USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 936 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 5 TYR OH : rot 180:sc= 0.902 USER MOD Set 1.2: A 90 LYS NZ :NH3+ 158:sc= 1.15 (180deg=-0.503) USER MOD Set 2.1: A 80 MET CE :methyl -156:sc= -2.24 (180deg=-2.19) USER MOD Set 2.2: A 81 MET CE :methyl -139:sc= -0.558 (180deg=-1.94) USER MOD Set 2.3: A 84 SER OG : rot 34:sc= 1.12 USER MOD Set 3.1: A 45 MET CE :methyl 150:sc= -1.53 (180deg=-3.77!) USER MOD Set 3.2: A 50 GLN : amide:sc= -0.779 K(o=-2.3,f=-9.2!) USER MOD Single : A 1 MET CE :methyl 173:sc= -0.599 (180deg=-0.96) USER MOD Single : A 1 MET N :NH3+ -142:sc= 1.24 (180deg=0.717) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.757 K(o=-0.76,f=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.2 USER MOD Single : A 16 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.89) USER MOD Single : A 17 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0676) USER MOD Single : A 18 ASN : amide:sc= -0.403 X(o=-0.4,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0734) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot -111:sc= 1.27 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 169:sc=-9.89e-05 (180deg=-0.103) USER MOD Single : A 43 LYS NZ :NH3+ 142:sc= -0.608 (180deg=-1.39) USER MOD Single : A 47 MET CE :methyl 177:sc= -2.87 (180deg=-3.07) USER MOD Single : A 51 ASN : amide:sc= -0.437 K(o=-0.44,f=-2.7!) USER MOD Single : A 53 THR OG1 : rot -61:sc= 0.656 USER MOD Single : A 58 GLN : amide:sc= -0.0249 K(o=-0.025,f=-1) USER MOD Single : A 60 MET CE :methyl 147:sc= -1.57 (180deg=-4.96!) USER MOD Single : A 69 SER OG : rot 93:sc= 1.2 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl 152:sc= -2.3! (180deg=-3.38!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 171:sc= -1.4! USER MOD Single : A 137 LYS NZ :NH3+ -155:sc= 1.22 (180deg=1.2) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 172:sc= 0.429 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 153 MET CE :methyl 167:sc= -1.98 (180deg=-2.55) USER MOD Single : A 154 MET CE :methyl 173:sc= -5! (180deg=-5.4!) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.376 -11.571 -9.689 1.00 0.00 N ATOM 2 CA MET A 1 -3.059 -10.972 -8.525 1.00 0.00 C ATOM 3 C MET A 1 -3.690 -12.061 -7.681 1.00 0.00 C ATOM 4 O MET A 1 -4.565 -12.792 -8.150 1.00 0.00 O ATOM 5 CB MET A 1 -4.137 -9.988 -8.984 1.00 0.00 C ATOM 6 CG MET A 1 -4.806 -9.226 -7.851 1.00 0.00 C ATOM 7 SD MET A 1 -6.187 -8.219 -8.424 1.00 0.00 S ATOM 8 CE MET A 1 -6.463 -7.163 -7.004 1.00 0.00 C ATOM 0 H1 MET A 1 -1.494 -11.054 -9.878 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.156 -12.567 -9.488 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.996 -11.515 -10.522 1.00 0.00 H new ATOM 0 HA MET A 1 -2.322 -10.433 -7.930 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.690 -9.273 -9.674 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.899 -10.534 -9.540 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.161 -9.933 -7.101 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.071 -8.586 -7.363 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.204 -6.404 -7.254 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.826 -7.763 -6.169 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.528 -6.679 -6.723 1.00 0.00 H new ATOM 20 N ASP A 2 -3.234 -12.178 -6.442 1.00 0.00 N ATOM 21 CA ASP A 2 -3.769 -13.171 -5.524 1.00 0.00 C ATOM 22 C ASP A 2 -5.223 -12.852 -5.225 1.00 0.00 C ATOM 23 O ASP A 2 -5.538 -11.788 -4.689 1.00 0.00 O ATOM 24 CB ASP A 2 -2.953 -13.209 -4.232 1.00 0.00 C ATOM 25 CG ASP A 2 -1.516 -13.632 -4.462 1.00 0.00 C ATOM 26 OD1 ASP A 2 -0.658 -12.753 -4.685 1.00 0.00 O ATOM 27 OD2 ASP A 2 -1.236 -14.849 -4.424 1.00 0.00 O1- ATOM 0 H ASP A 2 -2.494 -11.596 -6.050 1.00 0.00 H new ATOM 0 HA ASP A 2 -3.706 -14.155 -5.990 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -2.968 -12.223 -3.768 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -3.423 -13.898 -3.530 1.00 0.00 H new ATOM 32 N ASP A 3 -6.113 -13.769 -5.573 1.00 0.00 N ATOM 33 CA ASP A 3 -7.543 -13.498 -5.510 1.00 0.00 C ATOM 34 C ASP A 3 -8.068 -13.523 -4.088 1.00 0.00 C ATOM 35 O ASP A 3 -9.199 -13.122 -3.848 1.00 0.00 O ATOM 36 CB ASP A 3 -8.341 -14.462 -6.380 1.00 0.00 C ATOM 37 CG ASP A 3 -8.130 -15.910 -6.000 1.00 0.00 C ATOM 38 OD1 ASP A 3 -7.194 -16.535 -6.537 1.00 0.00 O ATOM 39 OD2 ASP A 3 -8.911 -16.434 -5.177 1.00 0.00 O1- ATOM 0 H ASP A 3 -5.873 -14.704 -5.901 1.00 0.00 H new ATOM 0 HA ASP A 3 -7.678 -12.490 -5.901 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -9.401 -14.222 -6.301 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -8.059 -14.321 -7.423 1.00 0.00 H new ATOM 44 N ILE A 4 -7.255 -13.985 -3.150 1.00 0.00 N ATOM 45 CA ILE A 4 -7.587 -13.843 -1.736 1.00 0.00 C ATOM 46 C ILE A 4 -7.738 -12.361 -1.414 1.00 0.00 C ATOM 47 O ILE A 4 -8.626 -11.942 -0.672 1.00 0.00 O ATOM 48 CB ILE A 4 -6.515 -14.481 -0.826 1.00 0.00 C ATOM 49 CG1 ILE A 4 -6.810 -14.192 0.644 1.00 0.00 C ATOM 50 CG2 ILE A 4 -5.136 -13.979 -1.196 1.00 0.00 C ATOM 51 CD1 ILE A 4 -6.061 -15.098 1.585 1.00 0.00 C ATOM 0 H ILE A 4 -6.370 -14.457 -3.336 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.523 -14.368 -1.545 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.542 -15.560 -0.975 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -6.552 -13.156 0.864 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.880 -14.298 0.822 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.394 -14.440 -0.544 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -4.920 -14.239 -2.232 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.100 -12.896 -1.079 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.313 -14.842 2.614 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -6.338 -16.134 1.390 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -4.989 -14.974 1.433 1.00 0.00 H new ATOM 63 N TYR A 5 -6.873 -11.575 -2.024 1.00 0.00 N ATOM 64 CA TYR A 5 -6.868 -10.138 -1.863 1.00 0.00 C ATOM 65 C TYR A 5 -7.881 -9.496 -2.786 1.00 0.00 C ATOM 66 O TYR A 5 -8.440 -8.442 -2.481 1.00 0.00 O ATOM 67 CB TYR A 5 -5.479 -9.621 -2.161 1.00 0.00 C ATOM 68 CG TYR A 5 -4.395 -10.279 -1.343 1.00 0.00 C ATOM 69 CD1 TYR A 5 -4.573 -10.557 0.008 1.00 0.00 C ATOM 70 CD2 TYR A 5 -3.199 -10.624 -1.929 1.00 0.00 C ATOM 71 CE1 TYR A 5 -3.575 -11.170 0.746 1.00 0.00 C ATOM 72 CE2 TYR A 5 -2.204 -11.227 -1.212 1.00 0.00 C ATOM 73 CZ TYR A 5 -2.388 -11.501 0.129 1.00 0.00 C ATOM 74 OH TYR A 5 -1.391 -12.117 0.853 1.00 0.00 O ATOM 0 H TYR A 5 -6.147 -11.922 -2.651 1.00 0.00 H new ATOM 0 HA TYR A 5 -7.142 -9.884 -0.839 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -5.265 -9.772 -3.219 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -5.455 -8.546 -1.981 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -5.503 -10.291 0.488 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -3.043 -10.414 -2.977 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -3.725 -11.386 1.793 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -1.274 -11.489 -1.694 1.00 0.00 H new ATOM 0 HH TYR A 5 -0.620 -12.284 0.272 1.00 0.00 H new ATOM 84 N LYS A 6 -8.112 -10.127 -3.924 1.00 0.00 N ATOM 85 CA LYS A 6 -9.105 -9.629 -4.846 1.00 0.00 C ATOM 86 C LYS A 6 -10.502 -9.828 -4.269 1.00 0.00 C ATOM 87 O LYS A 6 -11.389 -9.020 -4.497 1.00 0.00 O ATOM 88 CB LYS A 6 -9.005 -10.303 -6.200 1.00 0.00 C ATOM 89 CG LYS A 6 -9.862 -9.612 -7.225 1.00 0.00 C ATOM 90 CD LYS A 6 -10.261 -10.555 -8.326 1.00 0.00 C ATOM 91 CE LYS A 6 -11.531 -10.076 -8.985 1.00 0.00 C ATOM 92 NZ LYS A 6 -12.048 -11.046 -9.974 1.00 0.00 N1+ ATOM 0 H LYS A 6 -7.630 -10.974 -4.225 1.00 0.00 H new ATOM 0 HA LYS A 6 -8.917 -8.565 -4.989 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.967 -10.302 -6.532 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.311 -11.346 -6.112 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -10.755 -9.211 -6.745 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.319 -8.766 -7.646 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.462 -10.623 -9.065 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -10.407 -11.557 -7.922 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -12.289 -9.898 -8.222 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -11.345 -9.122 -9.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -12.921 -10.675 -10.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.336 -11.197 -10.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -12.251 -11.949 -9.501 1.00 0.00 H new ATOM 106 N ALA A 7 -10.684 -10.909 -3.516 1.00 0.00 N ATOM 107 CA ALA A 7 -11.952 -11.174 -2.844 1.00 0.00 C ATOM 108 C ALA A 7 -12.212 -10.124 -1.772 1.00 0.00 C ATOM 109 O ALA A 7 -13.356 -9.737 -1.527 1.00 0.00 O ATOM 110 CB ALA A 7 -11.957 -12.567 -2.236 1.00 0.00 C ATOM 0 H ALA A 7 -9.968 -11.617 -3.356 1.00 0.00 H new ATOM 0 HA ALA A 7 -12.751 -11.122 -3.584 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -12.911 -12.744 -1.740 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -11.814 -13.308 -3.023 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -11.149 -12.649 -1.509 1.00 0.00 H new ATOM 116 N ALA A 8 -11.136 -9.675 -1.137 1.00 0.00 N ATOM 117 CA ALA A 8 -11.200 -8.551 -0.221 1.00 0.00 C ATOM 118 C ALA A 8 -11.649 -7.311 -0.982 1.00 0.00 C ATOM 119 O ALA A 8 -12.536 -6.596 -0.545 1.00 0.00 O ATOM 120 CB ALA A 8 -9.842 -8.326 0.425 1.00 0.00 C ATOM 0 H ALA A 8 -10.205 -10.077 -1.243 1.00 0.00 H new ATOM 0 HA ALA A 8 -11.920 -8.762 0.570 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -9.901 -7.481 1.110 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -9.548 -9.220 0.976 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -9.102 -8.116 -0.347 1.00 0.00 H new ATOM 126 N VAL A 9 -11.025 -7.095 -2.135 1.00 0.00 N ATOM 127 CA VAL A 9 -11.421 -6.046 -3.079 1.00 0.00 C ATOM 128 C VAL A 9 -12.893 -6.156 -3.458 1.00 0.00 C ATOM 129 O VAL A 9 -13.583 -5.159 -3.647 1.00 0.00 O ATOM 130 CB VAL A 9 -10.560 -6.150 -4.358 1.00 0.00 C ATOM 131 CG1 VAL A 9 -11.352 -5.776 -5.606 1.00 0.00 C ATOM 132 CG2 VAL A 9 -9.321 -5.294 -4.215 1.00 0.00 C ATOM 0 H VAL A 9 -10.224 -7.645 -2.447 1.00 0.00 H new ATOM 0 HA VAL A 9 -11.265 -5.083 -2.592 1.00 0.00 H new ATOM 0 HB VAL A 9 -10.255 -7.189 -4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -10.711 -5.862 -6.483 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -12.204 -6.448 -5.712 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -11.709 -4.750 -5.517 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -8.719 -5.372 -5.120 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -9.612 -4.255 -4.061 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -8.738 -5.638 -3.360 1.00 0.00 H new ATOM 142 N GLU A 10 -13.338 -7.376 -3.596 1.00 0.00 N ATOM 143 CA GLU A 10 -14.700 -7.669 -3.987 1.00 0.00 C ATOM 144 C GLU A 10 -15.701 -7.312 -2.892 1.00 0.00 C ATOM 145 O GLU A 10 -16.862 -7.000 -3.166 1.00 0.00 O ATOM 146 CB GLU A 10 -14.770 -9.106 -4.393 1.00 0.00 C ATOM 147 CG GLU A 10 -14.117 -9.269 -5.730 1.00 0.00 C ATOM 148 CD GLU A 10 -15.046 -8.937 -6.867 1.00 0.00 C ATOM 149 OE1 GLU A 10 -15.699 -9.865 -7.396 1.00 0.00 O ATOM 150 OE2 GLU A 10 -15.151 -7.746 -7.224 1.00 0.00 O1- ATOM 0 H GLU A 10 -12.764 -8.205 -3.440 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.983 -7.047 -4.836 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -14.271 -9.731 -3.652 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.809 -9.434 -4.439 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.238 -8.626 -5.783 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.768 -10.296 -5.838 1.00 0.00 H new ATOM 157 N GLN A 11 -15.237 -7.359 -1.655 1.00 0.00 N ATOM 158 CA GLN A 11 -15.999 -6.849 -0.527 1.00 0.00 C ATOM 159 C GLN A 11 -15.748 -5.359 -0.377 1.00 0.00 C ATOM 160 O GLN A 11 -16.612 -4.611 0.092 1.00 0.00 O ATOM 161 CB GLN A 11 -15.615 -7.577 0.745 1.00 0.00 C ATOM 162 CG GLN A 11 -16.399 -7.098 1.920 1.00 0.00 C ATOM 163 CD GLN A 11 -15.961 -7.726 3.229 1.00 0.00 C ATOM 164 OE1 GLN A 11 -16.045 -7.101 4.286 1.00 0.00 O ATOM 165 NE2 GLN A 11 -15.500 -8.967 3.175 1.00 0.00 N ATOM 0 H GLN A 11 -14.328 -7.749 -1.405 1.00 0.00 H new ATOM 0 HA GLN A 11 -17.060 -7.018 -0.710 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.776 -8.647 0.613 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -14.551 -7.436 0.937 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -16.303 -6.015 1.995 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.455 -7.314 1.756 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -15.446 -9.452 2.280 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -15.200 -9.437 4.029 1.00 0.00 H new ATOM 174 N LEU A 12 -14.556 -4.936 -0.780 1.00 0.00 N ATOM 175 CA LEU A 12 -14.225 -3.542 -0.844 1.00 0.00 C ATOM 176 C LEU A 12 -15.172 -2.853 -1.790 1.00 0.00 C ATOM 177 O LEU A 12 -15.468 -3.350 -2.877 1.00 0.00 O ATOM 178 CB LEU A 12 -12.794 -3.352 -1.328 1.00 0.00 C ATOM 179 CG LEU A 12 -11.697 -3.697 -0.337 1.00 0.00 C ATOM 180 CD1 LEU A 12 -10.336 -3.283 -0.881 1.00 0.00 C ATOM 181 CD2 LEU A 12 -11.988 -3.051 0.997 1.00 0.00 C ATOM 0 H LEU A 12 -13.802 -5.559 -1.068 1.00 0.00 H new ATOM 0 HA LEU A 12 -14.314 -3.111 0.153 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -12.652 -3.960 -2.221 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -12.670 -2.311 -1.627 1.00 0.00 H new ATOM 0 HG LEU A 12 -11.672 -4.777 -0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.562 -3.538 -0.157 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -10.144 -3.807 -1.817 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -10.327 -2.208 -1.058 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -11.197 -3.303 1.703 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -12.035 -1.969 0.875 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -12.943 -3.415 1.377 1.00 0.00 H new ATOM 193 N THR A 13 -15.647 -1.720 -1.382 1.00 0.00 N ATOM 194 CA THR A 13 -16.604 -1.011 -2.169 1.00 0.00 C ATOM 195 C THR A 13 -15.912 0.067 -2.951 1.00 0.00 C ATOM 196 O THR A 13 -14.756 0.368 -2.673 1.00 0.00 O ATOM 197 CB THR A 13 -17.700 -0.430 -1.262 1.00 0.00 C ATOM 198 OG1 THR A 13 -17.158 0.629 -0.458 1.00 0.00 O ATOM 199 CG2 THR A 13 -18.240 -1.522 -0.347 1.00 0.00 C ATOM 0 H THR A 13 -15.387 -1.265 -0.507 1.00 0.00 H new ATOM 0 HA THR A 13 -17.079 -1.693 -2.874 1.00 0.00 H new ATOM 0 HB THR A 13 -18.505 -0.040 -1.885 1.00 0.00 H new ATOM 0 HG1 THR A 13 -17.862 0.996 0.117 1.00 0.00 H new ATOM 0 HG21 THR A 13 -19.017 -1.107 0.295 1.00 0.00 H new ATOM 0 HG22 THR A 13 -18.659 -2.328 -0.950 1.00 0.00 H new ATOM 0 HG23 THR A 13 -17.431 -1.913 0.269 1.00 0.00 H new ATOM 207 N GLU A 14 -16.580 0.623 -3.940 1.00 0.00 N ATOM 208 CA GLU A 14 -15.986 1.683 -4.729 1.00 0.00 C ATOM 209 C GLU A 14 -15.542 2.813 -3.819 1.00 0.00 C ATOM 210 O GLU A 14 -14.587 3.500 -4.112 1.00 0.00 O ATOM 211 CB GLU A 14 -16.974 2.196 -5.771 1.00 0.00 C ATOM 212 CG GLU A 14 -17.458 1.126 -6.727 1.00 0.00 C ATOM 213 CD GLU A 14 -18.416 1.669 -7.760 1.00 0.00 C ATOM 214 OE1 GLU A 14 -18.005 1.851 -8.924 1.00 0.00 O ATOM 215 OE2 GLU A 14 -19.588 1.929 -7.412 1.00 0.00 O1- ATOM 0 H GLU A 14 -17.527 0.362 -4.216 1.00 0.00 H new ATOM 0 HA GLU A 14 -15.116 1.286 -5.253 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -17.833 2.631 -5.261 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -16.504 2.996 -6.343 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -16.601 0.677 -7.230 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -17.948 0.333 -6.162 1.00 0.00 H new ATOM 222 N GLU A 15 -16.231 2.962 -2.692 1.00 0.00 N ATOM 223 CA GLU A 15 -15.870 3.950 -1.688 1.00 0.00 C ATOM 224 C GLU A 15 -14.578 3.550 -0.979 1.00 0.00 C ATOM 225 O GLU A 15 -13.671 4.366 -0.829 1.00 0.00 O ATOM 226 CB GLU A 15 -17.002 4.085 -0.676 1.00 0.00 C ATOM 227 CG GLU A 15 -18.303 4.555 -1.297 1.00 0.00 C ATOM 228 CD GLU A 15 -19.468 4.465 -0.342 1.00 0.00 C ATOM 229 OE1 GLU A 15 -20.160 3.429 -0.345 1.00 0.00 O ATOM 230 OE2 GLU A 15 -19.703 5.431 0.415 1.00 0.00 O1- ATOM 0 H GLU A 15 -17.050 2.404 -2.452 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.707 4.909 -2.180 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -17.165 3.122 -0.191 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.703 4.787 0.102 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -18.190 5.587 -1.630 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -18.516 3.955 -2.182 1.00 0.00 H new ATOM 237 N GLN A 16 -14.509 2.295 -0.533 1.00 0.00 N ATOM 238 CA GLN A 16 -13.306 1.743 0.055 1.00 0.00 C ATOM 239 C GLN A 16 -12.134 1.825 -0.905 1.00 0.00 C ATOM 240 O GLN A 16 -11.095 2.410 -0.610 1.00 0.00 O ATOM 241 CB GLN A 16 -13.566 0.313 0.401 1.00 0.00 C ATOM 242 CG GLN A 16 -14.379 0.182 1.651 1.00 0.00 C ATOM 243 CD GLN A 16 -13.657 0.715 2.872 1.00 0.00 C ATOM 244 OE1 GLN A 16 -12.426 0.690 2.946 1.00 0.00 O ATOM 245 NE2 GLN A 16 -14.418 1.195 3.837 1.00 0.00 N ATOM 0 H GLN A 16 -15.290 1.640 -0.573 1.00 0.00 H new ATOM 0 HA GLN A 16 -13.050 2.318 0.945 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -14.088 -0.171 -0.424 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -12.617 -0.208 0.528 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -15.320 0.718 1.526 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -14.629 -0.867 1.810 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -15.433 1.196 3.734 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -13.992 1.565 4.687 1.00 0.00 H new ATOM 254 N LYS A 17 -12.338 1.210 -2.053 1.00 0.00 N ATOM 255 CA LYS A 17 -11.383 1.175 -3.133 1.00 0.00 C ATOM 256 C LYS A 17 -10.948 2.584 -3.546 1.00 0.00 C ATOM 257 O LYS A 17 -9.763 2.843 -3.746 1.00 0.00 O ATOM 258 CB LYS A 17 -12.031 0.421 -4.287 1.00 0.00 C ATOM 259 CG LYS A 17 -12.247 -1.039 -3.949 1.00 0.00 C ATOM 260 CD LYS A 17 -12.861 -1.789 -5.108 1.00 0.00 C ATOM 261 CE LYS A 17 -11.924 -1.768 -6.295 1.00 0.00 C ATOM 262 NZ LYS A 17 -12.393 -2.630 -7.410 1.00 0.00 N1+ ATOM 0 H LYS A 17 -13.200 0.707 -2.262 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.472 0.666 -2.818 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -12.987 0.883 -4.533 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.401 0.500 -5.173 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.295 -1.497 -3.681 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.896 -1.120 -3.077 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.068 -2.819 -4.816 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -13.815 -1.337 -5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.819 -0.744 -6.652 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.935 -2.097 -5.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.619 -2.770 -8.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -12.694 -3.552 -7.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -13.195 -2.173 -7.888 1.00 0.00 H new ATOM 276 N ASN A 18 -11.914 3.487 -3.655 1.00 0.00 N ATOM 277 CA ASN A 18 -11.635 4.898 -3.924 1.00 0.00 C ATOM 278 C ASN A 18 -10.762 5.487 -2.841 1.00 0.00 C ATOM 279 O ASN A 18 -9.809 6.206 -3.123 1.00 0.00 O ATOM 280 CB ASN A 18 -12.921 5.701 -3.957 1.00 0.00 C ATOM 281 CG ASN A 18 -12.697 7.194 -4.141 1.00 0.00 C ATOM 282 OD1 ASN A 18 -13.417 8.013 -3.571 1.00 0.00 O ATOM 283 ND2 ASN A 18 -11.715 7.562 -4.955 1.00 0.00 N ATOM 0 H ASN A 18 -12.906 3.268 -3.561 1.00 0.00 H new ATOM 0 HA ASN A 18 -11.129 4.947 -4.888 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -13.550 5.333 -4.768 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -13.468 5.535 -3.029 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -11.537 8.552 -5.125 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -11.138 6.855 -5.410 1.00 0.00 H new ATOM 290 N GLU A 19 -11.117 5.188 -1.602 1.00 0.00 N ATOM 291 CA GLU A 19 -10.409 5.718 -0.458 1.00 0.00 C ATOM 292 C GLU A 19 -8.936 5.341 -0.551 1.00 0.00 C ATOM 293 O GLU A 19 -8.046 6.153 -0.288 1.00 0.00 O ATOM 294 CB GLU A 19 -11.024 5.181 0.835 1.00 0.00 C ATOM 295 CG GLU A 19 -10.459 5.787 2.104 1.00 0.00 C ATOM 296 CD GLU A 19 -11.245 5.361 3.324 1.00 0.00 C ATOM 297 OE1 GLU A 19 -10.830 4.402 4.008 1.00 0.00 O ATOM 298 OE2 GLU A 19 -12.302 5.971 3.591 1.00 0.00 O1- ATOM 0 H GLU A 19 -11.898 4.576 -1.366 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.494 6.805 -0.451 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -12.099 5.359 0.811 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -10.880 4.101 0.869 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.418 5.487 2.219 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -10.470 6.874 2.025 1.00 0.00 H new ATOM 305 N PHE A 20 -8.702 4.104 -0.962 1.00 0.00 N ATOM 306 CA PHE A 20 -7.360 3.600 -1.186 1.00 0.00 C ATOM 307 C PHE A 20 -6.711 4.279 -2.392 1.00 0.00 C ATOM 308 O PHE A 20 -5.520 4.560 -2.379 1.00 0.00 O ATOM 309 CB PHE A 20 -7.403 2.079 -1.370 1.00 0.00 C ATOM 310 CG PHE A 20 -7.763 1.352 -0.110 1.00 0.00 C ATOM 311 CD1 PHE A 20 -7.054 1.577 1.063 1.00 0.00 C ATOM 312 CD2 PHE A 20 -8.810 0.448 -0.093 1.00 0.00 C ATOM 313 CE1 PHE A 20 -7.389 0.911 2.221 1.00 0.00 C ATOM 314 CE2 PHE A 20 -9.146 -0.219 1.058 1.00 0.00 C ATOM 315 CZ PHE A 20 -8.436 0.010 2.221 1.00 0.00 C ATOM 0 H PHE A 20 -9.438 3.423 -1.149 1.00 0.00 H new ATOM 0 HA PHE A 20 -6.749 3.832 -0.314 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.127 1.832 -2.146 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -6.430 1.732 -1.719 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -6.234 2.280 1.067 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -9.370 0.265 -0.998 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -6.833 1.093 3.129 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -9.965 -0.923 1.055 1.00 0.00 H new ATOM 0 HZ PHE A 20 -8.699 -0.514 3.128 1.00 0.00 H new ATOM 325 N LYS A 21 -7.499 4.555 -3.424 1.00 0.00 N ATOM 326 CA LYS A 21 -6.988 5.211 -4.627 1.00 0.00 C ATOM 327 C LYS A 21 -6.544 6.612 -4.269 1.00 0.00 C ATOM 328 O LYS A 21 -5.456 7.057 -4.614 1.00 0.00 O ATOM 329 CB LYS A 21 -8.075 5.337 -5.676 1.00 0.00 C ATOM 330 CG LYS A 21 -7.565 5.401 -7.121 1.00 0.00 C ATOM 331 CD LYS A 21 -6.149 5.956 -7.247 1.00 0.00 C ATOM 332 CE LYS A 21 -5.918 6.587 -8.611 1.00 0.00 C ATOM 333 NZ LYS A 21 -6.234 5.653 -9.721 1.00 0.00 N1+ ATOM 0 H LYS A 21 -8.495 4.336 -3.455 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.165 4.614 -5.018 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.753 4.489 -5.581 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -8.658 6.235 -5.470 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -7.593 4.400 -7.552 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -8.242 6.020 -7.709 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -5.977 6.698 -6.468 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.427 5.155 -7.089 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.534 7.482 -8.705 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -4.879 6.905 -8.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.875 6.043 -10.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.785 4.733 -9.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -7.264 5.528 -9.787 1.00 0.00 H new ATOM 347 N ALA A 22 -7.443 7.309 -3.618 1.00 0.00 N ATOM 348 CA ALA A 22 -7.157 8.641 -3.115 1.00 0.00 C ATOM 349 C ALA A 22 -5.843 8.648 -2.358 1.00 0.00 C ATOM 350 O ALA A 22 -4.983 9.474 -2.628 1.00 0.00 O ATOM 351 CB ALA A 22 -8.279 9.140 -2.231 1.00 0.00 C ATOM 0 H ALA A 22 -8.387 6.978 -3.420 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.074 9.315 -3.968 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.039 10.139 -1.868 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -9.206 9.175 -2.804 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -8.402 8.466 -1.383 1.00 0.00 H new ATOM 357 N ALA A 23 -5.674 7.697 -1.443 1.00 0.00 N ATOM 358 CA ALA A 23 -4.437 7.595 -0.682 1.00 0.00 C ATOM 359 C ALA A 23 -3.281 7.186 -1.577 1.00 0.00 C ATOM 360 O ALA A 23 -2.149 7.598 -1.344 1.00 0.00 O ATOM 361 CB ALA A 23 -4.581 6.612 0.468 1.00 0.00 C ATOM 0 H ALA A 23 -6.374 6.992 -1.213 1.00 0.00 H new ATOM 0 HA ALA A 23 -4.224 8.581 -0.268 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -3.642 6.556 1.019 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -5.374 6.947 1.136 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -4.830 5.626 0.075 1.00 0.00 H new ATOM 367 N PHE A 24 -3.566 6.361 -2.585 1.00 0.00 N ATOM 368 CA PHE A 24 -2.587 6.045 -3.619 1.00 0.00 C ATOM 369 C PHE A 24 -2.020 7.332 -4.172 1.00 0.00 C ATOM 370 O PHE A 24 -0.815 7.561 -4.154 1.00 0.00 O ATOM 371 CB PHE A 24 -3.229 5.254 -4.770 1.00 0.00 C ATOM 372 CG PHE A 24 -2.337 5.067 -5.976 1.00 0.00 C ATOM 373 CD1 PHE A 24 -2.615 5.754 -7.145 1.00 0.00 C ATOM 374 CD2 PHE A 24 -1.232 4.220 -5.955 1.00 0.00 C ATOM 375 CE1 PHE A 24 -1.823 5.606 -8.261 1.00 0.00 C ATOM 376 CE2 PHE A 24 -0.438 4.073 -7.071 1.00 0.00 C ATOM 377 CZ PHE A 24 -0.733 4.764 -8.225 1.00 0.00 C ATOM 0 H PHE A 24 -4.468 5.900 -2.705 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.801 5.436 -3.172 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.527 4.273 -4.398 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.139 5.766 -5.083 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.467 6.417 -7.182 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -0.995 3.673 -5.055 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -2.056 6.150 -9.165 1.00 0.00 H new ATOM 0 HE2 PHE A 24 0.418 3.415 -7.041 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.111 4.646 -9.100 1.00 0.00 H new ATOM 387 N ASP A 25 -2.935 8.160 -4.641 1.00 0.00 N ATOM 388 CA ASP A 25 -2.625 9.477 -5.185 1.00 0.00 C ATOM 389 C ASP A 25 -1.722 10.282 -4.251 1.00 0.00 C ATOM 390 O ASP A 25 -0.766 10.919 -4.687 1.00 0.00 O ATOM 391 CB ASP A 25 -3.910 10.250 -5.405 1.00 0.00 C ATOM 392 CG ASP A 25 -3.680 11.538 -6.163 1.00 0.00 C ATOM 393 OD1 ASP A 25 -3.247 11.476 -7.333 1.00 0.00 O ATOM 394 OD2 ASP A 25 -3.936 12.620 -5.594 1.00 0.00 O1- ATOM 0 H ASP A 25 -3.930 7.937 -4.657 1.00 0.00 H new ATOM 0 HA ASP A 25 -2.098 9.327 -6.127 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -4.616 9.628 -5.955 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -4.366 10.474 -4.441 1.00 0.00 H new ATOM 399 N ILE A 26 -2.037 10.236 -2.964 1.00 0.00 N ATOM 400 CA ILE A 26 -1.308 11.003 -1.952 1.00 0.00 C ATOM 401 C ILE A 26 0.068 10.397 -1.735 1.00 0.00 C ATOM 402 O ILE A 26 1.080 11.098 -1.660 1.00 0.00 O ATOM 403 CB ILE A 26 -2.044 11.009 -0.601 1.00 0.00 C ATOM 404 CG1 ILE A 26 -3.548 11.088 -0.819 1.00 0.00 C ATOM 405 CG2 ILE A 26 -1.571 12.177 0.249 1.00 0.00 C ATOM 406 CD1 ILE A 26 -4.366 10.984 0.444 1.00 0.00 C ATOM 0 H ILE A 26 -2.799 9.671 -2.589 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.230 12.026 -2.319 1.00 0.00 H new ATOM 0 HB ILE A 26 -1.818 10.081 -0.076 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -3.782 12.031 -1.313 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.847 10.290 -1.498 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.099 12.170 1.202 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.499 12.087 0.427 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.775 13.112 -0.272 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -5.426 11.050 0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -4.165 10.029 0.930 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -4.099 11.798 1.118 1.00 0.00 H new ATOM 418 N PHE A 27 0.074 9.077 -1.651 1.00 0.00 N ATOM 419 CA PHE A 27 1.279 8.291 -1.447 1.00 0.00 C ATOM 420 C PHE A 27 2.270 8.566 -2.580 1.00 0.00 C ATOM 421 O PHE A 27 3.488 8.510 -2.394 1.00 0.00 O ATOM 422 CB PHE A 27 0.877 6.812 -1.419 1.00 0.00 C ATOM 423 CG PHE A 27 1.726 5.909 -0.571 1.00 0.00 C ATOM 424 CD1 PHE A 27 1.340 5.577 0.723 1.00 0.00 C ATOM 425 CD2 PHE A 27 2.883 5.357 -1.074 1.00 0.00 C ATOM 426 CE1 PHE A 27 2.097 4.710 1.491 1.00 0.00 C ATOM 427 CE2 PHE A 27 3.643 4.495 -0.310 1.00 0.00 C ATOM 428 CZ PHE A 27 3.253 4.170 0.970 1.00 0.00 C ATOM 0 H PHE A 27 -0.772 8.512 -1.724 1.00 0.00 H new ATOM 0 HA PHE A 27 1.763 8.557 -0.507 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -0.152 6.744 -1.067 1.00 0.00 H new ATOM 0 HB3 PHE A 27 0.891 6.434 -2.441 1.00 0.00 H new ATOM 0 HD1 PHE A 27 0.436 6.002 1.134 1.00 0.00 H new ATOM 0 HD2 PHE A 27 3.199 5.601 -2.077 1.00 0.00 H new ATOM 0 HE1 PHE A 27 1.784 4.458 2.493 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.549 4.073 -0.718 1.00 0.00 H new ATOM 0 HZ PHE A 27 3.851 3.494 1.564 1.00 0.00 H new ATOM 438 N VAL A 28 1.723 8.890 -3.749 1.00 0.00 N ATOM 439 CA VAL A 28 2.526 9.168 -4.928 1.00 0.00 C ATOM 440 C VAL A 28 2.493 10.647 -5.311 1.00 0.00 C ATOM 441 O VAL A 28 2.801 11.001 -6.448 1.00 0.00 O ATOM 442 CB VAL A 28 2.044 8.350 -6.141 1.00 0.00 C ATOM 443 CG1 VAL A 28 2.112 6.865 -5.848 1.00 0.00 C ATOM 444 CG2 VAL A 28 0.633 8.755 -6.536 1.00 0.00 C ATOM 0 H VAL A 28 0.717 8.966 -3.901 1.00 0.00 H new ATOM 0 HA VAL A 28 3.546 8.886 -4.667 1.00 0.00 H new ATOM 0 HB VAL A 28 2.707 8.562 -6.979 1.00 0.00 H new ATOM 0 HG11 VAL A 28 1.767 6.306 -6.718 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.141 6.586 -5.622 1.00 0.00 H new ATOM 0 HG13 VAL A 28 1.477 6.633 -4.993 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.312 8.165 -7.395 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -0.044 8.577 -5.700 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.618 9.813 -6.797 1.00 0.00 H new ATOM 454 N LEU A 29 2.107 11.520 -4.393 1.00 0.00 N ATOM 455 CA LEU A 29 2.120 12.942 -4.697 1.00 0.00 C ATOM 456 C LEU A 29 3.555 13.411 -4.862 1.00 0.00 C ATOM 457 O LEU A 29 4.357 13.347 -3.928 1.00 0.00 O ATOM 458 CB LEU A 29 1.396 13.749 -3.619 1.00 0.00 C ATOM 459 CG LEU A 29 -0.123 13.831 -3.780 1.00 0.00 C ATOM 460 CD1 LEU A 29 -0.751 14.551 -2.598 1.00 0.00 C ATOM 461 CD2 LEU A 29 -0.486 14.538 -5.078 1.00 0.00 C ATOM 0 H LEU A 29 1.789 11.278 -3.455 1.00 0.00 H new ATOM 0 HA LEU A 29 1.583 13.106 -5.632 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.620 13.310 -2.647 1.00 0.00 H new ATOM 0 HB3 LEU A 29 1.800 14.761 -3.612 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.515 12.815 -3.815 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.832 14.598 -2.733 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.523 14.010 -1.680 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.349 15.562 -2.533 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -1.571 14.587 -5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -0.077 15.548 -5.069 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.071 13.986 -5.921 1.00 0.00 H new ATOM 473 N GLY A 30 3.871 13.873 -6.060 1.00 0.00 N ATOM 474 CA GLY A 30 5.234 14.232 -6.377 1.00 0.00 C ATOM 475 C GLY A 30 5.963 13.107 -7.080 1.00 0.00 C ATOM 476 O GLY A 30 7.184 13.145 -7.228 1.00 0.00 O ATOM 0 H GLY A 30 3.205 14.006 -6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.238 15.119 -7.010 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.764 14.492 -5.461 1.00 0.00 H new ATOM 480 N ALA A 31 5.218 12.099 -7.514 1.00 0.00 N ATOM 481 CA ALA A 31 5.801 10.965 -8.211 1.00 0.00 C ATOM 482 C ALA A 31 5.933 11.247 -9.695 1.00 0.00 C ATOM 483 O ALA A 31 5.163 12.015 -10.269 1.00 0.00 O ATOM 484 CB ALA A 31 4.965 9.714 -7.992 1.00 0.00 C ATOM 0 H ALA A 31 4.206 12.046 -7.394 1.00 0.00 H new ATOM 0 HA ALA A 31 6.797 10.799 -7.802 1.00 0.00 H new ATOM 0 HB1 ALA A 31 5.418 8.876 -8.522 1.00 0.00 H new ATOM 0 HB2 ALA A 31 4.920 9.488 -6.927 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.956 9.880 -8.370 1.00 0.00 H new ATOM 490 N GLU A 32 6.916 10.609 -10.305 1.00 0.00 N ATOM 491 CA GLU A 32 7.190 10.789 -11.716 1.00 0.00 C ATOM 492 C GLU A 32 6.196 9.999 -12.557 1.00 0.00 C ATOM 493 O GLU A 32 5.643 10.506 -13.534 1.00 0.00 O ATOM 494 CB GLU A 32 8.611 10.321 -12.026 1.00 0.00 C ATOM 495 CG GLU A 32 9.077 10.643 -13.434 1.00 0.00 C ATOM 496 CD GLU A 32 9.144 12.131 -13.695 1.00 0.00 C ATOM 497 OE1 GLU A 32 10.074 12.786 -13.182 1.00 0.00 O ATOM 498 OE2 GLU A 32 8.278 12.652 -14.424 1.00 0.00 O1- ATOM 0 H GLU A 32 7.543 9.955 -9.837 1.00 0.00 H new ATOM 0 HA GLU A 32 7.092 11.847 -11.960 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.297 10.781 -11.314 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.668 9.243 -11.874 1.00 0.00 H new ATOM 0 HG2 GLU A 32 10.061 10.204 -13.597 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.399 10.181 -14.152 1.00 0.00 H new ATOM 505 N ASP A 33 5.974 8.754 -12.161 1.00 0.00 N ATOM 506 CA ASP A 33 5.113 7.849 -12.902 1.00 0.00 C ATOM 507 C ASP A 33 3.703 7.853 -12.340 1.00 0.00 C ATOM 508 O ASP A 33 2.757 7.423 -13.001 1.00 0.00 O ATOM 509 CB ASP A 33 5.664 6.429 -12.844 1.00 0.00 C ATOM 510 CG ASP A 33 7.004 6.275 -13.525 1.00 0.00 C ATOM 511 OD1 ASP A 33 8.038 6.613 -12.906 1.00 0.00 O ATOM 512 OD2 ASP A 33 7.034 5.777 -14.670 1.00 0.00 O1- ATOM 0 H ASP A 33 6.384 8.346 -11.321 1.00 0.00 H new ATOM 0 HA ASP A 33 5.084 8.193 -13.936 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.758 6.127 -11.801 1.00 0.00 H new ATOM 0 HB3 ASP A 33 4.949 5.751 -13.309 1.00 0.00 H new ATOM 517 N GLY A 34 3.572 8.347 -11.121 1.00 0.00 N ATOM 518 CA GLY A 34 2.287 8.340 -10.452 1.00 0.00 C ATOM 519 C GLY A 34 2.047 7.053 -9.697 1.00 0.00 C ATOM 520 O GLY A 34 1.021 6.889 -9.055 1.00 0.00 O ATOM 0 H GLY A 34 4.334 8.755 -10.580 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.234 9.181 -9.760 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.495 8.482 -11.187 1.00 0.00 H new ATOM 524 N SER A 35 2.996 6.138 -9.792 1.00 0.00 N ATOM 525 CA SER A 35 2.943 4.886 -9.058 1.00 0.00 C ATOM 526 C SER A 35 3.938 4.935 -7.911 1.00 0.00 C ATOM 527 O SER A 35 4.906 5.699 -7.947 1.00 0.00 O ATOM 528 CB SER A 35 3.275 3.718 -9.982 1.00 0.00 C ATOM 529 OG SER A 35 2.330 3.602 -11.034 1.00 0.00 O ATOM 0 H SER A 35 3.824 6.242 -10.379 1.00 0.00 H new ATOM 0 HA SER A 35 1.937 4.743 -8.664 1.00 0.00 H new ATOM 0 HB2 SER A 35 4.272 3.856 -10.401 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.296 2.792 -9.407 1.00 0.00 H new ATOM 0 HG SER A 35 2.572 2.846 -11.609 1.00 0.00 H new ATOM 535 N ILE A 36 3.698 4.121 -6.903 1.00 0.00 N ATOM 536 CA ILE A 36 4.513 4.133 -5.710 1.00 0.00 C ATOM 537 C ILE A 36 5.869 3.523 -5.976 1.00 0.00 C ATOM 538 O ILE A 36 5.992 2.312 -6.142 1.00 0.00 O ATOM 539 CB ILE A 36 3.837 3.347 -4.574 1.00 0.00 C ATOM 540 CG1 ILE A 36 2.443 3.908 -4.316 1.00 0.00 C ATOM 541 CG2 ILE A 36 4.683 3.401 -3.309 1.00 0.00 C ATOM 542 CD1 ILE A 36 1.654 3.118 -3.310 1.00 0.00 C ATOM 0 H ILE A 36 2.939 3.439 -6.889 1.00 0.00 H new ATOM 0 HA ILE A 36 4.633 5.175 -5.413 1.00 0.00 H new ATOM 0 HB ILE A 36 3.745 2.303 -4.872 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.533 4.937 -3.968 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.892 3.937 -5.256 1.00 0.00 H new ATOM 0 HG21 ILE A 36 4.189 2.839 -2.516 1.00 0.00 H new ATOM 0 HG22 ILE A 36 5.662 2.964 -3.507 1.00 0.00 H new ATOM 0 HG23 ILE A 36 4.805 4.438 -2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.673 3.575 -3.177 1.00 0.00 H new ATOM 0 HD12 ILE A 36 1.532 2.095 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 36 2.183 3.111 -2.357 1.00 0.00 H new ATOM 554 N SER A 37 6.882 4.360 -6.020 1.00 0.00 N ATOM 555 CA SER A 37 8.235 3.871 -6.061 1.00 0.00 C ATOM 556 C SER A 37 8.731 3.742 -4.640 1.00 0.00 C ATOM 557 O SER A 37 7.975 3.976 -3.691 1.00 0.00 O ATOM 558 CB SER A 37 9.140 4.812 -6.857 1.00 0.00 C ATOM 559 OG SER A 37 9.374 6.018 -6.148 1.00 0.00 O ATOM 0 H SER A 37 6.792 5.376 -6.028 1.00 0.00 H new ATOM 0 HA SER A 37 8.257 2.902 -6.561 1.00 0.00 H new ATOM 0 HB2 SER A 37 10.090 4.319 -7.065 1.00 0.00 H new ATOM 0 HB3 SER A 37 8.680 5.036 -7.819 1.00 0.00 H new ATOM 0 HG SER A 37 8.926 6.759 -6.606 1.00 0.00 H new ATOM 565 N THR A 38 9.976 3.386 -4.474 1.00 0.00 N ATOM 566 CA THR A 38 10.535 3.267 -3.154 1.00 0.00 C ATOM 567 C THR A 38 10.606 4.643 -2.492 1.00 0.00 C ATOM 568 O THR A 38 10.311 4.786 -1.306 1.00 0.00 O ATOM 569 CB THR A 38 11.915 2.611 -3.231 1.00 0.00 C ATOM 570 OG1 THR A 38 12.804 3.436 -3.996 1.00 0.00 O ATOM 571 CG2 THR A 38 11.787 1.246 -3.892 1.00 0.00 C ATOM 0 H THR A 38 10.622 3.174 -5.234 1.00 0.00 H new ATOM 0 HA THR A 38 9.894 2.633 -2.542 1.00 0.00 H new ATOM 0 HB THR A 38 12.317 2.493 -2.225 1.00 0.00 H new ATOM 0 HG1 THR A 38 13.686 3.012 -4.041 1.00 0.00 H new ATOM 0 HG21 THR A 38 12.769 0.776 -3.949 1.00 0.00 H new ATOM 0 HG22 THR A 38 11.117 0.618 -3.304 1.00 0.00 H new ATOM 0 HG23 THR A 38 11.383 1.365 -4.897 1.00 0.00 H new ATOM 579 N LYS A 39 10.951 5.656 -3.284 1.00 0.00 N ATOM 580 CA LYS A 39 10.977 7.036 -2.812 1.00 0.00 C ATOM 581 C LYS A 39 9.602 7.447 -2.292 1.00 0.00 C ATOM 582 O LYS A 39 9.468 7.955 -1.177 1.00 0.00 O ATOM 583 CB LYS A 39 11.418 7.964 -3.933 1.00 0.00 C ATOM 584 CG LYS A 39 11.644 9.404 -3.501 1.00 0.00 C ATOM 585 CD LYS A 39 12.035 10.276 -4.681 1.00 0.00 C ATOM 586 CE LYS A 39 12.343 11.706 -4.257 1.00 0.00 C ATOM 587 NZ LYS A 39 13.562 11.793 -3.410 1.00 0.00 N1+ ATOM 0 H LYS A 39 11.218 5.544 -4.262 1.00 0.00 H new ATOM 0 HA LYS A 39 11.692 7.112 -1.993 1.00 0.00 H new ATOM 0 HB2 LYS A 39 12.341 7.578 -4.367 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.664 7.947 -4.720 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.736 9.795 -3.041 1.00 0.00 H new ATOM 0 HG3 LYS A 39 12.427 9.441 -2.743 1.00 0.00 H new ATOM 0 HD2 LYS A 39 12.908 9.848 -5.174 1.00 0.00 H new ATOM 0 HD3 LYS A 39 11.226 10.281 -5.412 1.00 0.00 H new ATOM 0 HE2 LYS A 39 12.475 12.325 -5.144 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.493 12.111 -3.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.838 12.790 -3.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.365 11.384 -2.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 14.337 11.266 -3.862 1.00 0.00 H new ATOM 601 N GLU A 40 8.585 7.218 -3.116 1.00 0.00 N ATOM 602 CA GLU A 40 7.208 7.458 -2.747 1.00 0.00 C ATOM 603 C GLU A 40 6.827 6.795 -1.439 1.00 0.00 C ATOM 604 O GLU A 40 6.152 7.388 -0.602 1.00 0.00 O ATOM 605 CB GLU A 40 6.333 6.917 -3.842 1.00 0.00 C ATOM 606 CG GLU A 40 6.050 7.920 -4.922 1.00 0.00 C ATOM 607 CD GLU A 40 7.286 8.502 -5.572 1.00 0.00 C ATOM 608 OE1 GLU A 40 7.738 7.948 -6.600 1.00 0.00 O ATOM 609 OE2 GLU A 40 7.802 9.518 -5.068 1.00 0.00 O1- ATOM 0 H GLU A 40 8.701 6.858 -4.063 1.00 0.00 H new ATOM 0 HA GLU A 40 7.076 8.532 -2.612 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.812 6.043 -4.283 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.390 6.580 -3.412 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.439 7.446 -5.690 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.459 8.733 -4.501 1.00 0.00 H new ATOM 616 N LEU A 41 7.245 5.558 -1.273 1.00 0.00 N ATOM 617 CA LEU A 41 6.859 4.796 -0.108 1.00 0.00 C ATOM 618 C LEU A 41 7.649 5.278 1.117 1.00 0.00 C ATOM 619 O LEU A 41 7.114 5.326 2.228 1.00 0.00 O ATOM 620 CB LEU A 41 7.039 3.297 -0.407 1.00 0.00 C ATOM 621 CG LEU A 41 6.205 2.318 0.428 1.00 0.00 C ATOM 622 CD1 LEU A 41 6.218 0.946 -0.204 1.00 0.00 C ATOM 623 CD2 LEU A 41 6.698 2.221 1.849 1.00 0.00 C ATOM 0 H LEU A 41 7.849 5.062 -1.928 1.00 0.00 H new ATOM 0 HA LEU A 41 5.807 4.951 0.130 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.805 3.130 -1.459 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.091 3.048 -0.271 1.00 0.00 H new ATOM 0 HG LEU A 41 5.186 2.705 0.451 1.00 0.00 H new ATOM 0 HD11 LEU A 41 5.622 0.262 0.400 1.00 0.00 H new ATOM 0 HD12 LEU A 41 5.798 1.004 -1.208 1.00 0.00 H new ATOM 0 HD13 LEU A 41 7.244 0.581 -0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.077 1.516 2.402 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.731 1.875 1.853 1.00 0.00 H new ATOM 0 HD23 LEU A 41 6.642 3.202 2.321 1.00 0.00 H new ATOM 635 N GLY A 42 8.900 5.700 0.908 1.00 0.00 N ATOM 636 CA GLY A 42 9.663 6.306 1.992 1.00 0.00 C ATOM 637 C GLY A 42 9.061 7.623 2.412 1.00 0.00 C ATOM 638 O GLY A 42 9.079 7.956 3.588 1.00 0.00 O ATOM 0 H GLY A 42 9.393 5.634 0.018 1.00 0.00 H new ATOM 0 HA2 GLY A 42 9.691 5.627 2.845 1.00 0.00 H new ATOM 0 HA3 GLY A 42 10.694 6.459 1.673 1.00 0.00 H new ATOM 642 N LYS A 43 8.492 8.344 1.447 1.00 0.00 N ATOM 643 CA LYS A 43 7.781 9.595 1.716 1.00 0.00 C ATOM 644 C LYS A 43 6.848 9.417 2.909 1.00 0.00 C ATOM 645 O LYS A 43 6.830 10.223 3.840 1.00 0.00 O ATOM 646 CB LYS A 43 6.961 10.002 0.478 1.00 0.00 C ATOM 647 CG LYS A 43 5.798 10.936 0.792 1.00 0.00 C ATOM 648 CD LYS A 43 4.650 10.799 -0.210 1.00 0.00 C ATOM 649 CE LYS A 43 4.863 11.636 -1.462 1.00 0.00 C ATOM 650 NZ LYS A 43 6.009 11.159 -2.276 1.00 0.00 N1+ ATOM 0 H LYS A 43 8.510 8.080 0.462 1.00 0.00 H new ATOM 0 HA LYS A 43 8.508 10.375 1.943 1.00 0.00 H new ATOM 0 HB2 LYS A 43 7.621 10.488 -0.240 1.00 0.00 H new ATOM 0 HB3 LYS A 43 6.574 9.103 -0.002 1.00 0.00 H new ATOM 0 HG2 LYS A 43 5.428 10.725 1.795 1.00 0.00 H new ATOM 0 HG3 LYS A 43 6.154 11.966 0.794 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.542 9.752 -0.492 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.717 11.098 0.268 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.957 11.615 -2.068 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.031 12.674 -1.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 5.777 11.245 -3.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 6.849 11.734 -2.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 6.205 10.163 -2.050 1.00 0.00 H new ATOM 664 N VAL A 44 6.093 8.335 2.868 1.00 0.00 N ATOM 665 CA VAL A 44 5.146 8.020 3.917 1.00 0.00 C ATOM 666 C VAL A 44 5.807 7.386 5.124 1.00 0.00 C ATOM 667 O VAL A 44 5.474 7.736 6.235 1.00 0.00 O ATOM 668 CB VAL A 44 4.036 7.110 3.381 1.00 0.00 C ATOM 669 CG1 VAL A 44 3.046 6.733 4.484 1.00 0.00 C ATOM 670 CG2 VAL A 44 3.360 7.822 2.222 1.00 0.00 C ATOM 0 H VAL A 44 6.120 7.654 2.110 1.00 0.00 H new ATOM 0 HA VAL A 44 4.712 8.964 4.247 1.00 0.00 H new ATOM 0 HB VAL A 44 4.460 6.170 3.026 1.00 0.00 H new ATOM 0 HG11 VAL A 44 2.271 6.087 4.072 1.00 0.00 H new ATOM 0 HG12 VAL A 44 3.572 6.206 5.280 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.589 7.637 4.887 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.564 7.193 1.823 1.00 0.00 H new ATOM 0 HG22 VAL A 44 2.937 8.764 2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.093 8.021 1.440 1.00 0.00 H new ATOM 680 N MET A 45 6.737 6.472 4.909 1.00 0.00 N ATOM 681 CA MET A 45 7.382 5.774 6.017 1.00 0.00 C ATOM 682 C MET A 45 8.089 6.754 6.943 1.00 0.00 C ATOM 683 O MET A 45 7.869 6.727 8.148 1.00 0.00 O ATOM 684 CB MET A 45 8.371 4.743 5.482 1.00 0.00 C ATOM 685 CG MET A 45 7.727 3.653 4.641 1.00 0.00 C ATOM 686 SD MET A 45 7.120 2.254 5.600 1.00 0.00 S ATOM 687 CE MET A 45 5.663 2.965 6.332 1.00 0.00 C ATOM 0 H MET A 45 7.064 6.194 3.984 1.00 0.00 H new ATOM 0 HA MET A 45 6.611 5.262 6.593 1.00 0.00 H new ATOM 0 HB2 MET A 45 9.125 5.253 4.883 1.00 0.00 H new ATOM 0 HB3 MET A 45 8.890 4.282 6.322 1.00 0.00 H new ATOM 0 HG2 MET A 45 6.898 4.083 4.079 1.00 0.00 H new ATOM 0 HG3 MET A 45 8.453 3.293 3.912 1.00 0.00 H new ATOM 0 HE1 MET A 45 4.919 2.185 6.492 1.00 0.00 H new ATOM 0 HE2 MET A 45 5.922 3.421 7.287 1.00 0.00 H new ATOM 0 HE3 MET A 45 5.255 3.725 5.666 1.00 0.00 H new ATOM 697 N ARG A 46 8.925 7.619 6.379 1.00 0.00 N ATOM 698 CA ARG A 46 9.543 8.701 7.129 1.00 0.00 C ATOM 699 C ARG A 46 8.482 9.489 7.897 1.00 0.00 C ATOM 700 O ARG A 46 8.544 9.626 9.118 1.00 0.00 O ATOM 701 CB ARG A 46 10.249 9.620 6.151 1.00 0.00 C ATOM 702 CG ARG A 46 11.138 8.879 5.172 1.00 0.00 C ATOM 703 CD ARG A 46 11.905 9.832 4.296 1.00 0.00 C ATOM 704 NE ARG A 46 13.025 9.193 3.615 1.00 0.00 N ATOM 705 CZ ARG A 46 13.830 9.823 2.760 1.00 0.00 C ATOM 706 NH1 ARG A 46 13.613 11.098 2.447 1.00 0.00 N1+ ATOM 707 NH2 ARG A 46 14.858 9.179 2.229 1.00 0.00 N ATOM 0 H ARG A 46 9.191 7.589 5.395 1.00 0.00 H new ATOM 0 HA ARG A 46 10.254 8.290 7.845 1.00 0.00 H new ATOM 0 HB2 ARG A 46 9.504 10.190 5.596 1.00 0.00 H new ATOM 0 HB3 ARG A 46 10.851 10.338 6.707 1.00 0.00 H new ATOM 0 HG2 ARG A 46 11.835 8.245 5.720 1.00 0.00 H new ATOM 0 HG3 ARG A 46 10.529 8.222 4.551 1.00 0.00 H new ATOM 0 HD2 ARG A 46 11.231 10.260 3.554 1.00 0.00 H new ATOM 0 HD3 ARG A 46 12.277 10.657 4.903 1.00 0.00 H new ATOM 0 HE ARG A 46 13.203 8.207 3.804 1.00 0.00 H new ATOM 0 HH11 ARG A 46 12.827 11.598 2.862 1.00 0.00 H new ATOM 0 HH12 ARG A 46 14.233 11.575 1.792 1.00 0.00 H new ATOM 0 HH21 ARG A 46 15.031 8.204 2.475 1.00 0.00 H new ATOM 0 HH22 ARG A 46 15.477 9.658 1.574 1.00 0.00 H new ATOM 721 N MET A 47 7.513 9.988 7.149 1.00 0.00 N ATOM 722 CA MET A 47 6.331 10.658 7.696 1.00 0.00 C ATOM 723 C MET A 47 5.624 9.829 8.779 1.00 0.00 C ATOM 724 O MET A 47 5.016 10.373 9.700 1.00 0.00 O ATOM 725 CB MET A 47 5.365 10.950 6.546 1.00 0.00 C ATOM 726 CG MET A 47 3.912 10.919 6.950 1.00 0.00 C ATOM 727 SD MET A 47 2.830 11.781 5.795 1.00 0.00 S ATOM 728 CE MET A 47 3.054 10.778 4.332 1.00 0.00 C ATOM 0 H MET A 47 7.519 9.942 6.130 1.00 0.00 H new ATOM 0 HA MET A 47 6.657 11.580 8.177 1.00 0.00 H new ATOM 0 HB2 MET A 47 5.596 11.930 6.130 1.00 0.00 H new ATOM 0 HB3 MET A 47 5.528 10.220 5.753 1.00 0.00 H new ATOM 0 HG2 MET A 47 3.588 9.882 7.035 1.00 0.00 H new ATOM 0 HG3 MET A 47 3.808 11.367 7.938 1.00 0.00 H new ATOM 0 HE1 MET A 47 2.409 11.148 3.535 1.00 0.00 H new ATOM 0 HE2 MET A 47 4.094 10.831 4.010 1.00 0.00 H new ATOM 0 HE3 MET A 47 2.796 9.743 4.557 1.00 0.00 H new ATOM 738 N LEU A 48 5.725 8.522 8.665 1.00 0.00 N ATOM 739 CA LEU A 48 4.991 7.602 9.490 1.00 0.00 C ATOM 740 C LEU A 48 5.780 7.186 10.727 1.00 0.00 C ATOM 741 O LEU A 48 5.288 6.435 11.566 1.00 0.00 O ATOM 742 CB LEU A 48 4.645 6.413 8.631 1.00 0.00 C ATOM 743 CG LEU A 48 3.176 6.338 8.213 1.00 0.00 C ATOM 744 CD1 LEU A 48 2.902 5.049 7.472 1.00 0.00 C ATOM 745 CD2 LEU A 48 2.255 6.449 9.416 1.00 0.00 C ATOM 0 H LEU A 48 6.331 8.067 7.983 1.00 0.00 H new ATOM 0 HA LEU A 48 4.087 8.080 9.867 1.00 0.00 H new ATOM 0 HB2 LEU A 48 5.264 6.436 7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 48 4.902 5.503 9.172 1.00 0.00 H new ATOM 0 HG LEU A 48 2.976 7.180 7.550 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.852 5.012 7.182 1.00 0.00 H new ATOM 0 HD12 LEU A 48 3.527 5.002 6.580 1.00 0.00 H new ATOM 0 HD13 LEU A 48 3.130 4.202 8.119 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.218 6.392 9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.461 5.633 10.108 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.425 7.402 9.918 1.00 0.00 H new ATOM 757 N GLY A 49 7.007 7.680 10.833 1.00 0.00 N ATOM 758 CA GLY A 49 7.831 7.387 11.991 1.00 0.00 C ATOM 759 C GLY A 49 8.888 6.345 11.696 1.00 0.00 C ATOM 760 O GLY A 49 9.774 6.095 12.513 1.00 0.00 O ATOM 0 H GLY A 49 7.448 8.280 10.136 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.313 8.303 12.332 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.197 7.037 12.806 1.00 0.00 H new ATOM 764 N GLN A 50 8.783 5.731 10.533 1.00 0.00 N ATOM 765 CA GLN A 50 9.777 4.786 10.061 1.00 0.00 C ATOM 766 C GLN A 50 10.914 5.529 9.380 1.00 0.00 C ATOM 767 O GLN A 50 10.858 6.747 9.204 1.00 0.00 O ATOM 768 CB GLN A 50 9.168 3.804 9.055 1.00 0.00 C ATOM 769 CG GLN A 50 8.364 2.654 9.644 1.00 0.00 C ATOM 770 CD GLN A 50 6.942 3.013 10.051 1.00 0.00 C ATOM 771 OE1 GLN A 50 6.647 4.136 10.446 1.00 0.00 O ATOM 772 NE2 GLN A 50 6.043 2.049 9.938 1.00 0.00 N ATOM 0 H GLN A 50 8.006 5.873 9.888 1.00 0.00 H new ATOM 0 HA GLN A 50 10.147 4.233 10.924 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.522 4.363 8.378 1.00 0.00 H new ATOM 0 HB3 GLN A 50 9.974 3.386 8.453 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.325 1.845 8.914 1.00 0.00 H new ATOM 0 HG3 GLN A 50 8.891 2.270 10.517 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.324 1.126 9.606 1.00 0.00 H new ATOM 0 HE22 GLN A 50 5.069 2.228 10.183 1.00 0.00 H new ATOM 781 N ASN A 51 11.933 4.789 8.984 1.00 0.00 N ATOM 782 CA ASN A 51 13.014 5.339 8.179 1.00 0.00 C ATOM 783 C ASN A 51 13.728 4.214 7.440 1.00 0.00 C ATOM 784 O ASN A 51 14.905 3.931 7.662 1.00 0.00 O ATOM 785 CB ASN A 51 13.981 6.167 9.034 1.00 0.00 C ATOM 786 CG ASN A 51 14.680 5.378 10.134 1.00 0.00 C ATOM 787 OD1 ASN A 51 14.124 4.441 10.704 1.00 0.00 O ATOM 788 ND2 ASN A 51 15.917 5.749 10.430 1.00 0.00 N ATOM 0 H ASN A 51 12.037 3.799 9.207 1.00 0.00 H new ATOM 0 HA ASN A 51 12.593 6.020 7.440 1.00 0.00 H new ATOM 0 HB2 ASN A 51 14.736 6.608 8.383 1.00 0.00 H new ATOM 0 HB3 ASN A 51 13.431 6.991 9.488 1.00 0.00 H new ATOM 0 HD21 ASN A 51 16.440 5.252 11.151 1.00 0.00 H new ATOM 0 HD22 ASN A 51 16.347 6.531 9.936 1.00 0.00 H new ATOM 795 N PRO A 52 12.983 3.548 6.551 1.00 0.00 N ATOM 796 CA PRO A 52 13.475 2.405 5.769 1.00 0.00 C ATOM 797 C PRO A 52 14.513 2.793 4.741 1.00 0.00 C ATOM 798 O PRO A 52 14.628 3.960 4.365 1.00 0.00 O ATOM 799 CB PRO A 52 12.229 1.931 5.030 1.00 0.00 C ATOM 800 CG PRO A 52 11.360 3.132 4.954 1.00 0.00 C ATOM 801 CD PRO A 52 11.577 3.857 6.229 1.00 0.00 C ATOM 0 HA PRO A 52 13.950 1.667 6.415 1.00 0.00 H new ATOM 0 HB2 PRO A 52 12.476 1.556 4.037 1.00 0.00 H new ATOM 0 HB3 PRO A 52 11.736 1.118 5.564 1.00 0.00 H new ATOM 0 HG2 PRO A 52 11.624 3.754 4.099 1.00 0.00 H new ATOM 0 HG3 PRO A 52 10.313 2.853 4.834 1.00 0.00 H new ATOM 0 HD2 PRO A 52 11.415 4.929 6.116 1.00 0.00 H new ATOM 0 HD3 PRO A 52 10.899 3.512 7.010 1.00 0.00 H new ATOM 809 N THR A 53 15.251 1.807 4.276 1.00 0.00 N ATOM 810 CA THR A 53 16.074 1.980 3.102 1.00 0.00 C ATOM 811 C THR A 53 15.277 1.672 1.870 1.00 0.00 C ATOM 812 O THR A 53 14.226 1.031 1.947 1.00 0.00 O ATOM 813 CB THR A 53 17.312 1.075 3.095 1.00 0.00 C ATOM 814 OG1 THR A 53 16.993 -0.227 3.601 1.00 0.00 O ATOM 815 CG2 THR A 53 18.426 1.705 3.884 1.00 0.00 C ATOM 0 H THR A 53 15.297 0.878 4.694 1.00 0.00 H new ATOM 0 HA THR A 53 16.407 3.018 3.117 1.00 0.00 H new ATOM 0 HB THR A 53 17.649 0.958 2.065 1.00 0.00 H new ATOM 0 HG1 THR A 53 16.688 -0.151 4.529 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.297 1.050 3.869 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.687 2.666 3.441 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.102 1.856 4.914 1.00 0.00 H new ATOM 823 N PRO A 54 15.752 2.137 0.722 1.00 0.00 N ATOM 824 CA PRO A 54 15.217 1.746 -0.565 1.00 0.00 C ATOM 825 C PRO A 54 15.048 0.232 -0.695 1.00 0.00 C ATOM 826 O PRO A 54 14.200 -0.242 -1.443 1.00 0.00 O ATOM 827 CB PRO A 54 16.247 2.273 -1.539 1.00 0.00 C ATOM 828 CG PRO A 54 16.741 3.485 -0.873 1.00 0.00 C ATOM 829 CD PRO A 54 16.805 3.149 0.584 1.00 0.00 C ATOM 0 HA PRO A 54 14.216 2.142 -0.735 1.00 0.00 H new ATOM 0 HB2 PRO A 54 17.046 1.552 -1.710 1.00 0.00 H new ATOM 0 HB3 PRO A 54 15.806 2.497 -2.510 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.723 3.768 -1.253 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.075 4.329 -1.051 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.782 2.759 0.868 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.615 4.021 1.210 1.00 0.00 H new ATOM 837 N GLU A 55 15.859 -0.518 0.058 1.00 0.00 N ATOM 838 CA GLU A 55 15.772 -1.975 0.086 1.00 0.00 C ATOM 839 C GLU A 55 14.452 -2.426 0.692 1.00 0.00 C ATOM 840 O GLU A 55 13.702 -3.188 0.081 1.00 0.00 O ATOM 841 CB GLU A 55 16.905 -2.554 0.925 1.00 0.00 C ATOM 842 CG GLU A 55 17.048 -4.039 0.806 1.00 0.00 C ATOM 843 CD GLU A 55 17.904 -4.643 1.898 1.00 0.00 C ATOM 844 OE1 GLU A 55 19.137 -4.465 1.859 1.00 0.00 O ATOM 845 OE2 GLU A 55 17.345 -5.313 2.794 1.00 0.00 O1- ATOM 0 H GLU A 55 16.587 -0.133 0.659 1.00 0.00 H new ATOM 0 HA GLU A 55 15.844 -2.331 -0.942 1.00 0.00 H new ATOM 0 HB2 GLU A 55 17.842 -2.083 0.627 1.00 0.00 H new ATOM 0 HB3 GLU A 55 16.738 -2.297 1.971 1.00 0.00 H new ATOM 0 HG2 GLU A 55 16.059 -4.496 0.833 1.00 0.00 H new ATOM 0 HG3 GLU A 55 17.484 -4.279 -0.164 1.00 0.00 H new ATOM 852 N GLU A 56 14.174 -1.926 1.891 1.00 0.00 N ATOM 853 CA GLU A 56 12.973 -2.232 2.610 1.00 0.00 C ATOM 854 C GLU A 56 11.766 -1.695 1.880 1.00 0.00 C ATOM 855 O GLU A 56 10.730 -2.350 1.781 1.00 0.00 O ATOM 856 CB GLU A 56 13.097 -1.614 3.966 1.00 0.00 C ATOM 857 CG GLU A 56 14.021 -2.388 4.860 1.00 0.00 C ATOM 858 CD GLU A 56 14.648 -1.528 5.930 1.00 0.00 C ATOM 859 OE1 GLU A 56 14.475 -1.839 7.125 1.00 0.00 O ATOM 860 OE2 GLU A 56 15.320 -0.533 5.583 1.00 0.00 O1- ATOM 0 H GLU A 56 14.796 -1.288 2.387 1.00 0.00 H new ATOM 0 HA GLU A 56 12.840 -3.310 2.696 1.00 0.00 H new ATOM 0 HB2 GLU A 56 13.463 -0.592 3.866 1.00 0.00 H new ATOM 0 HB3 GLU A 56 12.112 -1.556 4.428 1.00 0.00 H new ATOM 0 HG2 GLU A 56 13.469 -3.202 5.330 1.00 0.00 H new ATOM 0 HG3 GLU A 56 14.807 -2.843 4.257 1.00 0.00 H new ATOM 867 N LEU A 57 11.919 -0.490 1.363 1.00 0.00 N ATOM 868 CA LEU A 57 10.909 0.132 0.560 1.00 0.00 C ATOM 869 C LEU A 57 10.614 -0.720 -0.657 1.00 0.00 C ATOM 870 O LEU A 57 9.461 -0.987 -0.952 1.00 0.00 O ATOM 871 CB LEU A 57 11.391 1.523 0.179 1.00 0.00 C ATOM 872 CG LEU A 57 11.508 2.475 1.369 1.00 0.00 C ATOM 873 CD1 LEU A 57 12.158 3.792 0.975 1.00 0.00 C ATOM 874 CD2 LEU A 57 10.136 2.705 1.982 1.00 0.00 C ATOM 0 H LEU A 57 12.755 0.079 1.495 1.00 0.00 H new ATOM 0 HA LEU A 57 9.976 0.224 1.116 1.00 0.00 H new ATOM 0 HB2 LEU A 57 12.363 1.441 -0.308 1.00 0.00 H new ATOM 0 HB3 LEU A 57 10.704 1.950 -0.551 1.00 0.00 H new ATOM 0 HG LEU A 57 12.155 2.012 2.114 1.00 0.00 H new ATOM 0 HD11 LEU A 57 12.223 4.441 1.848 1.00 0.00 H new ATOM 0 HD12 LEU A 57 13.159 3.602 0.589 1.00 0.00 H new ATOM 0 HD13 LEU A 57 11.558 4.278 0.205 1.00 0.00 H new ATOM 0 HD21 LEU A 57 10.225 3.384 2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 57 9.473 3.142 1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 57 9.725 1.754 2.321 1.00 0.00 H new ATOM 886 N GLN A 58 11.659 -1.200 -1.323 1.00 0.00 N ATOM 887 CA GLN A 58 11.480 -2.030 -2.503 1.00 0.00 C ATOM 888 C GLN A 58 10.815 -3.346 -2.132 1.00 0.00 C ATOM 889 O GLN A 58 10.106 -3.922 -2.935 1.00 0.00 O ATOM 890 CB GLN A 58 12.805 -2.313 -3.206 1.00 0.00 C ATOM 891 CG GLN A 58 12.623 -2.810 -4.627 1.00 0.00 C ATOM 892 CD GLN A 58 13.894 -3.391 -5.217 1.00 0.00 C ATOM 893 OE1 GLN A 58 14.727 -3.953 -4.506 1.00 0.00 O ATOM 894 NE2 GLN A 58 14.053 -3.255 -6.522 1.00 0.00 N ATOM 0 H GLN A 58 12.631 -1.029 -1.066 1.00 0.00 H new ATOM 0 HA GLN A 58 10.841 -1.476 -3.190 1.00 0.00 H new ATOM 0 HB2 GLN A 58 13.406 -1.404 -3.218 1.00 0.00 H new ATOM 0 HB3 GLN A 58 13.362 -3.056 -2.635 1.00 0.00 H new ATOM 0 HG2 GLN A 58 11.841 -3.569 -4.644 1.00 0.00 H new ATOM 0 HG3 GLN A 58 12.281 -1.986 -5.254 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.339 -2.783 -7.076 1.00 0.00 H new ATOM 0 HE22 GLN A 58 14.890 -3.623 -6.975 1.00 0.00 H new ATOM 903 N GLU A 59 11.046 -3.818 -0.913 1.00 0.00 N ATOM 904 CA GLU A 59 10.399 -5.036 -0.442 1.00 0.00 C ATOM 905 C GLU A 59 8.906 -4.823 -0.254 1.00 0.00 C ATOM 906 O GLU A 59 8.098 -5.694 -0.580 1.00 0.00 O ATOM 907 CB GLU A 59 11.019 -5.524 0.846 1.00 0.00 C ATOM 908 CG GLU A 59 12.405 -6.101 0.673 1.00 0.00 C ATOM 909 CD GLU A 59 12.752 -7.089 1.760 1.00 0.00 C ATOM 910 OE1 GLU A 59 12.391 -8.276 1.617 1.00 0.00 O ATOM 911 OE2 GLU A 59 13.399 -6.697 2.753 1.00 0.00 O1- ATOM 0 H GLU A 59 11.672 -3.380 -0.237 1.00 0.00 H new ATOM 0 HA GLU A 59 10.549 -5.799 -1.206 1.00 0.00 H new ATOM 0 HB2 GLU A 59 11.066 -4.696 1.553 1.00 0.00 H new ATOM 0 HB3 GLU A 59 10.372 -6.283 1.286 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.473 -6.593 -0.297 1.00 0.00 H new ATOM 0 HG3 GLU A 59 13.136 -5.292 0.673 1.00 0.00 H new ATOM 918 N MET A 60 8.548 -3.660 0.269 1.00 0.00 N ATOM 919 CA MET A 60 7.150 -3.285 0.420 1.00 0.00 C ATOM 920 C MET A 60 6.539 -2.995 -0.946 1.00 0.00 C ATOM 921 O MET A 60 5.386 -3.327 -1.207 1.00 0.00 O ATOM 922 CB MET A 60 7.027 -2.090 1.331 1.00 0.00 C ATOM 923 CG MET A 60 5.695 -2.050 2.029 1.00 0.00 C ATOM 924 SD MET A 60 4.812 -3.622 1.953 1.00 0.00 S ATOM 925 CE MET A 60 3.155 -3.074 2.309 1.00 0.00 C ATOM 0 H MET A 60 9.210 -2.957 0.597 1.00 0.00 H new ATOM 0 HA MET A 60 6.604 -4.113 0.872 1.00 0.00 H new ATOM 0 HB2 MET A 60 7.825 -2.116 2.073 1.00 0.00 H new ATOM 0 HB3 MET A 60 7.160 -1.177 0.751 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.846 -1.774 3.073 1.00 0.00 H new ATOM 0 HG3 MET A 60 5.079 -1.271 1.580 1.00 0.00 H new ATOM 0 HE1 MET A 60 2.442 -3.695 1.767 1.00 0.00 H new ATOM 0 HE2 MET A 60 2.967 -3.155 3.380 1.00 0.00 H new ATOM 0 HE3 MET A 60 3.041 -2.035 1.999 1.00 0.00 H new ATOM 935 N ILE A 61 7.334 -2.382 -1.818 1.00 0.00 N ATOM 936 CA ILE A 61 6.959 -2.209 -3.216 1.00 0.00 C ATOM 937 C ILE A 61 6.721 -3.580 -3.844 1.00 0.00 C ATOM 938 O ILE A 61 5.685 -3.841 -4.444 1.00 0.00 O ATOM 939 CB ILE A 61 8.063 -1.481 -4.019 1.00 0.00 C ATOM 940 CG1 ILE A 61 8.316 -0.083 -3.452 1.00 0.00 C ATOM 941 CG2 ILE A 61 7.710 -1.397 -5.499 1.00 0.00 C ATOM 942 CD1 ILE A 61 7.120 0.840 -3.477 1.00 0.00 C ATOM 0 H ILE A 61 8.247 -1.995 -1.578 1.00 0.00 H new ATOM 0 HA ILE A 61 6.054 -1.602 -3.248 1.00 0.00 H new ATOM 0 HB ILE A 61 8.978 -2.066 -3.923 1.00 0.00 H new ATOM 0 HG12 ILE A 61 8.659 -0.181 -2.422 1.00 0.00 H new ATOM 0 HG13 ILE A 61 9.126 0.380 -4.015 1.00 0.00 H new ATOM 0 HG21 ILE A 61 8.506 -0.880 -6.034 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.595 -2.403 -5.903 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.776 -0.848 -5.620 1.00 0.00 H new ATOM 0 HD11 ILE A 61 7.397 1.806 -3.055 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.786 0.975 -4.506 1.00 0.00 H new ATOM 0 HD13 ILE A 61 6.312 0.405 -2.888 1.00 0.00 H new ATOM 954 N ASP A 62 7.691 -4.462 -3.640 1.00 0.00 N ATOM 955 CA ASP A 62 7.711 -5.784 -4.254 1.00 0.00 C ATOM 956 C ASP A 62 6.563 -6.654 -3.764 1.00 0.00 C ATOM 957 O ASP A 62 6.143 -7.573 -4.466 1.00 0.00 O ATOM 958 CB ASP A 62 9.042 -6.473 -3.976 1.00 0.00 C ATOM 959 CG ASP A 62 9.286 -7.642 -4.900 1.00 0.00 C ATOM 960 OD1 ASP A 62 9.274 -8.795 -4.425 1.00 0.00 O ATOM 961 OD2 ASP A 62 9.494 -7.412 -6.108 1.00 0.00 O1- ATOM 0 H ASP A 62 8.494 -4.278 -3.038 1.00 0.00 H new ATOM 0 HA ASP A 62 7.589 -5.648 -5.329 1.00 0.00 H new ATOM 0 HB2 ASP A 62 9.852 -5.752 -4.085 1.00 0.00 H new ATOM 0 HB3 ASP A 62 9.060 -6.819 -2.943 1.00 0.00 H new ATOM 966 N GLU A 63 6.058 -6.365 -2.559 1.00 0.00 N ATOM 967 CA GLU A 63 4.876 -7.035 -2.028 1.00 0.00 C ATOM 968 C GLU A 63 3.770 -7.022 -3.051 1.00 0.00 C ATOM 969 O GLU A 63 2.966 -7.950 -3.147 1.00 0.00 O ATOM 970 CB GLU A 63 4.366 -6.311 -0.794 1.00 0.00 C ATOM 971 CG GLU A 63 4.671 -7.020 0.500 1.00 0.00 C ATOM 972 CD GLU A 63 3.777 -8.225 0.718 1.00 0.00 C ATOM 973 OE1 GLU A 63 2.664 -8.064 1.268 1.00 0.00 O ATOM 974 OE2 GLU A 63 4.174 -9.338 0.334 1.00 0.00 O1- ATOM 0 H GLU A 63 6.457 -5.665 -1.933 1.00 0.00 H new ATOM 0 HA GLU A 63 5.157 -8.058 -1.778 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.805 -5.314 -0.763 1.00 0.00 H new ATOM 0 HB3 GLU A 63 3.287 -6.182 -0.881 1.00 0.00 H new ATOM 0 HG2 GLU A 63 5.713 -7.338 0.501 1.00 0.00 H new ATOM 0 HG3 GLU A 63 4.549 -6.325 1.331 1.00 0.00 H new ATOM 981 N VAL A 64 3.753 -5.951 -3.818 1.00 0.00 N ATOM 982 CA VAL A 64 2.636 -5.654 -4.656 1.00 0.00 C ATOM 983 C VAL A 64 3.027 -5.335 -6.101 1.00 0.00 C ATOM 984 O VAL A 64 2.180 -5.353 -6.985 1.00 0.00 O ATOM 985 CB VAL A 64 1.801 -4.524 -4.022 1.00 0.00 C ATOM 986 CG1 VAL A 64 0.604 -5.148 -3.399 1.00 0.00 C ATOM 987 CG2 VAL A 64 2.544 -3.786 -2.916 1.00 0.00 C ATOM 0 H VAL A 64 4.513 -5.273 -3.870 1.00 0.00 H new ATOM 0 HA VAL A 64 2.026 -6.555 -4.723 1.00 0.00 H new ATOM 0 HB VAL A 64 1.561 -3.808 -4.808 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.012 -4.375 -2.939 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.025 -5.666 -4.163 1.00 0.00 H new ATOM 0 HG13 VAL A 64 0.920 -5.861 -2.637 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.905 -3.002 -2.509 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.808 -4.487 -2.124 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.451 -3.339 -3.323 1.00 0.00 H new ATOM 997 N ASP A 65 4.309 -5.080 -6.333 1.00 0.00 N ATOM 998 CA ASP A 65 4.833 -4.835 -7.681 1.00 0.00 C ATOM 999 C ASP A 65 4.664 -6.068 -8.577 1.00 0.00 C ATOM 1000 O ASP A 65 5.504 -6.973 -8.581 1.00 0.00 O ATOM 1001 CB ASP A 65 6.310 -4.440 -7.589 1.00 0.00 C ATOM 1002 CG ASP A 65 6.979 -4.268 -8.940 1.00 0.00 C ATOM 1003 OD1 ASP A 65 7.726 -5.182 -9.350 1.00 0.00 O ATOM 1004 OD2 ASP A 65 6.784 -3.218 -9.584 1.00 0.00 O1- ATOM 0 H ASP A 65 5.016 -5.036 -5.599 1.00 0.00 H new ATOM 0 HA ASP A 65 4.266 -4.021 -8.132 1.00 0.00 H new ATOM 0 HB2 ASP A 65 6.394 -3.508 -7.030 1.00 0.00 H new ATOM 0 HB3 ASP A 65 6.846 -5.201 -7.022 1.00 0.00 H new ATOM 1009 N GLU A 66 3.550 -6.119 -9.292 1.00 0.00 N ATOM 1010 CA GLU A 66 3.247 -7.218 -10.186 1.00 0.00 C ATOM 1011 C GLU A 66 3.754 -6.944 -11.595 1.00 0.00 C ATOM 1012 O GLU A 66 4.183 -7.859 -12.302 1.00 0.00 O ATOM 1013 CB GLU A 66 1.750 -7.465 -10.231 1.00 0.00 C ATOM 1014 CG GLU A 66 1.403 -8.736 -10.944 1.00 0.00 C ATOM 1015 CD GLU A 66 -0.073 -9.056 -10.922 1.00 0.00 C ATOM 1016 OE1 GLU A 66 -0.514 -9.732 -9.972 1.00 0.00 O ATOM 1017 OE2 GLU A 66 -0.793 -8.664 -11.863 1.00 0.00 O1- ATOM 0 H GLU A 66 2.831 -5.396 -9.266 1.00 0.00 H new ATOM 0 HA GLU A 66 3.753 -8.103 -9.800 1.00 0.00 H new ATOM 0 HB2 GLU A 66 1.360 -7.504 -9.214 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.261 -6.627 -10.728 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.736 -8.665 -11.980 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.952 -9.560 -10.489 1.00 0.00 H new ATOM 1024 N ASP A 67 3.687 -5.687 -12.012 1.00 0.00 N ATOM 1025 CA ASP A 67 4.068 -5.325 -13.374 1.00 0.00 C ATOM 1026 C ASP A 67 5.586 -5.243 -13.508 1.00 0.00 C ATOM 1027 O ASP A 67 6.125 -5.151 -14.613 1.00 0.00 O ATOM 1028 CB ASP A 67 3.420 -3.991 -13.767 1.00 0.00 C ATOM 1029 CG ASP A 67 3.654 -3.628 -15.219 1.00 0.00 C ATOM 1030 OD1 ASP A 67 4.573 -2.831 -15.498 1.00 0.00 O ATOM 1031 OD2 ASP A 67 2.918 -4.140 -16.090 1.00 0.00 O1- ATOM 0 H ASP A 67 3.376 -4.906 -11.434 1.00 0.00 H new ATOM 0 HA ASP A 67 3.710 -6.101 -14.051 1.00 0.00 H new ATOM 0 HB2 ASP A 67 2.348 -4.044 -13.579 1.00 0.00 H new ATOM 0 HB3 ASP A 67 3.816 -3.199 -13.131 1.00 0.00 H new ATOM 1036 N GLY A 68 6.273 -5.325 -12.378 1.00 0.00 N ATOM 1037 CA GLY A 68 7.721 -5.389 -12.385 1.00 0.00 C ATOM 1038 C GLY A 68 8.372 -4.060 -12.704 1.00 0.00 C ATOM 1039 O GLY A 68 9.548 -4.008 -13.059 1.00 0.00 O ATOM 0 H GLY A 68 5.850 -5.349 -11.450 1.00 0.00 H new ATOM 0 HA2 GLY A 68 8.068 -5.732 -11.411 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.043 -6.130 -13.117 1.00 0.00 H new ATOM 1043 N SER A 69 7.622 -2.981 -12.566 1.00 0.00 N ATOM 1044 CA SER A 69 8.125 -1.664 -12.919 1.00 0.00 C ATOM 1045 C SER A 69 8.786 -0.977 -11.730 1.00 0.00 C ATOM 1046 O SER A 69 9.148 0.199 -11.806 1.00 0.00 O ATOM 1047 CB SER A 69 6.995 -0.796 -13.470 1.00 0.00 C ATOM 1048 OG SER A 69 6.571 -1.258 -14.745 1.00 0.00 O ATOM 0 H SER A 69 6.665 -2.990 -12.213 1.00 0.00 H new ATOM 0 HA SER A 69 8.884 -1.795 -13.690 1.00 0.00 H new ATOM 0 HB2 SER A 69 6.153 -0.806 -12.777 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.331 0.238 -13.548 1.00 0.00 H new ATOM 0 HG SER A 69 5.825 -1.883 -14.635 1.00 0.00 H new ATOM 1054 N GLY A 70 8.932 -1.705 -10.630 1.00 0.00 N ATOM 1055 CA GLY A 70 9.567 -1.144 -9.452 1.00 0.00 C ATOM 1056 C GLY A 70 8.681 -0.121 -8.790 1.00 0.00 C ATOM 1057 O GLY A 70 9.140 0.726 -8.022 1.00 0.00 O ATOM 0 H GLY A 70 8.623 -2.672 -10.532 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.797 -1.941 -8.745 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.514 -0.682 -9.731 1.00 0.00 H new ATOM 1061 N THR A 71 7.405 -0.207 -9.107 1.00 0.00 N ATOM 1062 CA THR A 71 6.422 0.739 -8.640 1.00 0.00 C ATOM 1063 C THR A 71 5.096 0.058 -8.423 1.00 0.00 C ATOM 1064 O THR A 71 4.685 -0.789 -9.210 1.00 0.00 O ATOM 1065 CB THR A 71 6.223 1.881 -9.646 1.00 0.00 C ATOM 1066 OG1 THR A 71 6.451 1.415 -10.984 1.00 0.00 O ATOM 1067 CG2 THR A 71 7.134 3.046 -9.336 1.00 0.00 C ATOM 0 H THR A 71 7.022 -0.943 -9.701 1.00 0.00 H new ATOM 0 HA THR A 71 6.791 1.149 -7.700 1.00 0.00 H new ATOM 0 HB THR A 71 5.192 2.225 -9.563 1.00 0.00 H new ATOM 0 HG1 THR A 71 6.319 2.154 -11.615 1.00 0.00 H new ATOM 0 HG21 THR A 71 6.971 3.840 -10.065 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.917 3.422 -8.336 1.00 0.00 H new ATOM 0 HG23 THR A 71 8.173 2.718 -9.383 1.00 0.00 H new ATOM 1075 N VAL A 72 4.439 0.434 -7.357 1.00 0.00 N ATOM 1076 CA VAL A 72 3.126 -0.071 -7.068 1.00 0.00 C ATOM 1077 C VAL A 72 2.070 0.895 -7.553 1.00 0.00 C ATOM 1078 O VAL A 72 2.045 2.062 -7.155 1.00 0.00 O ATOM 1079 CB VAL A 72 2.961 -0.327 -5.568 1.00 0.00 C ATOM 1080 CG1 VAL A 72 1.496 -0.364 -5.175 1.00 0.00 C ATOM 1081 CG2 VAL A 72 3.618 -1.628 -5.218 1.00 0.00 C ATOM 0 H VAL A 72 4.798 1.096 -6.669 1.00 0.00 H new ATOM 0 HA VAL A 72 3.002 -1.018 -7.594 1.00 0.00 H new ATOM 0 HB VAL A 72 3.433 0.488 -5.020 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.411 -0.548 -4.104 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.030 0.591 -5.418 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.993 -1.162 -5.721 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.505 -1.817 -4.151 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.150 -2.435 -5.781 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.678 -1.579 -5.467 1.00 0.00 H new ATOM 1091 N ASP A 73 1.211 0.412 -8.420 1.00 0.00 N ATOM 1092 CA ASP A 73 0.129 1.225 -8.916 1.00 0.00 C ATOM 1093 C ASP A 73 -1.120 0.930 -8.114 1.00 0.00 C ATOM 1094 O ASP A 73 -1.095 0.096 -7.213 1.00 0.00 O ATOM 1095 CB ASP A 73 -0.102 1.008 -10.420 1.00 0.00 C ATOM 1096 CG ASP A 73 -0.724 -0.339 -10.769 1.00 0.00 C ATOM 1097 OD1 ASP A 73 -1.927 -0.546 -10.490 1.00 0.00 O ATOM 1098 OD2 ASP A 73 -0.024 -1.183 -11.368 1.00 0.00 O1- ATOM 0 H ASP A 73 1.241 -0.536 -8.794 1.00 0.00 H new ATOM 0 HA ASP A 73 0.392 2.276 -8.794 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -0.748 1.802 -10.795 1.00 0.00 H new ATOM 0 HB3 ASP A 73 0.852 1.101 -10.940 1.00 0.00 H new ATOM 1103 N PHE A 74 -2.199 1.612 -8.442 1.00 0.00 N ATOM 1104 CA PHE A 74 -3.401 1.583 -7.624 1.00 0.00 C ATOM 1105 C PHE A 74 -3.891 0.168 -7.335 1.00 0.00 C ATOM 1106 O PHE A 74 -4.080 -0.192 -6.178 1.00 0.00 O ATOM 1107 CB PHE A 74 -4.518 2.381 -8.283 1.00 0.00 C ATOM 1108 CG PHE A 74 -5.845 2.207 -7.602 1.00 0.00 C ATOM 1109 CD1 PHE A 74 -6.994 1.969 -8.340 1.00 0.00 C ATOM 1110 CD2 PHE A 74 -5.940 2.265 -6.218 1.00 0.00 C ATOM 1111 CE1 PHE A 74 -8.213 1.798 -7.713 1.00 0.00 C ATOM 1112 CE2 PHE A 74 -7.155 2.093 -5.590 1.00 0.00 C ATOM 1113 CZ PHE A 74 -8.293 1.861 -6.337 1.00 0.00 C ATOM 0 H PHE A 74 -2.271 2.197 -9.274 1.00 0.00 H new ATOM 0 HA PHE A 74 -3.131 2.037 -6.671 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -4.251 3.438 -8.282 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.608 2.076 -9.326 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -6.936 1.917 -9.417 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -5.054 2.447 -5.628 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -9.102 1.615 -8.299 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -7.217 2.140 -4.513 1.00 0.00 H new ATOM 0 HZ PHE A 74 -9.245 1.729 -5.844 1.00 0.00 H new ATOM 1123 N ASP A 75 -4.102 -0.626 -8.369 1.00 0.00 N ATOM 1124 CA ASP A 75 -4.724 -1.935 -8.189 1.00 0.00 C ATOM 1125 C ASP A 75 -3.798 -2.869 -7.409 1.00 0.00 C ATOM 1126 O ASP A 75 -4.254 -3.688 -6.610 1.00 0.00 O ATOM 1127 CB ASP A 75 -5.093 -2.538 -9.541 1.00 0.00 C ATOM 1128 CG ASP A 75 -6.019 -3.735 -9.429 1.00 0.00 C ATOM 1129 OD1 ASP A 75 -7.252 -3.533 -9.334 1.00 0.00 O ATOM 1130 OD2 ASP A 75 -5.523 -4.876 -9.470 1.00 0.00 O1- ATOM 0 H ASP A 75 -3.857 -0.396 -9.332 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.639 -1.808 -7.610 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.570 -1.774 -10.154 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.182 -2.839 -10.058 1.00 0.00 H new ATOM 1135 N GLU A 76 -2.496 -2.713 -7.626 1.00 0.00 N ATOM 1136 CA GLU A 76 -1.490 -3.403 -6.829 1.00 0.00 C ATOM 1137 C GLU A 76 -1.596 -2.966 -5.379 1.00 0.00 C ATOM 1138 O GLU A 76 -1.758 -3.775 -4.476 1.00 0.00 O ATOM 1139 CB GLU A 76 -0.106 -3.093 -7.359 1.00 0.00 C ATOM 1140 CG GLU A 76 0.144 -3.651 -8.738 1.00 0.00 C ATOM 1141 CD GLU A 76 1.466 -3.207 -9.325 1.00 0.00 C ATOM 1142 OE1 GLU A 76 2.115 -4.014 -10.029 1.00 0.00 O ATOM 1143 OE2 GLU A 76 1.859 -2.051 -9.097 1.00 0.00 O1- ATOM 0 H GLU A 76 -2.112 -2.110 -8.353 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.661 -4.478 -6.894 1.00 0.00 H new ATOM 0 HB2 GLU A 76 0.033 -2.012 -7.381 1.00 0.00 H new ATOM 0 HB3 GLU A 76 0.637 -3.496 -6.671 1.00 0.00 H new ATOM 0 HG2 GLU A 76 0.120 -4.740 -8.693 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.664 -3.342 -9.401 1.00 0.00 H new ATOM 1150 N PHE A 77 -1.538 -1.663 -5.191 1.00 0.00 N ATOM 1151 CA PHE A 77 -1.654 -1.036 -3.882 1.00 0.00 C ATOM 1152 C PHE A 77 -2.941 -1.445 -3.177 1.00 0.00 C ATOM 1153 O PHE A 77 -2.988 -1.513 -1.958 1.00 0.00 O ATOM 1154 CB PHE A 77 -1.575 0.477 -4.087 1.00 0.00 C ATOM 1155 CG PHE A 77 -1.985 1.349 -2.945 1.00 0.00 C ATOM 1156 CD1 PHE A 77 -3.303 1.519 -2.669 1.00 0.00 C ATOM 1157 CD2 PHE A 77 -1.054 2.023 -2.186 1.00 0.00 C ATOM 1158 CE1 PHE A 77 -3.715 2.351 -1.648 1.00 0.00 C ATOM 1159 CE2 PHE A 77 -1.443 2.854 -1.159 1.00 0.00 C ATOM 1160 CZ PHE A 77 -2.782 3.017 -0.889 1.00 0.00 C ATOM 0 H PHE A 77 -1.407 -0.997 -5.952 1.00 0.00 H new ATOM 0 HA PHE A 77 -0.843 -1.366 -3.233 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -0.547 0.728 -4.350 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -2.195 0.733 -4.946 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -4.041 0.995 -3.258 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -0.003 1.898 -2.400 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -4.768 2.479 -1.446 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -0.702 3.374 -0.570 1.00 0.00 H new ATOM 0 HZ PHE A 77 -3.099 3.665 -0.085 1.00 0.00 H new ATOM 1170 N LEU A 78 -3.979 -1.716 -3.942 1.00 0.00 N ATOM 1171 CA LEU A 78 -5.239 -2.153 -3.381 1.00 0.00 C ATOM 1172 C LEU A 78 -5.102 -3.558 -2.817 1.00 0.00 C ATOM 1173 O LEU A 78 -5.525 -3.826 -1.692 1.00 0.00 O ATOM 1174 CB LEU A 78 -6.316 -2.106 -4.452 1.00 0.00 C ATOM 1175 CG LEU A 78 -7.747 -2.032 -3.947 1.00 0.00 C ATOM 1176 CD1 LEU A 78 -7.803 -1.420 -2.561 1.00 0.00 C ATOM 1177 CD2 LEU A 78 -8.555 -1.194 -4.901 1.00 0.00 C ATOM 0 H LEU A 78 -3.973 -1.640 -4.959 1.00 0.00 H new ATOM 0 HA LEU A 78 -5.524 -1.486 -2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.130 -1.242 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.217 -2.992 -5.079 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.154 -3.041 -3.889 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -8.838 -1.379 -2.223 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -7.220 -2.029 -1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -7.391 -0.411 -2.592 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.585 -1.133 -4.549 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.130 -0.192 -4.954 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -8.536 -1.649 -5.891 1.00 0.00 H new ATOM 1189 N VAL A 79 -4.511 -4.451 -3.604 1.00 0.00 N ATOM 1190 CA VAL A 79 -4.105 -5.750 -3.099 1.00 0.00 C ATOM 1191 C VAL A 79 -3.207 -5.558 -1.877 1.00 0.00 C ATOM 1192 O VAL A 79 -3.402 -6.212 -0.863 1.00 0.00 O ATOM 1193 CB VAL A 79 -3.404 -6.592 -4.207 1.00 0.00 C ATOM 1194 CG1 VAL A 79 -1.973 -6.918 -3.867 1.00 0.00 C ATOM 1195 CG2 VAL A 79 -4.149 -7.877 -4.440 1.00 0.00 C ATOM 0 H VAL A 79 -4.305 -4.296 -4.591 1.00 0.00 H new ATOM 0 HA VAL A 79 -4.989 -6.310 -2.796 1.00 0.00 H new ATOM 0 HB VAL A 79 -3.409 -5.980 -5.109 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.532 -7.506 -4.672 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.409 -5.994 -3.742 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.941 -7.491 -2.940 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -3.646 -8.453 -5.217 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -4.173 -8.456 -3.517 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -5.168 -7.655 -4.756 1.00 0.00 H new ATOM 1205 N MET A 80 -2.272 -4.604 -1.966 1.00 0.00 N ATOM 1206 CA MET A 80 -1.384 -4.267 -0.853 1.00 0.00 C ATOM 1207 C MET A 80 -2.199 -3.897 0.371 1.00 0.00 C ATOM 1208 O MET A 80 -1.965 -4.393 1.472 1.00 0.00 O ATOM 1209 CB MET A 80 -0.453 -3.093 -1.216 1.00 0.00 C ATOM 1210 CG MET A 80 0.552 -2.762 -0.127 1.00 0.00 C ATOM 1211 SD MET A 80 1.769 -1.529 -0.618 1.00 0.00 S ATOM 1212 CE MET A 80 0.747 -0.068 -0.711 1.00 0.00 C ATOM 0 H MET A 80 -2.112 -4.049 -2.807 1.00 0.00 H new ATOM 0 HA MET A 80 -0.773 -5.144 -0.639 1.00 0.00 H new ATOM 0 HB2 MET A 80 0.083 -3.334 -2.134 1.00 0.00 H new ATOM 0 HB3 MET A 80 -1.058 -2.210 -1.423 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.017 -2.402 0.752 1.00 0.00 H new ATOM 0 HG3 MET A 80 1.070 -3.675 0.167 1.00 0.00 H new ATOM 0 HE1 MET A 80 1.207 0.656 -1.383 1.00 0.00 H new ATOM 0 HE2 MET A 80 -0.239 -0.337 -1.088 1.00 0.00 H new ATOM 0 HE3 MET A 80 0.648 0.371 0.282 1.00 0.00 H new ATOM 1222 N MET A 81 -3.173 -3.044 0.147 1.00 0.00 N ATOM 1223 CA MET A 81 -4.023 -2.535 1.178 1.00 0.00 C ATOM 1224 C MET A 81 -4.795 -3.642 1.885 1.00 0.00 C ATOM 1225 O MET A 81 -4.979 -3.591 3.101 1.00 0.00 O ATOM 1226 CB MET A 81 -4.952 -1.526 0.537 1.00 0.00 C ATOM 1227 CG MET A 81 -4.311 -0.166 0.368 1.00 0.00 C ATOM 1228 SD MET A 81 -3.598 0.465 1.900 1.00 0.00 S ATOM 1229 CE MET A 81 -1.868 0.007 1.709 1.00 0.00 C ATOM 0 H MET A 81 -3.394 -2.682 -0.781 1.00 0.00 H new ATOM 0 HA MET A 81 -3.423 -2.060 1.954 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.268 -1.898 -0.438 1.00 0.00 H new ATOM 0 HB3 MET A 81 -5.850 -1.427 1.147 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.532 -0.228 -0.392 1.00 0.00 H new ATOM 0 HG3 MET A 81 -5.057 0.539 0.002 1.00 0.00 H new ATOM 0 HE1 MET A 81 -1.481 -0.359 2.660 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.780 -0.776 0.956 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.293 0.878 1.395 1.00 0.00 H new ATOM 1239 N VAL A 82 -5.232 -4.654 1.144 1.00 0.00 N ATOM 1240 CA VAL A 82 -5.915 -5.777 1.776 1.00 0.00 C ATOM 1241 C VAL A 82 -4.897 -6.736 2.399 1.00 0.00 C ATOM 1242 O VAL A 82 -5.193 -7.416 3.383 1.00 0.00 O ATOM 1243 CB VAL A 82 -6.826 -6.572 0.821 1.00 0.00 C ATOM 1244 CG1 VAL A 82 -7.532 -5.707 -0.189 1.00 0.00 C ATOM 1245 CG2 VAL A 82 -6.057 -7.627 0.115 1.00 0.00 C ATOM 0 H VAL A 82 -5.130 -4.721 0.131 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.556 -5.337 2.540 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.591 -7.026 1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.156 -6.331 -0.829 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.156 -4.979 0.329 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -6.795 -5.184 -0.799 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.721 -8.175 -0.554 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.257 -7.167 -0.465 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -5.628 -8.314 0.844 1.00 0.00 H new ATOM 1255 N ARG A 83 -3.694 -6.789 1.822 1.00 0.00 N ATOM 1256 CA ARG A 83 -2.624 -7.619 2.366 1.00 0.00 C ATOM 1257 C ARG A 83 -2.277 -7.128 3.763 1.00 0.00 C ATOM 1258 O ARG A 83 -1.916 -7.911 4.645 1.00 0.00 O ATOM 1259 CB ARG A 83 -1.369 -7.580 1.474 1.00 0.00 C ATOM 1260 CG ARG A 83 -1.582 -8.111 0.071 1.00 0.00 C ATOM 1261 CD ARG A 83 -0.365 -7.896 -0.831 1.00 0.00 C ATOM 1262 NE ARG A 83 0.756 -8.793 -0.536 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.117 -9.818 -1.320 1.00 0.00 C ATOM 1264 NH1 ARG A 83 0.401 -10.129 -2.398 1.00 0.00 N1+ ATOM 1265 NH2 ARG A 83 2.208 -10.517 -1.041 1.00 0.00 N ATOM 0 H ARG A 83 -3.440 -6.269 0.982 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.973 -8.651 2.404 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -1.015 -6.551 1.410 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.580 -8.159 1.953 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -1.809 -9.176 0.120 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -2.449 -7.620 -0.372 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -0.665 -8.034 -1.870 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -0.028 -6.864 -0.731 1.00 0.00 H new ATOM 0 HE ARG A 83 1.293 -8.627 0.316 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -0.430 -9.585 -2.633 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.683 -10.911 -2.989 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.775 -10.275 -0.228 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.481 -11.297 -1.639 1.00 0.00 H new ATOM 1279 N SER A 84 -2.375 -5.817 3.938 1.00 0.00 N ATOM 1280 CA SER A 84 -2.142 -5.183 5.223 1.00 0.00 C ATOM 1281 C SER A 84 -3.357 -5.288 6.156 1.00 0.00 C ATOM 1282 O SER A 84 -3.236 -5.084 7.365 1.00 0.00 O ATOM 1283 CB SER A 84 -1.744 -3.725 5.000 1.00 0.00 C ATOM 1284 OG SER A 84 -2.522 -3.119 3.984 1.00 0.00 O ATOM 0 H SER A 84 -2.618 -5.166 3.192 1.00 0.00 H new ATOM 0 HA SER A 84 -1.329 -5.711 5.721 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.863 -3.169 5.930 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.689 -3.673 4.730 1.00 0.00 H new ATOM 0 HG SER A 84 -3.432 -3.483 4.008 1.00 0.00 H new ATOM 1290 N MET A 85 -4.522 -5.598 5.594 1.00 0.00 N ATOM 1291 CA MET A 85 -5.741 -5.743 6.358 1.00 0.00 C ATOM 1292 C MET A 85 -5.698 -6.979 7.239 1.00 0.00 C ATOM 1293 O MET A 85 -6.052 -6.938 8.413 1.00 0.00 O ATOM 1294 CB MET A 85 -6.897 -5.872 5.404 1.00 0.00 C ATOM 1295 CG MET A 85 -7.316 -4.591 4.723 1.00 0.00 C ATOM 1296 SD MET A 85 -8.657 -4.863 3.550 1.00 0.00 S ATOM 1297 CE MET A 85 -8.629 -3.321 2.648 1.00 0.00 C ATOM 0 H MET A 85 -4.639 -5.755 4.593 1.00 0.00 H new ATOM 0 HA MET A 85 -5.854 -4.867 6.996 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.636 -6.603 4.639 1.00 0.00 H new ATOM 0 HB3 MET A 85 -7.753 -6.272 5.948 1.00 0.00 H new ATOM 0 HG2 MET A 85 -7.632 -3.867 5.474 1.00 0.00 H new ATOM 0 HG3 MET A 85 -6.461 -4.159 4.203 1.00 0.00 H new ATOM 0 HE1 MET A 85 -9.000 -3.485 1.636 1.00 0.00 H new ATOM 0 HE2 MET A 85 -9.263 -2.592 3.153 1.00 0.00 H new ATOM 0 HE3 MET A 85 -7.607 -2.944 2.603 1.00 0.00 H new ATOM 1307 N LYS A 86 -5.266 -8.081 6.640 1.00 0.00 N ATOM 1308 CA LYS A 86 -5.248 -9.375 7.282 1.00 0.00 C ATOM 1309 C LYS A 86 -4.381 -9.382 8.532 1.00 0.00 C ATOM 1310 O LYS A 86 -4.722 -10.011 9.533 1.00 0.00 O ATOM 1311 CB LYS A 86 -4.735 -10.387 6.268 1.00 0.00 C ATOM 1312 CG LYS A 86 -5.783 -10.818 5.259 1.00 0.00 C ATOM 1313 CD LYS A 86 -6.915 -11.576 5.930 1.00 0.00 C ATOM 1314 CE LYS A 86 -8.032 -11.887 4.954 1.00 0.00 C ATOM 1315 NZ LYS A 86 -9.138 -12.640 5.597 1.00 0.00 N1+ ATOM 0 H LYS A 86 -4.915 -8.094 5.682 1.00 0.00 H new ATOM 0 HA LYS A 86 -6.256 -9.630 7.608 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.885 -9.958 5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -4.369 -11.266 6.798 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.182 -9.941 4.748 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.321 -11.448 4.498 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.532 -12.504 6.353 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.308 -10.986 6.758 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.420 -10.957 4.539 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -7.635 -12.467 4.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -9.881 -12.832 4.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.774 -13.539 5.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.535 -12.076 6.376 1.00 0.00 H new ATOM 1329 N ASP A 87 -3.270 -8.671 8.460 1.00 0.00 N ATOM 1330 CA ASP A 87 -2.312 -8.606 9.552 1.00 0.00 C ATOM 1331 C ASP A 87 -1.176 -7.689 9.147 1.00 0.00 C ATOM 1332 O ASP A 87 -1.051 -7.371 7.960 1.00 0.00 O ATOM 1333 CB ASP A 87 -1.765 -10.006 9.880 1.00 0.00 C ATOM 1334 CG ASP A 87 -0.757 -10.000 11.012 1.00 0.00 C ATOM 1335 OD1 ASP A 87 -1.177 -10.060 12.188 1.00 0.00 O ATOM 1336 OD2 ASP A 87 0.460 -9.927 10.732 1.00 0.00 O1- ATOM 0 H ASP A 87 -3.005 -8.121 7.643 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.806 -8.219 10.443 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -2.595 -10.661 10.144 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.299 -10.426 8.988 1.00 0.00 H new ATOM 1341 N ASP A 88 -0.363 -7.263 10.107 1.00 0.00 N ATOM 1342 CA ASP A 88 0.818 -6.457 9.814 1.00 0.00 C ATOM 1343 C ASP A 88 1.606 -7.088 8.678 1.00 0.00 C ATOM 1344 O ASP A 88 2.018 -6.408 7.744 1.00 0.00 O ATOM 1345 CB ASP A 88 1.721 -6.340 11.042 1.00 0.00 C ATOM 1346 CG ASP A 88 1.018 -5.750 12.245 1.00 0.00 C ATOM 1347 OD1 ASP A 88 1.263 -4.569 12.567 1.00 0.00 O ATOM 1348 OD2 ASP A 88 0.218 -6.469 12.881 1.00 0.00 O1- ATOM 0 H ASP A 88 -0.500 -7.463 11.098 1.00 0.00 H new ATOM 0 HA ASP A 88 0.482 -5.460 9.527 1.00 0.00 H new ATOM 0 HB2 ASP A 88 2.102 -7.328 11.300 1.00 0.00 H new ATOM 0 HB3 ASP A 88 2.583 -5.721 10.793 1.00 0.00 H new ATOM 1353 N SER A 89 1.765 -8.405 8.745 1.00 0.00 N ATOM 1354 CA SER A 89 2.515 -9.138 7.736 1.00 0.00 C ATOM 1355 C SER A 89 1.673 -10.242 7.090 1.00 0.00 C ATOM 1356 O SER A 89 2.217 -11.199 6.542 1.00 0.00 O ATOM 1357 CB SER A 89 3.790 -9.708 8.355 1.00 0.00 C ATOM 1358 OG SER A 89 3.665 -9.800 9.767 1.00 0.00 O ATOM 0 H SER A 89 1.383 -8.987 9.490 1.00 0.00 H new ATOM 0 HA SER A 89 2.786 -8.444 6.940 1.00 0.00 H new ATOM 0 HB2 SER A 89 3.993 -10.694 7.938 1.00 0.00 H new ATOM 0 HB3 SER A 89 4.639 -9.073 8.101 1.00 0.00 H new ATOM 0 HG SER A 89 4.427 -10.298 10.131 1.00 0.00 H new ATOM 1364 N LYS A 90 0.347 -10.071 7.137 1.00 0.00 N ATOM 1365 CA LYS A 90 -0.611 -11.038 6.578 1.00 0.00 C ATOM 1366 C LYS A 90 -0.323 -12.448 7.116 1.00 0.00 C ATOM 1367 O LYS A 90 -0.763 -12.801 8.207 1.00 0.00 O ATOM 1368 CB LYS A 90 -0.584 -11.010 5.033 1.00 0.00 C ATOM 1369 CG LYS A 90 -1.861 -11.509 4.338 1.00 0.00 C ATOM 1370 CD LYS A 90 -2.235 -12.929 4.734 1.00 0.00 C ATOM 1371 CE LYS A 90 -3.195 -13.576 3.752 1.00 0.00 C ATOM 1372 NZ LYS A 90 -2.509 -14.019 2.511 1.00 0.00 N1+ ATOM 0 H LYS A 90 -0.095 -9.257 7.564 1.00 0.00 H new ATOM 0 HA LYS A 90 -1.615 -10.754 6.894 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.391 -9.987 4.709 1.00 0.00 H new ATOM 0 HB3 LYS A 90 0.255 -11.616 4.691 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.686 -10.840 4.582 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.722 -11.463 3.258 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.330 -13.533 4.803 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.688 -12.918 5.725 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.675 -14.432 4.226 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.984 -12.868 3.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.074 -14.758 2.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.401 -13.210 1.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.571 -14.399 2.750 1.00 0.00 H new ATOM 1386 N GLY A 136 0.439 -13.230 6.360 1.00 0.00 N ATOM 1387 CA GLY A 136 0.789 -14.565 6.787 1.00 0.00 C ATOM 1388 C GLY A 136 2.124 -14.581 7.481 1.00 0.00 C ATOM 1389 O GLY A 136 3.066 -15.221 7.021 1.00 0.00 O ATOM 0 H GLY A 136 0.821 -12.958 5.454 1.00 0.00 H new ATOM 0 HA2 GLY A 136 0.022 -14.947 7.460 1.00 0.00 H new ATOM 0 HA3 GLY A 136 0.817 -15.230 5.924 1.00 0.00 H new ATOM 1393 N LYS A 137 2.206 -13.850 8.577 1.00 0.00 N ATOM 1394 CA LYS A 137 3.433 -13.737 9.340 1.00 0.00 C ATOM 1395 C LYS A 137 3.931 -15.114 9.778 1.00 0.00 C ATOM 1396 O LYS A 137 3.137 -15.986 10.137 1.00 0.00 O ATOM 1397 CB LYS A 137 3.201 -12.822 10.540 1.00 0.00 C ATOM 1398 CG LYS A 137 2.064 -13.279 11.440 1.00 0.00 C ATOM 1399 CD LYS A 137 1.731 -12.235 12.486 1.00 0.00 C ATOM 1400 CE LYS A 137 0.530 -12.646 13.322 1.00 0.00 C ATOM 1401 NZ LYS A 137 0.036 -11.525 14.167 1.00 0.00 N1+ ATOM 0 H LYS A 137 1.425 -13.319 8.962 1.00 0.00 H new ATOM 0 HA LYS A 137 4.208 -13.300 8.711 1.00 0.00 H new ATOM 0 HB2 LYS A 137 4.118 -12.766 11.127 1.00 0.00 H new ATOM 0 HB3 LYS A 137 2.989 -11.814 10.183 1.00 0.00 H new ATOM 0 HG2 LYS A 137 1.180 -13.485 10.836 1.00 0.00 H new ATOM 0 HG3 LYS A 137 2.339 -14.212 11.931 1.00 0.00 H new ATOM 0 HD2 LYS A 137 2.593 -12.082 13.136 1.00 0.00 H new ATOM 0 HD3 LYS A 137 1.527 -11.282 11.998 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -0.271 -12.987 12.665 1.00 0.00 H new ATOM 0 HE3 LYS A 137 0.801 -13.489 13.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -0.464 -11.908 14.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.841 -10.949 14.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -0.615 -10.933 13.613 1.00 0.00 H new ATOM 1415 N PHE A 138 5.250 -15.295 9.694 1.00 0.00 N ATOM 1416 CA PHE A 138 5.926 -16.562 10.009 1.00 0.00 C ATOM 1417 C PHE A 138 5.762 -17.587 8.880 1.00 0.00 C ATOM 1418 O PHE A 138 6.582 -18.494 8.734 1.00 0.00 O ATOM 1419 CB PHE A 138 5.451 -17.145 11.350 1.00 0.00 C ATOM 1420 CG PHE A 138 6.174 -18.401 11.750 1.00 0.00 C ATOM 1421 CD1 PHE A 138 7.530 -18.371 12.034 1.00 0.00 C ATOM 1422 CD2 PHE A 138 5.499 -19.607 11.850 1.00 0.00 C ATOM 1423 CE1 PHE A 138 8.201 -19.523 12.397 1.00 0.00 C ATOM 1424 CE2 PHE A 138 6.166 -20.762 12.214 1.00 0.00 C ATOM 1425 CZ PHE A 138 7.517 -20.719 12.493 1.00 0.00 C ATOM 0 H PHE A 138 5.891 -14.557 9.401 1.00 0.00 H new ATOM 0 HA PHE A 138 6.988 -16.337 10.104 1.00 0.00 H new ATOM 0 HB2 PHE A 138 5.584 -16.395 12.130 1.00 0.00 H new ATOM 0 HB3 PHE A 138 4.383 -17.355 11.288 1.00 0.00 H new ATOM 0 HD1 PHE A 138 8.068 -17.437 11.971 1.00 0.00 H new ATOM 0 HD2 PHE A 138 4.440 -19.645 11.641 1.00 0.00 H new ATOM 0 HE1 PHE A 138 9.260 -19.488 12.606 1.00 0.00 H new ATOM 0 HE2 PHE A 138 5.630 -21.697 12.280 1.00 0.00 H new ATOM 0 HZ PHE A 138 8.038 -21.619 12.786 1.00 0.00 H new ATOM 1435 N LYS A 139 4.714 -17.441 8.081 1.00 0.00 N ATOM 1436 CA LYS A 139 4.485 -18.336 6.955 1.00 0.00 C ATOM 1437 C LYS A 139 5.041 -17.735 5.667 1.00 0.00 C ATOM 1438 O LYS A 139 5.448 -18.452 4.749 1.00 0.00 O ATOM 1439 CB LYS A 139 2.999 -18.633 6.805 1.00 0.00 C ATOM 1440 CG LYS A 139 2.686 -19.637 5.708 1.00 0.00 C ATOM 1441 CD LYS A 139 1.206 -19.972 5.659 1.00 0.00 C ATOM 1442 CE LYS A 139 0.904 -20.963 4.551 1.00 0.00 C ATOM 1443 NZ LYS A 139 -0.522 -21.377 4.547 1.00 0.00 N1+ ATOM 0 H LYS A 139 4.009 -16.712 8.191 1.00 0.00 H new ATOM 0 HA LYS A 139 5.008 -19.272 7.150 1.00 0.00 H new ATOM 0 HB2 LYS A 139 2.615 -19.012 7.752 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.471 -17.703 6.596 1.00 0.00 H new ATOM 0 HG2 LYS A 139 3.000 -19.234 4.745 1.00 0.00 H new ATOM 0 HG3 LYS A 139 3.260 -20.548 5.874 1.00 0.00 H new ATOM 0 HD2 LYS A 139 0.893 -20.387 6.617 1.00 0.00 H new ATOM 0 HD3 LYS A 139 0.629 -19.061 5.502 1.00 0.00 H new ATOM 0 HE2 LYS A 139 1.155 -20.518 3.588 1.00 0.00 H new ATOM 0 HE3 LYS A 139 1.536 -21.843 4.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -0.685 -22.054 3.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -0.756 -21.826 5.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -1.126 -20.542 4.408 1.00 0.00 H new ATOM 1457 N ARG A 140 5.041 -16.414 5.598 1.00 0.00 N ATOM 1458 CA ARG A 140 5.590 -15.710 4.458 1.00 0.00 C ATOM 1459 C ARG A 140 6.706 -14.778 4.900 1.00 0.00 C ATOM 1460 O ARG A 140 6.755 -14.336 6.051 1.00 0.00 O ATOM 1461 CB ARG A 140 4.511 -14.898 3.744 1.00 0.00 C ATOM 1462 CG ARG A 140 3.333 -15.718 3.244 1.00 0.00 C ATOM 1463 CD ARG A 140 3.669 -16.500 1.982 1.00 0.00 C ATOM 1464 NE ARG A 140 4.705 -17.511 2.202 1.00 0.00 N ATOM 1465 CZ ARG A 140 5.414 -18.073 1.226 1.00 0.00 C ATOM 1466 NH1 ARG A 140 5.190 -17.736 -0.040 1.00 0.00 N1+ ATOM 1467 NH2 ARG A 140 6.347 -18.969 1.519 1.00 0.00 N ATOM 0 H ARG A 140 4.663 -15.807 6.325 1.00 0.00 H new ATOM 0 HA ARG A 140 5.987 -16.454 3.768 1.00 0.00 H new ATOM 0 HB2 ARG A 140 4.141 -14.131 4.425 1.00 0.00 H new ATOM 0 HB3 ARG A 140 4.963 -14.381 2.897 1.00 0.00 H new ATOM 0 HG2 ARG A 140 3.017 -16.410 4.025 1.00 0.00 H new ATOM 0 HG3 ARG A 140 2.490 -15.056 3.045 1.00 0.00 H new ATOM 0 HD2 ARG A 140 2.767 -16.985 1.609 1.00 0.00 H new ATOM 0 HD3 ARG A 140 4.001 -15.808 1.208 1.00 0.00 H new ATOM 0 HE ARG A 140 4.895 -17.802 3.161 1.00 0.00 H new ATOM 0 HH11 ARG A 140 4.474 -17.046 -0.265 1.00 0.00 H new ATOM 0 HH12 ARG A 140 5.734 -18.168 -0.787 1.00 0.00 H new ATOM 0 HH21 ARG A 140 6.520 -19.226 2.491 1.00 0.00 H new ATOM 0 HH22 ARG A 140 6.892 -19.401 0.773 1.00 0.00 H new ATOM 1481 N PRO A 141 7.610 -14.476 3.972 1.00 0.00 N ATOM 1482 CA PRO A 141 8.680 -13.519 4.176 1.00 0.00 C ATOM 1483 C PRO A 141 8.182 -12.090 3.996 1.00 0.00 C ATOM 1484 O PRO A 141 8.743 -11.312 3.223 1.00 0.00 O ATOM 1485 CB PRO A 141 9.701 -13.873 3.088 1.00 0.00 C ATOM 1486 CG PRO A 141 9.021 -14.796 2.130 1.00 0.00 C ATOM 1487 CD PRO A 141 7.634 -15.056 2.634 1.00 0.00 C ATOM 0 HA PRO A 141 9.095 -13.568 5.183 1.00 0.00 H new ATOM 0 HB2 PRO A 141 10.047 -12.974 2.577 1.00 0.00 H new ATOM 0 HB3 PRO A 141 10.579 -14.349 3.524 1.00 0.00 H new ATOM 0 HG2 PRO A 141 8.987 -14.353 1.135 1.00 0.00 H new ATOM 0 HG3 PRO A 141 9.576 -15.730 2.044 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.886 -14.595 1.989 1.00 0.00 H new ATOM 0 HD3 PRO A 141 7.417 -16.124 2.662 1.00 0.00 H new ATOM 1495 N THR A 142 7.124 -11.762 4.724 1.00 0.00 N ATOM 1496 CA THR A 142 6.466 -10.474 4.606 1.00 0.00 C ATOM 1497 C THR A 142 7.241 -9.386 5.335 1.00 0.00 C ATOM 1498 O THR A 142 6.724 -8.762 6.266 1.00 0.00 O ATOM 1499 CB THR A 142 5.037 -10.536 5.162 1.00 0.00 C ATOM 1500 OG1 THR A 142 4.525 -11.872 5.054 1.00 0.00 O ATOM 1501 CG2 THR A 142 4.130 -9.588 4.395 1.00 0.00 C ATOM 0 H THR A 142 6.700 -12.383 5.413 1.00 0.00 H new ATOM 0 HA THR A 142 6.430 -10.229 3.545 1.00 0.00 H new ATOM 0 HB THR A 142 5.062 -10.239 6.210 1.00 0.00 H new ATOM 0 HG1 THR A 142 3.665 -11.931 5.519 1.00 0.00 H new ATOM 0 HG21 THR A 142 3.120 -9.643 4.801 1.00 0.00 H new ATOM 0 HG22 THR A 142 4.505 -8.569 4.491 1.00 0.00 H new ATOM 0 HG23 THR A 142 4.114 -9.871 3.343 1.00 0.00 H new ATOM 1509 N LEU A 143 8.487 -9.186 4.903 1.00 0.00 N ATOM 1510 CA LEU A 143 9.303 -8.054 5.328 1.00 0.00 C ATOM 1511 C LEU A 143 9.740 -8.156 6.787 1.00 0.00 C ATOM 1512 O LEU A 143 8.976 -8.561 7.659 1.00 0.00 O ATOM 1513 CB LEU A 143 8.554 -6.749 5.097 1.00 0.00 C ATOM 1514 CG LEU A 143 8.356 -6.372 3.630 1.00 0.00 C ATOM 1515 CD1 LEU A 143 7.198 -7.134 3.003 1.00 0.00 C ATOM 1516 CD2 LEU A 143 8.150 -4.886 3.518 1.00 0.00 C ATOM 0 H LEU A 143 8.958 -9.808 4.246 1.00 0.00 H new ATOM 0 HA LEU A 143 10.208 -8.071 4.721 1.00 0.00 H new ATOM 0 HB2 LEU A 143 7.577 -6.819 5.574 1.00 0.00 H new ATOM 0 HB3 LEU A 143 9.095 -5.944 5.594 1.00 0.00 H new ATOM 0 HG LEU A 143 9.253 -6.652 3.077 1.00 0.00 H new ATOM 0 HD11 LEU A 143 7.090 -6.838 1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 143 7.395 -8.205 3.058 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.278 -6.906 3.542 1.00 0.00 H new ATOM 0 HD21 LEU A 143 8.009 -4.616 2.471 1.00 0.00 H new ATOM 0 HD22 LEU A 143 7.268 -4.597 4.090 1.00 0.00 H new ATOM 0 HD23 LEU A 143 9.024 -4.367 3.912 1.00 0.00 H new ATOM 1528 N ARG A 144 10.989 -7.795 7.042 1.00 0.00 N ATOM 1529 CA ARG A 144 11.487 -7.705 8.407 1.00 0.00 C ATOM 1530 C ARG A 144 11.223 -6.307 8.952 1.00 0.00 C ATOM 1531 O ARG A 144 11.467 -6.022 10.126 1.00 0.00 O ATOM 1532 CB ARG A 144 12.984 -8.028 8.459 1.00 0.00 C ATOM 1533 CG ARG A 144 13.864 -7.015 7.744 1.00 0.00 C ATOM 1534 CD ARG A 144 15.281 -7.536 7.574 1.00 0.00 C ATOM 1535 NE ARG A 144 15.341 -8.643 6.621 1.00 0.00 N ATOM 1536 CZ ARG A 144 16.416 -9.406 6.431 1.00 0.00 C ATOM 1537 NH1 ARG A 144 17.527 -9.184 7.123 1.00 0.00 N1+ ATOM 1538 NH2 ARG A 144 16.387 -10.387 5.538 1.00 0.00 N ATOM 0 H ARG A 144 11.675 -7.560 6.324 1.00 0.00 H new ATOM 0 HA ARG A 144 10.964 -8.435 9.025 1.00 0.00 H new ATOM 0 HB2 ARG A 144 13.295 -8.091 9.502 1.00 0.00 H new ATOM 0 HB3 ARG A 144 13.148 -9.011 8.018 1.00 0.00 H new ATOM 0 HG2 ARG A 144 13.439 -6.787 6.767 1.00 0.00 H new ATOM 0 HG3 ARG A 144 13.882 -6.083 8.309 1.00 0.00 H new ATOM 0 HD2 ARG A 144 15.927 -6.727 7.233 1.00 0.00 H new ATOM 0 HD3 ARG A 144 15.665 -7.866 8.539 1.00 0.00 H new ATOM 0 HE ARG A 144 14.508 -8.843 6.067 1.00 0.00 H new ATOM 0 HH11 ARG A 144 17.560 -8.426 7.804 1.00 0.00 H new ATOM 0 HH12 ARG A 144 18.347 -9.772 6.973 1.00 0.00 H new ATOM 0 HH21 ARG A 144 15.540 -10.558 4.995 1.00 0.00 H new ATOM 0 HH22 ARG A 144 17.211 -10.970 5.394 1.00 0.00 H new ATOM 1552 N ARG A 145 10.709 -5.447 8.082 1.00 0.00 N ATOM 1553 CA ARG A 145 10.398 -4.068 8.423 1.00 0.00 C ATOM 1554 C ARG A 145 9.405 -3.509 7.418 1.00 0.00 C ATOM 1555 O ARG A 145 9.128 -4.147 6.411 1.00 0.00 O ATOM 1556 CB ARG A 145 11.668 -3.215 8.409 1.00 0.00 C ATOM 1557 CG ARG A 145 12.044 -2.641 9.765 1.00 0.00 C ATOM 1558 CD ARG A 145 11.044 -1.596 10.234 1.00 0.00 C ATOM 1559 NE ARG A 145 11.467 -0.955 11.476 1.00 0.00 N ATOM 1560 CZ ARG A 145 10.645 -0.335 12.323 1.00 0.00 C ATOM 1561 NH1 ARG A 145 9.338 -0.292 12.089 1.00 0.00 N1+ ATOM 1562 NH2 ARG A 145 11.129 0.237 13.416 1.00 0.00 N ATOM 0 H ARG A 145 10.496 -5.690 7.115 1.00 0.00 H new ATOM 0 HA ARG A 145 9.966 -4.043 9.424 1.00 0.00 H new ATOM 0 HB2 ARG A 145 12.496 -3.821 8.041 1.00 0.00 H new ATOM 0 HB3 ARG A 145 11.534 -2.395 7.703 1.00 0.00 H new ATOM 0 HG2 ARG A 145 12.099 -3.446 10.498 1.00 0.00 H new ATOM 0 HG3 ARG A 145 13.037 -2.194 9.708 1.00 0.00 H new ATOM 0 HD2 ARG A 145 10.920 -0.839 9.459 1.00 0.00 H new ATOM 0 HD3 ARG A 145 10.071 -2.065 10.381 1.00 0.00 H new ATOM 0 HE ARG A 145 12.459 -0.984 11.712 1.00 0.00 H new ATOM 0 HH11 ARG A 145 8.954 -0.736 11.255 1.00 0.00 H new ATOM 0 HH12 ARG A 145 8.718 0.185 12.744 1.00 0.00 H new ATOM 0 HH21 ARG A 145 12.130 0.203 13.609 1.00 0.00 H new ATOM 0 HH22 ARG A 145 10.501 0.711 14.064 1.00 0.00 H new ATOM 1576 N VAL A 146 8.883 -2.321 7.714 1.00 0.00 N ATOM 1577 CA VAL A 146 8.012 -1.556 6.819 1.00 0.00 C ATOM 1578 C VAL A 146 6.924 -2.371 6.144 1.00 0.00 C ATOM 1579 O VAL A 146 6.587 -2.127 4.985 1.00 0.00 O ATOM 1580 CB VAL A 146 8.787 -0.754 5.749 1.00 0.00 C ATOM 1581 CG1 VAL A 146 9.628 0.298 6.407 1.00 0.00 C ATOM 1582 CG2 VAL A 146 9.655 -1.626 4.855 1.00 0.00 C ATOM 0 H VAL A 146 9.057 -1.851 8.602 1.00 0.00 H new ATOM 0 HA VAL A 146 7.522 -0.858 7.498 1.00 0.00 H new ATOM 0 HB VAL A 146 8.040 -0.291 5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 146 10.171 0.859 5.646 1.00 0.00 H new ATOM 0 HG12 VAL A 146 8.987 0.977 6.970 1.00 0.00 H new ATOM 0 HG13 VAL A 146 10.338 -0.175 7.085 1.00 0.00 H new ATOM 0 HG21 VAL A 146 10.171 -1.000 4.127 1.00 0.00 H new ATOM 0 HG22 VAL A 146 10.389 -2.155 5.464 1.00 0.00 H new ATOM 0 HG23 VAL A 146 9.028 -2.349 4.333 1.00 0.00 H new ATOM 1592 N ARG A 147 6.348 -3.315 6.856 1.00 0.00 N ATOM 1593 CA ARG A 147 5.171 -3.963 6.341 1.00 0.00 C ATOM 1594 C ARG A 147 3.971 -3.099 6.703 1.00 0.00 C ATOM 1595 O ARG A 147 3.449 -3.175 7.815 1.00 0.00 O ATOM 1596 CB ARG A 147 5.014 -5.384 6.886 1.00 0.00 C ATOM 1597 CG ARG A 147 4.505 -6.374 5.844 1.00 0.00 C ATOM 1598 CD ARG A 147 3.313 -5.824 5.076 1.00 0.00 C ATOM 1599 NE ARG A 147 2.733 -6.794 4.152 1.00 0.00 N ATOM 1600 CZ ARG A 147 1.529 -7.340 4.301 1.00 0.00 C ATOM 1601 NH1 ARG A 147 0.793 -7.075 5.375 1.00 0.00 N1+ ATOM 1602 NH2 ARG A 147 1.070 -8.168 3.376 1.00 0.00 N ATOM 0 H ARG A 147 6.667 -3.642 7.768 1.00 0.00 H new ATOM 0 HA ARG A 147 5.254 -4.064 5.259 1.00 0.00 H new ATOM 0 HB2 ARG A 147 5.976 -5.729 7.266 1.00 0.00 H new ATOM 0 HB3 ARG A 147 4.325 -5.368 7.730 1.00 0.00 H new ATOM 0 HG2 ARG A 147 5.308 -6.612 5.147 1.00 0.00 H new ATOM 0 HG3 ARG A 147 4.223 -7.305 6.335 1.00 0.00 H new ATOM 0 HD2 ARG A 147 2.549 -5.503 5.784 1.00 0.00 H new ATOM 0 HD3 ARG A 147 3.623 -4.940 4.519 1.00 0.00 H new ATOM 0 HE ARG A 147 3.286 -7.071 3.341 1.00 0.00 H new ATOM 0 HH11 ARG A 147 1.150 -6.447 6.096 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -0.129 -7.499 5.479 1.00 0.00 H new ATOM 0 HH21 ARG A 147 1.638 -8.383 2.557 1.00 0.00 H new ATOM 0 HH22 ARG A 147 0.148 -8.591 3.482 1.00 0.00 H new ATOM 1616 N ILE A 148 3.596 -2.237 5.767 1.00 0.00 N ATOM 1617 CA ILE A 148 2.514 -1.281 5.954 1.00 0.00 C ATOM 1618 C ILE A 148 1.236 -1.941 6.452 1.00 0.00 C ATOM 1619 O ILE A 148 0.834 -2.988 5.951 1.00 0.00 O ATOM 1620 CB ILE A 148 2.219 -0.536 4.640 1.00 0.00 C ATOM 1621 CG1 ILE A 148 3.410 0.341 4.270 1.00 0.00 C ATOM 1622 CG2 ILE A 148 0.944 0.289 4.725 1.00 0.00 C ATOM 1623 CD1 ILE A 148 3.162 1.203 3.063 1.00 0.00 C ATOM 0 H ILE A 148 4.038 -2.182 4.849 1.00 0.00 H new ATOM 0 HA ILE A 148 2.849 -0.576 6.715 1.00 0.00 H new ATOM 0 HB ILE A 148 2.061 -1.279 3.858 1.00 0.00 H new ATOM 0 HG12 ILE A 148 3.660 0.979 5.118 1.00 0.00 H new ATOM 0 HG13 ILE A 148 4.276 -0.294 4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 148 0.775 0.797 3.776 1.00 0.00 H new ATOM 0 HG22 ILE A 148 0.100 -0.366 4.941 1.00 0.00 H new ATOM 0 HG23 ILE A 148 1.041 1.028 5.520 1.00 0.00 H new ATOM 0 HD11 ILE A 148 4.049 1.801 2.855 1.00 0.00 H new ATOM 0 HD12 ILE A 148 2.941 0.570 2.203 1.00 0.00 H new ATOM 0 HD13 ILE A 148 2.316 1.863 3.255 1.00 0.00 H new ATOM 1635 N SER A 149 0.644 -1.344 7.473 1.00 0.00 N ATOM 1636 CA SER A 149 -0.712 -1.662 7.866 1.00 0.00 C ATOM 1637 C SER A 149 -1.663 -0.697 7.166 1.00 0.00 C ATOM 1638 O SER A 149 -1.315 0.471 6.963 1.00 0.00 O ATOM 1639 CB SER A 149 -0.859 -1.571 9.381 1.00 0.00 C ATOM 1640 OG SER A 149 -0.086 -2.568 10.027 1.00 0.00 O ATOM 0 H SER A 149 1.090 -0.629 8.048 1.00 0.00 H new ATOM 0 HA SER A 149 -0.955 -2.683 7.572 1.00 0.00 H new ATOM 0 HB2 SER A 149 -0.545 -0.584 9.722 1.00 0.00 H new ATOM 0 HB3 SER A 149 -1.908 -1.684 9.656 1.00 0.00 H new ATOM 0 HG SER A 149 -0.195 -2.489 10.998 1.00 0.00 H new ATOM 1646 N ALA A 150 -2.841 -1.184 6.788 1.00 0.00 N ATOM 1647 CA ALA A 150 -3.779 -0.411 5.978 1.00 0.00 C ATOM 1648 C ALA A 150 -4.010 0.975 6.557 1.00 0.00 C ATOM 1649 O ALA A 150 -3.650 1.976 5.941 1.00 0.00 O ATOM 1650 CB ALA A 150 -5.102 -1.155 5.843 1.00 0.00 C ATOM 0 H ALA A 150 -3.171 -2.118 7.032 1.00 0.00 H new ATOM 0 HA ALA A 150 -3.338 -0.288 4.989 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -5.790 -0.566 5.237 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -4.930 -2.119 5.364 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -5.533 -1.313 6.832 1.00 0.00 H new ATOM 1656 N ASP A 151 -4.559 1.038 7.761 1.00 0.00 N ATOM 1657 CA ASP A 151 -4.930 2.321 8.340 1.00 0.00 C ATOM 1658 C ASP A 151 -3.708 3.117 8.774 1.00 0.00 C ATOM 1659 O ASP A 151 -3.757 4.344 8.852 1.00 0.00 O ATOM 1660 CB ASP A 151 -5.885 2.155 9.510 1.00 0.00 C ATOM 1661 CG ASP A 151 -5.225 1.578 10.747 1.00 0.00 C ATOM 1662 OD1 ASP A 151 -5.113 0.339 10.845 1.00 0.00 O ATOM 1663 OD2 ASP A 151 -4.827 2.362 11.633 1.00 0.00 O1- ATOM 0 H ASP A 151 -4.755 0.228 8.349 1.00 0.00 H new ATOM 0 HA ASP A 151 -5.442 2.879 7.556 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -6.318 3.124 9.757 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -6.707 1.506 9.209 1.00 0.00 H new ATOM 1668 N ALA A 152 -2.625 2.414 9.053 1.00 0.00 N ATOM 1669 CA ALA A 152 -1.358 3.053 9.404 1.00 0.00 C ATOM 1670 C ALA A 152 -0.935 4.040 8.326 1.00 0.00 C ATOM 1671 O ALA A 152 -0.572 5.175 8.618 1.00 0.00 O ATOM 1672 CB ALA A 152 -0.271 2.012 9.609 1.00 0.00 C ATOM 0 H ALA A 152 -2.592 1.395 9.045 1.00 0.00 H new ATOM 0 HA ALA A 152 -1.504 3.597 10.337 1.00 0.00 H new ATOM 0 HB1 ALA A 152 0.664 2.508 9.869 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -0.560 1.338 10.415 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -0.135 1.442 8.690 1.00 0.00 H new ATOM 1678 N MET A 153 -0.976 3.606 7.077 1.00 0.00 N ATOM 1679 CA MET A 153 -0.646 4.494 5.976 1.00 0.00 C ATOM 1680 C MET A 153 -1.840 5.382 5.625 1.00 0.00 C ATOM 1681 O MET A 153 -1.666 6.505 5.160 1.00 0.00 O ATOM 1682 CB MET A 153 -0.126 3.698 4.763 1.00 0.00 C ATOM 1683 CG MET A 153 -1.118 2.718 4.142 1.00 0.00 C ATOM 1684 SD MET A 153 -2.514 3.492 3.311 1.00 0.00 S ATOM 1685 CE MET A 153 -1.712 4.415 2.010 1.00 0.00 C ATOM 0 H MET A 153 -1.231 2.657 6.803 1.00 0.00 H new ATOM 0 HA MET A 153 0.163 5.154 6.288 1.00 0.00 H new ATOM 0 HB2 MET A 153 0.188 4.405 3.995 1.00 0.00 H new ATOM 0 HB3 MET A 153 0.762 3.144 5.068 1.00 0.00 H new ATOM 0 HG2 MET A 153 -0.588 2.090 3.426 1.00 0.00 H new ATOM 0 HG3 MET A 153 -1.497 2.060 4.924 1.00 0.00 H new ATOM 0 HE1 MET A 153 -2.457 4.749 1.288 1.00 0.00 H new ATOM 0 HE2 MET A 153 -1.206 5.281 2.437 1.00 0.00 H new ATOM 0 HE3 MET A 153 -0.982 3.779 1.509 1.00 0.00 H new ATOM 1695 N MET A 154 -3.049 4.881 5.885 1.00 0.00 N ATOM 1696 CA MET A 154 -4.280 5.640 5.653 1.00 0.00 C ATOM 1697 C MET A 154 -4.194 7.015 6.293 1.00 0.00 C ATOM 1698 O MET A 154 -4.331 8.035 5.622 1.00 0.00 O ATOM 1699 CB MET A 154 -5.486 4.890 6.238 1.00 0.00 C ATOM 1700 CG MET A 154 -5.968 3.678 5.448 1.00 0.00 C ATOM 1701 SD MET A 154 -6.883 4.093 3.960 1.00 0.00 S ATOM 1702 CE MET A 154 -5.535 4.130 2.799 1.00 0.00 C ATOM 0 H MET A 154 -3.203 3.945 6.260 1.00 0.00 H new ATOM 0 HA MET A 154 -4.405 5.754 4.576 1.00 0.00 H new ATOM 0 HB2 MET A 154 -5.231 4.563 7.246 1.00 0.00 H new ATOM 0 HB3 MET A 154 -6.315 5.592 6.330 1.00 0.00 H new ATOM 0 HG2 MET A 154 -5.106 3.069 5.174 1.00 0.00 H new ATOM 0 HG3 MET A 154 -6.599 3.065 6.092 1.00 0.00 H new ATOM 0 HE1 MET A 154 -5.928 4.251 1.789 1.00 0.00 H new ATOM 0 HE2 MET A 154 -4.875 4.965 3.034 1.00 0.00 H new ATOM 0 HE3 MET A 154 -4.976 3.197 2.861 1.00 0.00 H new ATOM 1712 N GLN A 155 -3.929 7.032 7.591 1.00 0.00 N ATOM 1713 CA GLN A 155 -3.901 8.275 8.347 1.00 0.00 C ATOM 1714 C GLN A 155 -2.886 9.260 7.791 1.00 0.00 C ATOM 1715 O GLN A 155 -3.201 10.426 7.551 1.00 0.00 O ATOM 1716 CB GLN A 155 -3.568 8.015 9.810 1.00 0.00 C ATOM 1717 CG GLN A 155 -2.505 6.963 10.003 1.00 0.00 C ATOM 1718 CD GLN A 155 -2.121 6.743 11.453 1.00 0.00 C ATOM 1719 OE1 GLN A 155 -2.715 5.920 12.147 1.00 0.00 O ATOM 1720 NE2 GLN A 155 -1.117 7.469 11.915 1.00 0.00 N ATOM 0 H GLN A 155 -3.730 6.198 8.143 1.00 0.00 H new ATOM 0 HA GLN A 155 -4.898 8.708 8.260 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -3.236 8.945 10.271 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -4.474 7.706 10.332 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -2.858 6.021 9.583 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -1.616 7.250 9.441 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -0.651 8.141 11.306 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -0.809 7.357 12.881 1.00 0.00 H new ATOM 1729 N ALA A 156 -1.669 8.770 7.609 1.00 0.00 N ATOM 1730 CA ALA A 156 -0.544 9.589 7.173 1.00 0.00 C ATOM 1731 C ALA A 156 -0.836 10.327 5.873 1.00 0.00 C ATOM 1732 O ALA A 156 -0.488 11.499 5.725 1.00 0.00 O ATOM 1733 CB ALA A 156 0.694 8.722 7.014 1.00 0.00 C ATOM 0 H ALA A 156 -1.431 7.790 7.760 1.00 0.00 H new ATOM 0 HA ALA A 156 -0.371 10.343 7.941 1.00 0.00 H new ATOM 0 HB1 ALA A 156 1.531 9.339 6.688 1.00 0.00 H new ATOM 0 HB2 ALA A 156 0.937 8.256 7.969 1.00 0.00 H new ATOM 0 HB3 ALA A 156 0.503 7.948 6.271 1.00 0.00 H new ATOM 1739 N LEU A 157 -1.485 9.647 4.940 1.00 0.00 N ATOM 1740 CA LEU A 157 -1.773 10.231 3.636 1.00 0.00 C ATOM 1741 C LEU A 157 -3.064 11.031 3.659 1.00 0.00 C ATOM 1742 O LEU A 157 -3.098 12.205 3.289 1.00 0.00 O ATOM 1743 CB LEU A 157 -1.881 9.154 2.565 1.00 0.00 C ATOM 1744 CG LEU A 157 -0.555 8.574 2.084 1.00 0.00 C ATOM 1745 CD1 LEU A 157 0.395 9.666 1.626 1.00 0.00 C ATOM 1746 CD2 LEU A 157 0.083 7.743 3.167 1.00 0.00 C ATOM 0 H LEU A 157 -1.822 8.692 5.060 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.944 10.898 3.399 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -2.495 8.341 2.952 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -2.409 9.571 1.707 1.00 0.00 H new ATOM 0 HG LEU A 157 -0.765 7.933 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 157 1.330 9.218 1.290 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -0.057 10.221 0.804 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.596 10.345 2.455 1.00 0.00 H new ATOM 0 HD21 LEU A 157 1.028 7.338 2.805 1.00 0.00 H new ATOM 0 HD22 LEU A 157 0.267 8.366 4.043 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -0.583 6.924 3.437 1.00 0.00 H new ATOM 1758 N LEU A 158 -4.117 10.379 4.120 1.00 0.00 N ATOM 1759 CA LEU A 158 -5.470 10.894 4.006 1.00 0.00 C ATOM 1760 C LEU A 158 -5.782 11.949 5.052 1.00 0.00 C ATOM 1761 O LEU A 158 -6.341 13.000 4.744 1.00 0.00 O ATOM 1762 CB LEU A 158 -6.447 9.746 4.186 1.00 0.00 C ATOM 1763 CG LEU A 158 -6.351 8.615 3.169 1.00 0.00 C ATOM 1764 CD1 LEU A 158 -7.152 7.422 3.672 1.00 0.00 C ATOM 1765 CD2 LEU A 158 -6.844 9.078 1.805 1.00 0.00 C ATOM 0 H LEU A 158 -4.057 9.474 4.586 1.00 0.00 H new ATOM 0 HA LEU A 158 -5.562 11.355 3.023 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -6.302 9.325 5.181 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -7.459 10.149 4.155 1.00 0.00 H new ATOM 0 HG LEU A 158 -5.309 8.315 3.053 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.087 6.609 2.949 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -6.748 7.090 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -8.195 7.712 3.800 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -6.768 8.257 1.092 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -7.884 9.396 1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -6.234 9.914 1.462 1.00 0.00 H new ATOM 1777 N GLY A 159 -5.443 11.646 6.296 1.00 0.00 N ATOM 1778 CA GLY A 159 -5.838 12.499 7.393 1.00 0.00 C ATOM 1779 C GLY A 159 -7.326 12.454 7.612 1.00 0.00 C ATOM 1780 O GLY A 159 -7.864 11.449 8.078 1.00 0.00 O ATOM 0 H GLY A 159 -4.901 10.824 6.564 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -5.325 12.187 8.302 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -5.529 13.524 7.189 1.00 0.00 H new ATOM 1784 N ALA A 160 -7.989 13.528 7.240 1.00 0.00 N ATOM 1785 CA ALA A 160 -9.436 13.632 7.340 1.00 0.00 C ATOM 1786 C ALA A 160 -10.131 12.576 6.498 1.00 0.00 C ATOM 1787 O ALA A 160 -11.100 11.949 6.923 1.00 0.00 O ATOM 1788 CB ALA A 160 -9.847 14.992 6.852 1.00 0.00 C ATOM 0 H ALA A 160 -7.540 14.360 6.857 1.00 0.00 H new ATOM 0 HA ALA A 160 -9.725 13.480 8.380 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -10.930 15.090 6.919 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -9.374 15.758 7.467 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -9.535 15.116 5.815 1.00 0.00 H new ATOM 1794 N ARG A 161 -9.620 12.397 5.292 1.00 0.00 N ATOM 1795 CA ARG A 161 -10.190 11.468 4.334 1.00 0.00 C ATOM 1796 C ARG A 161 -10.129 10.027 4.840 1.00 0.00 C ATOM 1797 O ARG A 161 -10.894 9.178 4.392 1.00 0.00 O ATOM 1798 CB ARG A 161 -9.473 11.628 3.001 1.00 0.00 C ATOM 1799 CG ARG A 161 -9.889 10.624 1.963 1.00 0.00 C ATOM 1800 CD ARG A 161 -10.956 11.203 1.084 1.00 0.00 C ATOM 1801 NE ARG A 161 -12.265 11.193 1.728 1.00 0.00 N ATOM 1802 CZ ARG A 161 -13.155 12.173 1.600 1.00 0.00 C ATOM 1803 NH1 ARG A 161 -12.856 13.243 0.878 1.00 0.00 N1+ ATOM 1804 NH2 ARG A 161 -14.336 12.088 2.200 1.00 0.00 N ATOM 0 H ARG A 161 -8.797 12.893 4.950 1.00 0.00 H new ATOM 0 HA ARG A 161 -11.247 11.699 4.199 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -9.659 12.631 2.617 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -8.399 11.543 3.165 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -9.028 10.335 1.360 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -10.257 9.720 2.448 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -10.691 12.227 0.819 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -11.006 10.636 0.154 1.00 0.00 H new ATOM 0 HE ARG A 161 -12.511 10.391 2.308 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -11.946 13.313 0.423 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -13.536 13.997 0.777 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -14.564 11.268 2.762 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -15.015 12.842 2.099 1.00 0.00 H new ATOM 1818 N ALA A 162 -9.243 9.757 5.792 1.00 0.00 N ATOM 1819 CA ALA A 162 -9.140 8.416 6.365 1.00 0.00 C ATOM 1820 C ALA A 162 -10.347 8.111 7.239 1.00 0.00 C ATOM 1821 O ALA A 162 -10.943 7.038 7.152 1.00 0.00 O ATOM 1822 CB ALA A 162 -7.867 8.268 7.187 1.00 0.00 C ATOM 0 H ALA A 162 -8.592 10.439 6.181 1.00 0.00 H new ATOM 0 HA ALA A 162 -9.108 7.707 5.538 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -7.816 7.261 7.601 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -7.000 8.442 6.550 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -7.872 8.995 7.999 1.00 0.00 H new ATOM 1828 N LYS A 163 -10.711 9.074 8.071 1.00 0.00 N ATOM 1829 CA LYS A 163 -11.783 8.889 9.036 1.00 0.00 C ATOM 1830 C LYS A 163 -13.143 9.189 8.412 1.00 0.00 C ATOM 1831 O LYS A 163 -14.152 8.593 8.789 1.00 0.00 O ATOM 1832 CB LYS A 163 -11.530 9.772 10.263 1.00 0.00 C ATOM 1833 CG LYS A 163 -11.412 11.257 9.946 1.00 0.00 C ATOM 1834 CD LYS A 163 -10.613 12.001 11.007 1.00 0.00 C ATOM 1835 CE LYS A 163 -9.137 11.642 10.940 1.00 0.00 C ATOM 1836 NZ LYS A 163 -8.351 12.307 12.005 1.00 0.00 N1+ ATOM 0 H LYS A 163 -10.277 9.997 8.097 1.00 0.00 H new ATOM 0 HA LYS A 163 -11.796 7.846 9.351 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -12.342 9.627 10.976 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -10.614 9.442 10.752 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -10.933 11.384 8.975 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -12.408 11.692 9.870 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.735 13.075 10.870 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -11.004 11.759 11.995 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.023 10.562 11.028 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -8.739 11.926 9.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -7.351 12.034 11.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -8.437 13.339 11.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -8.712 12.016 12.936 1.00 0.00 H new ATOM 1850 N GLY A 164 -13.165 10.113 7.457 1.00 0.00 N ATOM 1851 CA GLY A 164 -14.395 10.439 6.762 1.00 0.00 C ATOM 1852 C GLY A 164 -15.291 11.370 7.558 1.00 0.00 C ATOM 1853 O GLY A 164 -15.790 12.361 7.028 1.00 0.00 O ATOM 0 H GLY A 164 -12.349 10.643 7.152 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -14.154 10.903 5.806 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -14.938 9.520 6.542 1.00 0.00 H new ATOM 1857 N HIS A 165 -15.497 11.045 8.826 1.00 0.00 N ATOM 1858 CA HIS A 165 -16.363 11.834 9.691 1.00 0.00 C ATOM 1859 C HIS A 165 -15.551 12.866 10.457 1.00 0.00 C ATOM 1860 O HIS A 165 -15.012 12.528 11.530 1.00 0.00 O ATOM 1861 CB HIS A 165 -17.114 10.927 10.668 1.00 0.00 C ATOM 1862 CG HIS A 165 -17.945 9.883 9.993 1.00 0.00 C ATOM 1863 ND1 HIS A 165 -17.587 8.553 9.943 1.00 0.00 N ATOM 1864 CD2 HIS A 165 -19.114 9.981 9.321 1.00 0.00 C ATOM 1865 CE1 HIS A 165 -18.503 7.880 9.274 1.00 0.00 C ATOM 1866 NE2 HIS A 165 -19.440 8.723 8.885 1.00 0.00 N ATOM 1867 OXT HIS A 165 -15.449 14.010 9.981 1.00 0.00 O ATOM 0 H HIS A 165 -15.074 10.236 9.281 1.00 0.00 H new ATOM 0 HA HIS A 165 -17.090 12.353 9.066 1.00 0.00 H new ATOM 0 HB2 HIS A 165 -16.394 10.439 11.325 1.00 0.00 H new ATOM 0 HB3 HIS A 165 -17.757 11.540 11.300 1.00 0.00 H new ATOM 0 HD2 HIS A 165 -19.685 10.883 9.158 1.00 0.00 H new ATOM 0 HE1 HIS A 165 -18.488 6.818 9.078 1.00 0.00 H new ATOM 0 HE2 HIS A 165 -20.272 8.479 8.347 1.00 0.00 H new TER 1876 HIS A 165