222 -0.197 26.720 1.00 0.00 H new ATOM 0 HB ILE A 104 -17.996 2.547 27.864 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -17.141 0.008 29.342 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -16.071 1.363 29.041 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -19.822 1.290 28.980 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -19.936 1.148 27.209 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -19.288 -0.202 28.170 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -17.097 1.539 31.294 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -17.632 2.884 30.257 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -18.719 1.508 30.562 1.00 0.00 H new ATOM 1598 N ALA A 105 -17.846 0.581 24.333 1.00 0.00 N ATOM 1599 CA ALA A 105 -18.586 0.921 23.081 1.00 0.00 C ATOM 1600 C ALA A 105 -19.268 -0.327 22.514 1.00 0.00 C ATOM 1601 O ALA A 105 -20.345 -0.189 21.958 1.00 0.00 O ATOM 1602 CB ALA A 105 -17.516 1.432 22.116 1.00 0.00 C ATOM 1603 OXT ALA A 105 -18.702 -1.399 22.647 1.00 0.00 O ATOM 0 H ALA A 105 -17.201 -0.206 24.256 1.00 0.00 H new ATOM 0 HA ALA A 105 -19.369 1.660 23.251 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -17.981 1.704 21.168 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -17.027 2.307 22.545 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -16.776 0.650 21.946 1.00 0.00 H new TER 1609 ALA A 105