USER MOD reduce.3.24.130724 H: found=0, std=0, add=698, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 698 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 57 GLN : amide:sc= 0.586 K(o=1.2,f=0.72) USER MOD Set 1.2: A 88 GLN : amide:sc= 0.651 K(o=1.2,f=0.72) USER MOD Set 2.1: A 19 ASN : amide:sc= 2.04 K(o=3.1,f=-1.9) USER MOD Set 2.2: A 31 GLN : amide:sc= 1.08 K(o=3.1,f=-0.21!) USER MOD Set 3.1: A 28 SER OG : rot -91:sc= 1.36 USER MOD Set 3.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= -0.493 X(o=-0.49,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -166:sc= 1.16 (180deg=0.424) USER MOD Single : A 25 GLN : amide:sc= 1.02 K(o=1,f=-0.68) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.363 K(o=-0.36,f=-4.5!) USER MOD Single : A 38 THR OG1 : rot -150:sc= -0.549 USER MOD Single : A 41 SER OG : rot -99:sc= 0.101 USER MOD Single : A 42 LYS NZ :NH3+ 135:sc= 0.988 (180deg=-0.97!) USER MOD Single : A 44 MET CE :methyl -172:sc= -0.62 (180deg=-0.788) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot -50:sc= -0.849 USER MOD Single : A 51 GLN : amide:sc=-0.00751 X(o=-0.0075,f=-0.19) USER MOD Single : A 54 SER OG : rot 180:sc= 0.0318 USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= -0.255 X(o=-0.26,f=-0.46) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.383 USER MOD Single : A 75 GLN : amide:sc= -0.0619 K(o=-0.062,f=-0.67) USER MOD Single : A 78 MET CE :methyl -121:sc= -0.678 (180deg=-1.85) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -0.333 K(o=-0.33,f=-1) USER MOD Single : A 90 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.21) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0693 USER MOD Single : B 357 ASN : amide:sc= -0.101 X(o=-0.1,f=0.39) USER MOD Single : B 358 ASN : amide:sc= -0.712 K(o=-0.71,f=-1.4) USER MOD Single : B 365 SER OG : rot 39:sc= 0.065 USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 16 -5.140 15.677 12.485 1.00 10.00 N ATOM 2 CA ASP A 16 -6.090 14.549 12.635 1.00 10.00 C ATOM 3 C ASP A 16 -5.620 13.353 11.827 1.00 10.00 C ATOM 4 O ASP A 16 -4.637 13.443 11.089 1.00 10.00 O ATOM 5 CB ASP A 16 -7.494 14.960 12.186 1.00 10.00 C ATOM 6 CG ASP A 16 -8.375 15.360 13.352 1.00 10.00 C ATOM 7 OD1 ASP A 16 -9.078 14.486 13.902 1.00 10.00 O ATOM 8 OD2 ASP A 16 -8.371 16.552 13.722 1.00 10.00 O ATOM 0 HA ASP A 16 -6.128 14.274 13.689 1.00 10.00 H new ATOM 0 HB2 ASP A 16 -7.420 15.793 11.486 1.00 10.00 H new ATOM 0 HB3 ASP A 16 -7.958 14.133 11.649 1.00 10.00 H new ATOM 13 N HIS A 17 -6.321 12.235 11.965 1.00 10.00 N ATOM 14 CA HIS A 17 -5.971 11.021 11.239 1.00 10.00 C ATOM 15 C HIS A 17 -6.993 10.738 10.146 1.00 10.00 C ATOM 16 O HIS A 17 -8.156 11.129 10.255 1.00 10.00 O ATOM 17 CB HIS A 17 -5.889 9.825 12.191 1.00 10.00 C ATOM 18 CG HIS A 17 -4.659 9.811 13.045 1.00 10.00 C ATOM 19 ND1 HIS A 17 -4.675 10.285 14.334 1.00 10.00 N ATOM 20 CD2 HIS A 17 -3.414 9.367 12.753 1.00 10.00 C ATOM 21 CE1 HIS A 17 -3.450 10.118 14.797 1.00 10.00 C ATOM 22 NE2 HIS A 17 -2.649 9.565 13.874 1.00 10.00 N ATOM 0 H HIS A 17 -7.135 12.144 12.573 1.00 10.00 H new ATOM 0 HA HIS A 17 -4.994 11.174 10.781 1.00 10.00 H new ATOM 0 HB2 HIS A 17 -6.767 9.826 12.836 1.00 10.00 H new ATOM 0 HB3 HIS A 17 -5.924 8.905 11.607 1.00 10.00 H new ATOM 0 HD2 HIS A 17 -3.086 8.939 11.817 1.00 10.00 H new ATOM 0 HE1 HIS A 17 -3.133 10.392 15.792 1.00 10.00 H new ATOM 0 HE2 HIS A 17 -1.661 9.336 13.985 1.00 10.00 H new ATOM 30 N ILE A 18 -6.548 10.065 9.097 1.00 10.00 N ATOM 31 CA ILE A 18 -7.406 9.714 7.980 1.00 10.00 C ATOM 32 C ILE A 18 -7.527 8.194 7.888 1.00 10.00 C ATOM 33 O ILE A 18 -6.532 7.475 8.007 1.00 10.00 O ATOM 34 CB ILE A 18 -6.864 10.302 6.650 1.00 10.00 C ATOM 35 CG1 ILE A 18 -7.770 9.925 5.476 1.00 10.00 C ATOM 36 CG2 ILE A 18 -5.432 9.847 6.392 1.00 10.00 C ATOM 37 CD1 ILE A 18 -7.357 10.562 4.164 1.00 10.00 C ATOM 0 H ILE A 18 -5.584 9.748 8.997 1.00 10.00 H new ATOM 0 HA ILE A 18 -8.393 10.143 8.149 1.00 10.00 H new ATOM 0 HB ILE A 18 -6.862 11.388 6.743 1.00 10.00 H new ATOM 0 HG12 ILE A 18 -7.769 8.841 5.360 1.00 10.00 H new ATOM 0 HG13 ILE A 18 -8.793 10.220 5.708 1.00 10.00 H new ATOM 0 HG21 ILE A 18 -5.078 10.274 5.454 1.00 10.00 H new ATOM 0 HG22 ILE A 18 -4.791 10.182 7.208 1.00 10.00 H new ATOM 0 HG23 ILE A 18 -5.401 8.759 6.330 1.00 10.00 H new ATOM 0 HD11 ILE A 18 -8.043 10.251 3.376 1.00 10.00 H new ATOM 0 HD12 ILE A 18 -7.385 11.647 4.262 1.00 10.00 H new ATOM 0 HD13 ILE A 18 -6.345 10.247 3.909 1.00 10.00 H new ATOM 49 N ASN A 19 -8.744 7.705 7.706 1.00 10.00 N ATOM 50 CA ASN A 19 -8.979 6.270 7.625 1.00 10.00 C ATOM 51 C ASN A 19 -8.931 5.781 6.185 1.00 10.00 C ATOM 52 O ASN A 19 -9.827 6.063 5.390 1.00 10.00 O ATOM 53 CB ASN A 19 -10.331 5.913 8.250 1.00 10.00 C ATOM 54 CG ASN A 19 -10.425 6.324 9.706 1.00 10.00 C ATOM 55 OD1 ASN A 19 -10.067 5.561 10.604 1.00 10.00 O ATOM 56 ND2 ASN A 19 -10.910 7.532 9.949 1.00 10.00 N ATOM 0 H ASN A 19 -9.583 8.278 7.612 1.00 10.00 H new ATOM 0 HA ASN A 19 -8.184 5.773 8.181 1.00 10.00 H new ATOM 0 HB2 ASN A 19 -11.128 6.399 7.687 1.00 10.00 H new ATOM 0 HB3 ASN A 19 -10.493 4.838 8.168 1.00 10.00 H new ATOM 0 HD21 ASN A 19 -10.999 7.862 10.910 1.00 10.00 H new ATOM 0 HD22 ASN A 19 -11.195 8.132 9.175 1.00 10.00 H new ATOM 63 N LEU A 20 -7.876 5.057 5.852 1.00 10.00 N ATOM 64 CA LEU A 20 -7.707 4.514 4.513 1.00 10.00 C ATOM 65 C LEU A 20 -7.880 3.000 4.539 1.00 10.00 C ATOM 66 O LEU A 20 -7.136 2.295 5.220 1.00 10.00 O ATOM 67 CB LEU A 20 -6.326 4.877 3.964 1.00 10.00 C ATOM 68 CG LEU A 20 -6.059 6.377 3.821 1.00 10.00 C ATOM 69 CD1 LEU A 20 -4.626 6.626 3.387 1.00 10.00 C ATOM 70 CD2 LEU A 20 -7.030 6.999 2.828 1.00 10.00 C ATOM 0 H LEU A 20 -7.118 4.830 6.495 1.00 10.00 H new ATOM 0 HA LEU A 20 -8.466 4.946 3.861 1.00 10.00 H new ATOM 0 HB2 LEU A 20 -5.567 4.449 4.620 1.00 10.00 H new ATOM 0 HB3 LEU A 20 -6.205 4.407 2.988 1.00 10.00 H new ATOM 0 HG LEU A 20 -6.210 6.846 4.793 1.00 10.00 H new ATOM 0 HD11 LEU A 20 -4.456 7.698 3.291 1.00 10.00 H new ATOM 0 HD12 LEU A 20 -3.944 6.216 4.132 1.00 10.00 H new ATOM 0 HD13 LEU A 20 -4.448 6.143 2.426 1.00 10.00 H new ATOM 0 HD21 LEU A 20 -6.826 8.066 2.739 1.00 10.00 H new ATOM 0 HD22 LEU A 20 -6.909 6.524 1.855 1.00 10.00 H new ATOM 0 HD23 LEU A 20 -8.052 6.853 3.178 1.00 10.00 H new ATOM 82 N LYS A 21 -8.867 2.503 3.808 1.00 10.00 N ATOM 83 CA LYS A 21 -9.129 1.072 3.770 1.00 10.00 C ATOM 84 C LYS A 21 -8.328 0.390 2.672 1.00 10.00 C ATOM 85 O LYS A 21 -8.322 0.828 1.522 1.00 10.00 O ATOM 86 CB LYS A 21 -10.617 0.803 3.553 1.00 10.00 C ATOM 87 CG LYS A 21 -11.451 0.872 4.821 1.00 10.00 C ATOM 88 CD LYS A 21 -12.892 0.489 4.537 1.00 10.00 C ATOM 89 CE LYS A 21 -13.762 0.602 5.773 1.00 10.00 C ATOM 90 NZ LYS A 21 -15.144 1.016 5.425 1.00 10.00 N ATOM 0 H LYS A 21 -9.497 3.066 3.236 1.00 10.00 H new ATOM 0 HA LYS A 21 -8.822 0.660 4.732 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -11.005 1.526 2.836 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -10.735 -0.184 3.106 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -11.033 0.203 5.574 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -11.412 1.880 5.233 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -13.291 1.132 3.753 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -12.928 -0.533 4.160 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -13.787 -0.357 6.291 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -13.326 1.326 6.462 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -15.645 1.313 6.287 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -15.110 1.809 4.753 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -15.647 0.216 4.991 1.00 10.00 H new ATOM 104 N VAL A 22 -7.650 -0.683 3.035 1.00 10.00 N ATOM 105 CA VAL A 22 -6.862 -1.450 2.087 1.00 10.00 C ATOM 106 C VAL A 22 -7.478 -2.836 1.941 1.00 10.00 C ATOM 107 O VAL A 22 -7.560 -3.589 2.914 1.00 10.00 O ATOM 108 CB VAL A 22 -5.389 -1.576 2.531 1.00 10.00 C ATOM 109 CG1 VAL A 22 -4.556 -2.255 1.456 1.00 10.00 C ATOM 110 CG2 VAL A 22 -4.814 -0.209 2.874 1.00 10.00 C ATOM 0 H VAL A 22 -7.629 -1.046 3.988 1.00 10.00 H new ATOM 0 HA VAL A 22 -6.870 -0.926 1.131 1.00 10.00 H new ATOM 0 HB VAL A 22 -5.356 -2.196 3.427 1.00 10.00 H new ATOM 0 HG11 VAL A 22 -3.522 -2.332 1.792 1.00 10.00 H new ATOM 0 HG12 VAL A 22 -4.951 -3.253 1.265 1.00 10.00 H new ATOM 0 HG13 VAL A 22 -4.597 -1.667 0.539 1.00 10.00 H new ATOM 0 HG21 VAL A 22 -3.775 -0.319 3.185 1.00 10.00 H new ATOM 0 HG22 VAL A 22 -4.864 0.437 1.998 1.00 10.00 H new ATOM 0 HG23 VAL A 22 -5.390 0.235 3.686 1.00 10.00 H new ATOM 120 N ALA A 23 -7.924 -3.163 0.739 1.00 10.00 N ATOM 121 CA ALA A 23 -8.560 -4.447 0.492 1.00 10.00 C ATOM 122 C ALA A 23 -7.716 -5.323 -0.420 1.00 10.00 C ATOM 123 O ALA A 23 -7.211 -4.867 -1.448 1.00 10.00 O ATOM 124 CB ALA A 23 -9.939 -4.240 -0.109 1.00 10.00 C ATOM 0 H ALA A 23 -7.858 -2.558 -0.080 1.00 10.00 H new ATOM 0 HA ALA A 23 -8.658 -4.960 1.449 1.00 10.00 H new ATOM 0 HB1 ALA A 23 -10.406 -5.208 -0.290 1.00 10.00 H new ATOM 0 HB2 ALA A 23 -10.554 -3.664 0.582 1.00 10.00 H new ATOM 0 HB3 ALA A 23 -9.848 -3.699 -1.051 1.00 10.00 H new ATOM 130 N GLY A 24 -7.570 -6.582 -0.032 1.00 10.00 N ATOM 131 CA GLY A 24 -6.800 -7.517 -0.822 1.00 10.00 C ATOM 132 C GLY A 24 -7.644 -8.194 -1.883 1.00 10.00 C ATOM 133 O GLY A 24 -8.650 -7.644 -2.336 1.00 10.00 O ATOM 0 H GLY A 24 -7.973 -6.972 0.820 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -5.971 -6.993 -1.298 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -6.366 -8.273 -0.168 1.00 10.00 H new ATOM 137 N GLN A 25 -7.243 -9.393 -2.273 1.00 10.00 N ATOM 138 CA GLN A 25 -7.968 -10.146 -3.289 1.00 10.00 C ATOM 139 C GLN A 25 -8.901 -11.155 -2.636 1.00 10.00 C ATOM 140 O GLN A 25 -9.793 -11.708 -3.279 1.00 10.00 O ATOM 141 CB GLN A 25 -6.981 -10.860 -4.216 1.00 10.00 C ATOM 142 CG GLN A 25 -6.063 -9.911 -4.966 1.00 10.00 C ATOM 143 CD GLN A 25 -6.818 -9.005 -5.917 1.00 10.00 C ATOM 144 OE1 GLN A 25 -7.829 -9.397 -6.498 1.00 10.00 O ATOM 145 NE2 GLN A 25 -6.345 -7.781 -6.073 1.00 10.00 N ATOM 0 H GLN A 25 -6.420 -9.868 -1.903 1.00 10.00 H new ATOM 0 HA GLN A 25 -8.567 -9.452 -3.879 1.00 10.00 H new ATOM 0 HB2 GLN A 25 -6.376 -11.550 -3.628 1.00 10.00 H new ATOM 0 HB3 GLN A 25 -7.539 -11.459 -4.936 1.00 10.00 H new ATOM 0 HG2 GLN A 25 -5.512 -9.302 -4.250 1.00 10.00 H new ATOM 0 HG3 GLN A 25 -5.328 -10.489 -5.526 1.00 10.00 H new ATOM 0 HE21 GLN A 25 -5.504 -7.492 -5.574 1.00 10.00 H new ATOM 0 HE22 GLN A 25 -6.821 -7.125 -6.692 1.00 10.00 H new ATOM 154 N ASP A 26 -8.686 -11.376 -1.351 1.00 10.00 N ATOM 155 CA ASP A 26 -9.481 -12.319 -0.578 1.00 10.00 C ATOM 156 C ASP A 26 -10.683 -11.625 0.075 1.00 10.00 C ATOM 157 O ASP A 26 -11.752 -11.537 -0.526 1.00 10.00 O ATOM 158 CB ASP A 26 -8.593 -12.994 0.477 1.00 10.00 C ATOM 159 CG ASP A 26 -7.756 -11.994 1.258 1.00 10.00 C ATOM 160 OD1 ASP A 26 -6.784 -11.452 0.694 1.00 10.00 O ATOM 161 OD2 ASP A 26 -8.099 -11.715 2.425 1.00 10.00 O ATOM 0 H ASP A 26 -7.957 -10.908 -0.813 1.00 10.00 H new ATOM 0 HA ASP A 26 -9.875 -13.082 -1.250 1.00 10.00 H new ATOM 0 HB2 ASP A 26 -9.220 -13.557 1.169 1.00 10.00 H new ATOM 0 HB3 ASP A 26 -7.934 -13.711 -0.012 1.00 10.00 H new ATOM 166 N GLY A 27 -10.511 -11.143 1.300 1.00 10.00 N ATOM 167 CA GLY A 27 -11.586 -10.468 1.998 1.00 10.00 C ATOM 168 C GLY A 27 -11.090 -9.704 3.209 1.00 10.00 C ATOM 169 O GLY A 27 -11.849 -9.442 4.145 1.00 10.00 O ATOM 0 H GLY A 27 -9.639 -11.209 1.825 1.00 10.00 H new ATOM 0 HA2 GLY A 27 -12.085 -9.780 1.315 1.00 10.00 H new ATOM 0 HA3 GLY A 27 -12.330 -11.200 2.312 1.00 10.00 H new ATOM 173 N SER A 28 -9.810 -9.362 3.194 1.00 10.00 N ATOM 174 CA SER A 28 -9.195 -8.620 4.282 1.00 10.00 C ATOM 175 C SER A 28 -9.367 -7.124 4.054 1.00 10.00 C ATOM 176 O SER A 28 -9.013 -6.611 2.989 1.00 10.00 O ATOM 177 CB SER A 28 -7.711 -8.981 4.369 1.00 10.00 C ATOM 178 OG SER A 28 -7.192 -9.301 3.085 1.00 10.00 O ATOM 0 H SER A 28 -9.172 -9.590 2.431 1.00 10.00 H new ATOM 0 HA SER A 28 -9.680 -8.883 5.222 1.00 10.00 H new ATOM 0 HB2 SER A 28 -7.154 -8.146 4.794 1.00 10.00 H new ATOM 0 HB3 SER A 28 -7.577 -9.828 5.042 1.00 10.00 H new ATOM 0 HG SER A 28 -7.274 -10.265 2.930 1.00 10.00 H new ATOM 184 N VAL A 29 -9.929 -6.422 5.035 1.00 10.00 N ATOM 185 CA VAL A 29 -10.133 -4.986 4.899 1.00 10.00 C ATOM 186 C VAL A 29 -9.489 -4.242 6.059 1.00 10.00 C ATOM 187 O VAL A 29 -10.160 -3.863 7.017 1.00 10.00 O ATOM 188 CB VAL A 29 -11.632 -4.616 4.826 1.00 10.00 C ATOM 189 CG1 VAL A 29 -11.805 -3.192 4.320 1.00 10.00 C ATOM 190 CG2 VAL A 29 -12.395 -5.593 3.941 1.00 10.00 C ATOM 0 H VAL A 29 -10.246 -6.819 5.920 1.00 10.00 H new ATOM 0 HA VAL A 29 -9.662 -4.688 3.962 1.00 10.00 H new ATOM 0 HB VAL A 29 -12.045 -4.680 5.833 1.00 10.00 H new ATOM 0 HG11 VAL A 29 -12.866 -2.948 4.275 1.00 10.00 H new ATOM 0 HG12 VAL A 29 -11.303 -2.502 4.998 1.00 10.00 H new ATOM 0 HG13 VAL A 29 -11.370 -3.104 3.324 1.00 10.00 H new ATOM 0 HG21 VAL A 29 -13.447 -5.309 3.908 1.00 10.00 H new ATOM 0 HG22 VAL A 29 -11.981 -5.570 2.933 1.00 10.00 H new ATOM 0 HG23 VAL A 29 -12.304 -6.600 4.348 1.00 10.00 H new ATOM 200 N VAL A 30 -8.184 -4.041 5.973 1.00 10.00 N ATOM 201 CA VAL A 30 -7.459 -3.347 7.025 1.00 10.00 C ATOM 202 C VAL A 30 -7.723 -1.846 6.959 1.00 10.00 C ATOM 203 O VAL A 30 -7.788 -1.260 5.874 1.00 10.00 O ATOM 204 CB VAL A 30 -5.943 -3.620 6.955 1.00 10.00 C ATOM 205 CG1 VAL A 30 -5.653 -5.080 7.268 1.00 10.00 C ATOM 206 CG2 VAL A 30 -5.382 -3.246 5.593 1.00 10.00 C ATOM 0 H VAL A 30 -7.607 -4.347 5.189 1.00 10.00 H new ATOM 0 HA VAL A 30 -7.824 -3.733 7.977 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.452 -2.998 7.703 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -4.579 -5.257 7.215 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -6.010 -5.315 8.271 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -6.162 -5.716 6.543 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -4.311 -3.449 5.572 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.878 -3.835 4.821 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.554 -2.186 5.407 1.00 10.00 H new ATOM 216 N GLN A 31 -7.886 -1.233 8.119 1.00 10.00 N ATOM 217 CA GLN A 31 -8.159 0.191 8.198 1.00 10.00 C ATOM 218 C GLN A 31 -6.925 0.945 8.679 1.00 10.00 C ATOM 219 O GLN A 31 -6.590 0.931 9.864 1.00 10.00 O ATOM 220 CB GLN A 31 -9.342 0.437 9.138 1.00 10.00 C ATOM 221 CG GLN A 31 -9.820 1.880 9.175 1.00 10.00 C ATOM 222 CD GLN A 31 -11.171 2.012 9.851 1.00 10.00 C ATOM 223 OE1 GLN A 31 -12.006 1.113 9.775 1.00 10.00 O ATOM 224 NE2 GLN A 31 -11.399 3.129 10.522 1.00 10.00 N ATOM 0 H GLN A 31 -7.834 -1.702 9.023 1.00 10.00 H new ATOM 0 HA GLN A 31 -8.414 0.560 7.205 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -10.172 -0.201 8.834 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -9.060 0.134 10.146 1.00 10.00 H new ATOM 0 HG2 GLN A 31 -9.088 2.491 9.704 1.00 10.00 H new ATOM 0 HG3 GLN A 31 -9.884 2.267 8.158 1.00 10.00 H new ATOM 0 HE21 GLN A 31 -10.683 3.854 10.564 1.00 10.00 H new ATOM 0 HE22 GLN A 31 -12.291 3.265 10.998 1.00 10.00 H new ATOM 233 N PHE A 32 -6.244 1.591 7.755 1.00 10.00 N ATOM 234 CA PHE A 32 -5.055 2.350 8.090 1.00 10.00 C ATOM 235 C PHE A 32 -5.432 3.744 8.549 1.00 10.00 C ATOM 236 O PHE A 32 -5.926 4.557 7.769 1.00 10.00 O ATOM 237 CB PHE A 32 -4.108 2.423 6.897 1.00 10.00 C ATOM 238 CG PHE A 32 -3.122 1.289 6.861 1.00 10.00 C ATOM 239 CD1 PHE A 32 -3.415 0.120 6.180 1.00 10.00 C ATOM 240 CD2 PHE A 32 -1.907 1.393 7.516 1.00 10.00 C ATOM 241 CE1 PHE A 32 -2.515 -0.927 6.155 1.00 10.00 C ATOM 242 CE2 PHE A 32 -1.001 0.349 7.493 1.00 10.00 C ATOM 243 CZ PHE A 32 -1.307 -0.813 6.811 1.00 10.00 C ATOM 0 H PHE A 32 -6.493 1.606 6.766 1.00 10.00 H new ATOM 0 HA PHE A 32 -4.541 1.840 8.905 1.00 10.00 H new ATOM 0 HB2 PHE A 32 -4.691 2.420 5.976 1.00 10.00 H new ATOM 0 HB3 PHE A 32 -3.566 3.368 6.928 1.00 10.00 H new ATOM 0 HD1 PHE A 32 -4.358 0.026 5.662 1.00 10.00 H new ATOM 0 HD2 PHE A 32 -1.664 2.299 8.051 1.00 10.00 H new ATOM 0 HE1 PHE A 32 -2.757 -1.835 5.622 1.00 10.00 H new ATOM 0 HE2 PHE A 32 -0.056 0.442 8.007 1.00 10.00 H new ATOM 0 HZ PHE A 32 -0.602 -1.631 6.792 1.00 10.00 H new ATOM 253 N LYS A 33 -5.212 4.005 9.823 1.00 10.00 N ATOM 254 CA LYS A 33 -5.523 5.293 10.407 1.00 10.00 C ATOM 255 C LYS A 33 -4.235 6.088 10.601 1.00 10.00 C ATOM 256 O LYS A 33 -3.670 6.139 11.696 1.00 10.00 O ATOM 257 CB LYS A 33 -6.254 5.091 11.736 1.00 10.00 C ATOM 258 CG LYS A 33 -6.791 6.371 12.350 1.00 10.00 C ATOM 259 CD LYS A 33 -7.587 6.083 13.613 1.00 10.00 C ATOM 260 CE LYS A 33 -8.184 7.351 14.199 1.00 10.00 C ATOM 261 NZ LYS A 33 -9.120 7.062 15.316 1.00 10.00 N ATOM 0 H LYS A 33 -4.814 3.333 10.479 1.00 10.00 H new ATOM 0 HA LYS A 33 -6.177 5.856 9.741 1.00 10.00 H new ATOM 0 HB2 LYS A 33 -7.083 4.400 11.581 1.00 10.00 H new ATOM 0 HB3 LYS A 33 -5.573 4.619 12.444 1.00 10.00 H new ATOM 0 HG2 LYS A 33 -5.963 7.041 12.583 1.00 10.00 H new ATOM 0 HG3 LYS A 33 -7.424 6.886 11.628 1.00 10.00 H new ATOM 0 HD2 LYS A 33 -8.385 5.375 13.388 1.00 10.00 H new ATOM 0 HD3 LYS A 33 -6.940 5.610 14.352 1.00 10.00 H new ATOM 0 HE2 LYS A 33 -7.382 7.998 14.556 1.00 10.00 H new ATOM 0 HE3 LYS A 33 -8.711 7.898 13.417 1.00 10.00 H new ATOM 0 HZ1 LYS A 33 -9.504 7.954 15.687 1.00 10.00 H new ATOM 0 HZ2 LYS A 33 -9.899 6.466 14.971 1.00 10.00 H new ATOM 0 HZ3 LYS A 33 -8.612 6.563 16.074 1.00 10.00 H new ATOM 275 N ILE A 34 -3.765 6.681 9.518 1.00 10.00 N ATOM 276 CA ILE A 34 -2.537 7.460 9.536 1.00 10.00 C ATOM 277 C ILE A 34 -2.839 8.938 9.358 1.00 10.00 C ATOM 278 O ILE A 34 -3.996 9.330 9.237 1.00 10.00 O ATOM 279 CB ILE A 34 -1.569 7.010 8.418 1.00 10.00 C ATOM 280 CG1 ILE A 34 -2.221 7.175 7.039 1.00 10.00 C ATOM 281 CG2 ILE A 34 -1.148 5.563 8.636 1.00 10.00 C ATOM 282 CD1 ILE A 34 -1.245 7.074 5.886 1.00 10.00 C ATOM 0 H ILE A 34 -4.220 6.638 8.606 1.00 10.00 H new ATOM 0 HA ILE A 34 -2.064 7.294 10.504 1.00 10.00 H new ATOM 0 HB ILE A 34 -0.682 7.642 8.455 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -2.992 6.414 6.918 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -2.720 8.143 6.997 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -0.466 5.259 7.842 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.647 5.471 9.599 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -2.029 4.922 8.623 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -1.780 7.201 4.945 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -0.488 7.852 5.981 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -0.764 6.096 5.901 1.00 10.00 H new ATOM 294 N LYS A 35 -1.806 9.759 9.355 1.00 10.00 N ATOM 295 CA LYS A 35 -1.986 11.186 9.160 1.00 10.00 C ATOM 296 C LYS A 35 -1.894 11.502 7.673 1.00 10.00 C ATOM 297 O LYS A 35 -1.340 10.722 6.900 1.00 10.00 O ATOM 298 CB LYS A 35 -0.940 11.982 9.947 1.00 10.00 C ATOM 299 CG LYS A 35 -1.164 11.968 11.451 1.00 10.00 C ATOM 300 CD LYS A 35 -0.075 12.733 12.187 1.00 10.00 C ATOM 301 CE LYS A 35 -0.312 12.722 13.689 1.00 10.00 C ATOM 302 NZ LYS A 35 0.789 13.384 14.439 1.00 10.00 N ATOM 0 H LYS A 35 -0.838 9.465 9.485 1.00 10.00 H new ATOM 0 HA LYS A 35 -2.969 11.476 9.532 1.00 10.00 H new ATOM 0 HB2 LYS A 35 0.049 11.577 9.732 1.00 10.00 H new ATOM 0 HB3 LYS A 35 -0.944 13.015 9.598 1.00 10.00 H new ATOM 0 HG2 LYS A 35 -2.135 12.407 11.679 1.00 10.00 H new ATOM 0 HG3 LYS A 35 -1.189 10.938 11.806 1.00 10.00 H new ATOM 0 HD2 LYS A 35 0.896 12.290 11.967 1.00 10.00 H new ATOM 0 HD3 LYS A 35 -0.045 13.762 11.829 1.00 10.00 H new ATOM 0 HE2 LYS A 35 -1.253 13.226 13.910 1.00 10.00 H new ATOM 0 HE3 LYS A 35 -0.414 11.692 14.031 1.00 10.00 H new ATOM 0 HZ1 LYS A 35 0.583 13.352 15.458 1.00 10.00 H new ATOM 0 HZ2 LYS A 35 1.684 12.889 14.251 1.00 10.00 H new ATOM 0 HZ3 LYS A 35 0.871 14.375 14.133 1.00 10.00 H new ATOM 316 N ARG A 36 -2.421 12.649 7.269 1.00 10.00 N ATOM 317 CA ARG A 36 -2.391 13.042 5.861 1.00 10.00 C ATOM 318 C ARG A 36 -0.967 13.402 5.433 1.00 10.00 C ATOM 319 O ARG A 36 -0.682 13.568 4.246 1.00 10.00 O ATOM 320 CB ARG A 36 -3.344 14.217 5.611 1.00 10.00 C ATOM 321 CG ARG A 36 -4.803 13.881 5.891 1.00 10.00 C ATOM 322 CD ARG A 36 -5.725 15.052 5.585 1.00 10.00 C ATOM 323 NE ARG A 36 -5.901 15.256 4.147 1.00 10.00 N ATOM 324 CZ ARG A 36 -6.986 14.882 3.464 1.00 10.00 C ATOM 325 NH1 ARG A 36 -7.993 14.264 4.077 1.00 10.00 N ATOM 326 NH2 ARG A 36 -7.069 15.139 2.166 1.00 10.00 N ATOM 0 H ARG A 36 -2.872 13.322 7.889 1.00 10.00 H new ATOM 0 HA ARG A 36 -2.724 12.196 5.260 1.00 10.00 H new ATOM 0 HB2 ARG A 36 -3.045 15.057 6.238 1.00 10.00 H new ATOM 0 HB3 ARG A 36 -3.246 14.541 4.575 1.00 10.00 H new ATOM 0 HG2 ARG A 36 -5.099 13.020 5.291 1.00 10.00 H new ATOM 0 HG3 ARG A 36 -4.915 13.595 6.937 1.00 10.00 H new ATOM 0 HD2 ARG A 36 -6.697 14.877 6.047 1.00 10.00 H new ATOM 0 HD3 ARG A 36 -5.318 15.959 6.032 1.00 10.00 H new ATOM 0 HE ARG A 36 -5.147 15.713 3.634 1.00 10.00 H new ATOM 0 HH11 ARG A 36 -7.940 14.072 5.077 1.00 10.00 H new ATOM 0 HH12 ARG A 36 -8.817 13.982 3.546 1.00 10.00 H new ATOM 0 HH21 ARG A 36 -6.305 15.621 1.692 1.00 10.00 H new ATOM 0 HH22 ARG A 36 -7.896 14.855 1.642 1.00 10.00 H new ATOM 340 N HIS A 37 -0.082 13.498 6.418 1.00 10.00 N ATOM 341 CA HIS A 37 1.317 13.838 6.186 1.00 10.00 C ATOM 342 C HIS A 37 2.190 12.585 6.187 1.00 10.00 C ATOM 343 O HIS A 37 3.370 12.639 5.843 1.00 10.00 O ATOM 344 CB HIS A 37 1.815 14.799 7.277 1.00 10.00 C ATOM 345 CG HIS A 37 0.748 15.690 7.842 1.00 10.00 C ATOM 346 ND1 HIS A 37 -0.142 15.235 8.790 1.00 10.00 N ATOM 347 CD2 HIS A 37 0.471 16.983 7.559 1.00 10.00 C ATOM 348 CE1 HIS A 37 -0.936 16.259 9.059 1.00 10.00 C ATOM 349 NE2 HIS A 37 -0.603 17.336 8.334 1.00 10.00 N ATOM 0 H HIS A 37 -0.313 13.343 7.399 1.00 10.00 H new ATOM 0 HA HIS A 37 1.388 14.319 5.210 1.00 10.00 H new ATOM 0 HB2 HIS A 37 2.253 14.216 8.087 1.00 10.00 H new ATOM 0 HB3 HIS A 37 2.610 15.419 6.864 1.00 10.00 H new ATOM 0 HD2 HIS A 37 0.995 17.615 6.858 1.00 10.00 H new ATOM 0 HE1 HIS A 37 -1.748 16.231 9.771 1.00 10.00 H new ATOM 0 HE2 HIS A 37 -1.062 18.247 8.355 1.00 10.00 H new ATOM 357 N THR A 38 1.603 11.459 6.571 1.00 10.00 N ATOM 358 CA THR A 38 2.330 10.200 6.641 1.00 10.00 C ATOM 359 C THR A 38 2.519 9.590 5.250 1.00 10.00 C ATOM 360 O THR A 38 1.546 9.378 4.527 1.00 10.00 O ATOM 361 CB THR A 38 1.587 9.203 7.550 1.00 10.00 C ATOM 362 OG1 THR A 38 1.227 9.849 8.780 1.00 10.00 O ATOM 363 CG2 THR A 38 2.445 7.983 7.848 1.00 10.00 C ATOM 0 H THR A 38 0.621 11.393 6.840 1.00 10.00 H new ATOM 0 HA THR A 38 3.314 10.407 7.061 1.00 10.00 H new ATOM 0 HB THR A 38 0.690 8.870 7.028 1.00 10.00 H new ATOM 0 HG1 THR A 38 1.207 9.188 9.503 1.00 10.00 H new ATOM 0 HG21 THR A 38 1.893 7.298 8.492 1.00 10.00 H new ATOM 0 HG22 THR A 38 2.698 7.479 6.915 1.00 10.00 H new ATOM 0 HG23 THR A 38 3.360 8.296 8.351 1.00 10.00 H new ATOM 371 N PRO A 39 3.779 9.326 4.854 1.00 10.00 N ATOM 372 CA PRO A 39 4.093 8.731 3.548 1.00 10.00 C ATOM 373 C PRO A 39 3.429 7.368 3.358 1.00 10.00 C ATOM 374 O PRO A 39 3.480 6.508 4.242 1.00 10.00 O ATOM 375 CB PRO A 39 5.619 8.581 3.571 1.00 10.00 C ATOM 376 CG PRO A 39 6.087 9.538 4.610 1.00 10.00 C ATOM 377 CD PRO A 39 4.995 9.605 5.637 1.00 10.00 C ATOM 0 HA PRO A 39 3.728 9.347 2.727 1.00 10.00 H new ATOM 0 HB2 PRO A 39 5.911 7.560 3.816 1.00 10.00 H new ATOM 0 HB3 PRO A 39 6.053 8.812 2.598 1.00 10.00 H new ATOM 0 HG2 PRO A 39 7.022 9.201 5.057 1.00 10.00 H new ATOM 0 HG3 PRO A 39 6.276 10.521 4.178 1.00 10.00 H new ATOM 0 HD2 PRO A 39 5.141 8.870 6.429 1.00 10.00 H new ATOM 0 HD3 PRO A 39 4.951 10.584 6.114 1.00 10.00 H new ATOM 385 N LEU A 40 2.829 7.171 2.188 1.00 10.00 N ATOM 386 CA LEU A 40 2.138 5.925 1.873 1.00 10.00 C ATOM 387 C LEU A 40 3.110 4.756 1.732 1.00 10.00 C ATOM 388 O LEU A 40 2.698 3.597 1.748 1.00 10.00 O ATOM 389 CB LEU A 40 1.314 6.079 0.592 1.00 10.00 C ATOM 390 CG LEU A 40 0.133 7.050 0.690 1.00 10.00 C ATOM 391 CD1 LEU A 40 -0.640 7.088 -0.616 1.00 10.00 C ATOM 392 CD2 LEU A 40 -0.790 6.661 1.836 1.00 10.00 C ATOM 0 H LEU A 40 2.808 7.863 1.439 1.00 10.00 H new ATOM 0 HA LEU A 40 1.470 5.704 2.706 1.00 10.00 H new ATOM 0 HB2 LEU A 40 1.974 6.414 -0.208 1.00 10.00 H new ATOM 0 HB3 LEU A 40 0.935 5.099 0.303 1.00 10.00 H new ATOM 0 HG LEU A 40 0.530 8.046 0.887 1.00 10.00 H new ATOM 0 HD11 LEU A 40 -1.474 7.783 -0.525 1.00 10.00 H new ATOM 0 HD12 LEU A 40 0.019 7.416 -1.420 1.00 10.00 H new ATOM 0 HD13 LEU A 40 -1.021 6.092 -0.842 1.00 10.00 H new ATOM 0 HD21 LEU A 40 -1.622 7.364 1.888 1.00 10.00 H new ATOM 0 HD22 LEU A 40 -1.175 5.655 1.668 1.00 10.00 H new ATOM 0 HD23 LEU A 40 -0.236 6.686 2.774 1.00 10.00 H new ATOM 404 N SER A 41 4.396 5.060 1.603 1.00 10.00 N ATOM 405 CA SER A 41 5.417 4.026 1.474 1.00 10.00 C ATOM 406 C SER A 41 5.418 3.117 2.698 1.00 10.00 C ATOM 407 O SER A 41 5.431 1.891 2.581 1.00 10.00 O ATOM 408 CB SER A 41 6.789 4.670 1.299 1.00 10.00 C ATOM 409 OG SER A 41 6.886 5.852 2.075 1.00 10.00 O ATOM 0 H SER A 41 4.757 6.014 1.585 1.00 10.00 H new ATOM 0 HA SER A 41 5.191 3.421 0.596 1.00 10.00 H new ATOM 0 HB2 SER A 41 7.567 3.968 1.597 1.00 10.00 H new ATOM 0 HB3 SER A 41 6.956 4.904 0.248 1.00 10.00 H new ATOM 0 HG SER A 41 6.730 6.632 1.503 1.00 10.00 H new ATOM 415 N LYS A 42 5.377 3.737 3.873 1.00 10.00 N ATOM 416 CA LYS A 42 5.373 3.009 5.134 1.00 10.00 C ATOM 417 C LYS A 42 4.039 2.301 5.327 1.00 10.00 C ATOM 418 O LYS A 42 3.968 1.256 5.968 1.00 10.00 O ATOM 419 CB LYS A 42 5.660 3.968 6.292 1.00 10.00 C ATOM 420 CG LYS A 42 6.874 4.845 6.035 1.00 10.00 C ATOM 421 CD LYS A 42 7.252 5.684 7.244 1.00 10.00 C ATOM 422 CE LYS A 42 8.537 6.451 6.979 1.00 10.00 C ATOM 423 NZ LYS A 42 9.051 7.140 8.190 1.00 10.00 N ATOM 0 H LYS A 42 5.346 4.751 3.976 1.00 10.00 H new ATOM 0 HA LYS A 42 6.157 2.252 5.114 1.00 10.00 H new ATOM 0 HB2 LYS A 42 4.788 4.600 6.460 1.00 10.00 H new ATOM 0 HB3 LYS A 42 5.818 3.393 7.205 1.00 10.00 H new ATOM 0 HG2 LYS A 42 7.719 4.217 5.754 1.00 10.00 H new ATOM 0 HG3 LYS A 42 6.671 5.502 5.190 1.00 10.00 H new ATOM 0 HD2 LYS A 42 6.447 6.381 7.476 1.00 10.00 H new ATOM 0 HD3 LYS A 42 7.378 5.041 8.115 1.00 10.00 H new ATOM 0 HE2 LYS A 42 9.296 5.763 6.607 1.00 10.00 H new ATOM 0 HE3 LYS A 42 8.361 7.187 6.194 1.00 10.00 H new ATOM 0 HZ1 LYS A 42 10.076 6.983 8.270 1.00 10.00 H new ATOM 0 HZ2 LYS A 42 8.862 8.160 8.116 1.00 10.00 H new ATOM 0 HZ3 LYS A 42 8.576 6.760 9.034 1.00 10.00 H new ATOM 437 N LEU A 43 2.990 2.872 4.747 1.00 10.00 N ATOM 438 CA LEU A 43 1.657 2.291 4.824 1.00 10.00 C ATOM 439 C LEU A 43 1.631 0.984 4.038 1.00 10.00 C ATOM 440 O LEU A 43 1.151 -0.043 4.521 1.00 10.00 O ATOM 441 CB LEU A 43 0.619 3.278 4.263 1.00 10.00 C ATOM 442 CG LEU A 43 -0.813 2.747 4.141 1.00 10.00 C ATOM 443 CD1 LEU A 43 -1.810 3.846 4.470 1.00 10.00 C ATOM 444 CD2 LEU A 43 -1.072 2.204 2.739 1.00 10.00 C ATOM 0 H LEU A 43 3.039 3.741 4.216 1.00 10.00 H new ATOM 0 HA LEU A 43 1.407 2.086 5.865 1.00 10.00 H new ATOM 0 HB2 LEU A 43 0.605 4.162 4.901 1.00 10.00 H new ATOM 0 HB3 LEU A 43 0.951 3.602 3.277 1.00 10.00 H new ATOM 0 HG LEU A 43 -0.937 1.931 4.853 1.00 10.00 H new ATOM 0 HD11 LEU A 43 -2.824 3.456 4.380 1.00 10.00 H new ATOM 0 HD12 LEU A 43 -1.644 4.194 5.490 1.00 10.00 H new ATOM 0 HD13 LEU A 43 -1.678 4.677 3.777 1.00 10.00 H new ATOM 0 HD21 LEU A 43 -2.095 1.832 2.676 1.00 10.00 H new ATOM 0 HD22 LEU A 43 -0.929 3.000 2.008 1.00 10.00 H new ATOM 0 HD23 LEU A 43 -0.377 1.391 2.530 1.00 10.00 H new ATOM 456 N MET A 44 2.168 1.039 2.825 1.00 10.00 N ATOM 457 CA MET A 44 2.218 -0.124 1.952 1.00 10.00 C ATOM 458 C MET A 44 3.129 -1.193 2.537 1.00 10.00 C ATOM 459 O MET A 44 2.816 -2.384 2.495 1.00 10.00 O ATOM 460 CB MET A 44 2.709 0.277 0.559 1.00 10.00 C ATOM 461 CG MET A 44 1.762 1.213 -0.176 1.00 10.00 C ATOM 462 SD MET A 44 2.322 1.605 -1.845 1.00 10.00 S ATOM 463 CE MET A 44 3.791 2.572 -1.506 1.00 10.00 C ATOM 0 H MET A 44 2.577 1.883 2.423 1.00 10.00 H new ATOM 0 HA MET A 44 1.211 -0.532 1.867 1.00 10.00 H new ATOM 0 HB2 MET A 44 3.683 0.758 0.651 1.00 10.00 H new ATOM 0 HB3 MET A 44 2.853 -0.623 -0.039 1.00 10.00 H new ATOM 0 HG2 MET A 44 0.774 0.756 -0.227 1.00 10.00 H new ATOM 0 HG3 MET A 44 1.657 2.137 0.393 1.00 10.00 H new ATOM 0 HE1 MET A 44 4.165 3.003 -2.435 1.00 10.00 H new ATOM 0 HE2 MET A 44 3.547 3.372 -0.807 1.00 10.00 H new ATOM 0 HE3 MET A 44 4.556 1.930 -1.070 1.00 10.00 H new ATOM 473 N LYS A 45 4.249 -0.757 3.100 1.00 10.00 N ATOM 474 CA LYS A 45 5.211 -1.671 3.694 1.00 10.00 C ATOM 475 C LYS A 45 4.623 -2.355 4.923 1.00 10.00 C ATOM 476 O LYS A 45 4.873 -3.535 5.164 1.00 10.00 O ATOM 477 CB LYS A 45 6.496 -0.928 4.062 1.00 10.00 C ATOM 478 CG LYS A 45 7.752 -1.751 3.830 1.00 10.00 C ATOM 479 CD LYS A 45 9.001 -0.891 3.881 1.00 10.00 C ATOM 480 CE LYS A 45 10.224 -1.660 3.405 1.00 10.00 C ATOM 481 NZ LYS A 45 11.457 -0.833 3.457 1.00 10.00 N ATOM 0 H LYS A 45 4.512 0.227 3.157 1.00 10.00 H new ATOM 0 HA LYS A 45 5.450 -2.439 2.958 1.00 10.00 H new ATOM 0 HB2 LYS A 45 6.558 -0.011 3.477 1.00 10.00 H new ATOM 0 HB3 LYS A 45 6.450 -0.635 5.111 1.00 10.00 H new ATOM 0 HG2 LYS A 45 7.818 -2.535 4.584 1.00 10.00 H new ATOM 0 HG3 LYS A 45 7.690 -2.246 2.861 1.00 10.00 H new ATOM 0 HD2 LYS A 45 8.861 -0.006 3.260 1.00 10.00 H new ATOM 0 HD3 LYS A 45 9.163 -0.542 4.901 1.00 10.00 H new ATOM 0 HE2 LYS A 45 10.357 -2.548 4.023 1.00 10.00 H new ATOM 0 HE3 LYS A 45 10.061 -2.004 2.384 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 12.266 -1.395 3.124 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 11.341 0.002 2.847 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 11.628 -0.526 4.436 1.00 10.00 H new ATOM 495 N ALA A 46 3.831 -1.610 5.689 1.00 10.00 N ATOM 496 CA ALA A 46 3.201 -2.142 6.892 1.00 10.00 C ATOM 497 C ALA A 46 2.276 -3.304 6.552 1.00 10.00 C ATOM 498 O ALA A 46 2.303 -4.346 7.209 1.00 10.00 O ATOM 499 CB ALA A 46 2.435 -1.048 7.620 1.00 10.00 C ATOM 0 H ALA A 46 3.610 -0.633 5.496 1.00 10.00 H new ATOM 0 HA ALA A 46 3.986 -2.514 7.551 1.00 10.00 H new ATOM 0 HB1 ALA A 46 1.971 -1.462 8.515 1.00 10.00 H new ATOM 0 HB2 ALA A 46 3.121 -0.250 7.903 1.00 10.00 H new ATOM 0 HB3 ALA A 46 1.663 -0.646 6.964 1.00 10.00 H new ATOM 505 N TYR A 47 1.456 -3.129 5.519 1.00 10.00 N ATOM 506 CA TYR A 47 0.540 -4.180 5.098 1.00 10.00 C ATOM 507 C TYR A 47 1.325 -5.346 4.509 1.00 10.00 C ATOM 508 O TYR A 47 0.994 -6.509 4.733 1.00 10.00 O ATOM 509 CB TYR A 47 -0.470 -3.649 4.073 1.00 10.00 C ATOM 510 CG TYR A 47 -1.527 -4.662 3.679 1.00 10.00 C ATOM 511 CD1 TYR A 47 -1.659 -5.085 2.361 1.00 10.00 C ATOM 512 CD2 TYR A 47 -2.386 -5.206 4.628 1.00 10.00 C ATOM 513 CE1 TYR A 47 -2.619 -6.015 2.001 1.00 10.00 C ATOM 514 CE2 TYR A 47 -3.348 -6.136 4.274 1.00 10.00 C ATOM 515 CZ TYR A 47 -3.459 -6.538 2.960 1.00 10.00 C ATOM 516 OH TYR A 47 -4.413 -7.466 2.606 1.00 10.00 O ATOM 0 H TYR A 47 1.408 -2.275 4.963 1.00 10.00 H new ATOM 0 HA TYR A 47 -0.014 -4.525 5.971 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -0.960 -2.766 4.483 1.00 10.00 H new ATOM 0 HB3 TYR A 47 0.066 -3.330 3.179 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -1.001 -4.681 1.605 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -2.301 -4.897 5.659 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -2.709 -6.330 0.972 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.009 -6.545 5.024 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.920 -7.733 3.401 1.00 10.00 H new ATOM 526 N CYS A 48 2.377 -5.016 3.772 1.00 10.00 N ATOM 527 CA CYS A 48 3.234 -6.017 3.150 1.00 10.00 C ATOM 528 C CYS A 48 3.870 -6.920 4.206 1.00 10.00 C ATOM 529 O CYS A 48 3.908 -8.146 4.054 1.00 10.00 O ATOM 530 CB CYS A 48 4.319 -5.324 2.326 1.00 10.00 C ATOM 531 SG CYS A 48 5.367 -6.451 1.388 1.00 10.00 S ATOM 0 H CYS A 48 2.659 -4.053 3.589 1.00 10.00 H new ATOM 0 HA CYS A 48 2.625 -6.639 2.494 1.00 10.00 H new ATOM 0 HB2 CYS A 48 3.845 -4.627 1.635 1.00 10.00 H new ATOM 0 HB3 CYS A 48 4.946 -4.734 2.994 1.00 10.00 H new ATOM 0 HG CYS A 48 5.803 -7.392 2.172 1.00 10.00 H new ATOM 537 N GLU A 49 4.353 -6.305 5.278 1.00 10.00 N ATOM 538 CA GLU A 49 4.987 -7.034 6.369 1.00 10.00 C ATOM 539 C GLU A 49 3.962 -7.872 7.133 1.00 10.00 C ATOM 540 O GLU A 49 4.311 -8.849 7.792 1.00 10.00 O ATOM 541 CB GLU A 49 5.685 -6.058 7.318 1.00 10.00 C ATOM 542 CG GLU A 49 6.970 -5.470 6.756 1.00 10.00 C ATOM 543 CD GLU A 49 8.005 -6.531 6.438 1.00 10.00 C ATOM 544 OE1 GLU A 49 8.348 -6.700 5.248 1.00 10.00 O ATOM 545 OE2 GLU A 49 8.476 -7.206 7.377 1.00 10.00 O ATOM 0 H GLU A 49 4.317 -5.295 5.415 1.00 10.00 H new ATOM 0 HA GLU A 49 5.730 -7.709 5.944 1.00 10.00 H new ATOM 0 HB2 GLU A 49 4.999 -5.246 7.558 1.00 10.00 H new ATOM 0 HB3 GLU A 49 5.910 -6.572 8.253 1.00 10.00 H new ATOM 0 HG2 GLU A 49 6.742 -4.907 5.851 1.00 10.00 H new ATOM 0 HG3 GLU A 49 7.387 -4.764 7.474 1.00 10.00 H new ATOM 552 N ARG A 50 2.697 -7.486 7.041 1.00 10.00 N ATOM 553 CA ARG A 50 1.627 -8.203 7.722 1.00 10.00 C ATOM 554 C ARG A 50 1.262 -9.479 6.978 1.00 10.00 C ATOM 555 O ARG A 50 0.861 -10.470 7.586 1.00 10.00 O ATOM 556 CB ARG A 50 0.397 -7.315 7.863 1.00 10.00 C ATOM 557 CG ARG A 50 0.391 -6.496 9.137 1.00 10.00 C ATOM 558 CD ARG A 50 -0.703 -5.450 9.108 1.00 10.00 C ATOM 559 NE ARG A 50 -1.080 -5.032 10.450 1.00 10.00 N ATOM 560 CZ ARG A 50 -2.333 -4.804 10.828 1.00 10.00 C ATOM 561 NH1 ARG A 50 -3.325 -4.914 9.952 1.00 10.00 N ATOM 562 NH2 ARG A 50 -2.597 -4.461 12.080 1.00 10.00 N ATOM 0 H ARG A 50 2.386 -6.679 6.500 1.00 10.00 H new ATOM 0 HA ARG A 50 1.986 -8.475 8.715 1.00 10.00 H new ATOM 0 HB2 ARG A 50 0.343 -6.642 7.007 1.00 10.00 H new ATOM 0 HB3 ARG A 50 -0.497 -7.938 7.836 1.00 10.00 H new ATOM 0 HG2 ARG A 50 0.247 -7.153 9.995 1.00 10.00 H new ATOM 0 HG3 ARG A 50 1.359 -6.011 9.266 1.00 10.00 H new ATOM 0 HD2 ARG A 50 -0.365 -4.585 8.538 1.00 10.00 H new ATOM 0 HD3 ARG A 50 -1.576 -5.850 8.592 1.00 10.00 H new ATOM 0 HE ARG A 50 -0.339 -4.907 11.140 1.00 10.00 H new ATOM 0 HH11 ARG A 50 -3.126 -5.174 8.986 1.00 10.00 H new ATOM 0 HH12 ARG A 50 -4.286 -4.738 10.245 1.00 10.00 H new ATOM 0 HH21 ARG A 50 -1.838 -4.372 12.755 1.00 10.00 H new ATOM 0 HH22 ARG A 50 -3.560 -4.286 12.369 1.00 10.00 H new ATOM 576 N GLN A 51 1.390 -9.447 5.661 1.00 10.00 N ATOM 577 CA GLN A 51 1.075 -10.610 4.842 1.00 10.00 C ATOM 578 C GLN A 51 2.302 -11.505 4.703 1.00 10.00 C ATOM 579 O GLN A 51 2.222 -12.615 4.168 1.00 10.00 O ATOM 580 CB GLN A 51 0.580 -10.183 3.457 1.00 10.00 C ATOM 581 CG GLN A 51 -0.536 -9.144 3.489 1.00 10.00 C ATOM 582 CD GLN A 51 -1.703 -9.544 4.374 1.00 10.00 C ATOM 583 OE1 GLN A 51 -1.741 -9.207 5.557 1.00 10.00 O ATOM 584 NE2 GLN A 51 -2.663 -10.257 3.811 1.00 10.00 N ATOM 0 H GLN A 51 1.709 -8.632 5.136 1.00 10.00 H new ATOM 0 HA GLN A 51 0.280 -11.169 5.336 1.00 10.00 H new ATOM 0 HB2 GLN A 51 1.420 -9.781 2.890 1.00 10.00 H new ATOM 0 HB3 GLN A 51 0.227 -11.064 2.921 1.00 10.00 H new ATOM 0 HG2 GLN A 51 -0.130 -8.196 3.841 1.00 10.00 H new ATOM 0 HG3 GLN A 51 -0.898 -8.979 2.474 1.00 10.00 H new ATOM 0 HE21 GLN A 51 -2.595 -10.517 2.827 1.00 10.00 H new ATOM 0 HE22 GLN A 51 -3.472 -10.547 4.361 1.00 10.00 H new ATOM 593 N GLY A 52 3.435 -11.009 5.190 1.00 10.00 N ATOM 594 CA GLY A 52 4.678 -11.758 5.127 1.00 10.00 C ATOM 595 C GLY A 52 5.201 -11.885 3.713 1.00 10.00 C ATOM 596 O GLY A 52 5.692 -12.941 3.319 1.00 10.00 O ATOM 0 H GLY A 52 3.515 -10.093 5.631 1.00 10.00 H new ATOM 0 HA2 GLY A 52 5.428 -11.266 5.746 1.00 10.00 H new ATOM 0 HA3 GLY A 52 4.522 -12.753 5.545 1.00 10.00 H new ATOM 600 N LEU A 53 5.098 -10.809 2.950 1.00 10.00 N ATOM 601 CA LEU A 53 5.556 -10.814 1.567 1.00 10.00 C ATOM 602 C LEU A 53 6.609 -9.739 1.335 1.00 10.00 C ATOM 603 O LEU A 53 6.915 -8.944 2.230 1.00 10.00 O ATOM 604 CB LEU A 53 4.374 -10.584 0.620 1.00 10.00 C ATOM 605 CG LEU A 53 3.267 -11.638 0.679 1.00 10.00 C ATOM 606 CD1 LEU A 53 2.079 -11.205 -0.169 1.00 10.00 C ATOM 607 CD2 LEU A 53 3.790 -12.991 0.219 1.00 10.00 C ATOM 0 H LEU A 53 4.703 -9.922 3.262 1.00 10.00 H new ATOM 0 HA LEU A 53 6.003 -11.787 1.365 1.00 10.00 H new ATOM 0 HB2 LEU A 53 3.937 -9.611 0.843 1.00 10.00 H new ATOM 0 HB3 LEU A 53 4.753 -10.537 -0.401 1.00 10.00 H new ATOM 0 HG LEU A 53 2.936 -11.735 1.713 1.00 10.00 H new ATOM 0 HD11 LEU A 53 1.299 -11.965 -0.118 1.00 10.00 H new ATOM 0 HD12 LEU A 53 1.689 -10.259 0.207 1.00 10.00 H new ATOM 0 HD13 LEU A 53 2.397 -11.081 -1.204 1.00 10.00 H new ATOM 0 HD21 LEU A 53 2.988 -13.727 0.268 1.00 10.00 H new ATOM 0 HD22 LEU A 53 4.148 -12.913 -0.808 1.00 10.00 H new ATOM 0 HD23 LEU A 53 4.609 -13.304 0.866 1.00 10.00 H new ATOM 619 N SER A 54 7.163 -9.730 0.134 1.00 10.00 N ATOM 620 CA SER A 54 8.162 -8.750 -0.243 1.00 10.00 C ATOM 621 C SER A 54 7.484 -7.528 -0.847 1.00 10.00 C ATOM 622 O SER A 54 6.529 -7.657 -1.617 1.00 10.00 O ATOM 623 CB SER A 54 9.143 -9.354 -1.247 1.00 10.00 C ATOM 624 OG SER A 54 9.997 -8.363 -1.792 1.00 10.00 O ATOM 0 H SER A 54 6.933 -10.398 -0.601 1.00 10.00 H new ATOM 0 HA SER A 54 8.714 -8.449 0.647 1.00 10.00 H new ATOM 0 HB2 SER A 54 9.741 -10.123 -0.757 1.00 10.00 H new ATOM 0 HB3 SER A 54 8.591 -9.843 -2.050 1.00 10.00 H new ATOM 0 HG SER A 54 10.615 -8.778 -2.429 1.00 10.00 H new ATOM 630 N MET A 55 7.982 -6.347 -0.503 1.00 10.00 N ATOM 631 CA MET A 55 7.420 -5.098 -1.010 1.00 10.00 C ATOM 632 C MET A 55 7.534 -5.019 -2.532 1.00 10.00 C ATOM 633 O MET A 55 6.781 -4.299 -3.184 1.00 10.00 O ATOM 634 CB MET A 55 8.128 -3.902 -0.366 1.00 10.00 C ATOM 635 CG MET A 55 7.505 -2.561 -0.725 1.00 10.00 C ATOM 636 SD MET A 55 8.382 -1.165 0.008 1.00 10.00 S ATOM 637 CE MET A 55 7.558 0.210 -0.794 1.00 10.00 C ATOM 0 H MET A 55 8.776 -6.226 0.126 1.00 10.00 H new ATOM 0 HA MET A 55 6.362 -5.072 -0.748 1.00 10.00 H new ATOM 0 HB2 MET A 55 8.113 -4.022 0.717 1.00 10.00 H new ATOM 0 HB3 MET A 55 9.174 -3.901 -0.673 1.00 10.00 H new ATOM 0 HG2 MET A 55 7.494 -2.449 -1.809 1.00 10.00 H new ATOM 0 HG3 MET A 55 6.467 -2.547 -0.393 1.00 10.00 H new ATOM 0 HE1 MET A 55 7.990 1.147 -0.444 1.00 10.00 H new ATOM 0 HE2 MET A 55 7.687 0.132 -1.874 1.00 10.00 H new ATOM 0 HE3 MET A 55 6.495 0.188 -0.553 1.00 10.00 H new ATOM 647 N ARG A 56 8.465 -5.775 -3.095 1.00 10.00 N ATOM 648 CA ARG A 56 8.673 -5.776 -4.536 1.00 10.00 C ATOM 649 C ARG A 56 7.863 -6.883 -5.202 1.00 10.00 C ATOM 650 O ARG A 56 7.868 -7.018 -6.427 1.00 10.00 O ATOM 651 CB ARG A 56 10.160 -5.945 -4.855 1.00 10.00 C ATOM 652 CG ARG A 56 10.616 -5.145 -6.065 1.00 10.00 C ATOM 653 CD ARG A 56 12.131 -5.132 -6.180 1.00 10.00 C ATOM 654 NE ARG A 56 12.607 -4.085 -7.085 1.00 10.00 N ATOM 655 CZ ARG A 56 13.646 -3.288 -6.827 1.00 10.00 C ATOM 656 NH1 ARG A 56 14.316 -3.408 -5.687 1.00 10.00 N ATOM 657 NH2 ARG A 56 14.015 -2.371 -7.710 1.00 10.00 N ATOM 0 H ARG A 56 9.088 -6.395 -2.577 1.00 10.00 H new ATOM 0 HA ARG A 56 8.332 -4.819 -4.931 1.00 10.00 H new ATOM 0 HB2 ARG A 56 10.746 -5.642 -3.987 1.00 10.00 H new ATOM 0 HB3 ARG A 56 10.369 -7.001 -5.028 1.00 10.00 H new ATOM 0 HG2 ARG A 56 10.184 -5.573 -6.970 1.00 10.00 H new ATOM 0 HG3 ARG A 56 10.246 -4.123 -5.988 1.00 10.00 H new ATOM 0 HD2 ARG A 56 12.567 -4.983 -5.192 1.00 10.00 H new ATOM 0 HD3 ARG A 56 12.475 -6.103 -6.537 1.00 10.00 H new ATOM 0 HE ARG A 56 12.114 -3.956 -7.968 1.00 10.00 H new ATOM 0 HH11 ARG A 56 14.037 -4.112 -5.003 1.00 10.00 H new ATOM 0 HH12 ARG A 56 15.109 -2.796 -5.495 1.00 10.00 H new ATOM 0 HH21 ARG A 56 13.505 -2.274 -8.588 1.00 10.00 H new ATOM 0 HH22 ARG A 56 14.809 -1.762 -7.512 1.00 10.00 H new ATOM 671 N GLN A 57 7.150 -7.661 -4.397 1.00 10.00 N ATOM 672 CA GLN A 57 6.339 -8.760 -4.913 1.00 10.00 C ATOM 673 C GLN A 57 4.907 -8.310 -5.190 1.00 10.00 C ATOM 674 O GLN A 57 4.255 -8.812 -6.102 1.00 10.00 O ATOM 675 CB GLN A 57 6.333 -9.929 -3.925 1.00 10.00 C ATOM 676 CG GLN A 57 5.555 -11.140 -4.419 1.00 10.00 C ATOM 677 CD GLN A 57 5.383 -12.201 -3.352 1.00 10.00 C ATOM 678 OE1 GLN A 57 6.237 -12.373 -2.483 1.00 10.00 O ATOM 679 NE2 GLN A 57 4.272 -12.919 -3.408 1.00 10.00 N ATOM 0 H GLN A 57 7.116 -7.552 -3.383 1.00 10.00 H new ATOM 0 HA GLN A 57 6.784 -9.086 -5.853 1.00 10.00 H new ATOM 0 HB2 GLN A 57 7.362 -10.227 -3.721 1.00 10.00 H new ATOM 0 HB3 GLN A 57 5.905 -9.593 -2.980 1.00 10.00 H new ATOM 0 HG2 GLN A 57 4.573 -10.818 -4.767 1.00 10.00 H new ATOM 0 HG3 GLN A 57 6.071 -11.573 -5.276 1.00 10.00 H new ATOM 0 HE21 GLN A 57 3.589 -12.745 -4.145 1.00 10.00 H new ATOM 0 HE22 GLN A 57 4.099 -13.646 -2.714 1.00 10.00 H new ATOM 688 N ILE A 58 4.420 -7.360 -4.408 1.00 10.00 N ATOM 689 CA ILE A 58 3.060 -6.868 -4.579 1.00 10.00 C ATOM 690 C ILE A 58 3.047 -5.441 -5.115 1.00 10.00 C ATOM 691 O ILE A 58 4.071 -4.758 -5.116 1.00 10.00 O ATOM 692 CB ILE A 58 2.259 -6.934 -3.260 1.00 10.00 C ATOM 693 CG1 ILE A 58 3.070 -6.347 -2.102 1.00 10.00 C ATOM 694 CG2 ILE A 58 1.856 -8.372 -2.957 1.00 10.00 C ATOM 695 CD1 ILE A 58 2.317 -6.313 -0.789 1.00 10.00 C ATOM 0 H ILE A 58 4.942 -6.916 -3.652 1.00 10.00 H new ATOM 0 HA ILE A 58 2.581 -7.522 -5.308 1.00 10.00 H new ATOM 0 HB ILE A 58 1.355 -6.337 -3.377 1.00 10.00 H new ATOM 0 HG12 ILE A 58 3.980 -6.933 -1.974 1.00 10.00 H new ATOM 0 HG13 ILE A 58 3.377 -5.334 -2.361 1.00 10.00 H new ATOM 0 HG21 ILE A 58 1.292 -8.403 -2.025 1.00 10.00 H new ATOM 0 HG22 ILE A 58 1.237 -8.755 -3.768 1.00 10.00 H new ATOM 0 HG23 ILE A 58 2.750 -8.988 -2.861 1.00 10.00 H new ATOM 0 HD11 ILE A 58 2.954 -5.885 -0.015 1.00 10.00 H new ATOM 0 HD12 ILE A 58 1.420 -5.703 -0.899 1.00 10.00 H new ATOM 0 HD13 ILE A 58 2.034 -7.327 -0.506 1.00 10.00 H new ATOM 707 N ARG A 59 1.893 -5.009 -5.600 1.00 10.00 N ATOM 708 CA ARG A 59 1.729 -3.663 -6.138 1.00 10.00 C ATOM 709 C ARG A 59 0.459 -3.033 -5.583 1.00 10.00 C ATOM 710 O ARG A 59 -0.573 -3.694 -5.476 1.00 10.00 O ATOM 711 CB ARG A 59 1.658 -3.688 -7.669 1.00 10.00 C ATOM 712 CG ARG A 59 2.942 -4.144 -8.350 1.00 10.00 C ATOM 713 CD ARG A 59 4.107 -3.215 -8.038 1.00 10.00 C ATOM 714 NE ARG A 59 5.332 -3.623 -8.723 1.00 10.00 N ATOM 715 CZ ARG A 59 6.139 -4.597 -8.293 1.00 10.00 C ATOM 716 NH1 ARG A 59 5.878 -5.232 -7.157 1.00 10.00 N ATOM 717 NH2 ARG A 59 7.219 -4.920 -8.991 1.00 10.00 N ATOM 0 H ARG A 59 1.046 -5.577 -5.633 1.00 10.00 H new ATOM 0 HA ARG A 59 2.594 -3.071 -5.839 1.00 10.00 H new ATOM 0 HB2 ARG A 59 0.846 -4.348 -7.972 1.00 10.00 H new ATOM 0 HB3 ARG A 59 1.407 -2.689 -8.026 1.00 10.00 H new ATOM 0 HG2 ARG A 59 3.186 -5.155 -8.025 1.00 10.00 H new ATOM 0 HG3 ARG A 59 2.787 -4.184 -9.428 1.00 10.00 H new ATOM 0 HD2 ARG A 59 3.849 -2.198 -8.333 1.00 10.00 H new ATOM 0 HD3 ARG A 59 4.281 -3.201 -6.962 1.00 10.00 H new ATOM 0 HE ARG A 59 5.586 -3.134 -9.582 1.00 10.00 H new ATOM 0 HH11 ARG A 59 5.058 -4.977 -6.607 1.00 10.00 H new ATOM 0 HH12 ARG A 59 6.498 -5.975 -6.834 1.00 10.00 H new ATOM 0 HH21 ARG A 59 7.434 -4.425 -9.856 1.00 10.00 H new ATOM 0 HH22 ARG A 59 7.835 -5.664 -8.662 1.00 10.00 H new ATOM 731 N PHE A 60 0.536 -1.761 -5.228 1.00 10.00 N ATOM 732 CA PHE A 60 -0.614 -1.052 -4.687 1.00 10.00 C ATOM 733 C PHE A 60 -1.130 -0.034 -5.697 1.00 10.00 C ATOM 734 O PHE A 60 -0.354 0.735 -6.272 1.00 10.00 O ATOM 735 CB PHE A 60 -0.242 -0.352 -3.376 1.00 10.00 C ATOM 736 CG PHE A 60 0.009 -1.288 -2.227 1.00 10.00 C ATOM 737 CD1 PHE A 60 1.192 -2.006 -2.142 1.00 10.00 C ATOM 738 CD2 PHE A 60 -0.937 -1.441 -1.224 1.00 10.00 C ATOM 739 CE1 PHE A 60 1.425 -2.858 -1.081 1.00 10.00 C ATOM 740 CE2 PHE A 60 -0.709 -2.292 -0.161 1.00 10.00 C ATOM 741 CZ PHE A 60 0.474 -3.003 -0.090 1.00 10.00 C ATOM 0 H PHE A 60 1.383 -1.197 -5.304 1.00 10.00 H new ATOM 0 HA PHE A 60 -1.403 -1.776 -4.484 1.00 10.00 H new ATOM 0 HB2 PHE A 60 0.651 0.251 -3.540 1.00 10.00 H new ATOM 0 HB3 PHE A 60 -1.044 0.334 -3.103 1.00 10.00 H new ATOM 0 HD1 PHE A 60 1.939 -1.898 -2.914 1.00 10.00 H new ATOM 0 HD2 PHE A 60 -1.863 -0.888 -1.275 1.00 10.00 H new ATOM 0 HE1 PHE A 60 2.351 -3.411 -1.026 1.00 10.00 H new ATOM 0 HE2 PHE A 60 -1.454 -2.402 0.614 1.00 10.00 H new ATOM 0 HZ PHE A 60 0.655 -3.671 0.739 1.00 10.00 H new ATOM 751 N ARG A 61 -2.435 -0.040 -5.921 1.00 10.00 N ATOM 752 CA ARG A 61 -3.050 0.884 -6.862 1.00 10.00 C ATOM 753 C ARG A 61 -4.153 1.686 -6.184 1.00 10.00 C ATOM 754 O ARG A 61 -4.874 1.176 -5.327 1.00 10.00 O ATOM 755 CB ARG A 61 -3.615 0.134 -8.073 1.00 10.00 C ATOM 756 CG ARG A 61 -2.557 -0.568 -8.912 1.00 10.00 C ATOM 757 CD ARG A 61 -3.129 -1.069 -10.228 1.00 10.00 C ATOM 758 NE ARG A 61 -2.192 -1.931 -10.949 1.00 10.00 N ATOM 759 CZ ARG A 61 -2.291 -2.222 -12.247 1.00 10.00 C ATOM 760 NH1 ARG A 61 -3.292 -1.731 -12.965 1.00 10.00 N ATOM 761 NH2 ARG A 61 -1.388 -3.006 -12.818 1.00 10.00 N ATOM 0 H ARG A 61 -3.089 -0.675 -5.464 1.00 10.00 H new ATOM 0 HA ARG A 61 -2.279 1.572 -7.209 1.00 10.00 H new ATOM 0 HB2 ARG A 61 -4.338 -0.604 -7.726 1.00 10.00 H new ATOM 0 HB3 ARG A 61 -4.157 0.839 -8.704 1.00 10.00 H new ATOM 0 HG2 ARG A 61 -1.734 0.119 -9.110 1.00 10.00 H new ATOM 0 HG3 ARG A 61 -2.144 -1.407 -8.351 1.00 10.00 H new ATOM 0 HD2 ARG A 61 -4.050 -1.619 -10.035 1.00 10.00 H new ATOM 0 HD3 ARG A 61 -3.392 -0.217 -10.855 1.00 10.00 H new ATOM 0 HE ARG A 61 -1.415 -2.335 -10.426 1.00 10.00 H new ATOM 0 HH11 ARG A 61 -3.988 -1.129 -12.525 1.00 10.00 H new ATOM 0 HH12 ARG A 61 -3.366 -1.955 -13.957 1.00 10.00 H new ATOM 0 HH21 ARG A 61 -0.619 -3.385 -12.265 1.00 10.00 H new ATOM 0 HH22 ARG A 61 -1.462 -3.230 -13.810 1.00 10.00 H new ATOM 775 N PHE A 62 -4.264 2.947 -6.564 1.00 10.00 N ATOM 776 CA PHE A 62 -5.268 3.838 -6.013 1.00 10.00 C ATOM 777 C PHE A 62 -5.929 4.623 -7.139 1.00 10.00 C ATOM 778 O PHE A 62 -5.248 5.299 -7.911 1.00 10.00 O ATOM 779 CB PHE A 62 -4.620 4.793 -5.003 1.00 10.00 C ATOM 780 CG PHE A 62 -5.409 6.049 -4.744 1.00 10.00 C ATOM 781 CD1 PHE A 62 -6.543 6.023 -3.950 1.00 10.00 C ATOM 782 CD2 PHE A 62 -5.010 7.257 -5.298 1.00 10.00 C ATOM 783 CE1 PHE A 62 -7.265 7.177 -3.713 1.00 10.00 C ATOM 784 CE2 PHE A 62 -5.728 8.411 -5.066 1.00 10.00 C ATOM 785 CZ PHE A 62 -6.857 8.371 -4.272 1.00 10.00 C ATOM 0 H PHE A 62 -3.661 3.381 -7.263 1.00 10.00 H new ATOM 0 HA PHE A 62 -6.029 3.252 -5.498 1.00 10.00 H new ATOM 0 HB2 PHE A 62 -4.480 4.265 -4.060 1.00 10.00 H new ATOM 0 HB3 PHE A 62 -3.629 5.068 -5.365 1.00 10.00 H new ATOM 0 HD1 PHE A 62 -6.867 5.091 -3.511 1.00 10.00 H new ATOM 0 HD2 PHE A 62 -4.127 7.294 -5.918 1.00 10.00 H new ATOM 0 HE1 PHE A 62 -8.147 7.145 -3.091 1.00 10.00 H new ATOM 0 HE2 PHE A 62 -5.408 9.345 -5.505 1.00 10.00 H new ATOM 0 HZ PHE A 62 -7.421 9.274 -4.088 1.00 10.00 H new ATOM 795 N ASP A 63 -7.250 4.491 -7.252 1.00 10.00 N ATOM 796 CA ASP A 63 -8.024 5.194 -8.279 1.00 10.00 C ATOM 797 C ASP A 63 -7.558 4.793 -9.682 1.00 10.00 C ATOM 798 O ASP A 63 -7.691 5.549 -10.645 1.00 10.00 O ATOM 799 CB ASP A 63 -7.913 6.715 -8.081 1.00 10.00 C ATOM 800 CG ASP A 63 -8.926 7.498 -8.896 1.00 10.00 C ATOM 801 OD1 ASP A 63 -10.136 7.193 -8.806 1.00 10.00 O ATOM 802 OD2 ASP A 63 -8.516 8.427 -9.627 1.00 10.00 O ATOM 0 H ASP A 63 -7.812 3.899 -6.640 1.00 10.00 H new ATOM 0 HA ASP A 63 -9.071 4.907 -8.179 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -8.047 6.948 -7.025 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -6.908 7.038 -8.354 1.00 10.00 H new ATOM 807 N GLY A 64 -7.006 3.591 -9.789 1.00 10.00 N ATOM 808 CA GLY A 64 -6.532 3.098 -11.069 1.00 10.00 C ATOM 809 C GLY A 64 -5.073 3.423 -11.331 1.00 10.00 C ATOM 810 O GLY A 64 -4.479 2.914 -12.280 1.00 10.00 O ATOM 0 H GLY A 64 -6.878 2.946 -9.009 1.00 10.00 H new ATOM 0 HA2 GLY A 64 -6.670 2.017 -11.109 1.00 10.00 H new ATOM 0 HA3 GLY A 64 -7.142 3.526 -11.865 1.00 10.00 H new ATOM 814 N GLN A 65 -4.491 4.265 -10.490 1.00 10.00 N ATOM 815 CA GLN A 65 -3.096 4.661 -10.649 1.00 10.00 C ATOM 816 C GLN A 65 -2.222 4.019 -9.577 1.00 10.00 C ATOM 817 O GLN A 65 -2.629 3.913 -8.424 1.00 10.00 O ATOM 818 CB GLN A 65 -2.972 6.186 -10.576 1.00 10.00 C ATOM 819 CG GLN A 65 -3.248 6.884 -11.897 1.00 10.00 C ATOM 820 CD GLN A 65 -2.250 6.500 -12.971 1.00 10.00 C ATOM 821 OE1 GLN A 65 -2.486 5.583 -13.757 1.00 10.00 O ATOM 822 NE2 GLN A 65 -1.118 7.183 -12.998 1.00 10.00 N ATOM 0 H GLN A 65 -4.961 4.688 -9.690 1.00 10.00 H new ATOM 0 HA GLN A 65 -2.753 4.317 -11.625 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -3.665 6.563 -9.824 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.967 6.445 -10.241 1.00 10.00 H new ATOM 0 HG2 GLN A 65 -4.254 6.635 -12.234 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -3.220 7.963 -11.748 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -0.961 7.936 -12.329 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -0.402 6.956 -13.688 1.00 10.00 H new ATOM 831 N PRO A 66 -1.015 3.565 -9.943 1.00 10.00 N ATOM 832 CA PRO A 66 -0.089 2.948 -8.990 1.00 10.00 C ATOM 833 C PRO A 66 0.428 3.958 -7.966 1.00 10.00 C ATOM 834 O PRO A 66 0.698 5.115 -8.298 1.00 10.00 O ATOM 835 CB PRO A 66 1.054 2.441 -9.874 1.00 10.00 C ATOM 836 CG PRO A 66 0.993 3.283 -11.100 1.00 10.00 C ATOM 837 CD PRO A 66 -0.458 3.608 -11.307 1.00 10.00 C ATOM 0 HA PRO A 66 -0.564 2.160 -8.405 1.00 10.00 H new ATOM 0 HB2 PRO A 66 2.016 2.543 -9.372 1.00 10.00 H new ATOM 0 HB3 PRO A 66 0.930 1.385 -10.113 1.00 10.00 H new ATOM 0 HG2 PRO A 66 1.583 4.192 -10.979 1.00 10.00 H new ATOM 0 HG3 PRO A 66 1.400 2.751 -11.960 1.00 10.00 H new ATOM 0 HD2 PRO A 66 -0.589 4.589 -11.764 1.00 10.00 H new ATOM 0 HD3 PRO A 66 -0.943 2.884 -11.962 1.00 10.00 H new ATOM 845 N ILE A 67 0.551 3.521 -6.723 1.00 10.00 N ATOM 846 CA ILE A 67 1.028 4.387 -5.657 1.00 10.00 C ATOM 847 C ILE A 67 2.551 4.436 -5.653 1.00 10.00 C ATOM 848 O ILE A 67 3.214 3.417 -5.848 1.00 10.00 O ATOM 849 CB ILE A 67 0.525 3.908 -4.278 1.00 10.00 C ATOM 850 CG1 ILE A 67 -0.997 3.737 -4.302 1.00 10.00 C ATOM 851 CG2 ILE A 67 0.935 4.887 -3.185 1.00 10.00 C ATOM 852 CD1 ILE A 67 -1.579 3.285 -2.981 1.00 10.00 C ATOM 0 H ILE A 67 0.327 2.571 -6.427 1.00 10.00 H new ATOM 0 HA ILE A 67 0.633 5.386 -5.843 1.00 10.00 H new ATOM 0 HB ILE A 67 0.982 2.943 -4.059 1.00 10.00 H new ATOM 0 HG12 ILE A 67 -1.456 4.684 -4.586 1.00 10.00 H new ATOM 0 HG13 ILE A 67 -1.260 3.012 -5.072 1.00 10.00 H new ATOM 0 HG21 ILE A 67 0.570 4.530 -2.222 1.00 10.00 H new ATOM 0 HG22 ILE A 67 2.022 4.965 -3.155 1.00 10.00 H new ATOM 0 HG23 ILE A 67 0.506 5.867 -3.395 1.00 10.00 H new ATOM 0 HD11 ILE A 67 -2.660 3.186 -3.075 1.00 10.00 H new ATOM 0 HD12 ILE A 67 -1.149 2.322 -2.704 1.00 10.00 H new ATOM 0 HD13 ILE A 67 -1.348 4.021 -2.211 1.00 10.00 H new ATOM 864 N ASN A 68 3.102 5.623 -5.448 1.00 10.00 N ATOM 865 CA ASN A 68 4.542 5.798 -5.419 1.00 10.00 C ATOM 866 C ASN A 68 5.048 5.797 -3.984 1.00 10.00 C ATOM 867 O ASN A 68 4.260 5.862 -3.040 1.00 10.00 O ATOM 868 CB ASN A 68 4.939 7.098 -6.125 1.00 10.00 C ATOM 869 CG ASN A 68 4.844 6.987 -7.635 1.00 10.00 C ATOM 870 OD1 ASN A 68 5.757 6.483 -8.292 1.00 10.00 O ATOM 871 ND2 ASN A 68 3.748 7.468 -8.196 1.00 10.00 N ATOM 0 H ASN A 68 2.570 6.480 -5.299 1.00 10.00 H new ATOM 0 HA ASN A 68 5.002 4.964 -5.949 1.00 10.00 H new ATOM 0 HB2 ASN A 68 4.294 7.907 -5.781 1.00 10.00 H new ATOM 0 HB3 ASN A 68 5.959 7.363 -5.846 1.00 10.00 H new ATOM 0 HD21 ASN A 68 3.635 7.430 -9.209 1.00 10.00 H new ATOM 0 HD22 ASN A 68 3.016 7.877 -7.616 1.00 10.00 H new ATOM 878 N GLU A 69 6.362 5.726 -3.822 1.00 10.00 N ATOM 879 CA GLU A 69 6.967 5.702 -2.499 1.00 10.00 C ATOM 880 C GLU A 69 6.786 7.040 -1.794 1.00 10.00 C ATOM 881 O GLU A 69 6.256 7.101 -0.684 1.00 10.00 O ATOM 882 CB GLU A 69 8.451 5.353 -2.601 1.00 10.00 C ATOM 883 CG GLU A 69 8.707 4.030 -3.303 1.00 10.00 C ATOM 884 CD GLU A 69 10.146 3.583 -3.187 1.00 10.00 C ATOM 885 OE1 GLU A 69 10.475 2.876 -2.215 1.00 10.00 O ATOM 886 OE2 GLU A 69 10.955 3.938 -4.065 1.00 10.00 O ATOM 0 H GLU A 69 7.030 5.684 -4.592 1.00 10.00 H new ATOM 0 HA GLU A 69 6.465 4.935 -1.909 1.00 10.00 H new ATOM 0 HB2 GLU A 69 8.969 6.148 -3.138 1.00 10.00 H new ATOM 0 HB3 GLU A 69 8.878 5.314 -1.599 1.00 10.00 H new ATOM 0 HG2 GLU A 69 8.057 3.265 -2.878 1.00 10.00 H new ATOM 0 HG3 GLU A 69 8.443 4.124 -4.356 1.00 10.00 H new ATOM 893 N THR A 70 7.202 8.112 -2.447 1.00 10.00 N ATOM 894 CA THR A 70 7.083 9.445 -1.875 1.00 10.00 C ATOM 895 C THR A 70 5.679 10.020 -2.089 1.00 10.00 C ATOM 896 O THR A 70 5.513 11.199 -2.412 1.00 10.00 O ATOM 897 CB THR A 70 8.136 10.389 -2.480 1.00 10.00 C ATOM 898 OG1 THR A 70 9.324 9.644 -2.788 1.00 10.00 O ATOM 899 CG2 THR A 70 8.483 11.514 -1.514 1.00 10.00 C ATOM 0 H THR A 70 7.626 8.086 -3.375 1.00 10.00 H new ATOM 0 HA THR A 70 7.257 9.360 -0.802 1.00 10.00 H new ATOM 0 HB THR A 70 7.722 10.829 -3.388 1.00 10.00 H new ATOM 0 HG1 THR A 70 9.995 10.244 -3.175 1.00 10.00 H new ATOM 0 HG21 THR A 70 9.230 12.166 -1.968 1.00 10.00 H new ATOM 0 HG22 THR A 70 7.586 12.091 -1.290 1.00 10.00 H new ATOM 0 HG23 THR A 70 8.883 11.092 -0.592 1.00 10.00 H new ATOM 907 N ASP A 71 4.672 9.176 -1.912 1.00 10.00 N ATOM 908 CA ASP A 71 3.284 9.591 -2.069 1.00 10.00 C ATOM 909 C ASP A 71 2.650 9.794 -0.704 1.00 10.00 C ATOM 910 O ASP A 71 3.041 9.149 0.272 1.00 10.00 O ATOM 911 CB ASP A 71 2.481 8.554 -2.864 1.00 10.00 C ATOM 912 CG ASP A 71 2.294 8.940 -4.319 1.00 10.00 C ATOM 913 OD1 ASP A 71 2.539 10.115 -4.665 1.00 10.00 O ATOM 914 OD2 ASP A 71 1.902 8.068 -5.125 1.00 10.00 O ATOM 0 H ASP A 71 4.791 8.195 -1.658 1.00 10.00 H new ATOM 0 HA ASP A 71 3.271 10.530 -2.623 1.00 10.00 H new ATOM 0 HB2 ASP A 71 2.989 7.591 -2.811 1.00 10.00 H new ATOM 0 HB3 ASP A 71 1.504 8.425 -2.399 1.00 10.00 H new ATOM 919 N THR A 72 1.681 10.690 -0.631 1.00 10.00 N ATOM 920 CA THR A 72 0.998 10.980 0.618 1.00 10.00 C ATOM 921 C THR A 72 -0.500 11.147 0.374 1.00 10.00 C ATOM 922 O THR A 72 -0.909 11.496 -0.738 1.00 10.00 O ATOM 923 CB THR A 72 1.560 12.260 1.273 1.00 10.00 C ATOM 924 OG1 THR A 72 2.143 13.105 0.270 1.00 10.00 O ATOM 925 CG2 THR A 72 2.607 11.924 2.322 1.00 10.00 C ATOM 0 H THR A 72 1.348 11.233 -1.428 1.00 10.00 H new ATOM 0 HA THR A 72 1.165 10.141 1.294 1.00 10.00 H new ATOM 0 HB THR A 72 0.736 12.780 1.761 1.00 10.00 H new ATOM 0 HG1 THR A 72 2.496 13.916 0.691 1.00 10.00 H new ATOM 0 HG21 THR A 72 2.985 12.845 2.766 1.00 10.00 H new ATOM 0 HG22 THR A 72 2.158 11.304 3.098 1.00 10.00 H new ATOM 0 HG23 THR A 72 3.429 11.382 1.855 1.00 10.00 H new ATOM 933 N PRO A 73 -1.338 10.894 1.398 1.00 10.00 N ATOM 934 CA PRO A 73 -2.797 11.026 1.280 1.00 10.00 C ATOM 935 C PRO A 73 -3.213 12.407 0.780 1.00 10.00 C ATOM 936 O PRO A 73 -4.126 12.536 -0.033 1.00 10.00 O ATOM 937 CB PRO A 73 -3.298 10.802 2.710 1.00 10.00 C ATOM 938 CG PRO A 73 -2.227 10.010 3.375 1.00 10.00 C ATOM 939 CD PRO A 73 -0.934 10.446 2.745 1.00 10.00 C ATOM 0 HA PRO A 73 -3.211 10.322 0.558 1.00 10.00 H new ATOM 0 HB2 PRO A 73 -3.464 11.749 3.223 1.00 10.00 H new ATOM 0 HB3 PRO A 73 -4.247 10.266 2.716 1.00 10.00 H new ATOM 0 HG2 PRO A 73 -2.218 10.192 4.450 1.00 10.00 H new ATOM 0 HG3 PRO A 73 -2.388 8.941 3.234 1.00 10.00 H new ATOM 0 HD2 PRO A 73 -0.464 11.250 3.311 1.00 10.00 H new ATOM 0 HD3 PRO A 73 -0.216 9.628 2.697 1.00 10.00 H new ATOM 947 N ALA A 74 -2.527 13.436 1.263 1.00 10.00 N ATOM 948 CA ALA A 74 -2.824 14.804 0.863 1.00 10.00 C ATOM 949 C ALA A 74 -2.390 15.067 -0.579 1.00 10.00 C ATOM 950 O ALA A 74 -3.077 15.757 -1.327 1.00 10.00 O ATOM 951 CB ALA A 74 -2.149 15.784 1.811 1.00 10.00 C ATOM 0 H ALA A 74 -1.762 13.348 1.932 1.00 10.00 H new ATOM 0 HA ALA A 74 -3.903 14.947 0.916 1.00 10.00 H new ATOM 0 HB1 ALA A 74 -2.377 16.804 1.503 1.00 10.00 H new ATOM 0 HB2 ALA A 74 -2.515 15.620 2.825 1.00 10.00 H new ATOM 0 HB3 ALA A 74 -1.070 15.630 1.786 1.00 10.00 H new ATOM 957 N GLN A 75 -1.260 14.484 -0.967 1.00 10.00 N ATOM 958 CA GLN A 75 -0.718 14.659 -2.311 1.00 10.00 C ATOM 959 C GLN A 75 -1.632 14.036 -3.364 1.00 10.00 C ATOM 960 O GLN A 75 -1.855 14.612 -4.429 1.00 10.00 O ATOM 961 CB GLN A 75 0.676 14.031 -2.391 1.00 10.00 C ATOM 962 CG GLN A 75 1.440 14.374 -3.659 1.00 10.00 C ATOM 963 CD GLN A 75 1.757 15.853 -3.773 1.00 10.00 C ATOM 964 OE1 GLN A 75 1.911 16.550 -2.770 1.00 10.00 O ATOM 965 NE2 GLN A 75 1.864 16.339 -4.998 1.00 10.00 N ATOM 0 H GLN A 75 -0.698 13.882 -0.365 1.00 10.00 H new ATOM 0 HA GLN A 75 -0.650 15.728 -2.515 1.00 10.00 H new ATOM 0 HB2 GLN A 75 1.259 14.356 -1.529 1.00 10.00 H new ATOM 0 HB3 GLN A 75 0.579 12.948 -2.320 1.00 10.00 H new ATOM 0 HG2 GLN A 75 2.369 13.805 -3.683 1.00 10.00 H new ATOM 0 HG3 GLN A 75 0.855 14.065 -4.525 1.00 10.00 H new ATOM 0 HE21 GLN A 75 1.729 15.727 -5.803 1.00 10.00 H new ATOM 0 HE22 GLN A 75 2.082 17.326 -5.138 1.00 10.00 H new ATOM 974 N LEU A 76 -2.169 12.863 -3.056 1.00 10.00 N ATOM 975 CA LEU A 76 -3.051 12.163 -3.983 1.00 10.00 C ATOM 976 C LEU A 76 -4.502 12.596 -3.798 1.00 10.00 C ATOM 977 O LEU A 76 -5.406 12.040 -4.423 1.00 10.00 O ATOM 978 CB LEU A 76 -2.928 10.649 -3.800 1.00 10.00 C ATOM 979 CG LEU A 76 -1.579 10.051 -4.208 1.00 10.00 C ATOM 980 CD1 LEU A 76 -1.559 8.554 -3.942 1.00 10.00 C ATOM 981 CD2 LEU A 76 -1.284 10.338 -5.676 1.00 10.00 C ATOM 0 H LEU A 76 -2.010 12.376 -2.174 1.00 10.00 H new ATOM 0 HA LEU A 76 -2.744 12.424 -4.996 1.00 10.00 H new ATOM 0 HB2 LEU A 76 -3.112 10.410 -2.753 1.00 10.00 H new ATOM 0 HB3 LEU A 76 -3.713 10.164 -4.380 1.00 10.00 H new ATOM 0 HG LEU A 76 -0.800 10.519 -3.606 1.00 10.00 H new ATOM 0 HD11 LEU A 76 -0.593 8.145 -4.238 1.00 10.00 H new ATOM 0 HD12 LEU A 76 -1.721 8.371 -2.880 1.00 10.00 H new ATOM 0 HD13 LEU A 76 -2.349 8.072 -4.518 1.00 10.00 H new ATOM 0 HD21 LEU A 76 -0.321 9.904 -5.945 1.00 10.00 H new ATOM 0 HD22 LEU A 76 -2.065 9.900 -6.297 1.00 10.00 H new ATOM 0 HD23 LEU A 76 -1.254 11.416 -5.837 1.00 10.00 H new ATOM 993 N GLU A 77 -4.708 13.588 -2.933 1.00 10.00 N ATOM 994 CA GLU A 77 -6.039 14.128 -2.653 1.00 10.00 C ATOM 995 C GLU A 77 -6.998 13.039 -2.176 1.00 10.00 C ATOM 996 O GLU A 77 -8.176 13.029 -2.541 1.00 10.00 O ATOM 997 CB GLU A 77 -6.592 14.830 -3.894 1.00 10.00 C ATOM 998 CG GLU A 77 -5.855 16.112 -4.237 1.00 10.00 C ATOM 999 CD GLU A 77 -5.980 16.478 -5.698 1.00 10.00 C ATOM 1000 OE1 GLU A 77 -4.961 16.863 -6.302 1.00 10.00 O ATOM 1001 OE2 GLU A 77 -7.096 16.374 -6.249 1.00 10.00 O ATOM 0 H GLU A 77 -3.960 14.040 -2.407 1.00 10.00 H new ATOM 0 HA GLU A 77 -5.946 14.855 -1.847 1.00 10.00 H new ATOM 0 HB2 GLU A 77 -6.537 14.149 -4.743 1.00 10.00 H new ATOM 0 HB3 GLU A 77 -7.646 15.057 -3.735 1.00 10.00 H new ATOM 0 HG2 GLU A 77 -6.246 16.926 -3.627 1.00 10.00 H new ATOM 0 HG3 GLU A 77 -4.801 16.001 -3.983 1.00 10.00 H new ATOM 1008 N MET A 78 -6.486 12.135 -1.354 1.00 10.00 N ATOM 1009 CA MET A 78 -7.290 11.050 -0.811 1.00 10.00 C ATOM 1010 C MET A 78 -8.098 11.563 0.367 1.00 10.00 C ATOM 1011 O MET A 78 -7.666 12.481 1.066 1.00 10.00 O ATOM 1012 CB MET A 78 -6.402 9.890 -0.350 1.00 10.00 C ATOM 1013 CG MET A 78 -5.340 9.489 -1.359 1.00 10.00 C ATOM 1014 SD MET A 78 -4.170 8.289 -0.694 1.00 10.00 S ATOM 1015 CE MET A 78 -5.215 6.841 -0.566 1.00 10.00 C ATOM 0 H MET A 78 -5.513 12.132 -1.047 1.00 10.00 H new ATOM 0 HA MET A 78 -7.957 10.687 -1.593 1.00 10.00 H new ATOM 0 HB2 MET A 78 -5.915 10.168 0.585 1.00 10.00 H new ATOM 0 HB3 MET A 78 -7.031 9.026 -0.137 1.00 10.00 H new ATOM 0 HG2 MET A 78 -5.823 9.070 -2.242 1.00 10.00 H new ATOM 0 HG3 MET A 78 -4.798 10.378 -1.684 1.00 10.00 H new ATOM 0 HE1 MET A 78 -5.244 6.504 0.470 1.00 10.00 H new ATOM 0 HE2 MET A 78 -6.224 7.090 -0.895 1.00 10.00 H new ATOM 0 HE3 MET A 78 -4.814 6.046 -1.195 1.00 10.00 H new ATOM 1025 N GLU A 79 -9.261 10.982 0.593 1.00 10.00 N ATOM 1026 CA GLU A 79 -10.101 11.402 1.698 1.00 10.00 C ATOM 1027 C GLU A 79 -10.406 10.239 2.625 1.00 10.00 C ATOM 1028 O GLU A 79 -9.992 9.104 2.379 1.00 10.00 O ATOM 1029 CB GLU A 79 -11.399 12.038 1.195 1.00 10.00 C ATOM 1030 CG GLU A 79 -11.241 13.488 0.759 1.00 10.00 C ATOM 1031 CD GLU A 79 -10.408 14.308 1.727 1.00 10.00 C ATOM 1032 OE1 GLU A 79 -10.461 14.049 2.949 1.00 10.00 O ATOM 1033 OE2 GLU A 79 -9.692 15.224 1.269 1.00 10.00 O ATOM 0 H GLU A 79 -9.644 10.222 0.030 1.00 10.00 H new ATOM 0 HA GLU A 79 -9.549 12.154 2.262 1.00 10.00 H new ATOM 0 HB2 GLU A 79 -11.778 11.455 0.356 1.00 10.00 H new ATOM 0 HB3 GLU A 79 -12.149 11.985 1.984 1.00 10.00 H new ATOM 0 HG2 GLU A 79 -10.777 13.517 -0.227 1.00 10.00 H new ATOM 0 HG3 GLU A 79 -12.227 13.942 0.661 1.00 10.00 H new ATOM 1040 N ASP A 80 -11.115 10.539 3.701 1.00 10.00 N ATOM 1041 CA ASP A 80 -11.480 9.539 4.693 1.00 10.00 C ATOM 1042 C ASP A 80 -12.407 8.488 4.095 1.00 10.00 C ATOM 1043 O ASP A 80 -13.327 8.820 3.344 1.00 10.00 O ATOM 1044 CB ASP A 80 -12.153 10.214 5.888 1.00 10.00 C ATOM 1045 CG ASP A 80 -12.275 9.292 7.082 1.00 10.00 C ATOM 1046 OD1 ASP A 80 -13.419 8.948 7.459 1.00 10.00 O ATOM 1047 OD2 ASP A 80 -11.234 8.924 7.660 1.00 10.00 O ATOM 0 H ASP A 80 -11.453 11.478 3.912 1.00 10.00 H new ATOM 0 HA ASP A 80 -10.571 9.039 5.026 1.00 10.00 H new ATOM 0 HB2 ASP A 80 -11.581 11.097 6.172 1.00 10.00 H new ATOM 0 HB3 ASP A 80 -13.145 10.558 5.596 1.00 10.00 H new ATOM 1052 N GLU A 81 -12.138 7.226 4.432 1.00 10.00 N ATOM 1053 CA GLU A 81 -12.917 6.084 3.958 1.00 10.00 C ATOM 1054 C GLU A 81 -12.623 5.774 2.493 1.00 10.00 C ATOM 1055 O GLU A 81 -13.519 5.398 1.733 1.00 10.00 O ATOM 1056 CB GLU A 81 -14.421 6.300 4.169 1.00 10.00 C ATOM 1057 CG GLU A 81 -14.955 5.672 5.445 1.00 10.00 C ATOM 1058 CD GLU A 81 -14.747 4.173 5.492 1.00 10.00 C ATOM 1059 OE1 GLU A 81 -14.784 3.523 4.425 1.00 10.00 O ATOM 1060 OE2 GLU A 81 -14.564 3.627 6.596 1.00 10.00 O ATOM 0 H GLU A 81 -11.367 6.967 5.047 1.00 10.00 H new ATOM 0 HA GLU A 81 -12.612 5.224 4.554 1.00 10.00 H new ATOM 0 HB2 GLU A 81 -14.626 7.370 4.188 1.00 10.00 H new ATOM 0 HB3 GLU A 81 -14.961 5.887 3.317 1.00 10.00 H new ATOM 0 HG2 GLU A 81 -14.463 6.130 6.303 1.00 10.00 H new ATOM 0 HG3 GLU A 81 -16.019 5.890 5.534 1.00 10.00 H new ATOM 1067 N ASP A 82 -11.366 5.926 2.095 1.00 10.00 N ATOM 1068 CA ASP A 82 -10.973 5.622 0.724 1.00 10.00 C ATOM 1069 C ASP A 82 -10.629 4.140 0.614 1.00 10.00 C ATOM 1070 O ASP A 82 -10.734 3.402 1.597 1.00 10.00 O ATOM 1071 CB ASP A 82 -9.790 6.483 0.270 1.00 10.00 C ATOM 1072 CG ASP A 82 -9.858 6.811 -1.215 1.00 10.00 C ATOM 1073 OD1 ASP A 82 -9.973 5.871 -2.035 1.00 10.00 O ATOM 1074 OD2 ASP A 82 -9.812 8.010 -1.567 1.00 10.00 O ATOM 0 H ASP A 82 -10.608 6.254 2.694 1.00 10.00 H new ATOM 0 HA ASP A 82 -11.811 5.853 0.066 1.00 10.00 H new ATOM 0 HB2 ASP A 82 -9.774 7.409 0.845 1.00 10.00 H new ATOM 0 HB3 ASP A 82 -8.858 5.959 0.483 1.00 10.00 H new ATOM 1079 N THR A 83 -10.211 3.705 -0.563 1.00 10.00 N ATOM 1080 CA THR A 83 -9.888 2.304 -0.781 1.00 10.00 C ATOM 1081 C THR A 83 -8.631 2.138 -1.635 1.00 10.00 C ATOM 1082 O THR A 83 -8.446 2.836 -2.632 1.00 10.00 O ATOM 1083 CB THR A 83 -11.061 1.577 -1.465 1.00 10.00 C ATOM 1084 OG1 THR A 83 -12.290 2.268 -1.191 1.00 10.00 O ATOM 1085 CG2 THR A 83 -11.169 0.138 -0.979 1.00 10.00 C ATOM 0 H THR A 83 -10.087 4.301 -1.382 1.00 10.00 H new ATOM 0 HA THR A 83 -9.703 1.864 0.199 1.00 10.00 H new ATOM 0 HB THR A 83 -10.875 1.568 -2.539 1.00 10.00 H new ATOM 0 HG1 THR A 83 -13.032 1.802 -1.630 1.00 10.00 H new ATOM 0 HG21 THR A 83 -12.005 -0.353 -1.477 1.00 10.00 H new ATOM 0 HG22 THR A 83 -10.246 -0.394 -1.210 1.00 10.00 H new ATOM 0 HG23 THR A 83 -11.333 0.129 0.099 1.00 10.00 H new ATOM 1093 N ILE A 84 -7.766 1.224 -1.217 1.00 10.00 N ATOM 1094 CA ILE A 84 -6.535 0.934 -1.933 1.00 10.00 C ATOM 1095 C ILE A 84 -6.555 -0.515 -2.416 1.00 10.00 C ATOM 1096 O ILE A 84 -6.892 -1.424 -1.652 1.00 10.00 O ATOM 1097 CB ILE A 84 -5.296 1.173 -1.040 1.00 10.00 C ATOM 1098 CG1 ILE A 84 -5.255 2.631 -0.568 1.00 10.00 C ATOM 1099 CG2 ILE A 84 -4.018 0.818 -1.788 1.00 10.00 C ATOM 1100 CD1 ILE A 84 -4.237 2.893 0.523 1.00 10.00 C ATOM 0 H ILE A 84 -7.899 0.665 -0.374 1.00 10.00 H new ATOM 0 HA ILE A 84 -6.469 1.608 -2.787 1.00 10.00 H new ATOM 0 HB ILE A 84 -5.370 0.526 -0.166 1.00 10.00 H new ATOM 0 HG12 ILE A 84 -5.033 3.273 -1.421 1.00 10.00 H new ATOM 0 HG13 ILE A 84 -6.243 2.913 -0.205 1.00 10.00 H new ATOM 0 HG21 ILE A 84 -3.158 0.993 -1.142 1.00 10.00 H new ATOM 0 HG22 ILE A 84 -4.046 -0.232 -2.078 1.00 10.00 H new ATOM 0 HG23 ILE A 84 -3.934 1.439 -2.680 1.00 10.00 H new ATOM 0 HD11 ILE A 84 -4.268 3.946 0.804 1.00 10.00 H new ATOM 0 HD12 ILE A 84 -4.469 2.278 1.393 1.00 10.00 H new ATOM 0 HD13 ILE A 84 -3.241 2.644 0.158 1.00 10.00 H new ATOM 1112 N ASP A 85 -6.209 -0.722 -3.683 1.00 10.00 N ATOM 1113 CA ASP A 85 -6.203 -2.058 -4.274 1.00 10.00 C ATOM 1114 C ASP A 85 -4.809 -2.672 -4.227 1.00 10.00 C ATOM 1115 O ASP A 85 -3.821 -2.024 -4.576 1.00 10.00 O ATOM 1116 CB ASP A 85 -6.687 -2.007 -5.727 1.00 10.00 C ATOM 1117 CG ASP A 85 -8.189 -2.141 -5.853 1.00 10.00 C ATOM 1118 OD1 ASP A 85 -8.700 -3.277 -5.759 1.00 10.00 O ATOM 1119 OD2 ASP A 85 -8.870 -1.112 -6.063 1.00 10.00 O ATOM 0 H ASP A 85 -5.928 0.021 -4.323 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.881 -2.679 -3.689 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -6.372 -1.065 -6.176 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -6.207 -2.806 -6.293 1.00 10.00 H new ATOM 1124 N VAL A 86 -4.737 -3.926 -3.798 1.00 10.00 N ATOM 1125 CA VAL A 86 -3.465 -4.637 -3.708 1.00 10.00 C ATOM 1126 C VAL A 86 -3.405 -5.763 -4.735 1.00 10.00 C ATOM 1127 O VAL A 86 -4.268 -6.640 -4.757 1.00 10.00 O ATOM 1128 CB VAL A 86 -3.249 -5.236 -2.302 1.00 10.00 C ATOM 1129 CG1 VAL A 86 -1.811 -5.707 -2.133 1.00 10.00 C ATOM 1130 CG2 VAL A 86 -3.617 -4.225 -1.228 1.00 10.00 C ATOM 0 H VAL A 86 -5.546 -4.474 -3.506 1.00 10.00 H new ATOM 0 HA VAL A 86 -2.678 -3.910 -3.908 1.00 10.00 H new ATOM 0 HB VAL A 86 -3.903 -6.101 -2.193 1.00 10.00 H new ATOM 0 HG11 VAL A 86 -1.680 -6.126 -1.135 1.00 10.00 H new ATOM 0 HG12 VAL A 86 -1.588 -6.470 -2.879 1.00 10.00 H new ATOM 0 HG13 VAL A 86 -1.134 -4.863 -2.264 1.00 10.00 H new ATOM 0 HG21 VAL A 86 -3.458 -4.666 -0.244 1.00 10.00 H new ATOM 0 HG22 VAL A 86 -2.992 -3.338 -1.334 1.00 10.00 H new ATOM 0 HG23 VAL A 86 -4.665 -3.945 -1.335 1.00 10.00 H new ATOM 1140 N PHE A 87 -2.390 -5.734 -5.583 1.00 10.00 N ATOM 1141 CA PHE A 87 -2.225 -6.752 -6.611 1.00 10.00 C ATOM 1142 C PHE A 87 -0.886 -7.465 -6.455 1.00 10.00 C ATOM 1143 O PHE A 87 0.018 -6.968 -5.784 1.00 10.00 O ATOM 1144 CB PHE A 87 -2.320 -6.124 -8.003 1.00 10.00 C ATOM 1145 CG PHE A 87 -3.676 -5.562 -8.322 1.00 10.00 C ATOM 1146 CD1 PHE A 87 -4.723 -6.400 -8.666 1.00 10.00 C ATOM 1147 CD2 PHE A 87 -3.902 -4.197 -8.286 1.00 10.00 C ATOM 1148 CE1 PHE A 87 -5.969 -5.887 -8.964 1.00 10.00 C ATOM 1149 CE2 PHE A 87 -5.147 -3.679 -8.583 1.00 10.00 C ATOM 1150 CZ PHE A 87 -6.179 -4.525 -8.924 1.00 10.00 C ATOM 0 H PHE A 87 -1.666 -5.016 -5.581 1.00 10.00 H new ATOM 0 HA PHE A 87 -3.025 -7.483 -6.495 1.00 10.00 H new ATOM 0 HB2 PHE A 87 -1.579 -5.329 -8.084 1.00 10.00 H new ATOM 0 HB3 PHE A 87 -2.064 -6.876 -8.749 1.00 10.00 H new ATOM 0 HD1 PHE A 87 -4.563 -7.467 -8.702 1.00 10.00 H new ATOM 0 HD2 PHE A 87 -3.095 -3.529 -8.023 1.00 10.00 H new ATOM 0 HE1 PHE A 87 -6.778 -6.551 -9.228 1.00 10.00 H new ATOM 0 HE2 PHE A 87 -5.311 -2.612 -8.548 1.00 10.00 H new ATOM 0 HZ PHE A 87 -7.153 -4.121 -9.160 1.00 10.00 H new ATOM 1160 N GLN A 88 -0.774 -8.631 -7.069 1.00 10.00 N ATOM 1161 CA GLN A 88 0.449 -9.420 -7.018 1.00 10.00 C ATOM 1162 C GLN A 88 1.186 -9.323 -8.349 1.00 10.00 C ATOM 1163 O GLN A 88 0.564 -9.120 -9.396 1.00 10.00 O ATOM 1164 CB GLN A 88 0.132 -10.883 -6.699 1.00 10.00 C ATOM 1165 CG GLN A 88 -0.140 -11.145 -5.225 1.00 10.00 C ATOM 1166 CD GLN A 88 0.986 -11.907 -4.551 1.00 10.00 C ATOM 1167 OE1 GLN A 88 2.143 -11.827 -4.964 1.00 10.00 O ATOM 1168 NE2 GLN A 88 0.658 -12.645 -3.503 1.00 10.00 N ATOM 0 H GLN A 88 -1.523 -9.057 -7.615 1.00 10.00 H new ATOM 0 HA GLN A 88 1.086 -9.024 -6.227 1.00 10.00 H new ATOM 0 HB2 GLN A 88 -0.737 -11.192 -7.280 1.00 10.00 H new ATOM 0 HB3 GLN A 88 0.968 -11.505 -7.021 1.00 10.00 H new ATOM 0 HG2 GLN A 88 -0.289 -10.195 -4.712 1.00 10.00 H new ATOM 0 HG3 GLN A 88 -1.067 -11.710 -5.125 1.00 10.00 H new ATOM 0 HE21 GLN A 88 -0.312 -12.685 -3.191 1.00 10.00 H new ATOM 0 HE22 GLN A 88 1.376 -13.173 -3.007 1.00 10.00 H new ATOM 1177 N GLN A 89 2.502 -9.456 -8.305 1.00 10.00 N ATOM 1178 CA GLN A 89 3.319 -9.382 -9.509 1.00 10.00 C ATOM 1179 C GLN A 89 3.181 -10.655 -10.344 1.00 10.00 C ATOM 1180 O GLN A 89 2.861 -11.724 -9.820 1.00 10.00 O ATOM 1181 CB GLN A 89 4.786 -9.146 -9.136 1.00 10.00 C ATOM 1182 CG GLN A 89 5.657 -8.710 -10.302 1.00 10.00 C ATOM 1183 CD GLN A 89 5.112 -7.487 -11.021 1.00 10.00 C ATOM 1184 OE1 GLN A 89 4.474 -6.626 -10.417 1.00 10.00 O ATOM 1185 NE2 GLN A 89 5.356 -7.408 -12.318 1.00 10.00 N ATOM 0 H GLN A 89 3.030 -9.616 -7.447 1.00 10.00 H new ATOM 0 HA GLN A 89 2.967 -8.544 -10.111 1.00 10.00 H new ATOM 0 HB2 GLN A 89 4.834 -8.386 -8.356 1.00 10.00 H new ATOM 0 HB3 GLN A 89 5.195 -10.064 -8.713 1.00 10.00 H new ATOM 0 HG2 GLN A 89 6.661 -8.494 -9.938 1.00 10.00 H new ATOM 0 HG3 GLN A 89 5.745 -9.533 -11.011 1.00 10.00 H new ATOM 0 HE21 GLN A 89 5.889 -8.143 -12.782 1.00 10.00 H new ATOM 0 HE22 GLN A 89 5.011 -6.612 -12.854 1.00 10.00 H new ATOM 1194 N GLN A 90 3.414 -10.522 -11.644 1.00 10.00 N ATOM 1195 CA GLN A 90 3.322 -11.644 -12.569 1.00 10.00 C ATOM 1196 C GLN A 90 4.440 -12.652 -12.309 1.00 10.00 C ATOM 1197 O GLN A 90 5.592 -12.274 -12.084 1.00 10.00 O ATOM 1198 CB GLN A 90 3.389 -11.147 -14.018 1.00 10.00 C ATOM 1199 CG GLN A 90 2.109 -10.482 -14.517 1.00 10.00 C ATOM 1200 CD GLN A 90 1.895 -9.085 -13.956 1.00 10.00 C ATOM 1201 OE1 GLN A 90 2.432 -8.105 -14.472 1.00 10.00 O ATOM 1202 NE2 GLN A 90 1.093 -8.981 -12.908 1.00 10.00 N ATOM 0 H GLN A 90 3.671 -9.639 -12.085 1.00 10.00 H new ATOM 0 HA GLN A 90 2.365 -12.140 -12.409 1.00 10.00 H new ATOM 0 HB2 GLN A 90 4.211 -10.437 -14.108 1.00 10.00 H new ATOM 0 HB3 GLN A 90 3.623 -11.990 -14.668 1.00 10.00 H new ATOM 0 HG2 GLN A 90 2.137 -10.428 -15.605 1.00 10.00 H new ATOM 0 HG3 GLN A 90 1.256 -11.107 -14.251 1.00 10.00 H new ATOM 0 HE21 GLN A 90 0.666 -9.816 -12.508 1.00 10.00 H new ATOM 0 HE22 GLN A 90 0.902 -8.066 -12.501 1.00 10.00 H new ATOM 1211 N THR A 91 4.091 -13.928 -12.339 1.00 10.00 N ATOM 1212 CA THR A 91 5.045 -15.004 -12.107 1.00 10.00 C ATOM 1213 C THR A 91 5.640 -15.511 -13.420 1.00 10.00 C ATOM 1214 O THR A 91 6.422 -16.465 -13.442 1.00 10.00 O ATOM 1215 CB THR A 91 4.351 -16.167 -11.380 1.00 10.00 C ATOM 1216 OG1 THR A 91 2.928 -15.992 -11.463 1.00 10.00 O ATOM 1217 CG2 THR A 91 4.778 -16.230 -9.921 1.00 10.00 C ATOM 0 H THR A 91 3.140 -14.248 -12.524 1.00 10.00 H new ATOM 0 HA THR A 91 5.854 -14.610 -11.492 1.00 10.00 H new ATOM 0 HB THR A 91 4.640 -17.103 -11.859 1.00 10.00 H new ATOM 0 HG1 THR A 91 2.480 -16.732 -11.002 1.00 10.00 H new ATOM 0 HG21 THR A 91 4.273 -17.061 -9.430 1.00 10.00 H new ATOM 0 HG22 THR A 91 5.857 -16.376 -9.864 1.00 10.00 H new ATOM 0 HG23 THR A 91 4.511 -15.298 -9.423 1.00 10.00 H new ATOM 1225 N GLY A 92 5.261 -14.866 -14.511 1.00 10.00 N ATOM 1226 CA GLY A 92 5.747 -15.253 -15.816 1.00 10.00 C ATOM 1227 C GLY A 92 4.613 -15.343 -16.808 1.00 10.00 C ATOM 1228 O GLY A 92 3.625 -14.603 -16.636 1.00 10.00 O ATOM 0 H GLY A 92 4.619 -14.073 -14.514 1.00 10.00 H new ATOM 0 HA2 GLY A 92 6.483 -14.528 -16.164 1.00 10.00 H new ATOM 0 HA3 GLY A 92 6.254 -16.216 -15.749 1.00 10.00 H new TER 1232 GLY A 92 ATOM 1233 N ASN B 357 -15.826 -10.346 6.622 1.00 10.00 N ATOM 1234 CA ASN B 357 -14.611 -9.549 6.346 1.00 10.00 C ATOM 1235 C ASN B 357 -13.926 -9.187 7.647 1.00 10.00 C ATOM 1236 O ASN B 357 -14.533 -9.247 8.713 1.00 10.00 O ATOM 1237 CB ASN B 357 -14.964 -8.280 5.558 1.00 10.00 C ATOM 1238 CG ASN B 357 -15.754 -7.261 6.372 1.00 10.00 C ATOM 1239 OD1 ASN B 357 -16.508 -7.616 7.278 1.00 10.00 O ATOM 1240 ND2 ASN B 357 -15.592 -5.990 6.042 1.00 10.00 N ATOM 0 HA ASN B 357 -13.930 -10.148 5.741 1.00 10.00 H new ATOM 0 HB2 ASN B 357 -14.045 -7.815 5.202 1.00 10.00 H new ATOM 0 HB3 ASN B 357 -15.543 -8.558 4.677 1.00 10.00 H new ATOM 0 HD21 ASN B 357 -16.102 -5.264 6.545 1.00 10.00 H new ATOM 0 HD22 ASN B 357 -14.957 -5.737 5.285 1.00 10.00 H new ATOM 1247 N ASN B 358 -12.654 -8.830 7.569 1.00 10.00 N ATOM 1248 CA ASN B 358 -11.910 -8.463 8.765 1.00 10.00 C ATOM 1249 C ASN B 358 -11.364 -7.052 8.664 1.00 10.00 C ATOM 1250 O ASN B 358 -10.685 -6.714 7.699 1.00 10.00 O ATOM 1251 CB ASN B 358 -10.763 -9.461 9.004 1.00 10.00 C ATOM 1252 CG ASN B 358 -9.889 -9.672 7.777 1.00 10.00 C ATOM 1253 OD1 ASN B 358 -8.884 -8.989 7.585 1.00 10.00 O ATOM 1254 ND2 ASN B 358 -10.269 -10.618 6.933 1.00 10.00 N ATOM 0 H ASN B 358 -12.119 -8.786 6.701 1.00 10.00 H new ATOM 0 HA ASN B 358 -12.596 -8.498 9.611 1.00 10.00 H new ATOM 0 HB2 ASN B 358 -10.144 -9.103 9.826 1.00 10.00 H new ATOM 0 HB3 ASN B 358 -11.181 -10.419 9.313 1.00 10.00 H new ATOM 0 HD21 ASN B 358 -9.723 -10.800 6.091 1.00 10.00 H new ATOM 0 HD22 ASN B 358 -11.108 -11.165 7.124 1.00 10.00 H new ATOM 1261 N ARG B 359 -11.696 -6.220 9.648 1.00 10.00 N ATOM 1262 CA ARG B 359 -11.196 -4.854 9.675 1.00 10.00 C ATOM 1263 C ARG B 359 -10.492 -4.544 10.996 1.00 10.00 C ATOM 1264 O ARG B 359 -11.086 -4.653 12.073 1.00 10.00 O ATOM 1265 CB ARG B 359 -12.333 -3.851 9.449 1.00 10.00 C ATOM 1266 CG ARG B 359 -13.705 -4.372 9.845 1.00 10.00 C ATOM 1267 CD ARG B 359 -14.788 -3.344 9.569 1.00 10.00 C ATOM 1268 NE ARG B 359 -14.767 -2.251 10.541 1.00 10.00 N ATOM 1269 CZ ARG B 359 -15.564 -1.183 10.483 1.00 10.00 C ATOM 1270 NH1 ARG B 359 -16.435 -1.049 9.491 1.00 10.00 N ATOM 1271 NH2 ARG B 359 -15.488 -0.244 11.419 1.00 10.00 N ATOM 0 H ARG B 359 -12.304 -6.467 10.429 1.00 10.00 H new ATOM 0 HA ARG B 359 -10.472 -4.759 8.866 1.00 10.00 H new ATOM 0 HB2 ARG B 359 -12.122 -2.945 10.017 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -12.352 -3.570 8.396 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -13.921 -5.288 9.294 1.00 10.00 H new ATOM 0 HG3 ARG B 359 -13.707 -4.629 10.904 1.00 10.00 H new ATOM 0 HD2 ARG B 359 -14.656 -2.939 8.566 1.00 10.00 H new ATOM 0 HD3 ARG B 359 -15.763 -3.830 9.591 1.00 10.00 H new ATOM 0 HE ARG B 359 -14.101 -2.309 11.311 1.00 10.00 H new ATOM 0 HH11 ARG B 359 -16.498 -1.765 8.767 1.00 10.00 H new ATOM 0 HH12 ARG B 359 -17.042 -0.230 9.452 1.00 10.00 H new ATOM 0 HH21 ARG B 359 -14.820 -0.339 12.184 1.00 10.00 H new ATOM 0 HH22 ARG B 359 -16.098 0.572 11.373 1.00 10.00 H new ATOM 1285 N ASP B 360 -9.235 -4.159 10.899 1.00 10.00 N ATOM 1286 CA ASP B 360 -8.422 -3.774 12.053 1.00 10.00 C ATOM 1287 C ASP B 360 -7.798 -2.407 11.784 1.00 10.00 C ATOM 1288 O ASP B 360 -7.402 -2.142 10.649 1.00 10.00 O ATOM 1289 CB ASP B 360 -7.372 -4.838 12.422 1.00 10.00 C ATOM 1290 CG ASP B 360 -6.017 -4.599 11.801 1.00 10.00 C ATOM 1291 OD1 ASP B 360 -5.822 -4.992 10.633 1.00 10.00 O ATOM 1292 OD2 ASP B 360 -5.128 -4.051 12.491 1.00 10.00 O ATOM 0 H ASP B 360 -8.737 -4.101 10.011 1.00 10.00 H new ATOM 0 HA ASP B 360 -9.068 -3.703 12.928 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -7.264 -4.868 13.506 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -7.736 -5.817 12.111 1.00 10.00 H new ATOM 1297 N PRO B 361 -7.711 -1.502 12.775 1.00 10.00 N ATOM 1298 CA PRO B 361 -7.159 -0.177 12.546 1.00 10.00 C ATOM 1299 C PRO B 361 -5.741 -0.011 13.091 1.00 10.00 C ATOM 1300 O PRO B 361 -5.433 -0.330 14.245 1.00 10.00 O ATOM 1301 CB PRO B 361 -8.137 0.695 13.342 1.00 10.00 C ATOM 1302 CG PRO B 361 -8.633 -0.179 14.464 1.00 10.00 C ATOM 1303 CD PRO B 361 -8.254 -1.610 14.135 1.00 10.00 C ATOM 0 HA PRO B 361 -7.067 0.063 11.487 1.00 10.00 H new ATOM 0 HB2 PRO B 361 -7.643 1.587 13.728 1.00 10.00 H new ATOM 0 HB3 PRO B 361 -8.961 1.034 12.714 1.00 10.00 H new ATOM 0 HG2 PRO B 361 -8.189 0.126 15.412 1.00 10.00 H new ATOM 0 HG3 PRO B 361 -9.713 -0.085 14.573 1.00 10.00 H new ATOM 0 HD2 PRO B 361 -7.516 -2.003 14.834 1.00 10.00 H new ATOM 0 HD3 PRO B 361 -9.116 -2.275 14.174 1.00 10.00 H new ATOM 1311 N ILE B 362 -4.884 0.500 12.213 1.00 10.00 N ATOM 1312 CA ILE B 362 -3.469 0.694 12.494 1.00 10.00 C ATOM 1313 C ILE B 362 -3.112 2.165 12.435 1.00 10.00 C ATOM 1314 O ILE B 362 -3.505 2.864 11.511 1.00 10.00 O ATOM 1315 CB ILE B 362 -2.587 -0.060 11.465 1.00 10.00 C ATOM 1316 CG1 ILE B 362 -3.156 -1.447 11.162 1.00 10.00 C ATOM 1317 CG2 ILE B 362 -1.152 -0.183 11.954 1.00 10.00 C ATOM 1318 CD1 ILE B 362 -3.948 -1.502 9.874 1.00 10.00 C ATOM 0 H ILE B 362 -5.158 0.794 11.275 1.00 10.00 H new ATOM 0 HA ILE B 362 -3.282 0.302 13.494 1.00 10.00 H new ATOM 0 HB ILE B 362 -2.590 0.526 10.546 1.00 10.00 H new ATOM 0 HG12 ILE B 362 -2.337 -2.164 11.107 1.00 10.00 H new ATOM 0 HG13 ILE B 362 -3.797 -1.757 11.988 1.00 10.00 H new ATOM 0 HG21 ILE B 362 -0.559 -0.716 11.211 1.00 10.00 H new ATOM 0 HG22 ILE B 362 -0.733 0.812 12.107 1.00 10.00 H new ATOM 0 HG23 ILE B 362 -1.134 -0.733 12.895 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -4.323 -2.514 9.720 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -4.788 -0.809 9.933 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -3.305 -1.222 9.039 1.00 10.00 H new ATOM 1330 N VAL B 363 -2.374 2.637 13.425 1.00 10.00 N ATOM 1331 CA VAL B 363 -1.987 4.037 13.467 1.00 10.00 C ATOM 1332 C VAL B 363 -0.477 4.170 13.366 1.00 10.00 C ATOM 1333 O VAL B 363 0.270 3.517 14.097 1.00 10.00 O ATOM 1334 CB VAL B 363 -2.465 4.710 14.776 1.00 10.00 C ATOM 1335 CG1 VAL B 363 -2.136 6.197 14.785 1.00 10.00 C ATOM 1336 CG2 VAL B 363 -3.955 4.494 14.979 1.00 10.00 C ATOM 0 H VAL B 363 -2.033 2.076 14.206 1.00 10.00 H new ATOM 0 HA VAL B 363 -2.460 4.535 12.620 1.00 10.00 H new ATOM 0 HB VAL B 363 -1.931 4.242 15.603 1.00 10.00 H new ATOM 0 HG11 VAL B 363 -2.484 6.641 15.717 1.00 10.00 H new ATOM 0 HG12 VAL B 363 -1.058 6.332 14.700 1.00 10.00 H new ATOM 0 HG13 VAL B 363 -2.630 6.684 13.944 1.00 10.00 H new ATOM 0 HG21 VAL B 363 -4.270 4.975 15.905 1.00 10.00 H new ATOM 0 HG22 VAL B 363 -4.503 4.926 14.141 1.00 10.00 H new ATOM 0 HG23 VAL B 363 -4.163 3.426 15.037 1.00 10.00 H new ATOM 1346 N ILE B 364 -0.039 5.000 12.440 1.00 10.00 N ATOM 1347 CA ILE B 364 1.375 5.248 12.227 1.00 10.00 C ATOM 1348 C ILE B 364 1.672 6.721 12.444 1.00 10.00 C ATOM 1349 O ILE B 364 0.965 7.590 11.925 1.00 10.00 O ATOM 1350 CB ILE B 364 1.833 4.849 10.807 1.00 10.00 C ATOM 1351 CG1 ILE B 364 1.594 3.357 10.563 1.00 10.00 C ATOM 1352 CG2 ILE B 364 3.303 5.190 10.595 1.00 10.00 C ATOM 1353 CD1 ILE B 364 1.726 2.934 9.113 1.00 10.00 C ATOM 0 H ILE B 364 -0.652 5.522 11.814 1.00 10.00 H new ATOM 0 HA ILE B 364 1.922 4.634 12.942 1.00 10.00 H new ATOM 0 HB ILE B 364 1.242 5.418 10.090 1.00 10.00 H new ATOM 0 HG12 ILE B 364 2.302 2.785 11.162 1.00 10.00 H new ATOM 0 HG13 ILE B 364 0.596 3.098 10.916 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.602 4.900 9.588 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.450 6.263 10.722 1.00 10.00 H new ATOM 0 HG23 ILE B 364 3.910 4.652 11.323 1.00 10.00 H new ATOM 0 HD11 ILE B 364 1.541 1.863 9.028 1.00 10.00 H new ATOM 0 HD12 ILE B 364 0.999 3.477 8.508 1.00 10.00 H new ATOM 0 HD13 ILE B 364 2.732 3.158 8.759 1.00 10.00 H new ATOM 1365 N SER B 365 2.688 7.002 13.230 1.00 10.00 N ATOM 1366 CA SER B 365 3.086 8.368 13.493 1.00 10.00 C ATOM 1367 C SER B 365 4.516 8.577 13.028 1.00 10.00 C ATOM 1368 O SER B 365 5.411 7.797 13.373 1.00 10.00 O ATOM 1369 CB SER B 365 2.958 8.660 14.986 1.00 10.00 C ATOM 1370 OG SER B 365 3.565 7.629 15.748 1.00 10.00 O ATOM 0 H SER B 365 3.257 6.298 13.701 1.00 10.00 H new ATOM 0 HA SER B 365 2.437 9.053 12.948 1.00 10.00 H new ATOM 0 HB2 SER B 365 3.428 9.616 15.217 1.00 10.00 H new ATOM 0 HB3 SER B 365 1.906 8.749 15.256 1.00 10.00 H new ATOM 0 HG SER B 365 4.389 7.337 15.306 1.00 10.00 H new ATOM 1376 N ASP B 366 4.723 9.600 12.223 1.00 10.00 N ATOM 1377 CA ASP B 366 6.044 9.910 11.712 1.00 10.00 C ATOM 1378 C ASP B 366 6.448 11.330 12.071 1.00 10.00 C ATOM 1379 O ASP B 366 5.663 12.262 11.886 1.00 10.00 O ATOM 1380 CB ASP B 366 6.090 9.713 10.199 1.00 10.00 C ATOM 1381 CG ASP B 366 7.488 9.395 9.717 1.00 10.00 C ATOM 1382 OD1 ASP B 366 7.738 9.472 8.499 1.00 10.00 O ATOM 1383 OD2 ASP B 366 8.349 9.038 10.555 1.00 10.00 O ATOM 0 H ASP B 366 3.989 10.234 11.907 1.00 10.00 H new ATOM 0 HA ASP B 366 6.754 9.226 12.177 1.00 10.00 H new ATOM 0 HB2 ASP B 366 5.415 8.905 9.917 1.00 10.00 H new ATOM 0 HB3 ASP B 366 5.731 10.615 9.704 1.00 10.00 H new ATOM 1388 N SER B 367 7.651 11.487 12.592 1.00 10.00 N ATOM 1389 CA SER B 367 8.158 12.795 12.969 1.00 10.00 C ATOM 1390 C SER B 367 9.241 13.239 11.984 1.00 10.00 C ATOM 1391 O SER B 367 10.019 12.415 11.505 1.00 10.00 O ATOM 1392 CB SER B 367 8.725 12.760 14.394 1.00 10.00 C ATOM 1393 OG SER B 367 7.775 12.255 15.322 1.00 10.00 O ATOM 0 H SER B 367 8.300 10.719 12.765 1.00 10.00 H new ATOM 0 HA SER B 367 7.336 13.510 12.940 1.00 10.00 H new ATOM 0 HB2 SER B 367 9.621 12.139 14.415 1.00 10.00 H new ATOM 0 HB3 SER B 367 9.027 13.764 14.691 1.00 10.00 H new ATOM 0 HG SER B 367 8.168 12.244 16.220 1.00 10.00 H new ATOM 1399 N PRO B 368 9.292 14.543 11.657 1.00 10.00 N ATOM 1400 CA PRO B 368 10.285 15.087 10.727 1.00 10.00 C ATOM 1401 C PRO B 368 11.702 14.987 11.284 1.00 10.00 C ATOM 1402 O PRO B 368 12.000 15.669 12.285 1.00 10.00 O ATOM 1403 CB PRO B 368 9.866 16.554 10.560 1.00 10.00 C ATOM 1404 CG PRO B 368 9.055 16.870 11.768 1.00 10.00 C ATOM 1405 CD PRO B 368 8.391 15.586 12.178 1.00 10.00 C ATOM 0 HA PRO B 368 10.308 14.538 9.785 1.00 10.00 H new ATOM 0 HB2 PRO B 368 10.736 17.206 10.489 1.00 10.00 H new ATOM 0 HB3 PRO B 368 9.286 16.696 9.648 1.00 10.00 H new ATOM 0 HG2 PRO B 368 9.685 17.255 12.570 1.00 10.00 H new ATOM 0 HG3 PRO B 368 8.314 17.638 11.549 1.00 10.00 H new ATOM 0 HD2 PRO B 368 8.285 15.519 13.261 1.00 10.00 H new ATOM 0 HD3 PRO B 368 7.391 15.499 11.753 1.00 10.00 H new TER 1413 PRO B 368