USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 687 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: p 48 TYR OH : rot 165:sc= -0.232 USER MOD Set 1.2: p 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: p 20 LYS NZ :NH3+ 146:sc= -0.834 (180deg=0) USER MOD Set 2.2: p 27 LYS NZ :NH3+ -172:sc= -0.818 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ 170:sc= -0.0967 (180deg=-0.24) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= -0.146 K(o=-0.15,f=-1.1!) USER MOD Single : p 16 GLN : amide:sc= 0 X(o=0,f=0.015) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 33 ASN :FLIP amide:sc=-0.00336 F(o=-0.9,f=-0.0034) USER MOD Single : p 34 CYS SG : rot 4:sc= 0.593 USER MOD Single : p 36 CYS SG : rot 170:sc= -0.141 USER MOD Single : p 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 41 CYS SG : rot 180:sc= 0 USER MOD Single : p 42 SER OG : rot 180:sc= 0 USER MOD Single : p 43 ASN : amide:sc= -0.245 X(o=-0.24,f=0) USER MOD Single : p 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 49 SER OG : rot 180:sc= 0.0791 USER MOD Single : p 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00343) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -6.578 24.838 3.993 1.00 0.00 N ATOM 2 CA MET p 1 -6.363 23.855 2.892 1.00 0.00 C ATOM 3 C MET p 1 -5.156 22.937 3.182 1.00 0.00 C ATOM 4 O MET p 1 -4.545 22.378 2.264 1.00 0.00 O ATOM 5 CB MET p 1 -6.198 24.591 1.537 1.00 0.00 C ATOM 6 CG MET p 1 -5.135 25.692 1.515 1.00 0.00 C ATOM 7 SD MET p 1 -4.990 26.486 -0.098 1.00 0.00 S ATOM 8 CE MET p 1 -3.684 27.668 0.223 1.00 0.00 C ATOM 0 H1 MET p 1 -7.281 25.544 3.696 1.00 0.00 H new ATOM 0 H2 MET p 1 -6.922 24.341 4.839 1.00 0.00 H new ATOM 0 H3 MET p 1 -5.680 25.315 4.213 1.00 0.00 H new ATOM 0 HA MET p 1 -7.244 23.217 2.830 1.00 0.00 H new ATOM 0 HB2 MET p 1 -5.952 23.856 0.771 1.00 0.00 H new ATOM 0 HB3 MET p 1 -7.157 25.029 1.261 1.00 0.00 H new ATOM 0 HG2 MET p 1 -5.381 26.444 2.265 1.00 0.00 H new ATOM 0 HG3 MET p 1 -4.171 25.267 1.794 1.00 0.00 H new ATOM 0 HE1 MET p 1 -3.479 28.238 -0.683 1.00 0.00 H new ATOM 0 HE2 MET p 1 -3.995 28.347 1.017 1.00 0.00 H new ATOM 0 HE3 MET p 1 -2.782 27.139 0.531 1.00 0.00 H new ATOM 20 N GLN p 2 -4.826 22.794 4.468 1.00 0.00 N ATOM 21 CA GLN p 2 -3.719 21.965 4.917 1.00 0.00 C ATOM 22 C GLN p 2 -4.198 20.833 5.842 1.00 0.00 C ATOM 23 O GLN p 2 -3.414 19.988 6.269 1.00 0.00 O ATOM 24 CB GLN p 2 -2.700 22.842 5.662 1.00 0.00 C ATOM 25 CG GLN p 2 -3.287 24.048 6.397 1.00 0.00 C ATOM 26 CD GLN p 2 -2.229 24.865 7.112 1.00 0.00 C ATOM 27 OE1 GLN p 2 -1.659 25.797 6.545 1.00 0.00 O ATOM 28 NE2 GLN p 2 -1.961 24.519 8.366 1.00 0.00 N ATOM 0 H GLN p 2 -5.327 23.256 5.227 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.257 21.509 4.041 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -2.170 22.221 6.384 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -1.961 23.199 4.945 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -3.812 24.684 5.684 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -4.026 23.704 7.121 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.458 23.739 8.797 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -1.259 25.033 8.898 1.00 0.00 H new ATOM 37 N ALA p 3 -5.499 20.819 6.117 1.00 0.00 N ATOM 38 CA ALA p 3 -6.106 19.840 7.023 1.00 0.00 C ATOM 39 C ALA p 3 -6.597 18.609 6.284 1.00 0.00 C ATOM 40 O ALA p 3 -6.443 17.488 6.755 1.00 0.00 O ATOM 41 CB ALA p 3 -7.238 20.482 7.815 1.00 0.00 C ATOM 0 H ALA p 3 -6.164 21.483 5.721 1.00 0.00 H new ATOM 0 HA ALA p 3 -5.333 19.510 7.717 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -7.679 19.743 8.484 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -6.846 21.313 8.401 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -8.000 20.850 7.128 1.00 0.00 H new ATOM 47 N LEU p 4 -7.240 18.870 5.157 1.00 0.00 N ATOM 48 CA LEU p 4 -7.809 17.878 4.280 1.00 0.00 C ATOM 49 C LEU p 4 -6.827 17.560 3.167 1.00 0.00 C ATOM 50 O LEU p 4 -6.385 16.430 3.006 1.00 0.00 O ATOM 51 CB LEU p 4 -9.116 18.444 3.719 1.00 0.00 C ATOM 52 CG LEU p 4 -10.110 17.444 3.142 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.477 18.076 3.162 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.728 17.057 1.721 1.00 0.00 C ATOM 0 H LEU p 4 -7.382 19.822 4.821 1.00 0.00 H new ATOM 0 HA LEU p 4 -8.014 16.951 4.816 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.615 18.997 4.515 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -8.867 19.163 2.939 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.105 16.534 3.742 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.207 17.377 2.753 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -11.748 18.324 4.188 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.467 18.984 2.560 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.453 16.342 1.331 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.721 17.947 1.091 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -8.736 16.604 1.721 1.00 0.00 H new ATOM 66 N GLU p 5 -6.514 18.617 2.415 1.00 0.00 N ATOM 67 CA GLU p 5 -5.597 18.582 1.260 1.00 0.00 C ATOM 68 C GLU p 5 -4.224 18.050 1.624 1.00 0.00 C ATOM 69 O GLU p 5 -3.568 17.416 0.801 1.00 0.00 O ATOM 70 CB GLU p 5 -5.431 19.977 0.644 1.00 0.00 C ATOM 71 CG GLU p 5 -6.674 20.847 0.726 1.00 0.00 C ATOM 72 CD GLU p 5 -7.104 21.391 -0.622 1.00 0.00 C ATOM 73 OE1 GLU p 5 -7.902 20.718 -1.307 1.00 0.00 O ATOM 74 OE2 GLU p 5 -6.643 22.491 -0.992 1.00 0.00 O ATOM 0 H GLU p 5 -6.897 19.546 2.591 1.00 0.00 H new ATOM 0 HA GLU p 5 -6.053 17.905 0.538 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.610 20.488 1.146 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.146 19.868 -0.402 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.490 20.266 1.155 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.485 21.679 1.404 1.00 0.00 H new ATOM 81 N LYS p 6 -3.812 18.326 2.854 1.00 0.00 N ATOM 82 CA LYS p 6 -2.517 17.871 3.367 1.00 0.00 C ATOM 83 C LYS p 6 -2.674 16.559 4.120 1.00 0.00 C ATOM 84 O LYS p 6 -1.689 15.923 4.473 1.00 0.00 O ATOM 85 CB LYS p 6 -1.853 18.919 4.244 1.00 0.00 C ATOM 86 CG LYS p 6 -0.981 19.896 3.466 1.00 0.00 C ATOM 87 CD LYS p 6 -0.099 20.720 4.388 1.00 0.00 C ATOM 88 CE LYS p 6 0.719 21.739 3.611 1.00 0.00 C ATOM 89 NZ LYS p 6 1.584 22.556 4.505 1.00 0.00 N ATOM 0 H LYS p 6 -4.358 18.867 3.524 1.00 0.00 H new ATOM 0 HA LYS p 6 -1.864 17.708 2.510 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -2.623 19.476 4.777 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -1.243 18.419 4.996 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -0.357 19.346 2.762 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.614 20.561 2.879 1.00 0.00 H new ATOM 0 HD2 LYS p 6 -0.719 21.233 5.123 1.00 0.00 H new ATOM 0 HD3 LYS p 6 0.570 20.060 4.940 1.00 0.00 H new ATOM 0 HE2 LYS p 6 1.339 21.223 2.878 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.049 22.395 3.056 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 2.125 23.238 3.936 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 0.991 23.068 5.189 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 2.242 21.933 5.016 1.00 0.00 H new ATOM 103 N GLU p 7 -3.936 16.199 4.379 1.00 0.00 N ATOM 104 CA GLU p 7 -4.313 14.935 5.008 1.00 0.00 C ATOM 105 C GLU p 7 -4.496 13.928 3.876 1.00 0.00 C ATOM 106 O GLU p 7 -4.420 12.716 4.056 1.00 0.00 O ATOM 107 CB GLU p 7 -5.606 15.139 5.803 1.00 0.00 C ATOM 108 CG GLU p 7 -6.531 13.936 5.873 1.00 0.00 C ATOM 109 CD GLU p 7 -6.745 13.436 7.288 1.00 0.00 C ATOM 110 OE1 GLU p 7 -5.963 12.572 7.738 1.00 0.00 O ATOM 111 OE2 GLU p 7 -7.693 13.910 7.948 1.00 0.00 O ATOM 0 H GLU p 7 -4.735 16.790 4.152 1.00 0.00 H new ATOM 0 HA GLU p 7 -3.558 14.573 5.706 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -5.344 15.433 6.819 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.155 15.971 5.362 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -7.495 14.199 5.437 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.117 13.130 5.267 1.00 0.00 H new ATOM 118 N LEU p 8 -4.749 14.528 2.717 1.00 0.00 N ATOM 119 CA LEU p 8 -4.930 13.892 1.440 1.00 0.00 C ATOM 120 C LEU p 8 -3.570 13.829 0.771 1.00 0.00 C ATOM 121 O LEU p 8 -3.291 12.940 -0.025 1.00 0.00 O ATOM 122 CB LEU p 8 -5.927 14.728 0.611 1.00 0.00 C ATOM 123 CG LEU p 8 -5.743 14.717 -0.909 1.00 0.00 C ATOM 124 CD1 LEU p 8 -6.069 13.350 -1.451 1.00 0.00 C ATOM 125 CD2 LEU p 8 -6.598 15.789 -1.555 1.00 0.00 C ATOM 0 H LEU p 8 -4.837 15.542 2.654 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.332 12.884 1.537 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.934 14.374 0.834 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.869 15.762 0.952 1.00 0.00 H new ATOM 0 HG LEU p 8 -4.703 14.940 -1.148 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.937 13.347 -2.533 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.404 12.612 -1.002 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -7.103 13.100 -1.211 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -6.455 15.767 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -7.647 15.606 -1.324 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.308 16.767 -1.171 1.00 0.00 H new ATOM 137 N ALA p 9 -2.771 14.850 1.096 1.00 0.00 N ATOM 138 CA ALA p 9 -1.381 14.972 0.646 1.00 0.00 C ATOM 139 C ALA p 9 -0.524 14.132 1.577 1.00 0.00 C ATOM 140 O ALA p 9 0.604 13.750 1.255 1.00 0.00 O ATOM 141 CB ALA p 9 -0.890 16.411 0.620 1.00 0.00 C ATOM 0 H ALA p 9 -3.075 15.624 1.686 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.312 14.619 -0.383 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.145 16.436 0.279 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.511 16.995 -0.060 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -0.952 16.835 1.622 1.00 0.00 H new ATOM 147 N GLN p 10 -1.114 13.865 2.754 1.00 0.00 N ATOM 148 CA GLN p 10 -0.535 13.017 3.771 1.00 0.00 C ATOM 149 C GLN p 10 -1.028 11.614 3.484 1.00 0.00 C ATOM 150 O GLN p 10 -0.361 10.645 3.786 1.00 0.00 O ATOM 151 CB GLN p 10 -0.951 13.500 5.164 1.00 0.00 C ATOM 152 CG GLN p 10 -1.125 12.418 6.217 1.00 0.00 C ATOM 153 CD GLN p 10 -0.078 12.487 7.312 1.00 0.00 C ATOM 154 OE1 GLN p 10 0.985 11.874 7.211 1.00 0.00 O ATOM 155 NE2 GLN p 10 -0.374 13.238 8.368 1.00 0.00 N ATOM 0 H GLN p 10 -2.023 14.247 3.015 1.00 0.00 H new ATOM 0 HA GLN p 10 0.555 13.044 3.753 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -0.204 14.209 5.520 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -1.890 14.046 5.073 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -2.116 12.507 6.662 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.078 11.440 5.737 1.00 0.00 H new ATOM 0 HE21 GLN p 10 -1.267 13.729 8.410 1.00 0.00 H new ATOM 0 HE22 GLN p 10 0.292 13.323 9.136 1.00 0.00 H new ATOM 164 N ASN p 11 -2.226 11.576 2.879 1.00 0.00 N ATOM 165 CA ASN p 11 -2.891 10.346 2.428 1.00 0.00 C ATOM 166 C ASN p 11 -2.279 9.981 1.097 1.00 0.00 C ATOM 167 O ASN p 11 -2.374 8.846 0.633 1.00 0.00 O ATOM 168 CB ASN p 11 -4.406 10.524 2.273 1.00 0.00 C ATOM 169 CG ASN p 11 -5.185 9.233 2.487 1.00 0.00 C ATOM 170 OD1 ASN p 11 -4.820 8.393 3.314 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.268 9.069 1.737 1.00 0.00 N ATOM 0 H ASN p 11 -2.769 12.417 2.686 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.748 9.562 3.172 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.752 11.273 2.986 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.620 10.909 1.276 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.832 8.225 1.833 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.536 9.787 1.064 1.00 0.00 H new ATOM 178 N GLU p 12 -1.662 11.011 0.497 1.00 0.00 N ATOM 179 CA GLU p 12 -0.925 10.927 -0.715 1.00 0.00 C ATOM 180 C GLU p 12 0.446 10.443 -0.313 1.00 0.00 C ATOM 181 O GLU p 12 1.108 9.716 -1.026 1.00 0.00 O ATOM 182 CB GLU p 12 -0.839 12.317 -1.285 1.00 0.00 C ATOM 183 CG GLU p 12 -0.108 12.397 -2.579 1.00 0.00 C ATOM 184 CD GLU p 12 -0.971 12.861 -3.735 1.00 0.00 C ATOM 185 OE1 GLU p 12 -1.040 14.087 -3.971 1.00 0.00 O ATOM 186 OE2 GLU p 12 -1.579 12.001 -4.405 1.00 0.00 O ATOM 0 H GLU p 12 -1.681 11.955 0.883 1.00 0.00 H new ATOM 0 HA GLU p 12 -1.373 10.265 -1.456 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.848 12.704 -1.425 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.347 12.966 -0.561 1.00 0.00 H new ATOM 0 HG2 GLU p 12 0.735 13.079 -2.469 1.00 0.00 H new ATOM 0 HG3 GLU p 12 0.304 11.416 -2.815 1.00 0.00 H new ATOM 193 N TRP p 13 0.809 10.929 0.869 1.00 0.00 N ATOM 194 CA TRP p 13 2.052 10.591 1.564 1.00 0.00 C ATOM 195 C TRP p 13 1.881 9.243 2.254 1.00 0.00 C ATOM 196 O TRP p 13 2.860 8.627 2.652 1.00 0.00 O ATOM 197 CB TRP p 13 2.436 11.672 2.578 1.00 0.00 C ATOM 198 CG TRP p 13 3.915 11.759 2.833 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.620 11.081 3.786 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.872 12.568 2.127 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.950 11.416 3.719 1.00 0.00 N ATOM 202 CE2 TRP p 13 6.131 12.325 2.710 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.789 13.473 1.060 1.00 0.00 C ATOM 204 CZ2 TRP p 13 7.292 12.952 2.264 1.00 0.00 C ATOM 205 CZ3 TRP p 13 5.943 14.093 0.619 1.00 0.00 C ATOM 206 CH2 TRP p 13 7.180 13.830 1.220 1.00 0.00 C ATOM 0 H TRP p 13 0.231 11.590 1.388 1.00 0.00 H new ATOM 0 HA TRP p 13 2.861 10.531 0.836 1.00 0.00 H new ATOM 0 HB2 TRP p 13 2.080 12.638 2.219 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.924 11.473 3.520 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.193 10.382 4.490 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.685 11.048 4.323 1.00 0.00 H new ATOM 0 HE3 TRP p 13 3.839 13.682 0.590 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 8.248 12.752 2.726 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 5.890 14.792 -0.203 1.00 0.00 H new ATOM 0 HH2 TRP p 13 8.064 14.330 0.852 1.00 0.00 H new ATOM 217 N GLU p 14 0.606 8.844 2.429 1.00 0.00 N ATOM 218 CA GLU p 14 0.238 7.517 2.974 1.00 0.00 C ATOM 219 C GLU p 14 0.079 6.625 1.784 1.00 0.00 C ATOM 220 O GLU p 14 0.039 5.403 1.877 1.00 0.00 O ATOM 221 CB GLU p 14 -1.059 7.513 3.773 1.00 0.00 C ATOM 222 CG GLU p 14 -1.040 8.514 4.885 1.00 0.00 C ATOM 223 CD GLU p 14 -1.607 7.983 6.187 1.00 0.00 C ATOM 224 OE1 GLU p 14 -2.829 8.121 6.402 1.00 0.00 O ATOM 225 OE2 GLU p 14 -0.829 7.430 6.991 1.00 0.00 O ATOM 0 H GLU p 14 -0.197 9.428 2.198 1.00 0.00 H new ATOM 0 HA GLU p 14 1.011 7.193 3.671 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.895 7.728 3.107 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.227 6.518 4.185 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.014 8.841 5.051 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.609 9.393 4.582 1.00 0.00 H new ATOM 232 N LEU p 15 -0.070 7.335 0.671 1.00 0.00 N ATOM 233 CA LEU p 15 -0.151 6.765 -0.668 1.00 0.00 C ATOM 234 C LEU p 15 1.284 6.576 -1.147 1.00 0.00 C ATOM 235 O LEU p 15 1.594 5.637 -1.860 1.00 0.00 O ATOM 236 CB LEU p 15 -0.949 7.691 -1.620 1.00 0.00 C ATOM 237 CG LEU p 15 -1.124 7.264 -3.099 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.002 7.826 -3.950 1.00 0.00 C ATOM 239 CD2 LEU p 15 -1.190 5.755 -3.242 1.00 0.00 C ATOM 0 H LEU p 15 -0.140 8.353 0.676 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.681 5.813 -0.657 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.944 7.824 -1.195 1.00 0.00 H new ATOM 0 HB3 LEU p 15 -0.466 8.668 -1.613 1.00 0.00 H new ATOM 0 HG LEU p 15 -2.072 7.672 -3.450 1.00 0.00 H new ATOM 0 HD11 LEU p 15 -0.136 7.517 -4.986 1.00 0.00 H new ATOM 0 HD12 LEU p 15 -0.006 8.914 -3.892 1.00 0.00 H new ATOM 0 HD13 LEU p 15 0.957 7.451 -3.583 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -1.313 5.494 -4.293 1.00 0.00 H new ATOM 0 HD22 LEU p 15 -0.268 5.313 -2.864 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -2.036 5.372 -2.672 1.00 0.00 H new ATOM 251 N GLN p 16 2.128 7.508 -0.690 1.00 0.00 N ATOM 252 CA GLN p 16 3.582 7.531 -0.947 1.00 0.00 C ATOM 253 C GLN p 16 4.214 6.637 0.067 1.00 0.00 C ATOM 254 O GLN p 16 5.294 6.108 -0.131 1.00 0.00 O ATOM 255 CB GLN p 16 4.179 8.929 -0.792 1.00 0.00 C ATOM 256 CG GLN p 16 3.536 9.943 -1.692 1.00 0.00 C ATOM 257 CD GLN p 16 4.529 10.689 -2.561 1.00 0.00 C ATOM 258 OE1 GLN p 16 5.048 11.736 -2.171 1.00 0.00 O ATOM 259 NE2 GLN p 16 4.798 10.154 -3.746 1.00 0.00 N ATOM 0 H GLN p 16 1.815 8.290 -0.115 1.00 0.00 H new ATOM 0 HA GLN p 16 3.765 7.209 -1.972 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.072 9.251 0.244 1.00 0.00 H new ATOM 0 HB3 GLN p 16 5.247 8.888 -1.005 1.00 0.00 H new ATOM 0 HG2 GLN p 16 2.809 9.442 -2.331 1.00 0.00 H new ATOM 0 HG3 GLN p 16 2.985 10.661 -1.084 1.00 0.00 H new ATOM 0 HE21 GLN p 16 4.345 9.285 -4.028 1.00 0.00 H new ATOM 0 HE22 GLN p 16 5.458 10.612 -4.374 1.00 0.00 H new ATOM 268 N ALA p 17 3.499 6.561 1.185 1.00 0.00 N ATOM 269 CA ALA p 17 3.838 5.680 2.310 1.00 0.00 C ATOM 270 C ALA p 17 3.251 4.317 2.013 1.00 0.00 C ATOM 271 O ALA p 17 3.595 3.330 2.651 1.00 0.00 O ATOM 272 CB ALA p 17 3.340 6.193 3.653 1.00 0.00 C ATOM 0 H ALA p 17 2.657 7.114 1.342 1.00 0.00 H new ATOM 0 HA ALA p 17 4.923 5.638 2.401 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.626 5.493 4.438 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.783 7.168 3.857 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.254 6.286 3.627 1.00 0.00 H new ATOM 278 N LEU p 18 2.313 4.323 1.045 1.00 0.00 N ATOM 279 CA LEU p 18 1.679 3.126 0.510 1.00 0.00 C ATOM 280 C LEU p 18 2.592 2.620 -0.589 1.00 0.00 C ATOM 281 O LEU p 18 2.739 1.423 -0.801 1.00 0.00 O ATOM 282 CB LEU p 18 0.321 3.488 -0.076 1.00 0.00 C ATOM 283 CG LEU p 18 -0.659 2.362 -0.402 1.00 0.00 C ATOM 284 CD1 LEU p 18 -1.977 3.007 -0.723 1.00 0.00 C ATOM 285 CD2 LEU p 18 -0.194 1.529 -1.588 1.00 0.00 C ATOM 0 H LEU p 18 1.976 5.183 0.612 1.00 0.00 H new ATOM 0 HA LEU p 18 1.527 2.371 1.282 1.00 0.00 H new ATOM 0 HB2 LEU p 18 -0.172 4.163 0.623 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.496 4.051 -0.993 1.00 0.00 H new ATOM 0 HG LEU p 18 -0.735 1.686 0.450 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -2.710 2.237 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -2.321 3.580 0.138 1.00 0.00 H new ATOM 0 HD13 LEU p 18 -1.858 3.673 -1.578 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.920 0.740 -1.785 1.00 0.00 H new ATOM 0 HD22 LEU p 18 -0.103 2.167 -2.467 1.00 0.00 H new ATOM 0 HD23 LEU p 18 0.774 1.083 -1.362 1.00 0.00 H new ATOM 297 N GLU p 19 3.147 3.605 -1.306 1.00 0.00 N ATOM 298 CA GLU p 19 4.140 3.374 -2.380 1.00 0.00 C ATOM 299 C GLU p 19 5.454 3.058 -1.722 1.00 0.00 C ATOM 300 O GLU p 19 6.292 2.354 -2.268 1.00 0.00 O ATOM 301 CB GLU p 19 4.345 4.584 -3.293 1.00 0.00 C ATOM 302 CG GLU p 19 3.069 5.114 -3.881 1.00 0.00 C ATOM 303 CD GLU p 19 3.062 5.112 -5.397 1.00 0.00 C ATOM 304 OE1 GLU p 19 3.488 6.122 -5.995 1.00 0.00 O ATOM 305 OE2 GLU p 19 2.630 4.099 -5.987 1.00 0.00 O ATOM 0 H GLU p 19 2.924 4.590 -1.163 1.00 0.00 H new ATOM 0 HA GLU p 19 3.768 2.562 -3.004 1.00 0.00 H new ATOM 0 HB2 GLU p 19 4.832 5.378 -2.727 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.021 4.308 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.234 4.514 -3.520 1.00 0.00 H new ATOM 0 HG3 GLU p 19 2.908 6.132 -3.525 1.00 0.00 H new ATOM 312 N LYS p 20 5.608 3.675 -0.552 1.00 0.00 N ATOM 313 CA LYS p 20 6.764 3.472 0.330 1.00 0.00 C ATOM 314 C LYS p 20 6.541 2.211 1.149 1.00 0.00 C ATOM 315 O LYS p 20 7.473 1.653 1.723 1.00 0.00 O ATOM 316 CB LYS p 20 6.970 4.661 1.257 1.00 0.00 C ATOM 317 CG LYS p 20 8.339 5.311 1.143 1.00 0.00 C ATOM 318 CD LYS p 20 9.196 5.028 2.367 1.00 0.00 C ATOM 319 CE LYS p 20 10.561 5.687 2.253 1.00 0.00 C ATOM 320 NZ LYS p 20 11.407 5.424 3.450 1.00 0.00 N ATOM 0 H LYS p 20 4.927 4.339 -0.182 1.00 0.00 H new ATOM 0 HA LYS p 20 7.659 3.371 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.206 5.409 1.045 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.820 4.335 2.286 1.00 0.00 H new ATOM 0 HG2 LYS p 20 8.845 4.942 0.251 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.222 6.388 1.021 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.688 5.392 3.260 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.319 3.952 2.486 1.00 0.00 H new ATOM 0 HE2 LYS p 20 11.069 5.318 1.362 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.435 6.762 2.126 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.403 5.349 3.161 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 11.301 6.205 4.128 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 11.108 4.534 3.898 1.00 0.00 H new ATOM 334 N GLU p 21 5.262 1.805 1.195 1.00 0.00 N ATOM 335 CA GLU p 21 4.819 0.578 1.833 1.00 0.00 C ATOM 336 C GLU p 21 4.957 -0.476 0.758 1.00 0.00 C ATOM 337 O GLU p 21 5.227 -1.651 1.018 1.00 0.00 O ATOM 338 CB GLU p 21 3.371 0.719 2.324 1.00 0.00 C ATOM 339 CG GLU p 21 2.533 -0.548 2.272 1.00 0.00 C ATOM 340 CD GLU p 21 2.163 -1.067 3.647 1.00 0.00 C ATOM 341 OE1 GLU p 21 2.937 -1.873 4.206 1.00 0.00 O ATOM 342 OE2 GLU p 21 1.099 -0.667 4.167 1.00 0.00 O ATOM 0 H GLU p 21 4.500 2.339 0.778 1.00 0.00 H new ATOM 0 HA GLU p 21 5.402 0.323 2.718 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.389 1.079 3.353 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.877 1.485 1.726 1.00 0.00 H new ATOM 0 HG2 GLU p 21 1.622 -0.352 1.706 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.083 -1.320 1.734 1.00 0.00 H new ATOM 349 N LEU p 22 4.752 0.015 -0.474 1.00 0.00 N ATOM 350 CA LEU p 22 4.932 -0.766 -1.676 1.00 0.00 C ATOM 351 C LEU p 22 6.430 -0.921 -1.857 1.00 0.00 C ATOM 352 O LEU p 22 6.933 -2.000 -2.168 1.00 0.00 O ATOM 353 CB LEU p 22 4.322 -0.012 -2.858 1.00 0.00 C ATOM 354 CG LEU p 22 3.994 -0.796 -4.127 1.00 0.00 C ATOM 355 CD1 LEU p 22 3.334 0.154 -5.096 1.00 0.00 C ATOM 356 CD2 LEU p 22 5.241 -1.395 -4.759 1.00 0.00 C ATOM 0 H LEU p 22 4.454 0.975 -0.650 1.00 0.00 H new ATOM 0 HA LEU p 22 4.447 -1.740 -1.613 1.00 0.00 H new ATOM 0 HB2 LEU p 22 3.402 0.460 -2.512 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.009 0.789 -3.131 1.00 0.00 H new ATOM 0 HG LEU p 22 3.333 -1.625 -3.876 1.00 0.00 H new ATOM 0 HD11 LEU p 22 3.087 -0.377 -6.015 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.422 0.553 -4.651 1.00 0.00 H new ATOM 0 HD13 LEU p 22 4.015 0.974 -5.323 1.00 0.00 H new ATOM 0 HD21 LEU p 22 4.965 -1.945 -5.659 1.00 0.00 H new ATOM 0 HD22 LEU p 22 5.936 -0.597 -5.020 1.00 0.00 H new ATOM 0 HD23 LEU p 22 5.717 -2.074 -4.051 1.00 0.00 H new ATOM 368 N ALA p 23 7.117 0.207 -1.625 1.00 0.00 N ATOM 369 CA ALA p 23 8.585 0.270 -1.682 1.00 0.00 C ATOM 370 C ALA p 23 9.198 -0.428 -0.467 1.00 0.00 C ATOM 371 O ALA p 23 10.386 -0.731 -0.457 1.00 0.00 O ATOM 372 CB ALA p 23 9.084 1.707 -1.767 1.00 0.00 C ATOM 0 H ALA p 23 6.674 1.096 -1.394 1.00 0.00 H new ATOM 0 HA ALA p 23 8.900 -0.248 -2.588 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.173 1.712 -1.807 1.00 0.00 H new ATOM 0 HB2 ALA p 23 8.685 2.178 -2.666 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.751 2.260 -0.889 1.00 0.00 H new ATOM 378 N GLN p 24 8.344 -0.683 0.541 1.00 0.00 N ATOM 379 CA GLN p 24 8.701 -1.356 1.769 1.00 0.00 C ATOM 380 C GLN p 24 8.756 -2.866 1.538 1.00 0.00 C ATOM 381 O GLN p 24 9.462 -3.574 2.225 1.00 0.00 O ATOM 382 CB GLN p 24 7.640 -1.007 2.809 1.00 0.00 C ATOM 383 CG GLN p 24 7.652 -1.884 4.028 1.00 0.00 C ATOM 384 CD GLN p 24 7.709 -1.104 5.327 1.00 0.00 C ATOM 385 OE1 GLN p 24 8.788 -0.807 5.838 1.00 0.00 O ATOM 386 NE2 GLN p 24 6.544 -0.769 5.867 1.00 0.00 N ATOM 0 H GLN p 24 7.361 -0.412 0.507 1.00 0.00 H new ATOM 0 HA GLN p 24 9.684 -1.038 2.116 1.00 0.00 H new ATOM 0 HB2 GLN p 24 7.781 0.028 3.120 1.00 0.00 H new ATOM 0 HB3 GLN p 24 6.657 -1.069 2.342 1.00 0.00 H new ATOM 0 HG2 GLN p 24 6.759 -2.509 4.026 1.00 0.00 H new ATOM 0 HG3 GLN p 24 8.510 -2.554 3.977 1.00 0.00 H new ATOM 0 HE21 GLN p 24 5.673 -1.037 5.408 1.00 0.00 H new ATOM 0 HE22 GLN p 24 6.519 -0.244 6.741 1.00 0.00 H new ATOM 395 N LEU p 25 7.976 -3.295 0.551 1.00 0.00 N ATOM 396 CA LEU p 25 7.839 -4.688 0.114 1.00 0.00 C ATOM 397 C LEU p 25 8.980 -5.048 -0.799 1.00 0.00 C ATOM 398 O LEU p 25 9.345 -6.205 -0.972 1.00 0.00 O ATOM 399 CB LEU p 25 6.509 -4.854 -0.638 1.00 0.00 C ATOM 400 CG LEU p 25 5.501 -5.793 0.014 1.00 0.00 C ATOM 401 CD1 LEU p 25 6.106 -7.179 0.120 1.00 0.00 C ATOM 402 CD2 LEU p 25 5.098 -5.253 1.377 1.00 0.00 C ATOM 0 H LEU p 25 7.395 -2.657 0.007 1.00 0.00 H new ATOM 0 HA LEU p 25 7.854 -5.345 0.984 1.00 0.00 H new ATOM 0 HB2 LEU p 25 6.048 -3.872 -0.747 1.00 0.00 H new ATOM 0 HB3 LEU p 25 6.722 -5.219 -1.643 1.00 0.00 H new ATOM 0 HG LEU p 25 4.600 -5.858 -0.596 1.00 0.00 H new ATOM 0 HD11 LEU p 25 5.389 -7.855 0.586 1.00 0.00 H new ATOM 0 HD12 LEU p 25 6.355 -7.545 -0.876 1.00 0.00 H new ATOM 0 HD13 LEU p 25 7.010 -7.136 0.727 1.00 0.00 H new ATOM 0 HD21 LEU p 25 4.377 -5.929 1.838 1.00 0.00 H new ATOM 0 HD22 LEU p 25 5.980 -5.175 2.013 1.00 0.00 H new ATOM 0 HD23 LEU p 25 4.647 -4.268 1.259 1.00 0.00 H new ATOM 414 N GLU p 26 9.475 -3.983 -1.377 1.00 0.00 N ATOM 415 CA GLU p 26 10.610 -3.937 -2.269 1.00 0.00 C ATOM 416 C GLU p 26 11.819 -3.741 -1.400 1.00 0.00 C ATOM 417 O GLU p 26 12.941 -4.049 -1.776 1.00 0.00 O ATOM 418 CB GLU p 26 10.463 -2.774 -3.233 1.00 0.00 C ATOM 419 CG GLU p 26 9.135 -2.779 -3.953 1.00 0.00 C ATOM 420 CD GLU p 26 9.273 -2.656 -5.458 1.00 0.00 C ATOM 421 OE1 GLU p 26 9.279 -1.513 -5.963 1.00 0.00 O ATOM 422 OE2 GLU p 26 9.374 -3.702 -6.133 1.00 0.00 O ATOM 0 H GLU p 26 9.068 -3.060 -1.227 1.00 0.00 H new ATOM 0 HA GLU p 26 10.692 -4.849 -2.861 1.00 0.00 H new ATOM 0 HB2 GLU p 26 10.572 -1.838 -2.686 1.00 0.00 H new ATOM 0 HB3 GLU p 26 11.269 -2.810 -3.966 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.604 -3.701 -3.717 1.00 0.00 H new ATOM 0 HG3 GLU p 26 8.524 -1.956 -3.582 1.00 0.00 H new ATOM 429 N LYS p 27 11.518 -3.160 -0.234 1.00 0.00 N ATOM 430 CA LYS p 27 12.490 -2.947 0.841 1.00 0.00 C ATOM 431 C LYS p 27 12.593 -4.232 1.638 1.00 0.00 C ATOM 432 O LYS p 27 13.665 -4.593 2.128 1.00 0.00 O ATOM 433 CB LYS p 27 12.104 -1.794 1.761 1.00 0.00 C ATOM 434 CG LYS p 27 12.672 -0.452 1.332 1.00 0.00 C ATOM 435 CD LYS p 27 12.530 0.590 2.430 1.00 0.00 C ATOM 436 CE LYS p 27 13.110 1.929 2.004 1.00 0.00 C ATOM 437 NZ LYS p 27 12.985 2.955 3.076 1.00 0.00 N ATOM 0 H LYS p 27 10.583 -2.821 -0.009 1.00 0.00 H new ATOM 0 HA LYS p 27 13.448 -2.679 0.395 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.017 -1.722 1.802 1.00 0.00 H new ATOM 0 HB3 LYS p 27 12.447 -2.017 2.771 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.724 -0.567 1.072 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.158 -0.108 0.434 1.00 0.00 H new ATOM 0 HD2 LYS p 27 11.477 0.712 2.683 1.00 0.00 H new ATOM 0 HD3 LYS p 27 13.036 0.243 3.331 1.00 0.00 H new ATOM 0 HE2 LYS p 27 14.161 1.803 1.743 1.00 0.00 H new ATOM 0 HE3 LYS p 27 12.598 2.277 1.107 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 13.266 3.884 2.702 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 11.999 2.997 3.403 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 13.603 2.701 3.873 1.00 0.00 H new ATOM 451 N GLU p 28 11.440 -4.916 1.757 1.00 0.00 N ATOM 452 CA GLU p 28 11.381 -6.237 2.421 1.00 0.00 C ATOM 453 C GLU p 28 11.988 -7.217 1.462 1.00 0.00 C ATOM 454 O GLU p 28 12.642 -8.187 1.841 1.00 0.00 O ATOM 455 CB GLU p 28 9.957 -6.697 2.743 1.00 0.00 C ATOM 456 CG GLU p 28 9.183 -5.727 3.590 1.00 0.00 C ATOM 457 CD GLU p 28 8.787 -6.295 4.939 1.00 0.00 C ATOM 458 OE1 GLU p 28 9.574 -6.152 5.898 1.00 0.00 O ATOM 459 OE2 GLU p 28 7.689 -6.882 5.036 1.00 0.00 O ATOM 0 H GLU p 28 10.542 -4.582 1.406 1.00 0.00 H new ATOM 0 HA GLU p 28 11.908 -6.171 3.373 1.00 0.00 H new ATOM 0 HB2 GLU p 28 9.418 -6.860 1.810 1.00 0.00 H new ATOM 0 HB3 GLU p 28 10.003 -7.657 3.257 1.00 0.00 H new ATOM 0 HG2 GLU p 28 9.782 -4.830 3.743 1.00 0.00 H new ATOM 0 HG3 GLU p 28 8.284 -5.423 3.053 1.00 0.00 H new ATOM 466 N LEU p 29 11.731 -6.914 0.193 1.00 0.00 N ATOM 467 CA LEU p 29 12.264 -7.672 -0.926 1.00 0.00 C ATOM 468 C LEU p 29 13.766 -7.445 -1.049 1.00 0.00 C ATOM 469 O LEU p 29 14.540 -8.386 -1.233 1.00 0.00 O ATOM 470 CB LEU p 29 11.586 -7.208 -2.207 1.00 0.00 C ATOM 471 CG LEU p 29 11.346 -8.238 -3.306 1.00 0.00 C ATOM 472 CD1 LEU p 29 10.781 -7.514 -4.503 1.00 0.00 C ATOM 473 CD2 LEU p 29 12.625 -8.966 -3.684 1.00 0.00 C ATOM 0 H LEU p 29 11.142 -6.129 -0.086 1.00 0.00 H new ATOM 0 HA LEU p 29 12.076 -8.733 -0.760 1.00 0.00 H new ATOM 0 HB2 LEU p 29 10.622 -6.778 -1.937 1.00 0.00 H new ATOM 0 HB3 LEU p 29 12.187 -6.403 -2.630 1.00 0.00 H new ATOM 0 HG LEU p 29 10.648 -8.994 -2.946 1.00 0.00 H new ATOM 0 HD11 LEU p 29 10.599 -8.227 -5.307 1.00 0.00 H new ATOM 0 HD12 LEU p 29 9.844 -7.031 -4.227 1.00 0.00 H new ATOM 0 HD13 LEU p 29 11.492 -6.760 -4.841 1.00 0.00 H new ATOM 0 HD21 LEU p 29 12.412 -9.691 -4.470 1.00 0.00 H new ATOM 0 HD22 LEU p 29 13.361 -8.246 -4.044 1.00 0.00 H new ATOM 0 HD23 LEU p 29 13.021 -9.483 -2.810 1.00 0.00 H new ATOM 485 N GLN p 30 14.151 -6.171 -0.935 1.00 0.00 N ATOM 486 CA GLN p 30 15.557 -5.748 -1.031 1.00 0.00 C ATOM 487 C GLN p 30 16.423 -6.342 0.060 1.00 0.00 C ATOM 488 O GLN p 30 17.275 -7.207 -0.160 1.00 0.00 O ATOM 489 CB GLN p 30 15.630 -4.235 -0.888 1.00 0.00 C ATOM 490 CG GLN p 30 15.907 -3.547 -2.170 1.00 0.00 C ATOM 491 CD GLN p 30 16.133 -2.056 -2.013 1.00 0.00 C ATOM 492 OE1 GLN p 30 15.195 -1.263 -2.084 1.00 0.00 O ATOM 493 NE2 GLN p 30 17.385 -1.667 -1.798 1.00 0.00 N ATOM 0 H GLN p 30 13.500 -5.402 -0.774 1.00 0.00 H new ATOM 0 HA GLN p 30 15.926 -6.093 -1.997 1.00 0.00 H new ATOM 0 HB2 GLN p 30 14.688 -3.868 -0.481 1.00 0.00 H new ATOM 0 HB3 GLN p 30 16.409 -3.980 -0.169 1.00 0.00 H new ATOM 0 HG2 GLN p 30 16.787 -3.994 -2.632 1.00 0.00 H new ATOM 0 HG3 GLN p 30 15.072 -3.711 -2.851 1.00 0.00 H new ATOM 0 HE21 GLN p 30 18.132 -2.359 -1.746 1.00 0.00 H new ATOM 0 HE22 GLN p 30 17.599 -0.676 -1.684 1.00 0.00 H new ATOM 502 N ALA p 31 16.148 -5.821 1.231 1.00 0.00 N ATOM 503 CA ALA p 31 16.835 -6.158 2.497 1.00 0.00 C ATOM 504 C ALA p 31 16.920 -7.664 2.772 1.00 0.00 C ATOM 505 O ALA p 31 17.812 -8.114 3.498 1.00 0.00 O ATOM 506 CB ALA p 31 16.149 -5.460 3.661 1.00 0.00 C ATOM 0 H ALA p 31 15.415 -5.122 1.355 1.00 0.00 H new ATOM 0 HA ALA p 31 17.861 -5.806 2.391 1.00 0.00 H new ATOM 0 HB1 ALA p 31 16.661 -5.713 4.590 1.00 0.00 H new ATOM 0 HB2 ALA p 31 16.184 -4.381 3.510 1.00 0.00 H new ATOM 0 HB3 ALA p 31 15.110 -5.785 3.719 1.00 0.00 H new ATOM 512 N TRP p 32 15.993 -8.426 2.190 1.00 0.00 N ATOM 513 CA TRP p 32 15.966 -9.884 2.369 1.00 0.00 C ATOM 514 C TRP p 32 16.762 -10.601 1.274 1.00 0.00 C ATOM 515 O TRP p 32 17.615 -11.441 1.578 1.00 0.00 O ATOM 516 CB TRP p 32 14.525 -10.406 2.406 1.00 0.00 C ATOM 517 CG TRP p 32 13.936 -10.437 3.789 1.00 0.00 C ATOM 518 CD1 TRP p 32 13.388 -9.387 4.469 1.00 0.00 C ATOM 519 CD2 TRP p 32 13.832 -11.575 4.661 1.00 0.00 C ATOM 520 NE1 TRP p 32 12.953 -9.799 5.705 1.00 0.00 N ATOM 521 CE2 TRP p 32 13.214 -11.137 5.846 1.00 0.00 C ATOM 522 CE3 TRP p 32 14.203 -12.923 4.556 1.00 0.00 C ATOM 523 CZ2 TRP p 32 12.957 -11.992 6.916 1.00 0.00 C ATOM 524 CZ3 TRP p 32 13.946 -13.770 5.618 1.00 0.00 C ATOM 525 CH2 TRP p 32 13.329 -13.302 6.784 1.00 0.00 C ATOM 0 H TRP p 32 15.251 -8.062 1.592 1.00 0.00 H new ATOM 0 HA TRP p 32 16.440 -10.101 3.326 1.00 0.00 H new ATOM 0 HB2 TRP p 32 13.903 -9.778 1.768 1.00 0.00 H new ATOM 0 HB3 TRP p 32 14.500 -11.411 1.986 1.00 0.00 H new ATOM 0 HD1 TRP p 32 13.308 -8.379 4.090 1.00 0.00 H new ATOM 0 HE1 TRP p 32 12.508 -9.205 6.405 1.00 0.00 H new ATOM 0 HE3 TRP p 32 14.681 -13.293 3.661 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 12.481 -11.633 7.817 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 14.226 -14.811 5.547 1.00 0.00 H new ATOM 0 HH2 TRP p 32 13.143 -13.989 7.596 1.00 0.00 H new ATOM 536 N ASN p 33 16.481 -10.266 0.004 1.00 0.00 N ATOM 537 CA ASN p 33 17.173 -10.877 -1.140 1.00 0.00 C ATOM 538 C ASN p 33 17.415 -9.855 -2.254 1.00 0.00 C ATOM 539 O ASN p 33 16.469 -9.252 -2.770 1.00 0.00 O ATOM 540 CB ASN p 33 16.392 -12.096 -1.683 1.00 0.00 C ATOM 541 CG ASN p 33 14.926 -11.805 -1.990 1.00 0.00 C ATOM 542 OD1 ASN p 33 14.649 -11.407 -3.225 1.00 0.00 O flip ATOM 543 ND2 ASN p 33 14.061 -11.939 -1.125 1.00 0.00 N flip ATOM 0 H ASN p 33 15.778 -9.574 -0.255 1.00 0.00 H new ATOM 0 HA ASN p 33 18.142 -11.226 -0.784 1.00 0.00 H new ATOM 0 HB2 ASN p 33 16.879 -12.452 -2.591 1.00 0.00 H new ATOM 0 HB3 ASN p 33 16.447 -12.904 -0.954 1.00 0.00 H new ATOM 0 HD21 ASN p 33 14.320 -12.248 -0.188 1.00 0.00 H new ATOM 0 HD22 ASN p 33 13.085 -11.741 -1.345 1.00 0.00 H new ATOM 550 N CYS p 34 18.690 -9.673 -2.613 1.00 0.00 N ATOM 551 CA CYS p 34 19.076 -8.733 -3.666 1.00 0.00 C ATOM 552 C CYS p 34 19.325 -9.466 -4.987 1.00 0.00 C ATOM 553 O CYS p 34 18.794 -9.073 -6.029 1.00 0.00 O ATOM 554 CB CYS p 34 20.322 -7.945 -3.248 1.00 0.00 C ATOM 555 SG CYS p 34 20.108 -6.971 -1.740 1.00 0.00 S ATOM 0 H CYS p 34 19.474 -10.167 -2.187 1.00 0.00 H new ATOM 0 HA CYS p 34 18.254 -8.033 -3.816 1.00 0.00 H new ATOM 0 HB2 CYS p 34 21.148 -8.642 -3.104 1.00 0.00 H new ATOM 0 HB3 CYS p 34 20.607 -7.278 -4.061 1.00 0.00 H new ATOM 0 HG CYS p 34 18.932 -7.203 -1.237 1.00 0.00 H new ATOM 561 N ILE p 35 20.137 -10.534 -4.930 1.00 0.00 N ATOM 562 CA ILE p 35 20.462 -11.343 -6.112 1.00 0.00 C ATOM 563 C ILE p 35 20.665 -12.814 -5.730 1.00 0.00 C ATOM 564 O ILE p 35 21.728 -13.200 -5.231 1.00 0.00 O ATOM 565 CB ILE p 35 21.711 -10.811 -6.889 1.00 0.00 C ATOM 566 CG1 ILE p 35 22.866 -10.422 -5.946 1.00 0.00 C ATOM 567 CG2 ILE p 35 21.322 -9.624 -7.758 1.00 0.00 C ATOM 568 CD1 ILE p 35 24.041 -11.375 -6.003 1.00 0.00 C ATOM 0 H ILE p 35 20.582 -10.857 -4.071 1.00 0.00 H new ATOM 0 HA ILE p 35 19.607 -11.261 -6.783 1.00 0.00 H new ATOM 0 HB ILE p 35 22.069 -11.624 -7.520 1.00 0.00 H new ATOM 0 HG12 ILE p 35 23.209 -9.419 -6.200 1.00 0.00 H new ATOM 0 HG13 ILE p 35 22.491 -10.381 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE p 35 22.200 -9.262 -8.294 1.00 0.00 H new ATOM 0 HG22 ILE p 35 20.560 -9.932 -8.475 1.00 0.00 H new ATOM 0 HG23 ILE p 35 20.927 -8.826 -7.129 1.00 0.00 H new ATOM 0 HD11 ILE p 35 24.816 -11.039 -5.314 1.00 0.00 H new ATOM 0 HD12 ILE p 35 23.712 -12.375 -5.720 1.00 0.00 H new ATOM 0 HD13 ILE p 35 24.442 -11.398 -7.016 1.00 0.00 H new ATOM 580 N CYS p 36 19.619 -13.622 -5.949 1.00 0.00 N ATOM 581 CA CYS p 36 19.652 -15.054 -5.636 1.00 0.00 C ATOM 582 C CYS p 36 18.917 -15.862 -6.702 1.00 0.00 C ATOM 583 O CYS p 36 17.968 -15.370 -7.320 1.00 0.00 O ATOM 584 CB CYS p 36 19.025 -15.318 -4.261 1.00 0.00 C ATOM 585 SG CYS p 36 19.181 -17.028 -3.689 1.00 0.00 S ATOM 0 H CYS p 36 18.734 -13.304 -6.345 1.00 0.00 H new ATOM 0 HA CYS p 36 20.695 -15.369 -5.618 1.00 0.00 H new ATOM 0 HB2 CYS p 36 19.491 -14.658 -3.529 1.00 0.00 H new ATOM 0 HB3 CYS p 36 17.968 -15.055 -4.300 1.00 0.00 H new ATOM 0 HG CYS p 36 18.817 -17.104 -2.443 1.00 0.00 H new ATOM 591 N ASP p 37 19.367 -17.104 -6.905 1.00 0.00 N ATOM 592 CA ASP p 37 18.762 -18.005 -7.890 1.00 0.00 C ATOM 593 C ASP p 37 17.817 -19.002 -7.214 1.00 0.00 C ATOM 594 O ASP p 37 16.736 -19.289 -7.737 1.00 0.00 O ATOM 595 CB ASP p 37 19.846 -18.754 -8.673 1.00 0.00 C ATOM 596 CG ASP p 37 20.598 -17.853 -9.635 1.00 0.00 C ATOM 597 OD1 ASP p 37 20.161 -17.733 -10.800 1.00 0.00 O ATOM 598 OD2 ASP p 37 21.622 -17.268 -9.225 1.00 0.00 O ATOM 0 H ASP p 37 20.153 -17.510 -6.397 1.00 0.00 H new ATOM 0 HA ASP p 37 18.182 -17.399 -8.586 1.00 0.00 H new ATOM 0 HB2 ASP p 37 20.552 -19.201 -7.973 1.00 0.00 H new ATOM 0 HB3 ASP p 37 19.388 -19.572 -9.229 1.00 0.00 H new ATOM 603 N ILE p 38 18.236 -19.522 -6.053 1.00 0.00 N ATOM 604 CA ILE p 38 17.435 -20.486 -5.291 1.00 0.00 C ATOM 605 C ILE p 38 17.468 -20.164 -3.794 1.00 0.00 C ATOM 606 O ILE p 38 18.542 -20.122 -3.187 1.00 0.00 O ATOM 607 CB ILE p 38 17.868 -21.975 -5.526 1.00 0.00 C ATOM 608 CG1 ILE p 38 19.385 -22.247 -5.233 1.00 0.00 C ATOM 609 CG2 ILE p 38 17.476 -22.433 -6.933 1.00 0.00 C ATOM 610 CD1 ILE p 38 20.394 -21.610 -6.187 1.00 0.00 C ATOM 0 H ILE p 38 19.130 -19.289 -5.620 1.00 0.00 H new ATOM 0 HA ILE p 38 16.415 -20.387 -5.663 1.00 0.00 H new ATOM 0 HB ILE p 38 17.323 -22.573 -4.796 1.00 0.00 H new ATOM 0 HG12 ILE p 38 19.604 -21.898 -4.224 1.00 0.00 H new ATOM 0 HG13 ILE p 38 19.545 -23.325 -5.240 1.00 0.00 H new ATOM 0 HG21 ILE p 38 17.784 -23.468 -7.078 1.00 0.00 H new ATOM 0 HG22 ILE p 38 16.395 -22.356 -7.053 1.00 0.00 H new ATOM 0 HG23 ILE p 38 17.969 -21.801 -7.672 1.00 0.00 H new ATOM 0 HD11 ILE p 38 21.405 -21.873 -5.876 1.00 0.00 H new ATOM 0 HD12 ILE p 38 20.219 -21.975 -7.199 1.00 0.00 H new ATOM 0 HD13 ILE p 38 20.279 -20.526 -6.167 1.00 0.00 H new ATOM 622 N GLU p 39 16.284 -19.940 -3.218 1.00 0.00 N ATOM 623 CA GLU p 39 16.158 -19.616 -1.793 1.00 0.00 C ATOM 624 C GLU p 39 15.124 -20.515 -1.110 1.00 0.00 C ATOM 625 O GLU p 39 14.127 -20.905 -1.725 1.00 0.00 O ATOM 626 CB GLU p 39 15.805 -18.125 -1.590 1.00 0.00 C ATOM 627 CG GLU p 39 14.608 -17.617 -2.397 1.00 0.00 C ATOM 628 CD GLU p 39 14.320 -16.149 -2.153 1.00 0.00 C ATOM 629 OE1 GLU p 39 14.881 -15.304 -2.881 1.00 0.00 O ATOM 630 OE2 GLU p 39 13.531 -15.844 -1.233 1.00 0.00 O ATOM 0 H GLU p 39 15.396 -19.977 -3.718 1.00 0.00 H new ATOM 0 HA GLU p 39 17.126 -19.801 -1.327 1.00 0.00 H new ATOM 0 HB2 GLU p 39 15.605 -17.957 -0.532 1.00 0.00 H new ATOM 0 HB3 GLU p 39 16.677 -17.524 -1.849 1.00 0.00 H new ATOM 0 HG2 GLU p 39 14.797 -17.774 -3.459 1.00 0.00 H new ATOM 0 HG3 GLU p 39 13.726 -18.204 -2.140 1.00 0.00 H new ATOM 637 N ASN p 40 15.381 -20.832 0.162 1.00 0.00 N ATOM 638 CA ASN p 40 14.489 -21.681 0.954 1.00 0.00 C ATOM 639 C ASN p 40 14.157 -21.021 2.289 1.00 0.00 C ATOM 640 O ASN p 40 15.058 -20.591 3.017 1.00 0.00 O ATOM 641 CB ASN p 40 15.125 -23.054 1.194 1.00 0.00 C ATOM 642 CG ASN p 40 15.203 -23.891 -0.070 1.00 0.00 C ATOM 643 OD1 ASN p 40 14.283 -24.645 -0.388 1.00 0.00 O ATOM 644 ND2 ASN p 40 16.306 -23.762 -0.797 1.00 0.00 N ATOM 0 H ASN p 40 16.206 -20.510 0.668 1.00 0.00 H new ATOM 0 HA ASN p 40 13.565 -21.814 0.392 1.00 0.00 H new ATOM 0 HB2 ASN p 40 16.128 -22.920 1.599 1.00 0.00 H new ATOM 0 HB3 ASN p 40 14.547 -23.591 1.946 1.00 0.00 H new ATOM 0 HD21 ASN p 40 16.416 -24.300 -1.657 1.00 0.00 H new ATOM 0 HD22 ASN p 40 17.044 -23.125 -0.496 1.00 0.00 H new ATOM 651 N CYS p 41 12.859 -20.945 2.597 1.00 0.00 N ATOM 652 CA CYS p 41 12.384 -20.338 3.842 1.00 0.00 C ATOM 653 C CYS p 41 11.438 -21.278 4.591 1.00 0.00 C ATOM 654 O CYS p 41 11.523 -21.402 5.815 1.00 0.00 O ATOM 655 CB CYS p 41 11.684 -19.007 3.548 1.00 0.00 C ATOM 656 SG CYS p 41 11.214 -18.073 5.025 1.00 0.00 S ATOM 0 H CYS p 41 12.115 -21.299 1.996 1.00 0.00 H new ATOM 0 HA CYS p 41 13.249 -20.153 4.479 1.00 0.00 H new ATOM 0 HB2 CYS p 41 12.343 -18.390 2.936 1.00 0.00 H new ATOM 0 HB3 CYS p 41 10.790 -19.203 2.956 1.00 0.00 H new ATOM 0 HG CYS p 41 10.632 -16.965 4.671 1.00 0.00 H new ATOM 662 N SER p 42 10.535 -21.946 3.837 1.00 0.00 N ATOM 663 CA SER p 42 9.536 -22.896 4.387 1.00 0.00 C ATOM 664 C SER p 42 8.560 -22.203 5.345 1.00 0.00 C ATOM 665 O SER p 42 8.973 -21.603 6.342 1.00 0.00 O ATOM 666 CB SER p 42 10.217 -24.088 5.089 1.00 0.00 C ATOM 667 OG SER p 42 9.278 -25.104 5.406 1.00 0.00 O ATOM 0 H SER p 42 10.477 -21.842 2.824 1.00 0.00 H new ATOM 0 HA SER p 42 8.965 -23.277 3.540 1.00 0.00 H new ATOM 0 HB2 SER p 42 10.995 -24.497 4.444 1.00 0.00 H new ATOM 0 HB3 SER p 42 10.707 -23.745 6.000 1.00 0.00 H new ATOM 0 HG SER p 42 9.738 -25.848 5.849 1.00 0.00 H new ATOM 673 N ASN p 43 7.266 -22.295 5.024 1.00 0.00 N ATOM 674 CA ASN p 43 6.214 -21.684 5.839 1.00 0.00 C ATOM 675 C ASN p 43 5.331 -22.747 6.481 1.00 0.00 C ATOM 676 O ASN p 43 4.872 -23.675 5.806 1.00 0.00 O ATOM 677 CB ASN p 43 5.357 -20.740 4.988 1.00 0.00 C ATOM 678 CG ASN p 43 6.101 -19.481 4.583 1.00 0.00 C ATOM 679 OD1 ASN p 43 6.749 -19.439 3.537 1.00 0.00 O ATOM 680 ND2 ASN p 43 6.010 -18.448 5.411 1.00 0.00 N ATOM 0 H ASN p 43 6.922 -22.790 4.201 1.00 0.00 H new ATOM 0 HA ASN p 43 6.696 -21.111 6.631 1.00 0.00 H new ATOM 0 HB2 ASN p 43 5.025 -21.265 4.092 1.00 0.00 H new ATOM 0 HB3 ASN p 43 4.462 -20.465 5.547 1.00 0.00 H new ATOM 0 HD21 ASN p 43 6.488 -17.574 5.191 1.00 0.00 H new ATOM 0 HD22 ASN p 43 5.462 -18.528 6.267 1.00 0.00 H new ATOM 687 N MET p 44 5.100 -22.600 7.788 1.00 0.00 N ATOM 688 CA MET p 44 4.268 -23.537 8.549 1.00 0.00 C ATOM 689 C MET p 44 2.866 -22.968 8.776 1.00 0.00 C ATOM 690 O MET p 44 1.873 -23.695 8.681 1.00 0.00 O ATOM 691 CB MET p 44 4.922 -23.867 9.898 1.00 0.00 C ATOM 692 CG MET p 44 6.150 -24.761 9.789 1.00 0.00 C ATOM 693 SD MET p 44 5.765 -26.398 9.138 1.00 0.00 S ATOM 694 CE MET p 44 7.382 -27.167 9.180 1.00 0.00 C ATOM 0 H MET p 44 5.481 -21.835 8.345 1.00 0.00 H new ATOM 0 HA MET p 44 4.179 -24.453 7.965 1.00 0.00 H new ATOM 0 HB2 MET p 44 5.205 -22.937 10.390 1.00 0.00 H new ATOM 0 HB3 MET p 44 4.186 -24.354 10.537 1.00 0.00 H new ATOM 0 HG2 MET p 44 6.887 -24.282 9.144 1.00 0.00 H new ATOM 0 HG3 MET p 44 6.607 -24.864 10.773 1.00 0.00 H new ATOM 0 HE1 MET p 44 7.309 -28.188 8.806 1.00 0.00 H new ATOM 0 HE2 MET p 44 8.071 -26.600 8.554 1.00 0.00 H new ATOM 0 HE3 MET p 44 7.751 -27.181 10.205 1.00 0.00 H new ATOM 704 N ALA p 45 2.800 -21.663 9.075 1.00 0.00 N ATOM 705 CA ALA p 45 1.531 -20.978 9.319 1.00 0.00 C ATOM 706 C ALA p 45 1.250 -19.872 8.281 1.00 0.00 C ATOM 707 O ALA p 45 0.117 -19.784 7.798 1.00 0.00 O ATOM 708 CB ALA p 45 1.497 -20.404 10.731 1.00 0.00 C ATOM 0 H ALA p 45 3.619 -21.060 9.153 1.00 0.00 H new ATOM 0 HA ALA p 45 0.741 -21.722 9.216 1.00 0.00 H new ATOM 0 HB1 ALA p 45 0.546 -19.898 10.895 1.00 0.00 H new ATOM 0 HB2 ALA p 45 1.608 -21.211 11.455 1.00 0.00 H new ATOM 0 HB3 ALA p 45 2.313 -19.692 10.854 1.00 0.00 H new ATOM 714 N PRO p 46 2.254 -19.001 7.904 1.00 0.00 N ATOM 715 CA PRO p 46 2.037 -17.920 6.918 1.00 0.00 C ATOM 716 C PRO p 46 1.901 -18.437 5.484 1.00 0.00 C ATOM 717 O PRO p 46 2.368 -19.533 5.164 1.00 0.00 O ATOM 718 CB PRO p 46 3.295 -17.041 7.044 1.00 0.00 C ATOM 719 CG PRO p 46 4.013 -17.524 8.258 1.00 0.00 C ATOM 720 CD PRO p 46 3.653 -18.972 8.391 1.00 0.00 C ATOM 0 HA PRO p 46 1.106 -17.390 7.119 1.00 0.00 H new ATOM 0 HB2 PRO p 46 3.923 -17.130 6.158 1.00 0.00 H new ATOM 0 HB3 PRO p 46 3.028 -15.989 7.141 1.00 0.00 H new ATOM 0 HG2 PRO p 46 5.090 -17.396 8.153 1.00 0.00 H new ATOM 0 HG3 PRO p 46 3.710 -16.962 9.142 1.00 0.00 H new ATOM 0 HD2 PRO p 46 4.304 -19.609 7.792 1.00 0.00 H new ATOM 0 HD3 PRO p 46 3.731 -19.316 9.422 1.00 0.00 H new ATOM 728 N LEU p 47 1.254 -17.629 4.638 1.00 0.00 N ATOM 729 CA LEU p 47 1.033 -17.977 3.230 1.00 0.00 C ATOM 730 C LEU p 47 1.720 -16.983 2.290 1.00 0.00 C ATOM 731 O LEU p 47 1.804 -17.220 1.079 1.00 0.00 O ATOM 732 CB LEU p 47 -0.479 -18.017 2.921 1.00 0.00 C ATOM 733 CG LEU p 47 -1.300 -19.230 3.443 1.00 0.00 C ATOM 734 CD1 LEU p 47 -0.739 -20.562 2.943 1.00 0.00 C ATOM 735 CD2 LEU p 47 -1.403 -19.228 4.966 1.00 0.00 C ATOM 0 H LEU p 47 0.871 -16.722 4.906 1.00 0.00 H new ATOM 0 HA LEU p 47 1.468 -18.962 3.063 1.00 0.00 H new ATOM 0 HB2 LEU p 47 -0.927 -17.111 3.328 1.00 0.00 H new ATOM 0 HB3 LEU p 47 -0.600 -17.973 1.839 1.00 0.00 H new ATOM 0 HG LEU p 47 -2.305 -19.121 3.036 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -1.344 -21.381 3.333 1.00 0.00 H new ATOM 0 HD12 LEU p 47 -0.762 -20.580 1.853 1.00 0.00 H new ATOM 0 HD13 LEU p 47 0.289 -20.675 3.286 1.00 0.00 H new ATOM 0 HD21 LEU p 47 -1.984 -20.091 5.293 1.00 0.00 H new ATOM 0 HD22 LEU p 47 -0.404 -19.279 5.398 1.00 0.00 H new ATOM 0 HD23 LEU p 47 -1.895 -18.313 5.296 1.00 0.00 H new ATOM 747 N TYR p 48 2.213 -15.876 2.860 1.00 0.00 N ATOM 748 CA TYR p 48 2.898 -14.815 2.101 1.00 0.00 C ATOM 749 C TYR p 48 4.205 -15.317 1.469 1.00 0.00 C ATOM 750 O TYR p 48 5.176 -15.618 2.174 1.00 0.00 O ATOM 751 CB TYR p 48 3.184 -13.610 3.012 1.00 0.00 C ATOM 752 CG TYR p 48 1.944 -12.908 3.525 1.00 0.00 C ATOM 753 CD1 TYR p 48 1.270 -13.374 4.648 1.00 0.00 C ATOM 754 CD2 TYR p 48 1.450 -11.777 2.888 1.00 0.00 C ATOM 755 CE1 TYR p 48 0.140 -12.734 5.120 1.00 0.00 C ATOM 756 CE2 TYR p 48 0.321 -11.130 3.354 1.00 0.00 C ATOM 757 CZ TYR p 48 -0.330 -11.613 4.469 1.00 0.00 C ATOM 758 OH TYR p 48 -1.455 -10.972 4.937 1.00 0.00 O ATOM 0 H TYR p 48 2.150 -15.688 3.861 1.00 0.00 H new ATOM 0 HA TYR p 48 2.234 -14.509 1.293 1.00 0.00 H new ATOM 0 HB2 TYR p 48 3.776 -13.946 3.864 1.00 0.00 H new ATOM 0 HB3 TYR p 48 3.793 -12.892 2.464 1.00 0.00 H new ATOM 0 HD1 TYR p 48 1.636 -14.251 5.160 1.00 0.00 H new ATOM 0 HD2 TYR p 48 1.957 -11.397 2.013 1.00 0.00 H new ATOM 0 HE1 TYR p 48 -0.372 -13.110 5.994 1.00 0.00 H new ATOM 0 HE2 TYR p 48 -0.049 -10.251 2.847 1.00 0.00 H new ATOM 0 HH TYR p 48 -1.518 -10.083 4.529 1.00 0.00 H new ATOM 768 N SER p 49 4.204 -15.417 0.131 1.00 0.00 N ATOM 769 CA SER p 49 5.369 -15.881 -0.626 1.00 0.00 C ATOM 770 C SER p 49 5.493 -15.123 -1.964 1.00 0.00 C ATOM 771 O SER p 49 5.685 -13.904 -1.964 1.00 0.00 O ATOM 772 CB SER p 49 5.291 -17.407 -0.845 1.00 0.00 C ATOM 773 OG SER p 49 4.078 -17.772 -1.480 1.00 0.00 O ATOM 0 H SER p 49 3.400 -15.180 -0.450 1.00 0.00 H new ATOM 0 HA SER p 49 6.268 -15.669 -0.048 1.00 0.00 H new ATOM 0 HB2 SER p 49 6.135 -17.734 -1.452 1.00 0.00 H new ATOM 0 HB3 SER p 49 5.371 -17.919 0.114 1.00 0.00 H new ATOM 0 HG SER p 49 4.055 -18.743 -1.608 1.00 0.00 H new ATOM 779 N ASP p 50 5.384 -15.847 -3.090 1.00 0.00 N ATOM 780 CA ASP p 50 5.495 -15.249 -4.427 1.00 0.00 C ATOM 781 C ASP p 50 4.117 -14.969 -5.031 1.00 0.00 C ATOM 782 O ASP p 50 3.861 -13.863 -5.517 1.00 0.00 O ATOM 783 CB ASP p 50 6.307 -16.160 -5.358 1.00 0.00 C ATOM 784 CG ASP p 50 7.779 -16.204 -4.993 1.00 0.00 C ATOM 785 OD1 ASP p 50 8.546 -15.368 -5.516 1.00 0.00 O ATOM 786 OD2 ASP p 50 8.165 -17.076 -4.186 1.00 0.00 O ATOM 0 H ASP p 50 5.218 -16.853 -3.098 1.00 0.00 H new ATOM 0 HA ASP p 50 6.015 -14.297 -4.321 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.897 -17.169 -5.321 1.00 0.00 H new ATOM 0 HB3 ASP p 50 6.201 -15.811 -6.385 1.00 0.00 H new ATOM 791 N GLN p 51 3.236 -15.982 -4.993 1.00 0.00 N ATOM 792 CA GLN p 51 1.872 -15.873 -5.536 1.00 0.00 C ATOM 793 C GLN p 51 0.927 -15.164 -4.556 1.00 0.00 C ATOM 794 O GLN p 51 -0.208 -14.834 -4.906 1.00 0.00 O ATOM 795 CB GLN p 51 1.322 -17.263 -5.875 1.00 0.00 C ATOM 796 CG GLN p 51 1.949 -17.890 -7.112 1.00 0.00 C ATOM 797 CD GLN p 51 1.373 -19.256 -7.429 1.00 0.00 C ATOM 798 OE1 GLN p 51 1.870 -20.278 -6.955 1.00 0.00 O ATOM 799 NE2 GLN p 51 0.318 -19.280 -8.235 1.00 0.00 N ATOM 0 H GLN p 51 3.447 -16.894 -4.588 1.00 0.00 H new ATOM 0 HA GLN p 51 1.927 -15.273 -6.444 1.00 0.00 H new ATOM 0 HB2 GLN p 51 1.483 -17.924 -5.023 1.00 0.00 H new ATOM 0 HB3 GLN p 51 0.245 -17.190 -6.023 1.00 0.00 H new ATOM 0 HG2 GLN p 51 1.798 -17.229 -7.966 1.00 0.00 H new ATOM 0 HG3 GLN p 51 3.025 -17.979 -6.964 1.00 0.00 H new ATOM 0 HE21 GLN p 51 -0.061 -18.408 -8.605 1.00 0.00 H new ATOM 0 HE22 GLN p 51 -0.113 -20.170 -8.484 1.00 0.00 H new ATOM 808 N ALA p 52 1.412 -14.948 -3.332 1.00 0.00 N ATOM 809 CA ALA p 52 0.647 -14.285 -2.276 1.00 0.00 C ATOM 810 C ALA p 52 1.092 -12.827 -2.084 1.00 0.00 C ATOM 811 O ALA p 52 0.490 -12.086 -1.314 1.00 0.00 O ATOM 812 CB ALA p 52 0.792 -15.066 -0.979 1.00 0.00 C ATOM 0 H ALA p 52 2.350 -15.229 -3.045 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.402 -14.264 -2.572 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.222 -14.573 -0.192 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.414 -16.079 -1.120 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.843 -15.107 -0.695 1.00 0.00 H new ATOM 818 N LEU p 53 2.164 -12.446 -2.788 1.00 0.00 N ATOM 819 CA LEU p 53 2.758 -11.126 -2.735 1.00 0.00 C ATOM 820 C LEU p 53 2.193 -10.263 -3.853 1.00 0.00 C ATOM 821 O LEU p 53 1.476 -9.296 -3.609 1.00 0.00 O ATOM 822 CB LEU p 53 4.275 -11.291 -2.865 1.00 0.00 C ATOM 823 CG LEU p 53 5.136 -10.135 -2.380 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.479 -10.682 -1.963 1.00 0.00 C ATOM 825 CD2 LEU p 53 5.300 -9.098 -3.478 1.00 0.00 C ATOM 0 H LEU p 53 2.649 -13.075 -3.427 1.00 0.00 H new ATOM 0 HA LEU p 53 2.528 -10.629 -1.793 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.567 -12.186 -2.316 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.508 -11.471 -3.914 1.00 0.00 H new ATOM 0 HG LEU p 53 4.657 -9.647 -1.531 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.111 -9.866 -1.612 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.343 -11.407 -1.161 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.954 -11.168 -2.815 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.919 -8.278 -3.114 1.00 0.00 H new ATOM 0 HD22 LEU p 53 5.778 -9.557 -4.343 1.00 0.00 H new ATOM 0 HD23 LEU p 53 4.321 -8.714 -3.765 1.00 0.00 H new ATOM 837 N LYS p 54 2.519 -10.660 -5.087 1.00 0.00 N ATOM 838 CA LYS p 54 2.052 -9.984 -6.318 1.00 0.00 C ATOM 839 C LYS p 54 0.516 -9.944 -6.385 1.00 0.00 C ATOM 840 O LYS p 54 -0.062 -9.208 -7.183 1.00 0.00 O ATOM 841 CB LYS p 54 2.603 -10.694 -7.558 1.00 0.00 C ATOM 842 CG LYS p 54 4.086 -10.452 -7.798 1.00 0.00 C ATOM 843 CD LYS p 54 4.570 -11.167 -9.049 1.00 0.00 C ATOM 844 CE LYS p 54 6.048 -10.914 -9.299 1.00 0.00 C ATOM 845 NZ LYS p 54 6.529 -11.606 -10.527 1.00 0.00 N ATOM 0 H LYS p 54 3.119 -11.465 -5.269 1.00 0.00 H new ATOM 0 HA LYS p 54 2.423 -8.959 -6.293 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.431 -11.766 -7.458 1.00 0.00 H new ATOM 0 HB3 LYS p 54 2.044 -10.362 -8.433 1.00 0.00 H new ATOM 0 HG2 LYS p 54 4.271 -9.382 -7.894 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.657 -10.798 -6.936 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.395 -12.238 -8.948 1.00 0.00 H new ATOM 0 HD3 LYS p 54 3.992 -10.830 -9.909 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.222 -9.842 -9.394 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.625 -11.255 -8.440 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.541 -11.409 -10.663 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.386 -12.631 -10.426 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 5.996 -11.262 -11.351 1.00 0.00 H new ATOM 859 N LYS p 55 -0.101 -10.763 -5.531 1.00 0.00 N ATOM 860 CA LYS p 55 -1.531 -10.885 -5.389 1.00 0.00 C ATOM 861 C LYS p 55 -2.001 -9.999 -4.255 1.00 0.00 C ATOM 862 O LYS p 55 -3.067 -9.397 -4.337 1.00 0.00 O ATOM 863 CB LYS p 55 -1.913 -12.338 -5.132 1.00 0.00 C ATOM 864 CG LYS p 55 -2.216 -13.119 -6.399 1.00 0.00 C ATOM 865 CD LYS p 55 -2.994 -14.391 -6.100 1.00 0.00 C ATOM 866 CE LYS p 55 -3.306 -15.174 -7.368 1.00 0.00 C ATOM 867 NZ LYS p 55 -4.368 -14.522 -8.187 1.00 0.00 N ATOM 0 H LYS p 55 0.413 -11.378 -4.900 1.00 0.00 H new ATOM 0 HA LYS p 55 -2.016 -10.566 -6.312 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.100 -12.830 -4.597 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.786 -12.366 -4.480 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -2.789 -12.494 -7.084 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.283 -13.372 -6.903 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -2.419 -15.017 -5.418 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -3.924 -14.137 -5.591 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -2.399 -15.272 -7.964 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -3.623 -16.182 -7.101 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -4.547 -15.090 -9.040 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -5.242 -14.451 -7.629 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -4.056 -13.569 -8.465 1.00 0.00 H new ATOM 881 N LYS p 56 -1.184 -9.942 -3.187 1.00 0.00 N ATOM 882 CA LYS p 56 -1.473 -9.065 -2.022 1.00 0.00 C ATOM 883 C LYS p 56 -1.161 -7.607 -2.385 1.00 0.00 C ATOM 884 O LYS p 56 -1.526 -6.663 -1.680 1.00 0.00 O ATOM 885 CB LYS p 56 -0.657 -9.475 -0.797 1.00 0.00 C ATOM 886 CG LYS p 56 -1.423 -10.356 0.186 1.00 0.00 C ATOM 887 CD LYS p 56 -2.230 -9.531 1.182 1.00 0.00 C ATOM 888 CE LYS p 56 -2.984 -10.417 2.159 1.00 0.00 C ATOM 889 NZ LYS p 56 -3.757 -9.619 3.150 1.00 0.00 N ATOM 0 H LYS p 56 -0.325 -10.485 -3.100 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.529 -9.169 -1.774 1.00 0.00 H new ATOM 0 HB2 LYS p 56 0.235 -10.006 -1.128 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.320 -8.577 -0.279 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.093 -11.016 -0.365 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -0.721 -10.992 0.726 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -1.562 -8.868 1.732 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -2.936 -8.898 0.644 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -3.663 -11.068 1.609 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -2.279 -11.062 2.683 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -4.257 -10.261 3.798 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -3.107 -9.016 3.693 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -4.448 -9.022 2.652 1.00 0.00 H new ATOM 903 N LEU p 57 -0.470 -7.492 -3.513 1.00 0.00 N ATOM 904 CA LEU p 57 -0.053 -6.254 -4.140 1.00 0.00 C ATOM 905 C LEU p 57 -1.118 -5.893 -5.135 1.00 0.00 C ATOM 906 O LEU p 57 -1.528 -4.741 -5.261 1.00 0.00 O ATOM 907 CB LEU p 57 1.266 -6.467 -4.871 1.00 0.00 C ATOM 908 CG LEU p 57 2.538 -5.990 -4.179 1.00 0.00 C ATOM 909 CD1 LEU p 57 2.783 -6.741 -2.876 1.00 0.00 C ATOM 910 CD2 LEU p 57 3.690 -6.187 -5.134 1.00 0.00 C ATOM 0 H LEU p 57 -0.171 -8.311 -4.041 1.00 0.00 H new ATOM 0 HA LEU p 57 0.084 -5.467 -3.399 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.371 -7.533 -5.071 1.00 0.00 H new ATOM 0 HB3 LEU p 57 1.200 -5.966 -5.837 1.00 0.00 H new ATOM 0 HG LEU p 57 2.437 -4.936 -3.918 1.00 0.00 H new ATOM 0 HD11 LEU p 57 3.698 -6.374 -2.411 1.00 0.00 H new ATOM 0 HD12 LEU p 57 1.943 -6.581 -2.200 1.00 0.00 H new ATOM 0 HD13 LEU p 57 2.883 -7.806 -3.083 1.00 0.00 H new ATOM 0 HD21 LEU p 57 4.614 -5.853 -4.663 1.00 0.00 H new ATOM 0 HD22 LEU p 57 3.774 -7.243 -5.390 1.00 0.00 H new ATOM 0 HD23 LEU p 57 3.515 -5.607 -6.040 1.00 0.00 H new ATOM 922 N ALA p 58 -1.533 -6.941 -5.865 1.00 0.00 N ATOM 923 CA ALA p 58 -2.629 -6.833 -6.850 1.00 0.00 C ATOM 924 C ALA p 58 -3.966 -6.617 -6.131 1.00 0.00 C ATOM 925 O ALA p 58 -4.962 -6.231 -6.744 1.00 0.00 O ATOM 926 CB ALA p 58 -2.701 -8.064 -7.739 1.00 0.00 C ATOM 0 H ALA p 58 -1.128 -7.874 -5.794 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.423 -5.973 -7.488 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.518 -7.951 -8.452 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -1.761 -8.178 -8.279 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -2.875 -8.947 -7.124 1.00 0.00 H new ATOM 932 N GLN p 59 -3.948 -6.890 -4.818 1.00 0.00 N ATOM 933 CA GLN p 59 -5.069 -6.709 -3.927 1.00 0.00 C ATOM 934 C GLN p 59 -4.922 -5.339 -3.267 1.00 0.00 C ATOM 935 O GLN p 59 -5.893 -4.736 -2.831 1.00 0.00 O ATOM 936 CB GLN p 59 -5.043 -7.839 -2.893 1.00 0.00 C ATOM 937 CG GLN p 59 -5.774 -7.542 -1.604 1.00 0.00 C ATOM 938 CD GLN p 59 -6.882 -8.535 -1.306 1.00 0.00 C ATOM 939 OE1 GLN p 59 -6.658 -9.553 -0.651 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.084 -8.243 -1.787 1.00 0.00 N ATOM 0 H GLN p 59 -3.120 -7.254 -4.347 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.023 -6.745 -4.452 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.477 -8.732 -3.342 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.005 -8.073 -2.659 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.061 -7.544 -0.780 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.197 -6.539 -1.656 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.224 -7.388 -2.325 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -8.868 -8.874 -1.619 1.00 0.00 H new ATOM 949 N LEU p 60 -3.660 -4.908 -3.200 1.00 0.00 N ATOM 950 CA LEU p 60 -3.238 -3.618 -2.651 1.00 0.00 C ATOM 951 C LEU p 60 -3.519 -2.503 -3.661 1.00 0.00 C ATOM 952 O LEU p 60 -3.855 -1.381 -3.307 1.00 0.00 O ATOM 953 CB LEU p 60 -1.733 -3.704 -2.364 1.00 0.00 C ATOM 954 CG LEU p 60 -1.015 -2.396 -2.044 1.00 0.00 C ATOM 955 CD1 LEU p 60 -1.583 -1.791 -0.784 1.00 0.00 C ATOM 956 CD2 LEU p 60 0.471 -2.649 -1.928 1.00 0.00 C ATOM 0 H LEU p 60 -2.877 -5.467 -3.538 1.00 0.00 H new ATOM 0 HA LEU p 60 -3.787 -3.393 -1.737 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -1.586 -4.385 -1.526 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.248 -4.154 -3.230 1.00 0.00 H new ATOM 0 HG LEU p 60 -1.171 -1.680 -2.851 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -1.065 -0.858 -0.563 1.00 0.00 H new ATOM 0 HD12 LEU p 60 -2.646 -1.592 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.449 -2.486 0.045 1.00 0.00 H new ATOM 0 HD21 LEU p 60 0.983 -1.714 -1.699 1.00 0.00 H new ATOM 0 HD22 LEU p 60 0.656 -3.368 -1.130 1.00 0.00 H new ATOM 0 HD23 LEU p 60 0.847 -3.047 -2.870 1.00 0.00 H new ATOM 968 N LYS p 61 -3.303 -2.886 -4.905 1.00 0.00 N ATOM 969 CA LYS p 61 -3.511 -2.105 -6.113 1.00 0.00 C ATOM 970 C LYS p 61 -4.995 -2.073 -6.404 1.00 0.00 C ATOM 971 O LYS p 61 -5.528 -1.114 -6.968 1.00 0.00 O ATOM 972 CB LYS p 61 -2.742 -2.752 -7.268 1.00 0.00 C ATOM 973 CG LYS p 61 -1.445 -2.037 -7.612 1.00 0.00 C ATOM 974 CD LYS p 61 -0.878 -2.497 -8.953 1.00 0.00 C ATOM 975 CE LYS p 61 -1.288 -1.571 -10.090 1.00 0.00 C ATOM 976 NZ LYS p 61 -0.741 -2.024 -11.400 1.00 0.00 N ATOM 0 H LYS p 61 -2.951 -3.820 -5.115 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.146 -1.085 -5.987 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -2.519 -3.787 -7.010 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.380 -2.774 -8.151 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -1.621 -0.962 -7.642 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -0.711 -2.218 -6.827 1.00 0.00 H new ATOM 0 HD2 LYS p 61 0.210 -2.538 -8.892 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -1.224 -3.509 -9.166 1.00 0.00 H new ATOM 0 HE2 LYS p 61 -2.376 -1.525 -10.147 1.00 0.00 H new ATOM 0 HE3 LYS p 61 -0.937 -0.561 -9.880 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 -1.043 -1.367 -12.148 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 0.298 -2.043 -11.354 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -1.096 -2.978 -11.613 1.00 0.00 H new ATOM 990 N TRP p 62 -5.638 -3.172 -5.996 1.00 0.00 N ATOM 991 CA TRP p 62 -7.079 -3.331 -6.078 1.00 0.00 C ATOM 992 C TRP p 62 -7.666 -2.576 -4.907 1.00 0.00 C ATOM 993 O TRP p 62 -8.780 -2.055 -4.973 1.00 0.00 O ATOM 994 CB TRP p 62 -7.479 -4.801 -6.017 1.00 0.00 C ATOM 995 CG TRP p 62 -8.549 -5.172 -7.005 1.00 0.00 C ATOM 996 CD1 TRP p 62 -9.885 -5.282 -6.754 1.00 0.00 C ATOM 997 CD2 TRP p 62 -8.375 -5.482 -8.398 1.00 0.00 C ATOM 998 NE1 TRP p 62 -10.554 -5.639 -7.900 1.00 0.00 N ATOM 999 CE2 TRP p 62 -9.651 -5.768 -8.921 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -7.268 -5.545 -9.255 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -9.849 -6.112 -10.257 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -7.468 -5.886 -10.579 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -8.750 -6.164 -11.069 1.00 0.00 C ATOM 0 H TRP p 62 -5.160 -3.980 -5.597 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.451 -2.944 -7.027 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -6.598 -5.417 -6.199 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -7.828 -5.033 -5.011 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -10.350 -5.113 -5.794 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -11.561 -5.784 -7.977 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -6.276 -5.331 -8.887 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -10.836 -6.330 -10.638 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -6.621 -5.939 -11.247 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -8.873 -6.425 -12.110 1.00 0.00 H new ATOM 1014 N LYS p 63 -6.866 -2.544 -3.828 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.216 -1.787 -2.618 1.00 0.00 C ATOM 1016 C LYS p 63 -6.786 -0.325 -2.775 1.00 0.00 C ATOM 1017 O LYS p 63 -7.200 0.538 -2.004 1.00 0.00 O ATOM 1018 CB LYS p 63 -6.568 -2.386 -1.368 1.00 0.00 C ATOM 1019 CG LYS p 63 -7.457 -3.371 -0.615 1.00 0.00 C ATOM 1020 CD LYS p 63 -8.367 -2.669 0.384 1.00 0.00 C ATOM 1021 CE LYS p 63 -9.251 -3.658 1.126 1.00 0.00 C ATOM 1022 NZ LYS p 63 -10.139 -2.980 2.110 1.00 0.00 N ATOM 0 H LYS p 63 -5.973 -3.034 -3.771 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.297 -1.842 -2.493 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -5.647 -2.892 -1.657 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -6.289 -1.577 -0.694 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -8.064 -3.930 -1.328 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -6.833 -4.095 -0.091 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -7.762 -2.113 1.100 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -8.991 -1.943 -0.138 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -9.859 -4.210 0.409 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -8.626 -4.387 1.643 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -10.725 -3.689 2.595 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -9.559 -2.474 2.809 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -10.753 -2.303 1.614 1.00 0.00 H new ATOM 1036 N LEU p 64 -5.929 -0.090 -3.784 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.410 1.231 -4.141 1.00 0.00 C ATOM 1038 C LEU p 64 -6.411 1.936 -5.047 1.00 0.00 C ATOM 1039 O LEU p 64 -6.584 3.142 -5.002 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.086 1.039 -4.877 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.102 2.208 -4.960 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -1.884 1.716 -5.696 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.692 3.405 -5.691 1.00 0.00 C ATOM 0 H LEU p 64 -5.573 -0.834 -4.384 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.255 1.837 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.566 0.205 -4.405 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.319 0.733 -5.897 1.00 0.00 H new ATOM 0 HG LEU p 64 -2.858 2.543 -3.952 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -1.156 2.524 -5.776 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -1.442 0.882 -5.151 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -2.171 1.386 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -2.957 4.209 -5.725 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -3.959 3.115 -6.707 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -4.583 3.749 -5.166 1.00 0.00 H new ATOM 1055 N GLN p 65 -6.991 1.117 -5.899 1.00 0.00 N ATOM 1056 CA GLN p 65 -8.033 1.454 -6.841 1.00 0.00 C ATOM 1057 C GLN p 65 -9.340 1.570 -6.056 1.00 0.00 C ATOM 1058 O GLN p 65 -10.314 2.162 -6.503 1.00 0.00 O ATOM 1059 CB GLN p 65 -8.080 0.330 -7.883 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.416 0.153 -8.570 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.304 0.066 -10.079 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -9.144 -1.018 -10.640 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -9.390 1.211 -10.746 1.00 0.00 N ATOM 0 H GLN p 65 -6.728 0.133 -5.954 1.00 0.00 H new ATOM 0 HA GLN p 65 -7.859 2.398 -7.356 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.321 0.525 -8.641 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -7.811 -0.608 -7.397 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -9.893 -0.752 -8.195 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -10.066 0.988 -8.308 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -9.523 2.087 -10.241 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -9.323 1.215 -11.764 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.281 0.964 -4.872 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.353 0.954 -3.880 1.00 0.00 C ATOM 1074 C ALA p 66 -10.076 2.092 -2.923 1.00 0.00 C ATOM 1075 O ALA p 66 -10.952 2.550 -2.197 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.422 -0.370 -3.135 1.00 0.00 C ATOM 0 H ALA p 66 -8.456 0.448 -4.567 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.318 1.077 -4.371 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.232 -0.336 -2.407 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -10.605 -1.177 -3.844 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -9.478 -0.547 -2.620 1.00 0.00 H new ATOM 1082 N LEU p 67 -8.795 2.501 -2.952 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.262 3.628 -2.196 1.00 0.00 C ATOM 1084 C LEU p 67 -8.537 4.864 -3.047 1.00 0.00 C ATOM 1085 O LEU p 67 -8.913 5.920 -2.555 1.00 0.00 O ATOM 1086 CB LEU p 67 -6.741 3.423 -1.970 1.00 0.00 C ATOM 1087 CG LEU p 67 -5.928 4.497 -1.199 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -4.835 5.039 -2.102 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -6.796 5.635 -0.705 1.00 0.00 C ATOM 0 H LEU p 67 -8.088 2.037 -3.522 1.00 0.00 H new ATOM 0 HA LEU p 67 -8.721 3.728 -1.213 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -6.614 2.478 -1.443 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -6.279 3.306 -2.950 1.00 0.00 H new ATOM 0 HG LEU p 67 -5.495 4.019 -0.320 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -4.261 5.794 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -4.174 4.226 -2.402 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -5.284 5.487 -2.988 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -6.179 6.359 -0.173 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -7.275 6.122 -1.554 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -7.560 5.245 -0.032 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.341 4.656 -4.343 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.588 5.652 -5.384 1.00 0.00 C ATOM 1103 C LYS p 68 -10.078 5.755 -5.605 1.00 0.00 C ATOM 1104 O LYS p 68 -10.577 6.799 -6.012 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.872 5.311 -6.697 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.379 5.624 -6.694 1.00 0.00 C ATOM 1107 CD LYS p 68 -6.098 7.064 -7.113 1.00 0.00 C ATOM 1108 CE LYS p 68 -4.605 7.362 -7.151 1.00 0.00 C ATOM 1109 NZ LYS p 68 -3.929 6.712 -8.310 1.00 0.00 N ATOM 0 H LYS p 68 -7.997 3.769 -4.711 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.186 6.609 -5.052 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -8.009 4.250 -6.908 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.346 5.861 -7.510 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -5.974 5.450 -5.697 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.864 4.942 -7.371 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -6.530 7.247 -8.097 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -6.587 7.747 -6.418 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -4.453 8.440 -7.202 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -4.144 7.019 -6.225 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -2.922 6.970 -8.314 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -4.021 5.679 -8.231 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -4.372 7.033 -9.195 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.773 4.629 -5.356 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.229 4.596 -5.400 1.00 0.00 C ATOM 1125 C LYS p 69 -12.734 5.114 -4.057 1.00 0.00 C ATOM 1126 O LYS p 69 -13.902 5.470 -3.904 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.751 3.190 -5.662 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.191 2.961 -7.096 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.147 1.784 -7.205 1.00 0.00 C ATOM 1130 CE LYS p 69 -14.586 1.554 -8.642 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.514 0.395 -8.761 1.00 0.00 N ATOM 0 H LYS p 69 -10.340 3.735 -5.123 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.590 5.218 -6.219 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -11.972 2.470 -5.411 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.592 2.994 -4.997 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.675 3.860 -7.477 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.317 2.780 -7.721 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -13.664 0.885 -6.823 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -15.022 1.966 -6.581 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -15.076 2.451 -9.020 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -13.709 1.382 -9.266 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -15.790 0.272 -9.756 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -15.038 -0.466 -8.424 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -16.363 0.569 -8.186 1.00 0.00 H new ATOM 1145 N LYS p 70 -11.793 5.122 -3.093 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.002 5.644 -1.750 1.00 0.00 C ATOM 1147 C LYS p 70 -11.569 7.101 -1.753 1.00 0.00 C ATOM 1148 O LYS p 70 -11.974 7.888 -0.903 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.194 4.867 -0.718 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.036 4.091 0.286 1.00 0.00 C ATOM 1151 CD LYS p 70 -11.867 4.636 1.694 1.00 0.00 C ATOM 1152 CE LYS p 70 -12.693 3.852 2.699 1.00 0.00 C ATOM 1153 NZ LYS p 70 -12.521 4.370 4.084 1.00 0.00 N ATOM 0 H LYS p 70 -10.852 4.756 -3.240 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.053 5.545 -1.479 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -10.537 4.170 -1.239 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -10.554 5.563 -0.176 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.086 4.143 -0.002 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -11.751 3.039 0.265 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -10.815 4.596 1.977 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -12.164 5.685 1.717 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -13.746 3.902 2.421 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -12.404 2.802 2.666 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -13.101 3.808 4.739 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -11.521 4.299 4.359 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -12.821 5.365 4.122 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.697 7.405 -2.728 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.186 8.755 -2.978 1.00 0.00 C ATOM 1169 C ASN p 71 -11.128 9.432 -3.967 1.00 0.00 C ATOM 1170 O ASN p 71 -11.090 10.643 -4.161 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.761 8.727 -3.539 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.967 9.970 -3.183 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.299 10.020 -2.150 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -8.037 10.983 -4.040 1.00 0.00 N ATOM 0 H ASN p 71 -10.324 6.707 -3.372 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.145 9.306 -2.039 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.242 7.848 -3.158 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.804 8.626 -4.624 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.525 11.845 -3.854 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -8.603 10.899 -4.884 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.945 8.576 -4.600 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.995 8.955 -5.537 1.00 0.00 C ATOM 1183 C ALA p 72 -14.254 9.083 -4.719 1.00 0.00 C ATOM 1184 O ALA p 72 -15.214 9.741 -5.105 1.00 0.00 O ATOM 1185 CB ALA p 72 -13.179 7.921 -6.639 1.00 0.00 C ATOM 0 H ALA p 72 -11.884 7.567 -4.463 1.00 0.00 H new ATOM 0 HA ALA p 72 -12.738 9.887 -6.041 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.971 8.245 -7.314 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -12.249 7.814 -7.197 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.449 6.962 -6.197 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.194 8.394 -3.563 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.199 8.386 -2.552 1.00 0.00 C ATOM 1193 C GLN p 73 -14.945 9.602 -1.693 1.00 0.00 C ATOM 1194 O GLN p 73 -15.854 10.229 -1.168 1.00 0.00 O ATOM 1195 CB GLN p 73 -14.991 7.130 -1.748 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.011 6.913 -0.687 1.00 0.00 C ATOM 1197 CD GLN p 73 -16.876 5.689 -0.920 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -17.927 5.771 -1.556 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -16.437 4.548 -0.404 1.00 0.00 N ATOM 0 H GLN p 73 -13.394 7.809 -3.324 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.215 8.410 -2.947 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -14.996 6.274 -2.423 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.004 7.166 -1.287 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.508 6.815 0.275 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.651 7.793 -0.624 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -15.560 4.528 0.116 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -16.977 3.691 -0.527 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.644 9.846 -1.547 1.00 0.00 N ATOM 1209 CA LEU p 74 -13.093 10.996 -0.842 1.00 0.00 C ATOM 1210 C LEU p 74 -13.221 12.206 -1.744 1.00 0.00 C ATOM 1211 O LEU p 74 -13.343 13.311 -1.286 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.627 10.756 -0.489 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.022 11.641 0.607 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.488 11.222 2.000 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.515 11.566 0.504 1.00 0.00 C ATOM 0 H LEU p 74 -12.926 9.230 -1.928 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.638 11.158 0.088 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.518 9.716 -0.183 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -11.035 10.886 -1.395 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.360 12.667 0.460 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.036 11.875 2.747 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.574 11.300 2.059 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.188 10.192 2.190 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.066 12.190 1.277 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.192 10.534 0.638 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.199 11.920 -0.477 1.00 0.00 H new ATOM 1227 N LYS p 75 -13.208 11.941 -3.047 1.00 0.00 N ATOM 1228 CA LYS p 75 -13.388 12.960 -4.077 1.00 0.00 C ATOM 1229 C LYS p 75 -14.875 13.163 -4.214 1.00 0.00 C ATOM 1230 O LYS p 75 -15.354 14.186 -4.713 1.00 0.00 O ATOM 1231 CB LYS p 75 -12.797 12.507 -5.407 1.00 0.00 C ATOM 1232 CG LYS p 75 -11.721 13.424 -5.962 1.00 0.00 C ATOM 1233 CD LYS p 75 -12.200 14.158 -7.204 1.00 0.00 C ATOM 1234 CE LYS p 75 -11.126 15.084 -7.753 1.00 0.00 C ATOM 1235 NZ LYS p 75 -11.588 15.811 -8.968 1.00 0.00 N ATOM 0 H LYS p 75 -13.071 11.002 -3.422 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.878 13.883 -3.800 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -12.377 11.509 -5.283 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -13.601 12.426 -6.139 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -11.430 14.147 -5.200 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -10.833 12.840 -6.203 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -12.484 13.435 -7.969 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -13.093 14.736 -6.965 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -10.840 15.804 -6.986 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -10.235 14.504 -7.994 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -10.827 16.432 -9.311 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -11.837 15.125 -9.709 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -12.423 16.385 -8.733 1.00 0.00 H new ATOM 1249 N LYS p 76 -15.587 12.131 -3.745 1.00 0.00 N ATOM 1250 CA LYS p 76 -17.040 12.134 -3.705 1.00 0.00 C ATOM 1251 C LYS p 76 -17.472 12.725 -2.383 1.00 0.00 C ATOM 1252 O LYS p 76 -18.514 13.381 -2.287 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.599 10.728 -3.869 1.00 0.00 C ATOM 1254 CG LYS p 76 -18.181 10.447 -5.247 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.676 10.721 -5.298 1.00 0.00 C ATOM 1256 CE LYS p 76 -20.245 10.459 -6.683 1.00 0.00 C ATOM 1257 NZ LYS p 76 -21.706 10.741 -6.746 1.00 0.00 N ATOM 0 H LYS p 76 -15.165 11.275 -3.385 1.00 0.00 H new ATOM 0 HA LYS p 76 -17.427 12.731 -4.531 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.806 10.008 -3.668 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -18.374 10.567 -3.119 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.673 11.064 -5.988 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.993 9.407 -5.515 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -20.187 10.092 -4.569 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -19.867 11.756 -5.015 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -19.724 11.079 -7.413 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -20.064 9.420 -6.959 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -22.055 10.550 -7.707 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -22.207 10.132 -6.068 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -21.878 11.739 -6.507 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.644 12.471 -1.363 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.872 13.013 -0.038 1.00 0.00 C ATOM 1273 C LYS p 77 -16.223 14.388 0.089 1.00 0.00 C ATOM 1274 O LYS p 77 -16.536 15.147 1.010 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.332 12.067 1.027 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.359 11.074 1.539 1.00 0.00 C ATOM 1277 CD LYS p 77 -16.883 10.383 2.806 1.00 0.00 C ATOM 1278 CE LYS p 77 -17.915 9.392 3.321 1.00 0.00 C ATOM 1279 NZ LYS p 77 -17.460 8.713 4.566 1.00 0.00 N ATOM 0 H LYS p 77 -15.809 11.890 -1.441 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.946 13.120 0.113 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.483 11.519 0.617 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.958 12.654 1.866 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.299 11.590 1.736 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.560 10.328 0.770 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -15.945 9.864 2.608 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -16.678 11.129 3.574 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -18.853 9.912 3.513 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.116 8.645 2.553 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -18.191 8.046 4.885 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -16.578 8.195 4.377 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -17.292 9.423 5.307 1.00 0.00 H new ATOM 1293 N LEU p 78 -15.309 14.696 -0.854 1.00 0.00 N ATOM 1294 CA LEU p 78 -14.614 15.994 -0.892 1.00 0.00 C ATOM 1295 C LEU p 78 -15.583 17.172 -0.973 1.00 0.00 C ATOM 1296 O LEU p 78 -15.609 18.042 -0.097 1.00 0.00 O ATOM 1297 CB LEU p 78 -13.676 16.029 -2.105 1.00 0.00 C ATOM 1298 CG LEU p 78 -12.176 16.035 -1.808 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -11.399 15.888 -3.100 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -11.773 17.311 -1.095 1.00 0.00 C ATOM 0 H LEU p 78 -15.036 14.058 -1.602 1.00 0.00 H new ATOM 0 HA LEU p 78 -14.052 16.093 0.037 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -13.896 15.165 -2.732 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -13.911 16.917 -2.692 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.946 15.194 -1.153 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -10.331 15.893 -2.885 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -11.668 14.948 -3.581 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -11.639 16.718 -3.765 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -10.702 17.293 -0.894 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -12.010 18.169 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -12.317 17.389 -0.154 1.00 0.00 H new ATOM 1312 N GLN p 79 -16.367 17.166 -2.040 1.00 0.00 N ATOM 1313 CA GLN p 79 -17.374 18.186 -2.314 1.00 0.00 C ATOM 1314 C GLN p 79 -18.676 17.924 -1.556 1.00 0.00 C ATOM 1315 O GLN p 79 -19.297 18.847 -1.022 1.00 0.00 O ATOM 1316 CB GLN p 79 -17.647 18.263 -3.825 1.00 0.00 C ATOM 1317 CG GLN p 79 -17.625 16.926 -4.566 1.00 0.00 C ATOM 1318 CD GLN p 79 -17.937 17.072 -6.042 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -17.039 17.260 -6.863 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -19.216 16.987 -6.388 1.00 0.00 N ATOM 0 H GLN p 79 -16.322 16.440 -2.755 1.00 0.00 H new ATOM 0 HA GLN p 79 -16.980 19.141 -1.966 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -18.621 18.727 -3.977 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -16.906 18.922 -4.278 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -16.643 16.467 -4.450 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -18.349 16.250 -4.111 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -19.928 16.830 -5.675 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -19.487 17.078 -7.367 1.00 0.00 H new ATOM 1329 N ALA p 80 -19.063 16.657 -1.529 1.00 0.00 N ATOM 1330 CA ALA p 80 -20.284 16.215 -0.853 1.00 0.00 C ATOM 1331 C ALA p 80 -19.987 15.719 0.563 1.00 0.00 C ATOM 1332 O ALA p 80 -20.501 16.334 1.522 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.978 15.133 -1.670 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.238 14.728 0.704 1.00 0.00 O ATOM 0 H ALA p 80 -18.542 15.902 -1.974 1.00 0.00 H new ATOM 0 HA ALA p 80 -20.953 17.071 -0.768 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.884 14.814 -1.156 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -21.238 15.529 -2.652 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -20.309 14.281 -1.788 1.00 0.00 H new TER 1340 ALA p 80