USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 795 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 SER N :NH3+ 150:sc= 0.0137 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot -89:sc= -1.28! USER MOD Single : A 14 CYS SG : rot -50:sc= -6.63! USER MOD Single : A 18 THR OG1 : rot 180:sc= -0.018 USER MOD Single : A 23 HIS : no HD1:sc=-0.00457 X(o=-0.0046,f=-0.3) USER MOD Single : A 24 HIS : no HD1:sc= -0.0253 X(o=-0.025,f=-0.072) USER MOD Single : A 25 THR OG1 : rot 141:sc= -1.93! USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 GLN : amide:sc= -2.66 K(o=-2.7,f=-1.2) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= -3! C(o=-3!,f=-3.1!) USER MOD Single : A 36 SER OG : rot 110:sc= -4.17! USER MOD Single : A 39 LYS NZ :NH3+ -178:sc= -2.15! (180deg=-2.27!) USER MOD Single : A 44 HIS : no HE2:sc= -12.9! C(o=-13!,f=-18!) USER MOD Single : A 48 ASN : amide:sc= -8.63! C(o=-8.6!,f=-11!) USER MOD Single : A 53 SER OG : rot 180:sc= -0.098 USER MOD Single : A 55 MET CE :methyl -150:sc= -18.1! (180deg=-19.6!) USER MOD Single : A 57 SER OG : rot -48:sc= 0.805 USER MOD Single : A 58 SER OG : rot -160:sc= -0.928 USER MOD Single : A 67 TYR OH : rot -178:sc= -4.44! USER MOD Single : A 68 LYS NZ :NH3+ -140:sc= -0.134 (180deg=-0.821) USER MOD Single : A 69 GLN : amide:sc= -0.0379 K(o=-0.038,f=-2.1!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 GLN : amide:sc= -0.0072 X(o=-0.0072,f=-0.18) USER MOD Single : A 77 MET CE :methyl -132:sc= -11.2! (180deg=-19.6!) USER MOD Single : A 80 CYS SG : rot -35:sc= -4.91! USER MOD Single : A 83 SER OG : rot 128:sc= -1.84! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 GLN : amide:sc= -6.45! C(o=-6.5!,f=-14!) USER MOD Single : A 107 GLN : amide:sc= -0.23 K(o=-0.23,f=-1.9!) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -11.112 -15.641 2.025 1.00 0.00 N ATOM 2 CA SER A 1 -10.517 -15.504 0.708 1.00 0.00 C ATOM 3 C SER A 1 -9.687 -14.221 0.639 1.00 0.00 C ATOM 4 O SER A 1 -10.114 -13.174 1.122 1.00 0.00 O ATOM 5 CB SER A 1 -11.590 -15.500 -0.385 1.00 0.00 C ATOM 6 OG SER A 1 -12.330 -16.717 -0.409 1.00 0.00 O ATOM 0 H1 SER A 1 -12.013 -16.155 1.947 1.00 0.00 H new ATOM 0 H2 SER A 1 -10.465 -16.168 2.645 1.00 0.00 H new ATOM 0 H3 SER A 1 -11.286 -14.698 2.427 1.00 0.00 H new ATOM 0 HA SER A 1 -9.866 -16.361 0.538 1.00 0.00 H new ATOM 0 HB2 SER A 1 -12.271 -14.665 -0.222 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.119 -15.343 -1.355 1.00 0.00 H new ATOM 0 HG SER A 1 -13.005 -16.675 -1.118 1.00 0.00 H new ATOM 11 N LEU A 2 -8.513 -14.344 0.035 1.00 0.00 N ATOM 12 CA LEU A 2 -7.619 -13.208 -0.102 1.00 0.00 C ATOM 13 C LEU A 2 -6.183 -13.710 -0.257 1.00 0.00 C ATOM 14 O LEU A 2 -5.788 -14.681 0.386 1.00 0.00 O ATOM 15 CB LEU A 2 -7.808 -12.234 1.063 1.00 0.00 C ATOM 16 CG LEU A 2 -6.652 -11.265 1.320 1.00 0.00 C ATOM 17 CD1 LEU A 2 -6.818 -9.982 0.503 1.00 0.00 C ATOM 18 CD2 LEU A 2 -6.502 -10.976 2.815 1.00 0.00 C ATOM 0 H LEU A 2 -8.161 -15.214 -0.365 1.00 0.00 H new ATOM 0 HA LEU A 2 -7.858 -12.642 -1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -8.711 -11.651 0.881 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -7.980 -12.813 1.971 1.00 0.00 H new ATOM 0 HG LEU A 2 -5.729 -11.740 0.988 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -5.983 -9.311 0.705 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -6.838 -10.227 -0.559 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -7.752 -9.492 0.780 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -5.674 -10.285 2.971 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -7.422 -10.531 3.194 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -6.303 -11.906 3.347 1.00 0.00 H new ATOM 29 N GLY A 3 -5.440 -13.026 -1.115 1.00 0.00 N ATOM 30 CA GLY A 3 -4.055 -13.392 -1.363 1.00 0.00 C ATOM 31 C GLY A 3 -3.099 -12.431 -0.653 1.00 0.00 C ATOM 32 O GLY A 3 -3.535 -11.537 0.070 1.00 0.00 O ATOM 0 H GLY A 3 -5.770 -12.221 -1.647 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -3.876 -14.410 -1.017 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -3.858 -13.381 -2.435 1.00 0.00 H new ATOM 36 N ILE A 4 -1.813 -12.648 -0.886 1.00 0.00 N ATOM 37 CA ILE A 4 -0.791 -11.812 -0.277 1.00 0.00 C ATOM 38 C ILE A 4 0.590 -12.304 -0.714 1.00 0.00 C ATOM 39 O ILE A 4 0.875 -13.499 -0.653 1.00 0.00 O ATOM 40 CB ILE A 4 -0.974 -11.762 1.241 1.00 0.00 C ATOM 41 CG1 ILE A 4 -0.759 -10.343 1.772 1.00 0.00 C ATOM 42 CG2 ILE A 4 -0.068 -12.778 1.937 1.00 0.00 C ATOM 43 CD1 ILE A 4 0.308 -9.609 0.957 1.00 0.00 C ATOM 0 H ILE A 4 -1.455 -13.390 -1.488 1.00 0.00 H new ATOM 0 HA ILE A 4 -0.887 -10.782 -0.620 1.00 0.00 H new ATOM 0 HB ILE A 4 -2.003 -12.040 1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.697 -9.790 1.732 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -0.458 -10.384 2.819 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -0.218 -12.721 3.015 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -0.312 -13.782 1.589 1.00 0.00 H new ATOM 0 HG23 ILE A 4 0.973 -12.557 1.704 1.00 0.00 H new ATOM 0 HD11 ILE A 4 0.442 -8.603 1.355 1.00 0.00 H new ATOM 0 HD12 ILE A 4 1.251 -10.152 1.019 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -0.008 -9.548 -0.085 1.00 0.00 H new ATOM 54 N ASP A 5 1.411 -11.357 -1.143 1.00 0.00 N ATOM 55 CA ASP A 5 2.756 -11.679 -1.589 1.00 0.00 C ATOM 56 C ASP A 5 3.743 -10.676 -0.988 1.00 0.00 C ATOM 57 O ASP A 5 3.334 -9.684 -0.386 1.00 0.00 O ATOM 58 CB ASP A 5 2.866 -11.595 -3.113 1.00 0.00 C ATOM 59 CG ASP A 5 3.740 -12.671 -3.759 1.00 0.00 C ATOM 60 OD1 ASP A 5 3.633 -13.862 -3.431 1.00 0.00 O ATOM 61 OD2 ASP A 5 4.570 -12.240 -4.647 1.00 0.00 O ATOM 0 H ASP A 5 1.171 -10.367 -1.191 1.00 0.00 H new ATOM 0 HA ASP A 5 2.983 -12.695 -1.266 1.00 0.00 H new ATOM 0 HB2 ASP A 5 1.864 -11.658 -3.538 1.00 0.00 H new ATOM 0 HB3 ASP A 5 3.264 -10.616 -3.380 1.00 0.00 H new ATOM 66 N MET A 6 5.021 -10.969 -1.172 1.00 0.00 N ATOM 67 CA MET A 6 6.069 -10.105 -0.654 1.00 0.00 C ATOM 68 C MET A 6 7.362 -10.272 -1.456 1.00 0.00 C ATOM 69 O MET A 6 7.793 -11.392 -1.721 1.00 0.00 O ATOM 70 CB MET A 6 6.331 -10.445 0.815 1.00 0.00 C ATOM 71 CG MET A 6 5.378 -9.678 1.733 1.00 0.00 C ATOM 72 SD MET A 6 5.812 -9.964 3.441 1.00 0.00 S ATOM 73 CE MET A 6 4.375 -10.876 3.978 1.00 0.00 C ATOM 0 H MET A 6 5.355 -11.792 -1.672 1.00 0.00 H new ATOM 0 HA MET A 6 5.739 -9.070 -0.743 1.00 0.00 H new ATOM 0 HB2 MET A 6 6.209 -11.517 0.971 1.00 0.00 H new ATOM 0 HB3 MET A 6 7.362 -10.201 1.070 1.00 0.00 H new ATOM 0 HG2 MET A 6 5.425 -8.612 1.511 1.00 0.00 H new ATOM 0 HG3 MET A 6 4.351 -9.996 1.552 1.00 0.00 H new ATOM 0 HE1 MET A 6 4.482 -11.136 5.031 1.00 0.00 H new ATOM 0 HE2 MET A 6 3.484 -10.263 3.844 1.00 0.00 H new ATOM 0 HE3 MET A 6 4.280 -11.787 3.387 1.00 0.00 H new ATOM 81 N ASN A 7 7.944 -9.138 -1.819 1.00 0.00 N ATOM 82 CA ASN A 7 9.180 -9.144 -2.585 1.00 0.00 C ATOM 83 C ASN A 7 10.076 -7.999 -2.107 1.00 0.00 C ATOM 84 O ASN A 7 9.624 -7.112 -1.385 1.00 0.00 O ATOM 85 CB ASN A 7 8.904 -8.938 -4.076 1.00 0.00 C ATOM 86 CG ASN A 7 9.318 -10.169 -4.884 1.00 0.00 C ATOM 87 OD1 ASN A 7 8.571 -11.121 -5.043 1.00 0.00 O ATOM 88 ND2 ASN A 7 10.548 -10.099 -5.385 1.00 0.00 N ATOM 0 H ASN A 7 7.583 -8.210 -1.597 1.00 0.00 H new ATOM 0 HA ASN A 7 9.664 -10.109 -2.438 1.00 0.00 H new ATOM 0 HB2 ASN A 7 7.844 -8.738 -4.229 1.00 0.00 H new ATOM 0 HB3 ASN A 7 9.448 -8.064 -4.433 1.00 0.00 H new ATOM 0 HD21 ASN A 7 10.917 -10.871 -5.940 1.00 0.00 H new ATOM 0 HD22 ASN A 7 11.122 -9.273 -5.215 1.00 0.00 H new ATOM 94 N VAL A 8 11.330 -8.056 -2.530 1.00 0.00 N ATOM 95 CA VAL A 8 12.294 -7.035 -2.155 1.00 0.00 C ATOM 96 C VAL A 8 13.040 -6.561 -3.404 1.00 0.00 C ATOM 97 O VAL A 8 13.339 -7.357 -4.291 1.00 0.00 O ATOM 98 CB VAL A 8 13.228 -7.572 -1.068 1.00 0.00 C ATOM 99 CG1 VAL A 8 14.686 -7.530 -1.528 1.00 0.00 C ATOM 100 CG2 VAL A 8 13.044 -6.803 0.241 1.00 0.00 C ATOM 0 H VAL A 8 11.701 -8.793 -3.129 1.00 0.00 H new ATOM 0 HA VAL A 8 11.787 -6.168 -1.731 1.00 0.00 H new ATOM 0 HB VAL A 8 12.965 -8.614 -0.885 1.00 0.00 H new ATOM 0 HG11 VAL A 8 15.328 -7.917 -0.737 1.00 0.00 H new ATOM 0 HG12 VAL A 8 14.803 -8.142 -2.422 1.00 0.00 H new ATOM 0 HG13 VAL A 8 14.967 -6.501 -1.753 1.00 0.00 H new ATOM 0 HG21 VAL A 8 13.719 -7.204 0.997 1.00 0.00 H new ATOM 0 HG22 VAL A 8 13.267 -5.749 0.078 1.00 0.00 H new ATOM 0 HG23 VAL A 8 12.014 -6.907 0.583 1.00 0.00 H new ATOM 110 N LYS A 9 13.319 -5.266 -3.430 1.00 0.00 N ATOM 111 CA LYS A 9 14.024 -4.676 -4.555 1.00 0.00 C ATOM 112 C LYS A 9 14.889 -3.516 -4.058 1.00 0.00 C ATOM 113 O LYS A 9 14.379 -2.435 -3.769 1.00 0.00 O ATOM 114 CB LYS A 9 13.038 -4.279 -5.657 1.00 0.00 C ATOM 115 CG LYS A 9 11.679 -4.948 -5.444 1.00 0.00 C ATOM 116 CD LYS A 9 11.678 -6.376 -5.994 1.00 0.00 C ATOM 117 CE LYS A 9 10.766 -6.490 -7.218 1.00 0.00 C ATOM 118 NZ LYS A 9 11.250 -7.554 -8.126 1.00 0.00 N ATOM 0 H LYS A 9 13.070 -4.609 -2.690 1.00 0.00 H new ATOM 0 HA LYS A 9 14.696 -5.405 -5.007 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.916 -3.196 -5.668 1.00 0.00 H new ATOM 0 HB3 LYS A 9 13.439 -4.565 -6.629 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.440 -4.964 -4.381 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.901 -4.364 -5.936 1.00 0.00 H new ATOM 0 HD2 LYS A 9 12.693 -6.667 -6.264 1.00 0.00 H new ATOM 0 HD3 LYS A 9 11.343 -7.067 -5.221 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.747 -6.710 -6.901 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.736 -5.537 -7.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.621 -7.619 -8.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.214 -7.328 -8.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 11.255 -8.464 -7.623 1.00 0.00 H new ATOM 127 N GLU A 10 16.184 -3.781 -3.973 1.00 0.00 N ATOM 128 CA GLU A 10 17.126 -2.773 -3.515 1.00 0.00 C ATOM 129 C GLU A 10 16.835 -2.397 -2.061 1.00 0.00 C ATOM 130 O GLU A 10 17.740 -2.006 -1.324 1.00 0.00 O ATOM 131 CB GLU A 10 17.090 -1.539 -4.418 1.00 0.00 C ATOM 132 CG GLU A 10 17.724 -0.333 -3.723 1.00 0.00 C ATOM 133 CD GLU A 10 18.531 0.509 -4.714 1.00 0.00 C ATOM 134 OE1 GLU A 10 17.948 1.176 -5.580 1.00 0.00 O ATOM 135 OE2 GLU A 10 19.811 0.454 -4.560 1.00 0.00 O ATOM 0 H GLU A 10 16.604 -4.679 -4.213 1.00 0.00 H new ATOM 0 HA GLU A 10 18.131 -3.192 -3.568 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.620 -1.748 -5.347 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.058 -1.309 -4.685 1.00 0.00 H new ATOM 0 HG2 GLU A 10 16.946 0.280 -3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 10 18.373 -0.673 -2.916 1.00 0.00 H new ATOM 141 N SER A 11 15.569 -2.528 -1.691 1.00 0.00 N ATOM 142 CA SER A 11 15.149 -2.207 -0.338 1.00 0.00 C ATOM 143 C SER A 11 13.630 -2.026 -0.291 1.00 0.00 C ATOM 144 O SER A 11 13.062 -1.793 0.774 1.00 0.00 O ATOM 145 CB SER A 11 15.849 -0.945 0.172 1.00 0.00 C ATOM 146 OG SER A 11 16.486 -0.226 -0.881 1.00 0.00 O ATOM 0 H SER A 11 14.821 -2.852 -2.305 1.00 0.00 H new ATOM 0 HA SER A 11 15.431 -3.035 0.313 1.00 0.00 H new ATOM 0 HB2 SER A 11 15.121 -0.300 0.663 1.00 0.00 H new ATOM 0 HB3 SER A 11 16.589 -1.219 0.923 1.00 0.00 H new ATOM 0 HG SER A 11 17.400 -0.559 -0.998 1.00 0.00 H new ATOM 151 N VAL A 12 13.016 -2.140 -1.461 1.00 0.00 N ATOM 152 CA VAL A 12 11.575 -1.993 -1.566 1.00 0.00 C ATOM 153 C VAL A 12 10.918 -3.372 -1.479 1.00 0.00 C ATOM 154 O VAL A 12 11.184 -4.244 -2.304 1.00 0.00 O ATOM 155 CB VAL A 12 11.219 -1.241 -2.851 1.00 0.00 C ATOM 156 CG1 VAL A 12 11.500 -2.101 -4.085 1.00 0.00 C ATOM 157 CG2 VAL A 12 9.762 -0.776 -2.829 1.00 0.00 C ATOM 0 H VAL A 12 13.491 -2.332 -2.343 1.00 0.00 H new ATOM 0 HA VAL A 12 11.190 -1.397 -0.738 1.00 0.00 H new ATOM 0 HB VAL A 12 11.853 -0.356 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 12 11.238 -1.543 -4.984 1.00 0.00 H new ATOM 0 HG12 VAL A 12 12.558 -2.361 -4.114 1.00 0.00 H new ATOM 0 HG13 VAL A 12 10.904 -3.012 -4.037 1.00 0.00 H new ATOM 0 HG21 VAL A 12 9.536 -0.245 -3.753 1.00 0.00 H new ATOM 0 HG22 VAL A 12 9.105 -1.641 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL A 12 9.605 -0.110 -1.980 1.00 0.00 H new ATOM 167 N LEU A 13 10.071 -3.525 -0.471 1.00 0.00 N ATOM 168 CA LEU A 13 9.373 -4.783 -0.264 1.00 0.00 C ATOM 169 C LEU A 13 8.021 -4.735 -0.978 1.00 0.00 C ATOM 170 O LEU A 13 7.104 -4.048 -0.530 1.00 0.00 O ATOM 171 CB LEU A 13 9.270 -5.099 1.229 1.00 0.00 C ATOM 172 CG LEU A 13 9.924 -4.091 2.175 1.00 0.00 C ATOM 173 CD1 LEU A 13 11.322 -3.707 1.686 1.00 0.00 C ATOM 174 CD2 LEU A 13 9.029 -2.866 2.373 1.00 0.00 C ATOM 0 H LEU A 13 9.852 -2.799 0.211 1.00 0.00 H new ATOM 0 HA LEU A 13 9.935 -5.607 -0.702 1.00 0.00 H new ATOM 0 HB2 LEU A 13 8.215 -5.181 1.491 1.00 0.00 H new ATOM 0 HB3 LEU A 13 9.719 -6.076 1.405 1.00 0.00 H new ATOM 0 HG LEU A 13 10.043 -4.564 3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 13 11.765 -2.989 2.377 1.00 0.00 H new ATOM 0 HD12 LEU A 13 11.948 -4.598 1.638 1.00 0.00 H new ATOM 0 HD13 LEU A 13 11.251 -3.260 0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 13 9.517 -2.165 3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 13 8.856 -2.382 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 13 8.075 -3.177 2.799 1.00 0.00 H new ATOM 185 N CYS A 14 7.941 -5.472 -2.076 1.00 0.00 N ATOM 186 CA CYS A 14 6.715 -5.521 -2.856 1.00 0.00 C ATOM 187 C CYS A 14 5.702 -6.384 -2.103 1.00 0.00 C ATOM 188 O CYS A 14 6.052 -7.434 -1.565 1.00 0.00 O ATOM 189 CB CYS A 14 6.966 -6.040 -4.273 1.00 0.00 C ATOM 190 SG CYS A 14 8.692 -5.688 -4.771 1.00 0.00 S ATOM 0 H CYS A 14 8.704 -6.040 -2.444 1.00 0.00 H new ATOM 0 HA CYS A 14 6.316 -4.514 -2.975 1.00 0.00 H new ATOM 0 HB2 CYS A 14 6.778 -7.113 -4.315 1.00 0.00 H new ATOM 0 HB3 CYS A 14 6.274 -5.568 -4.970 1.00 0.00 H new ATOM 0 HG CYS A 14 8.963 -4.437 -4.544 1.00 0.00 H new ATOM 195 N ILE A 15 4.463 -5.913 -2.089 1.00 0.00 N ATOM 196 CA ILE A 15 3.396 -6.628 -1.412 1.00 0.00 C ATOM 197 C ILE A 15 2.231 -6.836 -2.381 1.00 0.00 C ATOM 198 O ILE A 15 1.400 -5.945 -2.556 1.00 0.00 O ATOM 199 CB ILE A 15 3.002 -5.907 -0.121 1.00 0.00 C ATOM 200 CG1 ILE A 15 3.863 -6.375 1.054 1.00 0.00 C ATOM 201 CG2 ILE A 15 1.508 -6.069 0.164 1.00 0.00 C ATOM 202 CD1 ILE A 15 5.334 -6.021 0.830 1.00 0.00 C ATOM 0 H ILE A 15 4.175 -5.043 -2.537 1.00 0.00 H new ATOM 0 HA ILE A 15 3.736 -7.617 -1.106 1.00 0.00 H new ATOM 0 HB ILE A 15 3.191 -4.842 -0.254 1.00 0.00 H new ATOM 0 HG12 ILE A 15 3.510 -5.912 1.975 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.759 -7.453 1.179 1.00 0.00 H new ATOM 0 HG21 ILE A 15 1.255 -5.547 1.087 1.00 0.00 H new ATOM 0 HG22 ILE A 15 0.933 -5.648 -0.660 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.270 -7.128 0.269 1.00 0.00 H new ATOM 0 HD11 ILE A 15 5.924 -6.365 1.679 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.690 -6.505 -0.079 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.437 -4.941 0.730 1.00 0.00 H new ATOM 213 N ARG A 16 2.208 -8.014 -2.985 1.00 0.00 N ATOM 214 CA ARG A 16 1.158 -8.349 -3.932 1.00 0.00 C ATOM 215 C ARG A 16 0.075 -9.187 -3.249 1.00 0.00 C ATOM 216 O ARG A 16 0.310 -10.340 -2.894 1.00 0.00 O ATOM 217 CB ARG A 16 1.719 -9.127 -5.124 1.00 0.00 C ATOM 218 CG ARG A 16 1.640 -8.296 -6.407 1.00 0.00 C ATOM 219 CD ARG A 16 3.029 -8.102 -7.020 1.00 0.00 C ATOM 220 NE ARG A 16 2.921 -7.347 -8.289 1.00 0.00 N ATOM 221 CZ ARG A 16 3.947 -7.152 -9.143 1.00 0.00 C ATOM 222 NH1 ARG A 16 5.171 -7.654 -8.870 1.00 0.00 N ATOM 223 NH2 ARG A 16 3.738 -6.461 -10.248 1.00 0.00 N ATOM 0 H ARG A 16 2.900 -8.749 -2.837 1.00 0.00 H new ATOM 0 HA ARG A 16 0.727 -7.415 -4.293 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.755 -9.402 -4.928 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.161 -10.055 -5.252 1.00 0.00 H new ATOM 0 HG2 ARG A 16 0.987 -8.791 -7.126 1.00 0.00 H new ATOM 0 HG3 ARG A 16 1.196 -7.325 -6.189 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.672 -7.566 -6.322 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.494 -9.071 -7.202 1.00 0.00 H new ATOM 0 HE ARG A 16 2.014 -6.949 -8.533 1.00 0.00 H new ATOM 0 HH11 ARG A 16 5.325 -8.185 -8.013 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.941 -7.502 -9.521 1.00 0.00 H new ATOM 0 HH21 ARG A 16 2.811 -6.083 -10.446 1.00 0.00 H new ATOM 0 HH22 ARG A 16 4.503 -6.305 -10.904 1.00 0.00 H new ATOM 233 N LEU A 17 -1.088 -8.574 -3.088 1.00 0.00 N ATOM 234 CA LEU A 17 -2.209 -9.249 -2.455 1.00 0.00 C ATOM 235 C LEU A 17 -3.370 -9.342 -3.447 1.00 0.00 C ATOM 236 O LEU A 17 -3.655 -8.385 -4.166 1.00 0.00 O ATOM 237 CB LEU A 17 -2.576 -8.558 -1.141 1.00 0.00 C ATOM 238 CG LEU A 17 -4.028 -8.095 -1.009 1.00 0.00 C ATOM 239 CD1 LEU A 17 -4.326 -7.617 0.413 1.00 0.00 C ATOM 240 CD2 LEU A 17 -4.358 -7.025 -2.053 1.00 0.00 C ATOM 0 H LEU A 17 -1.279 -7.617 -3.385 1.00 0.00 H new ATOM 0 HA LEU A 17 -1.937 -10.270 -2.187 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.358 -9.242 -0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -1.926 -7.692 -1.015 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.677 -8.949 -1.204 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.365 -7.294 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -4.155 -8.434 1.115 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.670 -6.782 0.661 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.396 -6.712 -1.938 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -3.703 -6.165 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -4.211 -7.434 -3.052 1.00 0.00 H new ATOM 251 N THR A 18 -4.009 -10.502 -3.454 1.00 0.00 N ATOM 252 CA THR A 18 -5.133 -10.732 -4.346 1.00 0.00 C ATOM 253 C THR A 18 -6.330 -11.277 -3.565 1.00 0.00 C ATOM 254 O THR A 18 -6.276 -12.383 -3.030 1.00 0.00 O ATOM 255 CB THR A 18 -4.664 -11.662 -5.466 1.00 0.00 C ATOM 256 OG1 THR A 18 -3.762 -12.557 -4.821 1.00 0.00 O ATOM 257 CG2 THR A 18 -3.798 -10.942 -6.502 1.00 0.00 C ATOM 0 H THR A 18 -3.770 -11.293 -2.856 1.00 0.00 H new ATOM 0 HA THR A 18 -5.476 -9.802 -4.799 1.00 0.00 H new ATOM 0 HB THR A 18 -5.531 -12.100 -5.960 1.00 0.00 H new ATOM 0 HG1 THR A 18 -3.412 -13.197 -5.476 1.00 0.00 H new ATOM 0 HG21 THR A 18 -3.492 -11.648 -7.274 1.00 0.00 H new ATOM 0 HG22 THR A 18 -4.371 -10.133 -6.956 1.00 0.00 H new ATOM 0 HG23 THR A 18 -2.914 -10.532 -6.015 1.00 0.00 H new ATOM 265 N GLY A 19 -7.384 -10.475 -3.524 1.00 0.00 N ATOM 266 CA GLY A 19 -8.593 -10.863 -2.818 1.00 0.00 C ATOM 267 C GLY A 19 -9.516 -9.659 -2.610 1.00 0.00 C ATOM 268 O GLY A 19 -9.977 -9.052 -3.575 1.00 0.00 O ATOM 0 H GLY A 19 -7.426 -9.558 -3.969 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -9.117 -11.634 -3.383 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.332 -11.297 -1.853 1.00 0.00 H new ATOM 272 N GLU A 20 -9.757 -9.352 -1.344 1.00 0.00 N ATOM 273 CA GLU A 20 -10.617 -8.234 -0.996 1.00 0.00 C ATOM 274 C GLU A 20 -9.865 -7.243 -0.105 1.00 0.00 C ATOM 275 O GLU A 20 -8.836 -7.585 0.477 1.00 0.00 O ATOM 276 CB GLU A 20 -11.901 -8.718 -0.319 1.00 0.00 C ATOM 277 CG GLU A 20 -13.105 -8.557 -1.247 1.00 0.00 C ATOM 278 CD GLU A 20 -13.453 -9.881 -1.930 1.00 0.00 C ATOM 279 OE1 GLU A 20 -12.590 -10.487 -2.583 1.00 0.00 O ATOM 280 OE2 GLU A 20 -14.668 -10.278 -1.762 1.00 0.00 O ATOM 0 H GLU A 20 -9.372 -9.858 -0.547 1.00 0.00 H new ATOM 0 HA GLU A 20 -10.903 -7.721 -1.915 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -11.794 -9.765 -0.035 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -12.067 -8.154 0.599 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -13.963 -8.202 -0.677 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -12.888 -7.801 -2.001 1.00 0.00 H new ATOM 286 N LEU A 21 -10.408 -6.038 -0.025 1.00 0.00 N ATOM 287 CA LEU A 21 -9.801 -4.996 0.787 1.00 0.00 C ATOM 288 C LEU A 21 -10.788 -4.563 1.873 1.00 0.00 C ATOM 289 O LEU A 21 -11.515 -3.585 1.702 1.00 0.00 O ATOM 290 CB LEU A 21 -9.313 -3.845 -0.096 1.00 0.00 C ATOM 291 CG LEU A 21 -7.820 -3.840 -0.426 1.00 0.00 C ATOM 292 CD1 LEU A 21 -7.002 -4.438 0.721 1.00 0.00 C ATOM 293 CD2 LEU A 21 -7.548 -4.551 -1.754 1.00 0.00 C ATOM 0 H LEU A 21 -11.262 -5.759 -0.509 1.00 0.00 H new ATOM 0 HA LEU A 21 -8.914 -5.375 1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -9.872 -3.869 -1.032 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -9.559 -2.905 0.398 1.00 0.00 H new ATOM 0 HG LEU A 21 -7.501 -2.804 -0.544 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -5.944 -4.422 0.460 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -7.161 -3.852 1.626 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -7.317 -5.467 0.895 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -6.479 -4.533 -1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -7.887 -5.585 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.084 -4.043 -2.555 1.00 0.00 H new ATOM 304 N ASP A 22 -10.781 -5.310 2.966 1.00 0.00 N ATOM 305 CA ASP A 22 -11.666 -5.016 4.080 1.00 0.00 C ATOM 306 C ASP A 22 -10.930 -5.279 5.395 1.00 0.00 C ATOM 307 O ASP A 22 -9.837 -5.845 5.396 1.00 0.00 O ATOM 308 CB ASP A 22 -12.909 -5.906 4.047 1.00 0.00 C ATOM 309 CG ASP A 22 -12.933 -6.942 2.921 1.00 0.00 C ATOM 310 OD1 ASP A 22 -13.286 -8.112 3.136 1.00 0.00 O ATOM 311 OD2 ASP A 22 -12.564 -6.500 1.766 1.00 0.00 O ATOM 0 H ASP A 22 -10.176 -6.119 3.104 1.00 0.00 H new ATOM 0 HA ASP A 22 -11.969 -3.972 4.002 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -12.990 -6.427 5.001 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -13.790 -5.271 3.955 1.00 0.00 H new ATOM 316 N HIS A 23 -11.558 -4.859 6.483 1.00 0.00 N ATOM 317 CA HIS A 23 -10.976 -5.044 7.802 1.00 0.00 C ATOM 318 C HIS A 23 -10.440 -6.470 7.931 1.00 0.00 C ATOM 319 O HIS A 23 -9.501 -6.718 8.685 1.00 0.00 O ATOM 320 CB HIS A 23 -11.986 -4.688 8.895 1.00 0.00 C ATOM 321 CG HIS A 23 -12.862 -5.842 9.321 1.00 0.00 C ATOM 322 ND1 HIS A 23 -12.566 -6.645 10.409 1.00 0.00 N ATOM 323 CD2 HIS A 23 -14.026 -6.318 8.795 1.00 0.00 C ATOM 324 CE1 HIS A 23 -13.517 -7.561 10.523 1.00 0.00 C ATOM 325 NE2 HIS A 23 -14.421 -7.357 9.521 1.00 0.00 N ATOM 0 H HIS A 23 -12.464 -4.391 6.479 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.134 -4.364 7.931 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.447 -4.314 9.765 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.620 -3.876 8.539 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.540 -5.918 7.934 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -13.568 -8.333 11.276 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -15.261 -7.911 9.357 1.00 0.00 H new ATOM 332 N HIS A 24 -11.059 -7.371 7.182 1.00 0.00 N ATOM 333 CA HIS A 24 -10.655 -8.767 7.203 1.00 0.00 C ATOM 334 C HIS A 24 -9.343 -8.934 6.435 1.00 0.00 C ATOM 335 O HIS A 24 -8.395 -9.531 6.942 1.00 0.00 O ATOM 336 CB HIS A 24 -11.773 -9.663 6.668 1.00 0.00 C ATOM 337 CG HIS A 24 -12.702 -10.191 7.735 1.00 0.00 C ATOM 338 ND1 HIS A 24 -14.066 -9.957 7.725 1.00 0.00 N ATOM 339 CD2 HIS A 24 -12.449 -10.944 8.844 1.00 0.00 C ATOM 340 CE1 HIS A 24 -14.600 -10.546 8.785 1.00 0.00 C ATOM 341 NE2 HIS A 24 -13.596 -11.156 9.478 1.00 0.00 N ATOM 0 H HIS A 24 -11.837 -7.162 6.557 1.00 0.00 H new ATOM 0 HA HIS A 24 -10.476 -9.082 8.231 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -12.357 -9.102 5.938 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -11.327 -10.506 6.139 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -11.480 -11.306 9.154 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -15.646 -10.544 9.053 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -13.708 -11.688 10.341 1.00 0.00 H new ATOM 348 N THR A 25 -9.330 -8.394 5.226 1.00 0.00 N ATOM 349 CA THR A 25 -8.149 -8.475 4.382 1.00 0.00 C ATOM 350 C THR A 25 -7.118 -7.427 4.806 1.00 0.00 C ATOM 351 O THR A 25 -5.918 -7.622 4.625 1.00 0.00 O ATOM 352 CB THR A 25 -8.596 -8.333 2.926 1.00 0.00 C ATOM 353 OG1 THR A 25 -8.607 -6.927 2.702 1.00 0.00 O ATOM 354 CG2 THR A 25 -10.052 -8.755 2.718 1.00 0.00 C ATOM 0 H THR A 25 -10.118 -7.898 4.810 1.00 0.00 H new ATOM 0 HA THR A 25 -7.651 -9.439 4.491 1.00 0.00 H new ATOM 0 HB THR A 25 -7.949 -8.934 2.287 1.00 0.00 H new ATOM 0 HG1 THR A 25 -8.273 -6.737 1.800 1.00 0.00 H new ATOM 0 HG21 THR A 25 -10.319 -8.635 1.668 1.00 0.00 H new ATOM 0 HG22 THR A 25 -10.173 -9.799 3.006 1.00 0.00 H new ATOM 0 HG23 THR A 25 -10.703 -8.132 3.331 1.00 0.00 H new ATOM 362 N ALA A 26 -7.625 -6.336 5.362 1.00 0.00 N ATOM 363 CA ALA A 26 -6.764 -5.256 5.813 1.00 0.00 C ATOM 364 C ALA A 26 -6.020 -5.696 7.075 1.00 0.00 C ATOM 365 O ALA A 26 -5.011 -5.096 7.446 1.00 0.00 O ATOM 366 CB ALA A 26 -7.601 -3.995 6.039 1.00 0.00 C ATOM 0 H ALA A 26 -8.622 -6.177 5.510 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.017 -5.019 5.055 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -6.955 -3.185 6.377 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -8.085 -3.707 5.106 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -8.361 -4.193 6.795 1.00 0.00 H new ATOM 372 N GLU A 27 -6.544 -6.740 7.698 1.00 0.00 N ATOM 373 CA GLU A 27 -5.942 -7.268 8.912 1.00 0.00 C ATOM 374 C GLU A 27 -4.586 -7.903 8.597 1.00 0.00 C ATOM 375 O GLU A 27 -3.603 -7.654 9.294 1.00 0.00 O ATOM 376 CB GLU A 27 -6.873 -8.270 9.595 1.00 0.00 C ATOM 377 CG GLU A 27 -7.190 -7.837 11.027 1.00 0.00 C ATOM 378 CD GLU A 27 -8.646 -7.384 11.154 1.00 0.00 C ATOM 379 OE1 GLU A 27 -9.545 -8.223 11.310 1.00 0.00 O ATOM 380 OE2 GLU A 27 -8.828 -6.108 11.086 1.00 0.00 O ATOM 0 H GLU A 27 -7.379 -7.236 7.386 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.782 -6.442 9.605 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.798 -8.359 9.025 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -6.408 -9.256 9.604 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.002 -8.665 11.711 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -6.526 -7.024 11.320 1.00 0.00 H new ATOM 386 N THR A 28 -4.577 -8.713 7.548 1.00 0.00 N ATOM 387 CA THR A 28 -3.359 -9.387 7.134 1.00 0.00 C ATOM 388 C THR A 28 -2.184 -8.407 7.123 1.00 0.00 C ATOM 389 O THR A 28 -1.120 -8.701 7.664 1.00 0.00 O ATOM 390 CB THR A 28 -3.618 -10.039 5.775 1.00 0.00 C ATOM 391 OG1 THR A 28 -3.769 -11.423 6.077 1.00 0.00 O ATOM 392 CG2 THR A 28 -2.394 -9.989 4.858 1.00 0.00 C ATOM 0 H THR A 28 -5.394 -8.917 6.973 1.00 0.00 H new ATOM 0 HA THR A 28 -3.082 -10.170 7.839 1.00 0.00 H new ATOM 0 HB THR A 28 -4.457 -9.541 5.288 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.942 -11.921 5.251 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.632 -10.465 3.907 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.112 -8.951 4.683 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.564 -10.516 5.330 1.00 0.00 H new ATOM 400 N LEU A 29 -2.417 -7.261 6.500 1.00 0.00 N ATOM 401 CA LEU A 29 -1.392 -6.235 6.411 1.00 0.00 C ATOM 402 C LEU A 29 -1.091 -5.698 7.813 1.00 0.00 C ATOM 403 O LEU A 29 0.027 -5.268 8.090 1.00 0.00 O ATOM 404 CB LEU A 29 -1.803 -5.151 5.413 1.00 0.00 C ATOM 405 CG LEU A 29 -0.689 -4.611 4.514 1.00 0.00 C ATOM 406 CD1 LEU A 29 0.146 -5.752 3.929 1.00 0.00 C ATOM 407 CD2 LEU A 29 -1.259 -3.700 3.423 1.00 0.00 C ATOM 0 H LEU A 29 -3.301 -7.020 6.052 1.00 0.00 H new ATOM 0 HA LEU A 29 -0.464 -6.656 6.024 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.594 -5.550 4.778 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -2.231 -4.317 5.969 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.021 -4.004 5.125 1.00 0.00 H new ATOM 0 HD11 LEU A 29 0.931 -5.340 3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 29 0.598 -6.325 4.739 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.495 -6.405 3.337 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.447 -3.329 2.798 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.962 -4.263 2.809 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.775 -2.858 3.885 1.00 0.00 H new ATOM 418 N LYS A 30 -2.109 -5.742 8.659 1.00 0.00 N ATOM 419 CA LYS A 30 -1.968 -5.266 10.025 1.00 0.00 C ATOM 420 C LYS A 30 -0.664 -5.807 10.617 1.00 0.00 C ATOM 421 O LYS A 30 0.072 -5.076 11.278 1.00 0.00 O ATOM 422 CB LYS A 30 -3.209 -5.618 10.847 1.00 0.00 C ATOM 423 CG LYS A 30 -3.438 -4.595 11.962 1.00 0.00 C ATOM 424 CD LYS A 30 -2.487 -4.843 13.135 1.00 0.00 C ATOM 425 CE LYS A 30 -2.638 -6.267 13.671 1.00 0.00 C ATOM 426 NZ LYS A 30 -2.740 -6.258 15.148 1.00 0.00 N ATOM 0 H LYS A 30 -3.035 -6.100 8.425 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.900 -4.178 10.044 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.083 -5.653 10.196 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.093 -6.612 11.279 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.287 -3.588 11.573 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.470 -4.652 12.307 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.458 -4.678 12.815 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -2.691 -4.127 13.931 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.526 -6.731 13.242 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.784 -6.870 13.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -2.842 -7.233 15.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.881 -5.835 15.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -3.569 -5.700 15.435 1.00 0.00 H new ATOM 435 N GLN A 31 -0.420 -7.083 10.359 1.00 0.00 N ATOM 436 CA GLN A 31 0.781 -7.731 10.858 1.00 0.00 C ATOM 437 C GLN A 31 2.008 -7.242 10.085 1.00 0.00 C ATOM 438 O GLN A 31 3.093 -7.119 10.650 1.00 0.00 O ATOM 439 CB GLN A 31 0.655 -9.254 10.782 1.00 0.00 C ATOM 440 CG GLN A 31 0.950 -9.757 9.367 1.00 0.00 C ATOM 441 CD GLN A 31 0.112 -10.995 9.041 1.00 0.00 C ATOM 442 OE1 GLN A 31 0.623 -12.060 8.734 1.00 0.00 O ATOM 443 NE2 GLN A 31 -1.201 -10.798 9.125 1.00 0.00 N ATOM 0 H GLN A 31 -1.034 -7.686 9.811 1.00 0.00 H new ATOM 0 HA GLN A 31 0.906 -7.463 11.907 1.00 0.00 H new ATOM 0 HB2 GLN A 31 1.346 -9.716 11.488 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -0.350 -9.555 11.077 1.00 0.00 H new ATOM 0 HG2 GLN A 31 0.737 -8.969 8.645 1.00 0.00 H new ATOM 0 HG3 GLN A 31 2.010 -9.996 9.275 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -1.563 -9.881 9.388 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -1.845 -11.564 8.927 1.00 0.00 H new ATOM 450 N LYS A 32 1.794 -6.977 8.805 1.00 0.00 N ATOM 451 CA LYS A 32 2.868 -6.504 7.948 1.00 0.00 C ATOM 452 C LYS A 32 3.298 -5.108 8.401 1.00 0.00 C ATOM 453 O LYS A 32 4.334 -4.603 7.970 1.00 0.00 O ATOM 454 CB LYS A 32 2.451 -6.573 6.479 1.00 0.00 C ATOM 455 CG LYS A 32 3.523 -5.960 5.575 1.00 0.00 C ATOM 456 CD LYS A 32 4.874 -6.646 5.784 1.00 0.00 C ATOM 457 CE LYS A 32 5.763 -6.495 4.549 1.00 0.00 C ATOM 458 NZ LYS A 32 7.164 -6.848 4.872 1.00 0.00 N ATOM 0 H LYS A 32 0.892 -7.081 8.340 1.00 0.00 H new ATOM 0 HA LYS A 32 3.740 -7.151 8.038 1.00 0.00 H new ATOM 0 HB2 LYS A 32 2.280 -7.611 6.194 1.00 0.00 H new ATOM 0 HB3 LYS A 32 1.508 -6.045 6.340 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.221 -6.054 4.532 1.00 0.00 H new ATOM 0 HG3 LYS A 32 3.616 -4.895 5.786 1.00 0.00 H new ATOM 0 HD2 LYS A 32 5.374 -6.215 6.651 1.00 0.00 H new ATOM 0 HD3 LYS A 32 4.719 -7.704 5.998 1.00 0.00 H new ATOM 0 HE2 LYS A 32 5.395 -7.137 3.748 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.715 -5.470 4.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 7.754 -6.740 4.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 7.517 -6.218 5.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 7.207 -7.834 5.200 1.00 0.00 H new ATOM 467 N VAL A 33 2.481 -4.521 9.264 1.00 0.00 N ATOM 468 CA VAL A 33 2.764 -3.193 9.779 1.00 0.00 C ATOM 469 C VAL A 33 3.845 -3.289 10.857 1.00 0.00 C ATOM 470 O VAL A 33 4.879 -2.628 10.765 1.00 0.00 O ATOM 471 CB VAL A 33 1.474 -2.541 10.282 1.00 0.00 C ATOM 472 CG1 VAL A 33 1.721 -1.090 10.703 1.00 0.00 C ATOM 473 CG2 VAL A 33 0.369 -2.626 9.227 1.00 0.00 C ATOM 0 H VAL A 33 1.622 -4.942 9.619 1.00 0.00 H new ATOM 0 HA VAL A 33 3.150 -2.550 8.988 1.00 0.00 H new ATOM 0 HB VAL A 33 1.140 -3.092 11.161 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.788 -0.650 11.056 1.00 0.00 H new ATOM 0 HG12 VAL A 33 2.461 -1.064 11.503 1.00 0.00 H new ATOM 0 HG13 VAL A 33 2.090 -0.521 9.849 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.537 -2.155 9.610 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.690 -2.111 8.321 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.165 -3.672 8.997 1.00 0.00 H new ATOM 483 N THR A 34 3.570 -4.115 11.854 1.00 0.00 N ATOM 484 CA THR A 34 4.507 -4.306 12.949 1.00 0.00 C ATOM 485 C THR A 34 5.905 -4.612 12.407 1.00 0.00 C ATOM 486 O THR A 34 6.901 -4.127 12.942 1.00 0.00 O ATOM 487 CB THR A 34 3.954 -5.405 13.859 1.00 0.00 C ATOM 488 OG1 THR A 34 5.093 -5.861 14.584 1.00 0.00 O ATOM 489 CG2 THR A 34 3.493 -6.637 13.076 1.00 0.00 C ATOM 0 H THR A 34 2.711 -4.661 11.928 1.00 0.00 H new ATOM 0 HA THR A 34 4.614 -3.397 13.541 1.00 0.00 H new ATOM 0 HB THR A 34 3.120 -5.010 14.439 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.825 -6.574 15.200 1.00 0.00 H new ATOM 0 HG21 THR A 34 3.110 -7.386 13.769 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.706 -6.351 12.379 1.00 0.00 H new ATOM 0 HG23 THR A 34 4.335 -7.052 12.522 1.00 0.00 H new ATOM 497 N GLN A 35 5.934 -5.414 11.353 1.00 0.00 N ATOM 498 CA GLN A 35 7.193 -5.789 10.733 1.00 0.00 C ATOM 499 C GLN A 35 7.866 -4.563 10.112 1.00 0.00 C ATOM 500 O GLN A 35 9.051 -4.321 10.337 1.00 0.00 O ATOM 501 CB GLN A 35 6.983 -6.888 9.688 1.00 0.00 C ATOM 502 CG GLN A 35 6.663 -8.226 10.357 1.00 0.00 C ATOM 503 CD GLN A 35 5.741 -9.072 9.476 1.00 0.00 C ATOM 504 OE1 GLN A 35 6.148 -10.045 8.862 1.00 0.00 O ATOM 505 NE2 GLN A 35 4.481 -8.648 9.449 1.00 0.00 N ATOM 0 H GLN A 35 5.106 -5.815 10.913 1.00 0.00 H new ATOM 0 HA GLN A 35 7.851 -6.188 11.505 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.169 -6.608 9.019 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.879 -6.989 9.076 1.00 0.00 H new ATOM 0 HG2 GLN A 35 7.587 -8.770 10.551 1.00 0.00 H new ATOM 0 HG3 GLN A 35 6.189 -8.050 11.322 1.00 0.00 H new ATOM 0 HE21 GLN A 35 4.208 -7.826 9.987 1.00 0.00 H new ATOM 0 HE22 GLN A 35 3.788 -9.145 8.890 1.00 0.00 H new ATOM 512 N SER A 36 7.080 -3.823 9.343 1.00 0.00 N ATOM 513 CA SER A 36 7.586 -2.629 8.688 1.00 0.00 C ATOM 514 C SER A 36 7.706 -1.488 9.701 1.00 0.00 C ATOM 515 O SER A 36 8.496 -0.564 9.510 1.00 0.00 O ATOM 516 CB SER A 36 6.682 -2.213 7.526 1.00 0.00 C ATOM 517 OG SER A 36 7.430 -1.880 6.360 1.00 0.00 O ATOM 0 H SER A 36 6.098 -4.027 9.159 1.00 0.00 H new ATOM 0 HA SER A 36 8.573 -2.853 8.283 1.00 0.00 H new ATOM 0 HB2 SER A 36 5.992 -3.025 7.295 1.00 0.00 H new ATOM 0 HB3 SER A 36 6.077 -1.357 7.826 1.00 0.00 H new ATOM 0 HG SER A 36 7.292 -2.568 5.676 1.00 0.00 H new ATOM 522 N LEU A 37 6.911 -1.590 10.756 1.00 0.00 N ATOM 523 CA LEU A 37 6.918 -0.578 11.799 1.00 0.00 C ATOM 524 C LEU A 37 8.359 -0.324 12.246 1.00 0.00 C ATOM 525 O LEU A 37 8.724 0.808 12.561 1.00 0.00 O ATOM 526 CB LEU A 37 5.982 -0.978 12.940 1.00 0.00 C ATOM 527 CG LEU A 37 4.788 -0.051 13.184 1.00 0.00 C ATOM 528 CD1 LEU A 37 4.165 0.402 11.862 1.00 0.00 C ATOM 529 CD2 LEU A 37 3.761 -0.711 14.106 1.00 0.00 C ATOM 0 H LEU A 37 6.258 -2.358 10.911 1.00 0.00 H new ATOM 0 HA LEU A 37 6.531 0.366 11.417 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.604 -1.980 12.739 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.565 -1.036 13.859 1.00 0.00 H new ATOM 0 HG LEU A 37 5.149 0.843 13.692 1.00 0.00 H new ATOM 0 HD11 LEU A 37 3.319 1.059 12.065 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.909 0.939 11.274 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.822 -0.469 11.304 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.923 -0.032 14.263 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.400 -1.632 13.648 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.227 -0.940 15.064 1.00 0.00 H new ATOM 540 N GLU A 38 9.138 -1.395 12.261 1.00 0.00 N ATOM 541 CA GLU A 38 10.530 -1.302 12.665 1.00 0.00 C ATOM 542 C GLU A 38 11.315 -2.510 12.147 1.00 0.00 C ATOM 543 O GLU A 38 11.671 -3.399 12.919 1.00 0.00 O ATOM 544 CB GLU A 38 10.654 -1.179 14.186 1.00 0.00 C ATOM 545 CG GLU A 38 10.028 0.126 14.683 1.00 0.00 C ATOM 546 CD GLU A 38 10.450 0.422 16.123 1.00 0.00 C ATOM 547 OE1 GLU A 38 9.669 0.194 17.057 1.00 0.00 O ATOM 548 OE2 GLU A 38 11.638 0.907 16.253 1.00 0.00 O ATOM 0 H GLU A 38 8.831 -2.332 12.000 1.00 0.00 H new ATOM 0 HA GLU A 38 10.956 -0.400 12.225 1.00 0.00 H new ATOM 0 HB2 GLU A 38 10.164 -2.027 14.664 1.00 0.00 H new ATOM 0 HB3 GLU A 38 11.705 -1.215 14.473 1.00 0.00 H new ATOM 0 HG2 GLU A 38 10.331 0.949 14.035 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.942 0.058 14.625 1.00 0.00 H new ATOM 554 N LYS A 39 11.561 -2.501 10.846 1.00 0.00 N ATOM 555 CA LYS A 39 12.295 -3.585 10.216 1.00 0.00 C ATOM 556 C LYS A 39 13.773 -3.486 10.603 1.00 0.00 C ATOM 557 O LYS A 39 14.417 -4.497 10.874 1.00 0.00 O ATOM 558 CB LYS A 39 12.056 -3.589 8.705 1.00 0.00 C ATOM 559 CG LYS A 39 13.107 -2.747 7.980 1.00 0.00 C ATOM 560 CD LYS A 39 12.573 -2.239 6.640 1.00 0.00 C ATOM 561 CE LYS A 39 11.430 -1.244 6.847 1.00 0.00 C ATOM 562 NZ LYS A 39 10.994 -0.677 5.551 1.00 0.00 N ATOM 0 H LYS A 39 11.265 -1.760 10.210 1.00 0.00 H new ATOM 0 HA LYS A 39 11.933 -4.548 10.575 1.00 0.00 H new ATOM 0 HB2 LYS A 39 12.085 -4.613 8.332 1.00 0.00 H new ATOM 0 HB3 LYS A 39 11.061 -3.199 8.490 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.395 -1.902 8.605 1.00 0.00 H new ATOM 0 HG3 LYS A 39 14.005 -3.342 7.816 1.00 0.00 H new ATOM 0 HD2 LYS A 39 13.378 -1.762 6.081 1.00 0.00 H new ATOM 0 HD3 LYS A 39 12.224 -3.080 6.041 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.591 -1.741 7.334 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.754 -0.442 7.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 10.241 0.021 5.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.801 -0.214 5.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 10.634 -1.439 4.942 1.00 0.00 H new ATOM 571 N ASP A 40 14.267 -2.256 10.616 1.00 0.00 N ATOM 572 CA ASP A 40 15.655 -2.011 10.966 1.00 0.00 C ATOM 573 C ASP A 40 16.135 -0.737 10.268 1.00 0.00 C ATOM 574 O ASP A 40 16.080 0.349 10.845 1.00 0.00 O ATOM 575 CB ASP A 40 16.550 -3.165 10.509 1.00 0.00 C ATOM 576 CG ASP A 40 16.837 -4.223 11.576 1.00 0.00 C ATOM 577 OD1 ASP A 40 17.170 -3.897 12.725 1.00 0.00 O ATOM 578 OD2 ASP A 40 16.703 -5.444 11.183 1.00 0.00 O ATOM 0 H ASP A 40 13.730 -1.419 10.390 1.00 0.00 H new ATOM 0 HA ASP A 40 15.717 -1.913 12.050 1.00 0.00 H new ATOM 0 HB2 ASP A 40 16.081 -3.651 9.653 1.00 0.00 H new ATOM 0 HB3 ASP A 40 17.498 -2.754 10.162 1.00 0.00 H new ATOM 583 N ASP A 41 16.595 -0.910 9.038 1.00 0.00 N ATOM 584 CA ASP A 41 17.084 0.212 8.255 1.00 0.00 C ATOM 585 C ASP A 41 15.894 1.006 7.712 1.00 0.00 C ATOM 586 O ASP A 41 14.904 1.207 8.414 1.00 0.00 O ATOM 587 CB ASP A 41 17.917 -0.267 7.066 1.00 0.00 C ATOM 588 CG ASP A 41 18.934 0.748 6.537 1.00 0.00 C ATOM 589 OD1 ASP A 41 18.803 1.959 6.764 1.00 0.00 O ATOM 590 OD2 ASP A 41 19.905 0.241 5.858 1.00 0.00 O ATOM 0 H ASP A 41 16.639 -1.812 8.564 1.00 0.00 H new ATOM 0 HA ASP A 41 17.705 0.830 8.903 1.00 0.00 H new ATOM 0 HB2 ASP A 41 18.448 -1.174 7.356 1.00 0.00 H new ATOM 0 HB3 ASP A 41 17.242 -0.539 6.255 1.00 0.00 H new ATOM 595 N ILE A 42 16.031 1.435 6.465 1.00 0.00 N ATOM 596 CA ILE A 42 14.979 2.203 5.819 1.00 0.00 C ATOM 597 C ILE A 42 14.738 1.646 4.414 1.00 0.00 C ATOM 598 O ILE A 42 15.305 2.142 3.442 1.00 0.00 O ATOM 599 CB ILE A 42 15.315 3.695 5.841 1.00 0.00 C ATOM 600 CG1 ILE A 42 14.762 4.363 7.103 1.00 0.00 C ATOM 601 CG2 ILE A 42 14.825 4.385 4.566 1.00 0.00 C ATOM 602 CD1 ILE A 42 13.324 3.918 7.374 1.00 0.00 C ATOM 0 H ILE A 42 16.853 1.266 5.886 1.00 0.00 H new ATOM 0 HA ILE A 42 14.042 2.104 6.367 1.00 0.00 H new ATOM 0 HB ILE A 42 16.399 3.801 5.869 1.00 0.00 H new ATOM 0 HG12 ILE A 42 15.391 4.112 7.957 1.00 0.00 H new ATOM 0 HG13 ILE A 42 14.796 5.447 6.990 1.00 0.00 H new ATOM 0 HG21 ILE A 42 15.076 5.445 4.606 1.00 0.00 H new ATOM 0 HG22 ILE A 42 15.305 3.931 3.699 1.00 0.00 H new ATOM 0 HG23 ILE A 42 13.744 4.271 4.483 1.00 0.00 H new ATOM 0 HD11 ILE A 42 12.956 4.407 8.276 1.00 0.00 H new ATOM 0 HD12 ILE A 42 12.693 4.192 6.529 1.00 0.00 H new ATOM 0 HD13 ILE A 42 13.297 2.837 7.511 1.00 0.00 H new ATOM 613 N ARG A 43 13.896 0.624 4.353 1.00 0.00 N ATOM 614 CA ARG A 43 13.574 -0.004 3.083 1.00 0.00 C ATOM 615 C ARG A 43 12.475 0.783 2.366 1.00 0.00 C ATOM 616 O ARG A 43 12.149 1.902 2.760 1.00 0.00 O ATOM 617 CB ARG A 43 13.109 -1.447 3.286 1.00 0.00 C ATOM 618 CG ARG A 43 14.272 -2.426 3.115 1.00 0.00 C ATOM 619 CD ARG A 43 15.581 -1.816 3.619 1.00 0.00 C ATOM 620 NE ARG A 43 16.412 -2.859 4.261 1.00 0.00 N ATOM 621 CZ ARG A 43 17.197 -3.724 3.584 1.00 0.00 C ATOM 622 NH1 ARG A 43 17.267 -3.676 2.237 1.00 0.00 N ATOM 623 NH2 ARG A 43 17.898 -4.617 4.260 1.00 0.00 N ATOM 0 H ARG A 43 13.428 0.216 5.162 1.00 0.00 H new ATOM 0 HA ARG A 43 14.479 -0.008 2.475 1.00 0.00 H new ATOM 0 HB2 ARG A 43 12.679 -1.558 4.281 1.00 0.00 H new ATOM 0 HB3 ARG A 43 12.322 -1.683 2.570 1.00 0.00 H new ATOM 0 HG2 ARG A 43 14.061 -3.345 3.661 1.00 0.00 H new ATOM 0 HG3 ARG A 43 14.373 -2.696 2.064 1.00 0.00 H new ATOM 0 HD2 ARG A 43 16.125 -1.366 2.789 1.00 0.00 H new ATOM 0 HD3 ARG A 43 15.370 -1.018 4.331 1.00 0.00 H new ATOM 0 HE ARG A 43 16.390 -2.929 5.278 1.00 0.00 H new ATOM 0 HH11 ARG A 43 16.724 -2.982 1.723 1.00 0.00 H new ATOM 0 HH12 ARG A 43 17.863 -4.333 1.734 1.00 0.00 H new ATOM 0 HH21 ARG A 43 17.841 -4.646 5.278 1.00 0.00 H new ATOM 0 HH22 ARG A 43 18.496 -5.278 3.764 1.00 0.00 H new ATOM 633 N HIS A 44 11.935 0.168 1.325 1.00 0.00 N ATOM 634 CA HIS A 44 10.880 0.796 0.549 1.00 0.00 C ATOM 635 C HIS A 44 9.692 -0.161 0.428 1.00 0.00 C ATOM 636 O HIS A 44 9.841 -1.368 0.607 1.00 0.00 O ATOM 637 CB HIS A 44 11.407 1.260 -0.811 1.00 0.00 C ATOM 638 CG HIS A 44 12.373 2.418 -0.731 1.00 0.00 C ATOM 639 ND1 HIS A 44 12.126 3.550 0.027 1.00 0.00 N ATOM 640 CD2 HIS A 44 13.588 2.608 -1.322 1.00 0.00 C ATOM 641 CE1 HIS A 44 13.153 4.376 -0.109 1.00 0.00 C ATOM 642 NE2 HIS A 44 14.057 3.791 -0.947 1.00 0.00 N ATOM 0 H HIS A 44 12.209 -0.760 1.000 1.00 0.00 H new ATOM 0 HA HIS A 44 10.531 1.691 1.063 1.00 0.00 H new ATOM 0 HB2 HIS A 44 11.900 0.422 -1.304 1.00 0.00 H new ATOM 0 HB3 HIS A 44 10.563 1.547 -1.438 1.00 0.00 H new ATOM 0 HD1 HIS A 44 11.295 3.719 0.594 1.00 0.00 H new ATOM 0 HD2 HIS A 44 14.084 1.913 -1.983 1.00 0.00 H new ATOM 0 HE1 HIS A 44 13.256 5.343 0.361 1.00 0.00 H new ATOM 649 N ILE A 45 8.537 0.415 0.126 1.00 0.00 N ATOM 650 CA ILE A 45 7.324 -0.371 -0.021 1.00 0.00 C ATOM 651 C ILE A 45 6.966 -0.477 -1.505 1.00 0.00 C ATOM 652 O ILE A 45 7.444 0.311 -2.320 1.00 0.00 O ATOM 653 CB ILE A 45 6.202 0.209 0.842 1.00 0.00 C ATOM 654 CG1 ILE A 45 5.945 1.677 0.493 1.00 0.00 C ATOM 655 CG2 ILE A 45 6.500 0.017 2.331 1.00 0.00 C ATOM 656 CD1 ILE A 45 6.374 1.982 -0.944 1.00 0.00 C ATOM 0 H ILE A 45 8.416 1.417 -0.021 1.00 0.00 H new ATOM 0 HA ILE A 45 7.482 -1.386 0.342 1.00 0.00 H new ATOM 0 HB ILE A 45 5.285 -0.339 0.624 1.00 0.00 H new ATOM 0 HG12 ILE A 45 4.886 1.904 0.616 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.491 2.320 1.184 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.687 0.438 2.922 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.594 -1.047 2.549 1.00 0.00 H new ATOM 0 HG23 ILE A 45 7.432 0.523 2.584 1.00 0.00 H new ATOM 0 HD11 ILE A 45 6.181 3.031 -1.166 1.00 0.00 H new ATOM 0 HD12 ILE A 45 7.439 1.777 -1.057 1.00 0.00 H new ATOM 0 HD13 ILE A 45 5.809 1.355 -1.633 1.00 0.00 H new ATOM 667 N VAL A 46 6.130 -1.459 -1.810 1.00 0.00 N ATOM 668 CA VAL A 46 5.703 -1.678 -3.181 1.00 0.00 C ATOM 669 C VAL A 46 4.389 -2.462 -3.183 1.00 0.00 C ATOM 670 O VAL A 46 4.393 -3.688 -3.267 1.00 0.00 O ATOM 671 CB VAL A 46 6.814 -2.374 -3.971 1.00 0.00 C ATOM 672 CG1 VAL A 46 6.232 -3.348 -4.996 1.00 0.00 C ATOM 673 CG2 VAL A 46 7.731 -1.351 -4.645 1.00 0.00 C ATOM 0 H VAL A 46 5.737 -2.111 -1.131 1.00 0.00 H new ATOM 0 HA VAL A 46 5.515 -0.726 -3.678 1.00 0.00 H new ATOM 0 HB VAL A 46 7.415 -2.950 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 46 7.043 -3.828 -5.543 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.641 -4.107 -4.482 1.00 0.00 H new ATOM 0 HG13 VAL A 46 5.596 -2.804 -5.694 1.00 0.00 H new ATOM 0 HG21 VAL A 46 8.512 -1.872 -5.200 1.00 0.00 H new ATOM 0 HG22 VAL A 46 7.148 -0.736 -5.330 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.188 -0.716 -3.886 1.00 0.00 H new ATOM 683 N LEU A 47 3.295 -1.720 -3.088 1.00 0.00 N ATOM 684 CA LEU A 47 1.976 -2.330 -3.076 1.00 0.00 C ATOM 685 C LEU A 47 1.505 -2.542 -4.517 1.00 0.00 C ATOM 686 O LEU A 47 1.945 -1.842 -5.427 1.00 0.00 O ATOM 687 CB LEU A 47 1.010 -1.499 -2.230 1.00 0.00 C ATOM 688 CG LEU A 47 1.550 -1.004 -0.887 1.00 0.00 C ATOM 689 CD1 LEU A 47 0.436 -0.376 -0.045 1.00 0.00 C ATOM 690 CD2 LEU A 47 2.270 -2.127 -0.137 1.00 0.00 C ATOM 0 H LEU A 47 3.295 -0.702 -3.019 1.00 0.00 H new ATOM 0 HA LEU A 47 2.014 -3.312 -2.604 1.00 0.00 H new ATOM 0 HB2 LEU A 47 0.698 -0.634 -2.815 1.00 0.00 H new ATOM 0 HB3 LEU A 47 0.117 -2.095 -2.042 1.00 0.00 H new ATOM 0 HG LEU A 47 2.286 -0.224 -1.082 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.847 -0.033 0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.007 0.470 -0.582 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -0.340 -1.118 0.143 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.644 -1.748 0.814 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.575 -2.946 0.047 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.105 -2.488 -0.737 1.00 0.00 H new ATOM 701 N ASN A 48 0.617 -3.511 -4.679 1.00 0.00 N ATOM 702 CA ASN A 48 0.081 -3.825 -5.991 1.00 0.00 C ATOM 703 C ASN A 48 -0.962 -4.936 -5.861 1.00 0.00 C ATOM 704 O ASN A 48 -0.618 -6.090 -5.612 1.00 0.00 O ATOM 705 CB ASN A 48 1.183 -4.320 -6.932 1.00 0.00 C ATOM 706 CG ASN A 48 2.262 -5.080 -6.159 1.00 0.00 C ATOM 707 OD1 ASN A 48 2.058 -5.543 -5.049 1.00 0.00 O ATOM 708 ND2 ASN A 48 3.419 -5.183 -6.806 1.00 0.00 N ATOM 0 H ASN A 48 0.255 -4.090 -3.921 1.00 0.00 H new ATOM 0 HA ASN A 48 -0.362 -2.917 -6.399 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.751 -4.969 -7.694 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.631 -3.473 -7.451 1.00 0.00 H new ATOM 0 HD21 ASN A 48 4.203 -5.673 -6.375 1.00 0.00 H new ATOM 0 HD22 ASN A 48 3.523 -4.772 -7.734 1.00 0.00 H new ATOM 714 N LEU A 49 -2.217 -4.549 -6.034 1.00 0.00 N ATOM 715 CA LEU A 49 -3.314 -5.497 -5.938 1.00 0.00 C ATOM 716 C LEU A 49 -3.943 -5.683 -7.320 1.00 0.00 C ATOM 717 O LEU A 49 -4.312 -4.710 -7.975 1.00 0.00 O ATOM 718 CB LEU A 49 -4.309 -5.058 -4.862 1.00 0.00 C ATOM 719 CG LEU A 49 -5.721 -4.728 -5.351 1.00 0.00 C ATOM 720 CD1 LEU A 49 -6.770 -5.539 -4.586 1.00 0.00 C ATOM 721 CD2 LEU A 49 -5.990 -3.223 -5.272 1.00 0.00 C ATOM 0 H LEU A 49 -2.499 -3.591 -6.240 1.00 0.00 H new ATOM 0 HA LEU A 49 -2.948 -6.473 -5.620 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -4.380 -5.849 -4.116 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -3.905 -4.180 -4.358 1.00 0.00 H new ATOM 0 HG LEU A 49 -5.795 -5.014 -6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -7.765 -5.285 -4.953 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -6.588 -6.603 -4.737 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -6.705 -5.307 -3.523 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -7.000 -3.015 -5.625 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -5.891 -2.889 -4.239 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -5.271 -2.692 -5.896 1.00 0.00 H new ATOM 732 N GLU A 50 -4.048 -6.941 -7.723 1.00 0.00 N ATOM 733 CA GLU A 50 -4.627 -7.268 -9.015 1.00 0.00 C ATOM 734 C GLU A 50 -6.055 -7.790 -8.840 1.00 0.00 C ATOM 735 O GLU A 50 -6.855 -7.743 -9.773 1.00 0.00 O ATOM 736 CB GLU A 50 -3.761 -8.282 -9.764 1.00 0.00 C ATOM 737 CG GLU A 50 -3.364 -7.751 -11.143 1.00 0.00 C ATOM 738 CD GLU A 50 -4.459 -8.032 -12.174 1.00 0.00 C ATOM 739 OE1 GLU A 50 -5.345 -7.190 -12.383 1.00 0.00 O ATOM 740 OE2 GLU A 50 -4.367 -9.172 -12.770 1.00 0.00 O ATOM 0 H GLU A 50 -3.742 -7.746 -7.177 1.00 0.00 H new ATOM 0 HA GLU A 50 -4.664 -6.359 -9.615 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -2.865 -8.500 -9.183 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.306 -9.220 -9.874 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -3.181 -6.678 -11.085 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -2.431 -8.217 -11.461 1.00 0.00 H new ATOM 746 N ASP A 51 -6.331 -8.276 -7.639 1.00 0.00 N ATOM 747 CA ASP A 51 -7.648 -8.806 -7.329 1.00 0.00 C ATOM 748 C ASP A 51 -8.407 -7.800 -6.461 1.00 0.00 C ATOM 749 O ASP A 51 -8.670 -8.061 -5.289 1.00 0.00 O ATOM 750 CB ASP A 51 -7.544 -10.119 -6.551 1.00 0.00 C ATOM 751 CG ASP A 51 -8.879 -10.700 -6.082 1.00 0.00 C ATOM 752 OD1 ASP A 51 -9.895 -9.993 -6.017 1.00 0.00 O ATOM 753 OD2 ASP A 51 -8.849 -11.952 -5.770 1.00 0.00 O ATOM 0 H ASP A 51 -5.664 -8.314 -6.868 1.00 0.00 H new ATOM 0 HA ASP A 51 -8.169 -8.985 -8.269 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -7.044 -10.857 -7.178 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -6.909 -9.958 -5.680 1.00 0.00 H new ATOM 758 N LEU A 52 -8.737 -6.672 -7.072 1.00 0.00 N ATOM 759 CA LEU A 52 -9.461 -5.626 -6.369 1.00 0.00 C ATOM 760 C LEU A 52 -10.957 -5.755 -6.671 1.00 0.00 C ATOM 761 O LEU A 52 -11.359 -5.778 -7.833 1.00 0.00 O ATOM 762 CB LEU A 52 -8.883 -4.252 -6.710 1.00 0.00 C ATOM 763 CG LEU A 52 -9.671 -3.045 -6.196 1.00 0.00 C ATOM 764 CD1 LEU A 52 -11.105 -3.059 -6.729 1.00 0.00 C ATOM 765 CD2 LEU A 52 -9.627 -2.973 -4.668 1.00 0.00 C ATOM 0 H LEU A 52 -8.517 -6.459 -8.045 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.341 -5.739 -5.292 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -7.871 -4.197 -6.310 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.802 -4.173 -7.794 1.00 0.00 H new ATOM 0 HG LEU A 52 -9.196 -2.140 -6.575 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -11.643 -2.191 -6.349 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -11.089 -3.027 -7.818 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.607 -3.969 -6.400 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -10.194 -2.107 -4.328 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.063 -3.880 -4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -8.592 -2.881 -4.338 1.00 0.00 H new ATOM 776 N SER A 53 -11.737 -5.837 -5.605 1.00 0.00 N ATOM 777 CA SER A 53 -13.179 -5.963 -5.741 1.00 0.00 C ATOM 778 C SER A 53 -13.882 -5.104 -4.688 1.00 0.00 C ATOM 779 O SER A 53 -14.240 -3.958 -4.955 1.00 0.00 O ATOM 780 CB SER A 53 -13.618 -7.423 -5.613 1.00 0.00 C ATOM 781 OG SER A 53 -15.009 -7.539 -5.321 1.00 0.00 O ATOM 0 H SER A 53 -11.399 -5.819 -4.643 1.00 0.00 H new ATOM 0 HA SER A 53 -13.461 -5.612 -6.734 1.00 0.00 H new ATOM 0 HB2 SER A 53 -13.397 -7.951 -6.541 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.041 -7.907 -4.826 1.00 0.00 H new ATOM 0 HG SER A 53 -15.250 -8.486 -5.249 1.00 0.00 H new ATOM 786 N PHE A 54 -14.058 -5.691 -3.513 1.00 0.00 N ATOM 787 CA PHE A 54 -14.711 -4.992 -2.419 1.00 0.00 C ATOM 788 C PHE A 54 -14.026 -3.654 -2.136 1.00 0.00 C ATOM 789 O PHE A 54 -14.590 -2.594 -2.403 1.00 0.00 O ATOM 790 CB PHE A 54 -14.590 -5.885 -1.182 1.00 0.00 C ATOM 791 CG PHE A 54 -15.072 -5.226 0.111 1.00 0.00 C ATOM 792 CD1 PHE A 54 -16.400 -5.195 0.405 1.00 0.00 C ATOM 793 CD2 PHE A 54 -14.173 -4.672 0.968 1.00 0.00 C ATOM 794 CE1 PHE A 54 -16.847 -4.583 1.606 1.00 0.00 C ATOM 795 CE2 PHE A 54 -14.620 -4.059 2.169 1.00 0.00 C ATOM 796 CZ PHE A 54 -15.948 -4.028 2.462 1.00 0.00 C ATOM 0 H PHE A 54 -13.760 -6.642 -3.295 1.00 0.00 H new ATOM 0 HA PHE A 54 -15.751 -4.790 -2.675 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -15.163 -6.797 -1.348 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -13.548 -6.180 -1.060 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -17.114 -5.636 -0.275 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -13.119 -4.698 0.735 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -17.901 -4.558 1.840 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.906 -3.618 2.849 1.00 0.00 H new ATOM 0 HZ PHE A 54 -16.289 -3.562 3.375 1.00 0.00 H new ATOM 805 N MET A 55 -12.818 -3.746 -1.597 1.00 0.00 N ATOM 806 CA MET A 55 -12.050 -2.556 -1.274 1.00 0.00 C ATOM 807 C MET A 55 -12.963 -1.428 -0.791 1.00 0.00 C ATOM 808 O MET A 55 -13.468 -0.645 -1.593 1.00 0.00 O ATOM 809 CB MET A 55 -11.281 -2.093 -2.514 1.00 0.00 C ATOM 810 CG MET A 55 -11.283 -0.566 -2.622 1.00 0.00 C ATOM 811 SD MET A 55 -12.661 -0.028 -3.619 1.00 0.00 S ATOM 812 CE MET A 55 -12.938 -1.501 -4.588 1.00 0.00 C ATOM 0 H MET A 55 -12.353 -4.627 -1.376 1.00 0.00 H new ATOM 0 HA MET A 55 -11.353 -2.803 -0.473 1.00 0.00 H new ATOM 0 HB2 MET A 55 -10.254 -2.456 -2.466 1.00 0.00 H new ATOM 0 HB3 MET A 55 -11.731 -2.525 -3.408 1.00 0.00 H new ATOM 0 HG2 MET A 55 -11.347 -0.123 -1.628 1.00 0.00 H new ATOM 0 HG3 MET A 55 -10.348 -0.223 -3.064 1.00 0.00 H new ATOM 0 HE1 MET A 55 -13.342 -1.225 -5.562 1.00 0.00 H new ATOM 0 HE2 MET A 55 -11.995 -2.030 -4.723 1.00 0.00 H new ATOM 0 HE3 MET A 55 -13.647 -2.148 -4.072 1.00 0.00 H new ATOM 820 N ASP A 56 -13.148 -1.381 0.521 1.00 0.00 N ATOM 821 CA ASP A 56 -13.991 -0.362 1.122 1.00 0.00 C ATOM 822 C ASP A 56 -13.126 0.585 1.955 1.00 0.00 C ATOM 823 O ASP A 56 -11.948 0.781 1.656 1.00 0.00 O ATOM 824 CB ASP A 56 -15.035 -0.987 2.049 1.00 0.00 C ATOM 825 CG ASP A 56 -16.331 -0.188 2.198 1.00 0.00 C ATOM 826 OD1 ASP A 56 -16.889 0.313 1.211 1.00 0.00 O ATOM 827 OD2 ASP A 56 -16.774 -0.087 3.406 1.00 0.00 O ATOM 0 H ASP A 56 -12.728 -2.033 1.184 1.00 0.00 H new ATOM 0 HA ASP A 56 -14.496 0.173 0.318 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -15.280 -1.982 1.676 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -14.591 -1.117 3.036 1.00 0.00 H new ATOM 832 N SER A 57 -13.742 1.148 2.984 1.00 0.00 N ATOM 833 CA SER A 57 -13.043 2.069 3.863 1.00 0.00 C ATOM 834 C SER A 57 -12.521 1.325 5.093 1.00 0.00 C ATOM 835 O SER A 57 -12.389 1.910 6.168 1.00 0.00 O ATOM 836 CB SER A 57 -13.952 3.225 4.287 1.00 0.00 C ATOM 837 OG SER A 57 -13.260 4.186 5.079 1.00 0.00 O ATOM 0 H SER A 57 -14.719 0.984 3.229 1.00 0.00 H new ATOM 0 HA SER A 57 -12.199 2.489 3.316 1.00 0.00 H new ATOM 0 HB2 SER A 57 -14.358 3.711 3.400 1.00 0.00 H new ATOM 0 HB3 SER A 57 -14.798 2.833 4.851 1.00 0.00 H new ATOM 0 HG SER A 57 -12.758 3.728 5.785 1.00 0.00 H new ATOM 842 N SER A 58 -12.238 0.046 4.897 1.00 0.00 N ATOM 843 CA SER A 58 -11.734 -0.784 5.977 1.00 0.00 C ATOM 844 C SER A 58 -10.209 -0.683 6.047 1.00 0.00 C ATOM 845 O SER A 58 -9.656 -0.310 7.080 1.00 0.00 O ATOM 846 CB SER A 58 -12.162 -2.242 5.797 1.00 0.00 C ATOM 847 OG SER A 58 -13.222 -2.375 4.855 1.00 0.00 O ATOM 0 H SER A 58 -12.348 -0.436 4.005 1.00 0.00 H new ATOM 0 HA SER A 58 -12.159 -0.422 6.913 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.307 -2.832 5.467 1.00 0.00 H new ATOM 0 HB3 SER A 58 -12.478 -2.648 6.758 1.00 0.00 H new ATOM 0 HG SER A 58 -13.676 -3.233 4.992 1.00 0.00 H new ATOM 852 N GLY A 59 -9.574 -1.022 4.935 1.00 0.00 N ATOM 853 CA GLY A 59 -8.124 -0.974 4.858 1.00 0.00 C ATOM 854 C GLY A 59 -7.639 0.440 4.535 1.00 0.00 C ATOM 855 O GLY A 59 -6.463 0.756 4.720 1.00 0.00 O ATOM 0 H GLY A 59 -10.037 -1.331 4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -7.695 -1.302 5.805 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -7.774 -1.666 4.092 1.00 0.00 H new ATOM 859 N LEU A 60 -8.567 1.257 4.060 1.00 0.00 N ATOM 860 CA LEU A 60 -8.250 2.631 3.711 1.00 0.00 C ATOM 861 C LEU A 60 -7.527 3.297 4.883 1.00 0.00 C ATOM 862 O LEU A 60 -6.526 3.984 4.691 1.00 0.00 O ATOM 863 CB LEU A 60 -9.509 3.375 3.261 1.00 0.00 C ATOM 864 CG LEU A 60 -9.393 4.160 1.952 1.00 0.00 C ATOM 865 CD1 LEU A 60 -8.748 5.527 2.188 1.00 0.00 C ATOM 866 CD2 LEU A 60 -8.647 3.349 0.891 1.00 0.00 C ATOM 0 H LEU A 60 -9.541 0.993 3.908 1.00 0.00 H new ATOM 0 HA LEU A 60 -7.570 2.660 2.859 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.317 2.651 3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -9.800 4.066 4.052 1.00 0.00 H new ATOM 0 HG LEU A 60 -10.398 4.340 1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -8.677 6.064 1.242 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -9.357 6.101 2.887 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -7.750 5.391 2.604 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -8.578 3.929 -0.029 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -7.644 3.117 1.249 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -9.186 2.422 0.696 1.00 0.00 H new ATOM 877 N GLY A 61 -8.065 3.070 6.074 1.00 0.00 N ATOM 878 CA GLY A 61 -7.485 3.639 7.278 1.00 0.00 C ATOM 879 C GLY A 61 -6.262 2.838 7.729 1.00 0.00 C ATOM 880 O GLY A 61 -5.300 3.404 8.247 1.00 0.00 O ATOM 0 H GLY A 61 -8.896 2.500 6.230 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -7.198 4.674 7.094 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -8.230 3.651 8.074 1.00 0.00 H new ATOM 884 N VAL A 62 -6.337 1.533 7.515 1.00 0.00 N ATOM 885 CA VAL A 62 -5.248 0.647 7.893 1.00 0.00 C ATOM 886 C VAL A 62 -4.016 0.973 7.046 1.00 0.00 C ATOM 887 O VAL A 62 -2.893 0.653 7.431 1.00 0.00 O ATOM 888 CB VAL A 62 -5.692 -0.811 7.768 1.00 0.00 C ATOM 889 CG1 VAL A 62 -5.000 -1.495 6.587 1.00 0.00 C ATOM 890 CG2 VAL A 62 -5.438 -1.575 9.069 1.00 0.00 C ATOM 0 H VAL A 62 -7.136 1.067 7.084 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.975 0.800 8.937 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.765 -0.819 7.579 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.333 -2.531 6.520 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.253 -0.972 5.665 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.920 -1.470 6.734 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -5.763 -2.609 8.953 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.373 -1.553 9.302 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.997 -1.108 9.880 1.00 0.00 H new ATOM 900 N ILE A 63 -4.268 1.605 5.909 1.00 0.00 N ATOM 901 CA ILE A 63 -3.193 1.976 5.006 1.00 0.00 C ATOM 902 C ILE A 63 -2.831 3.446 5.228 1.00 0.00 C ATOM 903 O ILE A 63 -1.658 3.815 5.178 1.00 0.00 O ATOM 904 CB ILE A 63 -3.571 1.648 3.560 1.00 0.00 C ATOM 905 CG1 ILE A 63 -3.363 0.161 3.262 1.00 0.00 C ATOM 906 CG2 ILE A 63 -2.810 2.541 2.577 1.00 0.00 C ATOM 907 CD1 ILE A 63 -4.599 -0.443 2.596 1.00 0.00 C ATOM 0 H ILE A 63 -5.201 1.869 5.593 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.298 1.391 5.218 1.00 0.00 H new ATOM 0 HB ILE A 63 -4.633 1.857 3.430 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -2.497 0.034 2.612 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.147 -0.372 4.188 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.098 2.287 1.557 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.052 3.586 2.772 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.738 2.387 2.701 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.424 -1.500 2.395 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.458 -0.337 3.259 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.798 0.076 1.658 1.00 0.00 H new ATOM 918 N LEU A 64 -3.859 4.246 5.468 1.00 0.00 N ATOM 919 CA LEU A 64 -3.664 5.668 5.699 1.00 0.00 C ATOM 920 C LEU A 64 -2.837 5.865 6.971 1.00 0.00 C ATOM 921 O LEU A 64 -1.848 6.597 6.965 1.00 0.00 O ATOM 922 CB LEU A 64 -5.008 6.396 5.720 1.00 0.00 C ATOM 923 CG LEU A 64 -4.957 7.908 5.486 1.00 0.00 C ATOM 924 CD1 LEU A 64 -5.765 8.298 4.246 1.00 0.00 C ATOM 925 CD2 LEU A 64 -5.411 8.671 6.731 1.00 0.00 C ATOM 0 H LEU A 64 -4.830 3.937 5.508 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.100 6.113 4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -5.651 5.952 4.960 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.482 6.214 6.684 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.921 8.190 5.297 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.713 9.377 4.102 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -5.354 7.795 3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.805 8.000 4.381 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.365 9.743 6.538 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.435 8.390 6.977 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.757 8.425 7.567 1.00 0.00 H new ATOM 936 N GLY A 65 -3.273 5.200 8.030 1.00 0.00 N ATOM 937 CA GLY A 65 -2.585 5.292 9.307 1.00 0.00 C ATOM 938 C GLY A 65 -1.188 4.676 9.224 1.00 0.00 C ATOM 939 O GLY A 65 -0.298 5.041 9.990 1.00 0.00 O ATOM 0 H GLY A 65 -4.094 4.595 8.031 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -2.508 6.337 9.608 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.166 4.781 10.075 1.00 0.00 H new ATOM 943 N ARG A 66 -1.039 3.752 8.287 1.00 0.00 N ATOM 944 CA ARG A 66 0.235 3.080 8.092 1.00 0.00 C ATOM 945 C ARG A 66 1.146 3.919 7.195 1.00 0.00 C ATOM 946 O ARG A 66 2.337 4.058 7.469 1.00 0.00 O ATOM 947 CB ARG A 66 0.041 1.699 7.462 1.00 0.00 C ATOM 948 CG ARG A 66 0.175 0.593 8.511 1.00 0.00 C ATOM 949 CD ARG A 66 -0.827 0.793 9.649 1.00 0.00 C ATOM 950 NE ARG A 66 -0.192 1.540 10.758 1.00 0.00 N ATOM 951 CZ ARG A 66 -0.862 2.027 11.824 1.00 0.00 C ATOM 952 NH1 ARG A 66 -2.196 1.852 11.933 1.00 0.00 N ATOM 953 NH2 ARG A 66 -0.194 2.680 12.757 1.00 0.00 N ATOM 0 H ARG A 66 -1.780 3.452 7.654 1.00 0.00 H new ATOM 0 HA ARG A 66 0.697 2.957 9.072 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.942 1.644 6.994 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.778 1.548 6.674 1.00 0.00 H new ATOM 0 HG2 ARG A 66 0.011 -0.378 8.044 1.00 0.00 H new ATOM 0 HG3 ARG A 66 1.189 0.587 8.911 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -1.699 1.337 9.285 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -1.181 -0.174 10.007 1.00 0.00 H new ATOM 0 HE ARG A 66 0.815 1.697 10.714 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -2.705 1.349 11.207 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -2.695 2.223 12.742 1.00 0.00 H new ATOM 0 HH21 ARG A 66 0.814 2.810 12.666 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -0.685 3.054 13.569 1.00 0.00 H new ATOM 963 N TYR A 67 0.551 4.458 6.141 1.00 0.00 N ATOM 964 CA TYR A 67 1.294 5.281 5.201 1.00 0.00 C ATOM 965 C TYR A 67 2.288 6.185 5.931 1.00 0.00 C ATOM 966 O TYR A 67 3.441 6.307 5.520 1.00 0.00 O ATOM 967 CB TYR A 67 0.256 6.151 4.490 1.00 0.00 C ATOM 968 CG TYR A 67 0.569 6.414 3.016 1.00 0.00 C ATOM 969 CD1 TYR A 67 1.333 7.506 2.657 1.00 0.00 C ATOM 970 CD2 TYR A 67 0.087 5.559 2.046 1.00 0.00 C ATOM 971 CE1 TYR A 67 1.627 7.753 1.268 1.00 0.00 C ATOM 972 CE2 TYR A 67 0.380 5.807 0.658 1.00 0.00 C ATOM 973 CZ TYR A 67 1.137 6.891 0.338 1.00 0.00 C ATOM 974 OH TYR A 67 1.414 7.125 -0.974 1.00 0.00 O ATOM 0 H TYR A 67 -0.437 4.341 5.917 1.00 0.00 H new ATOM 0 HA TYR A 67 1.860 4.658 4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.719 5.669 4.563 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.179 7.106 5.010 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.710 8.175 3.416 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -0.510 4.704 2.328 1.00 0.00 H new ATOM 0 HE1 TYR A 67 2.223 8.604 0.973 1.00 0.00 H new ATOM 0 HE2 TYR A 67 0.007 5.147 -0.112 1.00 0.00 H new ATOM 0 HH TYR A 67 0.969 6.450 -1.528 1.00 0.00 H new ATOM 983 N LYS A 68 1.806 6.798 7.002 1.00 0.00 N ATOM 984 CA LYS A 68 2.638 7.689 7.794 1.00 0.00 C ATOM 985 C LYS A 68 3.680 6.865 8.554 1.00 0.00 C ATOM 986 O LYS A 68 4.840 7.263 8.651 1.00 0.00 O ATOM 987 CB LYS A 68 1.773 8.569 8.697 1.00 0.00 C ATOM 988 CG LYS A 68 0.387 8.788 8.084 1.00 0.00 C ATOM 989 CD LYS A 68 -0.665 7.928 8.788 1.00 0.00 C ATOM 990 CE LYS A 68 -0.665 8.184 10.296 1.00 0.00 C ATOM 991 NZ LYS A 68 -1.997 8.646 10.744 1.00 0.00 N ATOM 0 H LYS A 68 0.849 6.695 7.340 1.00 0.00 H new ATOM 0 HA LYS A 68 3.183 8.376 7.147 1.00 0.00 H new ATOM 0 HB2 LYS A 68 1.672 8.102 9.677 1.00 0.00 H new ATOM 0 HB3 LYS A 68 2.263 9.531 8.851 1.00 0.00 H new ATOM 0 HG2 LYS A 68 0.113 9.840 8.161 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.412 8.542 7.022 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -1.651 8.147 8.379 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -0.466 6.874 8.595 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -0.393 7.271 10.826 1.00 0.00 H new ATOM 0 HE3 LYS A 68 0.088 8.932 10.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -1.883 9.398 11.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -2.528 9.015 9.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.517 7.850 11.165 1.00 0.00 H new ATOM 1000 N GLN A 69 3.229 5.732 9.072 1.00 0.00 N ATOM 1001 CA GLN A 69 4.108 4.849 9.819 1.00 0.00 C ATOM 1002 C GLN A 69 5.080 4.142 8.873 1.00 0.00 C ATOM 1003 O GLN A 69 6.284 4.110 9.124 1.00 0.00 O ATOM 1004 CB GLN A 69 3.302 3.837 10.635 1.00 0.00 C ATOM 1005 CG GLN A 69 3.925 3.626 12.017 1.00 0.00 C ATOM 1006 CD GLN A 69 3.498 4.731 12.985 1.00 0.00 C ATOM 1007 OE1 GLN A 69 3.418 5.898 12.639 1.00 0.00 O ATOM 1008 NE2 GLN A 69 3.229 4.300 14.213 1.00 0.00 N ATOM 0 H GLN A 69 2.266 5.405 8.989 1.00 0.00 H new ATOM 0 HA GLN A 69 4.688 5.451 10.518 1.00 0.00 H new ATOM 0 HB2 GLN A 69 2.276 4.188 10.745 1.00 0.00 H new ATOM 0 HB3 GLN A 69 3.259 2.887 10.103 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.624 2.656 12.411 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.012 3.612 11.932 1.00 0.00 H new ATOM 0 HE21 GLN A 69 3.316 3.309 14.436 1.00 0.00 H new ATOM 0 HE22 GLN A 69 2.935 4.961 14.932 1.00 0.00 H new ATOM 1015 N ILE A 70 4.522 3.591 7.805 1.00 0.00 N ATOM 1016 CA ILE A 70 5.324 2.887 6.820 1.00 0.00 C ATOM 1017 C ILE A 70 6.329 3.857 6.199 1.00 0.00 C ATOM 1018 O ILE A 70 7.402 3.447 5.756 1.00 0.00 O ATOM 1019 CB ILE A 70 4.425 2.192 5.795 1.00 0.00 C ATOM 1020 CG1 ILE A 70 5.213 1.161 4.984 1.00 0.00 C ATOM 1021 CG2 ILE A 70 3.725 3.214 4.897 1.00 0.00 C ATOM 1022 CD1 ILE A 70 5.879 0.133 5.902 1.00 0.00 C ATOM 0 H ILE A 70 3.523 3.618 7.601 1.00 0.00 H new ATOM 0 HA ILE A 70 5.900 2.093 7.295 1.00 0.00 H new ATOM 0 HB ILE A 70 3.647 1.651 6.334 1.00 0.00 H new ATOM 0 HG12 ILE A 70 4.545 0.653 4.288 1.00 0.00 H new ATOM 0 HG13 ILE A 70 5.972 1.666 4.387 1.00 0.00 H new ATOM 0 HG21 ILE A 70 3.093 2.694 4.178 1.00 0.00 H new ATOM 0 HG22 ILE A 70 3.111 3.875 5.508 1.00 0.00 H new ATOM 0 HG23 ILE A 70 4.472 3.802 4.364 1.00 0.00 H new ATOM 0 HD11 ILE A 70 6.432 -0.588 5.300 1.00 0.00 H new ATOM 0 HD12 ILE A 70 6.564 0.641 6.581 1.00 0.00 H new ATOM 0 HD13 ILE A 70 5.115 -0.387 6.480 1.00 0.00 H new ATOM 1033 N LYS A 71 5.947 5.126 6.184 1.00 0.00 N ATOM 1034 CA LYS A 71 6.802 6.158 5.624 1.00 0.00 C ATOM 1035 C LYS A 71 7.940 6.458 6.600 1.00 0.00 C ATOM 1036 O LYS A 71 9.042 6.812 6.185 1.00 0.00 O ATOM 1037 CB LYS A 71 5.977 7.389 5.244 1.00 0.00 C ATOM 1038 CG LYS A 71 5.491 7.299 3.796 1.00 0.00 C ATOM 1039 CD LYS A 71 4.263 8.184 3.574 1.00 0.00 C ATOM 1040 CE LYS A 71 4.676 9.608 3.191 1.00 0.00 C ATOM 1041 NZ LYS A 71 4.012 10.595 4.071 1.00 0.00 N ATOM 0 H LYS A 71 5.057 5.462 6.551 1.00 0.00 H new ATOM 0 HA LYS A 71 7.260 5.811 4.698 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.121 7.478 5.913 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.579 8.289 5.374 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.290 7.604 3.121 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.247 6.265 3.554 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.640 7.758 2.787 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.659 8.208 4.481 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.758 9.712 3.269 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.411 9.803 2.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 4.303 11.555 3.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 2.980 10.506 3.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 4.285 10.419 5.059 1.00 0.00 H new ATOM 1050 N GLN A 72 7.634 6.303 7.880 1.00 0.00 N ATOM 1051 CA GLN A 72 8.618 6.553 8.920 1.00 0.00 C ATOM 1052 C GLN A 72 9.706 5.477 8.892 1.00 0.00 C ATOM 1053 O GLN A 72 10.856 5.744 9.235 1.00 0.00 O ATOM 1054 CB GLN A 72 7.954 6.624 10.298 1.00 0.00 C ATOM 1055 CG GLN A 72 8.892 6.099 11.386 1.00 0.00 C ATOM 1056 CD GLN A 72 8.770 6.931 12.664 1.00 0.00 C ATOM 1057 OE1 GLN A 72 7.707 7.407 13.026 1.00 0.00 O ATOM 1058 NE2 GLN A 72 9.914 7.079 13.324 1.00 0.00 N ATOM 0 H GLN A 72 6.719 6.008 8.220 1.00 0.00 H new ATOM 0 HA GLN A 72 9.084 7.519 8.726 1.00 0.00 H new ATOM 0 HB2 GLN A 72 7.676 7.654 10.519 1.00 0.00 H new ATOM 0 HB3 GLN A 72 7.034 6.040 10.293 1.00 0.00 H new ATOM 0 HG2 GLN A 72 8.656 5.057 11.602 1.00 0.00 H new ATOM 0 HG3 GLN A 72 9.921 6.125 11.028 1.00 0.00 H new ATOM 0 HE21 GLN A 72 10.769 6.653 12.965 1.00 0.00 H new ATOM 0 HE22 GLN A 72 9.937 7.618 14.190 1.00 0.00 H new ATOM 1065 N ILE A 73 9.303 4.285 8.478 1.00 0.00 N ATOM 1066 CA ILE A 73 10.229 3.168 8.399 1.00 0.00 C ATOM 1067 C ILE A 73 10.099 2.498 7.031 1.00 0.00 C ATOM 1068 O ILE A 73 10.270 1.286 6.910 1.00 0.00 O ATOM 1069 CB ILE A 73 10.017 2.212 9.575 1.00 0.00 C ATOM 1070 CG1 ILE A 73 9.422 2.947 10.778 1.00 0.00 C ATOM 1071 CG2 ILE A 73 11.315 1.485 9.932 1.00 0.00 C ATOM 1072 CD1 ILE A 73 7.893 2.925 10.732 1.00 0.00 C ATOM 0 H ILE A 73 8.348 4.068 8.194 1.00 0.00 H new ATOM 0 HA ILE A 73 11.257 3.519 8.485 1.00 0.00 H new ATOM 0 HB ILE A 73 9.296 1.453 9.272 1.00 0.00 H new ATOM 0 HG12 ILE A 73 9.768 2.482 11.701 1.00 0.00 H new ATOM 0 HG13 ILE A 73 9.774 3.978 10.789 1.00 0.00 H new ATOM 0 HG21 ILE A 73 11.136 0.812 10.771 1.00 0.00 H new ATOM 0 HG22 ILE A 73 11.658 0.910 9.072 1.00 0.00 H new ATOM 0 HG23 ILE A 73 12.076 2.214 10.208 1.00 0.00 H new ATOM 0 HD11 ILE A 73 7.495 3.454 11.598 1.00 0.00 H new ATOM 0 HD12 ILE A 73 7.549 3.413 9.820 1.00 0.00 H new ATOM 0 HD13 ILE A 73 7.543 1.893 10.745 1.00 0.00 H new ATOM 1083 N GLY A 74 9.795 3.316 6.033 1.00 0.00 N ATOM 1084 CA GLY A 74 9.639 2.817 4.678 1.00 0.00 C ATOM 1085 C GLY A 74 10.003 3.892 3.652 1.00 0.00 C ATOM 1086 O GLY A 74 9.719 3.743 2.464 1.00 0.00 O ATOM 0 H GLY A 74 9.653 4.321 6.137 1.00 0.00 H new ATOM 0 HA2 GLY A 74 10.273 1.942 4.534 1.00 0.00 H new ATOM 0 HA3 GLY A 74 8.610 2.494 4.522 1.00 0.00 H new ATOM 1090 N GLY A 75 10.626 4.951 4.148 1.00 0.00 N ATOM 1091 CA GLY A 75 11.032 6.051 3.290 1.00 0.00 C ATOM 1092 C GLY A 75 9.819 6.701 2.621 1.00 0.00 C ATOM 1093 O GLY A 75 9.516 7.865 2.873 1.00 0.00 O ATOM 0 H GLY A 75 10.860 5.071 5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 75 11.570 6.795 3.877 1.00 0.00 H new ATOM 0 HA3 GLY A 75 11.721 5.687 2.528 1.00 0.00 H new ATOM 1097 N GLU A 76 9.158 5.918 1.779 1.00 0.00 N ATOM 1098 CA GLU A 76 7.986 6.403 1.071 1.00 0.00 C ATOM 1099 C GLU A 76 7.004 5.256 0.824 1.00 0.00 C ATOM 1100 O GLU A 76 7.410 4.104 0.688 1.00 0.00 O ATOM 1101 CB GLU A 76 8.379 7.081 -0.242 1.00 0.00 C ATOM 1102 CG GLU A 76 9.861 7.463 -0.240 1.00 0.00 C ATOM 1103 CD GLU A 76 10.095 8.742 0.566 1.00 0.00 C ATOM 1104 OE1 GLU A 76 9.180 9.569 0.698 1.00 0.00 O ATOM 1105 OE2 GLU A 76 11.278 8.862 1.067 1.00 0.00 O ATOM 0 H GLU A 76 9.412 4.952 1.572 1.00 0.00 H new ATOM 0 HA GLU A 76 7.493 7.150 1.693 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.174 6.411 -1.077 1.00 0.00 H new ATOM 0 HB3 GLU A 76 7.770 7.973 -0.391 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.450 6.649 0.183 1.00 0.00 H new ATOM 0 HG3 GLU A 76 10.205 7.606 -1.264 1.00 0.00 H new ATOM 1111 N MET A 77 5.728 5.612 0.774 1.00 0.00 N ATOM 1112 CA MET A 77 4.684 4.627 0.546 1.00 0.00 C ATOM 1113 C MET A 77 4.157 4.709 -0.888 1.00 0.00 C ATOM 1114 O MET A 77 3.835 5.793 -1.373 1.00 0.00 O ATOM 1115 CB MET A 77 3.535 4.865 1.528 1.00 0.00 C ATOM 1116 CG MET A 77 2.996 3.540 2.071 1.00 0.00 C ATOM 1117 SD MET A 77 2.334 2.556 0.736 1.00 0.00 S ATOM 1118 CE MET A 77 2.829 0.929 1.275 1.00 0.00 C ATOM 0 H MET A 77 5.394 6.569 0.888 1.00 0.00 H new ATOM 0 HA MET A 77 5.106 3.634 0.701 1.00 0.00 H new ATOM 0 HB2 MET A 77 3.880 5.487 2.354 1.00 0.00 H new ATOM 0 HB3 MET A 77 2.734 5.411 1.031 1.00 0.00 H new ATOM 0 HG2 MET A 77 3.793 2.994 2.576 1.00 0.00 H new ATOM 0 HG3 MET A 77 2.220 3.730 2.813 1.00 0.00 H new ATOM 0 HE1 MET A 77 3.295 0.397 0.446 1.00 0.00 H new ATOM 0 HE2 MET A 77 3.541 1.018 2.095 1.00 0.00 H new ATOM 0 HE3 MET A 77 1.953 0.376 1.614 1.00 0.00 H new ATOM 1126 N VAL A 78 4.084 3.550 -1.525 1.00 0.00 N ATOM 1127 CA VAL A 78 3.602 3.477 -2.894 1.00 0.00 C ATOM 1128 C VAL A 78 2.381 2.557 -2.950 1.00 0.00 C ATOM 1129 O VAL A 78 2.192 1.715 -2.074 1.00 0.00 O ATOM 1130 CB VAL A 78 4.732 3.029 -3.823 1.00 0.00 C ATOM 1131 CG1 VAL A 78 4.236 1.982 -4.823 1.00 0.00 C ATOM 1132 CG2 VAL A 78 5.353 4.226 -4.546 1.00 0.00 C ATOM 0 H VAL A 78 4.351 2.653 -1.118 1.00 0.00 H new ATOM 0 HA VAL A 78 3.285 4.460 -3.241 1.00 0.00 H new ATOM 0 HB VAL A 78 5.507 2.568 -3.211 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.058 1.680 -5.472 1.00 0.00 H new ATOM 0 HG12 VAL A 78 3.861 1.112 -4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 78 3.434 2.407 -5.427 1.00 0.00 H new ATOM 0 HG21 VAL A 78 6.154 3.881 -5.200 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.590 4.728 -5.141 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.759 4.923 -3.813 1.00 0.00 H new ATOM 1142 N VAL A 79 1.584 2.749 -3.991 1.00 0.00 N ATOM 1143 CA VAL A 79 0.386 1.948 -4.174 1.00 0.00 C ATOM 1144 C VAL A 79 -0.098 2.084 -5.619 1.00 0.00 C ATOM 1145 O VAL A 79 -0.329 3.192 -6.098 1.00 0.00 O ATOM 1146 CB VAL A 79 -0.676 2.350 -3.148 1.00 0.00 C ATOM 1147 CG1 VAL A 79 -1.154 3.783 -3.389 1.00 0.00 C ATOM 1148 CG2 VAL A 79 -1.850 1.369 -3.160 1.00 0.00 C ATOM 0 H VAL A 79 1.745 3.448 -4.716 1.00 0.00 H new ATOM 0 HA VAL A 79 0.603 0.894 -4.001 1.00 0.00 H new ATOM 0 HB VAL A 79 -0.219 2.311 -2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.908 4.045 -2.647 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -0.310 4.467 -3.305 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.585 3.860 -4.387 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -2.590 1.678 -2.422 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -2.307 1.360 -4.150 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -1.491 0.369 -2.917 1.00 0.00 H new ATOM 1158 N CYS A 80 -0.236 0.940 -6.274 1.00 0.00 N ATOM 1159 CA CYS A 80 -0.688 0.917 -7.655 1.00 0.00 C ATOM 1160 C CYS A 80 -1.903 -0.008 -7.747 1.00 0.00 C ATOM 1161 O CYS A 80 -2.435 -0.444 -6.727 1.00 0.00 O ATOM 1162 CB CYS A 80 0.429 0.489 -8.609 1.00 0.00 C ATOM 1163 SG CYS A 80 1.320 -0.953 -7.921 1.00 0.00 S ATOM 0 H CYS A 80 -0.043 0.022 -5.874 1.00 0.00 H new ATOM 0 HA CYS A 80 -0.974 1.923 -7.964 1.00 0.00 H new ATOM 0 HB2 CYS A 80 0.010 0.237 -9.583 1.00 0.00 H new ATOM 0 HB3 CYS A 80 1.123 1.315 -8.764 1.00 0.00 H new ATOM 0 HG CYS A 80 1.381 -0.848 -6.627 1.00 0.00 H new ATOM 1168 N ALA A 81 -2.307 -0.280 -8.979 1.00 0.00 N ATOM 1169 CA ALA A 81 -3.449 -1.145 -9.218 1.00 0.00 C ATOM 1170 C ALA A 81 -4.735 -0.395 -8.865 1.00 0.00 C ATOM 1171 O ALA A 81 -5.694 -0.994 -8.379 1.00 0.00 O ATOM 1172 CB ALA A 81 -3.289 -2.437 -8.415 1.00 0.00 C ATOM 0 H ALA A 81 -1.864 0.084 -9.822 1.00 0.00 H new ATOM 0 HA ALA A 81 -3.507 -1.421 -10.271 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -4.146 -3.086 -8.595 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -2.377 -2.947 -8.724 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -3.230 -2.200 -7.353 1.00 0.00 H new ATOM 1178 N ILE A 82 -4.714 0.904 -9.122 1.00 0.00 N ATOM 1179 CA ILE A 82 -5.866 1.743 -8.837 1.00 0.00 C ATOM 1180 C ILE A 82 -7.070 1.236 -9.632 1.00 0.00 C ATOM 1181 O ILE A 82 -6.960 0.266 -10.381 1.00 0.00 O ATOM 1182 CB ILE A 82 -5.535 3.214 -9.094 1.00 0.00 C ATOM 1183 CG1 ILE A 82 -6.478 4.133 -8.316 1.00 0.00 C ATOM 1184 CG2 ILE A 82 -5.539 3.524 -10.592 1.00 0.00 C ATOM 1185 CD1 ILE A 82 -6.800 3.550 -6.938 1.00 0.00 C ATOM 0 H ILE A 82 -3.917 1.397 -9.525 1.00 0.00 H new ATOM 0 HA ILE A 82 -6.131 1.680 -7.782 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.526 3.405 -8.729 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -6.021 5.116 -8.201 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -7.400 4.274 -8.879 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.301 4.576 -10.746 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.794 2.906 -11.093 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.525 3.311 -11.005 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -7.472 4.223 -6.406 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -7.279 2.578 -7.057 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.878 3.433 -6.368 1.00 0.00 H new ATOM 1196 N SER A 83 -8.193 1.914 -9.443 1.00 0.00 N ATOM 1197 CA SER A 83 -9.416 1.544 -10.134 1.00 0.00 C ATOM 1198 C SER A 83 -10.400 2.716 -10.119 1.00 0.00 C ATOM 1199 O SER A 83 -10.292 3.611 -9.283 1.00 0.00 O ATOM 1200 CB SER A 83 -10.054 0.307 -9.499 1.00 0.00 C ATOM 1201 OG SER A 83 -11.137 0.648 -8.638 1.00 0.00 O ATOM 0 H SER A 83 -8.281 2.718 -8.821 1.00 0.00 H new ATOM 0 HA SER A 83 -9.166 1.301 -11.167 1.00 0.00 H new ATOM 0 HB2 SER A 83 -10.411 -0.360 -10.284 1.00 0.00 H new ATOM 0 HB3 SER A 83 -9.300 -0.240 -8.934 1.00 0.00 H new ATOM 0 HG SER A 83 -11.929 0.127 -8.886 1.00 0.00 H new ATOM 1206 N PRO A 84 -11.361 2.671 -11.080 1.00 0.00 N ATOM 1207 CA PRO A 84 -12.364 3.718 -11.185 1.00 0.00 C ATOM 1208 C PRO A 84 -13.413 3.585 -10.079 1.00 0.00 C ATOM 1209 O PRO A 84 -14.374 4.353 -10.036 1.00 0.00 O ATOM 1210 CB PRO A 84 -12.948 3.564 -12.580 1.00 0.00 C ATOM 1211 CG PRO A 84 -12.586 2.158 -13.031 1.00 0.00 C ATOM 1212 CD PRO A 84 -11.520 1.626 -12.087 1.00 0.00 C ATOM 0 HA PRO A 84 -11.947 4.716 -11.050 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -14.029 3.704 -12.568 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.537 4.310 -13.260 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -13.465 1.514 -13.016 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -12.217 2.169 -14.056 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -11.827 0.683 -11.634 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.584 1.437 -12.613 1.00 0.00 H new ATOM 1217 N ALA A 85 -13.193 2.607 -9.213 1.00 0.00 N ATOM 1218 CA ALA A 85 -14.107 2.365 -8.110 1.00 0.00 C ATOM 1219 C ALA A 85 -13.304 2.100 -6.836 1.00 0.00 C ATOM 1220 O ALA A 85 -13.780 1.422 -5.927 1.00 0.00 O ATOM 1221 CB ALA A 85 -15.039 1.204 -8.465 1.00 0.00 C ATOM 0 H ALA A 85 -12.395 1.973 -9.253 1.00 0.00 H new ATOM 0 HA ALA A 85 -14.731 3.240 -7.929 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -15.725 1.022 -7.638 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -15.608 1.455 -9.360 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -14.448 0.307 -8.651 1.00 0.00 H new ATOM 1227 N VAL A 86 -12.098 2.646 -6.810 1.00 0.00 N ATOM 1228 CA VAL A 86 -11.223 2.477 -5.663 1.00 0.00 C ATOM 1229 C VAL A 86 -10.607 3.827 -5.292 1.00 0.00 C ATOM 1230 O VAL A 86 -10.471 4.150 -4.112 1.00 0.00 O ATOM 1231 CB VAL A 86 -10.174 1.403 -5.958 1.00 0.00 C ATOM 1232 CG1 VAL A 86 -8.988 1.516 -4.997 1.00 0.00 C ATOM 1233 CG2 VAL A 86 -10.792 0.004 -5.905 1.00 0.00 C ATOM 0 H VAL A 86 -11.705 3.207 -7.566 1.00 0.00 H new ATOM 0 HA VAL A 86 -11.790 2.130 -4.799 1.00 0.00 H new ATOM 0 HB VAL A 86 -9.802 1.567 -6.969 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.257 0.741 -5.228 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -8.524 2.496 -5.105 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -9.337 1.391 -3.972 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -10.025 -0.741 -6.118 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -11.205 -0.174 -4.912 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -11.587 -0.071 -6.647 1.00 0.00 H new ATOM 1243 N LYS A 87 -10.251 4.582 -6.321 1.00 0.00 N ATOM 1244 CA LYS A 87 -9.652 5.891 -6.118 1.00 0.00 C ATOM 1245 C LYS A 87 -10.721 6.862 -5.612 1.00 0.00 C ATOM 1246 O LYS A 87 -10.405 7.973 -5.190 1.00 0.00 O ATOM 1247 CB LYS A 87 -8.948 6.361 -7.393 1.00 0.00 C ATOM 1248 CG LYS A 87 -9.957 6.607 -8.518 1.00 0.00 C ATOM 1249 CD LYS A 87 -9.249 7.051 -9.800 1.00 0.00 C ATOM 1250 CE LYS A 87 -10.258 7.307 -10.922 1.00 0.00 C ATOM 1251 NZ LYS A 87 -9.632 8.082 -12.015 1.00 0.00 N ATOM 0 H LYS A 87 -10.366 4.313 -7.298 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.877 5.842 -5.353 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.394 7.277 -7.190 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.221 5.612 -7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -10.525 5.696 -8.708 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.672 7.370 -8.210 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.675 7.958 -9.608 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -8.539 6.285 -10.112 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -10.630 6.358 -11.308 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.118 7.850 -10.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -10.330 8.247 -12.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.299 8.995 -11.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -8.826 7.550 -12.401 1.00 0.00 H new ATOM 1260 N ARG A 88 -11.965 6.407 -5.671 1.00 0.00 N ATOM 1261 CA ARG A 88 -13.081 7.222 -5.223 1.00 0.00 C ATOM 1262 C ARG A 88 -13.033 7.400 -3.704 1.00 0.00 C ATOM 1263 O ARG A 88 -13.549 8.384 -3.175 1.00 0.00 O ATOM 1264 CB ARG A 88 -14.418 6.587 -5.613 1.00 0.00 C ATOM 1265 CG ARG A 88 -14.855 5.552 -4.575 1.00 0.00 C ATOM 1266 CD ARG A 88 -14.031 4.269 -4.697 1.00 0.00 C ATOM 1267 NE ARG A 88 -14.893 3.089 -4.463 1.00 0.00 N ATOM 1268 CZ ARG A 88 -15.973 2.780 -5.212 1.00 0.00 C ATOM 1269 NH1 ARG A 88 -16.334 3.563 -6.250 1.00 0.00 N ATOM 1270 NH2 ARG A 88 -16.671 1.701 -4.912 1.00 0.00 N ATOM 0 H ARG A 88 -12.224 5.485 -6.022 1.00 0.00 H new ATOM 0 HA ARG A 88 -12.997 8.194 -5.709 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -15.180 7.361 -5.703 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -14.328 6.112 -6.590 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -14.742 5.967 -3.573 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -15.912 5.323 -4.708 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -13.580 4.209 -5.688 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -13.214 4.282 -3.975 1.00 0.00 H new ATOM 0 HE ARG A 88 -14.656 2.470 -3.687 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -15.789 4.396 -6.474 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -17.151 3.322 -6.811 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -16.392 1.115 -4.125 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -17.490 1.453 -5.467 1.00 0.00 H new ATOM 1280 N LEU A 89 -12.409 6.435 -3.046 1.00 0.00 N ATOM 1281 CA LEU A 89 -12.286 6.474 -1.599 1.00 0.00 C ATOM 1282 C LEU A 89 -11.359 7.623 -1.200 1.00 0.00 C ATOM 1283 O LEU A 89 -11.666 8.384 -0.284 1.00 0.00 O ATOM 1284 CB LEU A 89 -11.842 5.112 -1.063 1.00 0.00 C ATOM 1285 CG LEU A 89 -12.929 4.267 -0.394 1.00 0.00 C ATOM 1286 CD1 LEU A 89 -12.455 2.827 -0.187 1.00 0.00 C ATOM 1287 CD2 LEU A 89 -13.398 4.911 0.912 1.00 0.00 C ATOM 0 H LEU A 89 -11.983 5.621 -3.488 1.00 0.00 H new ATOM 0 HA LEU A 89 -13.255 6.672 -1.140 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -11.421 4.539 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -11.039 5.271 -0.343 1.00 0.00 H new ATOM 0 HG LEU A 89 -13.791 4.229 -1.061 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -13.246 2.249 0.290 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.211 2.382 -1.152 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -11.569 2.823 0.448 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -14.170 4.291 1.367 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -12.555 5.001 1.597 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -13.804 5.901 0.704 1.00 0.00 H new ATOM 1298 N PHE A 90 -10.242 7.714 -1.908 1.00 0.00 N ATOM 1299 CA PHE A 90 -9.269 8.758 -1.640 1.00 0.00 C ATOM 1300 C PHE A 90 -9.664 10.067 -2.327 1.00 0.00 C ATOM 1301 O PHE A 90 -9.190 11.137 -1.951 1.00 0.00 O ATOM 1302 CB PHE A 90 -7.931 8.280 -2.210 1.00 0.00 C ATOM 1303 CG PHE A 90 -7.533 6.872 -1.764 1.00 0.00 C ATOM 1304 CD1 PHE A 90 -7.199 6.638 -0.467 1.00 0.00 C ATOM 1305 CD2 PHE A 90 -7.512 5.853 -2.666 1.00 0.00 C ATOM 1306 CE1 PHE A 90 -6.829 5.331 -0.053 1.00 0.00 C ATOM 1307 CE2 PHE A 90 -7.141 4.547 -2.252 1.00 0.00 C ATOM 1308 CZ PHE A 90 -6.808 4.313 -0.954 1.00 0.00 C ATOM 0 H PHE A 90 -9.990 7.081 -2.667 1.00 0.00 H new ATOM 0 HA PHE A 90 -9.211 8.945 -0.568 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -7.982 8.305 -3.299 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -7.150 8.979 -1.911 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -7.215 7.447 0.249 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.778 6.038 -3.696 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -6.564 5.146 0.978 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.123 3.739 -2.968 1.00 0.00 H new ATOM 0 HZ PHE A 90 -6.527 3.319 -0.639 1.00 0.00 H new ATOM 1317 N ASP A 91 -10.529 9.937 -3.323 1.00 0.00 N ATOM 1318 CA ASP A 91 -10.993 11.096 -4.066 1.00 0.00 C ATOM 1319 C ASP A 91 -11.918 11.930 -3.177 1.00 0.00 C ATOM 1320 O ASP A 91 -11.915 13.158 -3.251 1.00 0.00 O ATOM 1321 CB ASP A 91 -11.784 10.675 -5.305 1.00 0.00 C ATOM 1322 CG ASP A 91 -11.281 11.263 -6.626 1.00 0.00 C ATOM 1323 OD1 ASP A 91 -10.591 12.293 -6.643 1.00 0.00 O ATOM 1324 OD2 ASP A 91 -11.630 10.610 -7.682 1.00 0.00 O ATOM 0 H ASP A 91 -10.920 9.047 -3.632 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.119 11.671 -4.373 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -11.764 9.588 -5.378 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.826 10.966 -5.169 1.00 0.00 H new ATOM 1329 N MET A 92 -12.685 11.230 -2.355 1.00 0.00 N ATOM 1330 CA MET A 92 -13.612 11.891 -1.451 1.00 0.00 C ATOM 1331 C MET A 92 -12.937 12.224 -0.119 1.00 0.00 C ATOM 1332 O MET A 92 -13.330 13.170 0.561 1.00 0.00 O ATOM 1333 CB MET A 92 -14.816 10.981 -1.200 1.00 0.00 C ATOM 1334 CG MET A 92 -15.911 11.220 -2.241 1.00 0.00 C ATOM 1335 SD MET A 92 -17.520 11.092 -1.478 1.00 0.00 S ATOM 1336 CE MET A 92 -18.491 12.036 -2.640 1.00 0.00 C ATOM 0 H MET A 92 -12.684 10.212 -2.295 1.00 0.00 H new ATOM 0 HA MET A 92 -13.939 12.822 -1.913 1.00 0.00 H new ATOM 0 HB2 MET A 92 -14.501 9.938 -1.232 1.00 0.00 H new ATOM 0 HB3 MET A 92 -15.213 11.164 -0.201 1.00 0.00 H new ATOM 0 HG2 MET A 92 -15.789 12.206 -2.688 1.00 0.00 H new ATOM 0 HG3 MET A 92 -15.823 10.491 -3.047 1.00 0.00 H new ATOM 0 HE1 MET A 92 -19.530 12.058 -2.313 1.00 0.00 H new ATOM 0 HE2 MET A 92 -18.106 13.054 -2.693 1.00 0.00 H new ATOM 0 HE3 MET A 92 -18.430 11.573 -3.625 1.00 0.00 H new ATOM 1344 N SER A 93 -11.931 11.428 0.212 1.00 0.00 N ATOM 1345 CA SER A 93 -11.198 11.626 1.452 1.00 0.00 C ATOM 1346 C SER A 93 -10.434 12.951 1.400 1.00 0.00 C ATOM 1347 O SER A 93 -10.200 13.577 2.433 1.00 0.00 O ATOM 1348 CB SER A 93 -10.233 10.468 1.712 1.00 0.00 C ATOM 1349 OG SER A 93 -10.474 9.845 2.970 1.00 0.00 O ATOM 0 H SER A 93 -11.606 10.645 -0.356 1.00 0.00 H new ATOM 0 HA SER A 93 -11.915 11.657 2.273 1.00 0.00 H new ATOM 0 HB2 SER A 93 -10.331 9.729 0.917 1.00 0.00 H new ATOM 0 HB3 SER A 93 -9.208 10.836 1.680 1.00 0.00 H new ATOM 0 HG SER A 93 -9.839 9.110 3.098 1.00 0.00 H new ATOM 1354 N GLY A 94 -10.066 13.340 0.188 1.00 0.00 N ATOM 1355 CA GLY A 94 -9.334 14.579 -0.011 1.00 0.00 C ATOM 1356 C GLY A 94 -7.951 14.510 0.642 1.00 0.00 C ATOM 1357 O GLY A 94 -7.341 15.540 0.924 1.00 0.00 O ATOM 0 H GLY A 94 -10.261 12.818 -0.667 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.227 14.775 -1.078 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -9.898 15.411 0.411 1.00 0.00 H new ATOM 1361 N LEU A 95 -7.497 13.284 0.863 1.00 0.00 N ATOM 1362 CA LEU A 95 -6.199 13.068 1.478 1.00 0.00 C ATOM 1363 C LEU A 95 -5.390 12.092 0.620 1.00 0.00 C ATOM 1364 O LEU A 95 -4.358 11.585 1.057 1.00 0.00 O ATOM 1365 CB LEU A 95 -6.361 12.619 2.931 1.00 0.00 C ATOM 1366 CG LEU A 95 -5.348 13.188 3.927 1.00 0.00 C ATOM 1367 CD1 LEU A 95 -4.911 12.123 4.934 1.00 0.00 C ATOM 1368 CD2 LEU A 95 -4.156 13.813 3.199 1.00 0.00 C ATOM 0 H LEU A 95 -8.005 12.431 0.627 1.00 0.00 H new ATOM 0 HA LEU A 95 -5.637 14.001 1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.362 12.892 3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.300 11.531 2.963 1.00 0.00 H new ATOM 0 HG LEU A 95 -5.834 13.984 4.492 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -4.191 12.554 5.630 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -5.780 11.766 5.486 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -4.450 11.289 4.405 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.451 14.210 3.929 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.662 13.054 2.592 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.505 14.621 2.556 1.00 0.00 H new ATOM 1379 N PHE A 96 -5.890 11.859 -0.585 1.00 0.00 N ATOM 1380 CA PHE A 96 -5.227 10.953 -1.507 1.00 0.00 C ATOM 1381 C PHE A 96 -3.712 11.162 -1.487 1.00 0.00 C ATOM 1382 O PHE A 96 -2.949 10.223 -1.709 1.00 0.00 O ATOM 1383 CB PHE A 96 -5.756 11.274 -2.906 1.00 0.00 C ATOM 1384 CG PHE A 96 -6.121 10.038 -3.732 1.00 0.00 C ATOM 1385 CD1 PHE A 96 -5.480 8.859 -3.511 1.00 0.00 C ATOM 1386 CD2 PHE A 96 -7.086 10.118 -4.686 1.00 0.00 C ATOM 1387 CE1 PHE A 96 -5.819 7.712 -4.278 1.00 0.00 C ATOM 1388 CE2 PHE A 96 -7.426 8.972 -5.453 1.00 0.00 C ATOM 1389 CZ PHE A 96 -6.783 7.793 -5.232 1.00 0.00 C ATOM 0 H PHE A 96 -6.746 12.282 -0.944 1.00 0.00 H new ATOM 0 HA PHE A 96 -5.428 9.920 -1.223 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -6.637 11.910 -2.813 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -5.003 11.849 -3.445 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -4.714 8.795 -2.753 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -7.595 11.054 -4.861 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -5.310 6.776 -4.103 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -8.193 9.036 -6.210 1.00 0.00 H new ATOM 0 HZ PHE A 96 -7.039 6.921 -5.815 1.00 0.00 H new ATOM 1398 N LYS A 97 -3.321 12.400 -1.222 1.00 0.00 N ATOM 1399 CA LYS A 97 -1.911 12.744 -1.170 1.00 0.00 C ATOM 1400 C LYS A 97 -1.233 11.940 -0.059 1.00 0.00 C ATOM 1401 O LYS A 97 -0.020 11.744 -0.081 1.00 0.00 O ATOM 1402 CB LYS A 97 -1.734 14.258 -1.029 1.00 0.00 C ATOM 1403 CG LYS A 97 -2.787 15.011 -1.844 1.00 0.00 C ATOM 1404 CD LYS A 97 -2.223 16.326 -2.385 1.00 0.00 C ATOM 1405 CE LYS A 97 -3.248 17.455 -2.261 1.00 0.00 C ATOM 1406 NZ LYS A 97 -3.216 18.320 -3.463 1.00 0.00 N ATOM 0 H LYS A 97 -3.957 13.177 -1.041 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.419 12.473 -2.104 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -1.811 14.541 0.021 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -0.737 14.544 -1.364 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -3.125 14.388 -2.672 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -3.658 15.214 -1.221 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -1.318 16.590 -1.838 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -1.939 16.201 -3.430 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -4.246 17.036 -2.134 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -3.037 18.050 -1.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.918 19.081 -3.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -2.268 18.735 -3.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -3.440 17.752 -4.305 1.00 0.00 H new ATOM 1415 N ILE A 98 -2.048 11.496 0.887 1.00 0.00 N ATOM 1416 CA ILE A 98 -1.543 10.717 2.005 1.00 0.00 C ATOM 1417 C ILE A 98 -1.452 9.245 1.596 1.00 0.00 C ATOM 1418 O ILE A 98 -0.908 8.426 2.333 1.00 0.00 O ATOM 1419 CB ILE A 98 -2.394 10.957 3.253 1.00 0.00 C ATOM 1420 CG1 ILE A 98 -1.522 11.375 4.439 1.00 0.00 C ATOM 1421 CG2 ILE A 98 -3.251 9.732 3.577 1.00 0.00 C ATOM 1422 CD1 ILE A 98 -1.551 10.315 5.542 1.00 0.00 C ATOM 0 H ILE A 98 -3.054 11.661 0.902 1.00 0.00 H new ATOM 0 HA ILE A 98 -0.535 11.038 2.268 1.00 0.00 H new ATOM 0 HB ILE A 98 -3.076 11.782 3.047 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -0.496 11.529 4.104 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -1.874 12.327 4.836 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -3.846 9.930 4.469 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -3.914 9.520 2.738 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -2.605 8.873 3.755 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.923 10.637 6.373 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -2.575 10.181 5.891 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.176 9.370 5.149 1.00 0.00 H new ATOM 1433 N ILE A 99 -1.994 8.957 0.421 1.00 0.00 N ATOM 1434 CA ILE A 99 -1.981 7.598 -0.094 1.00 0.00 C ATOM 1435 C ILE A 99 -1.122 7.545 -1.359 1.00 0.00 C ATOM 1436 O ILE A 99 -0.729 6.467 -1.802 1.00 0.00 O ATOM 1437 CB ILE A 99 -3.409 7.089 -0.300 1.00 0.00 C ATOM 1438 CG1 ILE A 99 -4.139 6.947 1.037 1.00 0.00 C ATOM 1439 CG2 ILE A 99 -3.418 5.786 -1.100 1.00 0.00 C ATOM 1440 CD1 ILE A 99 -3.497 5.857 1.898 1.00 0.00 C ATOM 0 H ILE A 99 -2.444 9.640 -0.188 1.00 0.00 H new ATOM 0 HA ILE A 99 -1.527 6.921 0.630 1.00 0.00 H new ATOM 0 HB ILE A 99 -3.953 7.829 -0.887 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -4.117 7.897 1.570 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.187 6.705 0.860 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -4.446 5.447 -1.232 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -2.964 5.955 -2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.851 5.026 -0.563 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -4.034 5.776 2.843 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -3.543 4.904 1.372 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -2.456 6.114 2.094 1.00 0.00 H new ATOM 1451 N ARG A 100 -0.854 8.723 -1.904 1.00 0.00 N ATOM 1452 CA ARG A 100 -0.049 8.825 -3.109 1.00 0.00 C ATOM 1453 C ARG A 100 -0.242 7.584 -3.983 1.00 0.00 C ATOM 1454 O ARG A 100 0.502 6.612 -3.858 1.00 0.00 O ATOM 1455 CB ARG A 100 1.435 8.975 -2.767 1.00 0.00 C ATOM 1456 CG ARG A 100 2.099 10.025 -3.660 1.00 0.00 C ATOM 1457 CD ARG A 100 3.608 10.081 -3.412 1.00 0.00 C ATOM 1458 NE ARG A 100 3.981 11.401 -2.855 1.00 0.00 N ATOM 1459 CZ ARG A 100 4.012 11.684 -1.536 1.00 0.00 C ATOM 1460 NH1 ARG A 100 3.692 10.742 -0.624 1.00 0.00 N ATOM 1461 NH2 ARG A 100 4.360 12.898 -1.151 1.00 0.00 N ATOM 0 H ARG A 100 -1.180 9.615 -1.533 1.00 0.00 H new ATOM 0 HA ARG A 100 -0.376 9.711 -3.654 1.00 0.00 H new ATOM 0 HB2 ARG A 100 1.544 9.261 -1.721 1.00 0.00 H new ATOM 0 HB3 ARG A 100 1.939 8.016 -2.890 1.00 0.00 H new ATOM 0 HG2 ARG A 100 1.907 9.791 -4.707 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.659 11.003 -3.467 1.00 0.00 H new ATOM 0 HD2 ARG A 100 3.901 9.290 -2.722 1.00 0.00 H new ATOM 0 HD3 ARG A 100 4.145 9.906 -4.344 1.00 0.00 H new ATOM 0 HE ARG A 100 4.230 12.143 -3.509 1.00 0.00 H new ATOM 0 HH11 ARG A 100 3.424 9.807 -0.930 1.00 0.00 H new ATOM 0 HH12 ARG A 100 3.718 10.966 0.371 1.00 0.00 H new ATOM 0 HH21 ARG A 100 4.600 13.604 -1.847 1.00 0.00 H new ATOM 0 HH22 ARG A 100 4.389 13.129 -0.158 1.00 0.00 H new ATOM 1471 N PHE A 101 -1.243 7.657 -4.846 1.00 0.00 N ATOM 1472 CA PHE A 101 -1.543 6.552 -5.740 1.00 0.00 C ATOM 1473 C PHE A 101 -1.241 6.924 -7.193 1.00 0.00 C ATOM 1474 O PHE A 101 -1.036 8.096 -7.508 1.00 0.00 O ATOM 1475 CB PHE A 101 -3.038 6.257 -5.603 1.00 0.00 C ATOM 1476 CG PHE A 101 -3.377 4.766 -5.560 1.00 0.00 C ATOM 1477 CD1 PHE A 101 -3.345 4.029 -6.703 1.00 0.00 C ATOM 1478 CD2 PHE A 101 -3.712 4.178 -4.381 1.00 0.00 C ATOM 1479 CE1 PHE A 101 -3.659 2.645 -6.664 1.00 0.00 C ATOM 1480 CE2 PHE A 101 -4.026 2.794 -4.342 1.00 0.00 C ATOM 1481 CZ PHE A 101 -3.993 2.056 -5.484 1.00 0.00 C ATOM 0 H PHE A 101 -1.858 8.465 -4.946 1.00 0.00 H new ATOM 0 HA PHE A 101 -0.932 5.688 -5.479 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -3.409 6.730 -4.694 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -3.566 6.715 -6.439 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.081 4.497 -7.640 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -3.739 4.764 -3.474 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -3.633 2.060 -7.571 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -4.291 2.327 -3.405 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.232 1.003 -5.454 1.00 0.00 H new ATOM 1490 N GLU A 102 -1.223 5.905 -8.040 1.00 0.00 N ATOM 1491 CA GLU A 102 -0.950 6.111 -9.453 1.00 0.00 C ATOM 1492 C GLU A 102 -1.937 5.313 -10.306 1.00 0.00 C ATOM 1493 O GLU A 102 -3.096 5.146 -9.928 1.00 0.00 O ATOM 1494 CB GLU A 102 0.495 5.737 -9.791 1.00 0.00 C ATOM 1495 CG GLU A 102 1.145 6.805 -10.672 1.00 0.00 C ATOM 1496 CD GLU A 102 0.235 7.180 -11.843 1.00 0.00 C ATOM 1497 OE1 GLU A 102 -0.762 7.891 -11.650 1.00 0.00 O ATOM 1498 OE2 GLU A 102 0.596 6.707 -12.987 1.00 0.00 O ATOM 0 H GLU A 102 -1.393 4.935 -7.775 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.079 7.170 -9.678 1.00 0.00 H new ATOM 0 HB2 GLU A 102 1.069 5.620 -8.872 1.00 0.00 H new ATOM 0 HB3 GLU A 102 0.515 4.775 -10.304 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.360 7.692 -10.076 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.098 6.437 -11.051 1.00 0.00 H new ATOM 1504 N GLN A 103 -1.442 4.842 -11.441 1.00 0.00 N ATOM 1505 CA GLN A 103 -2.267 4.065 -12.352 1.00 0.00 C ATOM 1506 C GLN A 103 -1.392 3.144 -13.204 1.00 0.00 C ATOM 1507 O GLN A 103 -0.846 3.567 -14.221 1.00 0.00 O ATOM 1508 CB GLN A 103 -3.122 4.979 -13.232 1.00 0.00 C ATOM 1509 CG GLN A 103 -3.699 6.140 -12.419 1.00 0.00 C ATOM 1510 CD GLN A 103 -4.500 7.089 -13.313 1.00 0.00 C ATOM 1511 OE1 GLN A 103 -4.594 6.920 -14.517 1.00 0.00 O ATOM 1512 NE2 GLN A 103 -5.069 8.097 -12.658 1.00 0.00 N ATOM 0 H GLN A 103 -0.481 4.983 -11.751 1.00 0.00 H new ATOM 0 HA GLN A 103 -2.944 3.447 -11.762 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -2.519 5.369 -14.052 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.933 4.405 -13.679 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -4.340 5.752 -11.628 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -2.890 6.687 -11.934 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -4.951 8.181 -11.648 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -5.624 8.786 -13.165 1.00 0.00 H new ATOM 1519 N SER A 104 -1.289 1.900 -12.759 1.00 0.00 N ATOM 1520 CA SER A 104 -0.491 0.915 -13.467 1.00 0.00 C ATOM 1521 C SER A 104 0.871 1.510 -13.834 1.00 0.00 C ATOM 1522 O SER A 104 1.902 1.060 -13.337 1.00 0.00 O ATOM 1523 CB SER A 104 -1.211 0.424 -14.725 1.00 0.00 C ATOM 1524 OG SER A 104 -0.374 -0.395 -15.535 1.00 0.00 O ATOM 0 H SER A 104 -1.746 1.552 -11.916 1.00 0.00 H new ATOM 0 HA SER A 104 -0.341 0.059 -12.809 1.00 0.00 H new ATOM 0 HB2 SER A 104 -2.099 -0.138 -14.438 1.00 0.00 H new ATOM 0 HB3 SER A 104 -1.551 1.281 -15.306 1.00 0.00 H new ATOM 0 HG SER A 104 -0.871 -0.689 -16.327 1.00 0.00 H new ATOM 1529 N GLU A 105 0.829 2.512 -14.700 1.00 0.00 N ATOM 1530 CA GLU A 105 2.047 3.172 -15.139 1.00 0.00 C ATOM 1531 C GLU A 105 3.068 3.213 -14.000 1.00 0.00 C ATOM 1532 O GLU A 105 4.273 3.159 -14.241 1.00 0.00 O ATOM 1533 CB GLU A 105 1.749 4.580 -15.659 1.00 0.00 C ATOM 1534 CG GLU A 105 3.023 5.255 -16.171 1.00 0.00 C ATOM 1535 CD GLU A 105 2.732 6.112 -17.405 1.00 0.00 C ATOM 1536 OE1 GLU A 105 1.622 6.647 -17.541 1.00 0.00 O ATOM 1537 OE2 GLU A 105 3.709 6.211 -18.243 1.00 0.00 O ATOM 0 H GLU A 105 -0.029 2.883 -15.109 1.00 0.00 H new ATOM 0 HA GLU A 105 2.473 2.598 -15.962 1.00 0.00 H new ATOM 0 HB2 GLU A 105 1.013 4.527 -16.461 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.310 5.181 -14.863 1.00 0.00 H new ATOM 0 HG2 GLU A 105 3.450 5.877 -15.385 1.00 0.00 H new ATOM 0 HG3 GLU A 105 3.767 4.497 -16.417 1.00 0.00 H new ATOM 1543 N GLN A 106 2.548 3.308 -12.785 1.00 0.00 N ATOM 1544 CA GLN A 106 3.400 3.358 -11.609 1.00 0.00 C ATOM 1545 C GLN A 106 4.223 2.072 -11.495 1.00 0.00 C ATOM 1546 O GLN A 106 5.153 1.996 -10.694 1.00 0.00 O ATOM 1547 CB GLN A 106 2.574 3.593 -10.343 1.00 0.00 C ATOM 1548 CG GLN A 106 3.227 2.927 -9.130 1.00 0.00 C ATOM 1549 CD GLN A 106 2.563 3.385 -7.830 1.00 0.00 C ATOM 1550 OE1 GLN A 106 1.921 2.621 -7.128 1.00 0.00 O ATOM 1551 NE2 GLN A 106 2.755 4.670 -7.548 1.00 0.00 N ATOM 0 H GLN A 106 1.548 3.352 -12.590 1.00 0.00 H new ATOM 0 HA GLN A 106 4.086 4.198 -11.717 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.473 4.663 -10.164 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.568 3.197 -10.482 1.00 0.00 H new ATOM 0 HG2 GLN A 106 3.150 1.843 -9.220 1.00 0.00 H new ATOM 0 HG3 GLN A 106 4.289 3.170 -9.105 1.00 0.00 H new ATOM 0 HE21 GLN A 106 3.303 5.254 -8.179 1.00 0.00 H new ATOM 0 HE22 GLN A 106 2.354 5.072 -6.700 1.00 0.00 H new ATOM 1558 N GLN A 107 3.850 1.096 -12.310 1.00 0.00 N ATOM 1559 CA GLN A 107 4.542 -0.182 -12.311 1.00 0.00 C ATOM 1560 C GLN A 107 6.035 0.022 -12.045 1.00 0.00 C ATOM 1561 O GLN A 107 6.693 -0.848 -11.477 1.00 0.00 O ATOM 1562 CB GLN A 107 4.317 -0.926 -13.629 1.00 0.00 C ATOM 1563 CG GLN A 107 5.017 -0.213 -14.788 1.00 0.00 C ATOM 1564 CD GLN A 107 5.989 -1.153 -15.503 1.00 0.00 C ATOM 1565 OE1 GLN A 107 5.921 -2.366 -15.386 1.00 0.00 O ATOM 1566 NE2 GLN A 107 6.896 -0.528 -16.249 1.00 0.00 N ATOM 0 H GLN A 107 3.078 1.164 -12.974 1.00 0.00 H new ATOM 0 HA GLN A 107 4.131 -0.796 -11.510 1.00 0.00 H new ATOM 0 HB2 GLN A 107 4.693 -1.945 -13.544 1.00 0.00 H new ATOM 0 HB3 GLN A 107 3.249 -0.997 -13.833 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.274 0.154 -15.496 1.00 0.00 H new ATOM 0 HG3 GLN A 107 5.556 0.656 -14.412 1.00 0.00 H new ATOM 0 HE21 GLN A 107 6.897 0.491 -16.303 1.00 0.00 H new ATOM 0 HE22 GLN A 107 7.590 -1.067 -16.767 1.00 0.00 H new ATOM 1573 N ALA A 108 6.526 1.178 -12.468 1.00 0.00 N ATOM 1574 CA ALA A 108 7.929 1.508 -12.282 1.00 0.00 C ATOM 1575 C ALA A 108 8.097 2.290 -10.978 1.00 0.00 C ATOM 1576 O ALA A 108 8.930 1.941 -10.144 1.00 0.00 O ATOM 1577 CB ALA A 108 8.436 2.286 -13.498 1.00 0.00 C ATOM 0 H ALA A 108 5.977 1.898 -12.939 1.00 0.00 H new ATOM 0 HA ALA A 108 8.529 0.601 -12.202 1.00 0.00 H new ATOM 0 HB1 ALA A 108 9.488 2.534 -13.359 1.00 0.00 H new ATOM 0 HB2 ALA A 108 8.322 1.675 -14.394 1.00 0.00 H new ATOM 0 HB3 ALA A 108 7.859 3.204 -13.609 1.00 0.00 H new ATOM 1583 N LEU A 109 7.291 3.333 -10.844 1.00 0.00 N ATOM 1584 CA LEU A 109 7.340 4.168 -9.655 1.00 0.00 C ATOM 1585 C LEU A 109 6.906 3.345 -8.441 1.00 0.00 C ATOM 1586 O LEU A 109 7.128 3.749 -7.300 1.00 0.00 O ATOM 1587 CB LEU A 109 6.518 5.441 -9.860 1.00 0.00 C ATOM 1588 CG LEU A 109 7.300 6.756 -9.842 1.00 0.00 C ATOM 1589 CD1 LEU A 109 6.438 7.915 -10.347 1.00 0.00 C ATOM 1590 CD2 LEU A 109 7.875 7.032 -8.452 1.00 0.00 C ATOM 0 H LEU A 109 6.601 3.619 -11.538 1.00 0.00 H new ATOM 0 HA LEU A 109 8.360 4.502 -9.466 1.00 0.00 H new ATOM 0 HB2 LEU A 109 5.998 5.364 -10.815 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.754 5.485 -9.084 1.00 0.00 H new ATOM 0 HG LEU A 109 8.143 6.661 -10.526 1.00 0.00 H new ATOM 0 HD11 LEU A 109 7.018 8.837 -10.324 1.00 0.00 H new ATOM 0 HD12 LEU A 109 6.119 7.713 -11.370 1.00 0.00 H new ATOM 0 HD13 LEU A 109 5.561 8.022 -9.708 1.00 0.00 H new ATOM 0 HD21 LEU A 109 8.426 7.972 -8.466 1.00 0.00 H new ATOM 0 HD22 LEU A 109 7.062 7.099 -7.729 1.00 0.00 H new ATOM 0 HD23 LEU A 109 8.547 6.222 -8.169 1.00 0.00 H new ATOM 1601 N LEU A 110 6.293 2.205 -8.727 1.00 0.00 N ATOM 1602 CA LEU A 110 5.826 1.321 -7.673 1.00 0.00 C ATOM 1603 C LEU A 110 6.994 0.976 -6.747 1.00 0.00 C ATOM 1604 O LEU A 110 6.817 0.863 -5.534 1.00 0.00 O ATOM 1605 CB LEU A 110 5.132 0.094 -8.270 1.00 0.00 C ATOM 1606 CG LEU A 110 5.091 -1.151 -7.382 1.00 0.00 C ATOM 1607 CD1 LEU A 110 4.299 -0.884 -6.100 1.00 0.00 C ATOM 1608 CD2 LEU A 110 4.545 -2.355 -8.153 1.00 0.00 C ATOM 0 H LEU A 110 6.109 1.874 -9.674 1.00 0.00 H new ATOM 0 HA LEU A 110 5.072 1.820 -7.064 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.108 0.368 -8.525 1.00 0.00 H new ATOM 0 HB3 LEU A 110 5.634 -0.165 -9.202 1.00 0.00 H new ATOM 0 HG LEU A 110 6.111 -1.394 -7.085 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.285 -1.785 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.770 -0.073 -5.544 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.277 -0.603 -6.355 1.00 0.00 H new ATOM 0 HD21 LEU A 110 4.526 -3.227 -7.500 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.534 -2.138 -8.498 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.186 -2.558 -9.011 1.00 0.00 H new ATOM 1619 N THR A 111 8.161 0.819 -7.353 1.00 0.00 N ATOM 1620 CA THR A 111 9.358 0.490 -6.597 1.00 0.00 C ATOM 1621 C THR A 111 9.614 1.543 -5.518 1.00 0.00 C ATOM 1622 O THR A 111 10.532 1.400 -4.711 1.00 0.00 O ATOM 1623 CB THR A 111 10.517 0.341 -7.587 1.00 0.00 C ATOM 1624 OG1 THR A 111 10.808 -1.054 -7.573 1.00 0.00 O ATOM 1625 CG2 THR A 111 11.804 0.996 -7.085 1.00 0.00 C ATOM 0 H THR A 111 8.304 0.913 -8.359 1.00 0.00 H new ATOM 0 HA THR A 111 9.242 -0.454 -6.065 1.00 0.00 H new ATOM 0 HB THR A 111 10.236 0.781 -8.544 1.00 0.00 H new ATOM 0 HG1 THR A 111 11.547 -1.240 -8.189 1.00 0.00 H new ATOM 0 HG21 THR A 111 12.593 0.861 -7.824 1.00 0.00 H new ATOM 0 HG22 THR A 111 11.633 2.061 -6.927 1.00 0.00 H new ATOM 0 HG23 THR A 111 12.105 0.534 -6.145 1.00 0.00 H new ATOM 1633 N LEU A 112 8.785 2.577 -5.535 1.00 0.00 N ATOM 1634 CA LEU A 112 8.910 3.653 -4.568 1.00 0.00 C ATOM 1635 C LEU A 112 9.750 4.780 -5.171 1.00 0.00 C ATOM 1636 O LEU A 112 10.417 5.518 -4.447 1.00 0.00 O ATOM 1637 CB LEU A 112 9.457 3.121 -3.242 1.00 0.00 C ATOM 1638 CG LEU A 112 8.955 3.822 -1.979 1.00 0.00 C ATOM 1639 CD1 LEU A 112 10.008 4.787 -1.431 1.00 0.00 C ATOM 1640 CD2 LEU A 112 7.617 4.520 -2.235 1.00 0.00 C ATOM 0 H LEU A 112 8.024 2.692 -6.204 1.00 0.00 H new ATOM 0 HA LEU A 112 7.931 4.073 -4.337 1.00 0.00 H new ATOM 0 HB2 LEU A 112 9.209 2.062 -3.168 1.00 0.00 H new ATOM 0 HB3 LEU A 112 10.544 3.193 -3.266 1.00 0.00 H new ATOM 0 HG LEU A 112 8.783 3.065 -1.214 1.00 0.00 H new ATOM 0 HD11 LEU A 112 9.625 5.272 -0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 112 10.915 4.235 -1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 112 10.235 5.543 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.282 5.011 -1.321 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.739 5.264 -3.022 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.876 3.783 -2.544 1.00 0.00 H new ATOM 1651 N GLY A 113 9.690 4.879 -6.491 1.00 0.00 N ATOM 1652 CA GLY A 113 10.437 5.904 -7.199 1.00 0.00 C ATOM 1653 C GLY A 113 11.832 6.081 -6.597 1.00 0.00 C ATOM 1654 O GLY A 113 12.428 7.151 -6.707 1.00 0.00 O ATOM 0 H GLY A 113 9.135 4.266 -7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 113 10.523 5.634 -8.252 1.00 0.00 H new ATOM 0 HA3 GLY A 113 9.896 6.849 -7.155 1.00 0.00 H new ATOM 1658 N VAL A 114 12.313 5.016 -5.973 1.00 0.00 N ATOM 1659 CA VAL A 114 13.625 5.040 -5.353 1.00 0.00 C ATOM 1660 C VAL A 114 14.435 3.835 -5.837 1.00 0.00 C ATOM 1661 O VAL A 114 14.832 2.987 -5.039 1.00 0.00 O ATOM 1662 CB VAL A 114 13.484 5.093 -3.830 1.00 0.00 C ATOM 1663 CG1 VAL A 114 14.852 5.009 -3.150 1.00 0.00 C ATOM 1664 CG2 VAL A 114 12.731 6.350 -3.393 1.00 0.00 C ATOM 0 H VAL A 114 11.816 4.130 -5.884 1.00 0.00 H new ATOM 0 HA VAL A 114 14.170 5.937 -5.647 1.00 0.00 H new ATOM 0 HB VAL A 114 12.900 4.227 -3.517 1.00 0.00 H new ATOM 0 HG11 VAL A 114 14.724 5.049 -2.068 1.00 0.00 H new ATOM 0 HG12 VAL A 114 15.337 4.072 -3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 114 15.471 5.846 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 114 12.645 6.363 -2.307 1.00 0.00 H new ATOM 0 HG22 VAL A 114 13.276 7.234 -3.724 1.00 0.00 H new ATOM 0 HG23 VAL A 114 11.735 6.350 -3.836 1.00 0.00 H new ATOM 1674 N ALA A 115 14.659 3.799 -7.142 1.00 0.00 N ATOM 1675 CA ALA A 115 15.414 2.712 -7.743 1.00 0.00 C ATOM 1676 C ALA A 115 15.145 2.681 -9.249 1.00 0.00 C ATOM 1677 O ALA A 115 14.172 2.076 -9.696 1.00 0.00 O ATOM 1678 CB ALA A 115 15.047 1.396 -7.057 1.00 0.00 C ATOM 0 H ALA A 115 14.331 4.505 -7.801 1.00 0.00 H new ATOM 0 HA ALA A 115 16.484 2.864 -7.603 1.00 0.00 H new ATOM 0 HB1 ALA A 115 15.613 0.581 -7.507 1.00 0.00 H new ATOM 0 HB2 ALA A 115 15.286 1.460 -5.995 1.00 0.00 H new ATOM 0 HB3 ALA A 115 13.980 1.208 -7.178 1.00 0.00 H new ATOM 1684 N SER A 116 16.025 3.339 -9.988 1.00 0.00 N ATOM 1685 CA SER A 116 15.895 3.394 -11.435 1.00 0.00 C ATOM 1686 C SER A 116 16.649 4.608 -11.982 1.00 0.00 C ATOM 1687 O SER A 116 17.335 4.509 -12.999 1.00 0.00 O ATOM 1688 CB SER A 116 14.424 3.450 -11.853 1.00 0.00 C ATOM 1689 OG SER A 116 14.241 4.181 -13.063 1.00 0.00 O ATOM 0 H SER A 116 16.831 3.839 -9.613 1.00 0.00 H new ATOM 0 HA SER A 116 16.330 2.486 -11.853 1.00 0.00 H new ATOM 0 HB2 SER A 116 14.044 2.436 -11.981 1.00 0.00 H new ATOM 0 HB3 SER A 116 13.838 3.912 -11.058 1.00 0.00 H new ATOM 0 HG SER A 116 13.290 4.193 -13.297 1.00 0.00 H new TER 1694 SER A 116