USER MOD reduce.3.24.130724 H: found=0, std=0, add=803, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 803 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 69 SER OG : rot 119:sc= 1.25 USER MOD Set 1.2: C 71 THR OG1 : rot 180:sc= 0.901 USER MOD Set 2.1: C 13 THR OG1 : rot 180:sc= -2.33! USER MOD Set 2.2: C 16 GLN :FLIP amide:sc= 0.54 F(o=-4.7,f=-1.8) USER MOD Single : C 1 MET CE :methyl -108:sc= -1.69! (180deg=-2.98!) USER MOD Single : C 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 5 TYR OH : rot 180:sc= 0 USER MOD Single : C 6 LYS NZ :NH3+ 155:sc= -0.0816 (180deg=-1.23) USER MOD Single : C 11 GLN : amide:sc= -0.0994 K(o=-0.099,f=-0.79) USER MOD Single : C 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 18 ASN : amide:sc= -0.397 K(o=-0.4,f=-1.4!) USER MOD Single : C 21 LYS NZ :NH3+ -172:sc= -0.0126 (180deg=-0.14) USER MOD Single : C 35 CYS SG : rot 180:sc= -0.0497 USER MOD Single : C 37 SER OG : rot 121:sc= -4.52! USER MOD Single : C 38 THR OG1 : rot -76:sc= -0.151 USER MOD Single : C 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 45 MET CE :methyl 176:sc= -9.78! (180deg=-9.97!) USER MOD Single : C 47 MET CE :methyl 180:sc= -5.65! (180deg=-5.65!) USER MOD Single : C 50 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : C 51 ASN : amide:sc= -2.13! C(o=-2.1!,f=-7.1!) USER MOD Single : C 53 THR OG1 : rot 180:sc= 0.0852 USER MOD Single : C 58 GLN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : C 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 80 MET CE :methyl 144:sc= -0.178 (180deg=-1.16) USER MOD Single : C 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 84 CYS SG : rot 180:sc= -3.47! USER MOD Single : C 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 89 SER OG : rot 180:sc= 0 USER MOD Single : I 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : I 3 SER OG : rot 180:sc= 0 USER MOD Single : I 7 MET CE :methyl -140:sc= -10.6! (180deg=-16.3!) USER MOD Single : I 8 MET CE :methyl -121:sc= -17.9! (180deg=-22.8!) USER MOD Single : I 9 GLN : amide:sc= 0 X(o=0,f=0.011) USER MOD Single : I 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 54.871 -12.993 19.736 1.00 0.00 N ATOM 2 CA MET C 1 53.749 -12.034 19.947 1.00 0.00 C ATOM 3 C MET C 1 53.643 -11.072 18.760 1.00 0.00 C ATOM 4 O MET C 1 52.651 -11.042 18.060 1.00 0.00 O ATOM 5 CB MET C 1 54.112 -11.273 21.222 1.00 0.00 C ATOM 6 CG MET C 1 52.849 -10.652 21.823 1.00 0.00 C ATOM 7 SD MET C 1 51.672 -11.962 22.239 1.00 0.00 S ATOM 8 CE MET C 1 50.603 -11.773 20.792 1.00 0.00 C ATOM 0 H1 MET C 1 54.932 -13.640 20.548 1.00 0.00 H new ATOM 0 H2 MET C 1 54.701 -13.541 18.869 1.00 0.00 H new ATOM 0 H3 MET C 1 55.764 -12.468 19.644 1.00 0.00 H new ATOM 0 HA MET C 1 52.787 -12.539 20.033 1.00 0.00 H new ATOM 0 HB2 MET C 1 54.576 -11.948 21.941 1.00 0.00 H new ATOM 0 HB3 MET C 1 54.842 -10.495 20.998 1.00 0.00 H new ATOM 0 HG2 MET C 1 53.102 -10.079 22.715 1.00 0.00 H new ATOM 0 HG3 MET C 1 52.400 -9.957 21.114 1.00 0.00 H new ATOM 0 HE1 MET C 1 49.657 -11.325 21.095 1.00 0.00 H new ATOM 0 HE2 MET C 1 51.092 -11.130 20.060 1.00 0.00 H new ATOM 0 HE3 MET C 1 50.415 -12.751 20.348 1.00 0.00 H new ATOM 20 N ASP C 2 54.659 -10.285 18.530 1.00 0.00 N ATOM 21 CA ASP C 2 54.614 -9.325 17.389 1.00 0.00 C ATOM 22 C ASP C 2 54.982 -10.035 16.084 1.00 0.00 C ATOM 23 O ASP C 2 55.828 -9.584 15.338 1.00 0.00 O ATOM 24 CB ASP C 2 55.652 -8.256 17.729 1.00 0.00 C ATOM 25 CG ASP C 2 55.341 -6.976 16.951 1.00 0.00 C ATOM 26 OD1 ASP C 2 55.045 -7.081 15.772 1.00 0.00 O ATOM 27 OD2 ASP C 2 55.404 -5.914 17.546 1.00 0.00 O ATOM 0 H ASP C 2 55.517 -10.265 19.081 1.00 0.00 H new ATOM 0 HA ASP C 2 53.621 -8.898 17.248 1.00 0.00 H new ATOM 0 HB2 ASP C 2 55.644 -8.054 18.800 1.00 0.00 H new ATOM 0 HB3 ASP C 2 56.651 -8.612 17.479 1.00 0.00 H new ATOM 32 N ASP C 3 54.350 -11.141 15.802 1.00 0.00 N ATOM 33 CA ASP C 3 54.662 -11.877 14.543 1.00 0.00 C ATOM 34 C ASP C 3 53.718 -11.425 13.427 1.00 0.00 C ATOM 35 O ASP C 3 53.309 -12.205 12.588 1.00 0.00 O ATOM 36 CB ASP C 3 54.434 -13.351 14.879 1.00 0.00 C ATOM 37 CG ASP C 3 55.311 -14.221 13.976 1.00 0.00 C ATOM 38 OD1 ASP C 3 56.283 -13.702 13.451 1.00 0.00 O ATOM 39 OD2 ASP C 3 54.995 -15.389 13.826 1.00 0.00 O ATOM 0 H ASP C 3 53.632 -11.567 16.388 1.00 0.00 H new ATOM 0 HA ASP C 3 55.678 -11.694 14.194 1.00 0.00 H new ATOM 0 HB2 ASP C 3 54.673 -13.538 15.926 1.00 0.00 H new ATOM 0 HB3 ASP C 3 53.384 -13.608 14.741 1.00 0.00 H new ATOM 44 N ILE C 4 53.366 -10.168 13.411 1.00 0.00 N ATOM 45 CA ILE C 4 52.447 -9.661 12.353 1.00 0.00 C ATOM 46 C ILE C 4 53.239 -9.279 11.100 1.00 0.00 C ATOM 47 O ILE C 4 52.752 -9.376 9.991 1.00 0.00 O ATOM 48 CB ILE C 4 51.788 -8.425 12.964 1.00 0.00 C ATOM 49 CG1 ILE C 4 51.069 -8.815 14.258 1.00 0.00 C ATOM 50 CG2 ILE C 4 50.776 -7.844 11.975 1.00 0.00 C ATOM 51 CD1 ILE C 4 51.923 -8.407 15.461 1.00 0.00 C ATOM 0 H ILE C 4 53.676 -9.469 14.086 1.00 0.00 H new ATOM 0 HA ILE C 4 51.715 -10.409 12.050 1.00 0.00 H new ATOM 0 HB ILE C 4 52.552 -7.679 13.183 1.00 0.00 H new ATOM 0 HG12 ILE C 4 50.096 -8.326 14.307 1.00 0.00 H new ATOM 0 HG13 ILE C 4 50.887 -9.890 14.276 1.00 0.00 H new ATOM 0 HG21 ILE C 4 50.306 -6.962 12.411 1.00 0.00 H new ATOM 0 HG22 ILE C 4 51.287 -7.565 11.054 1.00 0.00 H new ATOM 0 HG23 ILE C 4 50.013 -8.590 11.755 1.00 0.00 H new ATOM 0 HD11 ILE C 4 51.411 -8.685 16.382 1.00 0.00 H new ATOM 0 HD12 ILE C 4 52.886 -8.916 15.413 1.00 0.00 H new ATOM 0 HD13 ILE C 4 52.082 -7.329 15.445 1.00 0.00 H new ATOM 63 N TYR C 5 54.457 -8.838 11.267 1.00 0.00 N ATOM 64 CA TYR C 5 55.276 -8.445 10.084 1.00 0.00 C ATOM 65 C TYR C 5 55.843 -9.685 9.386 1.00 0.00 C ATOM 66 O TYR C 5 55.414 -10.053 8.310 1.00 0.00 O ATOM 67 CB TYR C 5 56.406 -7.584 10.653 1.00 0.00 C ATOM 68 CG TYR C 5 55.824 -6.494 11.521 1.00 0.00 C ATOM 69 CD1 TYR C 5 54.966 -5.539 10.965 1.00 0.00 C ATOM 70 CD2 TYR C 5 56.146 -6.439 12.883 1.00 0.00 C ATOM 71 CE1 TYR C 5 54.429 -4.528 11.771 1.00 0.00 C ATOM 72 CE2 TYR C 5 55.610 -5.427 13.689 1.00 0.00 C ATOM 73 CZ TYR C 5 54.751 -4.471 13.133 1.00 0.00 C ATOM 74 OH TYR C 5 54.222 -3.474 13.927 1.00 0.00 O ATOM 0 H TYR C 5 54.920 -8.733 12.170 1.00 0.00 H new ATOM 0 HA TYR C 5 54.688 -7.909 9.339 1.00 0.00 H new ATOM 0 HB2 TYR C 5 57.089 -8.202 11.236 1.00 0.00 H new ATOM 0 HB3 TYR C 5 56.987 -7.146 9.841 1.00 0.00 H new ATOM 0 HD1 TYR C 5 54.718 -5.582 9.915 1.00 0.00 H new ATOM 0 HD2 TYR C 5 56.808 -7.177 13.312 1.00 0.00 H new ATOM 0 HE1 TYR C 5 53.766 -3.791 11.342 1.00 0.00 H new ATOM 0 HE2 TYR C 5 55.859 -5.384 14.739 1.00 0.00 H new ATOM 0 HH TYR C 5 54.546 -3.581 14.846 1.00 0.00 H new ATOM 84 N LYS C 6 56.806 -10.329 9.987 1.00 0.00 N ATOM 85 CA LYS C 6 57.402 -11.541 9.354 1.00 0.00 C ATOM 86 C LYS C 6 56.306 -12.425 8.754 1.00 0.00 C ATOM 87 O LYS C 6 56.431 -12.923 7.653 1.00 0.00 O ATOM 88 CB LYS C 6 58.116 -12.268 10.493 1.00 0.00 C ATOM 89 CG LYS C 6 59.365 -11.480 10.894 1.00 0.00 C ATOM 90 CD LYS C 6 60.012 -12.131 12.118 1.00 0.00 C ATOM 91 CE LYS C 6 61.350 -11.448 12.411 1.00 0.00 C ATOM 92 NZ LYS C 6 61.014 -10.008 12.595 1.00 0.00 N ATOM 0 H LYS C 6 57.206 -10.069 10.889 1.00 0.00 H new ATOM 0 HA LYS C 6 58.081 -11.289 8.540 1.00 0.00 H new ATOM 0 HB2 LYS C 6 57.448 -12.372 11.348 1.00 0.00 H new ATOM 0 HB3 LYS C 6 58.393 -13.275 10.180 1.00 0.00 H new ATOM 0 HG2 LYS C 6 60.073 -11.455 10.066 1.00 0.00 H new ATOM 0 HG3 LYS C 6 59.099 -10.447 11.117 1.00 0.00 H new ATOM 0 HD2 LYS C 6 59.351 -12.046 12.981 1.00 0.00 H new ATOM 0 HD3 LYS C 6 60.166 -13.195 11.939 1.00 0.00 H new ATOM 0 HE2 LYS C 6 61.817 -11.862 13.305 1.00 0.00 H new ATOM 0 HE3 LYS C 6 62.053 -11.588 11.590 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 61.737 -9.556 13.190 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 60.984 -9.537 11.668 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 60.085 -9.924 13.055 1.00 0.00 H new ATOM 106 N ALA C 7 55.234 -12.625 9.469 1.00 0.00 N ATOM 107 CA ALA C 7 54.133 -13.479 8.935 1.00 0.00 C ATOM 108 C ALA C 7 53.427 -12.772 7.776 1.00 0.00 C ATOM 109 O ALA C 7 53.351 -13.284 6.677 1.00 0.00 O ATOM 110 CB ALA C 7 53.174 -13.667 10.111 1.00 0.00 C ATOM 0 H ALA C 7 55.072 -12.236 10.398 1.00 0.00 H new ATOM 0 HA ALA C 7 54.499 -14.430 8.549 1.00 0.00 H new ATOM 0 HB1 ALA C 7 52.333 -14.287 9.799 1.00 0.00 H new ATOM 0 HB2 ALA C 7 53.698 -14.154 10.934 1.00 0.00 H new ATOM 0 HB3 ALA C 7 52.806 -12.695 10.440 1.00 0.00 H new ATOM 116 N ALA C 8 52.906 -11.600 8.015 1.00 0.00 N ATOM 117 CA ALA C 8 52.200 -10.861 6.930 1.00 0.00 C ATOM 118 C ALA C 8 53.062 -10.817 5.666 1.00 0.00 C ATOM 119 O ALA C 8 52.568 -10.627 4.573 1.00 0.00 O ATOM 120 CB ALA C 8 51.993 -9.452 7.486 1.00 0.00 C ATOM 0 H ALA C 8 52.939 -11.122 8.915 1.00 0.00 H new ATOM 0 HA ALA C 8 51.259 -11.336 6.653 1.00 0.00 H new ATOM 0 HB1 ALA C 8 51.477 -8.841 6.745 1.00 0.00 H new ATOM 0 HB2 ALA C 8 51.393 -9.504 8.395 1.00 0.00 H new ATOM 0 HB3 ALA C 8 52.961 -9.005 7.715 1.00 0.00 H new ATOM 126 N VAL C 9 54.346 -10.988 5.806 1.00 0.00 N ATOM 127 CA VAL C 9 55.238 -10.953 4.611 1.00 0.00 C ATOM 128 C VAL C 9 55.176 -12.284 3.860 1.00 0.00 C ATOM 129 O VAL C 9 54.854 -12.335 2.690 1.00 0.00 O ATOM 130 CB VAL C 9 56.642 -10.729 5.175 1.00 0.00 C ATOM 131 CG1 VAL C 9 57.634 -10.556 4.023 1.00 0.00 C ATOM 132 CG2 VAL C 9 56.644 -9.472 6.045 1.00 0.00 C ATOM 0 H VAL C 9 54.818 -11.151 6.695 1.00 0.00 H new ATOM 0 HA VAL C 9 54.947 -10.175 3.905 1.00 0.00 H new ATOM 0 HB VAL C 9 56.934 -11.589 5.777 1.00 0.00 H new ATOM 0 HG11 VAL C 9 58.634 -10.396 4.425 1.00 0.00 H new ATOM 0 HG12 VAL C 9 57.631 -11.452 3.403 1.00 0.00 H new ATOM 0 HG13 VAL C 9 57.344 -9.696 3.419 1.00 0.00 H new ATOM 0 HG21 VAL C 9 57.644 -9.310 6.448 1.00 0.00 H new ATOM 0 HG22 VAL C 9 56.352 -8.612 5.442 1.00 0.00 H new ATOM 0 HG23 VAL C 9 55.938 -9.596 6.866 1.00 0.00 H new ATOM 142 N GLU C 10 55.492 -13.358 4.525 1.00 0.00 N ATOM 143 CA GLU C 10 55.465 -14.691 3.856 1.00 0.00 C ATOM 144 C GLU C 10 54.041 -15.052 3.420 1.00 0.00 C ATOM 145 O GLU C 10 53.837 -15.952 2.629 1.00 0.00 O ATOM 146 CB GLU C 10 55.963 -15.673 4.917 1.00 0.00 C ATOM 147 CG GLU C 10 57.083 -16.531 4.325 1.00 0.00 C ATOM 148 CD GLU C 10 57.511 -17.586 5.347 1.00 0.00 C ATOM 149 OE1 GLU C 10 58.093 -17.209 6.350 1.00 0.00 O ATOM 150 OE2 GLU C 10 57.250 -18.754 5.106 1.00 0.00 O ATOM 0 H GLU C 10 55.769 -13.372 5.507 1.00 0.00 H new ATOM 0 HA GLU C 10 56.079 -14.708 2.956 1.00 0.00 H new ATOM 0 HB2 GLU C 10 56.327 -15.130 5.789 1.00 0.00 H new ATOM 0 HB3 GLU C 10 55.144 -16.307 5.256 1.00 0.00 H new ATOM 0 HG2 GLU C 10 56.741 -17.014 3.410 1.00 0.00 H new ATOM 0 HG3 GLU C 10 57.933 -15.904 4.056 1.00 0.00 H new ATOM 157 N GLN C 11 53.057 -14.365 3.930 1.00 0.00 N ATOM 158 CA GLN C 11 51.652 -14.684 3.541 1.00 0.00 C ATOM 159 C GLN C 11 51.174 -13.740 2.433 1.00 0.00 C ATOM 160 O GLN C 11 49.993 -13.627 2.169 1.00 0.00 O ATOM 161 CB GLN C 11 50.832 -14.478 4.815 1.00 0.00 C ATOM 162 CG GLN C 11 51.248 -15.519 5.858 1.00 0.00 C ATOM 163 CD GLN C 11 50.113 -15.715 6.865 1.00 0.00 C ATOM 164 OE1 GLN C 11 48.962 -15.813 6.490 1.00 0.00 O ATOM 165 NE2 GLN C 11 50.393 -15.778 8.138 1.00 0.00 N ATOM 0 H GLN C 11 53.162 -13.600 4.596 1.00 0.00 H new ATOM 0 HA GLN C 11 51.554 -15.697 3.152 1.00 0.00 H new ATOM 0 HB2 GLN C 11 50.990 -13.472 5.205 1.00 0.00 H new ATOM 0 HB3 GLN C 11 49.768 -14.571 4.596 1.00 0.00 H new ATOM 0 HG2 GLN C 11 51.482 -16.465 5.370 1.00 0.00 H new ATOM 0 HG3 GLN C 11 52.152 -15.193 6.372 1.00 0.00 H new ATOM 0 HE21 GLN C 11 51.360 -15.696 8.452 1.00 0.00 H new ATOM 0 HE22 GLN C 11 49.645 -15.910 8.819 1.00 0.00 H new ATOM 174 N LEU C 12 52.081 -13.069 1.777 1.00 0.00 N ATOM 175 CA LEU C 12 51.673 -12.140 0.683 1.00 0.00 C ATOM 176 C LEU C 12 51.262 -12.942 -0.556 1.00 0.00 C ATOM 177 O LEU C 12 51.265 -14.157 -0.549 1.00 0.00 O ATOM 178 CB LEU C 12 52.915 -11.298 0.389 1.00 0.00 C ATOM 179 CG LEU C 12 53.129 -10.287 1.516 1.00 0.00 C ATOM 180 CD1 LEU C 12 54.395 -9.474 1.238 1.00 0.00 C ATOM 181 CD2 LEU C 12 51.927 -9.342 1.589 1.00 0.00 C ATOM 0 H LEU C 12 53.085 -13.123 1.950 1.00 0.00 H new ATOM 0 HA LEU C 12 50.821 -11.520 0.962 1.00 0.00 H new ATOM 0 HB2 LEU C 12 53.789 -11.942 0.294 1.00 0.00 H new ATOM 0 HB3 LEU C 12 52.797 -10.778 -0.562 1.00 0.00 H new ATOM 0 HG LEU C 12 53.235 -10.817 2.463 1.00 0.00 H new ATOM 0 HD11 LEU C 12 54.548 -8.753 2.041 1.00 0.00 H new ATOM 0 HD12 LEU C 12 55.253 -10.144 1.183 1.00 0.00 H new ATOM 0 HD13 LEU C 12 54.287 -8.945 0.291 1.00 0.00 H new ATOM 0 HD21 LEU C 12 52.079 -8.621 2.392 1.00 0.00 H new ATOM 0 HD22 LEU C 12 51.822 -8.813 0.642 1.00 0.00 H new ATOM 0 HD23 LEU C 12 51.023 -9.918 1.785 1.00 0.00 H new ATOM 193 N THR C 13 50.911 -12.274 -1.621 1.00 0.00 N ATOM 194 CA THR C 13 50.504 -13.005 -2.857 1.00 0.00 C ATOM 195 C THR C 13 50.863 -12.187 -4.100 1.00 0.00 C ATOM 196 O THR C 13 51.044 -10.988 -4.034 1.00 0.00 O ATOM 197 CB THR C 13 48.986 -13.173 -2.744 1.00 0.00 C ATOM 198 OG1 THR C 13 48.499 -12.395 -1.659 1.00 0.00 O ATOM 199 CG2 THR C 13 48.652 -14.645 -2.510 1.00 0.00 C ATOM 0 H THR C 13 50.888 -11.257 -1.690 1.00 0.00 H new ATOM 0 HA THR C 13 51.012 -13.965 -2.951 1.00 0.00 H new ATOM 0 HB THR C 13 48.515 -12.837 -3.668 1.00 0.00 H new ATOM 0 HG1 THR C 13 47.527 -12.503 -1.589 1.00 0.00 H new ATOM 0 HG21 THR C 13 47.572 -14.765 -2.430 1.00 0.00 H new ATOM 0 HG22 THR C 13 49.022 -15.239 -3.346 1.00 0.00 H new ATOM 0 HG23 THR C 13 49.124 -14.983 -1.588 1.00 0.00 H new ATOM 207 N GLU C 14 50.966 -12.827 -5.232 1.00 0.00 N ATOM 208 CA GLU C 14 51.312 -12.085 -6.478 1.00 0.00 C ATOM 209 C GLU C 14 50.482 -10.802 -6.570 1.00 0.00 C ATOM 210 O GLU C 14 51.014 -9.715 -6.672 1.00 0.00 O ATOM 211 CB GLU C 14 50.958 -13.037 -7.620 1.00 0.00 C ATOM 212 CG GLU C 14 51.292 -12.375 -8.958 1.00 0.00 C ATOM 213 CD GLU C 14 50.138 -12.594 -9.939 1.00 0.00 C ATOM 214 OE1 GLU C 14 49.403 -13.551 -9.755 1.00 0.00 O ATOM 215 OE2 GLU C 14 50.009 -11.802 -10.858 1.00 0.00 O ATOM 0 H GLU C 14 50.826 -13.831 -5.349 1.00 0.00 H new ATOM 0 HA GLU C 14 52.361 -11.790 -6.508 1.00 0.00 H new ATOM 0 HB2 GLU C 14 51.512 -13.970 -7.515 1.00 0.00 H new ATOM 0 HB3 GLU C 14 49.898 -13.290 -7.582 1.00 0.00 H new ATOM 0 HG2 GLU C 14 51.464 -11.308 -8.815 1.00 0.00 H new ATOM 0 HG3 GLU C 14 52.213 -12.795 -9.364 1.00 0.00 H new ATOM 222 N GLU C 15 49.183 -10.919 -6.531 1.00 0.00 N ATOM 223 CA GLU C 15 48.325 -9.702 -6.612 1.00 0.00 C ATOM 224 C GLU C 15 48.896 -8.603 -5.712 1.00 0.00 C ATOM 225 O GLU C 15 48.869 -7.435 -6.045 1.00 0.00 O ATOM 226 CB GLU C 15 46.952 -10.150 -6.109 1.00 0.00 C ATOM 227 CG GLU C 15 46.144 -10.726 -7.274 1.00 0.00 C ATOM 228 CD GLU C 15 44.777 -11.188 -6.768 1.00 0.00 C ATOM 229 OE1 GLU C 15 44.729 -11.765 -5.694 1.00 0.00 O ATOM 230 OE2 GLU C 15 43.801 -10.958 -7.462 1.00 0.00 O ATOM 0 H GLU C 15 48.679 -11.802 -6.447 1.00 0.00 H new ATOM 0 HA GLU C 15 48.272 -9.295 -7.622 1.00 0.00 H new ATOM 0 HB2 GLU C 15 47.067 -10.900 -5.326 1.00 0.00 H new ATOM 0 HB3 GLU C 15 46.422 -9.306 -5.667 1.00 0.00 H new ATOM 0 HG2 GLU C 15 46.020 -9.973 -8.052 1.00 0.00 H new ATOM 0 HG3 GLU C 15 46.679 -11.563 -7.723 1.00 0.00 H new ATOM 237 N GLN C 16 49.419 -8.974 -4.576 1.00 0.00 N ATOM 238 CA GLN C 16 50.001 -7.956 -3.652 1.00 0.00 C ATOM 239 C GLN C 16 51.421 -7.614 -4.100 1.00 0.00 C ATOM 240 O GLN C 16 51.765 -6.465 -4.293 1.00 0.00 O ATOM 241 CB GLN C 16 50.028 -8.618 -2.269 1.00 0.00 C ATOM 242 CG GLN C 16 48.810 -9.529 -2.099 1.00 0.00 C ATOM 243 CD GLN C 16 48.404 -9.573 -0.625 1.00 0.00 C ATOM 244 OE1 GLN C 16 48.009 -8.475 -0.038 1.00 0.00 O flip ATOM 245 NE2 GLN C 16 48.443 -10.614 -0.001 1.00 0.00 N flip ATOM 0 H GLN C 16 49.469 -9.938 -4.246 1.00 0.00 H new ATOM 0 HA GLN C 16 49.422 -7.032 -3.641 1.00 0.00 H new ATOM 0 HB2 GLN C 16 50.944 -9.197 -2.152 1.00 0.00 H new ATOM 0 HB3 GLN C 16 50.032 -7.854 -1.491 1.00 0.00 H new ATOM 0 HG2 GLN C 16 47.981 -9.162 -2.704 1.00 0.00 H new ATOM 0 HG3 GLN C 16 49.042 -10.533 -2.453 1.00 0.00 H new ATOM 0 HE21 GLN C 16 48.751 -11.472 -0.459 1.00 0.00 H new ATOM 0 HE22 GLN C 16 48.167 -10.631 0.981 1.00 0.00 H new ATOM 254 N LYS C 17 52.248 -8.609 -4.270 1.00 0.00 N ATOM 255 CA LYS C 17 53.648 -8.349 -4.711 1.00 0.00 C ATOM 256 C LYS C 17 53.651 -7.381 -5.897 1.00 0.00 C ATOM 257 O LYS C 17 54.504 -6.524 -6.010 1.00 0.00 O ATOM 258 CB LYS C 17 54.194 -9.713 -5.133 1.00 0.00 C ATOM 259 CG LYS C 17 54.967 -10.336 -3.969 1.00 0.00 C ATOM 260 CD LYS C 17 54.332 -11.674 -3.590 1.00 0.00 C ATOM 261 CE LYS C 17 55.428 -12.720 -3.374 1.00 0.00 C ATOM 262 NZ LYS C 17 54.840 -13.997 -3.864 1.00 0.00 N ATOM 0 H LYS C 17 52.015 -9.591 -4.123 1.00 0.00 H new ATOM 0 HA LYS C 17 54.252 -7.897 -3.925 1.00 0.00 H new ATOM 0 HB2 LYS C 17 53.375 -10.368 -5.431 1.00 0.00 H new ATOM 0 HB3 LYS C 17 54.846 -9.603 -5.999 1.00 0.00 H new ATOM 0 HG2 LYS C 17 56.010 -10.483 -4.249 1.00 0.00 H new ATOM 0 HG3 LYS C 17 54.959 -9.662 -3.112 1.00 0.00 H new ATOM 0 HD2 LYS C 17 53.738 -11.562 -2.683 1.00 0.00 H new ATOM 0 HD3 LYS C 17 53.653 -12.002 -4.377 1.00 0.00 H new ATOM 0 HE2 LYS C 17 56.333 -12.464 -3.926 1.00 0.00 H new ATOM 0 HE3 LYS C 17 55.705 -12.791 -2.322 1.00 0.00 H new ATOM 0 HZ1 LYS C 17 55.532 -14.765 -3.749 1.00 0.00 H new ATOM 0 HZ2 LYS C 17 53.984 -14.218 -3.316 1.00 0.00 H new ATOM 0 HZ3 LYS C 17 54.592 -13.902 -4.870 1.00 0.00 H new ATOM 276 N ASN C 18 52.697 -7.511 -6.778 1.00 0.00 N ATOM 277 CA ASN C 18 52.640 -6.596 -7.955 1.00 0.00 C ATOM 278 C ASN C 18 52.530 -5.144 -7.483 1.00 0.00 C ATOM 279 O ASN C 18 52.895 -4.223 -8.185 1.00 0.00 O ATOM 280 CB ASN C 18 51.380 -7.011 -8.716 1.00 0.00 C ATOM 281 CG ASN C 18 51.703 -8.186 -9.640 1.00 0.00 C ATOM 282 OD1 ASN C 18 52.781 -8.258 -10.197 1.00 0.00 O ATOM 283 ND2 ASN C 18 50.809 -9.118 -9.828 1.00 0.00 N ATOM 0 H ASN C 18 51.955 -8.210 -6.735 1.00 0.00 H new ATOM 0 HA ASN C 18 53.532 -6.662 -8.578 1.00 0.00 H new ATOM 0 HB2 ASN C 18 50.595 -7.292 -8.014 1.00 0.00 H new ATOM 0 HB3 ASN C 18 51.001 -6.171 -9.298 1.00 0.00 H new ATOM 0 HD21 ASN C 18 51.015 -9.906 -10.442 1.00 0.00 H new ATOM 0 HD22 ASN C 18 49.904 -9.058 -9.361 1.00 0.00 H new ATOM 290 N GLU C 19 52.029 -4.936 -6.296 1.00 0.00 N ATOM 291 CA GLU C 19 51.895 -3.546 -5.777 1.00 0.00 C ATOM 292 C GLU C 19 53.228 -3.074 -5.189 1.00 0.00 C ATOM 293 O GLU C 19 53.704 -1.998 -5.491 1.00 0.00 O ATOM 294 CB GLU C 19 50.827 -3.632 -4.687 1.00 0.00 C ATOM 295 CG GLU C 19 49.584 -4.331 -5.243 1.00 0.00 C ATOM 296 CD GLU C 19 49.041 -3.539 -6.433 1.00 0.00 C ATOM 297 OE1 GLU C 19 49.716 -3.495 -7.448 1.00 0.00 O ATOM 298 OE2 GLU C 19 47.958 -2.990 -6.309 1.00 0.00 O ATOM 0 H GLU C 19 51.707 -5.669 -5.664 1.00 0.00 H new ATOM 0 HA GLU C 19 51.622 -2.836 -6.558 1.00 0.00 H new ATOM 0 HB2 GLU C 19 51.212 -4.181 -3.828 1.00 0.00 H new ATOM 0 HB3 GLU C 19 50.569 -2.633 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU C 19 49.833 -5.346 -5.552 1.00 0.00 H new ATOM 0 HG3 GLU C 19 48.822 -4.411 -4.468 1.00 0.00 H new ATOM 305 N PHE C 20 53.834 -3.872 -4.351 1.00 0.00 N ATOM 306 CA PHE C 20 55.137 -3.469 -3.747 1.00 0.00 C ATOM 307 C PHE C 20 56.189 -3.280 -4.842 1.00 0.00 C ATOM 308 O PHE C 20 56.959 -2.341 -4.820 1.00 0.00 O ATOM 309 CB PHE C 20 55.523 -4.627 -2.826 1.00 0.00 C ATOM 310 CG PHE C 20 54.396 -4.899 -1.858 1.00 0.00 C ATOM 311 CD1 PHE C 20 53.653 -3.834 -1.332 1.00 0.00 C ATOM 312 CD2 PHE C 20 54.093 -6.214 -1.487 1.00 0.00 C ATOM 313 CE1 PHE C 20 52.609 -4.085 -0.435 1.00 0.00 C ATOM 314 CE2 PHE C 20 53.047 -6.465 -0.590 1.00 0.00 C ATOM 315 CZ PHE C 20 52.305 -5.400 -0.064 1.00 0.00 C ATOM 0 H PHE C 20 53.484 -4.784 -4.059 1.00 0.00 H new ATOM 0 HA PHE C 20 55.068 -2.525 -3.206 1.00 0.00 H new ATOM 0 HB2 PHE C 20 55.734 -5.519 -3.415 1.00 0.00 H new ATOM 0 HB3 PHE C 20 56.434 -4.383 -2.280 1.00 0.00 H new ATOM 0 HD1 PHE C 20 53.886 -2.819 -1.619 1.00 0.00 H new ATOM 0 HD2 PHE C 20 54.666 -7.035 -1.892 1.00 0.00 H new ATOM 0 HE1 PHE C 20 52.037 -3.264 -0.029 1.00 0.00 H new ATOM 0 HE2 PHE C 20 52.813 -7.480 -0.304 1.00 0.00 H new ATOM 0 HZ PHE C 20 51.498 -5.593 0.628 1.00 0.00 H new ATOM 325 N LYS C 21 56.227 -4.166 -5.801 1.00 0.00 N ATOM 326 CA LYS C 21 57.228 -4.039 -6.898 1.00 0.00 C ATOM 327 C LYS C 21 57.343 -2.581 -7.348 1.00 0.00 C ATOM 328 O LYS C 21 58.424 -2.036 -7.453 1.00 0.00 O ATOM 329 CB LYS C 21 56.681 -4.904 -8.031 1.00 0.00 C ATOM 330 CG LYS C 21 57.439 -6.231 -8.063 1.00 0.00 C ATOM 331 CD LYS C 21 56.454 -7.384 -7.878 1.00 0.00 C ATOM 332 CE LYS C 21 56.681 -8.429 -8.973 1.00 0.00 C ATOM 333 NZ LYS C 21 56.501 -9.742 -8.294 1.00 0.00 N ATOM 0 H LYS C 21 55.607 -4.973 -5.872 1.00 0.00 H new ATOM 0 HA LYS C 21 58.224 -4.353 -6.585 1.00 0.00 H new ATOM 0 HB2 LYS C 21 55.616 -5.084 -7.885 1.00 0.00 H new ATOM 0 HB3 LYS C 21 56.790 -4.387 -8.984 1.00 0.00 H new ATOM 0 HG2 LYS C 21 57.967 -6.338 -9.011 1.00 0.00 H new ATOM 0 HG3 LYS C 21 58.192 -6.251 -7.275 1.00 0.00 H new ATOM 0 HD2 LYS C 21 56.587 -7.836 -6.895 1.00 0.00 H new ATOM 0 HD3 LYS C 21 55.430 -7.012 -7.922 1.00 0.00 H new ATOM 0 HE2 LYS C 21 55.970 -8.306 -9.790 1.00 0.00 H new ATOM 0 HE3 LYS C 21 57.679 -8.340 -9.403 1.00 0.00 H new ATOM 0 HZ1 LYS C 21 56.773 -10.508 -8.943 1.00 0.00 H new ATOM 0 HZ2 LYS C 21 57.100 -9.779 -7.445 1.00 0.00 H new ATOM 0 HZ3 LYS C 21 55.504 -9.857 -8.020 1.00 0.00 H new ATOM 347 N ALA C 22 56.235 -1.948 -7.613 1.00 0.00 N ATOM 348 CA ALA C 22 56.273 -0.527 -8.057 1.00 0.00 C ATOM 349 C ALA C 22 57.290 0.262 -7.226 1.00 0.00 C ATOM 350 O ALA C 22 58.302 0.710 -7.727 1.00 0.00 O ATOM 351 CB ALA C 22 54.859 -0.003 -7.814 1.00 0.00 C ATOM 0 H ALA C 22 55.302 -2.354 -7.541 1.00 0.00 H new ATOM 0 HA ALA C 22 56.573 -0.427 -9.100 1.00 0.00 H new ATOM 0 HB1 ALA C 22 54.802 1.043 -8.116 1.00 0.00 H new ATOM 0 HB2 ALA C 22 54.149 -0.589 -8.397 1.00 0.00 H new ATOM 0 HB3 ALA C 22 54.616 -0.088 -6.755 1.00 0.00 H new ATOM 357 N ALA C 23 57.028 0.438 -5.959 1.00 0.00 N ATOM 358 CA ALA C 23 57.980 1.200 -5.099 1.00 0.00 C ATOM 359 C ALA C 23 59.342 0.500 -5.058 1.00 0.00 C ATOM 360 O ALA C 23 60.370 1.133 -4.930 1.00 0.00 O ATOM 361 CB ALA C 23 57.341 1.211 -3.711 1.00 0.00 C ATOM 0 H ALA C 23 56.197 0.088 -5.482 1.00 0.00 H new ATOM 0 HA ALA C 23 58.155 2.208 -5.475 1.00 0.00 H new ATOM 0 HB1 ALA C 23 57.984 1.755 -3.019 1.00 0.00 H new ATOM 0 HB2 ALA C 23 56.368 1.699 -3.762 1.00 0.00 H new ATOM 0 HB3 ALA C 23 57.215 0.187 -3.360 1.00 0.00 H new ATOM 367 N PHE C 24 59.357 -0.800 -5.161 1.00 0.00 N ATOM 368 CA PHE C 24 60.656 -1.536 -5.124 1.00 0.00 C ATOM 369 C PHE C 24 61.506 -1.178 -6.345 1.00 0.00 C ATOM 370 O PHE C 24 62.720 -1.162 -6.286 1.00 0.00 O ATOM 371 CB PHE C 24 60.274 -3.016 -5.152 1.00 0.00 C ATOM 372 CG PHE C 24 61.526 -3.857 -5.242 1.00 0.00 C ATOM 373 CD1 PHE C 24 62.367 -3.983 -4.130 1.00 0.00 C ATOM 374 CD2 PHE C 24 61.845 -4.511 -6.439 1.00 0.00 C ATOM 375 CE1 PHE C 24 63.527 -4.762 -4.215 1.00 0.00 C ATOM 376 CE2 PHE C 24 63.003 -5.291 -6.523 1.00 0.00 C ATOM 377 CZ PHE C 24 63.845 -5.416 -5.410 1.00 0.00 C ATOM 0 H PHE C 24 58.529 -1.385 -5.269 1.00 0.00 H new ATOM 0 HA PHE C 24 61.247 -1.283 -4.243 1.00 0.00 H new ATOM 0 HB2 PHE C 24 59.713 -3.275 -4.254 1.00 0.00 H new ATOM 0 HB3 PHE C 24 59.625 -3.219 -6.003 1.00 0.00 H new ATOM 0 HD1 PHE C 24 62.121 -3.479 -3.207 1.00 0.00 H new ATOM 0 HD2 PHE C 24 61.197 -4.413 -7.297 1.00 0.00 H new ATOM 0 HE1 PHE C 24 64.177 -4.858 -3.358 1.00 0.00 H new ATOM 0 HE2 PHE C 24 63.248 -5.797 -7.445 1.00 0.00 H new ATOM 0 HZ PHE C 24 64.740 -6.017 -5.475 1.00 0.00 H new ATOM 387 N ASP C 25 60.879 -0.890 -7.454 1.00 0.00 N ATOM 388 CA ASP C 25 61.651 -0.535 -8.678 1.00 0.00 C ATOM 389 C ASP C 25 62.286 0.851 -8.521 1.00 0.00 C ATOM 390 O ASP C 25 63.491 1.001 -8.566 1.00 0.00 O ATOM 391 CB ASP C 25 60.621 -0.527 -9.807 1.00 0.00 C ATOM 392 CG ASP C 25 61.194 -1.245 -11.029 1.00 0.00 C ATOM 393 OD1 ASP C 25 61.638 -2.372 -10.875 1.00 0.00 O ATOM 394 OD2 ASP C 25 61.180 -0.659 -12.098 1.00 0.00 O ATOM 0 H ASP C 25 59.865 -0.885 -7.564 1.00 0.00 H new ATOM 0 HA ASP C 25 62.463 -1.236 -8.871 1.00 0.00 H new ATOM 0 HB2 ASP C 25 59.705 -1.019 -9.480 1.00 0.00 H new ATOM 0 HB3 ASP C 25 60.358 0.499 -10.066 1.00 0.00 H new ATOM 399 N ILE C 26 61.483 1.863 -8.339 1.00 0.00 N ATOM 400 CA ILE C 26 62.041 3.237 -8.181 1.00 0.00 C ATOM 401 C ILE C 26 62.942 3.306 -6.945 1.00 0.00 C ATOM 402 O ILE C 26 63.894 4.059 -6.900 1.00 0.00 O ATOM 403 CB ILE C 26 60.820 4.138 -8.005 1.00 0.00 C ATOM 404 CG1 ILE C 26 60.101 4.288 -9.347 1.00 0.00 C ATOM 405 CG2 ILE C 26 61.267 5.515 -7.510 1.00 0.00 C ATOM 406 CD1 ILE C 26 59.023 3.209 -9.471 1.00 0.00 C ATOM 0 H ILE C 26 60.466 1.799 -8.293 1.00 0.00 H new ATOM 0 HA ILE C 26 62.651 3.536 -9.033 1.00 0.00 H new ATOM 0 HB ILE C 26 60.143 3.693 -7.276 1.00 0.00 H new ATOM 0 HG12 ILE C 26 59.650 5.278 -9.422 1.00 0.00 H new ATOM 0 HG13 ILE C 26 60.815 4.200 -10.166 1.00 0.00 H new ATOM 0 HG21 ILE C 26 60.395 6.157 -7.385 1.00 0.00 H new ATOM 0 HG22 ILE C 26 61.780 5.409 -6.554 1.00 0.00 H new ATOM 0 HG23 ILE C 26 61.945 5.961 -8.238 1.00 0.00 H new ATOM 0 HD11 ILE C 26 58.510 3.315 -10.427 1.00 0.00 H new ATOM 0 HD12 ILE C 26 59.486 2.224 -9.415 1.00 0.00 H new ATOM 0 HD13 ILE C 26 58.304 3.318 -8.659 1.00 0.00 H new ATOM 418 N PHE C 27 62.646 2.528 -5.941 1.00 0.00 N ATOM 419 CA PHE C 27 63.484 2.552 -4.708 1.00 0.00 C ATOM 420 C PHE C 27 64.933 2.181 -5.038 1.00 0.00 C ATOM 421 O PHE C 27 65.841 2.463 -4.283 1.00 0.00 O ATOM 422 CB PHE C 27 62.863 1.506 -3.784 1.00 0.00 C ATOM 423 CG PHE C 27 61.873 2.172 -2.860 1.00 0.00 C ATOM 424 CD1 PHE C 27 61.099 3.248 -3.316 1.00 0.00 C ATOM 425 CD2 PHE C 27 61.729 1.715 -1.544 1.00 0.00 C ATOM 426 CE1 PHE C 27 60.183 3.864 -2.457 1.00 0.00 C ATOM 427 CE2 PHE C 27 60.812 2.332 -0.685 1.00 0.00 C ATOM 428 CZ PHE C 27 60.039 3.407 -1.141 1.00 0.00 C ATOM 0 H PHE C 27 61.861 1.877 -5.920 1.00 0.00 H new ATOM 0 HA PHE C 27 63.508 3.541 -4.249 1.00 0.00 H new ATOM 0 HB2 PHE C 27 62.365 0.736 -4.373 1.00 0.00 H new ATOM 0 HB3 PHE C 27 63.641 1.011 -3.204 1.00 0.00 H new ATOM 0 HD1 PHE C 27 61.210 3.601 -4.331 1.00 0.00 H new ATOM 0 HD2 PHE C 27 62.326 0.886 -1.192 1.00 0.00 H new ATOM 0 HE1 PHE C 27 59.586 4.693 -2.809 1.00 0.00 H new ATOM 0 HE2 PHE C 27 60.701 1.979 0.330 1.00 0.00 H new ATOM 0 HZ PHE C 27 59.332 3.884 -0.478 1.00 0.00 H new ATOM 438 N VAL C 28 65.156 1.548 -6.157 1.00 0.00 N ATOM 439 CA VAL C 28 66.547 1.158 -6.526 1.00 0.00 C ATOM 440 C VAL C 28 66.961 1.835 -7.836 1.00 0.00 C ATOM 441 O VAL C 28 67.975 1.509 -8.420 1.00 0.00 O ATOM 442 CB VAL C 28 66.494 -0.358 -6.700 1.00 0.00 C ATOM 443 CG1 VAL C 28 65.970 -1.000 -5.415 1.00 0.00 C ATOM 444 CG2 VAL C 28 65.558 -0.704 -7.859 1.00 0.00 C ATOM 0 H VAL C 28 64.437 1.284 -6.831 1.00 0.00 H new ATOM 0 HA VAL C 28 67.275 1.460 -5.773 1.00 0.00 H new ATOM 0 HB VAL C 28 67.494 -0.735 -6.914 1.00 0.00 H new ATOM 0 HG11 VAL C 28 65.932 -2.082 -5.538 1.00 0.00 H new ATOM 0 HG12 VAL C 28 66.635 -0.752 -4.587 1.00 0.00 H new ATOM 0 HG13 VAL C 28 64.969 -0.624 -5.202 1.00 0.00 H new ATOM 0 HG21 VAL C 28 65.519 -1.786 -7.985 1.00 0.00 H new ATOM 0 HG22 VAL C 28 64.558 -0.327 -7.644 1.00 0.00 H new ATOM 0 HG23 VAL C 28 65.929 -0.245 -8.776 1.00 0.00 H new ATOM 454 N LEU C 29 66.184 2.774 -8.303 1.00 0.00 N ATOM 455 CA LEU C 29 66.536 3.468 -9.576 1.00 0.00 C ATOM 456 C LEU C 29 67.879 4.188 -9.432 1.00 0.00 C ATOM 457 O LEU C 29 67.939 5.339 -9.045 1.00 0.00 O ATOM 458 CB LEU C 29 65.408 4.475 -9.802 1.00 0.00 C ATOM 459 CG LEU C 29 64.525 4.008 -10.960 1.00 0.00 C ATOM 460 CD1 LEU C 29 63.518 5.105 -11.308 1.00 0.00 C ATOM 461 CD2 LEU C 29 65.399 3.713 -12.182 1.00 0.00 C ATOM 0 H LEU C 29 65.322 3.091 -7.859 1.00 0.00 H new ATOM 0 HA LEU C 29 66.637 2.775 -10.411 1.00 0.00 H new ATOM 0 HB2 LEU C 29 64.812 4.577 -8.895 1.00 0.00 H new ATOM 0 HB3 LEU C 29 65.824 5.458 -10.022 1.00 0.00 H new ATOM 0 HG LEU C 29 63.991 3.104 -10.667 1.00 0.00 H new ATOM 0 HD11 LEU C 29 62.888 4.772 -12.133 1.00 0.00 H new ATOM 0 HD12 LEU C 29 62.895 5.316 -10.439 1.00 0.00 H new ATOM 0 HD13 LEU C 29 64.052 6.009 -11.600 1.00 0.00 H new ATOM 0 HD21 LEU C 29 64.770 3.380 -13.007 1.00 0.00 H new ATOM 0 HD22 LEU C 29 65.933 4.617 -12.474 1.00 0.00 H new ATOM 0 HD23 LEU C 29 66.117 2.931 -11.935 1.00 0.00 H new ATOM 473 N GLY C 30 68.957 3.520 -9.741 1.00 0.00 N ATOM 474 CA GLY C 30 70.294 4.168 -9.622 1.00 0.00 C ATOM 475 C GLY C 30 71.225 3.272 -8.803 1.00 0.00 C ATOM 476 O GLY C 30 72.429 3.441 -8.809 1.00 0.00 O ATOM 0 H GLY C 30 68.970 2.555 -10.070 1.00 0.00 H new ATOM 0 HA2 GLY C 30 70.716 4.340 -10.612 1.00 0.00 H new ATOM 0 HA3 GLY C 30 70.196 5.142 -9.144 1.00 0.00 H new ATOM 480 N ALA C 31 70.679 2.319 -8.098 1.00 0.00 N ATOM 481 CA ALA C 31 71.534 1.412 -7.277 1.00 0.00 C ATOM 482 C ALA C 31 72.380 0.517 -8.186 1.00 0.00 C ATOM 483 O ALA C 31 71.888 -0.070 -9.128 1.00 0.00 O ATOM 484 CB ALA C 31 70.551 0.572 -6.464 1.00 0.00 C ATOM 0 H ALA C 31 69.678 2.128 -8.054 1.00 0.00 H new ATOM 0 HA ALA C 31 72.226 1.962 -6.639 1.00 0.00 H new ATOM 0 HB1 ALA C 31 71.103 -0.123 -5.832 1.00 0.00 H new ATOM 0 HB2 ALA C 31 69.943 1.226 -5.839 1.00 0.00 H new ATOM 0 HB3 ALA C 31 69.905 0.013 -7.140 1.00 0.00 H new ATOM 490 N GLU C 32 73.651 0.407 -7.909 1.00 0.00 N ATOM 491 CA GLU C 32 74.528 -0.451 -8.757 1.00 0.00 C ATOM 492 C GLU C 32 74.398 -1.919 -8.339 1.00 0.00 C ATOM 493 O GLU C 32 75.023 -2.793 -8.906 1.00 0.00 O ATOM 494 CB GLU C 32 75.948 0.054 -8.499 1.00 0.00 C ATOM 495 CG GLU C 32 76.767 -0.036 -9.788 1.00 0.00 C ATOM 496 CD GLU C 32 76.865 -1.497 -10.232 1.00 0.00 C ATOM 497 OE1 GLU C 32 77.722 -2.195 -9.717 1.00 0.00 O ATOM 498 OE2 GLU C 32 76.082 -1.891 -11.080 1.00 0.00 O ATOM 0 H GLU C 32 74.120 0.874 -7.133 1.00 0.00 H new ATOM 0 HA GLU C 32 74.261 -0.396 -9.812 1.00 0.00 H new ATOM 0 HB2 GLU C 32 75.920 1.085 -8.146 1.00 0.00 H new ATOM 0 HB3 GLU C 32 76.419 -0.539 -7.715 1.00 0.00 H new ATOM 0 HG2 GLU C 32 76.300 0.562 -10.570 1.00 0.00 H new ATOM 0 HG3 GLU C 32 77.764 0.373 -9.627 1.00 0.00 H new ATOM 505 N ASP C 33 73.590 -2.196 -7.352 1.00 0.00 N ATOM 506 CA ASP C 33 73.424 -3.607 -6.899 1.00 0.00 C ATOM 507 C ASP C 33 71.940 -3.988 -6.882 1.00 0.00 C ATOM 508 O ASP C 33 71.566 -5.044 -6.412 1.00 0.00 O ATOM 509 CB ASP C 33 74.001 -3.640 -5.484 1.00 0.00 C ATOM 510 CG ASP C 33 75.377 -4.304 -5.510 1.00 0.00 C ATOM 511 OD1 ASP C 33 75.426 -5.523 -5.539 1.00 0.00 O ATOM 512 OD2 ASP C 33 76.361 -3.582 -5.501 1.00 0.00 O ATOM 0 H ASP C 33 73.038 -1.508 -6.840 1.00 0.00 H new ATOM 0 HA ASP C 33 73.925 -4.313 -7.561 1.00 0.00 H new ATOM 0 HB2 ASP C 33 74.082 -2.627 -5.089 1.00 0.00 H new ATOM 0 HB3 ASP C 33 73.333 -4.189 -4.820 1.00 0.00 H new ATOM 517 N GLY C 34 71.092 -3.138 -7.392 1.00 0.00 N ATOM 518 CA GLY C 34 69.637 -3.455 -7.401 1.00 0.00 C ATOM 519 C GLY C 34 69.088 -3.368 -5.976 1.00 0.00 C ATOM 520 O GLY C 34 68.189 -4.092 -5.601 1.00 0.00 O ATOM 0 H GLY C 34 71.344 -2.239 -7.802 1.00 0.00 H new ATOM 0 HA2 GLY C 34 69.106 -2.759 -8.050 1.00 0.00 H new ATOM 0 HA3 GLY C 34 69.474 -4.454 -7.805 1.00 0.00 H new ATOM 524 N CYS C 35 69.623 -2.484 -5.180 1.00 0.00 N ATOM 525 CA CYS C 35 69.134 -2.351 -3.778 1.00 0.00 C ATOM 526 C CYS C 35 68.764 -0.894 -3.486 1.00 0.00 C ATOM 527 O CYS C 35 68.521 -0.114 -4.385 1.00 0.00 O ATOM 528 CB CYS C 35 70.309 -2.795 -2.907 1.00 0.00 C ATOM 529 SG CYS C 35 71.645 -1.581 -3.030 1.00 0.00 S ATOM 0 H CYS C 35 70.377 -1.848 -5.439 1.00 0.00 H new ATOM 0 HA CYS C 35 68.241 -2.948 -3.590 1.00 0.00 H new ATOM 0 HB2 CYS C 35 69.989 -2.895 -1.870 1.00 0.00 H new ATOM 0 HB3 CYS C 35 70.663 -3.775 -3.228 1.00 0.00 H new ATOM 0 HG CYS C 35 72.643 -1.958 -2.287 1.00 0.00 H new ATOM 535 N ILE C 36 68.716 -0.520 -2.236 1.00 0.00 N ATOM 536 CA ILE C 36 68.358 0.889 -1.895 1.00 0.00 C ATOM 537 C ILE C 36 69.362 1.468 -0.893 1.00 0.00 C ATOM 538 O ILE C 36 69.949 0.757 -0.101 1.00 0.00 O ATOM 539 CB ILE C 36 66.964 0.805 -1.273 1.00 0.00 C ATOM 540 CG1 ILE C 36 66.016 0.086 -2.235 1.00 0.00 C ATOM 541 CG2 ILE C 36 66.439 2.217 -1.006 1.00 0.00 C ATOM 542 CD1 ILE C 36 64.813 -0.453 -1.458 1.00 0.00 C ATOM 0 H ILE C 36 68.908 -1.126 -1.438 1.00 0.00 H new ATOM 0 HA ILE C 36 68.376 1.540 -2.769 1.00 0.00 H new ATOM 0 HB ILE C 36 67.019 0.252 -0.335 1.00 0.00 H new ATOM 0 HG12 ILE C 36 65.682 0.772 -3.014 1.00 0.00 H new ATOM 0 HG13 ILE C 36 66.537 -0.732 -2.733 1.00 0.00 H new ATOM 0 HG21 ILE C 36 65.445 2.158 -0.563 1.00 0.00 H new ATOM 0 HG22 ILE C 36 67.112 2.732 -0.321 1.00 0.00 H new ATOM 0 HG23 ILE C 36 66.385 2.769 -1.945 1.00 0.00 H new ATOM 0 HD11 ILE C 36 64.137 -0.965 -2.143 1.00 0.00 H new ATOM 0 HD12 ILE C 36 65.156 -1.153 -0.696 1.00 0.00 H new ATOM 0 HD13 ILE C 36 64.288 0.374 -0.981 1.00 0.00 H new ATOM 554 N SER C 37 69.561 2.757 -0.927 1.00 0.00 N ATOM 555 CA SER C 37 70.524 3.401 0.015 1.00 0.00 C ATOM 556 C SER C 37 70.195 4.884 0.154 1.00 0.00 C ATOM 557 O SER C 37 71.065 5.729 0.143 1.00 0.00 O ATOM 558 CB SER C 37 71.878 3.237 -0.645 1.00 0.00 C ATOM 559 OG SER C 37 72.519 2.074 -0.137 1.00 0.00 O ATOM 0 H SER C 37 69.096 3.397 -1.571 1.00 0.00 H new ATOM 0 HA SER C 37 70.490 2.959 1.011 1.00 0.00 H new ATOM 0 HB2 SER C 37 71.760 3.157 -1.726 1.00 0.00 H new ATOM 0 HB3 SER C 37 72.494 4.116 -0.456 1.00 0.00 H new ATOM 0 HG SER C 37 72.708 1.456 -0.874 1.00 0.00 H new ATOM 565 N THR C 38 68.939 5.190 0.255 1.00 0.00 N ATOM 566 CA THR C 38 68.486 6.615 0.370 1.00 0.00 C ATOM 567 C THR C 38 68.642 7.306 -0.986 1.00 0.00 C ATOM 568 O THR C 38 67.701 7.859 -1.520 1.00 0.00 O ATOM 569 CB THR C 38 69.365 7.291 1.435 1.00 0.00 C ATOM 570 OG1 THR C 38 70.534 7.822 0.829 1.00 0.00 O ATOM 571 CG2 THR C 38 69.752 6.284 2.521 1.00 0.00 C ATOM 0 H THR C 38 68.184 4.505 0.264 1.00 0.00 H new ATOM 0 HA THR C 38 67.437 6.678 0.661 1.00 0.00 H new ATOM 0 HB THR C 38 68.800 8.102 1.895 1.00 0.00 H new ATOM 0 HG1 THR C 38 71.158 7.094 0.628 1.00 0.00 H new ATOM 0 HG21 THR C 38 70.374 6.776 3.268 1.00 0.00 H new ATOM 0 HG22 THR C 38 68.851 5.898 2.997 1.00 0.00 H new ATOM 0 HG23 THR C 38 70.307 5.460 2.072 1.00 0.00 H new ATOM 579 N LYS C 39 69.814 7.263 -1.561 1.00 0.00 N ATOM 580 CA LYS C 39 70.002 7.901 -2.893 1.00 0.00 C ATOM 581 C LYS C 39 68.907 7.406 -3.839 1.00 0.00 C ATOM 582 O LYS C 39 68.430 8.127 -4.694 1.00 0.00 O ATOM 583 CB LYS C 39 71.379 7.433 -3.369 1.00 0.00 C ATOM 584 CG LYS C 39 72.229 8.647 -3.744 1.00 0.00 C ATOM 585 CD LYS C 39 73.711 8.295 -3.604 1.00 0.00 C ATOM 586 CE LYS C 39 74.473 8.804 -4.829 1.00 0.00 C ATOM 587 NZ LYS C 39 75.878 8.354 -4.623 1.00 0.00 N ATOM 0 H LYS C 39 70.643 6.817 -1.168 1.00 0.00 H new ATOM 0 HA LYS C 39 69.943 8.989 -2.857 1.00 0.00 H new ATOM 0 HB2 LYS C 39 71.871 6.860 -2.584 1.00 0.00 H new ATOM 0 HB3 LYS C 39 71.273 6.771 -4.228 1.00 0.00 H new ATOM 0 HG2 LYS C 39 72.012 8.954 -4.767 1.00 0.00 H new ATOM 0 HG3 LYS C 39 71.982 9.490 -3.099 1.00 0.00 H new ATOM 0 HD2 LYS C 39 74.118 8.742 -2.697 1.00 0.00 H new ATOM 0 HD3 LYS C 39 73.832 7.216 -3.509 1.00 0.00 H new ATOM 0 HE2 LYS C 39 74.058 8.394 -5.750 1.00 0.00 H new ATOM 0 HE3 LYS C 39 74.414 9.890 -4.908 1.00 0.00 H new ATOM 0 HZ1 LYS C 39 76.463 8.666 -5.424 1.00 0.00 H new ATOM 0 HZ2 LYS C 39 76.249 8.765 -3.742 1.00 0.00 H new ATOM 0 HZ3 LYS C 39 75.904 7.316 -4.559 1.00 0.00 H new ATOM 601 N GLU C 40 68.497 6.179 -3.673 1.00 0.00 N ATOM 602 CA GLU C 40 67.419 5.620 -4.536 1.00 0.00 C ATOM 603 C GLU C 40 66.067 5.791 -3.839 1.00 0.00 C ATOM 604 O GLU C 40 65.031 5.855 -4.470 1.00 0.00 O ATOM 605 CB GLU C 40 67.755 4.134 -4.689 1.00 0.00 C ATOM 606 CG GLU C 40 69.243 3.965 -5.004 1.00 0.00 C ATOM 607 CD GLU C 40 70.019 3.729 -3.707 1.00 0.00 C ATOM 608 OE1 GLU C 40 70.374 4.704 -3.067 1.00 0.00 O ATOM 609 OE2 GLU C 40 70.244 2.576 -3.377 1.00 0.00 O ATOM 0 H GLU C 40 68.865 5.536 -2.972 1.00 0.00 H new ATOM 0 HA GLU C 40 67.357 6.120 -5.503 1.00 0.00 H new ATOM 0 HB2 GLU C 40 67.506 3.600 -3.772 1.00 0.00 H new ATOM 0 HB3 GLU C 40 67.154 3.697 -5.486 1.00 0.00 H new ATOM 0 HG2 GLU C 40 69.388 3.126 -5.684 1.00 0.00 H new ATOM 0 HG3 GLU C 40 69.621 4.854 -5.509 1.00 0.00 H new ATOM 616 N LEU C 41 66.076 5.860 -2.533 1.00 0.00 N ATOM 617 CA LEU C 41 64.801 6.021 -1.776 1.00 0.00 C ATOM 618 C LEU C 41 64.375 7.491 -1.759 1.00 0.00 C ATOM 619 O LEU C 41 63.288 7.836 -2.176 1.00 0.00 O ATOM 620 CB LEU C 41 65.125 5.543 -0.359 1.00 0.00 C ATOM 621 CG LEU C 41 63.836 5.141 0.355 1.00 0.00 C ATOM 622 CD1 LEU C 41 62.858 6.319 0.352 1.00 0.00 C ATOM 623 CD2 LEU C 41 63.204 3.951 -0.369 1.00 0.00 C ATOM 0 H LEU C 41 66.916 5.811 -1.957 1.00 0.00 H new ATOM 0 HA LEU C 41 63.981 5.459 -2.223 1.00 0.00 H new ATOM 0 HB2 LEU C 41 65.810 4.696 -0.398 1.00 0.00 H new ATOM 0 HB3 LEU C 41 65.628 6.335 0.196 1.00 0.00 H new ATOM 0 HG LEU C 41 64.063 4.863 1.384 1.00 0.00 H new ATOM 0 HD11 LEU C 41 61.939 6.030 0.862 1.00 0.00 H new ATOM 0 HD12 LEU C 41 63.308 7.167 0.868 1.00 0.00 H new ATOM 0 HD13 LEU C 41 62.630 6.600 -0.676 1.00 0.00 H new ATOM 0 HD21 LEU C 41 62.284 3.663 0.139 1.00 0.00 H new ATOM 0 HD22 LEU C 41 62.978 4.230 -1.398 1.00 0.00 H new ATOM 0 HD23 LEU C 41 63.899 3.111 -0.365 1.00 0.00 H new ATOM 635 N GLY C 42 65.224 8.356 -1.276 1.00 0.00 N ATOM 636 CA GLY C 42 64.870 9.804 -1.228 1.00 0.00 C ATOM 637 C GLY C 42 64.192 10.212 -2.537 1.00 0.00 C ATOM 638 O GLY C 42 63.268 11.001 -2.548 1.00 0.00 O ATOM 0 H GLY C 42 66.148 8.123 -0.912 1.00 0.00 H new ATOM 0 HA2 GLY C 42 64.205 9.998 -0.387 1.00 0.00 H new ATOM 0 HA3 GLY C 42 65.767 10.403 -1.070 1.00 0.00 H new ATOM 642 N LYS C 43 64.644 9.683 -3.641 1.00 0.00 N ATOM 643 CA LYS C 43 64.025 10.043 -4.948 1.00 0.00 C ATOM 644 C LYS C 43 62.499 9.977 -4.849 1.00 0.00 C ATOM 645 O LYS C 43 61.794 10.772 -5.439 1.00 0.00 O ATOM 646 CB LYS C 43 64.545 8.996 -5.933 1.00 0.00 C ATOM 647 CG LYS C 43 65.525 9.653 -6.907 1.00 0.00 C ATOM 648 CD LYS C 43 64.779 10.095 -8.164 1.00 0.00 C ATOM 649 CE LYS C 43 65.241 11.497 -8.567 1.00 0.00 C ATOM 650 NZ LYS C 43 64.491 11.804 -9.816 1.00 0.00 N ATOM 0 H LYS C 43 65.415 9.017 -3.694 1.00 0.00 H new ATOM 0 HA LYS C 43 64.277 11.057 -5.259 1.00 0.00 H new ATOM 0 HB2 LYS C 43 65.039 8.188 -5.394 1.00 0.00 H new ATOM 0 HB3 LYS C 43 63.714 8.552 -6.481 1.00 0.00 H new ATOM 0 HG2 LYS C 43 66.003 10.511 -6.435 1.00 0.00 H new ATOM 0 HG3 LYS C 43 66.317 8.952 -7.170 1.00 0.00 H new ATOM 0 HD2 LYS C 43 64.965 9.392 -8.976 1.00 0.00 H new ATOM 0 HD3 LYS C 43 63.704 10.093 -7.981 1.00 0.00 H new ATOM 0 HE2 LYS C 43 65.022 12.225 -7.786 1.00 0.00 H new ATOM 0 HE3 LYS C 43 66.317 11.525 -8.736 1.00 0.00 H new ATOM 0 HZ1 LYS C 43 64.754 12.751 -10.155 1.00 0.00 H new ATOM 0 HZ2 LYS C 43 64.725 11.099 -10.544 1.00 0.00 H new ATOM 0 HZ3 LYS C 43 63.469 11.777 -9.623 1.00 0.00 H new ATOM 664 N VAL C 44 61.982 9.036 -4.106 1.00 0.00 N ATOM 665 CA VAL C 44 60.503 8.923 -3.970 1.00 0.00 C ATOM 666 C VAL C 44 59.972 10.037 -3.065 1.00 0.00 C ATOM 667 O VAL C 44 58.884 10.542 -3.259 1.00 0.00 O ATOM 668 CB VAL C 44 60.271 7.554 -3.334 1.00 0.00 C ATOM 669 CG1 VAL C 44 58.788 7.394 -2.999 1.00 0.00 C ATOM 670 CG2 VAL C 44 60.693 6.459 -4.317 1.00 0.00 C ATOM 0 H VAL C 44 62.520 8.341 -3.588 1.00 0.00 H new ATOM 0 HA VAL C 44 59.988 9.020 -4.926 1.00 0.00 H new ATOM 0 HB VAL C 44 60.861 7.471 -2.421 1.00 0.00 H new ATOM 0 HG11 VAL C 44 58.621 6.417 -2.545 1.00 0.00 H new ATOM 0 HG12 VAL C 44 58.486 8.175 -2.301 1.00 0.00 H new ATOM 0 HG13 VAL C 44 58.198 7.476 -3.912 1.00 0.00 H new ATOM 0 HG21 VAL C 44 60.528 5.481 -3.865 1.00 0.00 H new ATOM 0 HG22 VAL C 44 60.102 6.541 -5.229 1.00 0.00 H new ATOM 0 HG23 VAL C 44 61.750 6.574 -4.558 1.00 0.00 H new ATOM 680 N MET C 45 60.732 10.426 -2.077 1.00 0.00 N ATOM 681 CA MET C 45 60.269 11.509 -1.166 1.00 0.00 C ATOM 682 C MET C 45 59.966 12.774 -1.972 1.00 0.00 C ATOM 683 O MET C 45 58.989 13.456 -1.733 1.00 0.00 O ATOM 684 CB MET C 45 61.436 11.747 -0.207 1.00 0.00 C ATOM 685 CG MET C 45 61.313 10.803 0.990 1.00 0.00 C ATOM 686 SD MET C 45 61.390 9.087 0.419 1.00 0.00 S ATOM 687 CE MET C 45 59.613 8.849 0.172 1.00 0.00 C ATOM 0 H MET C 45 61.652 10.041 -1.862 1.00 0.00 H new ATOM 0 HA MET C 45 59.356 11.243 -0.633 1.00 0.00 H new ATOM 0 HB2 MET C 45 62.383 11.579 -0.720 1.00 0.00 H new ATOM 0 HB3 MET C 45 61.437 12.783 0.132 1.00 0.00 H new ATOM 0 HG2 MET C 45 62.115 10.996 1.703 1.00 0.00 H new ATOM 0 HG3 MET C 45 60.373 10.982 1.512 1.00 0.00 H new ATOM 0 HE1 MET C 45 59.434 7.862 -0.253 1.00 0.00 H new ATOM 0 HE2 MET C 45 59.098 8.930 1.129 1.00 0.00 H new ATOM 0 HE3 MET C 45 59.235 9.612 -0.509 1.00 0.00 H new ATOM 697 N ARG C 46 60.794 13.089 -2.930 1.00 0.00 N ATOM 698 CA ARG C 46 60.550 14.304 -3.756 1.00 0.00 C ATOM 699 C ARG C 46 59.314 14.095 -4.634 1.00 0.00 C ATOM 700 O ARG C 46 58.610 15.027 -4.966 1.00 0.00 O ATOM 701 CB ARG C 46 61.803 14.456 -4.619 1.00 0.00 C ATOM 702 CG ARG C 46 62.681 15.574 -4.053 1.00 0.00 C ATOM 703 CD ARG C 46 63.181 16.460 -5.196 1.00 0.00 C ATOM 704 NE ARG C 46 64.482 15.862 -5.606 1.00 0.00 N ATOM 705 CZ ARG C 46 65.451 15.747 -4.739 1.00 0.00 C ATOM 706 NH1 ARG C 46 65.503 16.546 -3.708 1.00 0.00 N ATOM 707 NH2 ARG C 46 66.367 14.831 -4.902 1.00 0.00 N ATOM 0 H ARG C 46 61.629 12.557 -3.176 1.00 0.00 H new ATOM 0 HA ARG C 46 60.367 15.191 -3.149 1.00 0.00 H new ATOM 0 HB2 ARG C 46 62.359 13.518 -4.640 1.00 0.00 H new ATOM 0 HB3 ARG C 46 61.523 14.684 -5.648 1.00 0.00 H new ATOM 0 HG2 ARG C 46 62.113 16.170 -3.339 1.00 0.00 H new ATOM 0 HG3 ARG C 46 63.526 15.148 -3.512 1.00 0.00 H new ATOM 0 HD2 ARG C 46 62.473 16.472 -6.025 1.00 0.00 H new ATOM 0 HD3 ARG C 46 63.307 17.492 -4.869 1.00 0.00 H new ATOM 0 HE ARG C 46 64.616 15.542 -6.565 1.00 0.00 H new ATOM 0 HH11 ARG C 46 64.786 17.260 -3.580 1.00 0.00 H new ATOM 0 HH12 ARG C 46 66.260 16.456 -3.031 1.00 0.00 H new ATOM 0 HH21 ARG C 46 66.325 14.206 -5.707 1.00 0.00 H new ATOM 0 HH22 ARG C 46 67.124 14.741 -4.225 1.00 0.00 H new ATOM 721 N MET C 47 59.043 12.873 -5.007 1.00 0.00 N ATOM 722 CA MET C 47 57.850 12.602 -5.859 1.00 0.00 C ATOM 723 C MET C 47 56.590 12.547 -4.991 1.00 0.00 C ATOM 724 O MET C 47 55.509 12.884 -5.427 1.00 0.00 O ATOM 725 CB MET C 47 58.121 11.243 -6.506 1.00 0.00 C ATOM 726 CG MET C 47 58.791 11.453 -7.866 1.00 0.00 C ATOM 727 SD MET C 47 58.541 9.986 -8.895 1.00 0.00 S ATOM 728 CE MET C 47 59.402 8.809 -7.823 1.00 0.00 C ATOM 0 H MET C 47 59.595 12.052 -4.759 1.00 0.00 H new ATOM 0 HA MET C 47 57.689 13.378 -6.607 1.00 0.00 H new ATOM 0 HB2 MET C 47 58.762 10.642 -5.861 1.00 0.00 H new ATOM 0 HB3 MET C 47 57.188 10.694 -6.629 1.00 0.00 H new ATOM 0 HG2 MET C 47 58.372 12.331 -8.358 1.00 0.00 H new ATOM 0 HG3 MET C 47 59.857 11.640 -7.733 1.00 0.00 H new ATOM 0 HE1 MET C 47 59.371 7.817 -8.273 1.00 0.00 H new ATOM 0 HE2 MET C 47 60.440 9.120 -7.701 1.00 0.00 H new ATOM 0 HE3 MET C 47 58.915 8.781 -6.848 1.00 0.00 H new ATOM 738 N LEU C 48 56.724 12.129 -3.760 1.00 0.00 N ATOM 739 CA LEU C 48 55.534 12.059 -2.864 1.00 0.00 C ATOM 740 C LEU C 48 55.036 13.469 -2.543 1.00 0.00 C ATOM 741 O LEU C 48 54.003 13.650 -1.930 1.00 0.00 O ATOM 742 CB LEU C 48 56.031 11.372 -1.590 1.00 0.00 C ATOM 743 CG LEU C 48 56.116 9.861 -1.812 1.00 0.00 C ATOM 744 CD1 LEU C 48 56.398 9.167 -0.480 1.00 0.00 C ATOM 745 CD2 LEU C 48 54.789 9.351 -2.370 1.00 0.00 C ATOM 0 H LEU C 48 57.604 11.834 -3.338 1.00 0.00 H new ATOM 0 HA LEU C 48 54.706 11.519 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU C 48 57.010 11.763 -1.314 1.00 0.00 H new ATOM 0 HB3 LEU C 48 55.356 11.589 -0.762 1.00 0.00 H new ATOM 0 HG LEU C 48 56.918 9.645 -2.518 1.00 0.00 H new ATOM 0 HD11 LEU C 48 56.459 8.090 -0.637 1.00 0.00 H new ATOM 0 HD12 LEU C 48 57.343 9.529 -0.074 1.00 0.00 H new ATOM 0 HD13 LEU C 48 55.594 9.387 0.222 1.00 0.00 H new ATOM 0 HD21 LEU C 48 54.850 8.274 -2.528 1.00 0.00 H new ATOM 0 HD22 LEU C 48 53.989 9.569 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU C 48 54.579 9.845 -3.318 1.00 0.00 H new ATOM 757 N GLY C 49 55.768 14.470 -2.948 1.00 0.00 N ATOM 758 CA GLY C 49 55.340 15.867 -2.660 1.00 0.00 C ATOM 759 C GLY C 49 56.030 16.353 -1.385 1.00 0.00 C ATOM 760 O GLY C 49 55.552 17.243 -0.708 1.00 0.00 O ATOM 0 H GLY C 49 56.643 14.381 -3.465 1.00 0.00 H new ATOM 0 HA2 GLY C 49 55.595 16.518 -3.496 1.00 0.00 H new ATOM 0 HA3 GLY C 49 54.257 15.911 -2.541 1.00 0.00 H new ATOM 764 N GLN C 50 57.153 15.776 -1.050 1.00 0.00 N ATOM 765 CA GLN C 50 57.877 16.202 0.182 1.00 0.00 C ATOM 766 C GLN C 50 59.383 15.973 0.014 1.00 0.00 C ATOM 767 O GLN C 50 59.860 15.688 -1.067 1.00 0.00 O ATOM 768 CB GLN C 50 57.323 15.312 1.296 1.00 0.00 C ATOM 769 CG GLN C 50 56.906 16.180 2.484 1.00 0.00 C ATOM 770 CD GLN C 50 56.907 15.335 3.759 1.00 0.00 C ATOM 771 OE1 GLN C 50 56.795 14.126 3.701 1.00 0.00 O ATOM 772 NE2 GLN C 50 57.031 15.923 4.917 1.00 0.00 N ATOM 0 H GLN C 50 57.601 15.027 -1.578 1.00 0.00 H new ATOM 0 HA GLN C 50 57.736 17.261 0.398 1.00 0.00 H new ATOM 0 HB2 GLN C 50 56.468 14.743 0.930 1.00 0.00 H new ATOM 0 HB3 GLN C 50 58.077 14.589 1.607 1.00 0.00 H new ATOM 0 HG2 GLN C 50 57.591 17.021 2.592 1.00 0.00 H new ATOM 0 HG3 GLN C 50 55.914 16.597 2.312 1.00 0.00 H new ATOM 0 HE21 GLN C 50 57.125 16.937 4.966 1.00 0.00 H new ATOM 0 HE22 GLN C 50 57.034 15.368 5.773 1.00 0.00 H new ATOM 781 N ASN C 51 60.133 16.096 1.075 1.00 0.00 N ATOM 782 CA ASN C 51 61.607 15.885 0.979 1.00 0.00 C ATOM 783 C ASN C 51 62.244 15.962 2.370 1.00 0.00 C ATOM 784 O ASN C 51 62.556 17.032 2.854 1.00 0.00 O ATOM 785 CB ASN C 51 62.115 17.022 0.089 1.00 0.00 C ATOM 786 CG ASN C 51 61.841 18.366 0.767 1.00 0.00 C ATOM 787 OD1 ASN C 51 60.874 18.510 1.490 1.00 0.00 O ATOM 788 ND2 ASN C 51 62.657 19.364 0.565 1.00 0.00 N ATOM 0 H ASN C 51 59.789 16.334 2.005 1.00 0.00 H new ATOM 0 HA ASN C 51 61.858 14.907 0.570 1.00 0.00 H new ATOM 0 HB2 ASN C 51 63.184 16.906 -0.092 1.00 0.00 H new ATOM 0 HB3 ASN C 51 61.621 16.986 -0.882 1.00 0.00 H new ATOM 0 HD21 ASN C 51 62.483 20.264 1.013 1.00 0.00 H new ATOM 0 HD22 ASN C 51 63.469 19.245 -0.041 1.00 0.00 H new ATOM 795 N PRO C 52 62.410 14.814 2.968 1.00 0.00 N ATOM 796 CA PRO C 52 63.010 14.736 4.322 1.00 0.00 C ATOM 797 C PRO C 52 64.523 14.962 4.255 1.00 0.00 C ATOM 798 O PRO C 52 65.061 15.331 3.231 1.00 0.00 O ATOM 799 CB PRO C 52 62.697 13.311 4.769 1.00 0.00 C ATOM 800 CG PRO C 52 62.529 12.531 3.502 1.00 0.00 C ATOM 801 CD PRO C 52 62.056 13.492 2.442 1.00 0.00 C ATOM 0 HA PRO C 52 62.621 15.491 5.005 1.00 0.00 H new ATOM 0 HB2 PRO C 52 63.503 12.903 5.379 1.00 0.00 H new ATOM 0 HB3 PRO C 52 61.791 13.278 5.375 1.00 0.00 H new ATOM 0 HG2 PRO C 52 63.471 12.068 3.208 1.00 0.00 H new ATOM 0 HG3 PRO C 52 61.808 11.726 3.640 1.00 0.00 H new ATOM 0 HD2 PRO C 52 62.543 13.301 1.486 1.00 0.00 H new ATOM 0 HD3 PRO C 52 60.982 13.404 2.276 1.00 0.00 H new ATOM 809 N THR C 53 65.211 14.741 5.342 1.00 0.00 N ATOM 810 CA THR C 53 66.689 14.940 5.344 1.00 0.00 C ATOM 811 C THR C 53 67.397 13.639 4.955 1.00 0.00 C ATOM 812 O THR C 53 66.793 12.585 4.934 1.00 0.00 O ATOM 813 CB THR C 53 67.033 15.331 6.782 1.00 0.00 C ATOM 814 OG1 THR C 53 66.173 14.641 7.678 1.00 0.00 O ATOM 815 CG2 THR C 53 66.856 16.839 6.960 1.00 0.00 C ATOM 0 H THR C 53 64.814 14.431 6.229 1.00 0.00 H new ATOM 0 HA THR C 53 67.006 15.699 4.629 1.00 0.00 H new ATOM 0 HB THR C 53 68.068 15.063 6.993 1.00 0.00 H new ATOM 0 HG1 THR C 53 66.394 14.889 8.600 1.00 0.00 H new ATOM 0 HG21 THR C 53 67.102 17.116 7.985 1.00 0.00 H new ATOM 0 HG22 THR C 53 67.518 17.367 6.273 1.00 0.00 H new ATOM 0 HG23 THR C 53 65.822 17.111 6.748 1.00 0.00 H new ATOM 823 N PRO C 54 68.660 13.763 4.653 1.00 0.00 N ATOM 824 CA PRO C 54 69.469 12.586 4.254 1.00 0.00 C ATOM 825 C PRO C 54 69.789 11.711 5.470 1.00 0.00 C ATOM 826 O PRO C 54 70.087 10.540 5.342 1.00 0.00 O ATOM 827 CB PRO C 54 70.741 13.204 3.682 1.00 0.00 C ATOM 828 CG PRO C 54 70.848 14.547 4.331 1.00 0.00 C ATOM 829 CD PRO C 54 69.447 15.001 4.655 1.00 0.00 C ATOM 0 HA PRO C 54 68.956 11.938 3.544 1.00 0.00 H new ATOM 0 HB2 PRO C 54 71.613 12.588 3.904 1.00 0.00 H new ATOM 0 HB3 PRO C 54 70.682 13.294 2.597 1.00 0.00 H new ATOM 0 HG2 PRO C 54 71.452 14.489 5.236 1.00 0.00 H new ATOM 0 HG3 PRO C 54 71.338 15.258 3.665 1.00 0.00 H new ATOM 0 HD2 PRO C 54 69.403 15.499 5.623 1.00 0.00 H new ATOM 0 HD3 PRO C 54 69.077 15.710 3.915 1.00 0.00 H new ATOM 837 N GLU C 55 69.736 12.269 6.648 1.00 0.00 N ATOM 838 CA GLU C 55 70.044 11.467 7.867 1.00 0.00 C ATOM 839 C GLU C 55 68.854 10.576 8.238 1.00 0.00 C ATOM 840 O GLU C 55 69.020 9.450 8.665 1.00 0.00 O ATOM 841 CB GLU C 55 70.305 12.498 8.966 1.00 0.00 C ATOM 842 CG GLU C 55 70.997 11.822 10.150 1.00 0.00 C ATOM 843 CD GLU C 55 72.284 11.147 9.672 1.00 0.00 C ATOM 844 OE1 GLU C 55 73.302 11.819 9.627 1.00 0.00 O ATOM 845 OE2 GLU C 55 72.231 9.968 9.361 1.00 0.00 O ATOM 0 H GLU C 55 69.493 13.245 6.820 1.00 0.00 H new ATOM 0 HA GLU C 55 70.897 10.805 7.717 1.00 0.00 H new ATOM 0 HB2 GLU C 55 70.928 13.305 8.581 1.00 0.00 H new ATOM 0 HB3 GLU C 55 69.365 12.946 9.289 1.00 0.00 H new ATOM 0 HG2 GLU C 55 71.225 12.559 10.921 1.00 0.00 H new ATOM 0 HG3 GLU C 55 70.333 11.084 10.600 1.00 0.00 H new ATOM 852 N GLU C 56 67.656 11.070 8.081 1.00 0.00 N ATOM 853 CA GLU C 56 66.461 10.247 8.429 1.00 0.00 C ATOM 854 C GLU C 56 66.282 9.112 7.418 1.00 0.00 C ATOM 855 O GLU C 56 65.858 8.025 7.759 1.00 0.00 O ATOM 856 CB GLU C 56 65.278 11.214 8.361 1.00 0.00 C ATOM 857 CG GLU C 56 64.116 10.656 9.185 1.00 0.00 C ATOM 858 CD GLU C 56 63.130 11.780 9.503 1.00 0.00 C ATOM 859 OE1 GLU C 56 62.253 12.020 8.689 1.00 0.00 O ATOM 860 OE2 GLU C 56 63.266 12.379 10.556 1.00 0.00 O ATOM 0 H GLU C 56 67.453 12.005 7.728 1.00 0.00 H new ATOM 0 HA GLU C 56 66.555 9.784 9.411 1.00 0.00 H new ATOM 0 HB2 GLU C 56 65.572 12.192 8.742 1.00 0.00 H new ATOM 0 HB3 GLU C 56 64.969 11.355 7.325 1.00 0.00 H new ATOM 0 HG2 GLU C 56 63.613 9.862 8.633 1.00 0.00 H new ATOM 0 HG3 GLU C 56 64.490 10.214 10.108 1.00 0.00 H new ATOM 867 N LEU C 57 66.599 9.353 6.175 1.00 0.00 N ATOM 868 CA LEU C 57 66.442 8.285 5.146 1.00 0.00 C ATOM 869 C LEU C 57 67.147 7.004 5.602 1.00 0.00 C ATOM 870 O LEU C 57 66.556 5.945 5.659 1.00 0.00 O ATOM 871 CB LEU C 57 67.107 8.845 3.889 1.00 0.00 C ATOM 872 CG LEU C 57 66.032 9.261 2.883 1.00 0.00 C ATOM 873 CD1 LEU C 57 66.696 9.669 1.568 1.00 0.00 C ATOM 874 CD2 LEU C 57 65.085 8.084 2.629 1.00 0.00 C ATOM 0 H LEU C 57 66.959 10.242 5.828 1.00 0.00 H new ATOM 0 HA LEU C 57 65.397 8.028 4.973 1.00 0.00 H new ATOM 0 HB2 LEU C 57 67.730 9.702 4.146 1.00 0.00 H new ATOM 0 HB3 LEU C 57 67.763 8.095 3.447 1.00 0.00 H new ATOM 0 HG LEU C 57 65.467 10.103 3.284 1.00 0.00 H new ATOM 0 HD11 LEU C 57 65.931 9.966 0.851 1.00 0.00 H new ATOM 0 HD12 LEU C 57 67.371 10.506 1.746 1.00 0.00 H new ATOM 0 HD13 LEU C 57 67.261 8.826 1.169 1.00 0.00 H new ATOM 0 HD21 LEU C 57 64.319 8.381 1.912 1.00 0.00 H new ATOM 0 HD22 LEU C 57 65.650 7.242 2.228 1.00 0.00 H new ATOM 0 HD23 LEU C 57 64.611 7.790 3.565 1.00 0.00 H new ATOM 886 N GLN C 58 68.408 7.093 5.926 1.00 0.00 N ATOM 887 CA GLN C 58 69.150 5.882 6.378 1.00 0.00 C ATOM 888 C GLN C 58 68.313 5.098 7.394 1.00 0.00 C ATOM 889 O GLN C 58 68.353 3.885 7.439 1.00 0.00 O ATOM 890 CB GLN C 58 70.422 6.418 7.033 1.00 0.00 C ATOM 891 CG GLN C 58 71.631 5.633 6.521 1.00 0.00 C ATOM 892 CD GLN C 58 72.144 4.707 7.627 1.00 0.00 C ATOM 893 OE1 GLN C 58 72.674 5.164 8.620 1.00 0.00 O ATOM 894 NE2 GLN C 58 72.007 3.417 7.495 1.00 0.00 N ATOM 0 H GLN C 58 68.957 7.952 5.897 1.00 0.00 H new ATOM 0 HA GLN C 58 69.371 5.202 5.555 1.00 0.00 H new ATOM 0 HB2 GLN C 58 70.541 7.478 6.807 1.00 0.00 H new ATOM 0 HB3 GLN C 58 70.350 6.329 8.117 1.00 0.00 H new ATOM 0 HG2 GLN C 58 71.354 5.050 5.643 1.00 0.00 H new ATOM 0 HG3 GLN C 58 72.419 6.319 6.212 1.00 0.00 H new ATOM 0 HE21 GLN C 58 71.562 3.034 6.661 1.00 0.00 H new ATOM 0 HE22 GLN C 58 72.345 2.791 8.226 1.00 0.00 H new ATOM 903 N GLU C 59 67.556 5.781 8.208 1.00 0.00 N ATOM 904 CA GLU C 59 66.720 5.071 9.218 1.00 0.00 C ATOM 905 C GLU C 59 65.788 4.074 8.524 1.00 0.00 C ATOM 906 O GLU C 59 65.709 2.921 8.898 1.00 0.00 O ATOM 907 CB GLU C 59 65.914 6.169 9.911 1.00 0.00 C ATOM 908 CG GLU C 59 66.034 6.009 11.428 1.00 0.00 C ATOM 909 CD GLU C 59 67.083 6.984 11.964 1.00 0.00 C ATOM 910 OE1 GLU C 59 66.860 8.179 11.861 1.00 0.00 O ATOM 911 OE2 GLU C 59 68.093 6.519 12.468 1.00 0.00 O ATOM 0 H GLU C 59 67.480 6.798 8.218 1.00 0.00 H new ATOM 0 HA GLU C 59 67.322 4.502 9.927 1.00 0.00 H new ATOM 0 HB2 GLU C 59 66.280 7.150 9.608 1.00 0.00 H new ATOM 0 HB3 GLU C 59 64.868 6.112 9.610 1.00 0.00 H new ATOM 0 HG2 GLU C 59 65.071 6.199 11.901 1.00 0.00 H new ATOM 0 HG3 GLU C 59 66.314 4.985 11.675 1.00 0.00 H new ATOM 918 N MET C 60 65.084 4.507 7.513 1.00 0.00 N ATOM 919 CA MET C 60 64.162 3.579 6.797 1.00 0.00 C ATOM 920 C MET C 60 64.903 2.294 6.422 1.00 0.00 C ATOM 921 O MET C 60 64.306 1.254 6.232 1.00 0.00 O ATOM 922 CB MET C 60 63.734 4.336 5.540 1.00 0.00 C ATOM 923 CG MET C 60 62.619 5.323 5.893 1.00 0.00 C ATOM 924 SD MET C 60 62.153 6.257 4.415 1.00 0.00 S ATOM 925 CE MET C 60 60.412 5.769 4.378 1.00 0.00 C ATOM 0 H MET C 60 65.107 5.461 7.153 1.00 0.00 H new ATOM 0 HA MET C 60 63.307 3.290 7.408 1.00 0.00 H new ATOM 0 HB2 MET C 60 64.585 4.869 5.116 1.00 0.00 H new ATOM 0 HB3 MET C 60 63.387 3.635 4.781 1.00 0.00 H new ATOM 0 HG2 MET C 60 61.755 4.787 6.286 1.00 0.00 H new ATOM 0 HG3 MET C 60 62.955 6.003 6.676 1.00 0.00 H new ATOM 0 HE1 MET C 60 59.920 6.240 3.527 1.00 0.00 H new ATOM 0 HE2 MET C 60 60.340 4.685 4.284 1.00 0.00 H new ATOM 0 HE3 MET C 60 59.925 6.087 5.300 1.00 0.00 H new ATOM 935 N ILE C 61 66.201 2.361 6.317 1.00 0.00 N ATOM 936 CA ILE C 61 66.985 1.147 5.955 1.00 0.00 C ATOM 937 C ILE C 61 67.398 0.390 7.221 1.00 0.00 C ATOM 938 O ILE C 61 67.450 -0.824 7.240 1.00 0.00 O ATOM 939 CB ILE C 61 68.216 1.677 5.223 1.00 0.00 C ATOM 940 CG1 ILE C 61 67.799 2.226 3.856 1.00 0.00 C ATOM 941 CG2 ILE C 61 69.227 0.545 5.033 1.00 0.00 C ATOM 942 CD1 ILE C 61 67.319 3.670 4.009 1.00 0.00 C ATOM 0 H ILE C 61 66.754 3.205 6.466 1.00 0.00 H new ATOM 0 HA ILE C 61 66.413 0.452 5.341 1.00 0.00 H new ATOM 0 HB ILE C 61 68.672 2.473 5.811 1.00 0.00 H new ATOM 0 HG12 ILE C 61 68.640 2.183 3.163 1.00 0.00 H new ATOM 0 HG13 ILE C 61 67.005 1.611 3.432 1.00 0.00 H new ATOM 0 HG21 ILE C 61 70.105 0.925 4.510 1.00 0.00 H new ATOM 0 HG22 ILE C 61 69.525 0.156 6.007 1.00 0.00 H new ATOM 0 HG23 ILE C 61 68.773 -0.254 4.446 1.00 0.00 H new ATOM 0 HD11 ILE C 61 67.022 4.060 3.035 1.00 0.00 H new ATOM 0 HD12 ILE C 61 66.466 3.700 4.687 1.00 0.00 H new ATOM 0 HD13 ILE C 61 68.126 4.281 4.414 1.00 0.00 H new ATOM 954 N ASP C 62 67.691 1.098 8.276 1.00 0.00 N ATOM 955 CA ASP C 62 68.102 0.421 9.539 1.00 0.00 C ATOM 956 C ASP C 62 66.877 -0.169 10.248 1.00 0.00 C ATOM 957 O ASP C 62 66.892 -1.298 10.695 1.00 0.00 O ATOM 958 CB ASP C 62 68.736 1.522 10.389 1.00 0.00 C ATOM 959 CG ASP C 62 69.300 0.915 11.674 1.00 0.00 C ATOM 960 OD1 ASP C 62 68.793 -0.112 12.094 1.00 0.00 O ATOM 961 OD2 ASP C 62 70.231 1.488 12.217 1.00 0.00 O ATOM 0 H ASP C 62 67.664 2.117 8.319 1.00 0.00 H new ATOM 0 HA ASP C 62 68.791 -0.404 9.360 1.00 0.00 H new ATOM 0 HB2 ASP C 62 69.530 2.016 9.829 1.00 0.00 H new ATOM 0 HB3 ASP C 62 67.994 2.283 10.629 1.00 0.00 H new ATOM 966 N GLU C 63 65.819 0.587 10.355 1.00 0.00 N ATOM 967 CA GLU C 63 64.597 0.068 11.034 1.00 0.00 C ATOM 968 C GLU C 63 64.298 -1.359 10.565 1.00 0.00 C ATOM 969 O GLU C 63 63.744 -2.158 11.294 1.00 0.00 O ATOM 970 CB GLU C 63 63.477 1.018 10.610 1.00 0.00 C ATOM 971 CG GLU C 63 62.233 0.757 11.462 1.00 0.00 C ATOM 972 CD GLU C 63 61.537 2.085 11.765 1.00 0.00 C ATOM 973 OE1 GLU C 63 62.107 3.117 11.450 1.00 0.00 O ATOM 974 OE2 GLU C 63 60.443 2.048 12.307 1.00 0.00 O ATOM 0 H GLU C 63 65.747 1.541 10.002 1.00 0.00 H new ATOM 0 HA GLU C 63 64.710 0.029 12.117 1.00 0.00 H new ATOM 0 HB2 GLU C 63 63.800 2.052 10.727 1.00 0.00 H new ATOM 0 HB3 GLU C 63 63.244 0.874 9.555 1.00 0.00 H new ATOM 0 HG2 GLU C 63 61.552 0.089 10.935 1.00 0.00 H new ATOM 0 HG3 GLU C 63 62.513 0.260 12.391 1.00 0.00 H new ATOM 981 N VAL C 64 64.661 -1.682 9.355 1.00 0.00 N ATOM 982 CA VAL C 64 64.399 -3.057 8.838 1.00 0.00 C ATOM 983 C VAL C 64 65.690 -3.666 8.288 1.00 0.00 C ATOM 984 O VAL C 64 65.687 -4.353 7.287 1.00 0.00 O ATOM 985 CB VAL C 64 63.376 -2.872 7.717 1.00 0.00 C ATOM 986 CG1 VAL C 64 62.133 -2.171 8.268 1.00 0.00 C ATOM 987 CG2 VAL C 64 63.991 -2.020 6.605 1.00 0.00 C ATOM 0 H VAL C 64 65.128 -1.054 8.701 1.00 0.00 H new ATOM 0 HA VAL C 64 64.034 -3.728 9.615 1.00 0.00 H new ATOM 0 HB VAL C 64 63.094 -3.846 7.318 1.00 0.00 H new ATOM 0 HG11 VAL C 64 61.405 -2.040 7.468 1.00 0.00 H new ATOM 0 HG12 VAL C 64 61.695 -2.777 9.061 1.00 0.00 H new ATOM 0 HG13 VAL C 64 62.412 -1.196 8.668 1.00 0.00 H new ATOM 0 HG21 VAL C 64 63.264 -1.887 5.804 1.00 0.00 H new ATOM 0 HG22 VAL C 64 64.272 -1.046 7.006 1.00 0.00 H new ATOM 0 HG23 VAL C 64 64.876 -2.519 6.211 1.00 0.00 H new ATOM 997 N ASP C 65 66.796 -3.414 8.933 1.00 0.00 N ATOM 998 CA ASP C 65 68.087 -3.976 8.444 1.00 0.00 C ATOM 999 C ASP C 65 68.373 -5.319 9.123 1.00 0.00 C ATOM 1000 O ASP C 65 68.516 -5.399 10.327 1.00 0.00 O ATOM 1001 CB ASP C 65 69.141 -2.941 8.838 1.00 0.00 C ATOM 1002 CG ASP C 65 70.524 -3.427 8.401 1.00 0.00 C ATOM 1003 OD1 ASP C 65 70.766 -3.465 7.206 1.00 0.00 O ATOM 1004 OD2 ASP C 65 71.317 -3.752 9.268 1.00 0.00 O ATOM 0 H ASP C 65 66.862 -2.844 9.776 1.00 0.00 H new ATOM 0 HA ASP C 65 68.077 -4.161 7.370 1.00 0.00 H new ATOM 0 HB2 ASP C 65 68.917 -1.982 8.371 1.00 0.00 H new ATOM 0 HB3 ASP C 65 69.124 -2.782 9.916 1.00 0.00 H new ATOM 1009 N GLU C 66 68.458 -6.372 8.358 1.00 0.00 N ATOM 1010 CA GLU C 66 68.737 -7.710 8.956 1.00 0.00 C ATOM 1011 C GLU C 66 70.019 -8.294 8.358 1.00 0.00 C ATOM 1012 O GLU C 66 70.208 -9.493 8.319 1.00 0.00 O ATOM 1013 CB GLU C 66 67.529 -8.570 8.584 1.00 0.00 C ATOM 1014 CG GLU C 66 66.471 -8.461 9.682 1.00 0.00 C ATOM 1015 CD GLU C 66 65.968 -9.860 10.047 1.00 0.00 C ATOM 1016 OE1 GLU C 66 66.688 -10.567 10.731 1.00 0.00 O ATOM 1017 OE2 GLU C 66 64.870 -10.198 9.635 1.00 0.00 O ATOM 0 H GLU C 66 68.346 -6.365 7.344 1.00 0.00 H new ATOM 0 HA GLU C 66 68.882 -7.661 10.035 1.00 0.00 H new ATOM 0 HB2 GLU C 66 67.115 -8.242 7.631 1.00 0.00 H new ATOM 0 HB3 GLU C 66 67.833 -9.609 8.459 1.00 0.00 H new ATOM 0 HG2 GLU C 66 66.893 -7.974 10.561 1.00 0.00 H new ATOM 0 HG3 GLU C 66 65.641 -7.842 9.342 1.00 0.00 H new ATOM 1024 N ASP C 67 70.900 -7.452 7.892 1.00 0.00 N ATOM 1025 CA ASP C 67 72.169 -7.956 7.294 1.00 0.00 C ATOM 1026 C ASP C 67 73.345 -7.073 7.729 1.00 0.00 C ATOM 1027 O ASP C 67 74.443 -7.549 7.938 1.00 0.00 O ATOM 1028 CB ASP C 67 71.959 -7.868 5.782 1.00 0.00 C ATOM 1029 CG ASP C 67 71.331 -6.518 5.427 1.00 0.00 C ATOM 1030 OD1 ASP C 67 71.282 -5.662 6.294 1.00 0.00 O ATOM 1031 OD2 ASP C 67 70.911 -6.364 4.292 1.00 0.00 O ATOM 0 H ASP C 67 70.796 -6.437 7.899 1.00 0.00 H new ATOM 0 HA ASP C 67 72.401 -8.972 7.612 1.00 0.00 H new ATOM 0 HB2 ASP C 67 72.912 -7.984 5.265 1.00 0.00 H new ATOM 0 HB3 ASP C 67 71.314 -8.680 5.447 1.00 0.00 H new ATOM 1036 N GLY C 68 73.125 -5.793 7.865 1.00 0.00 N ATOM 1037 CA GLY C 68 74.230 -4.887 8.284 1.00 0.00 C ATOM 1038 C GLY C 68 74.911 -4.303 7.045 1.00 0.00 C ATOM 1039 O GLY C 68 76.095 -4.032 7.044 1.00 0.00 O ATOM 0 H GLY C 68 72.227 -5.337 7.704 1.00 0.00 H new ATOM 0 HA2 GLY C 68 73.839 -4.084 8.909 1.00 0.00 H new ATOM 0 HA3 GLY C 68 74.955 -5.435 8.886 1.00 0.00 H new ATOM 1043 N SER C 69 74.171 -4.108 5.988 1.00 0.00 N ATOM 1044 CA SER C 69 74.777 -3.542 4.749 1.00 0.00 C ATOM 1045 C SER C 69 74.395 -2.068 4.598 1.00 0.00 C ATOM 1046 O SER C 69 75.033 -1.322 3.881 1.00 0.00 O ATOM 1047 CB SER C 69 74.188 -4.371 3.609 1.00 0.00 C ATOM 1048 OG SER C 69 72.814 -4.044 3.451 1.00 0.00 O ATOM 0 H SER C 69 73.174 -4.316 5.928 1.00 0.00 H new ATOM 0 HA SER C 69 75.866 -3.585 4.763 1.00 0.00 H new ATOM 0 HB2 SER C 69 74.729 -4.174 2.684 1.00 0.00 H new ATOM 0 HB3 SER C 69 74.298 -5.434 3.823 1.00 0.00 H new ATOM 0 HG SER C 69 72.665 -3.681 2.553 1.00 0.00 H new ATOM 1054 N GLY C 70 73.361 -1.641 5.270 1.00 0.00 N ATOM 1055 CA GLY C 70 72.941 -0.216 5.166 1.00 0.00 C ATOM 1056 C GLY C 70 71.994 -0.042 3.977 1.00 0.00 C ATOM 1057 O GLY C 70 71.464 1.026 3.746 1.00 0.00 O ATOM 0 H GLY C 70 72.789 -2.218 5.887 1.00 0.00 H new ATOM 0 HA2 GLY C 70 72.446 0.095 6.086 1.00 0.00 H new ATOM 0 HA3 GLY C 70 73.816 0.423 5.043 1.00 0.00 H new ATOM 1061 N THR C 71 71.776 -1.083 3.221 1.00 0.00 N ATOM 1062 CA THR C 71 70.861 -0.970 2.048 1.00 0.00 C ATOM 1063 C THR C 71 69.627 -1.853 2.256 1.00 0.00 C ATOM 1064 O THR C 71 69.570 -2.650 3.172 1.00 0.00 O ATOM 1065 CB THR C 71 71.680 -1.466 0.855 1.00 0.00 C ATOM 1066 OG1 THR C 71 72.044 -2.823 1.062 1.00 0.00 O ATOM 1067 CG2 THR C 71 72.941 -0.613 0.712 1.00 0.00 C ATOM 0 H THR C 71 72.190 -2.004 3.363 1.00 0.00 H new ATOM 0 HA THR C 71 70.503 0.049 1.900 1.00 0.00 H new ATOM 0 HB THR C 71 71.084 -1.386 -0.054 1.00 0.00 H new ATOM 0 HG1 THR C 71 72.567 -3.142 0.297 1.00 0.00 H new ATOM 0 HG21 THR C 71 73.525 -0.966 -0.138 1.00 0.00 H new ATOM 0 HG22 THR C 71 72.660 0.428 0.552 1.00 0.00 H new ATOM 0 HG23 THR C 71 73.538 -0.692 1.620 1.00 0.00 H new ATOM 1075 N VAL C 72 68.638 -1.718 1.416 1.00 0.00 N ATOM 1076 CA VAL C 72 67.409 -2.550 1.572 1.00 0.00 C ATOM 1077 C VAL C 72 67.152 -3.365 0.302 1.00 0.00 C ATOM 1078 O VAL C 72 67.496 -2.960 -0.791 1.00 0.00 O ATOM 1079 CB VAL C 72 66.277 -1.548 1.800 1.00 0.00 C ATOM 1080 CG1 VAL C 72 64.932 -2.274 1.727 1.00 0.00 C ATOM 1081 CG2 VAL C 72 66.435 -0.906 3.180 1.00 0.00 C ATOM 0 H VAL C 72 68.626 -1.069 0.629 1.00 0.00 H new ATOM 0 HA VAL C 72 67.498 -3.262 2.393 1.00 0.00 H new ATOM 0 HB VAL C 72 66.315 -0.775 1.033 1.00 0.00 H new ATOM 0 HG11 VAL C 72 64.124 -1.561 1.889 1.00 0.00 H new ATOM 0 HG12 VAL C 72 64.819 -2.733 0.745 1.00 0.00 H new ATOM 0 HG13 VAL C 72 64.893 -3.047 2.495 1.00 0.00 H new ATOM 0 HG21 VAL C 72 65.628 -0.191 3.343 1.00 0.00 H new ATOM 0 HG22 VAL C 72 66.396 -1.679 3.948 1.00 0.00 H new ATOM 0 HG23 VAL C 72 67.393 -0.390 3.233 1.00 0.00 H new ATOM 1091 N ASP C 73 66.545 -4.512 0.440 1.00 0.00 N ATOM 1092 CA ASP C 73 66.258 -5.357 -0.753 1.00 0.00 C ATOM 1093 C ASP C 73 64.810 -5.845 -0.707 1.00 0.00 C ATOM 1094 O ASP C 73 64.096 -5.605 0.246 1.00 0.00 O ATOM 1095 CB ASP C 73 67.229 -6.535 -0.647 1.00 0.00 C ATOM 1096 CG ASP C 73 67.547 -7.063 -2.048 1.00 0.00 C ATOM 1097 OD1 ASP C 73 68.481 -6.561 -2.650 1.00 0.00 O ATOM 1098 OD2 ASP C 73 66.850 -7.960 -2.494 1.00 0.00 O ATOM 0 H ASP C 73 66.235 -4.901 1.330 1.00 0.00 H new ATOM 0 HA ASP C 73 66.383 -4.814 -1.690 1.00 0.00 H new ATOM 0 HB2 ASP C 73 68.146 -6.220 -0.149 1.00 0.00 H new ATOM 0 HB3 ASP C 73 66.792 -7.327 -0.039 1.00 0.00 H new ATOM 1103 N PHE C 74 64.369 -6.532 -1.726 1.00 0.00 N ATOM 1104 CA PHE C 74 62.966 -7.034 -1.727 1.00 0.00 C ATOM 1105 C PHE C 74 62.642 -7.681 -0.378 1.00 0.00 C ATOM 1106 O PHE C 74 61.497 -7.775 0.019 1.00 0.00 O ATOM 1107 CB PHE C 74 62.913 -8.073 -2.847 1.00 0.00 C ATOM 1108 CG PHE C 74 61.495 -8.193 -3.352 1.00 0.00 C ATOM 1109 CD1 PHE C 74 60.915 -7.137 -4.065 1.00 0.00 C ATOM 1110 CD2 PHE C 74 60.759 -9.359 -3.107 1.00 0.00 C ATOM 1111 CE1 PHE C 74 59.600 -7.246 -4.533 1.00 0.00 C ATOM 1112 CE2 PHE C 74 59.444 -9.468 -3.575 1.00 0.00 C ATOM 1113 CZ PHE C 74 58.865 -8.412 -4.288 1.00 0.00 C ATOM 0 H PHE C 74 64.917 -6.766 -2.554 1.00 0.00 H new ATOM 0 HA PHE C 74 62.241 -6.235 -1.883 1.00 0.00 H new ATOM 0 HB2 PHE C 74 63.577 -7.781 -3.661 1.00 0.00 H new ATOM 0 HB3 PHE C 74 63.263 -9.038 -2.480 1.00 0.00 H new ATOM 0 HD1 PHE C 74 61.482 -6.238 -4.254 1.00 0.00 H new ATOM 0 HD2 PHE C 74 61.206 -10.174 -2.557 1.00 0.00 H new ATOM 0 HE1 PHE C 74 59.153 -6.431 -5.083 1.00 0.00 H new ATOM 0 HE2 PHE C 74 58.876 -10.367 -3.386 1.00 0.00 H new ATOM 0 HZ PHE C 74 57.851 -8.497 -4.649 1.00 0.00 H new ATOM 1123 N ASP C 75 63.645 -8.125 0.333 1.00 0.00 N ATOM 1124 CA ASP C 75 63.394 -8.763 1.657 1.00 0.00 C ATOM 1125 C ASP C 75 63.180 -7.690 2.729 1.00 0.00 C ATOM 1126 O ASP C 75 62.109 -7.563 3.289 1.00 0.00 O ATOM 1127 CB ASP C 75 64.660 -9.568 1.954 1.00 0.00 C ATOM 1128 CG ASP C 75 64.360 -10.610 3.033 1.00 0.00 C ATOM 1129 OD1 ASP C 75 64.443 -10.266 4.200 1.00 0.00 O ATOM 1130 OD2 ASP C 75 64.052 -11.735 2.673 1.00 0.00 O ATOM 0 H ASP C 75 64.625 -8.073 0.054 1.00 0.00 H new ATOM 0 HA ASP C 75 62.502 -9.390 1.651 1.00 0.00 H new ATOM 0 HB2 ASP C 75 65.013 -10.059 1.047 1.00 0.00 H new ATOM 0 HB3 ASP C 75 65.457 -8.903 2.287 1.00 0.00 H new ATOM 1135 N GLU C 76 64.193 -6.920 3.018 1.00 0.00 N ATOM 1136 CA GLU C 76 64.051 -5.858 4.055 1.00 0.00 C ATOM 1137 C GLU C 76 63.028 -4.810 3.607 1.00 0.00 C ATOM 1138 O GLU C 76 62.440 -4.118 4.414 1.00 0.00 O ATOM 1139 CB GLU C 76 65.442 -5.235 4.174 1.00 0.00 C ATOM 1140 CG GLU C 76 66.406 -6.255 4.783 1.00 0.00 C ATOM 1141 CD GLU C 76 67.748 -5.581 5.072 1.00 0.00 C ATOM 1142 OE1 GLU C 76 67.812 -4.367 4.977 1.00 0.00 O ATOM 1143 OE2 GLU C 76 68.691 -6.292 5.384 1.00 0.00 O ATOM 0 H GLU C 76 65.113 -6.980 2.581 1.00 0.00 H new ATOM 0 HA GLU C 76 63.698 -6.255 5.007 1.00 0.00 H new ATOM 0 HB2 GLU C 76 65.798 -4.923 3.192 1.00 0.00 H new ATOM 0 HB3 GLU C 76 65.400 -4.341 4.796 1.00 0.00 H new ATOM 0 HG2 GLU C 76 65.987 -6.663 5.703 1.00 0.00 H new ATOM 0 HG3 GLU C 76 66.547 -7.091 4.098 1.00 0.00 H new ATOM 1150 N PHE C 77 62.810 -4.689 2.326 1.00 0.00 N ATOM 1151 CA PHE C 77 61.823 -3.686 1.831 1.00 0.00 C ATOM 1152 C PHE C 77 60.404 -4.096 2.233 1.00 0.00 C ATOM 1153 O PHE C 77 59.641 -3.303 2.748 1.00 0.00 O ATOM 1154 CB PHE C 77 61.972 -3.698 0.310 1.00 0.00 C ATOM 1155 CG PHE C 77 60.823 -2.940 -0.312 1.00 0.00 C ATOM 1156 CD1 PHE C 77 60.597 -1.603 0.037 1.00 0.00 C ATOM 1157 CD2 PHE C 77 59.986 -3.572 -1.238 1.00 0.00 C ATOM 1158 CE1 PHE C 77 59.533 -0.900 -0.539 1.00 0.00 C ATOM 1159 CE2 PHE C 77 58.922 -2.869 -1.815 1.00 0.00 C ATOM 1160 CZ PHE C 77 58.695 -1.533 -1.465 1.00 0.00 C ATOM 0 H PHE C 77 63.271 -5.240 1.602 1.00 0.00 H new ATOM 0 HA PHE C 77 61.998 -2.695 2.250 1.00 0.00 H new ATOM 0 HB2 PHE C 77 62.920 -3.243 0.023 1.00 0.00 H new ATOM 0 HB3 PHE C 77 61.986 -4.724 -0.057 1.00 0.00 H new ATOM 0 HD1 PHE C 77 61.244 -1.114 0.751 1.00 0.00 H new ATOM 0 HD2 PHE C 77 60.161 -4.603 -1.508 1.00 0.00 H new ATOM 0 HE1 PHE C 77 59.358 0.131 -0.269 1.00 0.00 H new ATOM 0 HE2 PHE C 77 58.276 -3.357 -2.530 1.00 0.00 H new ATOM 0 HZ PHE C 77 57.874 -0.990 -1.909 1.00 0.00 H new ATOM 1170 N LEU C 78 60.045 -5.329 2.002 1.00 0.00 N ATOM 1171 CA LEU C 78 58.674 -5.785 2.370 1.00 0.00 C ATOM 1172 C LEU C 78 58.370 -5.425 3.826 1.00 0.00 C ATOM 1173 O LEU C 78 57.339 -4.860 4.132 1.00 0.00 O ATOM 1174 CB LEU C 78 58.695 -7.302 2.181 1.00 0.00 C ATOM 1175 CG LEU C 78 58.283 -7.640 0.747 1.00 0.00 C ATOM 1176 CD1 LEU C 78 58.554 -9.119 0.470 1.00 0.00 C ATOM 1177 CD2 LEU C 78 56.791 -7.354 0.565 1.00 0.00 C ATOM 0 H LEU C 78 60.640 -6.039 1.575 1.00 0.00 H new ATOM 0 HA LEU C 78 57.904 -5.312 1.761 1.00 0.00 H new ATOM 0 HB2 LEU C 78 59.692 -7.692 2.386 1.00 0.00 H new ATOM 0 HB3 LEU C 78 58.015 -7.777 2.888 1.00 0.00 H new ATOM 0 HG LEU C 78 58.860 -7.030 0.052 1.00 0.00 H new ATOM 0 HD11 LEU C 78 58.260 -9.358 -0.552 1.00 0.00 H new ATOM 0 HD12 LEU C 78 59.617 -9.325 0.599 1.00 0.00 H new ATOM 0 HD13 LEU C 78 57.979 -9.731 1.165 1.00 0.00 H new ATOM 0 HD21 LEU C 78 56.496 -7.594 -0.457 1.00 0.00 H new ATOM 0 HD22 LEU C 78 56.216 -7.964 1.262 1.00 0.00 H new ATOM 0 HD23 LEU C 78 56.596 -6.299 0.760 1.00 0.00 H new ATOM 1189 N VAL C 79 59.258 -5.744 4.727 1.00 0.00 N ATOM 1190 CA VAL C 79 59.015 -5.412 6.159 1.00 0.00 C ATOM 1191 C VAL C 79 58.654 -3.931 6.298 1.00 0.00 C ATOM 1192 O VAL C 79 57.884 -3.547 7.156 1.00 0.00 O ATOM 1193 CB VAL C 79 60.335 -5.712 6.866 1.00 0.00 C ATOM 1194 CG1 VAL C 79 60.283 -5.165 8.294 1.00 0.00 C ATOM 1195 CG2 VAL C 79 60.556 -7.225 6.909 1.00 0.00 C ATOM 0 H VAL C 79 60.140 -6.219 4.534 1.00 0.00 H new ATOM 0 HA VAL C 79 58.190 -5.984 6.584 1.00 0.00 H new ATOM 0 HB VAL C 79 61.154 -5.239 6.324 1.00 0.00 H new ATOM 0 HG11 VAL C 79 61.225 -5.378 8.800 1.00 0.00 H new ATOM 0 HG12 VAL C 79 60.123 -4.087 8.265 1.00 0.00 H new ATOM 0 HG13 VAL C 79 59.465 -5.639 8.836 1.00 0.00 H new ATOM 0 HG21 VAL C 79 61.498 -7.441 7.413 1.00 0.00 H new ATOM 0 HG22 VAL C 79 59.737 -7.697 7.452 1.00 0.00 H new ATOM 0 HG23 VAL C 79 60.591 -7.617 5.892 1.00 0.00 H new ATOM 1205 N MET C 80 59.202 -3.098 5.457 1.00 0.00 N ATOM 1206 CA MET C 80 58.889 -1.642 5.538 1.00 0.00 C ATOM 1207 C MET C 80 57.517 -1.365 4.920 1.00 0.00 C ATOM 1208 O MET C 80 56.897 -0.354 5.185 1.00 0.00 O ATOM 1209 CB MET C 80 59.991 -0.955 4.732 1.00 0.00 C ATOM 1210 CG MET C 80 60.529 0.241 5.519 1.00 0.00 C ATOM 1211 SD MET C 80 62.013 0.882 4.703 1.00 0.00 S ATOM 1212 CE MET C 80 61.223 1.381 3.153 1.00 0.00 C ATOM 0 H MET C 80 59.853 -3.362 4.717 1.00 0.00 H new ATOM 0 HA MET C 80 58.853 -1.281 6.566 1.00 0.00 H new ATOM 0 HB2 MET C 80 60.797 -1.659 4.524 1.00 0.00 H new ATOM 0 HB3 MET C 80 59.600 -0.624 3.770 1.00 0.00 H new ATOM 0 HG2 MET C 80 59.770 1.020 5.581 1.00 0.00 H new ATOM 0 HG3 MET C 80 60.763 -0.058 6.541 1.00 0.00 H new ATOM 0 HE1 MET C 80 61.688 2.296 2.786 1.00 0.00 H new ATOM 0 HE2 MET C 80 61.343 0.590 2.412 1.00 0.00 H new ATOM 0 HE3 MET C 80 60.161 1.558 3.326 1.00 0.00 H new ATOM 1222 N MET C 81 57.036 -2.257 4.099 1.00 0.00 N ATOM 1223 CA MET C 81 55.702 -2.047 3.466 1.00 0.00 C ATOM 1224 C MET C 81 54.594 -2.535 4.401 1.00 0.00 C ATOM 1225 O MET C 81 53.471 -2.073 4.347 1.00 0.00 O ATOM 1226 CB MET C 81 55.733 -2.885 2.188 1.00 0.00 C ATOM 1227 CG MET C 81 56.317 -2.052 1.046 1.00 0.00 C ATOM 1228 SD MET C 81 54.975 -1.229 0.151 1.00 0.00 S ATOM 1229 CE MET C 81 55.724 0.416 0.083 1.00 0.00 C ATOM 0 H MET C 81 57.508 -3.123 3.838 1.00 0.00 H new ATOM 0 HA MET C 81 55.503 -0.996 3.258 1.00 0.00 H new ATOM 0 HB2 MET C 81 56.334 -3.781 2.343 1.00 0.00 H new ATOM 0 HB3 MET C 81 54.726 -3.216 1.933 1.00 0.00 H new ATOM 0 HG2 MET C 81 57.013 -1.312 1.441 1.00 0.00 H new ATOM 0 HG3 MET C 81 56.882 -2.691 0.368 1.00 0.00 H new ATOM 0 HE1 MET C 81 55.054 1.100 -0.438 1.00 0.00 H new ATOM 0 HE2 MET C 81 55.897 0.779 1.096 1.00 0.00 H new ATOM 0 HE3 MET C 81 56.673 0.362 -0.450 1.00 0.00 H new ATOM 1239 N VAL C 82 54.901 -3.466 5.261 1.00 0.00 N ATOM 1240 CA VAL C 82 53.868 -3.984 6.203 1.00 0.00 C ATOM 1241 C VAL C 82 53.643 -2.983 7.339 1.00 0.00 C ATOM 1242 O VAL C 82 52.523 -2.700 7.716 1.00 0.00 O ATOM 1243 CB VAL C 82 54.444 -5.293 6.743 1.00 0.00 C ATOM 1244 CG1 VAL C 82 53.346 -6.079 7.459 1.00 0.00 C ATOM 1245 CG2 VAL C 82 54.989 -6.125 5.579 1.00 0.00 C ATOM 0 H VAL C 82 55.824 -3.891 5.353 1.00 0.00 H new ATOM 0 HA VAL C 82 52.903 -4.136 5.718 1.00 0.00 H new ATOM 0 HB VAL C 82 55.249 -5.074 7.445 1.00 0.00 H new ATOM 0 HG11 VAL C 82 53.758 -7.012 7.843 1.00 0.00 H new ATOM 0 HG12 VAL C 82 52.955 -5.487 8.286 1.00 0.00 H new ATOM 0 HG13 VAL C 82 52.541 -6.300 6.758 1.00 0.00 H new ATOM 0 HG21 VAL C 82 55.401 -7.059 5.961 1.00 0.00 H new ATOM 0 HG22 VAL C 82 54.183 -6.343 4.879 1.00 0.00 H new ATOM 0 HG23 VAL C 82 55.772 -5.566 5.067 1.00 0.00 H new ATOM 1255 N ARG C 83 54.698 -2.443 7.887 1.00 0.00 N ATOM 1256 CA ARG C 83 54.540 -1.461 8.998 1.00 0.00 C ATOM 1257 C ARG C 83 53.997 -0.134 8.459 1.00 0.00 C ATOM 1258 O ARG C 83 53.199 0.527 9.094 1.00 0.00 O ATOM 1259 CB ARG C 83 55.947 -1.269 9.564 1.00 0.00 C ATOM 1260 CG ARG C 83 56.535 -2.628 9.949 1.00 0.00 C ATOM 1261 CD ARG C 83 57.954 -2.436 10.490 1.00 0.00 C ATOM 1262 NE ARG C 83 57.919 -3.005 11.866 1.00 0.00 N ATOM 1263 CZ ARG C 83 58.322 -2.288 12.880 1.00 0.00 C ATOM 1264 NH1 ARG C 83 57.660 -1.219 13.227 1.00 0.00 N ATOM 1265 NH2 ARG C 83 59.385 -2.641 13.547 1.00 0.00 N ATOM 0 H ARG C 83 55.661 -2.639 7.614 1.00 0.00 H new ATOM 0 HA ARG C 83 53.839 -1.809 9.756 1.00 0.00 H new ATOM 0 HB2 ARG C 83 56.584 -0.782 8.825 1.00 0.00 H new ATOM 0 HB3 ARG C 83 55.913 -0.616 10.436 1.00 0.00 H new ATOM 0 HG2 ARG C 83 55.909 -3.107 10.702 1.00 0.00 H new ATOM 0 HG3 ARG C 83 56.551 -3.288 9.082 1.00 0.00 H new ATOM 0 HD2 ARG C 83 58.687 -2.950 9.868 1.00 0.00 H new ATOM 0 HD3 ARG C 83 58.232 -1.382 10.505 1.00 0.00 H new ATOM 0 HE ARG C 83 57.580 -3.955 12.016 1.00 0.00 H new ATOM 0 HH11 ARG C 83 56.827 -0.943 12.706 1.00 0.00 H new ATOM 0 HH12 ARG C 83 57.975 -0.659 14.019 1.00 0.00 H new ATOM 0 HH21 ARG C 83 59.902 -3.478 13.277 1.00 0.00 H new ATOM 0 HH22 ARG C 83 59.700 -2.081 14.339 1.00 0.00 H new ATOM 1279 N CYS C 84 54.428 0.262 7.292 1.00 0.00 N ATOM 1280 CA CYS C 84 53.943 1.547 6.712 1.00 0.00 C ATOM 1281 C CYS C 84 52.412 1.566 6.659 1.00 0.00 C ATOM 1282 O CYS C 84 51.789 2.596 6.824 1.00 0.00 O ATOM 1283 CB CYS C 84 54.528 1.591 5.299 1.00 0.00 C ATOM 1284 SG CYS C 84 53.958 3.089 4.458 1.00 0.00 S ATOM 0 H CYS C 84 55.096 -0.249 6.715 1.00 0.00 H new ATOM 0 HA CYS C 84 54.249 2.407 7.308 1.00 0.00 H new ATOM 0 HB2 CYS C 84 55.617 1.578 5.344 1.00 0.00 H new ATOM 0 HB3 CYS C 84 54.222 0.707 4.739 1.00 0.00 H new ATOM 0 HG CYS C 84 54.456 3.129 3.258 1.00 0.00 H new ATOM 1290 N MET C 85 51.801 0.437 6.428 1.00 0.00 N ATOM 1291 CA MET C 85 50.312 0.398 6.363 1.00 0.00 C ATOM 1292 C MET C 85 49.713 0.506 7.767 1.00 0.00 C ATOM 1293 O MET C 85 48.807 1.281 8.006 1.00 0.00 O ATOM 1294 CB MET C 85 49.974 -0.958 5.741 1.00 0.00 C ATOM 1295 CG MET C 85 50.761 -1.134 4.441 1.00 0.00 C ATOM 1296 SD MET C 85 49.612 -1.211 3.044 1.00 0.00 S ATOM 1297 CE MET C 85 49.097 -2.932 3.265 1.00 0.00 C ATOM 0 H MET C 85 52.267 -0.459 6.282 1.00 0.00 H new ATOM 0 HA MET C 85 49.907 1.226 5.782 1.00 0.00 H new ATOM 0 HB2 MET C 85 50.218 -1.760 6.437 1.00 0.00 H new ATOM 0 HB3 MET C 85 48.904 -1.022 5.542 1.00 0.00 H new ATOM 0 HG2 MET C 85 51.455 -0.304 4.309 1.00 0.00 H new ATOM 0 HG3 MET C 85 51.358 -2.045 4.485 1.00 0.00 H new ATOM 0 HE1 MET C 85 48.373 -3.197 2.494 1.00 0.00 H new ATOM 0 HE2 MET C 85 49.966 -3.585 3.187 1.00 0.00 H new ATOM 0 HE3 MET C 85 48.641 -3.052 4.248 1.00 0.00 H new ATOM 1307 N LYS C 86 50.205 -0.265 8.697 1.00 0.00 N ATOM 1308 CA LYS C 86 49.654 -0.202 10.080 1.00 0.00 C ATOM 1309 C LYS C 86 48.140 -0.428 10.047 1.00 0.00 C ATOM 1310 O LYS C 86 47.364 0.449 10.370 1.00 0.00 O ATOM 1311 CB LYS C 86 49.976 1.211 10.571 1.00 0.00 C ATOM 1312 CG LYS C 86 49.751 1.293 12.082 1.00 0.00 C ATOM 1313 CD LYS C 86 49.838 2.753 12.530 1.00 0.00 C ATOM 1314 CE LYS C 86 48.435 3.358 12.573 1.00 0.00 C ATOM 1315 NZ LYS C 86 48.471 4.481 11.594 1.00 0.00 N ATOM 0 H LYS C 86 50.963 -0.934 8.560 1.00 0.00 H new ATOM 0 HA LYS C 86 50.079 -0.964 10.733 1.00 0.00 H new ATOM 0 HB2 LYS C 86 51.009 1.463 10.333 1.00 0.00 H new ATOM 0 HB3 LYS C 86 49.345 1.937 10.059 1.00 0.00 H new ATOM 0 HG2 LYS C 86 48.775 0.880 12.338 1.00 0.00 H new ATOM 0 HG3 LYS C 86 50.498 0.695 12.605 1.00 0.00 H new ATOM 0 HD2 LYS C 86 50.303 2.815 13.514 1.00 0.00 H new ATOM 0 HD3 LYS C 86 50.468 3.318 11.843 1.00 0.00 H new ATOM 0 HE2 LYS C 86 47.679 2.621 12.302 1.00 0.00 H new ATOM 0 HE3 LYS C 86 48.189 3.714 13.573 1.00 0.00 H new ATOM 0 HZ1 LYS C 86 47.542 4.947 11.566 1.00 0.00 H new ATOM 0 HZ2 LYS C 86 49.195 5.169 11.882 1.00 0.00 H new ATOM 0 HZ3 LYS C 86 48.701 4.111 10.650 1.00 0.00 H new ATOM 1329 N ASP C 87 47.716 -1.598 9.650 1.00 0.00 N ATOM 1330 CA ASP C 87 46.253 -1.879 9.587 1.00 0.00 C ATOM 1331 C ASP C 87 45.789 -2.596 10.859 1.00 0.00 C ATOM 1332 O ASP C 87 44.649 -2.999 10.972 1.00 0.00 O ATOM 1333 CB ASP C 87 46.079 -2.786 8.368 1.00 0.00 C ATOM 1334 CG ASP C 87 44.682 -3.409 8.388 1.00 0.00 C ATOM 1335 OD1 ASP C 87 43.739 -2.692 8.684 1.00 0.00 O ATOM 1336 OD2 ASP C 87 44.578 -4.591 8.107 1.00 0.00 O ATOM 0 H ASP C 87 48.319 -2.370 9.367 1.00 0.00 H new ATOM 0 HA ASP C 87 45.662 -0.966 9.508 1.00 0.00 H new ATOM 0 HB2 ASP C 87 46.219 -2.212 7.452 1.00 0.00 H new ATOM 0 HB3 ASP C 87 46.838 -3.569 8.373 1.00 0.00 H new ATOM 1341 N ASP C 88 46.660 -2.757 11.818 1.00 0.00 N ATOM 1342 CA ASP C 88 46.256 -3.446 13.077 1.00 0.00 C ATOM 1343 C ASP C 88 45.908 -2.414 14.153 1.00 0.00 C ATOM 1344 O ASP C 88 45.642 -1.266 13.861 1.00 0.00 O ATOM 1345 CB ASP C 88 47.479 -4.265 13.494 1.00 0.00 C ATOM 1346 CG ASP C 88 47.844 -5.245 12.379 1.00 0.00 C ATOM 1347 OD1 ASP C 88 47.304 -6.341 12.378 1.00 0.00 O ATOM 1348 OD2 ASP C 88 48.656 -4.885 11.544 1.00 0.00 O ATOM 0 H ASP C 88 47.630 -2.443 11.785 1.00 0.00 H new ATOM 0 HA ASP C 88 45.375 -4.074 12.940 1.00 0.00 H new ATOM 0 HB2 ASP C 88 48.320 -3.603 13.700 1.00 0.00 H new ATOM 0 HB3 ASP C 88 47.269 -4.808 14.415 1.00 0.00 H new ATOM 1353 N SER C 89 45.906 -2.814 15.396 1.00 0.00 N ATOM 1354 CA SER C 89 45.574 -1.853 16.488 1.00 0.00 C ATOM 1355 C SER C 89 44.107 -1.425 16.389 1.00 0.00 C ATOM 1356 O SER C 89 43.849 -0.399 15.782 1.00 0.00 O ATOM 1357 CB SER C 89 46.498 -0.658 16.259 1.00 0.00 C ATOM 1358 OG SER C 89 46.982 -0.193 17.513 1.00 0.00 O ATOM 1359 OXT SER C 89 43.267 -2.131 16.924 1.00 0.00 O ATOM 0 H SER C 89 46.120 -3.763 15.703 1.00 0.00 H new ATOM 0 HA SER C 89 45.711 -2.290 17.477 1.00 0.00 H new ATOM 0 HB2 SER C 89 47.331 -0.945 15.618 1.00 0.00 H new ATOM 0 HB3 SER C 89 45.961 0.139 15.745 1.00 0.00 H new ATOM 0 HG SER C 89 47.577 0.573 17.371 1.00 0.00 H new TER 1365 SER C 89 ATOM 1366 N ARG I 1 58.488 9.029 6.494 1.00 0.00 N ATOM 1367 CA ARG I 1 57.037 9.115 6.159 1.00 0.00 C ATOM 1368 C ARG I 1 56.805 8.708 4.701 1.00 0.00 C ATOM 1369 O ARG I 1 57.425 9.229 3.795 1.00 0.00 O ATOM 1370 CB ARG I 1 56.669 10.584 6.372 1.00 0.00 C ATOM 1371 CG ARG I 1 55.170 10.702 6.651 1.00 0.00 C ATOM 1372 CD ARG I 1 54.679 12.091 6.234 1.00 0.00 C ATOM 1373 NE ARG I 1 53.367 12.257 6.919 1.00 0.00 N ATOM 1374 CZ ARG I 1 52.357 12.778 6.277 1.00 0.00 C ATOM 1375 NH1 ARG I 1 51.566 12.013 5.575 1.00 0.00 N ATOM 1376 NH2 ARG I 1 52.140 14.063 6.335 1.00 0.00 N ATOM 0 H1 ARG I 1 58.632 9.308 7.486 1.00 0.00 H new ATOM 0 H2 ARG I 1 58.819 8.053 6.357 1.00 0.00 H new ATOM 0 H3 ARG I 1 59.026 9.667 5.873 1.00 0.00 H new ATOM 0 HA ARG I 1 56.431 8.450 6.773 1.00 0.00 H new ATOM 0 HB2 ARG I 1 57.238 10.995 7.206 1.00 0.00 H new ATOM 0 HB3 ARG I 1 56.932 11.167 5.489 1.00 0.00 H new ATOM 0 HG2 ARG I 1 54.626 9.933 6.103 1.00 0.00 H new ATOM 0 HG3 ARG I 1 54.973 10.538 7.710 1.00 0.00 H new ATOM 0 HD2 ARG I 1 55.383 12.866 6.537 1.00 0.00 H new ATOM 0 HD3 ARG I 1 54.571 12.163 5.152 1.00 0.00 H new ATOM 0 HE ARG I 1 53.258 11.964 7.890 1.00 0.00 H new ATOM 0 HH11 ARG I 1 51.737 11.009 5.528 1.00 0.00 H new ATOM 0 HH12 ARG I 1 50.777 12.420 5.073 1.00 0.00 H new ATOM 0 HH21 ARG I 1 52.760 14.661 6.882 1.00 0.00 H new ATOM 0 HH22 ARG I 1 51.351 14.470 5.833 1.00 0.00 H new ATOM 1392 N ILE I 2 55.916 7.782 4.468 1.00 0.00 N ATOM 1393 CA ILE I 2 55.643 7.342 3.069 1.00 0.00 C ATOM 1394 C ILE I 2 54.232 6.759 2.963 1.00 0.00 C ATOM 1395 O ILE I 2 54.050 5.560 2.887 1.00 0.00 O ATOM 1396 CB ILE I 2 56.690 6.267 2.781 1.00 0.00 C ATOM 1397 CG1 ILE I 2 56.403 5.628 1.419 1.00 0.00 C ATOM 1398 CG2 ILE I 2 56.630 5.193 3.868 1.00 0.00 C ATOM 1399 CD1 ILE I 2 57.704 5.518 0.623 1.00 0.00 C ATOM 0 H ILE I 2 55.366 7.310 5.186 1.00 0.00 H new ATOM 0 HA ILE I 2 55.699 8.167 2.359 1.00 0.00 H new ATOM 0 HB ILE I 2 57.682 6.719 2.770 1.00 0.00 H new ATOM 0 HG12 ILE I 2 55.962 4.640 1.554 1.00 0.00 H new ATOM 0 HG13 ILE I 2 55.678 6.228 0.869 1.00 0.00 H new ATOM 0 HG21 ILE I 2 57.377 4.426 3.663 1.00 0.00 H new ATOM 0 HG22 ILE I 2 56.832 5.646 4.839 1.00 0.00 H new ATOM 0 HG23 ILE I 2 55.638 4.741 3.878 1.00 0.00 H new ATOM 0 HD11 ILE I 2 57.500 5.063 -0.346 1.00 0.00 H new ATOM 0 HD12 ILE I 2 58.126 6.512 0.476 1.00 0.00 H new ATOM 0 HD13 ILE I 2 58.415 4.900 1.171 1.00 0.00 H new ATOM 1411 N SER I 3 53.231 7.597 2.958 1.00 0.00 N ATOM 1412 CA SER I 3 51.833 7.089 2.858 1.00 0.00 C ATOM 1413 C SER I 3 51.669 6.227 1.604 1.00 0.00 C ATOM 1414 O SER I 3 51.555 6.731 0.504 1.00 0.00 O ATOM 1415 CB SER I 3 50.963 8.340 2.762 1.00 0.00 C ATOM 1416 OG SER I 3 49.617 8.002 3.071 1.00 0.00 O ATOM 0 H SER I 3 53.321 8.611 3.019 1.00 0.00 H new ATOM 0 HA SER I 3 51.561 6.465 3.710 1.00 0.00 H new ATOM 0 HB2 SER I 3 51.326 9.103 3.451 1.00 0.00 H new ATOM 0 HB3 SER I 3 51.023 8.762 1.759 1.00 0.00 H new ATOM 0 HG SER I 3 49.057 8.804 3.012 1.00 0.00 H new ATOM 1422 N ALA I 4 51.654 4.932 1.758 1.00 0.00 N ATOM 1423 CA ALA I 4 51.495 4.044 0.572 1.00 0.00 C ATOM 1424 C ALA I 4 50.331 4.534 -0.293 1.00 0.00 C ATOM 1425 O ALA I 4 50.479 4.773 -1.475 1.00 0.00 O ATOM 1426 CB ALA I 4 51.190 2.660 1.148 1.00 0.00 C ATOM 0 H ALA I 4 51.745 4.451 2.653 1.00 0.00 H new ATOM 0 HA ALA I 4 52.383 4.032 -0.060 1.00 0.00 H new ATOM 0 HB1 ALA I 4 51.059 1.948 0.333 1.00 0.00 H new ATOM 0 HB2 ALA I 4 52.017 2.339 1.781 1.00 0.00 H new ATOM 0 HB3 ALA I 4 50.276 2.706 1.740 1.00 0.00 H new ATOM 1432 N ASP I 5 49.173 4.691 0.288 1.00 0.00 N ATOM 1433 CA ASP I 5 48.001 5.170 -0.501 1.00 0.00 C ATOM 1434 C ASP I 5 48.404 6.368 -1.365 1.00 0.00 C ATOM 1435 O ASP I 5 48.092 6.434 -2.537 1.00 0.00 O ATOM 1436 CB ASP I 5 46.965 5.587 0.543 1.00 0.00 C ATOM 1437 CG ASP I 5 46.661 4.404 1.464 1.00 0.00 C ATOM 1438 OD1 ASP I 5 46.322 3.351 0.950 1.00 0.00 O ATOM 1439 OD2 ASP I 5 46.772 4.572 2.668 1.00 0.00 O ATOM 0 H ASP I 5 48.987 4.509 1.274 1.00 0.00 H new ATOM 0 HA ASP I 5 47.615 4.406 -1.175 1.00 0.00 H new ATOM 0 HB2 ASP I 5 47.340 6.428 1.126 1.00 0.00 H new ATOM 0 HB3 ASP I 5 46.052 5.922 0.051 1.00 0.00 H new ATOM 1444 N ALA I 6 49.093 7.317 -0.792 1.00 0.00 N ATOM 1445 CA ALA I 6 49.516 8.512 -1.577 1.00 0.00 C ATOM 1446 C ALA I 6 50.743 8.181 -2.429 1.00 0.00 C ATOM 1447 O ALA I 6 50.997 8.805 -3.440 1.00 0.00 O ATOM 1448 CB ALA I 6 49.866 9.569 -0.530 1.00 0.00 C ATOM 0 H ALA I 6 49.381 7.317 0.186 1.00 0.00 H new ATOM 0 HA ALA I 6 48.737 8.852 -2.259 1.00 0.00 H new ATOM 0 HB1 ALA I 6 50.188 10.483 -1.029 1.00 0.00 H new ATOM 0 HB2 ALA I 6 48.989 9.780 0.082 1.00 0.00 H new ATOM 0 HB3 ALA I 6 50.671 9.199 0.105 1.00 0.00 H new ATOM 1454 N MET I 7 51.511 7.205 -2.026 1.00 0.00 N ATOM 1455 CA MET I 7 52.725 6.842 -2.812 1.00 0.00 C ATOM 1456 C MET I 7 52.322 6.144 -4.115 1.00 0.00 C ATOM 1457 O MET I 7 53.090 6.077 -5.054 1.00 0.00 O ATOM 1458 CB MET I 7 53.527 5.911 -1.897 1.00 0.00 C ATOM 1459 CG MET I 7 54.521 5.094 -2.725 1.00 0.00 C ATOM 1460 SD MET I 7 56.147 5.140 -1.931 1.00 0.00 S ATOM 1461 CE MET I 7 57.088 4.403 -3.291 1.00 0.00 C ATOM 0 H MET I 7 51.351 6.645 -1.189 1.00 0.00 H new ATOM 0 HA MET I 7 53.313 7.713 -3.103 1.00 0.00 H new ATOM 0 HB2 MET I 7 54.060 6.495 -1.147 1.00 0.00 H new ATOM 0 HB3 MET I 7 52.852 5.244 -1.361 1.00 0.00 H new ATOM 0 HG2 MET I 7 54.177 4.064 -2.814 1.00 0.00 H new ATOM 0 HG3 MET I 7 54.586 5.497 -3.736 1.00 0.00 H new ATOM 0 HE1 MET I 7 57.831 3.715 -2.888 1.00 0.00 H new ATOM 0 HE2 MET I 7 56.410 3.860 -3.950 1.00 0.00 H new ATOM 0 HE3 MET I 7 57.590 5.190 -3.855 1.00 0.00 H new ATOM 1471 N MET I 8 51.119 5.646 -4.191 1.00 0.00 N ATOM 1472 CA MET I 8 50.674 4.980 -5.448 1.00 0.00 C ATOM 1473 C MET I 8 50.306 6.047 -6.481 1.00 0.00 C ATOM 1474 O MET I 8 50.683 5.969 -7.632 1.00 0.00 O ATOM 1475 CB MET I 8 49.449 4.157 -5.053 1.00 0.00 C ATOM 1476 CG MET I 8 49.868 2.704 -4.817 1.00 0.00 C ATOM 1477 SD MET I 8 50.404 2.502 -3.100 1.00 0.00 S ATOM 1478 CE MET I 8 52.033 3.271 -3.274 1.00 0.00 C ATOM 0 H MET I 8 50.428 5.671 -3.441 1.00 0.00 H new ATOM 0 HA MET I 8 51.446 4.351 -5.891 1.00 0.00 H new ATOM 0 HB2 MET I 8 48.997 4.568 -4.150 1.00 0.00 H new ATOM 0 HB3 MET I 8 48.695 4.207 -5.839 1.00 0.00 H new ATOM 0 HG2 MET I 8 49.034 2.035 -5.030 1.00 0.00 H new ATOM 0 HG3 MET I 8 50.676 2.433 -5.496 1.00 0.00 H new ATOM 0 HE1 MET I 8 52.805 2.554 -2.997 1.00 0.00 H new ATOM 0 HE2 MET I 8 52.180 3.582 -4.308 1.00 0.00 H new ATOM 0 HE3 MET I 8 52.096 4.142 -2.621 1.00 0.00 H new ATOM 1488 N GLN I 9 49.585 7.052 -6.071 1.00 0.00 N ATOM 1489 CA GLN I 9 49.207 8.134 -7.022 1.00 0.00 C ATOM 1490 C GLN I 9 50.331 9.176 -7.096 1.00 0.00 C ATOM 1491 O GLN I 9 50.274 10.112 -7.867 1.00 0.00 O ATOM 1492 CB GLN I 9 47.934 8.748 -6.436 1.00 0.00 C ATOM 1493 CG GLN I 9 46.846 8.784 -7.511 1.00 0.00 C ATOM 1494 CD GLN I 9 46.473 10.236 -7.814 1.00 0.00 C ATOM 1495 OE1 GLN I 9 47.242 10.959 -8.417 1.00 0.00 O ATOM 1496 NE2 GLN I 9 45.318 10.697 -7.421 1.00 0.00 N ATOM 0 H GLN I 9 49.241 7.171 -5.118 1.00 0.00 H new ATOM 0 HA GLN I 9 49.046 7.766 -8.035 1.00 0.00 H new ATOM 0 HB2 GLN I 9 47.596 8.164 -5.580 1.00 0.00 H new ATOM 0 HB3 GLN I 9 48.136 9.756 -6.074 1.00 0.00 H new ATOM 0 HG2 GLN I 9 47.199 8.292 -8.417 1.00 0.00 H new ATOM 0 HG3 GLN I 9 45.967 8.235 -7.172 1.00 0.00 H new ATOM 0 HE21 GLN I 9 44.672 10.091 -6.915 1.00 0.00 H new ATOM 0 HE22 GLN I 9 45.060 11.664 -7.620 1.00 0.00 H new ATOM 1505 N ALA I 10 51.347 9.018 -6.288 1.00 0.00 N ATOM 1506 CA ALA I 10 52.473 9.996 -6.294 1.00 0.00 C ATOM 1507 C ALA I 10 53.511 9.644 -7.371 1.00 0.00 C ATOM 1508 O ALA I 10 53.932 10.492 -8.133 1.00 0.00 O ATOM 1509 CB ALA I 10 53.091 9.887 -4.901 1.00 0.00 C ATOM 0 H ALA I 10 51.445 8.251 -5.623 1.00 0.00 H new ATOM 0 HA ALA I 10 52.130 11.005 -6.521 1.00 0.00 H new ATOM 0 HB1 ALA I 10 53.931 10.577 -4.821 1.00 0.00 H new ATOM 0 HB2 ALA I 10 52.342 10.138 -4.150 1.00 0.00 H new ATOM 0 HB3 ALA I 10 53.442 8.868 -4.737 1.00 0.00 H new ATOM 1515 N LEU I 11 53.943 8.409 -7.434 1.00 0.00 N ATOM 1516 CA LEU I 11 54.968 8.040 -8.459 1.00 0.00 C ATOM 1517 C LEU I 11 54.791 6.591 -8.933 1.00 0.00 C ATOM 1518 O LEU I 11 55.702 5.994 -9.470 1.00 0.00 O ATOM 1519 CB LEU I 11 56.312 8.209 -7.746 1.00 0.00 C ATOM 1520 CG LEU I 11 56.258 7.521 -6.379 1.00 0.00 C ATOM 1521 CD1 LEU I 11 57.502 6.649 -6.195 1.00 0.00 C ATOM 1522 CD2 LEU I 11 56.215 8.581 -5.277 1.00 0.00 C ATOM 0 H LEU I 11 53.635 7.648 -6.828 1.00 0.00 H new ATOM 0 HA LEU I 11 54.886 8.662 -9.351 1.00 0.00 H new ATOM 0 HB2 LEU I 11 57.112 7.779 -8.349 1.00 0.00 H new ATOM 0 HB3 LEU I 11 56.539 9.268 -7.623 1.00 0.00 H new ATOM 0 HG LEU I 11 55.365 6.898 -6.322 1.00 0.00 H new ATOM 0 HD11 LEU I 11 57.463 6.160 -5.222 1.00 0.00 H new ATOM 0 HD12 LEU I 11 57.536 5.893 -6.980 1.00 0.00 H new ATOM 0 HD13 LEU I 11 58.395 7.272 -6.252 1.00 0.00 H new ATOM 0 HD21 LEU I 11 56.177 8.092 -4.303 1.00 0.00 H new ATOM 0 HD22 LEU I 11 57.108 9.203 -5.336 1.00 0.00 H new ATOM 0 HD23 LEU I 11 55.330 9.204 -5.406 1.00 0.00 H new ATOM 1534 N LEU I 12 53.630 6.022 -8.751 1.00 0.00 N ATOM 1535 CA LEU I 12 53.416 4.616 -9.207 1.00 0.00 C ATOM 1536 C LEU I 12 51.977 4.176 -8.921 1.00 0.00 C ATOM 1537 O LEU I 12 51.675 3.653 -7.865 1.00 0.00 O ATOM 1538 CB LEU I 12 54.405 3.773 -8.401 1.00 0.00 C ATOM 1539 CG LEU I 12 54.140 3.957 -6.908 1.00 0.00 C ATOM 1540 CD1 LEU I 12 53.824 2.600 -6.280 1.00 0.00 C ATOM 1541 CD2 LEU I 12 55.384 4.551 -6.245 1.00 0.00 C ATOM 0 H LEU I 12 52.824 6.465 -8.309 1.00 0.00 H new ATOM 0 HA LEU I 12 53.573 4.508 -10.280 1.00 0.00 H new ATOM 0 HB2 LEU I 12 54.306 2.722 -8.671 1.00 0.00 H new ATOM 0 HB3 LEU I 12 55.427 4.068 -8.638 1.00 0.00 H new ATOM 0 HG LEU I 12 53.294 4.629 -6.764 1.00 0.00 H new ATOM 0 HD11 LEU I 12 53.634 2.728 -5.214 1.00 0.00 H new ATOM 0 HD12 LEU I 12 52.941 2.175 -6.757 1.00 0.00 H new ATOM 0 HD13 LEU I 12 54.671 1.928 -6.420 1.00 0.00 H new ATOM 0 HD21 LEU I 12 55.200 4.684 -5.179 1.00 0.00 H new ATOM 0 HD22 LEU I 12 56.229 3.876 -6.386 1.00 0.00 H new ATOM 0 HD23 LEU I 12 55.612 5.516 -6.697 1.00 0.00 H new ATOM 1553 N GLY I 13 51.090 4.385 -9.854 1.00 0.00 N ATOM 1554 CA GLY I 13 49.671 3.981 -9.641 1.00 0.00 C ATOM 1555 C GLY I 13 48.840 4.385 -10.861 1.00 0.00 C ATOM 1556 O GLY I 13 49.177 5.309 -11.574 1.00 0.00 O ATOM 0 H GLY I 13 51.286 4.819 -10.756 1.00 0.00 H new ATOM 0 HA2 GLY I 13 49.607 2.904 -9.484 1.00 0.00 H new ATOM 0 HA3 GLY I 13 49.276 4.458 -8.744 1.00 0.00 H new ATOM 1560 N ALA I 14 47.757 3.701 -11.109 1.00 0.00 N ATOM 1561 CA ALA I 14 46.910 4.049 -12.286 1.00 0.00 C ATOM 1562 C ALA I 14 45.448 3.683 -12.017 1.00 0.00 C ATOM 1563 O ALA I 14 45.152 2.807 -11.228 1.00 0.00 O ATOM 1564 CB ALA I 14 47.468 3.213 -13.437 1.00 0.00 C ATOM 0 H ALA I 14 47.422 2.917 -10.549 1.00 0.00 H new ATOM 0 HA ALA I 14 46.933 5.116 -12.508 1.00 0.00 H new ATOM 0 HB1 ALA I 14 46.896 3.413 -14.343 1.00 0.00 H new ATOM 0 HB2 ALA I 14 48.513 3.474 -13.603 1.00 0.00 H new ATOM 0 HB3 ALA I 14 47.394 2.155 -13.187 1.00 0.00 H new ATOM 1570 N ARG I 15 44.532 4.345 -12.670 1.00 0.00 N ATOM 1571 CA ARG I 15 43.088 4.036 -12.455 1.00 0.00 C ATOM 1572 C ARG I 15 42.320 4.156 -13.775 1.00 0.00 C ATOM 1573 O ARG I 15 41.548 5.073 -13.975 1.00 0.00 O ATOM 1574 CB ARG I 15 42.603 5.086 -11.455 1.00 0.00 C ATOM 1575 CG ARG I 15 43.107 4.732 -10.055 1.00 0.00 C ATOM 1576 CD ARG I 15 43.277 6.011 -9.231 1.00 0.00 C ATOM 1577 NE ARG I 15 42.451 5.795 -8.011 1.00 0.00 N ATOM 1578 CZ ARG I 15 41.149 5.801 -8.096 1.00 0.00 C ATOM 1579 NH1 ARG I 15 40.497 6.930 -8.051 1.00 0.00 N ATOM 1580 NH2 ARG I 15 40.499 4.677 -8.226 1.00 0.00 N ATOM 0 H ARG I 15 44.721 5.087 -13.344 1.00 0.00 H new ATOM 0 HA ARG I 15 42.932 3.022 -12.088 1.00 0.00 H new ATOM 0 HB2 ARG I 15 42.965 6.073 -11.744 1.00 0.00 H new ATOM 0 HB3 ARG I 15 41.514 5.132 -11.460 1.00 0.00 H new ATOM 0 HG2 ARG I 15 42.403 4.061 -9.563 1.00 0.00 H new ATOM 0 HG3 ARG I 15 44.057 4.202 -10.123 1.00 0.00 H new ATOM 0 HD2 ARG I 15 44.323 6.180 -8.975 1.00 0.00 H new ATOM 0 HD3 ARG I 15 42.940 6.886 -9.786 1.00 0.00 H new ATOM 0 HE ARG I 15 42.903 5.642 -7.109 1.00 0.00 H new ATOM 0 HH11 ARG I 15 41.005 7.809 -7.949 1.00 0.00 H new ATOM 0 HH12 ARG I 15 39.479 6.934 -8.118 1.00 0.00 H new ATOM 0 HH21 ARG I 15 41.009 3.794 -8.261 1.00 0.00 H new ATOM 0 HH22 ARG I 15 39.481 4.681 -8.292 1.00 0.00 H new ATOM 1594 N ALA I 16 42.524 3.235 -14.679 1.00 0.00 N ATOM 1595 CA ALA I 16 41.805 3.296 -15.985 1.00 0.00 C ATOM 1596 C ALA I 16 41.992 1.984 -16.754 1.00 0.00 C ATOM 1597 O ALA I 16 41.040 1.296 -17.065 1.00 0.00 O ATOM 1598 CB ALA I 16 42.452 4.457 -16.740 1.00 0.00 C ATOM 0 H ALA I 16 43.157 2.443 -14.569 1.00 0.00 H new ATOM 0 HA ALA I 16 40.732 3.440 -15.859 1.00 0.00 H new ATOM 0 HB1 ALA I 16 41.977 4.567 -17.715 1.00 0.00 H new ATOM 0 HB2 ALA I 16 42.327 5.377 -16.169 1.00 0.00 H new ATOM 0 HB3 ALA I 16 43.515 4.256 -16.875 1.00 0.00 H new ATOM 1604 N LYS I 17 43.211 1.633 -17.060 1.00 0.00 N ATOM 1605 CA LYS I 17 43.456 0.366 -17.807 1.00 0.00 C ATOM 1606 C LYS I 17 44.220 -0.626 -16.926 1.00 0.00 C ATOM 1607 O LYS I 17 43.585 -1.277 -16.113 1.00 0.00 O ATOM 1608 CB LYS I 17 44.301 0.771 -19.014 1.00 0.00 C ATOM 1609 CG LYS I 17 43.391 0.985 -20.224 1.00 0.00 C ATOM 1610 CD LYS I 17 43.068 -0.365 -20.865 1.00 0.00 C ATOM 1611 CE LYS I 17 41.956 -0.188 -21.900 1.00 0.00 C ATOM 1612 NZ LYS I 17 42.661 -0.116 -23.210 1.00 0.00 N ATOM 1613 OXT LYS I 17 45.427 -0.717 -17.080 1.00 0.00 O ATOM 0 H LYS I 17 44.047 2.168 -16.826 1.00 0.00 H new ATOM 0 HA LYS I 17 42.528 -0.122 -18.106 1.00 0.00 H new ATOM 0 HB2 LYS I 17 44.853 1.685 -18.795 1.00 0.00 H new ATOM 0 HB3 LYS I 17 45.038 -0.002 -19.232 1.00 0.00 H new ATOM 0 HG2 LYS I 17 42.471 1.483 -19.917 1.00 0.00 H new ATOM 0 HG3 LYS I 17 43.879 1.636 -20.949 1.00 0.00 H new ATOM 0 HD2 LYS I 17 43.959 -0.776 -21.340 1.00 0.00 H new ATOM 0 HD3 LYS I 17 42.757 -1.077 -20.100 1.00 0.00 H new ATOM 0 HE2 LYS I 17 41.255 -1.022 -21.874 1.00 0.00 H new ATOM 0 HE3 LYS I 17 41.380 0.718 -21.711 1.00 0.00 H new ATOM 0 HZ1 LYS I 17 41.965 0.006 -23.973 1.00 0.00 H new ATOM 0 HZ2 LYS I 17 43.316 0.691 -23.208 1.00 0.00 H new ATOM 0 HZ3 LYS I 17 43.195 -0.995 -23.366 1.00 0.00 H new TER 1627 LYS I 17 HETATM 1628 CA CA C 90 70.320 -4.302 4.611 1.00 0.00 CA