USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 688 hydrogens (22 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: T 60 MET CE :methyl 160:sc= 0 (180deg=-0.0635) USER MOD Set 1.2: T 80 MET CE :methyl -144:sc= -0.0462 (180deg=-2.17!) USER MOD Set 2.1: T 69 SER OG : rot -79:sc= 0.663 USER MOD Set 2.2: T 71 THR OG1 : rot 37:sc= 0.336 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -163:sc= -0.0319 (180deg=-0.531) USER MOD Single : T 5 TYR OH : rot 180:sc= 0 USER MOD Single : T 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 11 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0 USER MOD Single : T 16 GLN : amide:sc= -8.33! C(o=-8.3!,f=-18!) USER MOD Single : T 17 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0313) USER MOD Single : T 18 ASN : amide:sc= -4.38! K(o=-4.4!,f=-1.2) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot -77:sc= 0.573 USER MOD Single : T 37 SER OG : rot 180:sc= 0.124 USER MOD Single : T 38 THR OG1 : rot 180:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 45 MET CE :methyl 168:sc= -0.108 (180deg=-0.338) USER MOD Single : T 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 50 GLN : amide:sc= -0.648 X(o=-0.65,f=-0.22) USER MOD Single : T 51 ASN : amide:sc= -0.503 K(o=-0.5,f=0.77) USER MOD Single : T 53 THR OG1 : rot 180:sc= 0.148 USER MOD Single : T 58 GLN : amide:sc= -2.59! C(o=-2.6!,f=-6.1!) USER MOD Single : T 81 MET CE :methyl 154:sc= -3.32 (180deg=-4.25!) USER MOD Single : T 84 SER OG : rot 180:sc= 0 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ -160:sc= -0.117 (180deg=-0.705) USER MOD Single : T 89 SER OG : rot 180:sc= -0.0149 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 76.902 -18.436 8.120 1.00 0.00 N ATOM 2 CA MET T 1 76.223 -18.856 6.862 1.00 0.00 C ATOM 3 C MET T 1 75.930 -17.624 6.012 1.00 0.00 C ATOM 4 O MET T 1 76.185 -17.615 4.807 1.00 0.00 O ATOM 5 CB MET T 1 74.918 -19.576 7.205 1.00 0.00 C ATOM 6 CG MET T 1 75.207 -20.721 8.179 1.00 0.00 C ATOM 7 SD MET T 1 73.743 -21.775 8.324 1.00 0.00 S ATOM 8 CE MET T 1 74.154 -22.919 6.982 1.00 0.00 C ATOM 0 H1 MET T 1 77.356 -19.261 8.561 1.00 0.00 H new ATOM 0 H2 MET T 1 77.623 -17.719 7.903 1.00 0.00 H new ATOM 0 H3 MET T 1 76.201 -18.035 8.775 1.00 0.00 H new ATOM 0 HA MET T 1 76.868 -19.533 6.303 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.210 -18.876 7.649 1.00 0.00 H new ATOM 0 HB3 MET T 1 74.455 -19.964 6.298 1.00 0.00 H new ATOM 0 HG2 MET T 1 76.056 -21.307 7.827 1.00 0.00 H new ATOM 0 HG3 MET T 1 75.479 -20.321 9.156 1.00 0.00 H new ATOM 0 HE1 MET T 1 73.369 -23.670 6.891 1.00 0.00 H new ATOM 0 HE2 MET T 1 74.238 -22.367 6.046 1.00 0.00 H new ATOM 0 HE3 MET T 1 75.103 -23.410 7.200 1.00 0.00 H new ATOM 20 N ASP T 2 75.391 -16.588 6.645 1.00 0.00 N ATOM 21 CA ASP T 2 75.066 -15.356 5.936 1.00 0.00 C ATOM 22 C ASP T 2 74.210 -15.655 4.709 1.00 0.00 C ATOM 23 O ASP T 2 74.493 -15.176 3.611 1.00 0.00 O ATOM 24 CB ASP T 2 76.352 -14.648 5.503 1.00 0.00 C ATOM 25 CG ASP T 2 77.112 -14.153 6.729 1.00 0.00 C ATOM 26 OD1 ASP T 2 76.484 -13.980 7.760 1.00 0.00 O ATOM 27 OD2 ASP T 2 78.310 -13.955 6.618 1.00 0.00 O ATOM 0 H ASP T 2 75.171 -16.576 7.641 1.00 0.00 H new ATOM 0 HA ASP T 2 74.504 -14.708 6.609 1.00 0.00 H new ATOM 0 HB2 ASP T 2 76.977 -15.331 4.928 1.00 0.00 H new ATOM 0 HB3 ASP T 2 76.113 -13.809 4.850 1.00 0.00 H new ATOM 32 N ASP T 3 73.162 -16.449 4.903 1.00 0.00 N ATOM 33 CA ASP T 3 72.271 -16.808 3.806 1.00 0.00 C ATOM 34 C ASP T 3 71.280 -15.681 3.527 1.00 0.00 C ATOM 35 O ASP T 3 71.154 -15.220 2.393 1.00 0.00 O ATOM 36 CB ASP T 3 71.506 -18.087 4.151 1.00 0.00 C ATOM 37 CG ASP T 3 72.467 -19.137 4.700 1.00 0.00 C ATOM 38 OD1 ASP T 3 73.584 -19.201 4.213 1.00 0.00 O ATOM 39 OD2 ASP T 3 72.072 -19.861 5.598 1.00 0.00 O ATOM 0 H ASP T 3 72.910 -16.854 5.804 1.00 0.00 H new ATOM 0 HA ASP T 3 72.875 -16.975 2.914 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.732 -17.870 4.887 1.00 0.00 H new ATOM 0 HB3 ASP T 3 71.003 -18.471 3.263 1.00 0.00 H new ATOM 44 N ILE T 4 70.577 -15.247 4.568 1.00 0.00 N ATOM 45 CA ILE T 4 69.595 -14.177 4.424 1.00 0.00 C ATOM 46 C ILE T 4 70.142 -13.038 3.564 1.00 0.00 C ATOM 47 O ILE T 4 69.385 -12.191 3.089 1.00 0.00 O ATOM 48 CB ILE T 4 69.176 -13.642 5.801 1.00 0.00 C ATOM 49 CG1 ILE T 4 70.326 -12.850 6.456 1.00 0.00 C ATOM 50 CG2 ILE T 4 68.781 -14.812 6.705 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.602 -13.699 6.531 1.00 0.00 C ATOM 0 H ILE T 4 70.667 -15.616 5.514 1.00 0.00 H new ATOM 0 HA ILE T 4 68.720 -14.593 3.924 1.00 0.00 H new ATOM 0 HB ILE T 4 68.326 -12.972 5.668 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.521 -11.943 5.883 1.00 0.00 H new ATOM 0 HG13 ILE T 4 70.033 -12.537 7.458 1.00 0.00 H new ATOM 0 HG21 ILE T 4 68.484 -14.432 7.682 1.00 0.00 H new ATOM 0 HG22 ILE T 4 67.947 -15.353 6.257 1.00 0.00 H new ATOM 0 HG23 ILE T 4 69.630 -15.485 6.820 1.00 0.00 H new ATOM 0 HD11 ILE T 4 72.398 -13.118 6.997 1.00 0.00 H new ATOM 0 HD12 ILE T 4 71.410 -14.593 7.124 1.00 0.00 H new ATOM 0 HD13 ILE T 4 71.905 -13.990 5.525 1.00 0.00 H new ATOM 63 N TYR T 5 71.458 -13.021 3.365 1.00 0.00 N ATOM 64 CA TYR T 5 72.094 -11.982 2.558 1.00 0.00 C ATOM 65 C TYR T 5 72.152 -12.405 1.093 1.00 0.00 C ATOM 66 O TYR T 5 71.943 -11.593 0.193 1.00 0.00 O ATOM 67 CB TYR T 5 73.512 -11.719 3.069 1.00 0.00 C ATOM 68 CG TYR T 5 73.446 -10.976 4.386 1.00 0.00 C ATOM 69 CD1 TYR T 5 72.993 -9.652 4.417 1.00 0.00 C ATOM 70 CD2 TYR T 5 73.837 -11.609 5.573 1.00 0.00 C ATOM 71 CE1 TYR T 5 72.930 -8.961 5.633 1.00 0.00 C ATOM 72 CE2 TYR T 5 73.774 -10.920 6.789 1.00 0.00 C ATOM 73 CZ TYR T 5 73.321 -9.595 6.819 1.00 0.00 C ATOM 74 OH TYR T 5 73.258 -8.914 8.018 1.00 0.00 O ATOM 0 H TYR T 5 72.103 -13.712 3.750 1.00 0.00 H new ATOM 0 HA TYR T 5 71.503 -11.070 2.640 1.00 0.00 H new ATOM 0 HB2 TYR T 5 74.044 -12.662 3.198 1.00 0.00 H new ATOM 0 HB3 TYR T 5 74.071 -11.135 2.338 1.00 0.00 H new ATOM 0 HD1 TYR T 5 72.692 -9.163 3.502 1.00 0.00 H new ATOM 0 HD2 TYR T 5 74.188 -12.630 5.549 1.00 0.00 H new ATOM 0 HE1 TYR T 5 72.580 -7.940 5.656 1.00 0.00 H new ATOM 0 HE2 TYR T 5 74.074 -11.409 7.704 1.00 0.00 H new ATOM 0 HH TYR T 5 73.564 -9.499 8.743 1.00 0.00 H new ATOM 84 N LYS T 6 72.438 -13.683 0.863 1.00 0.00 N ATOM 85 CA LYS T 6 72.522 -14.204 -0.497 1.00 0.00 C ATOM 86 C LYS T 6 71.186 -14.035 -1.214 1.00 0.00 C ATOM 87 O LYS T 6 71.133 -13.532 -2.336 1.00 0.00 O ATOM 88 CB LYS T 6 72.903 -15.691 -0.470 1.00 0.00 C ATOM 89 CG LYS T 6 74.227 -15.893 0.291 1.00 0.00 C ATOM 90 CD LYS T 6 75.431 -15.672 -0.644 1.00 0.00 C ATOM 91 CE LYS T 6 75.503 -16.775 -1.717 1.00 0.00 C ATOM 92 NZ LYS T 6 76.932 -17.049 -2.042 1.00 0.00 N ATOM 0 H LYS T 6 72.614 -14.372 1.594 1.00 0.00 H new ATOM 0 HA LYS T 6 73.288 -13.644 -1.034 1.00 0.00 H new ATOM 0 HB2 LYS T 6 72.110 -16.267 0.007 1.00 0.00 H new ATOM 0 HB3 LYS T 6 73.001 -16.066 -1.489 1.00 0.00 H new ATOM 0 HG2 LYS T 6 74.280 -15.199 1.130 1.00 0.00 H new ATOM 0 HG3 LYS T 6 74.263 -16.900 0.707 1.00 0.00 H new ATOM 0 HD2 LYS T 6 75.350 -14.697 -1.124 1.00 0.00 H new ATOM 0 HD3 LYS T 6 76.352 -15.665 -0.062 1.00 0.00 H new ATOM 0 HE2 LYS T 6 75.019 -17.683 -1.356 1.00 0.00 H new ATOM 0 HE3 LYS T 6 74.967 -16.463 -2.613 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 76.987 -17.793 -2.766 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 77.379 -16.182 -2.402 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 77.429 -17.363 -1.184 1.00 0.00 H new ATOM 106 N ALA T 7 70.109 -14.457 -0.559 1.00 0.00 N ATOM 107 CA ALA T 7 68.780 -14.347 -1.145 1.00 0.00 C ATOM 108 C ALA T 7 68.551 -12.942 -1.693 1.00 0.00 C ATOM 109 O ALA T 7 67.841 -12.759 -2.681 1.00 0.00 O ATOM 110 CB ALA T 7 67.717 -14.664 -0.091 1.00 0.00 C ATOM 0 H ALA T 7 70.131 -14.875 0.371 1.00 0.00 H new ATOM 0 HA ALA T 7 68.704 -15.062 -1.964 1.00 0.00 H new ATOM 0 HB1 ALA T 7 66.726 -14.580 -0.537 1.00 0.00 H new ATOM 0 HB2 ALA T 7 67.863 -15.679 0.279 1.00 0.00 H new ATOM 0 HB3 ALA T 7 67.804 -13.960 0.736 1.00 0.00 H new ATOM 116 N ALA T 8 69.159 -11.954 -1.045 1.00 0.00 N ATOM 117 CA ALA T 8 69.016 -10.568 -1.477 1.00 0.00 C ATOM 118 C ALA T 8 69.750 -10.340 -2.795 1.00 0.00 C ATOM 119 O ALA T 8 69.350 -9.502 -3.603 1.00 0.00 O ATOM 120 CB ALA T 8 69.576 -9.628 -0.409 1.00 0.00 C ATOM 0 H ALA T 8 69.751 -12.085 -0.225 1.00 0.00 H new ATOM 0 HA ALA T 8 67.956 -10.360 -1.624 1.00 0.00 H new ATOM 0 HB1 ALA T 8 69.465 -8.595 -0.739 1.00 0.00 H new ATOM 0 HB2 ALA T 8 69.031 -9.771 0.524 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.632 -9.847 -0.249 1.00 0.00 H new ATOM 126 N VAL T 9 70.826 -11.090 -3.004 1.00 0.00 N ATOM 127 CA VAL T 9 71.610 -10.962 -4.226 1.00 0.00 C ATOM 128 C VAL T 9 70.853 -11.553 -5.411 1.00 0.00 C ATOM 129 O VAL T 9 70.991 -11.089 -6.543 1.00 0.00 O ATOM 130 CB VAL T 9 72.951 -11.678 -4.066 1.00 0.00 C ATOM 131 CG1 VAL T 9 73.853 -11.348 -5.256 1.00 0.00 C ATOM 132 CG2 VAL T 9 73.624 -11.213 -2.773 1.00 0.00 C ATOM 0 H VAL T 9 71.174 -11.789 -2.347 1.00 0.00 H new ATOM 0 HA VAL T 9 71.786 -9.903 -4.413 1.00 0.00 H new ATOM 0 HB VAL T 9 72.785 -12.754 -4.025 1.00 0.00 H new ATOM 0 HG11 VAL T 9 74.809 -11.859 -5.141 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.374 -11.678 -6.178 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.020 -10.272 -5.299 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.581 -11.723 -2.657 1.00 0.00 H new ATOM 0 HG22 VAL T 9 73.789 -10.136 -2.816 1.00 0.00 H new ATOM 0 HG23 VAL T 9 72.982 -11.448 -1.924 1.00 0.00 H new ATOM 142 N GLU T 10 70.054 -12.581 -5.142 1.00 0.00 N ATOM 143 CA GLU T 10 69.280 -13.229 -6.194 1.00 0.00 C ATOM 144 C GLU T 10 68.302 -12.243 -6.825 1.00 0.00 C ATOM 145 O GLU T 10 67.885 -12.413 -7.970 1.00 0.00 O ATOM 146 CB GLU T 10 68.509 -14.418 -5.619 1.00 0.00 C ATOM 147 CG GLU T 10 69.489 -15.392 -4.960 1.00 0.00 C ATOM 148 CD GLU T 10 70.366 -16.047 -6.023 1.00 0.00 C ATOM 149 OE1 GLU T 10 69.913 -16.158 -7.150 1.00 0.00 O ATOM 150 OE2 GLU T 10 71.476 -16.428 -5.692 1.00 0.00 O ATOM 0 H GLU T 10 69.926 -12.980 -4.212 1.00 0.00 H new ATOM 0 HA GLU T 10 69.970 -13.581 -6.961 1.00 0.00 H new ATOM 0 HB2 GLU T 10 67.778 -14.072 -4.889 1.00 0.00 H new ATOM 0 HB3 GLU T 10 67.955 -14.923 -6.410 1.00 0.00 H new ATOM 0 HG2 GLU T 10 70.111 -14.862 -4.239 1.00 0.00 H new ATOM 0 HG3 GLU T 10 68.940 -16.155 -4.408 1.00 0.00 H new ATOM 157 N GLN T 11 67.940 -11.211 -6.070 1.00 0.00 N ATOM 158 CA GLN T 11 67.011 -10.203 -6.565 1.00 0.00 C ATOM 159 C GLN T 11 67.719 -9.244 -7.517 1.00 0.00 C ATOM 160 O GLN T 11 67.117 -8.734 -8.461 1.00 0.00 O ATOM 161 CB GLN T 11 66.419 -9.417 -5.393 1.00 0.00 C ATOM 162 CG GLN T 11 65.987 -10.389 -4.294 1.00 0.00 C ATOM 163 CD GLN T 11 65.296 -9.628 -3.168 1.00 0.00 C ATOM 164 OE1 GLN T 11 65.778 -8.580 -2.738 1.00 0.00 O ATOM 165 NE2 GLN T 11 64.188 -10.096 -2.661 1.00 0.00 N ATOM 0 H GLN T 11 68.273 -11.051 -5.119 1.00 0.00 H new ATOM 0 HA GLN T 11 66.210 -10.708 -7.105 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.156 -8.715 -5.003 1.00 0.00 H new ATOM 0 HB3 GLN T 11 65.565 -8.829 -5.730 1.00 0.00 H new ATOM 0 HG2 GLN T 11 65.312 -11.139 -4.705 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.855 -10.921 -3.905 1.00 0.00 H new ATOM 0 HE21 GLN T 11 63.790 -10.964 -3.019 1.00 0.00 H new ATOM 0 HE22 GLN T 11 63.720 -9.593 -1.907 1.00 0.00 H new ATOM 174 N LEU T 12 69.002 -9.006 -7.262 1.00 0.00 N ATOM 175 CA LEU T 12 69.783 -8.107 -8.104 1.00 0.00 C ATOM 176 C LEU T 12 70.078 -8.757 -9.452 1.00 0.00 C ATOM 177 O LEU T 12 70.620 -9.861 -9.515 1.00 0.00 O ATOM 178 CB LEU T 12 71.100 -7.749 -7.409 1.00 0.00 C ATOM 179 CG LEU T 12 70.839 -7.438 -5.933 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.157 -7.062 -5.252 1.00 0.00 C ATOM 181 CD2 LEU T 12 69.855 -6.268 -5.820 1.00 0.00 C ATOM 0 H LEU T 12 69.519 -9.419 -6.486 1.00 0.00 H new ATOM 0 HA LEU T 12 69.202 -7.200 -8.269 1.00 0.00 H new ATOM 0 HB2 LEU T 12 71.805 -8.576 -7.497 1.00 0.00 H new ATOM 0 HB3 LEU T 12 71.557 -6.888 -7.896 1.00 0.00 H new ATOM 0 HG LEU T 12 70.414 -8.316 -5.447 1.00 0.00 H new ATOM 0 HD11 LEU T 12 71.973 -6.840 -4.201 1.00 0.00 H new ATOM 0 HD12 LEU T 12 72.857 -7.894 -5.330 1.00 0.00 H new ATOM 0 HD13 LEU T 12 72.581 -6.184 -5.739 1.00 0.00 H new ATOM 0 HD21 LEU T 12 69.670 -6.048 -4.768 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.278 -5.389 -6.306 1.00 0.00 H new ATOM 0 HD23 LEU T 12 68.916 -6.534 -6.305 1.00 0.00 H new ATOM 193 N THR T 13 69.715 -8.067 -10.528 1.00 0.00 N ATOM 194 CA THR T 13 69.945 -8.585 -11.873 1.00 0.00 C ATOM 195 C THR T 13 71.398 -8.378 -12.285 1.00 0.00 C ATOM 196 O THR T 13 72.091 -7.516 -11.745 1.00 0.00 O ATOM 197 CB THR T 13 69.022 -7.878 -12.868 1.00 0.00 C ATOM 198 OG1 THR T 13 67.704 -7.832 -12.338 1.00 0.00 O ATOM 199 CG2 THR T 13 69.014 -8.638 -14.196 1.00 0.00 C ATOM 0 H THR T 13 69.263 -7.153 -10.497 1.00 0.00 H new ATOM 0 HA THR T 13 69.729 -9.653 -11.874 1.00 0.00 H new ATOM 0 HB THR T 13 69.383 -6.864 -13.038 1.00 0.00 H new ATOM 0 HG1 THR T 13 67.112 -7.378 -12.973 1.00 0.00 H new ATOM 0 HG21 THR T 13 68.356 -8.131 -14.901 1.00 0.00 H new ATOM 0 HG22 THR T 13 70.025 -8.671 -14.602 1.00 0.00 H new ATOM 0 HG23 THR T 13 68.656 -9.654 -14.031 1.00 0.00 H new ATOM 207 N GLU T 14 71.856 -9.174 -13.246 1.00 0.00 N ATOM 208 CA GLU T 14 73.230 -9.067 -13.723 1.00 0.00 C ATOM 209 C GLU T 14 73.468 -7.705 -14.368 1.00 0.00 C ATOM 210 O GLU T 14 74.558 -7.426 -14.868 1.00 0.00 O ATOM 211 CB GLU T 14 73.518 -10.172 -14.741 1.00 0.00 C ATOM 212 CG GLU T 14 73.414 -11.537 -14.056 1.00 0.00 C ATOM 213 CD GLU T 14 73.785 -12.642 -15.038 1.00 0.00 C ATOM 214 OE1 GLU T 14 73.195 -12.681 -16.105 1.00 0.00 O ATOM 215 OE2 GLU T 14 74.653 -13.433 -14.708 1.00 0.00 O ATOM 0 H GLU T 14 71.301 -9.895 -13.707 1.00 0.00 H new ATOM 0 HA GLU T 14 73.900 -9.176 -12.870 1.00 0.00 H new ATOM 0 HB2 GLU T 14 72.810 -10.113 -15.568 1.00 0.00 H new ATOM 0 HB3 GLU T 14 74.514 -10.041 -15.164 1.00 0.00 H new ATOM 0 HG2 GLU T 14 74.076 -11.570 -13.191 1.00 0.00 H new ATOM 0 HG3 GLU T 14 72.400 -11.692 -13.687 1.00 0.00 H new ATOM 222 N GLU T 15 72.440 -6.862 -14.355 1.00 0.00 N ATOM 223 CA GLU T 15 72.543 -5.528 -14.943 1.00 0.00 C ATOM 224 C GLU T 15 73.166 -4.548 -13.954 1.00 0.00 C ATOM 225 O GLU T 15 74.208 -3.953 -14.227 1.00 0.00 O ATOM 226 CB GLU T 15 71.155 -5.031 -15.350 1.00 0.00 C ATOM 227 CG GLU T 15 70.652 -5.840 -16.547 1.00 0.00 C ATOM 228 CD GLU T 15 69.172 -5.559 -16.780 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.424 -5.589 -15.816 1.00 0.00 O ATOM 230 OE2 GLU T 15 68.807 -5.319 -17.918 1.00 0.00 O ATOM 0 H GLU T 15 71.530 -7.076 -13.946 1.00 0.00 H new ATOM 0 HA GLU T 15 73.182 -5.589 -15.824 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.462 -5.130 -14.514 1.00 0.00 H new ATOM 0 HB3 GLU T 15 71.197 -3.972 -15.605 1.00 0.00 H new ATOM 0 HG2 GLU T 15 71.225 -5.581 -17.438 1.00 0.00 H new ATOM 0 HG3 GLU T 15 70.805 -6.904 -16.368 1.00 0.00 H new ATOM 237 N GLN T 16 72.516 -4.378 -12.806 1.00 0.00 N ATOM 238 CA GLN T 16 73.014 -3.459 -11.787 1.00 0.00 C ATOM 239 C GLN T 16 74.332 -3.958 -11.205 1.00 0.00 C ATOM 240 O GLN T 16 75.024 -3.226 -10.497 1.00 0.00 O ATOM 241 CB GLN T 16 71.974 -3.303 -10.670 1.00 0.00 C ATOM 242 CG GLN T 16 71.786 -4.638 -9.933 1.00 0.00 C ATOM 243 CD GLN T 16 72.875 -4.822 -8.880 1.00 0.00 C ATOM 244 OE1 GLN T 16 73.875 -5.493 -9.129 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.737 -4.261 -7.709 1.00 0.00 N ATOM 0 H GLN T 16 71.651 -4.860 -12.559 1.00 0.00 H new ATOM 0 HA GLN T 16 73.189 -2.490 -12.254 1.00 0.00 H new ATOM 0 HB2 GLN T 16 72.295 -2.533 -9.968 1.00 0.00 H new ATOM 0 HB3 GLN T 16 71.024 -2.974 -11.091 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.805 -4.664 -9.459 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.818 -5.462 -10.646 1.00 0.00 H new ATOM 0 HE21 GLN T 16 71.907 -3.705 -7.505 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.459 -4.379 -6.999 1.00 0.00 H new ATOM 254 N LYS T 17 74.682 -5.205 -11.512 1.00 0.00 N ATOM 255 CA LYS T 17 75.929 -5.781 -11.015 1.00 0.00 C ATOM 256 C LYS T 17 77.109 -5.279 -11.841 1.00 0.00 C ATOM 257 O LYS T 17 78.231 -5.180 -11.343 1.00 0.00 O ATOM 258 CB LYS T 17 75.869 -7.310 -11.084 1.00 0.00 C ATOM 259 CG LYS T 17 74.941 -7.847 -9.990 1.00 0.00 C ATOM 260 CD LYS T 17 75.064 -9.372 -9.921 1.00 0.00 C ATOM 261 CE LYS T 17 73.916 -9.939 -9.085 1.00 0.00 C ATOM 262 NZ LYS T 17 74.141 -11.394 -8.856 1.00 0.00 N ATOM 0 H LYS T 17 74.127 -5.830 -12.096 1.00 0.00 H new ATOM 0 HA LYS T 17 76.062 -5.473 -9.978 1.00 0.00 H new ATOM 0 HB2 LYS T 17 75.510 -7.624 -12.064 1.00 0.00 H new ATOM 0 HB3 LYS T 17 76.868 -7.727 -10.962 1.00 0.00 H new ATOM 0 HG2 LYS T 17 75.202 -7.406 -9.028 1.00 0.00 H new ATOM 0 HG3 LYS T 17 73.910 -7.564 -10.201 1.00 0.00 H new ATOM 0 HD2 LYS T 17 75.040 -9.795 -10.925 1.00 0.00 H new ATOM 0 HD3 LYS T 17 76.021 -9.651 -9.480 1.00 0.00 H new ATOM 0 HE2 LYS T 17 73.853 -9.415 -8.131 1.00 0.00 H new ATOM 0 HE3 LYS T 17 72.967 -9.783 -9.598 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 73.328 -11.795 -8.346 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 74.248 -11.877 -9.771 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 75.004 -11.527 -8.291 1.00 0.00 H new ATOM 276 N ASN T 18 76.847 -4.961 -13.105 1.00 0.00 N ATOM 277 CA ASN T 18 77.895 -4.469 -13.992 1.00 0.00 C ATOM 278 C ASN T 18 78.190 -3.000 -13.704 1.00 0.00 C ATOM 279 O ASN T 18 79.216 -2.468 -14.132 1.00 0.00 O ATOM 280 CB ASN T 18 77.463 -4.629 -15.450 1.00 0.00 C ATOM 281 CG ASN T 18 77.488 -6.103 -15.842 1.00 0.00 C ATOM 282 OD1 ASN T 18 77.969 -6.450 -16.921 1.00 0.00 O ATOM 283 ND2 ASN T 18 76.996 -6.994 -15.026 1.00 0.00 N ATOM 0 H ASN T 18 75.925 -5.034 -13.535 1.00 0.00 H new ATOM 0 HA ASN T 18 78.799 -5.052 -13.817 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.460 -4.224 -15.587 1.00 0.00 H new ATOM 0 HB3 ASN T 18 78.128 -4.060 -16.100 1.00 0.00 H new ATOM 0 HD21 ASN T 18 77.009 -7.982 -15.281 1.00 0.00 H new ATOM 0 HD22 ASN T 18 76.598 -6.703 -14.133 1.00 0.00 H new ATOM 290 N GLU T 19 77.287 -2.351 -12.979 1.00 0.00 N ATOM 291 CA GLU T 19 77.461 -0.944 -12.640 1.00 0.00 C ATOM 292 C GLU T 19 78.497 -0.785 -11.531 1.00 0.00 C ATOM 293 O GLU T 19 79.258 0.182 -11.513 1.00 0.00 O ATOM 294 CB GLU T 19 76.128 -0.348 -12.184 1.00 0.00 C ATOM 295 CG GLU T 19 75.186 -0.224 -13.383 1.00 0.00 C ATOM 296 CD GLU T 19 75.644 0.912 -14.291 1.00 0.00 C ATOM 297 OE1 GLU T 19 76.546 1.632 -13.896 1.00 0.00 O ATOM 298 OE2 GLU T 19 75.086 1.046 -15.367 1.00 0.00 O ATOM 0 H GLU T 19 76.432 -2.773 -12.616 1.00 0.00 H new ATOM 0 HA GLU T 19 77.810 -0.416 -13.527 1.00 0.00 H new ATOM 0 HB2 GLU T 19 75.678 -0.980 -11.419 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.291 0.631 -11.733 1.00 0.00 H new ATOM 0 HG2 GLU T 19 75.168 -1.161 -13.940 1.00 0.00 H new ATOM 0 HG3 GLU T 19 74.169 -0.038 -13.039 1.00 0.00 H new ATOM 305 N PHE T 20 78.520 -1.741 -10.607 1.00 0.00 N ATOM 306 CA PHE T 20 79.466 -1.697 -9.499 1.00 0.00 C ATOM 307 C PHE T 20 80.868 -2.066 -9.973 1.00 0.00 C ATOM 308 O PHE T 20 81.808 -1.285 -9.827 1.00 0.00 O ATOM 309 CB PHE T 20 79.023 -2.664 -8.397 1.00 0.00 C ATOM 310 CG PHE T 20 77.817 -2.100 -7.679 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.949 -0.947 -6.896 1.00 0.00 C ATOM 312 CD2 PHE T 20 76.569 -2.727 -7.796 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.835 -0.421 -6.230 1.00 0.00 C ATOM 314 CE2 PHE T 20 75.456 -2.200 -7.130 1.00 0.00 C ATOM 315 CZ PHE T 20 75.589 -1.048 -6.348 1.00 0.00 C ATOM 0 H PHE T 20 77.899 -2.550 -10.604 1.00 0.00 H new ATOM 0 HA PHE T 20 79.487 -0.681 -9.104 1.00 0.00 H new ATOM 0 HB2 PHE T 20 78.780 -3.635 -8.828 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.838 -2.823 -7.690 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.910 -0.463 -6.806 1.00 0.00 H new ATOM 0 HD2 PHE T 20 76.466 -3.617 -8.400 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.937 0.468 -5.626 1.00 0.00 H new ATOM 0 HE2 PHE T 20 74.494 -2.683 -7.220 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.730 -0.642 -5.835 1.00 0.00 H new ATOM 325 N LYS T 21 81.003 -3.262 -10.540 1.00 0.00 N ATOM 326 CA LYS T 21 82.299 -3.726 -11.029 1.00 0.00 C ATOM 327 C LYS T 21 83.017 -2.616 -11.792 1.00 0.00 C ATOM 328 O LYS T 21 84.230 -2.673 -11.991 1.00 0.00 O ATOM 329 CB LYS T 21 82.109 -4.939 -11.942 1.00 0.00 C ATOM 330 CG LYS T 21 81.516 -6.100 -11.137 1.00 0.00 C ATOM 331 CD LYS T 21 81.675 -7.406 -11.921 1.00 0.00 C ATOM 332 CE LYS T 21 80.836 -7.345 -13.199 1.00 0.00 C ATOM 333 NZ LYS T 21 80.698 -8.716 -13.766 1.00 0.00 N ATOM 0 H LYS T 21 80.238 -3.923 -10.672 1.00 0.00 H new ATOM 0 HA LYS T 21 82.908 -4.010 -10.171 1.00 0.00 H new ATOM 0 HB2 LYS T 21 81.449 -4.683 -12.771 1.00 0.00 H new ATOM 0 HB3 LYS T 21 83.065 -5.234 -12.375 1.00 0.00 H new ATOM 0 HG2 LYS T 21 82.018 -6.180 -10.173 1.00 0.00 H new ATOM 0 HG3 LYS T 21 80.462 -5.913 -10.933 1.00 0.00 H new ATOM 0 HD2 LYS T 21 82.724 -7.566 -12.170 1.00 0.00 H new ATOM 0 HD3 LYS T 21 81.360 -8.250 -11.308 1.00 0.00 H new ATOM 0 HE2 LYS T 21 79.852 -6.929 -12.982 1.00 0.00 H new ATOM 0 HE3 LYS T 21 81.308 -6.685 -13.926 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 80.128 -8.677 -14.635 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 81.640 -9.097 -13.987 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 80.229 -9.333 -13.072 1.00 0.00 H new ATOM 347 N ALA T 22 82.260 -1.608 -12.214 1.00 0.00 N ATOM 348 CA ALA T 22 82.837 -0.488 -12.952 1.00 0.00 C ATOM 349 C ALA T 22 83.490 0.501 -11.992 1.00 0.00 C ATOM 350 O ALA T 22 84.523 1.093 -12.304 1.00 0.00 O ATOM 351 CB ALA T 22 81.748 0.222 -13.758 1.00 0.00 C ATOM 0 H ALA T 22 81.254 -1.543 -12.060 1.00 0.00 H new ATOM 0 HA ALA T 22 83.596 -0.874 -13.632 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.186 1.056 -14.306 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.301 -0.480 -14.462 1.00 0.00 H new ATOM 0 HB3 ALA T 22 80.980 0.596 -13.081 1.00 0.00 H new ATOM 357 N ALA T 23 82.880 0.675 -10.824 1.00 0.00 N ATOM 358 CA ALA T 23 83.412 1.596 -9.827 1.00 0.00 C ATOM 359 C ALA T 23 84.770 1.117 -9.325 1.00 0.00 C ATOM 360 O ALA T 23 85.728 1.887 -9.266 1.00 0.00 O ATOM 361 CB ALA T 23 82.442 1.709 -8.649 1.00 0.00 C ATOM 0 H ALA T 23 82.024 0.195 -10.546 1.00 0.00 H new ATOM 0 HA ALA T 23 83.534 2.574 -10.293 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.847 2.399 -7.909 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.481 2.081 -9.004 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.306 0.728 -8.194 1.00 0.00 H new ATOM 367 N PHE T 24 84.847 -0.162 -8.966 1.00 0.00 N ATOM 368 CA PHE T 24 86.097 -0.734 -8.472 1.00 0.00 C ATOM 369 C PHE T 24 87.270 -0.284 -9.336 1.00 0.00 C ATOM 370 O PHE T 24 88.283 0.190 -8.825 1.00 0.00 O ATOM 371 CB PHE T 24 86.011 -2.265 -8.478 1.00 0.00 C ATOM 372 CG PHE T 24 85.128 -2.731 -7.344 1.00 0.00 C ATOM 373 CD1 PHE T 24 83.739 -2.782 -7.513 1.00 0.00 C ATOM 374 CD2 PHE T 24 85.698 -3.112 -6.123 1.00 0.00 C ATOM 375 CE1 PHE T 24 82.921 -3.216 -6.463 1.00 0.00 C ATOM 376 CE2 PHE T 24 84.880 -3.545 -5.073 1.00 0.00 C ATOM 377 CZ PHE T 24 83.492 -3.597 -5.243 1.00 0.00 C ATOM 0 H PHE T 24 84.066 -0.817 -9.007 1.00 0.00 H new ATOM 0 HA PHE T 24 86.257 -0.384 -7.452 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.610 -2.612 -9.430 1.00 0.00 H new ATOM 0 HB3 PHE T 24 87.007 -2.695 -8.376 1.00 0.00 H new ATOM 0 HD1 PHE T 24 83.298 -2.486 -8.454 1.00 0.00 H new ATOM 0 HD2 PHE T 24 86.769 -3.072 -5.991 1.00 0.00 H new ATOM 0 HE1 PHE T 24 81.850 -3.257 -6.594 1.00 0.00 H new ATOM 0 HE2 PHE T 24 85.320 -3.839 -4.132 1.00 0.00 H new ATOM 0 HZ PHE T 24 82.861 -3.931 -4.433 1.00 0.00 H new ATOM 387 N ASP T 25 87.123 -0.433 -10.649 1.00 0.00 N ATOM 388 CA ASP T 25 88.178 -0.034 -11.573 1.00 0.00 C ATOM 389 C ASP T 25 88.671 1.371 -11.238 1.00 0.00 C ATOM 390 O ASP T 25 89.867 1.652 -11.306 1.00 0.00 O ATOM 391 CB ASP T 25 87.655 -0.066 -13.010 1.00 0.00 C ATOM 392 CG ASP T 25 87.073 -1.439 -13.323 1.00 0.00 C ATOM 393 OD1 ASP T 25 86.635 -2.100 -12.396 1.00 0.00 O ATOM 394 OD2 ASP T 25 87.075 -1.812 -14.484 1.00 0.00 O ATOM 0 H ASP T 25 86.292 -0.823 -11.093 1.00 0.00 H new ATOM 0 HA ASP T 25 89.008 -0.734 -11.477 1.00 0.00 H new ATOM 0 HB2 ASP T 25 86.892 0.701 -13.145 1.00 0.00 H new ATOM 0 HB3 ASP T 25 88.463 0.162 -13.705 1.00 0.00 H new ATOM 399 N ILE T 26 87.740 2.246 -10.873 1.00 0.00 N ATOM 400 CA ILE T 26 88.090 3.619 -10.526 1.00 0.00 C ATOM 401 C ILE T 26 88.881 3.653 -9.222 1.00 0.00 C ATOM 402 O ILE T 26 89.812 4.445 -9.071 1.00 0.00 O ATOM 403 CB ILE T 26 86.821 4.463 -10.380 1.00 0.00 C ATOM 404 CG1 ILE T 26 85.865 4.166 -11.543 1.00 0.00 C ATOM 405 CG2 ILE T 26 87.188 5.949 -10.386 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.606 4.293 -12.878 1.00 0.00 C ATOM 0 H ILE T 26 86.745 2.032 -10.810 1.00 0.00 H new ATOM 0 HA ILE T 26 88.707 4.031 -11.325 1.00 0.00 H new ATOM 0 HB ILE T 26 86.331 4.215 -9.438 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.455 3.161 -11.440 1.00 0.00 H new ATOM 0 HG13 ILE T 26 85.023 4.858 -11.518 1.00 0.00 H new ATOM 0 HG21 ILE T 26 86.283 6.548 -10.282 1.00 0.00 H new ATOM 0 HG22 ILE T 26 87.861 6.161 -9.555 1.00 0.00 H new ATOM 0 HG23 ILE T 26 87.682 6.198 -11.325 1.00 0.00 H new ATOM 0 HD11 ILE T 26 85.919 4.080 -13.697 1.00 0.00 H new ATOM 0 HD12 ILE T 26 86.994 5.306 -12.984 1.00 0.00 H new ATOM 0 HD13 ILE T 26 87.433 3.583 -12.904 1.00 0.00 H new ATOM 418 N PHE T 27 88.507 2.787 -8.286 1.00 0.00 N ATOM 419 CA PHE T 27 89.194 2.725 -7.001 1.00 0.00 C ATOM 420 C PHE T 27 90.573 2.092 -7.170 1.00 0.00 C ATOM 421 O PHE T 27 91.597 2.740 -6.946 1.00 0.00 O ATOM 422 CB PHE T 27 88.369 1.901 -6.004 1.00 0.00 C ATOM 423 CG PHE T 27 87.191 2.713 -5.519 1.00 0.00 C ATOM 424 CD1 PHE T 27 87.358 3.634 -4.477 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.932 2.546 -6.109 1.00 0.00 C ATOM 426 CE1 PHE T 27 86.267 4.386 -4.025 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.841 3.298 -5.656 1.00 0.00 C ATOM 428 CZ PHE T 27 85.009 4.218 -4.615 1.00 0.00 C ATOM 0 H PHE T 27 87.739 2.124 -8.391 1.00 0.00 H new ATOM 0 HA PHE T 27 89.312 3.739 -6.620 1.00 0.00 H new ATOM 0 HB2 PHE T 27 88.019 0.984 -6.478 1.00 0.00 H new ATOM 0 HB3 PHE T 27 88.991 1.606 -5.159 1.00 0.00 H new ATOM 0 HD1 PHE T 27 88.329 3.764 -4.022 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.802 1.837 -6.913 1.00 0.00 H new ATOM 0 HE1 PHE T 27 86.396 5.096 -3.221 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.870 3.168 -6.110 1.00 0.00 H new ATOM 0 HZ PHE T 27 84.168 4.799 -4.267 1.00 0.00 H new ATOM 438 N VAL T 28 90.590 0.822 -7.568 1.00 0.00 N ATOM 439 CA VAL T 28 91.846 0.100 -7.768 1.00 0.00 C ATOM 440 C VAL T 28 92.329 0.254 -9.208 1.00 0.00 C ATOM 441 O VAL T 28 92.435 -0.727 -9.945 1.00 0.00 O ATOM 442 CB VAL T 28 91.644 -1.383 -7.455 1.00 0.00 C ATOM 443 CG1 VAL T 28 91.507 -1.572 -5.944 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.373 -1.882 -8.146 1.00 0.00 C ATOM 0 H VAL T 28 89.752 0.272 -7.758 1.00 0.00 H new ATOM 0 HA VAL T 28 92.597 0.518 -7.098 1.00 0.00 H new ATOM 0 HB VAL T 28 92.502 -1.949 -7.817 1.00 0.00 H new ATOM 0 HG11 VAL T 28 91.363 -2.629 -5.721 1.00 0.00 H new ATOM 0 HG12 VAL T 28 92.411 -1.217 -5.449 1.00 0.00 H new ATOM 0 HG13 VAL T 28 90.649 -1.005 -5.583 1.00 0.00 H new ATOM 0 HG21 VAL T 28 90.229 -2.939 -7.923 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.516 -1.315 -7.784 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.468 -1.748 -9.224 1.00 0.00 H new ATOM 454 N LEU T 29 92.619 1.491 -9.603 1.00 0.00 N ATOM 455 CA LEU T 29 93.091 1.764 -10.960 1.00 0.00 C ATOM 456 C LEU T 29 94.606 1.577 -11.049 1.00 0.00 C ATOM 457 O LEU T 29 95.259 2.142 -11.926 1.00 0.00 O ATOM 458 CB LEU T 29 92.710 3.198 -11.374 1.00 0.00 C ATOM 459 CG LEU T 29 92.815 4.144 -10.172 1.00 0.00 C ATOM 460 CD1 LEU T 29 94.207 4.041 -9.544 1.00 0.00 C ATOM 461 CD2 LEU T 29 92.578 5.582 -10.643 1.00 0.00 C ATOM 0 H LEU T 29 92.537 2.316 -9.008 1.00 0.00 H new ATOM 0 HA LEU T 29 92.614 1.059 -11.641 1.00 0.00 H new ATOM 0 HB2 LEU T 29 93.368 3.540 -12.173 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.694 3.212 -11.769 1.00 0.00 H new ATOM 0 HG LEU T 29 92.067 3.866 -9.429 1.00 0.00 H new ATOM 0 HD11 LEU T 29 94.272 4.716 -8.691 1.00 0.00 H new ATOM 0 HD12 LEU T 29 94.381 3.018 -9.211 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.960 4.315 -10.282 1.00 0.00 H new ATOM 0 HD21 LEU T 29 92.651 6.260 -9.793 1.00 0.00 H new ATOM 0 HD22 LEU T 29 93.329 5.850 -11.386 1.00 0.00 H new ATOM 0 HD23 LEU T 29 91.585 5.661 -11.085 1.00 0.00 H new ATOM 473 N GLY T 30 95.157 0.780 -10.139 1.00 0.00 N ATOM 474 CA GLY T 30 96.594 0.530 -10.131 1.00 0.00 C ATOM 475 C GLY T 30 97.015 -0.225 -8.875 1.00 0.00 C ATOM 476 O GLY T 30 98.198 -0.271 -8.535 1.00 0.00 O ATOM 0 H GLY T 30 94.636 0.300 -9.404 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.871 -0.046 -11.014 1.00 0.00 H new ATOM 0 HA3 GLY T 30 97.131 1.477 -10.186 1.00 0.00 H new ATOM 480 N ALA T 31 96.042 -0.818 -8.187 1.00 0.00 N ATOM 481 CA ALA T 31 96.327 -1.570 -6.969 1.00 0.00 C ATOM 482 C ALA T 31 96.781 -2.986 -7.308 1.00 0.00 C ATOM 483 O ALA T 31 96.551 -3.474 -8.415 1.00 0.00 O ATOM 484 CB ALA T 31 95.077 -1.629 -6.088 1.00 0.00 C ATOM 0 H ALA T 31 95.057 -0.793 -8.450 1.00 0.00 H new ATOM 0 HA ALA T 31 97.128 -1.064 -6.430 1.00 0.00 H new ATOM 0 HB1 ALA T 31 95.297 -2.192 -5.181 1.00 0.00 H new ATOM 0 HB2 ALA T 31 94.771 -0.617 -5.822 1.00 0.00 H new ATOM 0 HB3 ALA T 31 94.271 -2.120 -6.633 1.00 0.00 H new ATOM 490 N GLU T 32 97.425 -3.642 -6.347 1.00 0.00 N ATOM 491 CA GLU T 32 97.907 -5.002 -6.556 1.00 0.00 C ATOM 492 C GLU T 32 96.744 -5.942 -6.862 1.00 0.00 C ATOM 493 O GLU T 32 96.456 -6.231 -8.023 1.00 0.00 O ATOM 494 CB GLU T 32 98.645 -5.492 -5.308 1.00 0.00 C ATOM 495 CG GLU T 32 99.880 -4.620 -5.071 1.00 0.00 C ATOM 496 CD GLU T 32 100.555 -5.018 -3.763 1.00 0.00 C ATOM 497 OE1 GLU T 32 100.041 -5.902 -3.099 1.00 0.00 O ATOM 498 OE2 GLU T 32 101.576 -4.432 -3.445 1.00 0.00 O ATOM 0 H GLU T 32 97.624 -3.257 -5.423 1.00 0.00 H new ATOM 0 HA GLU T 32 98.590 -4.998 -7.405 1.00 0.00 H new ATOM 0 HB2 GLU T 32 97.985 -5.449 -4.442 1.00 0.00 H new ATOM 0 HB3 GLU T 32 98.941 -6.534 -5.433 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.579 -4.732 -5.900 1.00 0.00 H new ATOM 0 HG3 GLU T 32 99.592 -3.569 -5.037 1.00 0.00 H new ATOM 505 N ASP T 33 96.080 -6.415 -5.812 1.00 0.00 N ATOM 506 CA ASP T 33 94.950 -7.322 -5.980 1.00 0.00 C ATOM 507 C ASP T 33 93.698 -6.548 -6.387 1.00 0.00 C ATOM 508 O ASP T 33 93.547 -6.158 -7.544 1.00 0.00 O ATOM 509 CB ASP T 33 94.689 -8.078 -4.674 1.00 0.00 C ATOM 510 CG ASP T 33 94.725 -7.110 -3.496 1.00 0.00 C ATOM 511 OD1 ASP T 33 94.512 -5.929 -3.718 1.00 0.00 O ATOM 512 OD2 ASP T 33 94.965 -7.564 -2.390 1.00 0.00 O ATOM 0 H ASP T 33 96.302 -6.188 -4.843 1.00 0.00 H new ATOM 0 HA ASP T 33 95.192 -8.035 -6.768 1.00 0.00 H new ATOM 0 HB2 ASP T 33 93.719 -8.574 -4.719 1.00 0.00 H new ATOM 0 HB3 ASP T 33 95.439 -8.857 -4.539 1.00 0.00 H new ATOM 517 N GLY T 34 92.804 -6.333 -5.427 1.00 0.00 N ATOM 518 CA GLY T 34 91.566 -5.605 -5.694 1.00 0.00 C ATOM 519 C GLY T 34 91.004 -5.005 -4.409 1.00 0.00 C ATOM 520 O GLY T 34 89.792 -4.851 -4.263 1.00 0.00 O ATOM 0 H GLY T 34 92.911 -6.650 -4.463 1.00 0.00 H new ATOM 0 HA2 GLY T 34 91.753 -4.813 -6.419 1.00 0.00 H new ATOM 0 HA3 GLY T 34 90.832 -6.277 -6.139 1.00 0.00 H new ATOM 524 N SER T 35 91.895 -4.668 -3.481 1.00 0.00 N ATOM 525 CA SER T 35 91.482 -4.084 -2.208 1.00 0.00 C ATOM 526 C SER T 35 91.264 -2.583 -2.355 1.00 0.00 C ATOM 527 O SER T 35 91.669 -1.982 -3.349 1.00 0.00 O ATOM 528 CB SER T 35 92.549 -4.346 -1.145 1.00 0.00 C ATOM 529 OG SER T 35 93.831 -4.052 -1.684 1.00 0.00 O ATOM 0 H SER T 35 92.903 -4.788 -3.585 1.00 0.00 H new ATOM 0 HA SER T 35 90.544 -4.547 -1.902 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.362 -3.730 -0.266 1.00 0.00 H new ATOM 0 HB3 SER T 35 92.508 -5.386 -0.821 1.00 0.00 H new ATOM 0 HG SER T 35 94.113 -4.782 -2.273 1.00 0.00 H new ATOM 535 N ILE T 36 90.622 -1.979 -1.355 1.00 0.00 N ATOM 536 CA ILE T 36 90.350 -0.541 -1.373 1.00 0.00 C ATOM 537 C ILE T 36 90.634 0.073 -0.006 1.00 0.00 C ATOM 538 O ILE T 36 89.751 0.143 0.849 1.00 0.00 O ATOM 539 CB ILE T 36 88.888 -0.290 -1.747 1.00 0.00 C ATOM 540 CG1 ILE T 36 88.542 -1.069 -3.019 1.00 0.00 C ATOM 541 CG2 ILE T 36 88.675 1.205 -1.991 1.00 0.00 C ATOM 542 CD1 ILE T 36 87.056 -0.892 -3.336 1.00 0.00 C ATOM 0 H ILE T 36 90.281 -2.462 -0.524 1.00 0.00 H new ATOM 0 HA ILE T 36 91.001 -0.077 -2.114 1.00 0.00 H new ATOM 0 HB ILE T 36 88.244 -0.622 -0.933 1.00 0.00 H new ATOM 0 HG12 ILE T 36 89.148 -0.713 -3.852 1.00 0.00 H new ATOM 0 HG13 ILE T 36 88.773 -2.126 -2.885 1.00 0.00 H new ATOM 0 HG21 ILE T 36 87.634 1.385 -2.258 1.00 0.00 H new ATOM 0 HG22 ILE T 36 88.919 1.760 -1.085 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.320 1.536 -2.804 1.00 0.00 H new ATOM 0 HD11 ILE T 36 86.809 -1.446 -4.241 1.00 0.00 H new ATOM 0 HD12 ILE T 36 86.459 -1.269 -2.505 1.00 0.00 H new ATOM 0 HD13 ILE T 36 86.840 0.166 -3.487 1.00 0.00 H new ATOM 554 N SER T 37 91.870 0.517 0.193 1.00 0.00 N ATOM 555 CA SER T 37 92.260 1.125 1.461 1.00 0.00 C ATOM 556 C SER T 37 91.793 2.576 1.523 1.00 0.00 C ATOM 557 O SER T 37 91.074 3.045 0.641 1.00 0.00 O ATOM 558 CB SER T 37 93.779 1.069 1.621 1.00 0.00 C ATOM 559 OG SER T 37 94.130 1.508 2.927 1.00 0.00 O ATOM 0 H SER T 37 92.615 0.468 -0.502 1.00 0.00 H new ATOM 0 HA SER T 37 91.789 0.568 2.271 1.00 0.00 H new ATOM 0 HB2 SER T 37 94.136 0.052 1.458 1.00 0.00 H new ATOM 0 HB3 SER T 37 94.259 1.699 0.872 1.00 0.00 H new ATOM 0 HG SER T 37 95.103 1.472 3.034 1.00 0.00 H new ATOM 565 N THR T 38 92.206 3.281 2.571 1.00 0.00 N ATOM 566 CA THR T 38 91.823 4.679 2.739 1.00 0.00 C ATOM 567 C THR T 38 92.571 5.563 1.746 1.00 0.00 C ATOM 568 O THR T 38 92.272 6.750 1.610 1.00 0.00 O ATOM 569 CB THR T 38 92.132 5.137 4.165 1.00 0.00 C ATOM 570 OG1 THR T 38 93.539 5.165 4.358 1.00 0.00 O ATOM 571 CG2 THR T 38 91.498 4.167 5.164 1.00 0.00 C ATOM 0 H THR T 38 92.802 2.911 3.312 1.00 0.00 H new ATOM 0 HA THR T 38 90.753 4.768 2.553 1.00 0.00 H new ATOM 0 HB THR T 38 91.723 6.135 4.322 1.00 0.00 H new ATOM 0 HG1 THR T 38 93.738 5.460 5.271 1.00 0.00 H new ATOM 0 HG21 THR T 38 91.719 4.495 6.180 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.418 4.147 5.016 1.00 0.00 H new ATOM 0 HG23 THR T 38 91.904 3.168 5.009 1.00 0.00 H new ATOM 579 N LYS T 39 93.545 4.979 1.055 1.00 0.00 N ATOM 580 CA LYS T 39 94.331 5.725 0.078 1.00 0.00 C ATOM 581 C LYS T 39 93.573 5.851 -1.240 1.00 0.00 C ATOM 582 O LYS T 39 93.425 6.949 -1.778 1.00 0.00 O ATOM 583 CB LYS T 39 95.665 5.016 -0.167 1.00 0.00 C ATOM 584 CG LYS T 39 96.498 5.041 1.116 1.00 0.00 C ATOM 585 CD LYS T 39 97.898 4.495 0.826 1.00 0.00 C ATOM 586 CE LYS T 39 98.797 4.716 2.044 1.00 0.00 C ATOM 587 NZ LYS T 39 100.079 3.979 1.857 1.00 0.00 N ATOM 0 H LYS T 39 93.808 3.998 1.152 1.00 0.00 H new ATOM 0 HA LYS T 39 94.514 6.724 0.475 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.490 3.987 -0.480 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.207 5.507 -0.975 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.565 6.059 1.499 1.00 0.00 H new ATOM 0 HG3 LYS T 39 96.015 4.442 1.888 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.843 3.432 0.590 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.321 4.994 -0.046 1.00 0.00 H new ATOM 0 HE2 LYS T 39 98.993 5.780 2.176 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.295 4.370 2.947 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.690 4.129 2.685 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.883 2.963 1.751 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.560 4.330 1.004 1.00 0.00 H new ATOM 601 N GLU T 40 93.099 4.723 -1.757 1.00 0.00 N ATOM 602 CA GLU T 40 92.362 4.721 -3.017 1.00 0.00 C ATOM 603 C GLU T 40 90.920 5.172 -2.801 1.00 0.00 C ATOM 604 O GLU T 40 90.137 5.251 -3.748 1.00 0.00 O ATOM 605 CB GLU T 40 92.371 3.315 -3.625 1.00 0.00 C ATOM 606 CG GLU T 40 93.807 2.793 -3.686 1.00 0.00 C ATOM 607 CD GLU T 40 94.667 3.726 -4.532 1.00 0.00 C ATOM 608 OE1 GLU T 40 94.688 3.548 -5.739 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.290 4.606 -3.961 1.00 0.00 O ATOM 0 H GLU T 40 93.210 3.804 -1.328 1.00 0.00 H new ATOM 0 HA GLU T 40 92.849 5.418 -3.699 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.755 2.645 -3.026 1.00 0.00 H new ATOM 0 HB3 GLU T 40 91.938 3.337 -4.625 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.219 2.719 -2.679 1.00 0.00 H new ATOM 0 HG3 GLU T 40 93.820 1.789 -4.110 1.00 0.00 H new ATOM 616 N LEU T 41 90.575 5.463 -1.551 1.00 0.00 N ATOM 617 CA LEU T 41 89.222 5.902 -1.224 1.00 0.00 C ATOM 618 C LEU T 41 89.044 7.382 -1.565 1.00 0.00 C ATOM 619 O LEU T 41 88.217 7.743 -2.402 1.00 0.00 O ATOM 620 CB LEU T 41 88.953 5.667 0.276 1.00 0.00 C ATOM 621 CG LEU T 41 87.446 5.482 0.548 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.653 6.635 -0.077 1.00 0.00 C ATOM 623 CD2 LEU T 41 86.947 4.136 -0.022 1.00 0.00 C ATOM 0 H LEU T 41 91.208 5.404 -0.753 1.00 0.00 H new ATOM 0 HA LEU T 41 88.509 5.325 -1.813 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.497 4.785 0.612 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.329 6.512 0.853 1.00 0.00 H new ATOM 0 HG LEU T 41 87.291 5.481 1.627 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.590 6.495 0.121 1.00 0.00 H new ATOM 0 HD12 LEU T 41 86.981 7.580 0.357 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.823 6.652 -1.154 1.00 0.00 H new ATOM 0 HD21 LEU T 41 85.882 4.027 0.182 1.00 0.00 H new ATOM 0 HD22 LEU T 41 87.115 4.112 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.492 3.317 0.448 1.00 0.00 H new ATOM 635 N GLY T 42 89.823 8.232 -0.903 1.00 0.00 N ATOM 636 CA GLY T 42 89.743 9.671 -1.132 1.00 0.00 C ATOM 637 C GLY T 42 89.813 10.004 -2.620 1.00 0.00 C ATOM 638 O GLY T 42 89.060 10.845 -3.112 1.00 0.00 O ATOM 0 H GLY T 42 90.514 7.951 -0.207 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.812 10.056 -0.715 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.558 10.170 -0.607 1.00 0.00 H new ATOM 642 N LYS T 43 90.723 9.345 -3.330 1.00 0.00 N ATOM 643 CA LYS T 43 90.888 9.588 -4.762 1.00 0.00 C ATOM 644 C LYS T 43 89.534 9.700 -5.458 1.00 0.00 C ATOM 645 O LYS T 43 89.269 10.675 -6.161 1.00 0.00 O ATOM 646 CB LYS T 43 91.695 8.452 -5.397 1.00 0.00 C ATOM 647 CG LYS T 43 93.117 8.454 -4.830 1.00 0.00 C ATOM 648 CD LYS T 43 94.008 7.548 -5.681 1.00 0.00 C ATOM 649 CE LYS T 43 95.456 7.659 -5.201 1.00 0.00 C ATOM 650 NZ LYS T 43 96.344 6.881 -6.109 1.00 0.00 N ATOM 0 H LYS T 43 91.354 8.643 -2.943 1.00 0.00 H new ATOM 0 HA LYS T 43 91.422 10.530 -4.885 1.00 0.00 H new ATOM 0 HB2 LYS T 43 91.214 7.495 -5.197 1.00 0.00 H new ATOM 0 HB3 LYS T 43 91.724 8.574 -6.480 1.00 0.00 H new ATOM 0 HG2 LYS T 43 93.515 9.469 -4.822 1.00 0.00 H new ATOM 0 HG3 LYS T 43 93.108 8.106 -3.797 1.00 0.00 H new ATOM 0 HD2 LYS T 43 93.668 6.515 -5.609 1.00 0.00 H new ATOM 0 HD3 LYS T 43 93.939 7.834 -6.731 1.00 0.00 H new ATOM 0 HE2 LYS T 43 95.764 8.704 -5.182 1.00 0.00 H new ATOM 0 HE3 LYS T 43 95.542 7.283 -4.182 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 97.328 6.957 -5.781 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 96.055 5.882 -6.106 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 96.270 7.260 -7.075 1.00 0.00 H new ATOM 664 N VAL T 44 88.682 8.700 -5.259 1.00 0.00 N ATOM 665 CA VAL T 44 87.362 8.704 -5.879 1.00 0.00 C ATOM 666 C VAL T 44 86.504 9.833 -5.315 1.00 0.00 C ATOM 667 O VAL T 44 85.961 10.645 -6.063 1.00 0.00 O ATOM 668 CB VAL T 44 86.667 7.362 -5.642 1.00 0.00 C ATOM 669 CG1 VAL T 44 85.255 7.406 -6.230 1.00 0.00 C ATOM 670 CG2 VAL T 44 87.467 6.246 -6.319 1.00 0.00 C ATOM 0 H VAL T 44 88.879 7.884 -4.679 1.00 0.00 H new ATOM 0 HA VAL T 44 87.488 8.862 -6.950 1.00 0.00 H new ATOM 0 HB VAL T 44 86.608 7.169 -4.571 1.00 0.00 H new ATOM 0 HG11 VAL T 44 84.760 6.450 -6.061 1.00 0.00 H new ATOM 0 HG12 VAL T 44 84.685 8.200 -5.748 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.313 7.600 -7.301 1.00 0.00 H new ATOM 0 HG21 VAL T 44 86.972 5.290 -6.150 1.00 0.00 H new ATOM 0 HG22 VAL T 44 87.527 6.440 -7.390 1.00 0.00 H new ATOM 0 HG23 VAL T 44 88.472 6.213 -5.899 1.00 0.00 H new ATOM 680 N MET T 45 86.387 9.877 -3.992 1.00 0.00 N ATOM 681 CA MET T 45 85.590 10.913 -3.341 1.00 0.00 C ATOM 682 C MET T 45 85.977 12.294 -3.862 1.00 0.00 C ATOM 683 O MET T 45 85.238 13.263 -3.687 1.00 0.00 O ATOM 684 CB MET T 45 85.799 10.860 -1.828 1.00 0.00 C ATOM 685 CG MET T 45 85.312 9.512 -1.292 1.00 0.00 C ATOM 686 SD MET T 45 83.507 9.438 -1.398 1.00 0.00 S ATOM 687 CE MET T 45 83.284 7.927 -0.427 1.00 0.00 C ATOM 0 H MET T 45 86.829 9.215 -3.354 1.00 0.00 H new ATOM 0 HA MET T 45 84.539 10.732 -3.569 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.854 10.998 -1.591 1.00 0.00 H new ATOM 0 HB3 MET T 45 85.255 11.673 -1.346 1.00 0.00 H new ATOM 0 HG2 MET T 45 85.754 8.699 -1.867 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.632 9.382 -0.258 1.00 0.00 H new ATOM 0 HE1 MET T 45 82.229 7.805 -0.181 1.00 0.00 H new ATOM 0 HE2 MET T 45 83.623 7.069 -1.007 1.00 0.00 H new ATOM 0 HE3 MET T 45 83.865 7.996 0.493 1.00 0.00 H new ATOM 697 N ARG T 46 87.139 12.376 -4.503 1.00 0.00 N ATOM 698 CA ARG T 46 87.612 13.645 -5.046 1.00 0.00 C ATOM 699 C ARG T 46 86.591 14.225 -6.020 1.00 0.00 C ATOM 700 O ARG T 46 86.101 15.338 -5.830 1.00 0.00 O ATOM 701 CB ARG T 46 88.947 13.440 -5.765 1.00 0.00 C ATOM 702 CG ARG T 46 89.584 14.800 -6.053 1.00 0.00 C ATOM 703 CD ARG T 46 90.897 14.597 -6.813 1.00 0.00 C ATOM 704 NE ARG T 46 91.497 15.886 -7.136 1.00 0.00 N ATOM 705 CZ ARG T 46 92.558 15.972 -7.932 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.079 14.889 -8.441 1.00 0.00 N ATOM 707 NH2 ARG T 46 93.077 17.137 -8.206 1.00 0.00 N ATOM 0 H ARG T 46 87.766 11.586 -4.658 1.00 0.00 H new ATOM 0 HA ARG T 46 87.748 14.344 -4.221 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.615 12.836 -5.150 1.00 0.00 H new ATOM 0 HB3 ARG T 46 88.791 12.895 -6.696 1.00 0.00 H new ATOM 0 HG2 ARG T 46 88.903 15.416 -6.640 1.00 0.00 H new ATOM 0 HG3 ARG T 46 89.770 15.332 -5.120 1.00 0.00 H new ATOM 0 HD2 ARG T 46 91.587 14.007 -6.210 1.00 0.00 H new ATOM 0 HD3 ARG T 46 90.713 14.034 -7.728 1.00 0.00 H new ATOM 0 HE ARG T 46 91.095 16.738 -6.744 1.00 0.00 H new ATOM 0 HH11 ARG T 46 92.672 13.978 -8.228 1.00 0.00 H new ATOM 0 HH12 ARG T 46 93.893 14.953 -9.052 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.669 17.983 -7.809 1.00 0.00 H new ATOM 0 HH22 ARG T 46 93.891 17.202 -8.817 1.00 0.00 H new ATOM 721 N MET T 47 86.276 13.462 -7.061 1.00 0.00 N ATOM 722 CA MET T 47 85.311 13.911 -8.059 1.00 0.00 C ATOM 723 C MET T 47 83.998 14.309 -7.394 1.00 0.00 C ATOM 724 O MET T 47 83.278 15.176 -7.889 1.00 0.00 O ATOM 725 CB MET T 47 85.055 12.797 -9.075 1.00 0.00 C ATOM 726 CG MET T 47 86.326 12.538 -9.884 1.00 0.00 C ATOM 727 SD MET T 47 86.011 11.242 -11.107 1.00 0.00 S ATOM 728 CE MET T 47 86.438 9.831 -10.057 1.00 0.00 C ATOM 0 H MET T 47 86.670 12.538 -7.235 1.00 0.00 H new ATOM 0 HA MET T 47 85.723 14.781 -8.571 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.747 11.886 -8.561 1.00 0.00 H new ATOM 0 HB3 MET T 47 84.239 13.079 -9.741 1.00 0.00 H new ATOM 0 HG2 MET T 47 86.645 13.453 -10.383 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.137 12.237 -9.221 1.00 0.00 H new ATOM 0 HE1 MET T 47 86.313 8.907 -10.621 1.00 0.00 H new ATOM 0 HE2 MET T 47 87.474 9.920 -9.732 1.00 0.00 H new ATOM 0 HE3 MET T 47 85.784 9.815 -9.185 1.00 0.00 H new ATOM 738 N LEU T 48 83.692 13.668 -6.270 1.00 0.00 N ATOM 739 CA LEU T 48 82.460 13.962 -5.545 1.00 0.00 C ATOM 740 C LEU T 48 82.602 15.267 -4.765 1.00 0.00 C ATOM 741 O LEU T 48 81.782 15.576 -3.901 1.00 0.00 O ATOM 742 CB LEU T 48 82.134 12.816 -4.580 1.00 0.00 C ATOM 743 CG LEU T 48 81.554 11.629 -5.357 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.498 11.245 -6.501 1.00 0.00 C ATOM 745 CD2 LEU T 48 81.388 10.438 -4.408 1.00 0.00 C ATOM 0 H LEU T 48 84.275 12.947 -5.844 1.00 0.00 H new ATOM 0 HA LEU T 48 81.649 14.068 -6.265 1.00 0.00 H new ATOM 0 HB2 LEU T 48 83.035 12.509 -4.049 1.00 0.00 H new ATOM 0 HB3 LEU T 48 81.420 13.154 -3.829 1.00 0.00 H new ATOM 0 HG LEU T 48 80.585 11.906 -5.772 1.00 0.00 H new ATOM 0 HD11 LEU T 48 82.080 10.401 -7.050 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.616 12.093 -7.175 1.00 0.00 H new ATOM 0 HD13 LEU T 48 83.470 10.968 -6.093 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.976 9.591 -4.956 1.00 0.00 H new ATOM 0 HD22 LEU T 48 82.359 10.165 -3.994 1.00 0.00 H new ATOM 0 HD23 LEU T 48 80.712 10.710 -3.598 1.00 0.00 H new ATOM 757 N GLY T 49 83.647 16.027 -5.075 1.00 0.00 N ATOM 758 CA GLY T 49 83.885 17.295 -4.395 1.00 0.00 C ATOM 759 C GLY T 49 84.105 17.078 -2.902 1.00 0.00 C ATOM 760 O GLY T 49 83.576 17.819 -2.073 1.00 0.00 O ATOM 0 H GLY T 49 84.338 15.790 -5.787 1.00 0.00 H new ATOM 0 HA2 GLY T 49 84.757 17.786 -4.828 1.00 0.00 H new ATOM 0 HA3 GLY T 49 83.035 17.960 -4.549 1.00 0.00 H new ATOM 764 N GLN T 50 84.890 16.056 -2.567 1.00 0.00 N ATOM 765 CA GLN T 50 85.183 15.737 -1.168 1.00 0.00 C ATOM 766 C GLN T 50 86.641 15.309 -1.018 1.00 0.00 C ATOM 767 O GLN T 50 87.278 14.896 -1.986 1.00 0.00 O ATOM 768 CB GLN T 50 84.266 14.607 -0.687 1.00 0.00 C ATOM 769 CG GLN T 50 82.853 15.150 -0.459 1.00 0.00 C ATOM 770 CD GLN T 50 82.834 16.052 0.771 1.00 0.00 C ATOM 771 OE1 GLN T 50 82.266 17.144 0.733 1.00 0.00 O ATOM 772 NE2 GLN T 50 83.422 15.658 1.867 1.00 0.00 N ATOM 0 H GLN T 50 85.335 15.435 -3.243 1.00 0.00 H new ATOM 0 HA GLN T 50 85.009 16.627 -0.563 1.00 0.00 H new ATOM 0 HB2 GLN T 50 84.243 13.805 -1.425 1.00 0.00 H new ATOM 0 HB3 GLN T 50 84.655 14.179 0.237 1.00 0.00 H new ATOM 0 HG2 GLN T 50 82.523 15.708 -1.335 1.00 0.00 H new ATOM 0 HG3 GLN T 50 82.154 14.324 -0.326 1.00 0.00 H new ATOM 0 HE21 GLN T 50 83.892 14.753 1.897 1.00 0.00 H new ATOM 0 HE22 GLN T 50 83.412 16.255 2.694 1.00 0.00 H new ATOM 781 N ASN T 51 87.163 15.412 0.200 1.00 0.00 N ATOM 782 CA ASN T 51 88.548 15.033 0.459 1.00 0.00 C ATOM 783 C ASN T 51 88.843 15.057 1.957 1.00 0.00 C ATOM 784 O ASN T 51 89.671 15.839 2.423 1.00 0.00 O ATOM 785 CB ASN T 51 89.493 15.995 -0.262 1.00 0.00 C ATOM 786 CG ASN T 51 90.903 15.415 -0.292 1.00 0.00 C ATOM 787 OD1 ASN T 51 91.580 15.372 0.736 1.00 0.00 O ATOM 788 ND2 ASN T 51 91.390 14.965 -1.416 1.00 0.00 N ATOM 0 H ASN T 51 86.654 15.751 1.016 1.00 0.00 H new ATOM 0 HA ASN T 51 88.703 14.020 0.087 1.00 0.00 H new ATOM 0 HB2 ASN T 51 89.141 16.170 -1.279 1.00 0.00 H new ATOM 0 HB3 ASN T 51 89.498 16.960 0.244 1.00 0.00 H new ATOM 0 HD21 ASN T 51 92.333 14.577 -1.444 1.00 0.00 H new ATOM 0 HD22 ASN T 51 90.828 15.001 -2.266 1.00 0.00 H new ATOM 795 N PRO T 52 88.183 14.218 2.713 1.00 0.00 N ATOM 796 CA PRO T 52 88.377 14.138 4.188 1.00 0.00 C ATOM 797 C PRO T 52 89.650 13.377 4.558 1.00 0.00 C ATOM 798 O PRO T 52 90.309 12.794 3.697 1.00 0.00 O ATOM 799 CB PRO T 52 87.122 13.397 4.663 1.00 0.00 C ATOM 800 CG PRO T 52 86.751 12.508 3.517 1.00 0.00 C ATOM 801 CD PRO T 52 87.175 13.250 2.241 1.00 0.00 C ATOM 0 HA PRO T 52 88.500 15.117 4.651 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.321 12.818 5.565 1.00 0.00 H new ATOM 0 HB3 PRO T 52 86.317 14.093 4.902 1.00 0.00 H new ATOM 0 HG2 PRO T 52 87.256 11.545 3.593 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.680 12.307 3.512 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.593 12.567 1.501 1.00 0.00 H new ATOM 0 HD3 PRO T 52 86.329 13.751 1.770 1.00 0.00 H new ATOM 809 N THR T 53 89.988 13.388 5.844 1.00 0.00 N ATOM 810 CA THR T 53 91.184 12.697 6.317 1.00 0.00 C ATOM 811 C THR T 53 90.985 11.181 6.236 1.00 0.00 C ATOM 812 O THR T 53 89.855 10.697 6.301 1.00 0.00 O ATOM 813 CB THR T 53 91.485 13.102 7.772 1.00 0.00 C ATOM 814 OG1 THR T 53 92.074 12.008 8.460 1.00 0.00 O ATOM 815 CG2 THR T 53 90.187 13.502 8.480 1.00 0.00 C ATOM 0 H THR T 53 89.456 13.864 6.573 1.00 0.00 H new ATOM 0 HA THR T 53 92.025 12.980 5.684 1.00 0.00 H new ATOM 0 HB THR T 53 92.173 13.948 7.770 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.266 12.268 9.385 1.00 0.00 H new ATOM 0 HG21 THR T 53 90.407 13.787 9.509 1.00 0.00 H new ATOM 0 HG22 THR T 53 89.733 14.345 7.959 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.496 12.659 8.477 1.00 0.00 H new ATOM 823 N PRO T 54 92.050 10.425 6.100 1.00 0.00 N ATOM 824 CA PRO T 54 91.965 8.934 6.014 1.00 0.00 C ATOM 825 C PRO T 54 91.540 8.312 7.344 1.00 0.00 C ATOM 826 O PRO T 54 91.300 7.108 7.430 1.00 0.00 O ATOM 827 CB PRO T 54 93.393 8.512 5.625 1.00 0.00 C ATOM 828 CG PRO T 54 94.269 9.612 6.135 1.00 0.00 C ATOM 829 CD PRO T 54 93.446 10.896 6.011 1.00 0.00 C ATOM 0 HA PRO T 54 91.215 8.599 5.298 1.00 0.00 H new ATOM 0 HB2 PRO T 54 93.659 7.555 6.074 1.00 0.00 H new ATOM 0 HB3 PRO T 54 93.491 8.396 4.546 1.00 0.00 H new ATOM 0 HG2 PRO T 54 94.559 9.432 7.170 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.189 9.680 5.554 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.682 11.602 6.807 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.638 11.405 5.066 1.00 0.00 H new ATOM 837 N GLU T 55 91.448 9.144 8.378 1.00 0.00 N ATOM 838 CA GLU T 55 91.048 8.671 9.700 1.00 0.00 C ATOM 839 C GLU T 55 89.528 8.604 9.810 1.00 0.00 C ATOM 840 O GLU T 55 88.983 7.753 10.511 1.00 0.00 O ATOM 841 CB GLU T 55 91.598 9.607 10.777 1.00 0.00 C ATOM 842 CG GLU T 55 91.421 8.964 12.154 1.00 0.00 C ATOM 843 CD GLU T 55 91.845 9.943 13.244 1.00 0.00 C ATOM 844 OE1 GLU T 55 92.578 10.866 12.932 1.00 0.00 O ATOM 845 OE2 GLU T 55 91.430 9.754 14.376 1.00 0.00 O ATOM 0 H GLU T 55 91.644 10.144 8.327 1.00 0.00 H new ATOM 0 HA GLU T 55 91.455 7.670 9.845 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.653 9.811 10.592 1.00 0.00 H new ATOM 0 HB3 GLU T 55 91.078 10.564 10.742 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.380 8.674 12.298 1.00 0.00 H new ATOM 0 HG3 GLU T 55 92.017 8.054 12.219 1.00 0.00 H new ATOM 852 N GLU T 56 88.849 9.512 9.113 1.00 0.00 N ATOM 853 CA GLU T 56 87.391 9.549 9.141 1.00 0.00 C ATOM 854 C GLU T 56 86.806 8.491 8.209 1.00 0.00 C ATOM 855 O GLU T 56 85.791 7.871 8.522 1.00 0.00 O ATOM 856 CB GLU T 56 86.896 10.936 8.719 1.00 0.00 C ATOM 857 CG GLU T 56 87.156 11.939 9.845 1.00 0.00 C ATOM 858 CD GLU T 56 86.697 13.329 9.420 1.00 0.00 C ATOM 859 OE1 GLU T 56 87.375 13.933 8.606 1.00 0.00 O ATOM 860 OE2 GLU T 56 85.672 13.770 9.917 1.00 0.00 O ATOM 0 H GLU T 56 89.281 10.226 8.527 1.00 0.00 H new ATOM 0 HA GLU T 56 87.061 9.339 10.159 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.406 11.254 7.810 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.831 10.899 8.490 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.626 11.632 10.747 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.218 11.957 10.090 1.00 0.00 H new ATOM 867 N LEU T 57 87.453 8.290 7.065 1.00 0.00 N ATOM 868 CA LEU T 57 86.982 7.303 6.100 1.00 0.00 C ATOM 869 C LEU T 57 87.093 5.894 6.676 1.00 0.00 C ATOM 870 O LEU T 57 86.179 5.082 6.531 1.00 0.00 O ATOM 871 CB LEU T 57 87.805 7.394 4.808 1.00 0.00 C ATOM 872 CG LEU T 57 87.584 8.760 4.133 1.00 0.00 C ATOM 873 CD1 LEU T 57 88.739 9.047 3.167 1.00 0.00 C ATOM 874 CD2 LEU T 57 86.263 8.764 3.348 1.00 0.00 C ATOM 0 H LEU T 57 88.296 8.792 6.786 1.00 0.00 H new ATOM 0 HA LEU T 57 85.936 7.513 5.879 1.00 0.00 H new ATOM 0 HB2 LEU T 57 88.863 7.257 5.032 1.00 0.00 H new ATOM 0 HB3 LEU T 57 87.517 6.593 4.127 1.00 0.00 H new ATOM 0 HG LEU T 57 87.543 9.527 4.906 1.00 0.00 H new ATOM 0 HD11 LEU T 57 88.582 10.014 2.689 1.00 0.00 H new ATOM 0 HD12 LEU T 57 89.679 9.063 3.718 1.00 0.00 H new ATOM 0 HD13 LEU T 57 88.778 8.268 2.405 1.00 0.00 H new ATOM 0 HD21 LEU T 57 86.122 9.737 2.877 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.293 7.991 2.581 1.00 0.00 H new ATOM 0 HD23 LEU T 57 85.435 8.567 4.029 1.00 0.00 H new ATOM 886 N GLN T 58 88.214 5.611 7.331 1.00 0.00 N ATOM 887 CA GLN T 58 88.428 4.296 7.925 1.00 0.00 C ATOM 888 C GLN T 58 87.193 3.861 8.709 1.00 0.00 C ATOM 889 O GLN T 58 86.951 2.668 8.893 1.00 0.00 O ATOM 890 CB GLN T 58 89.654 4.335 8.848 1.00 0.00 C ATOM 891 CG GLN T 58 89.762 3.034 9.657 1.00 0.00 C ATOM 892 CD GLN T 58 89.633 1.821 8.740 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.680 1.051 8.856 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.543 1.600 7.830 1.00 0.00 N ATOM 0 H GLN T 58 88.983 6.268 7.464 1.00 0.00 H new ATOM 0 HA GLN T 58 88.605 3.573 7.128 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.558 4.477 8.256 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.579 5.186 9.525 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.718 3.002 10.179 1.00 0.00 H new ATOM 0 HG3 GLN T 58 88.982 3.006 10.418 1.00 0.00 H new ATOM 0 HE21 GLN T 58 91.333 2.238 7.733 1.00 0.00 H new ATOM 0 HE22 GLN T 58 90.464 0.790 7.216 1.00 0.00 H new ATOM 903 N GLU T 59 86.414 4.836 9.166 1.00 0.00 N ATOM 904 CA GLU T 59 85.204 4.539 9.927 1.00 0.00 C ATOM 905 C GLU T 59 84.253 3.680 9.098 1.00 0.00 C ATOM 906 O GLU T 59 83.618 2.763 9.616 1.00 0.00 O ATOM 907 CB GLU T 59 84.504 5.839 10.328 1.00 0.00 C ATOM 908 CG GLU T 59 85.459 6.697 11.160 1.00 0.00 C ATOM 909 CD GLU T 59 84.792 8.021 11.517 1.00 0.00 C ATOM 910 OE1 GLU T 59 83.578 8.095 11.421 1.00 0.00 O ATOM 911 OE2 GLU T 59 85.504 8.942 11.881 1.00 0.00 O ATOM 0 H GLU T 59 86.596 5.830 9.025 1.00 0.00 H new ATOM 0 HA GLU T 59 85.486 3.990 10.825 1.00 0.00 H new ATOM 0 HB2 GLU T 59 84.189 6.385 9.438 1.00 0.00 H new ATOM 0 HB3 GLU T 59 83.604 5.618 10.901 1.00 0.00 H new ATOM 0 HG2 GLU T 59 85.741 6.165 12.069 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.376 6.881 10.601 1.00 0.00 H new ATOM 918 N MET T 60 84.163 3.985 7.808 1.00 0.00 N ATOM 919 CA MET T 60 83.288 3.234 6.914 1.00 0.00 C ATOM 920 C MET T 60 83.823 1.820 6.712 1.00 0.00 C ATOM 921 O MET T 60 83.056 0.861 6.630 1.00 0.00 O ATOM 922 CB MET T 60 83.189 3.944 5.561 1.00 0.00 C ATOM 923 CG MET T 60 82.330 5.203 5.701 1.00 0.00 C ATOM 924 SD MET T 60 80.582 4.736 5.764 1.00 0.00 S ATOM 925 CE MET T 60 80.283 4.742 3.979 1.00 0.00 C ATOM 0 H MET T 60 84.681 4.741 7.360 1.00 0.00 H new ATOM 0 HA MET T 60 82.297 3.177 7.365 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.184 4.209 5.205 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.753 3.275 4.819 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.605 5.746 6.605 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.508 5.873 4.860 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.393 4.153 3.757 1.00 0.00 H new ATOM 0 HE2 MET T 60 80.134 5.767 3.639 1.00 0.00 H new ATOM 0 HE3 MET T 60 81.142 4.310 3.465 1.00 0.00 H new ATOM 935 N ILE T 61 85.144 1.699 6.632 1.00 0.00 N ATOM 936 CA ILE T 61 85.773 0.398 6.439 1.00 0.00 C ATOM 937 C ILE T 61 85.701 -0.417 7.729 1.00 0.00 C ATOM 938 O ILE T 61 85.605 -1.644 7.695 1.00 0.00 O ATOM 939 CB ILE T 61 87.235 0.581 6.015 1.00 0.00 C ATOM 940 CG1 ILE T 61 87.293 1.172 4.600 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.950 -0.775 6.019 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.719 2.595 4.587 1.00 0.00 C ATOM 0 H ILE T 61 85.796 2.481 6.697 1.00 0.00 H new ATOM 0 HA ILE T 61 85.240 -0.138 5.654 1.00 0.00 H new ATOM 0 HB ILE T 61 87.725 1.256 6.716 1.00 0.00 H new ATOM 0 HG12 ILE T 61 88.324 1.187 4.248 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.730 0.540 3.913 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.989 -0.640 5.717 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.916 -1.201 7.022 1.00 0.00 H new ATOM 0 HG23 ILE T 61 87.454 -1.450 5.321 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.768 2.998 3.575 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.681 2.572 4.918 1.00 0.00 H new ATOM 0 HD13 ILE T 61 87.300 3.228 5.258 1.00 0.00 H new ATOM 954 N ASP T 62 85.750 0.273 8.864 1.00 0.00 N ATOM 955 CA ASP T 62 85.692 -0.396 10.158 1.00 0.00 C ATOM 956 C ASP T 62 84.257 -0.785 10.499 1.00 0.00 C ATOM 957 O ASP T 62 83.799 -0.583 11.624 1.00 0.00 O ATOM 958 CB ASP T 62 86.245 0.525 11.247 1.00 0.00 C ATOM 959 CG ASP T 62 86.230 -0.192 12.593 1.00 0.00 C ATOM 960 OD1 ASP T 62 87.003 -1.121 12.756 1.00 0.00 O ATOM 961 OD2 ASP T 62 85.445 0.198 13.441 1.00 0.00 O ATOM 0 H ASP T 62 85.829 1.289 8.914 1.00 0.00 H new ATOM 0 HA ASP T 62 86.298 -1.301 10.104 1.00 0.00 H new ATOM 0 HB2 ASP T 62 87.262 0.827 10.998 1.00 0.00 H new ATOM 0 HB3 ASP T 62 85.647 1.435 11.304 1.00 0.00 H new ATOM 966 N GLU T 63 83.550 -1.346 9.520 1.00 0.00 N ATOM 967 CA GLU T 63 82.163 -1.764 9.722 1.00 0.00 C ATOM 968 C GLU T 63 81.838 -2.972 8.849 1.00 0.00 C ATOM 969 O GLU T 63 81.320 -3.978 9.334 1.00 0.00 O ATOM 970 CB GLU T 63 81.214 -0.615 9.375 1.00 0.00 C ATOM 971 CG GLU T 63 81.334 0.490 10.429 1.00 0.00 C ATOM 972 CD GLU T 63 80.262 1.550 10.199 1.00 0.00 C ATOM 973 OE1 GLU T 63 79.597 1.479 9.178 1.00 0.00 O ATOM 974 OE2 GLU T 63 80.123 2.416 11.047 1.00 0.00 O ATOM 0 H GLU T 63 83.912 -1.521 8.583 1.00 0.00 H new ATOM 0 HA GLU T 63 82.034 -2.038 10.769 1.00 0.00 H new ATOM 0 HB2 GLU T 63 81.454 -0.218 8.389 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.188 -0.979 9.331 1.00 0.00 H new ATOM 0 HG2 GLU T 63 81.228 0.065 11.427 1.00 0.00 H new ATOM 0 HG3 GLU T 63 82.323 0.945 10.380 1.00 0.00 H new ATOM 981 N VAL T 64 82.146 -2.866 7.561 1.00 0.00 N ATOM 982 CA VAL T 64 81.882 -3.957 6.630 1.00 0.00 C ATOM 983 C VAL T 64 82.946 -5.043 6.761 1.00 0.00 C ATOM 984 O VAL T 64 82.643 -6.234 6.687 1.00 0.00 O ATOM 985 CB VAL T 64 81.864 -3.430 5.195 1.00 0.00 C ATOM 986 CG1 VAL T 64 80.740 -2.405 5.041 1.00 0.00 C ATOM 987 CG2 VAL T 64 83.206 -2.764 4.879 1.00 0.00 C ATOM 0 H VAL T 64 82.576 -2.042 7.140 1.00 0.00 H new ATOM 0 HA VAL T 64 80.909 -4.385 6.871 1.00 0.00 H new ATOM 0 HB VAL T 64 81.697 -4.259 4.507 1.00 0.00 H new ATOM 0 HG11 VAL T 64 80.728 -2.030 4.018 1.00 0.00 H new ATOM 0 HG12 VAL T 64 79.784 -2.877 5.266 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.906 -1.576 5.729 1.00 0.00 H new ATOM 0 HG21 VAL T 64 83.194 -2.388 3.856 1.00 0.00 H new ATOM 0 HG22 VAL T 64 83.372 -1.936 5.568 1.00 0.00 H new ATOM 0 HG23 VAL T 64 84.009 -3.493 4.988 1.00 0.00 H new ATOM 997 N ASP T 65 84.192 -4.624 6.957 1.00 0.00 N ATOM 998 CA ASP T 65 85.292 -5.572 7.095 1.00 0.00 C ATOM 999 C ASP T 65 85.056 -6.493 8.289 1.00 0.00 C ATOM 1000 O ASP T 65 85.629 -6.295 9.360 1.00 0.00 O ATOM 1001 CB ASP T 65 86.614 -4.820 7.277 1.00 0.00 C ATOM 1002 CG ASP T 65 87.072 -4.235 5.945 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.331 -4.352 4.983 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.158 -3.681 5.906 1.00 0.00 O ATOM 0 H ASP T 65 84.464 -3.643 7.023 1.00 0.00 H new ATOM 0 HA ASP T 65 85.343 -6.176 6.189 1.00 0.00 H new ATOM 0 HB2 ASP T 65 86.490 -4.023 8.010 1.00 0.00 H new ATOM 0 HB3 ASP T 65 87.375 -5.496 7.667 1.00 0.00 H new ATOM 1009 N GLU T 66 84.213 -7.502 8.095 1.00 0.00 N ATOM 1010 CA GLU T 66 83.913 -8.448 9.163 1.00 0.00 C ATOM 1011 C GLU T 66 85.095 -9.384 9.388 1.00 0.00 C ATOM 1012 O GLU T 66 84.926 -10.598 9.506 1.00 0.00 O ATOM 1013 CB GLU T 66 82.671 -9.266 8.804 1.00 0.00 C ATOM 1014 CG GLU T 66 81.425 -8.386 8.930 1.00 0.00 C ATOM 1015 CD GLU T 66 81.135 -8.101 10.400 1.00 0.00 C ATOM 1016 OE1 GLU T 66 81.410 -8.965 11.216 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.643 -7.022 10.688 1.00 0.00 O ATOM 0 H GLU T 66 83.729 -7.685 7.216 1.00 0.00 H new ATOM 0 HA GLU T 66 83.724 -7.889 10.079 1.00 0.00 H new ATOM 0 HB2 GLU T 66 82.757 -9.650 7.787 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.588 -10.129 9.464 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.575 -7.450 8.392 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.570 -8.884 8.472 1.00 0.00 H new ATOM 1024 N ASP T 67 86.294 -8.811 9.444 1.00 0.00 N ATOM 1025 CA ASP T 67 87.503 -9.602 9.654 1.00 0.00 C ATOM 1026 C ASP T 67 88.629 -8.725 10.195 1.00 0.00 C ATOM 1027 O ASP T 67 89.572 -9.221 10.812 1.00 0.00 O ATOM 1028 CB ASP T 67 87.940 -10.243 8.336 1.00 0.00 C ATOM 1029 CG ASP T 67 88.025 -9.182 7.244 1.00 0.00 C ATOM 1030 OD1 ASP T 67 88.925 -8.361 7.313 1.00 0.00 O ATOM 1031 OD2 ASP T 67 87.191 -9.206 6.355 1.00 0.00 O ATOM 0 H ASP T 67 86.454 -7.808 9.348 1.00 0.00 H new ATOM 0 HA ASP T 67 87.284 -10.382 10.383 1.00 0.00 H new ATOM 0 HB2 ASP T 67 88.909 -10.727 8.461 1.00 0.00 H new ATOM 0 HB3 ASP T 67 87.231 -11.019 8.047 1.00 0.00 H new ATOM 1036 N GLY T 68 88.521 -7.421 9.961 1.00 0.00 N ATOM 1037 CA GLY T 68 89.536 -6.481 10.429 1.00 0.00 C ATOM 1038 C GLY T 68 90.714 -6.421 9.463 1.00 0.00 C ATOM 1039 O GLY T 68 91.844 -6.138 9.864 1.00 0.00 O ATOM 0 H GLY T 68 87.747 -6.992 9.454 1.00 0.00 H new ATOM 0 HA2 GLY T 68 89.097 -5.489 10.534 1.00 0.00 H new ATOM 0 HA3 GLY T 68 89.886 -6.781 11.417 1.00 0.00 H new ATOM 1043 N SER T 69 90.445 -6.689 8.188 1.00 0.00 N ATOM 1044 CA SER T 69 91.491 -6.663 7.171 1.00 0.00 C ATOM 1045 C SER T 69 91.747 -5.234 6.700 1.00 0.00 C ATOM 1046 O SER T 69 92.864 -4.888 6.316 1.00 0.00 O ATOM 1047 CB SER T 69 91.081 -7.526 5.978 1.00 0.00 C ATOM 1048 OG SER T 69 89.807 -7.104 5.509 1.00 0.00 O ATOM 0 H SER T 69 89.517 -6.925 7.836 1.00 0.00 H new ATOM 0 HA SER T 69 92.406 -7.059 7.610 1.00 0.00 H new ATOM 0 HB2 SER T 69 91.821 -7.441 5.182 1.00 0.00 H new ATOM 0 HB3 SER T 69 91.045 -8.576 6.269 1.00 0.00 H new ATOM 0 HG SER T 69 89.107 -7.465 6.092 1.00 0.00 H new ATOM 1054 N GLY T 70 90.705 -4.410 6.733 1.00 0.00 N ATOM 1055 CA GLY T 70 90.828 -3.022 6.305 1.00 0.00 C ATOM 1056 C GLY T 70 90.815 -2.920 4.784 1.00 0.00 C ATOM 1057 O GLY T 70 91.580 -2.155 4.196 1.00 0.00 O ATOM 0 H GLY T 70 89.773 -4.677 7.049 1.00 0.00 H new ATOM 0 HA2 GLY T 70 90.009 -2.435 6.720 1.00 0.00 H new ATOM 0 HA3 GLY T 70 91.753 -2.598 6.694 1.00 0.00 H new ATOM 1061 N THR T 71 89.941 -3.700 4.150 1.00 0.00 N ATOM 1062 CA THR T 71 89.835 -3.695 2.693 1.00 0.00 C ATOM 1063 C THR T 71 88.431 -4.103 2.255 1.00 0.00 C ATOM 1064 O THR T 71 87.926 -5.152 2.655 1.00 0.00 O ATOM 1065 CB THR T 71 90.855 -4.666 2.091 1.00 0.00 C ATOM 1066 OG1 THR T 71 90.673 -5.953 2.664 1.00 0.00 O ATOM 1067 CG2 THR T 71 92.274 -4.173 2.382 1.00 0.00 C ATOM 0 H THR T 71 89.300 -4.340 4.619 1.00 0.00 H new ATOM 0 HA THR T 71 90.038 -2.684 2.339 1.00 0.00 H new ATOM 0 HB THR T 71 90.709 -4.721 1.012 1.00 0.00 H new ATOM 0 HG1 THR T 71 89.717 -6.118 2.800 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.996 -4.867 1.952 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.413 -3.186 1.942 1.00 0.00 H new ATOM 0 HG23 THR T 71 92.425 -4.115 3.460 1.00 0.00 H new ATOM 1075 N VAL T 72 87.807 -3.267 1.430 1.00 0.00 N ATOM 1076 CA VAL T 72 86.460 -3.548 0.937 1.00 0.00 C ATOM 1077 C VAL T 72 86.522 -4.431 -0.304 1.00 0.00 C ATOM 1078 O VAL T 72 86.548 -3.935 -1.431 1.00 0.00 O ATOM 1079 CB VAL T 72 85.743 -2.236 0.601 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.369 -2.537 -0.007 1.00 0.00 C ATOM 1081 CG2 VAL T 72 85.566 -1.413 1.881 1.00 0.00 C ATOM 0 H VAL T 72 88.209 -2.394 1.090 1.00 0.00 H new ATOM 0 HA VAL T 72 85.907 -4.073 1.716 1.00 0.00 H new ATOM 0 HB VAL T 72 86.338 -1.673 -0.118 1.00 0.00 H new ATOM 0 HG11 VAL T 72 83.863 -1.601 -0.244 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.495 -3.123 -0.918 1.00 0.00 H new ATOM 0 HG13 VAL T 72 83.771 -3.102 0.708 1.00 0.00 H new ATOM 0 HG21 VAL T 72 85.056 -0.479 1.645 1.00 0.00 H new ATOM 0 HG22 VAL T 72 84.972 -1.979 2.599 1.00 0.00 H new ATOM 0 HG23 VAL T 72 86.543 -1.194 2.311 1.00 0.00 H new ATOM 1091 N ASP T 73 86.549 -5.742 -0.091 1.00 0.00 N ATOM 1092 CA ASP T 73 86.609 -6.687 -1.200 1.00 0.00 C ATOM 1093 C ASP T 73 85.363 -6.558 -2.073 1.00 0.00 C ATOM 1094 O ASP T 73 84.736 -5.500 -2.115 1.00 0.00 O ATOM 1095 CB ASP T 73 86.729 -8.116 -0.661 1.00 0.00 C ATOM 1096 CG ASP T 73 85.521 -8.453 0.207 1.00 0.00 C ATOM 1097 OD1 ASP T 73 84.421 -8.084 -0.171 1.00 0.00 O ATOM 1098 OD2 ASP T 73 85.713 -9.077 1.238 1.00 0.00 O ATOM 0 H ASP T 73 86.530 -6.173 0.833 1.00 0.00 H new ATOM 0 HA ASP T 73 87.485 -6.462 -1.808 1.00 0.00 H new ATOM 0 HB2 ASP T 73 86.799 -8.821 -1.490 1.00 0.00 H new ATOM 0 HB3 ASP T 73 87.645 -8.217 -0.078 1.00 0.00 H new ATOM 1103 N PHE T 74 85.007 -7.636 -2.771 1.00 0.00 N ATOM 1104 CA PHE T 74 83.830 -7.632 -3.643 1.00 0.00 C ATOM 1105 C PHE T 74 82.662 -8.347 -2.970 1.00 0.00 C ATOM 1106 O PHE T 74 81.532 -8.304 -3.456 1.00 0.00 O ATOM 1107 CB PHE T 74 84.162 -8.334 -4.962 1.00 0.00 C ATOM 1108 CG PHE T 74 82.934 -8.360 -5.841 1.00 0.00 C ATOM 1109 CD1 PHE T 74 82.595 -7.234 -6.602 1.00 0.00 C ATOM 1110 CD2 PHE T 74 82.135 -9.507 -5.895 1.00 0.00 C ATOM 1111 CE1 PHE T 74 81.457 -7.258 -7.418 1.00 0.00 C ATOM 1112 CE2 PHE T 74 80.996 -9.531 -6.710 1.00 0.00 C ATOM 1113 CZ PHE T 74 80.658 -8.405 -7.472 1.00 0.00 C ATOM 0 H PHE T 74 85.514 -8.521 -2.751 1.00 0.00 H new ATOM 0 HA PHE T 74 83.546 -6.598 -3.837 1.00 0.00 H new ATOM 0 HB2 PHE T 74 84.974 -7.813 -5.469 1.00 0.00 H new ATOM 0 HB3 PHE T 74 84.506 -9.350 -4.769 1.00 0.00 H new ATOM 0 HD1 PHE T 74 83.211 -6.348 -6.560 1.00 0.00 H new ATOM 0 HD2 PHE T 74 82.397 -10.375 -5.308 1.00 0.00 H new ATOM 0 HE1 PHE T 74 81.196 -6.390 -8.006 1.00 0.00 H new ATOM 0 HE2 PHE T 74 80.379 -10.417 -6.751 1.00 0.00 H new ATOM 0 HZ PHE T 74 79.780 -8.423 -8.101 1.00 0.00 H new ATOM 1123 N ASP T 75 82.944 -9.008 -1.850 1.00 0.00 N ATOM 1124 CA ASP T 75 81.909 -9.734 -1.116 1.00 0.00 C ATOM 1125 C ASP T 75 81.151 -8.801 -0.177 1.00 0.00 C ATOM 1126 O ASP T 75 80.120 -8.238 -0.545 1.00 0.00 O ATOM 1127 CB ASP T 75 82.547 -10.865 -0.305 1.00 0.00 C ATOM 1128 CG ASP T 75 83.049 -11.959 -1.242 1.00 0.00 C ATOM 1129 OD1 ASP T 75 84.156 -11.824 -1.737 1.00 0.00 O ATOM 1130 OD2 ASP T 75 82.321 -12.916 -1.448 1.00 0.00 O ATOM 0 H ASP T 75 83.873 -9.056 -1.433 1.00 0.00 H new ATOM 0 HA ASP T 75 81.205 -10.148 -1.837 1.00 0.00 H new ATOM 0 HB2 ASP T 75 83.374 -10.476 0.289 1.00 0.00 H new ATOM 0 HB3 ASP T 75 81.819 -11.278 0.393 1.00 0.00 H new ATOM 1135 N GLU T 76 81.666 -8.647 1.039 1.00 0.00 N ATOM 1136 CA GLU T 76 81.027 -7.784 2.028 1.00 0.00 C ATOM 1137 C GLU T 76 80.587 -6.464 1.397 1.00 0.00 C ATOM 1138 O GLU T 76 79.761 -5.744 1.956 1.00 0.00 O ATOM 1139 CB GLU T 76 81.993 -7.511 3.186 1.00 0.00 C ATOM 1140 CG GLU T 76 83.383 -7.197 2.629 1.00 0.00 C ATOM 1141 CD GLU T 76 84.338 -6.867 3.771 1.00 0.00 C ATOM 1142 OE1 GLU T 76 84.529 -7.719 4.622 1.00 0.00 O ATOM 1143 OE2 GLU T 76 84.865 -5.767 3.776 1.00 0.00 O ATOM 0 H GLU T 76 82.518 -9.105 1.362 1.00 0.00 H new ATOM 0 HA GLU T 76 80.142 -8.295 2.408 1.00 0.00 H new ATOM 0 HB2 GLU T 76 81.632 -6.675 3.785 1.00 0.00 H new ATOM 0 HB3 GLU T 76 82.041 -8.378 3.845 1.00 0.00 H new ATOM 0 HG2 GLU T 76 83.759 -8.050 2.064 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.326 -6.357 1.937 1.00 0.00 H new ATOM 1150 N PHE T 77 81.144 -6.154 0.231 1.00 0.00 N ATOM 1151 CA PHE T 77 80.796 -4.919 -0.463 1.00 0.00 C ATOM 1152 C PHE T 77 79.281 -4.785 -0.580 1.00 0.00 C ATOM 1153 O PHE T 77 78.745 -3.677 -0.593 1.00 0.00 O ATOM 1154 CB PHE T 77 81.430 -4.907 -1.857 1.00 0.00 C ATOM 1155 CG PHE T 77 80.957 -3.691 -2.627 1.00 0.00 C ATOM 1156 CD1 PHE T 77 81.255 -2.406 -2.154 1.00 0.00 C ATOM 1157 CD2 PHE T 77 80.222 -3.848 -3.810 1.00 0.00 C ATOM 1158 CE1 PHE T 77 80.818 -1.281 -2.865 1.00 0.00 C ATOM 1159 CE2 PHE T 77 79.787 -2.722 -4.519 1.00 0.00 C ATOM 1160 CZ PHE T 77 80.085 -1.439 -4.046 1.00 0.00 C ATOM 0 H PHE T 77 81.832 -6.734 -0.250 1.00 0.00 H new ATOM 0 HA PHE T 77 81.179 -4.075 0.111 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.517 -4.895 -1.772 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.163 -5.816 -2.396 1.00 0.00 H new ATOM 0 HD1 PHE T 77 81.821 -2.283 -1.242 1.00 0.00 H new ATOM 0 HD2 PHE T 77 79.991 -4.838 -4.175 1.00 0.00 H new ATOM 0 HE1 PHE T 77 81.047 -0.290 -2.501 1.00 0.00 H new ATOM 0 HE2 PHE T 77 79.221 -2.843 -5.431 1.00 0.00 H new ATOM 0 HZ PHE T 77 79.749 -0.571 -4.593 1.00 0.00 H new ATOM 1170 N LEU T 78 78.597 -5.921 -0.663 1.00 0.00 N ATOM 1171 CA LEU T 78 77.143 -5.919 -0.777 1.00 0.00 C ATOM 1172 C LEU T 78 76.506 -5.666 0.587 1.00 0.00 C ATOM 1173 O LEU T 78 75.690 -4.757 0.744 1.00 0.00 O ATOM 1174 CB LEU T 78 76.658 -7.261 -1.330 1.00 0.00 C ATOM 1175 CG LEU T 78 77.512 -7.666 -2.535 1.00 0.00 C ATOM 1176 CD1 LEU T 78 77.034 -9.022 -3.061 1.00 0.00 C ATOM 1177 CD2 LEU T 78 77.380 -6.613 -3.641 1.00 0.00 C ATOM 0 H LEU T 78 79.022 -6.848 -0.654 1.00 0.00 H new ATOM 0 HA LEU T 78 76.849 -5.122 -1.460 1.00 0.00 H new ATOM 0 HB2 LEU T 78 76.718 -8.026 -0.556 1.00 0.00 H new ATOM 0 HB3 LEU T 78 75.611 -7.186 -1.624 1.00 0.00 H new ATOM 0 HG LEU T 78 78.556 -7.738 -2.231 1.00 0.00 H new ATOM 0 HD11 LEU T 78 77.640 -9.314 -3.919 1.00 0.00 H new ATOM 0 HD12 LEU T 78 77.132 -9.772 -2.276 1.00 0.00 H new ATOM 0 HD13 LEU T 78 75.989 -8.947 -3.363 1.00 0.00 H new ATOM 0 HD21 LEU T 78 77.989 -6.905 -4.496 1.00 0.00 H new ATOM 0 HD22 LEU T 78 76.337 -6.536 -3.948 1.00 0.00 H new ATOM 0 HD23 LEU T 78 77.720 -5.647 -3.267 1.00 0.00 H new ATOM 1189 N VAL T 79 76.887 -6.473 1.571 1.00 0.00 N ATOM 1190 CA VAL T 79 76.349 -6.326 2.919 1.00 0.00 C ATOM 1191 C VAL T 79 76.478 -4.880 3.388 1.00 0.00 C ATOM 1192 O VAL T 79 75.905 -4.493 4.406 1.00 0.00 O ATOM 1193 CB VAL T 79 77.103 -7.245 3.882 1.00 0.00 C ATOM 1194 CG1 VAL T 79 76.463 -7.174 5.271 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.041 -8.685 3.364 1.00 0.00 C ATOM 0 H VAL T 79 77.561 -7.231 1.463 1.00 0.00 H new ATOM 0 HA VAL T 79 75.294 -6.601 2.905 1.00 0.00 H new ATOM 0 HB VAL T 79 78.143 -6.925 3.948 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.003 -7.830 5.954 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.508 -6.149 5.640 1.00 0.00 H new ATOM 0 HG13 VAL T 79 75.422 -7.492 5.209 1.00 0.00 H new ATOM 0 HG21 VAL T 79 77.578 -9.341 4.049 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.001 -9.003 3.297 1.00 0.00 H new ATOM 0 HG23 VAL T 79 77.500 -8.737 2.377 1.00 0.00 H new ATOM 1205 N MET T 80 77.236 -4.089 2.637 1.00 0.00 N ATOM 1206 CA MET T 80 77.441 -2.686 2.981 1.00 0.00 C ATOM 1207 C MET T 80 76.158 -1.885 2.784 1.00 0.00 C ATOM 1208 O MET T 80 75.575 -1.382 3.744 1.00 0.00 O ATOM 1209 CB MET T 80 78.552 -2.099 2.108 1.00 0.00 C ATOM 1210 CG MET T 80 78.859 -0.667 2.551 1.00 0.00 C ATOM 1211 SD MET T 80 80.444 -0.149 1.847 1.00 0.00 S ATOM 1212 CE MET T 80 80.417 1.559 2.445 1.00 0.00 C ATOM 0 H MET T 80 77.717 -4.393 1.790 1.00 0.00 H new ATOM 0 HA MET T 80 77.728 -2.627 4.031 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.449 -2.713 2.184 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.248 -2.108 1.061 1.00 0.00 H new ATOM 0 HG2 MET T 80 78.066 0.005 2.224 1.00 0.00 H new ATOM 0 HG3 MET T 80 78.896 -0.611 3.639 1.00 0.00 H new ATOM 0 HE1 MET T 80 80.866 2.213 1.698 1.00 0.00 H new ATOM 0 HE2 MET T 80 79.386 1.866 2.624 1.00 0.00 H new ATOM 0 HE3 MET T 80 80.982 1.628 3.374 1.00 0.00 H new ATOM 1222 N MET T 81 75.727 -1.764 1.531 1.00 0.00 N ATOM 1223 CA MET T 81 74.515 -1.015 1.214 1.00 0.00 C ATOM 1224 C MET T 81 73.270 -1.867 1.451 1.00 0.00 C ATOM 1225 O MET T 81 72.264 -1.378 1.965 1.00 0.00 O ATOM 1226 CB MET T 81 74.558 -0.558 -0.248 1.00 0.00 C ATOM 1227 CG MET T 81 75.550 0.601 -0.399 1.00 0.00 C ATOM 1228 SD MET T 81 76.050 0.745 -2.135 1.00 0.00 S ATOM 1229 CE MET T 81 77.580 -0.218 -2.020 1.00 0.00 C ATOM 0 H MET T 81 76.196 -2.173 0.723 1.00 0.00 H new ATOM 0 HA MET T 81 74.466 -0.145 1.869 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.853 -1.388 -0.890 1.00 0.00 H new ATOM 0 HB3 MET T 81 73.565 -0.244 -0.570 1.00 0.00 H new ATOM 0 HG2 MET T 81 75.093 1.531 -0.063 1.00 0.00 H new ATOM 0 HG3 MET T 81 76.424 0.430 0.229 1.00 0.00 H new ATOM 0 HE1 MET T 81 77.813 -0.649 -2.994 1.00 0.00 H new ATOM 0 HE2 MET T 81 78.396 0.432 -1.706 1.00 0.00 H new ATOM 0 HE3 MET T 81 77.452 -1.018 -1.291 1.00 0.00 H new ATOM 1239 N VAL T 82 73.343 -3.140 1.073 1.00 0.00 N ATOM 1240 CA VAL T 82 72.210 -4.045 1.248 1.00 0.00 C ATOM 1241 C VAL T 82 71.585 -3.866 2.630 1.00 0.00 C ATOM 1242 O VAL T 82 70.375 -4.015 2.797 1.00 0.00 O ATOM 1243 CB VAL T 82 72.668 -5.494 1.074 1.00 0.00 C ATOM 1244 CG1 VAL T 82 71.501 -6.441 1.364 1.00 0.00 C ATOM 1245 CG2 VAL T 82 73.147 -5.706 -0.364 1.00 0.00 C ATOM 0 H VAL T 82 74.166 -3.566 0.647 1.00 0.00 H new ATOM 0 HA VAL T 82 71.461 -3.808 0.493 1.00 0.00 H new ATOM 0 HB VAL T 82 73.483 -5.701 1.767 1.00 0.00 H new ATOM 0 HG11 VAL T 82 71.830 -7.473 1.239 1.00 0.00 H new ATOM 0 HG12 VAL T 82 71.156 -6.291 2.387 1.00 0.00 H new ATOM 0 HG13 VAL T 82 70.684 -6.234 0.672 1.00 0.00 H new ATOM 0 HG21 VAL T 82 73.474 -6.738 -0.490 1.00 0.00 H new ATOM 0 HG22 VAL T 82 72.330 -5.497 -1.054 1.00 0.00 H new ATOM 0 HG23 VAL T 82 73.979 -5.034 -0.573 1.00 0.00 H new ATOM 1255 N ARG T 83 72.417 -3.544 3.615 1.00 0.00 N ATOM 1256 CA ARG T 83 71.931 -3.346 4.977 1.00 0.00 C ATOM 1257 C ARG T 83 71.282 -1.973 5.119 1.00 0.00 C ATOM 1258 O ARG T 83 70.168 -1.851 5.627 1.00 0.00 O ATOM 1259 CB ARG T 83 73.090 -3.473 5.970 1.00 0.00 C ATOM 1260 CG ARG T 83 73.494 -4.941 6.104 1.00 0.00 C ATOM 1261 CD ARG T 83 74.637 -5.066 7.112 1.00 0.00 C ATOM 1262 NE ARG T 83 74.232 -4.524 8.404 1.00 0.00 N ATOM 1263 CZ ARG T 83 75.133 -4.146 9.305 1.00 0.00 C ATOM 1264 NH1 ARG T 83 76.406 -4.260 9.042 1.00 0.00 N ATOM 1265 NH2 ARG T 83 74.745 -3.662 10.454 1.00 0.00 N ATOM 0 H ARG T 83 73.422 -3.415 3.498 1.00 0.00 H new ATOM 0 HA ARG T 83 71.185 -4.111 5.192 1.00 0.00 H new ATOM 0 HB2 ARG T 83 73.940 -2.881 5.630 1.00 0.00 H new ATOM 0 HB3 ARG T 83 72.794 -3.077 6.942 1.00 0.00 H new ATOM 0 HG2 ARG T 83 72.641 -5.536 6.430 1.00 0.00 H new ATOM 0 HG3 ARG T 83 73.804 -5.334 5.136 1.00 0.00 H new ATOM 0 HD2 ARG T 83 74.922 -6.112 7.222 1.00 0.00 H new ATOM 0 HD3 ARG T 83 75.515 -4.534 6.745 1.00 0.00 H new ATOM 0 HE ARG T 83 73.239 -4.433 8.620 1.00 0.00 H new ATOM 0 HH11 ARG T 83 76.709 -4.639 8.145 1.00 0.00 H new ATOM 0 HH12 ARG T 83 77.098 -3.970 9.733 1.00 0.00 H new ATOM 0 HH21 ARG T 83 73.750 -3.574 10.660 1.00 0.00 H new ATOM 0 HH22 ARG T 83 75.437 -3.372 11.145 1.00 0.00 H new ATOM 1279 N SER T 84 71.989 -0.941 4.667 1.00 0.00 N ATOM 1280 CA SER T 84 71.472 0.419 4.749 1.00 0.00 C ATOM 1281 C SER T 84 70.217 0.569 3.894 1.00 0.00 C ATOM 1282 O SER T 84 69.369 1.419 4.163 1.00 0.00 O ATOM 1283 CB SER T 84 72.535 1.412 4.274 1.00 0.00 C ATOM 1284 OG SER T 84 73.743 1.180 4.987 1.00 0.00 O ATOM 0 H SER T 84 72.914 -1.020 4.244 1.00 0.00 H new ATOM 0 HA SER T 84 71.218 0.628 5.788 1.00 0.00 H new ATOM 0 HB2 SER T 84 72.703 1.298 3.203 1.00 0.00 H new ATOM 0 HB3 SER T 84 72.193 2.434 4.436 1.00 0.00 H new ATOM 0 HG SER T 84 74.428 1.813 4.685 1.00 0.00 H new ATOM 1290 N MET T 85 70.107 -0.264 2.864 1.00 0.00 N ATOM 1291 CA MET T 85 68.951 -0.217 1.976 1.00 0.00 C ATOM 1292 C MET T 85 67.755 -0.914 2.615 1.00 0.00 C ATOM 1293 O MET T 85 66.694 -0.313 2.789 1.00 0.00 O ATOM 1294 CB MET T 85 69.287 -0.894 0.645 1.00 0.00 C ATOM 1295 CG MET T 85 70.252 -0.011 -0.148 1.00 0.00 C ATOM 1296 SD MET T 85 70.717 -0.852 -1.682 1.00 0.00 S ATOM 1297 CE MET T 85 69.383 -0.197 -2.713 1.00 0.00 C ATOM 0 H MET T 85 70.799 -0.975 2.625 1.00 0.00 H new ATOM 0 HA MET T 85 68.696 0.828 1.798 1.00 0.00 H new ATOM 0 HB2 MET T 85 69.736 -1.871 0.825 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.376 -1.063 0.071 1.00 0.00 H new ATOM 0 HG2 MET T 85 69.783 0.947 -0.374 1.00 0.00 H new ATOM 0 HG3 MET T 85 71.140 0.201 0.447 1.00 0.00 H new ATOM 0 HE1 MET T 85 69.476 -0.593 -3.724 1.00 0.00 H new ATOM 0 HE2 MET T 85 68.421 -0.493 -2.295 1.00 0.00 H new ATOM 0 HE3 MET T 85 69.447 0.891 -2.742 1.00 0.00 H new ATOM 1307 N LYS T 86 67.933 -2.184 2.964 1.00 0.00 N ATOM 1308 CA LYS T 86 66.860 -2.953 3.584 1.00 0.00 C ATOM 1309 C LYS T 86 66.301 -2.214 4.795 1.00 0.00 C ATOM 1310 O LYS T 86 65.139 -2.391 5.161 1.00 0.00 O ATOM 1311 CB LYS T 86 67.383 -4.324 4.017 1.00 0.00 C ATOM 1312 CG LYS T 86 66.204 -5.237 4.358 1.00 0.00 C ATOM 1313 CD LYS T 86 66.723 -6.521 5.008 1.00 0.00 C ATOM 1314 CE LYS T 86 65.573 -7.519 5.156 1.00 0.00 C ATOM 1315 NZ LYS T 86 64.346 -6.800 5.601 1.00 0.00 N ATOM 0 H LYS T 86 68.803 -2.699 2.829 1.00 0.00 H new ATOM 0 HA LYS T 86 66.062 -3.083 2.852 1.00 0.00 H new ATOM 0 HB2 LYS T 86 67.980 -4.766 3.219 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.037 -4.219 4.883 1.00 0.00 H new ATOM 0 HG2 LYS T 86 65.519 -4.726 5.034 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.642 -5.476 3.455 1.00 0.00 H new ATOM 0 HD2 LYS T 86 67.518 -6.953 4.400 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.154 -6.299 5.984 1.00 0.00 H new ATOM 0 HE2 LYS T 86 65.389 -8.021 4.206 1.00 0.00 H new ATOM 0 HE3 LYS T 86 65.838 -8.291 5.879 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 63.680 -7.478 6.022 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 64.602 -6.082 6.308 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 63.899 -6.338 4.784 1.00 0.00 H new ATOM 1329 N ASP T 87 67.135 -1.384 5.413 1.00 0.00 N ATOM 1330 CA ASP T 87 66.714 -0.622 6.582 1.00 0.00 C ATOM 1331 C ASP T 87 67.645 0.565 6.813 1.00 0.00 C ATOM 1332 O ASP T 87 68.778 0.399 7.264 1.00 0.00 O ATOM 1333 CB ASP T 87 66.715 -1.521 7.821 1.00 0.00 C ATOM 1334 CG ASP T 87 65.552 -2.504 7.752 1.00 0.00 C ATOM 1335 OD1 ASP T 87 64.424 -2.069 7.912 1.00 0.00 O ATOM 1336 OD2 ASP T 87 65.806 -3.678 7.538 1.00 0.00 O ATOM 0 H ASP T 87 68.100 -1.223 5.126 1.00 0.00 H new ATOM 0 HA ASP T 87 65.705 -0.249 6.404 1.00 0.00 H new ATOM 0 HB2 ASP T 87 67.658 -2.064 7.886 1.00 0.00 H new ATOM 0 HB3 ASP T 87 66.635 -0.913 8.722 1.00 0.00 H new ATOM 1341 N ASP T 88 67.159 1.762 6.499 1.00 0.00 N ATOM 1342 CA ASP T 88 67.956 2.969 6.676 1.00 0.00 C ATOM 1343 C ASP T 88 67.988 3.381 8.145 1.00 0.00 C ATOM 1344 O ASP T 88 67.037 3.139 8.888 1.00 0.00 O ATOM 1345 CB ASP T 88 67.373 4.108 5.838 1.00 0.00 C ATOM 1346 CG ASP T 88 65.941 4.398 6.276 1.00 0.00 C ATOM 1347 OD1 ASP T 88 65.178 3.455 6.396 1.00 0.00 O ATOM 1348 OD2 ASP T 88 65.630 5.559 6.484 1.00 0.00 O ATOM 0 H ASP T 88 66.224 1.921 6.123 1.00 0.00 H new ATOM 0 HA ASP T 88 68.974 2.760 6.347 1.00 0.00 H new ATOM 0 HB2 ASP T 88 67.985 5.003 5.950 1.00 0.00 H new ATOM 0 HB3 ASP T 88 67.392 3.840 4.782 1.00 0.00 H new ATOM 1353 N SER T 89 69.087 4.005 8.556 1.00 0.00 N ATOM 1354 CA SER T 89 69.231 4.447 9.939 1.00 0.00 C ATOM 1355 C SER T 89 70.489 5.292 10.103 1.00 0.00 C ATOM 1356 O SER T 89 70.916 5.880 9.123 1.00 0.00 O ATOM 1357 CB SER T 89 69.303 3.235 10.868 1.00 0.00 C ATOM 1358 OG SER T 89 70.619 2.699 10.840 1.00 0.00 O ATOM 1359 OXT SER T 89 71.008 5.338 11.206 1.00 0.00 O ATOM 0 H SER T 89 69.885 4.215 7.957 1.00 0.00 H new ATOM 0 HA SER T 89 68.364 5.054 10.200 1.00 0.00 H new ATOM 0 HB2 SER T 89 69.038 3.525 11.885 1.00 0.00 H new ATOM 0 HB3 SER T 89 68.583 2.479 10.554 1.00 0.00 H new ATOM 0 HG SER T 89 70.669 1.923 11.436 1.00 0.00 H new TER 1365 SER T 89 HETATM 1366 CA CA T 90 87.231 -6.983 4.652 1.00 0.00 CA HETATM 1367 S1 WW7 T 91 80.407 3.710 -5.208 1.00 0.00 S HETATM 1368 O1 WW7 T 91 81.230 3.549 -6.360 1.00 0.00 O HETATM 1369 O2 WW7 T 91 79.658 4.940 -5.114 1.00 0.00 O HETATM 1370 N1 WW7 T 91 79.261 2.404 -5.234 1.00 0.00 N HETATM 1371 C4 WW7 T 91 82.984 3.389 -1.270 1.00 0.00 C HETATM 1372 C3 WW7 T 91 82.108 4.524 -1.516 1.00 0.00 C HETATM 1373 C2 WW7 T 91 81.321 4.612 -2.745 1.00 0.00 C HETATM 1374 C1 WW7 T 91 81.391 3.560 -3.751 1.00 0.00 C HETATM 1375 C9 WW7 T 91 82.263 2.412 -3.538 1.00 0.00 C HETATM 1376 C10 WW7 T 91 83.079 2.326 -2.264 1.00 0.00 C HETATM 1377 CL1 WW7 T 91 84.885 0.977 -0.618 1.00 0.00 CL HETATM 1378 C5 WW7 T 91 83.938 1.169 -2.049 1.00 0.00 C HETATM 1379 C6 WW7 T 91 84.011 0.113 -3.047 1.00 0.00 C HETATM 1380 C7 WW7 T 91 83.220 0.202 -4.277 1.00 0.00 C HETATM 1381 C8 WW7 T 91 82.351 1.343 -4.527 1.00 0.00 C HETATM 1382 C11 WW7 T 91 78.683 1.998 -3.956 1.00 0.00 C HETATM 1383 C12 WW7 T 91 77.904 3.104 -3.245 1.00 0.00 C HETATM 1384 C14 WW7 T 91 77.218 3.437 -0.860 1.00 0.00 C HETATM 1385 C13 WW7 T 91 78.402 3.251 -1.807 1.00 0.00 C HETATM 1386 C15 WW7 T 91 77.609 2.986 0.552 1.00 0.00 C HETATM 1387 C16 WW7 T 91 77.390 4.129 1.546 1.00 0.00 C HETATM 1388 N2 WW7 T 91 76.892 3.669 2.833 1.00 0.00 N HETATM 0 HN22 WW7 T 91 76.707 4.341 3.578 1.00 0.00 H new HETATM 0 HN21 WW7 T 91 76.727 2.675 2.990 1.00 0.00 H new HETATM 0 H162 WW7 T 91 78.330 4.661 1.694 1.00 0.00 H new HETATM 0 H161 WW7 T 91 76.684 4.843 1.122 1.00 0.00 H new HETATM 0 H152 WW7 T 91 77.014 2.120 0.844 1.00 0.00 H new HETATM 0 H151 WW7 T 91 78.654 2.675 0.567 1.00 0.00 H new HETATM 0 H142 WW7 T 91 76.912 4.483 -0.846 1.00 0.00 H new HETATM 0 H141 WW7 T 91 76.364 2.860 -1.213 1.00 0.00 H new HETATM 0 H132 WW7 T 91 78.973 2.368 -1.519 1.00 0.00 H new HETATM 0 H131 WW7 T 91 79.076 4.105 -1.732 1.00 0.00 H new HETATM 0 H122 WW7 T 91 78.025 4.047 -3.779 1.00 0.00 H new HETATM 0 H121 WW7 T 91 76.839 2.870 -3.248 1.00 0.00 H new HETATM 0 H112 WW7 T 91 78.019 1.150 -4.123 1.00 0.00 H new HETATM 0 H111 WW7 T 91 79.483 1.653 -3.301 1.00 0.00 H new HETATM 0 HN1 WW7 T 91 79.003 1.941 -6.105 1.00 0.00 H new HETATM 0 H8 WW7 T 91 81.770 1.398 -5.447 1.00 0.00 H new HETATM 0 H7 WW7 T 91 83.283 -0.597 -5.015 1.00 0.00 H new HETATM 0 H6 WW7 T 91 84.657 -0.749 -2.879 1.00 0.00 H new HETATM 0 H4 WW7 T 91 83.565 3.333 -0.350 1.00 0.00 H new HETATM 0 H3 WW7 T 91 82.037 5.319 -0.774 1.00 0.00 H new HETATM 0 H2 WW7 T 91 80.675 5.474 -2.911 1.00 0.00 H new