USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1153 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 58 SER OG : rot -80:sc= -0.596 USER MOD Set 1.2: A 67 MET CE :methyl -119:sc= -0.206 (180deg=-1.72) USER MOD Set 2.1: A 65 LYS NZ :NH3+ -101:sc= -0.475 (180deg=0.112) USER MOD Set 2.2: A 100 GLN : amide:sc= -3.27! C(o=-3.7!,f=-5.9!) USER MOD Set 3.1: A 53 LYS NZ :NH3+ -161:sc= 0.665 (180deg=0.27) USER MOD Set 3.2: A 126 SER OG : rot -160:sc= 0.0376 USER MOD Set 4.1: A 33 ASN : amide:sc= -0.265 X(o=-0.4,f=-0.078) USER MOD Set 4.2: A 59 ASN : amide:sc= -0.138 K(o=-0.4,f=-2!) USER MOD Set 5.1: A 9 THR OG1 : rot 47:sc= -0.161 USER MOD Set 5.2: A 83 GLN : amide:sc= -0.476 K(o=-0.64,f=-4!) USER MOD Set 6.1: A 2 LYS NZ :NH3+ 164:sc= 0.0312 (180deg=-1.02) USER MOD Set 6.2: A 76 TYR OH : rot -162:sc= 1.47 USER MOD Single : A 1 MET CE :methyl 147:sc= -0.2 (180deg=-1.81!) USER MOD Single : A 1 MET N :NH3+ -166:sc=-0.00276 (180deg=-0.184) USER MOD Single : A 8 ASN :FLIP amide:sc= -0.37 F(o=-0.93,f=-0.37) USER MOD Single : A 10 ASN : amide:sc= -0.44 X(o=-0.44,f=-0.69) USER MOD Single : A 11 ASN : amide:sc= -1.29 X(o=-1.3,f=-1.6) USER MOD Single : A 16 LYS NZ :NH3+ 127:sc= 0.00397 (180deg=-0.159) USER MOD Single : A 17 LYS NZ :NH3+ 141:sc= -0.0821 (180deg=-0.537!) USER MOD Single : A 19 LYS NZ :NH3+ 174:sc= 0.0201 (180deg=0.00245) USER MOD Single : A 20 LYS NZ :NH3+ -107:sc= 0.0652 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= -0.438 X(o=-0.44,f=-0.33) USER MOD Single : A 25 GLN : amide:sc= -0.521 K(o=-0.52,f=-3.5!) USER MOD Single : A 27 TYR OH : rot 15:sc= 0 USER MOD Single : A 28 GLN :FLIP amide:sc= -2.59 F(o=-3.5!,f=-2.6) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 MET CE :methyl -132:sc= -1.03 (180deg=-2.86!) USER MOD Single : A 43 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0192) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0779) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ -146:sc= 0.419 (180deg=-0.532!) USER MOD Single : A 62 GLN : amide:sc= 0.0861 X(o=0.086,f=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0247) USER MOD Single : A 77 LYS NZ :NH3+ 141:sc= 1.16 (180deg=0.427) USER MOD Single : A 85 GLN : amide:sc= -0.0148 X(o=-0.015,f=-0.27) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 142:sc= 0.184 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 110:sc= -0.917 USER MOD Single : A 106 LYS NZ :NH3+ -110:sc= 1.11 (180deg=0.328) USER MOD Single : A 108 THR OG1 : rot -76:sc= 0.355 USER MOD Single : A 115 LYS NZ :NH3+ -154:sc= 0.0756 (180deg=-0.475) USER MOD Single : A 121 MET CE :methyl -124:sc=-0.00914 (180deg=-0.308) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 HIS : no HE2:sc= 0.0547 X(o=0.055,f=-0.26) USER MOD Single : A 131 HIS : no HD1:sc= -0.028 K(o=-0.028,f=-0.65) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.043 9.769 6.707 1.00 64.53 N ATOM 2 CA MET A 1 -11.763 9.041 6.689 1.00 71.34 C ATOM 3 C MET A 1 -11.957 7.703 5.970 1.00 53.25 C ATOM 4 O MET A 1 -12.668 6.813 6.459 1.00 0.40 O ATOM 5 CB MET A 1 -11.220 8.829 8.138 1.00 62.32 C ATOM 6 CG MET A 1 -10.872 10.108 8.944 1.00 55.11 C ATOM 7 SD MET A 1 -9.203 10.767 8.633 1.00 25.43 S ATOM 8 CE MET A 1 -9.326 11.576 7.033 1.00 62.22 C ATOM 0 H1 MET A 1 -12.875 10.760 6.973 1.00 64.53 H new ATOM 0 H2 MET A 1 -13.476 9.733 5.762 1.00 64.53 H new ATOM 0 H3 MET A 1 -13.683 9.329 7.398 1.00 64.53 H new ATOM 0 HA MET A 1 -11.021 9.631 6.151 1.00 71.34 H new ATOM 0 HB2 MET A 1 -11.963 8.263 8.701 1.00 62.32 H new ATOM 0 HB3 MET A 1 -10.325 8.210 8.079 1.00 62.32 H new ATOM 0 HG2 MET A 1 -11.604 10.881 8.708 1.00 55.11 H new ATOM 0 HG3 MET A 1 -10.970 9.890 10.007 1.00 55.11 H new ATOM 0 HE1 MET A 1 -8.661 12.440 7.010 1.00 62.22 H new ATOM 0 HE2 MET A 1 -9.039 10.876 6.248 1.00 62.22 H new ATOM 0 HE3 MET A 1 -10.353 11.904 6.869 1.00 62.22 H new ATOM 20 N LYS A 2 -11.369 7.601 4.779 1.00 3.21 N ATOM 21 CA LYS A 2 -11.313 6.377 3.985 1.00 71.55 C ATOM 22 C LYS A 2 -9.851 6.198 3.582 1.00 60.24 C ATOM 23 O LYS A 2 -9.342 6.919 2.721 1.00 55.20 O ATOM 24 CB LYS A 2 -12.257 6.480 2.758 1.00 51.10 C ATOM 25 CG LYS A 2 -12.193 5.289 1.767 1.00 2.55 C ATOM 26 CD LYS A 2 -13.174 5.482 0.591 1.00 61.01 C ATOM 27 CE LYS A 2 -12.936 4.533 -0.576 1.00 3.44 C ATOM 28 NZ LYS A 2 -13.819 4.853 -1.727 1.00 35.04 N ATOM 0 H LYS A 2 -10.906 8.390 4.328 1.00 3.21 H new ATOM 0 HA LYS A 2 -11.655 5.509 4.548 1.00 71.55 H new ATOM 0 HB2 LYS A 2 -13.282 6.577 3.117 1.00 51.10 H new ATOM 0 HB3 LYS A 2 -12.021 7.395 2.215 1.00 51.10 H new ATOM 0 HG2 LYS A 2 -11.178 5.187 1.383 1.00 2.55 H new ATOM 0 HG3 LYS A 2 -12.430 4.364 2.292 1.00 2.55 H new ATOM 0 HD2 LYS A 2 -14.192 5.346 0.955 1.00 61.01 H new ATOM 0 HD3 LYS A 2 -13.098 6.509 0.233 1.00 61.01 H new ATOM 0 HE2 LYS A 2 -11.893 4.593 -0.888 1.00 3.44 H new ATOM 0 HE3 LYS A 2 -13.114 3.507 -0.254 1.00 3.44 H new ATOM 0 HZ1 LYS A 2 -13.458 4.384 -2.582 1.00 35.04 H new ATOM 0 HZ2 LYS A 2 -14.783 4.517 -1.529 1.00 35.04 H new ATOM 0 HZ3 LYS A 2 -13.835 5.882 -1.877 1.00 35.04 H new ATOM 42 N GLU A 3 -9.173 5.288 4.279 1.00 34.02 N ATOM 43 CA GLU A 3 -7.724 5.083 4.151 1.00 22.44 C ATOM 44 C GLU A 3 -7.422 4.059 3.048 1.00 53.23 C ATOM 45 O GLU A 3 -8.094 3.028 2.926 1.00 41.24 O ATOM 46 CB GLU A 3 -7.081 4.627 5.496 1.00 35.32 C ATOM 47 CG GLU A 3 -7.214 5.620 6.689 1.00 34.44 C ATOM 48 CD GLU A 3 -8.459 5.383 7.570 1.00 2.12 C ATOM 49 OE1 GLU A 3 -9.571 5.795 7.179 1.00 53.12 O ATOM 50 OE2 GLU A 3 -8.331 4.763 8.655 1.00 32.50 O ATOM 0 H GLU A 3 -9.614 4.665 4.955 1.00 34.02 H new ATOM 0 HA GLU A 3 -7.283 6.042 3.880 1.00 22.44 H new ATOM 0 HB2 GLU A 3 -7.531 3.678 5.787 1.00 35.32 H new ATOM 0 HB3 GLU A 3 -6.022 4.438 5.323 1.00 35.32 H new ATOM 0 HG2 GLU A 3 -6.322 5.545 7.311 1.00 34.44 H new ATOM 0 HG3 GLU A 3 -7.246 6.637 6.299 1.00 34.44 H new ATOM 57 N LEU A 4 -6.410 4.380 2.244 1.00 33.21 N ATOM 58 CA LEU A 4 -5.877 3.506 1.198 1.00 61.42 C ATOM 59 C LEU A 4 -4.408 3.237 1.559 1.00 23.24 C ATOM 60 O LEU A 4 -3.578 4.153 1.537 1.00 30.23 O ATOM 61 CB LEU A 4 -6.002 4.176 -0.205 1.00 2.11 C ATOM 62 CG LEU A 4 -7.360 4.018 -0.984 1.00 31.00 C ATOM 63 CD1 LEU A 4 -7.606 2.546 -1.368 1.00 4.42 C ATOM 64 CD2 LEU A 4 -8.571 4.620 -0.220 1.00 41.21 C ATOM 0 H LEU A 4 -5.926 5.276 2.302 1.00 33.21 H new ATOM 0 HA LEU A 4 -6.438 2.573 1.143 1.00 61.42 H new ATOM 0 HB2 LEU A 4 -5.809 5.242 -0.084 1.00 2.11 H new ATOM 0 HB3 LEU A 4 -5.207 3.778 -0.836 1.00 2.11 H new ATOM 0 HG LEU A 4 -7.265 4.599 -1.901 1.00 31.00 H new ATOM 0 HD11 LEU A 4 -8.551 2.463 -1.905 1.00 4.42 H new ATOM 0 HD12 LEU A 4 -6.794 2.196 -2.005 1.00 4.42 H new ATOM 0 HD13 LEU A 4 -7.647 1.937 -0.465 1.00 4.42 H new ATOM 0 HD21 LEU A 4 -9.478 4.480 -0.808 1.00 41.21 H new ATOM 0 HD22 LEU A 4 -8.681 4.118 0.741 1.00 41.21 H new ATOM 0 HD23 LEU A 4 -8.405 5.685 -0.057 1.00 41.21 H new ATOM 76 N ILE A 5 -4.120 1.990 1.930 1.00 34.23 N ATOM 77 CA ILE A 5 -2.775 1.542 2.326 1.00 45.35 C ATOM 78 C ILE A 5 -2.179 0.702 1.187 1.00 52.43 C ATOM 79 O ILE A 5 -2.753 -0.311 0.797 1.00 41.03 O ATOM 80 CB ILE A 5 -2.809 0.728 3.687 1.00 35.32 C ATOM 81 CG1 ILE A 5 -1.449 -0.008 3.955 1.00 45.52 C ATOM 82 CG2 ILE A 5 -4.009 -0.242 3.739 1.00 35.13 C ATOM 83 CD1 ILE A 5 -1.378 -0.829 5.238 1.00 45.23 C ATOM 0 H ILE A 5 -4.820 1.249 1.966 1.00 34.23 H new ATOM 0 HA ILE A 5 -2.144 2.413 2.502 1.00 45.35 H new ATOM 0 HB ILE A 5 -2.946 1.449 4.493 1.00 35.32 H new ATOM 0 HG12 ILE A 5 -1.243 -0.668 3.112 1.00 45.52 H new ATOM 0 HG13 ILE A 5 -0.653 0.737 3.979 1.00 45.52 H new ATOM 0 HG21 ILE A 5 -3.999 -0.782 4.686 1.00 35.13 H new ATOM 0 HG22 ILE A 5 -4.937 0.323 3.653 1.00 35.13 H new ATOM 0 HG23 ILE A 5 -3.939 -0.952 2.915 1.00 35.13 H new ATOM 0 HD11 ILE A 5 -0.395 -1.292 5.320 1.00 45.23 H new ATOM 0 HD12 ILE A 5 -1.545 -0.178 6.096 1.00 45.23 H new ATOM 0 HD13 ILE A 5 -2.144 -1.605 5.216 1.00 45.23 H new ATOM 95 N LEU A 6 -1.037 1.156 0.653 1.00 22.23 N ATOM 96 CA LEU A 6 -0.344 0.498 -0.462 1.00 41.31 C ATOM 97 C LEU A 6 0.837 -0.297 0.104 1.00 12.14 C ATOM 98 O LEU A 6 1.671 0.265 0.810 1.00 70.04 O ATOM 99 CB LEU A 6 0.144 1.538 -1.516 1.00 74.23 C ATOM 100 CG LEU A 6 -0.960 2.363 -2.272 1.00 75.34 C ATOM 101 CD1 LEU A 6 -1.641 3.418 -1.363 1.00 64.13 C ATOM 102 CD2 LEU A 6 -0.386 3.008 -3.557 1.00 54.23 C ATOM 0 H LEU A 6 -0.565 1.997 0.986 1.00 22.23 H new ATOM 0 HA LEU A 6 -1.034 -0.174 -0.972 1.00 41.31 H new ATOM 0 HB2 LEU A 6 0.808 2.242 -1.014 1.00 74.23 H new ATOM 0 HB3 LEU A 6 0.741 1.011 -2.260 1.00 74.23 H new ATOM 0 HG LEU A 6 -1.739 1.659 -2.564 1.00 75.34 H new ATOM 0 HD11 LEU A 6 -2.395 3.959 -1.935 1.00 64.13 H new ATOM 0 HD12 LEU A 6 -2.116 2.919 -0.518 1.00 64.13 H new ATOM 0 HD13 LEU A 6 -0.892 4.119 -0.995 1.00 64.13 H new ATOM 0 HD21 LEU A 6 -1.170 3.573 -4.062 1.00 54.23 H new ATOM 0 HD22 LEU A 6 0.432 3.678 -3.293 1.00 54.23 H new ATOM 0 HD23 LEU A 6 -0.016 2.227 -4.222 1.00 54.23 H new ATOM 114 N ILE A 7 0.876 -1.605 -0.177 1.00 54.23 N ATOM 115 CA ILE A 7 1.967 -2.490 0.255 1.00 2.14 C ATOM 116 C ILE A 7 2.916 -2.715 -0.935 1.00 3.41 C ATOM 117 O ILE A 7 2.502 -3.242 -1.967 1.00 3.12 O ATOM 118 CB ILE A 7 1.455 -3.891 0.820 1.00 15.13 C ATOM 119 CG1 ILE A 7 0.734 -3.756 2.214 1.00 3.13 C ATOM 120 CG2 ILE A 7 2.616 -4.915 0.928 1.00 32.13 C ATOM 121 CD1 ILE A 7 -0.607 -3.049 2.188 1.00 34.12 C ATOM 0 H ILE A 7 0.150 -2.082 -0.712 1.00 54.23 H new ATOM 0 HA ILE A 7 2.484 -2.001 1.081 1.00 2.14 H new ATOM 0 HB ILE A 7 0.722 -4.256 0.100 1.00 15.13 H new ATOM 0 HG12 ILE A 7 0.591 -4.754 2.628 1.00 3.13 H new ATOM 0 HG13 ILE A 7 1.395 -3.220 2.895 1.00 3.13 H new ATOM 0 HG21 ILE A 7 2.234 -5.859 1.316 1.00 32.13 H new ATOM 0 HG22 ILE A 7 3.051 -5.078 -0.058 1.00 32.13 H new ATOM 0 HG23 ILE A 7 3.380 -4.529 1.602 1.00 32.13 H new ATOM 0 HD11 ILE A 7 -1.017 -3.010 3.197 1.00 34.12 H new ATOM 0 HD12 ILE A 7 -0.477 -2.035 1.810 1.00 34.12 H new ATOM 0 HD13 ILE A 7 -1.293 -3.593 1.538 1.00 34.12 H new ATOM 133 N ASN A 8 4.181 -2.311 -0.775 1.00 32.24 N ATOM 134 CA ASN A 8 5.258 -2.653 -1.705 1.00 1.41 C ATOM 135 C ASN A 8 5.976 -3.871 -1.135 1.00 13.23 C ATOM 136 O ASN A 8 6.491 -3.822 -0.012 1.00 53.31 O ATOM 137 CB ASN A 8 6.262 -1.491 -1.854 1.00 31.11 C ATOM 138 CG ASN A 8 7.367 -1.755 -2.892 1.00 50.23 C ATOM 139 OD1 ASN A 8 7.012 -2.335 -4.036 1.00 71.41 O flip ATOM 140 ND2 ASN A 8 8.519 -1.374 -2.693 1.00 4.24 N flip ATOM 0 H ASN A 8 4.486 -1.734 0.009 1.00 32.24 H new ATOM 0 HA ASN A 8 4.841 -2.856 -2.691 1.00 1.41 H new ATOM 0 HB2 ASN A 8 5.720 -0.588 -2.136 1.00 31.11 H new ATOM 0 HB3 ASN A 8 6.724 -1.296 -0.886 1.00 31.11 H new ATOM 0 HD21 ASN A 8 8.764 -0.932 -1.807 1.00 4.24 H new ATOM 0 HD22 ASN A 8 9.229 -1.500 -3.414 1.00 4.24 H new ATOM 147 N THR A 9 5.954 -4.962 -1.887 1.00 64.12 N ATOM 148 CA THR A 9 6.610 -6.207 -1.509 1.00 41.50 C ATOM 149 C THR A 9 7.171 -6.890 -2.757 1.00 5.21 C ATOM 150 O THR A 9 6.525 -6.916 -3.814 1.00 55.03 O ATOM 151 CB THR A 9 5.642 -7.161 -0.717 1.00 31.52 C ATOM 152 OG1 THR A 9 6.218 -8.472 -0.580 1.00 24.44 O ATOM 153 CG2 THR A 9 4.255 -7.265 -1.366 1.00 24.12 C ATOM 0 H THR A 9 5.475 -5.009 -2.786 1.00 64.12 H new ATOM 0 HA THR A 9 7.434 -5.973 -0.835 1.00 41.50 H new ATOM 0 HB THR A 9 5.509 -6.718 0.270 1.00 31.52 H new ATOM 0 HG1 THR A 9 7.150 -8.391 -0.289 1.00 24.44 H new ATOM 0 HG21 THR A 9 3.628 -7.936 -0.779 1.00 24.12 H new ATOM 0 HG22 THR A 9 3.795 -6.277 -1.402 1.00 24.12 H new ATOM 0 HG23 THR A 9 4.355 -7.656 -2.378 1.00 24.12 H new ATOM 161 N ASN A 10 8.400 -7.392 -2.620 1.00 30.54 N ATOM 162 CA ASN A 10 9.105 -8.150 -3.668 1.00 44.41 C ATOM 163 C ASN A 10 8.943 -9.664 -3.451 1.00 3.44 C ATOM 164 O ASN A 10 9.279 -10.469 -4.326 1.00 53.32 O ATOM 165 CB ASN A 10 10.611 -7.759 -3.653 1.00 75.24 C ATOM 166 CG ASN A 10 10.882 -6.255 -3.831 1.00 64.01 C ATOM 167 OD1 ASN A 10 11.877 -5.730 -3.317 1.00 5.42 O ATOM 168 ND2 ASN A 10 10.027 -5.553 -4.575 1.00 12.52 N ATOM 0 H ASN A 10 8.946 -7.284 -1.765 1.00 30.54 H new ATOM 0 HA ASN A 10 8.673 -7.904 -4.638 1.00 44.41 H new ATOM 0 HB2 ASN A 10 11.048 -8.085 -2.709 1.00 75.24 H new ATOM 0 HB3 ASN A 10 11.123 -8.304 -4.446 1.00 75.24 H new ATOM 0 HD21 ASN A 10 10.186 -4.558 -4.732 1.00 12.52 H new ATOM 0 HD22 ASN A 10 9.214 -6.011 -4.987 1.00 12.52 H new ATOM 175 N ASN A 11 8.425 -10.034 -2.275 1.00 45.41 N ATOM 176 CA ASN A 11 8.344 -11.430 -1.812 1.00 53.43 C ATOM 177 C ASN A 11 6.929 -11.994 -2.088 1.00 12.35 C ATOM 178 O ASN A 11 5.949 -11.534 -1.493 1.00 13.40 O ATOM 179 CB ASN A 11 8.706 -11.470 -0.302 1.00 20.04 C ATOM 180 CG ASN A 11 8.779 -12.878 0.296 1.00 70.33 C ATOM 181 OD1 ASN A 11 9.091 -13.850 -0.392 1.00 33.31 O ATOM 182 ND2 ASN A 11 8.520 -12.994 1.587 1.00 3.12 N ATOM 0 H ASN A 11 8.044 -9.365 -1.606 1.00 45.41 H new ATOM 0 HA ASN A 11 9.051 -12.059 -2.353 1.00 53.43 H new ATOM 0 HB2 ASN A 11 9.668 -10.978 -0.159 1.00 20.04 H new ATOM 0 HB3 ASN A 11 7.966 -10.892 0.252 1.00 20.04 H new ATOM 0 HD21 ASN A 11 8.576 -13.907 2.038 1.00 3.12 H new ATOM 0 HD22 ASN A 11 8.264 -12.171 2.132 1.00 3.12 H new ATOM 189 N ASP A 12 6.854 -13.002 -2.983 1.00 12.43 N ATOM 190 CA ASP A 12 5.584 -13.550 -3.537 1.00 41.53 C ATOM 191 C ASP A 12 4.717 -14.220 -2.462 1.00 70.34 C ATOM 192 O ASP A 12 3.491 -14.042 -2.435 1.00 61.41 O ATOM 193 CB ASP A 12 5.886 -14.574 -4.662 1.00 74.24 C ATOM 194 CG ASP A 12 6.670 -13.963 -5.829 1.00 75.31 C ATOM 195 OD1 ASP A 12 7.903 -13.775 -5.701 1.00 52.02 O ATOM 196 OD2 ASP A 12 6.062 -13.667 -6.881 1.00 30.12 O ATOM 0 H ASP A 12 7.683 -13.469 -3.350 1.00 12.43 H new ATOM 0 HA ASP A 12 5.025 -12.705 -3.939 1.00 41.53 H new ATOM 0 HB2 ASP A 12 6.453 -15.407 -4.246 1.00 74.24 H new ATOM 0 HB3 ASP A 12 4.947 -14.983 -5.036 1.00 74.24 H new ATOM 201 N GLU A 13 5.365 -15.014 -1.599 1.00 3.43 N ATOM 202 CA GLU A 13 4.687 -15.699 -0.482 1.00 71.31 C ATOM 203 C GLU A 13 4.106 -14.673 0.507 1.00 41.42 C ATOM 204 O GLU A 13 2.987 -14.853 0.991 1.00 51.33 O ATOM 205 CB GLU A 13 5.645 -16.692 0.231 1.00 64.14 C ATOM 206 CG GLU A 13 6.968 -16.080 0.710 1.00 34.33 C ATOM 207 CD GLU A 13 7.816 -17.049 1.541 1.00 73.14 C ATOM 208 OE1 GLU A 13 7.550 -17.189 2.756 1.00 55.45 O ATOM 209 OE2 GLU A 13 8.740 -17.684 0.988 1.00 64.33 O ATOM 0 H GLU A 13 6.366 -15.201 -1.651 1.00 3.43 H new ATOM 0 HA GLU A 13 3.860 -16.281 -0.890 1.00 71.31 H new ATOM 0 HB2 GLU A 13 5.128 -17.121 1.089 1.00 64.14 H new ATOM 0 HB3 GLU A 13 5.867 -17.513 -0.450 1.00 64.14 H new ATOM 0 HG2 GLU A 13 7.544 -15.754 -0.156 1.00 34.33 H new ATOM 0 HG3 GLU A 13 6.756 -15.192 1.305 1.00 34.33 H new ATOM 216 N LEU A 14 4.854 -13.568 0.730 1.00 55.20 N ATOM 217 CA LEU A 14 4.439 -12.473 1.629 1.00 40.32 C ATOM 218 C LEU A 14 3.160 -11.801 1.099 1.00 53.24 C ATOM 219 O LEU A 14 2.249 -11.545 1.880 1.00 31.02 O ATOM 220 CB LEU A 14 5.589 -11.435 1.791 1.00 55.43 C ATOM 221 CG LEU A 14 5.296 -10.157 2.648 1.00 4.11 C ATOM 222 CD1 LEU A 14 4.823 -10.496 4.077 1.00 14.41 C ATOM 223 CD2 LEU A 14 6.526 -9.221 2.682 1.00 75.13 C ATOM 0 H LEU A 14 5.761 -13.413 0.291 1.00 55.20 H new ATOM 0 HA LEU A 14 4.221 -12.891 2.612 1.00 40.32 H new ATOM 0 HB2 LEU A 14 6.444 -11.947 2.232 1.00 55.43 H new ATOM 0 HB3 LEU A 14 5.891 -11.110 0.795 1.00 55.43 H new ATOM 0 HG LEU A 14 4.474 -9.634 2.160 1.00 4.11 H new ATOM 0 HD11 LEU A 14 4.635 -9.574 4.626 1.00 14.41 H new ATOM 0 HD12 LEU A 14 3.906 -11.082 4.027 1.00 14.41 H new ATOM 0 HD13 LEU A 14 5.594 -11.072 4.589 1.00 14.41 H new ATOM 0 HD21 LEU A 14 6.297 -8.341 3.283 1.00 75.13 H new ATOM 0 HD22 LEU A 14 7.373 -9.749 3.120 1.00 75.13 H new ATOM 0 HD23 LEU A 14 6.776 -8.912 1.667 1.00 75.13 H new ATOM 235 N ILE A 15 3.094 -11.567 -0.242 1.00 32.11 N ATOM 236 CA ILE A 15 1.906 -10.965 -0.910 1.00 53.13 C ATOM 237 C ILE A 15 0.629 -11.758 -0.546 1.00 43.31 C ATOM 238 O ILE A 15 -0.374 -11.178 -0.107 1.00 14.25 O ATOM 239 CB ILE A 15 2.025 -10.935 -2.492 1.00 54.44 C ATOM 240 CG1 ILE A 15 3.357 -10.276 -2.963 1.00 74.32 C ATOM 241 CG2 ILE A 15 0.806 -10.204 -3.111 1.00 63.53 C ATOM 242 CD1 ILE A 15 3.586 -10.263 -4.470 1.00 50.24 C ATOM 0 H ILE A 15 3.855 -11.788 -0.884 1.00 32.11 H new ATOM 0 HA ILE A 15 1.853 -9.937 -0.551 1.00 53.13 H new ATOM 0 HB ILE A 15 2.033 -11.968 -2.841 1.00 54.44 H new ATOM 0 HG12 ILE A 15 3.382 -9.248 -2.601 1.00 74.32 H new ATOM 0 HG13 ILE A 15 4.188 -10.800 -2.491 1.00 74.32 H new ATOM 0 HG21 ILE A 15 0.902 -10.192 -4.197 1.00 63.53 H new ATOM 0 HG22 ILE A 15 -0.110 -10.725 -2.834 1.00 63.53 H new ATOM 0 HG23 ILE A 15 0.768 -9.180 -2.738 1.00 63.53 H new ATOM 0 HD11 ILE A 15 4.540 -9.783 -4.689 1.00 50.24 H new ATOM 0 HD12 ILE A 15 3.601 -11.286 -4.845 1.00 50.24 H new ATOM 0 HD13 ILE A 15 2.782 -9.710 -4.955 1.00 50.24 H new ATOM 254 N LYS A 16 0.725 -13.092 -0.709 1.00 63.44 N ATOM 255 CA LYS A 16 -0.380 -14.039 -0.454 1.00 54.11 C ATOM 256 C LYS A 16 -0.858 -13.966 1.005 1.00 53.34 C ATOM 257 O LYS A 16 -2.060 -13.901 1.277 1.00 45.41 O ATOM 258 CB LYS A 16 0.076 -15.491 -0.760 1.00 4.05 C ATOM 259 CG LYS A 16 0.563 -15.726 -2.198 1.00 73.31 C ATOM 260 CD LYS A 16 1.000 -17.186 -2.445 1.00 4.41 C ATOM 261 CE LYS A 16 1.576 -17.397 -3.853 1.00 41.22 C ATOM 262 NZ LYS A 16 2.796 -16.575 -4.090 1.00 75.30 N ATOM 0 H LYS A 16 1.581 -13.548 -1.025 1.00 63.44 H new ATOM 0 HA LYS A 16 -1.206 -13.760 -1.109 1.00 54.11 H new ATOM 0 HB2 LYS A 16 0.878 -15.757 -0.072 1.00 4.05 H new ATOM 0 HB3 LYS A 16 -0.754 -16.167 -0.558 1.00 4.05 H new ATOM 0 HG2 LYS A 16 -0.234 -15.466 -2.895 1.00 73.31 H new ATOM 0 HG3 LYS A 16 1.400 -15.060 -2.408 1.00 73.31 H new ATOM 0 HD2 LYS A 16 1.748 -17.468 -1.704 1.00 4.41 H new ATOM 0 HD3 LYS A 16 0.145 -17.847 -2.303 1.00 4.41 H new ATOM 0 HE2 LYS A 16 1.817 -18.451 -3.991 1.00 41.22 H new ATOM 0 HE3 LYS A 16 0.819 -17.144 -4.595 1.00 41.22 H new ATOM 0 HZ1 LYS A 16 3.568 -17.188 -4.421 1.00 75.30 H new ATOM 0 HZ2 LYS A 16 2.594 -15.853 -4.811 1.00 75.30 H new ATOM 0 HZ3 LYS A 16 3.079 -16.110 -3.204 1.00 75.30 H new ATOM 276 N LYS A 17 0.121 -13.971 1.924 1.00 23.33 N ATOM 277 CA LYS A 17 -0.117 -13.976 3.378 1.00 32.45 C ATOM 278 C LYS A 17 -0.837 -12.695 3.827 1.00 0.10 C ATOM 279 O LYS A 17 -1.759 -12.751 4.657 1.00 52.51 O ATOM 280 CB LYS A 17 1.232 -14.140 4.121 1.00 40.51 C ATOM 281 CG LYS A 17 1.932 -15.486 3.848 1.00 60.53 C ATOM 282 CD LYS A 17 3.313 -15.588 4.529 1.00 43.11 C ATOM 283 CE LYS A 17 3.210 -15.644 6.055 1.00 35.03 C ATOM 284 NZ LYS A 17 4.550 -15.718 6.692 1.00 24.13 N ATOM 0 H LYS A 17 1.111 -13.972 1.677 1.00 23.33 H new ATOM 0 HA LYS A 17 -0.765 -14.817 3.625 1.00 32.45 H new ATOM 0 HB2 LYS A 17 1.898 -13.328 3.829 1.00 40.51 H new ATOM 0 HB3 LYS A 17 1.060 -14.041 5.193 1.00 40.51 H new ATOM 0 HG2 LYS A 17 1.297 -16.299 4.200 1.00 60.53 H new ATOM 0 HG3 LYS A 17 2.051 -15.617 2.773 1.00 60.53 H new ATOM 0 HD2 LYS A 17 3.827 -16.479 4.170 1.00 43.11 H new ATOM 0 HD3 LYS A 17 3.921 -14.731 4.240 1.00 43.11 H new ATOM 0 HE2 LYS A 17 2.683 -14.761 6.417 1.00 35.03 H new ATOM 0 HE3 LYS A 17 2.619 -16.511 6.349 1.00 35.03 H new ATOM 0 HZ1 LYS A 17 4.558 -15.134 7.553 1.00 24.13 H new ATOM 0 HZ2 LYS A 17 4.762 -16.705 6.941 1.00 24.13 H new ATOM 0 HZ3 LYS A 17 5.270 -15.366 6.029 1.00 24.13 H new ATOM 298 N ILE A 18 -0.416 -11.551 3.246 1.00 64.12 N ATOM 299 CA ILE A 18 -1.038 -10.240 3.497 1.00 43.30 C ATOM 300 C ILE A 18 -2.508 -10.286 3.051 1.00 34.55 C ATOM 301 O ILE A 18 -3.382 -9.968 3.846 1.00 43.15 O ATOM 302 CB ILE A 18 -0.260 -9.066 2.773 1.00 63.41 C ATOM 303 CG1 ILE A 18 1.207 -9.005 3.301 1.00 33.45 C ATOM 304 CG2 ILE A 18 -0.973 -7.696 2.957 1.00 31.34 C ATOM 305 CD1 ILE A 18 2.103 -8.000 2.617 1.00 54.41 C ATOM 0 H ILE A 18 0.365 -11.514 2.591 1.00 64.12 H new ATOM 0 HA ILE A 18 -0.988 -10.032 4.566 1.00 43.30 H new ATOM 0 HB ILE A 18 -0.249 -9.275 1.703 1.00 63.41 H new ATOM 0 HG12 ILE A 18 1.182 -8.777 4.367 1.00 33.45 H new ATOM 0 HG13 ILE A 18 1.654 -9.994 3.197 1.00 33.45 H new ATOM 0 HG21 ILE A 18 -0.406 -6.919 2.445 1.00 31.34 H new ATOM 0 HG22 ILE A 18 -1.977 -7.749 2.537 1.00 31.34 H new ATOM 0 HG23 ILE A 18 -1.036 -7.459 4.019 1.00 31.34 H new ATOM 0 HD11 ILE A 18 3.098 -8.040 3.059 1.00 54.41 H new ATOM 0 HD12 ILE A 18 2.169 -8.235 1.555 1.00 54.41 H new ATOM 0 HD13 ILE A 18 1.690 -6.999 2.743 1.00 54.41 H new ATOM 317 N LYS A 19 -2.756 -10.785 1.809 1.00 23.42 N ATOM 318 CA LYS A 19 -4.124 -10.923 1.236 1.00 71.33 C ATOM 319 C LYS A 19 -5.064 -11.652 2.214 1.00 0.33 C ATOM 320 O LYS A 19 -6.162 -11.170 2.501 1.00 1.55 O ATOM 321 CB LYS A 19 -4.113 -11.687 -0.126 1.00 61.43 C ATOM 322 CG LYS A 19 -3.375 -10.967 -1.269 1.00 14.14 C ATOM 323 CD LYS A 19 -3.513 -11.707 -2.621 1.00 25.23 C ATOM 324 CE LYS A 19 -2.808 -10.969 -3.768 1.00 42.24 C ATOM 325 NZ LYS A 19 -3.049 -11.616 -5.087 1.00 5.45 N ATOM 0 H LYS A 19 -2.018 -11.101 1.180 1.00 23.42 H new ATOM 0 HA LYS A 19 -4.490 -9.911 1.064 1.00 71.33 H new ATOM 0 HB2 LYS A 19 -3.652 -12.663 0.026 1.00 61.43 H new ATOM 0 HB3 LYS A 19 -5.143 -11.865 -0.434 1.00 61.43 H new ATOM 0 HG2 LYS A 19 -3.768 -9.955 -1.370 1.00 14.14 H new ATOM 0 HG3 LYS A 19 -2.319 -10.875 -1.015 1.00 14.14 H new ATOM 0 HD2 LYS A 19 -3.096 -12.710 -2.527 1.00 25.23 H new ATOM 0 HD3 LYS A 19 -4.570 -11.823 -2.862 1.00 25.23 H new ATOM 0 HE2 LYS A 19 -3.157 -9.937 -3.802 1.00 42.24 H new ATOM 0 HE3 LYS A 19 -1.736 -10.936 -3.572 1.00 42.24 H new ATOM 0 HZ1 LYS A 19 -2.640 -11.029 -5.842 1.00 5.45 H new ATOM 0 HZ2 LYS A 19 -2.603 -12.556 -5.099 1.00 5.45 H new ATOM 0 HZ3 LYS A 19 -4.072 -11.716 -5.243 1.00 5.45 H new ATOM 339 N LYS A 20 -4.568 -12.777 2.771 1.00 4.24 N ATOM 340 CA LYS A 20 -5.330 -13.629 3.706 1.00 34.42 C ATOM 341 C LYS A 20 -5.705 -12.857 4.988 1.00 63.51 C ATOM 342 O LYS A 20 -6.864 -12.885 5.415 1.00 73.44 O ATOM 343 CB LYS A 20 -4.527 -14.914 4.061 1.00 73.20 C ATOM 344 CG LYS A 20 -4.115 -15.833 2.875 1.00 24.44 C ATOM 345 CD LYS A 20 -5.306 -16.386 2.024 1.00 22.34 C ATOM 346 CE LYS A 20 -5.703 -15.487 0.834 1.00 12.40 C ATOM 347 NZ LYS A 20 -6.934 -15.970 0.143 1.00 23.23 N ATOM 0 H LYS A 20 -3.626 -13.120 2.584 1.00 4.24 H new ATOM 0 HA LYS A 20 -6.253 -13.924 3.207 1.00 34.42 H new ATOM 0 HB2 LYS A 20 -3.622 -14.614 4.589 1.00 73.20 H new ATOM 0 HB3 LYS A 20 -5.122 -15.505 4.758 1.00 73.20 H new ATOM 0 HG2 LYS A 20 -3.446 -15.276 2.218 1.00 24.44 H new ATOM 0 HG3 LYS A 20 -3.547 -16.676 3.268 1.00 24.44 H new ATOM 0 HD2 LYS A 20 -5.041 -17.373 1.646 1.00 22.34 H new ATOM 0 HD3 LYS A 20 -6.172 -16.515 2.673 1.00 22.34 H new ATOM 0 HE2 LYS A 20 -5.864 -14.469 1.189 1.00 12.40 H new ATOM 0 HE3 LYS A 20 -4.880 -15.449 0.120 1.00 12.40 H new ATOM 0 HZ1 LYS A 20 -6.676 -16.388 -0.774 1.00 23.23 H new ATOM 0 HZ2 LYS A 20 -7.403 -16.688 0.731 1.00 23.23 H new ATOM 0 HZ3 LYS A 20 -7.582 -15.171 -0.011 1.00 23.23 H new ATOM 361 N GLU A 21 -4.713 -12.139 5.556 1.00 70.15 N ATOM 362 CA GLU A 21 -4.891 -11.334 6.786 1.00 54.41 C ATOM 363 C GLU A 21 -5.937 -10.224 6.588 1.00 53.23 C ATOM 364 O GLU A 21 -6.812 -10.026 7.426 1.00 52.33 O ATOM 365 CB GLU A 21 -3.535 -10.720 7.227 1.00 64.52 C ATOM 366 CG GLU A 21 -2.471 -11.758 7.630 1.00 5.42 C ATOM 367 CD GLU A 21 -2.875 -12.582 8.868 1.00 44.51 C ATOM 368 OE1 GLU A 21 -3.538 -13.641 8.723 1.00 31.33 O ATOM 369 OE2 GLU A 21 -2.551 -12.169 9.994 1.00 12.51 O ATOM 0 H GLU A 21 -3.767 -12.100 5.176 1.00 70.15 H new ATOM 0 HA GLU A 21 -5.255 -11.999 7.569 1.00 54.41 H new ATOM 0 HB2 GLU A 21 -3.142 -10.112 6.412 1.00 64.52 H new ATOM 0 HB3 GLU A 21 -3.709 -10.050 8.069 1.00 64.52 H new ATOM 0 HG2 GLU A 21 -2.294 -12.433 6.793 1.00 5.42 H new ATOM 0 HG3 GLU A 21 -1.530 -11.246 7.832 1.00 5.42 H new ATOM 376 N VAL A 22 -5.845 -9.545 5.446 1.00 2.55 N ATOM 377 CA VAL A 22 -6.707 -8.405 5.086 1.00 43.03 C ATOM 378 C VAL A 22 -8.165 -8.862 4.845 1.00 41.33 C ATOM 379 O VAL A 22 -9.114 -8.136 5.173 1.00 1.34 O ATOM 380 CB VAL A 22 -6.109 -7.690 3.821 1.00 43.12 C ATOM 381 CG1 VAL A 22 -6.955 -6.492 3.353 1.00 41.33 C ATOM 382 CG2 VAL A 22 -4.660 -7.249 4.097 1.00 42.34 C ATOM 0 H VAL A 22 -5.158 -9.771 4.727 1.00 2.55 H new ATOM 0 HA VAL A 22 -6.733 -7.696 5.914 1.00 43.03 H new ATOM 0 HB VAL A 22 -6.122 -8.417 3.009 1.00 43.12 H new ATOM 0 HG11 VAL A 22 -6.491 -6.040 2.476 1.00 41.33 H new ATOM 0 HG12 VAL A 22 -7.958 -6.833 3.098 1.00 41.33 H new ATOM 0 HG13 VAL A 22 -7.015 -5.754 4.153 1.00 41.33 H new ATOM 0 HG21 VAL A 22 -4.256 -6.755 3.214 1.00 42.34 H new ATOM 0 HG22 VAL A 22 -4.644 -6.557 4.939 1.00 42.34 H new ATOM 0 HG23 VAL A 22 -4.053 -8.123 4.334 1.00 42.34 H new ATOM 392 N GLU A 23 -8.320 -10.086 4.308 1.00 2.43 N ATOM 393 CA GLU A 23 -9.640 -10.732 4.118 1.00 73.43 C ATOM 394 C GLU A 23 -10.262 -11.102 5.478 1.00 13.12 C ATOM 395 O GLU A 23 -11.479 -10.973 5.662 1.00 52.33 O ATOM 396 CB GLU A 23 -9.504 -11.990 3.212 1.00 54.24 C ATOM 397 CG GLU A 23 -9.207 -11.673 1.731 1.00 41.24 C ATOM 398 CD GLU A 23 -8.833 -12.904 0.890 1.00 32.31 C ATOM 399 OE1 GLU A 23 -9.660 -13.839 0.790 1.00 65.21 O ATOM 400 OE2 GLU A 23 -7.733 -12.937 0.292 1.00 4.13 O ATOM 0 H GLU A 23 -7.537 -10.658 3.992 1.00 2.43 H new ATOM 0 HA GLU A 23 -10.304 -10.024 3.622 1.00 73.43 H new ATOM 0 HB2 GLU A 23 -8.707 -12.622 3.604 1.00 54.24 H new ATOM 0 HB3 GLU A 23 -10.426 -12.568 3.271 1.00 54.24 H new ATOM 0 HG2 GLU A 23 -10.082 -11.197 1.290 1.00 41.24 H new ATOM 0 HG3 GLU A 23 -8.392 -10.951 1.681 1.00 41.24 H new ATOM 407 N ASN A 24 -9.410 -11.538 6.434 1.00 5.12 N ATOM 408 CA ASN A 24 -9.834 -11.855 7.821 1.00 22.51 C ATOM 409 C ASN A 24 -10.364 -10.593 8.519 1.00 41.54 C ATOM 410 O ASN A 24 -11.345 -10.643 9.267 1.00 24.33 O ATOM 411 CB ASN A 24 -8.652 -12.449 8.651 1.00 25.44 C ATOM 412 CG ASN A 24 -8.116 -13.771 8.094 1.00 10.21 C ATOM 413 OD1 ASN A 24 -8.868 -14.586 7.559 1.00 2.24 O ATOM 414 ND2 ASN A 24 -6.813 -13.987 8.206 1.00 13.41 N ATOM 0 H ASN A 24 -8.414 -11.680 6.269 1.00 5.12 H new ATOM 0 HA ASN A 24 -10.628 -12.600 7.762 1.00 22.51 H new ATOM 0 HB2 ASN A 24 -7.840 -11.722 8.683 1.00 25.44 H new ATOM 0 HB3 ASN A 24 -8.982 -12.604 9.678 1.00 25.44 H new ATOM 0 HD21 ASN A 24 -6.406 -14.849 7.843 1.00 13.41 H new ATOM 0 HD22 ASN A 24 -6.217 -13.291 8.655 1.00 13.41 H new ATOM 421 N GLN A 25 -9.699 -9.456 8.231 1.00 13.11 N ATOM 422 CA GLN A 25 -10.032 -8.140 8.809 1.00 22.23 C ATOM 423 C GLN A 25 -11.228 -7.480 8.069 1.00 74.51 C ATOM 424 O GLN A 25 -11.796 -6.498 8.559 1.00 53.03 O ATOM 425 CB GLN A 25 -8.779 -7.220 8.763 1.00 71.13 C ATOM 426 CG GLN A 25 -7.504 -7.770 9.465 1.00 1.34 C ATOM 427 CD GLN A 25 -7.579 -7.894 10.996 1.00 21.24 C ATOM 428 OE1 GLN A 25 -8.633 -8.152 11.589 1.00 55.02 O ATOM 429 NE2 GLN A 25 -6.441 -7.718 11.652 1.00 64.21 N ATOM 0 H GLN A 25 -8.910 -9.426 7.586 1.00 13.11 H new ATOM 0 HA GLN A 25 -10.334 -8.284 9.846 1.00 22.23 H new ATOM 0 HB2 GLN A 25 -8.537 -7.020 7.719 1.00 71.13 H new ATOM 0 HB3 GLN A 25 -9.037 -6.264 9.219 1.00 71.13 H new ATOM 0 HG2 GLN A 25 -7.281 -8.753 9.051 1.00 1.34 H new ATOM 0 HG3 GLN A 25 -6.666 -7.120 9.213 1.00 1.34 H new ATOM 0 HE21 GLN A 25 -5.585 -7.506 11.140 1.00 64.21 H new ATOM 0 HE22 GLN A 25 -6.421 -7.795 12.669 1.00 64.21 H new ATOM 438 N GLY A 26 -11.575 -8.019 6.878 1.00 73.14 N ATOM 439 CA GLY A 26 -12.778 -7.612 6.136 1.00 62.23 C ATOM 440 C GLY A 26 -12.587 -6.368 5.265 1.00 54.11 C ATOM 441 O GLY A 26 -13.539 -5.622 5.022 1.00 73.33 O ATOM 0 H GLY A 26 -11.029 -8.743 6.411 1.00 73.14 H new ATOM 0 HA2 GLY A 26 -13.098 -8.440 5.503 1.00 62.23 H new ATOM 0 HA3 GLY A 26 -13.583 -7.424 6.846 1.00 62.23 H new ATOM 445 N TYR A 27 -11.352 -6.141 4.790 1.00 60.54 N ATOM 446 CA TYR A 27 -11.034 -5.038 3.850 1.00 42.21 C ATOM 447 C TYR A 27 -11.041 -5.575 2.409 1.00 73.22 C ATOM 448 O TYR A 27 -10.886 -6.785 2.186 1.00 73.10 O ATOM 449 CB TYR A 27 -9.640 -4.412 4.157 1.00 60.13 C ATOM 450 CG TYR A 27 -9.492 -3.672 5.498 1.00 74.25 C ATOM 451 CD1 TYR A 27 -9.873 -4.267 6.704 1.00 74.41 C ATOM 452 CD2 TYR A 27 -8.954 -2.381 5.560 1.00 70.54 C ATOM 453 CE1 TYR A 27 -9.731 -3.611 7.906 1.00 4.23 C ATOM 454 CE2 TYR A 27 -8.811 -1.723 6.766 1.00 34.01 C ATOM 455 CZ TYR A 27 -9.202 -2.344 7.931 1.00 10.23 C ATOM 456 OH TYR A 27 -9.060 -1.698 9.131 1.00 55.23 O ATOM 0 H TYR A 27 -10.544 -6.711 5.041 1.00 60.54 H new ATOM 0 HA TYR A 27 -11.791 -4.263 3.969 1.00 42.21 H new ATOM 0 HB2 TYR A 27 -8.896 -5.208 4.124 1.00 60.13 H new ATOM 0 HB3 TYR A 27 -9.397 -3.715 3.355 1.00 60.13 H new ATOM 0 HD1 TYR A 27 -10.288 -5.264 6.693 1.00 74.41 H new ATOM 0 HD2 TYR A 27 -8.645 -1.891 4.649 1.00 70.54 H new ATOM 0 HE1 TYR A 27 -10.034 -4.091 8.825 1.00 4.23 H new ATOM 0 HE2 TYR A 27 -8.395 -0.727 6.795 1.00 34.01 H new ATOM 0 HH TYR A 27 -9.150 -2.344 9.863 1.00 55.23 H new ATOM 466 N GLN A 28 -11.191 -4.659 1.440 1.00 72.31 N ATOM 467 CA GLN A 28 -11.173 -4.986 0.007 1.00 2.21 C ATOM 468 C GLN A 28 -9.708 -5.140 -0.437 1.00 23.41 C ATOM 469 O GLN A 28 -8.944 -4.177 -0.364 1.00 1.33 O ATOM 470 CB GLN A 28 -11.890 -3.877 -0.834 1.00 43.23 C ATOM 471 CG GLN A 28 -13.399 -3.640 -0.523 1.00 62.40 C ATOM 472 CD GLN A 28 -13.660 -2.975 0.838 1.00 35.03 C ATOM 473 OE1 GLN A 28 -13.679 -1.656 0.872 1.00 31.44 O flip ATOM 474 NE2 GLN A 28 -13.840 -3.649 1.850 1.00 15.21 N flip ATOM 0 H GLN A 28 -11.329 -3.666 1.630 1.00 72.31 H new ATOM 0 HA GLN A 28 -11.714 -5.918 -0.160 1.00 2.21 H new ATOM 0 HB2 GLN A 28 -11.358 -2.937 -0.684 1.00 43.23 H new ATOM 0 HB3 GLN A 28 -11.794 -4.133 -1.889 1.00 43.23 H new ATOM 0 HG2 GLN A 28 -13.828 -3.017 -1.308 1.00 62.40 H new ATOM 0 HG3 GLN A 28 -13.920 -4.597 -0.554 1.00 62.40 H new ATOM 0 HE21 GLN A 28 -13.820 -4.667 1.795 1.00 15.21 H new ATOM 0 HE22 GLN A 28 -14.009 -3.190 2.745 1.00 15.21 H new ATOM 483 N VAL A 29 -9.307 -6.361 -0.827 1.00 54.32 N ATOM 484 CA VAL A 29 -7.938 -6.636 -1.286 1.00 13.23 C ATOM 485 C VAL A 29 -7.849 -6.397 -2.802 1.00 21.54 C ATOM 486 O VAL A 29 -8.373 -7.189 -3.590 1.00 22.45 O ATOM 487 CB VAL A 29 -7.476 -8.111 -0.965 1.00 72.20 C ATOM 488 CG1 VAL A 29 -5.970 -8.303 -1.282 1.00 64.35 C ATOM 489 CG2 VAL A 29 -7.811 -8.504 0.492 1.00 23.51 C ATOM 0 H VAL A 29 -9.918 -7.178 -0.833 1.00 54.32 H new ATOM 0 HA VAL A 29 -7.274 -5.959 -0.748 1.00 13.23 H new ATOM 0 HB VAL A 29 -8.036 -8.785 -1.613 1.00 72.20 H new ATOM 0 HG11 VAL A 29 -5.677 -9.328 -1.052 1.00 64.35 H new ATOM 0 HG12 VAL A 29 -5.792 -8.103 -2.339 1.00 64.35 H new ATOM 0 HG13 VAL A 29 -5.380 -7.613 -0.678 1.00 64.35 H new ATOM 0 HG21 VAL A 29 -7.479 -9.525 0.679 1.00 23.51 H new ATOM 0 HG22 VAL A 29 -7.303 -7.826 1.178 1.00 23.51 H new ATOM 0 HG23 VAL A 29 -8.888 -8.438 0.648 1.00 23.51 H new ATOM 499 N ARG A 30 -7.234 -5.278 -3.196 1.00 52.14 N ATOM 500 CA ARG A 30 -6.868 -5.007 -4.595 1.00 62.23 C ATOM 501 C ARG A 30 -5.374 -5.304 -4.746 1.00 35.31 C ATOM 502 O ARG A 30 -4.582 -4.847 -3.920 1.00 50.23 O ATOM 503 CB ARG A 30 -7.165 -3.527 -4.980 1.00 42.14 C ATOM 504 CG ARG A 30 -8.644 -3.072 -4.880 1.00 42.43 C ATOM 505 CD ARG A 30 -9.606 -3.828 -5.823 1.00 50.50 C ATOM 506 NE ARG A 30 -9.929 -5.191 -5.342 1.00 11.34 N ATOM 507 CZ ARG A 30 -10.252 -6.247 -6.117 1.00 1.43 C ATOM 508 NH1 ARG A 30 -10.300 -6.145 -7.443 1.00 44.42 N ATOM 509 NH2 ARG A 30 -10.515 -7.415 -5.547 1.00 4.24 N ATOM 0 H ARG A 30 -6.974 -4.530 -2.553 1.00 52.14 H new ATOM 0 HA ARG A 30 -7.459 -5.636 -5.261 1.00 62.23 H new ATOM 0 HB2 ARG A 30 -6.565 -2.880 -4.340 1.00 42.14 H new ATOM 0 HB3 ARG A 30 -6.826 -3.366 -6.003 1.00 42.14 H new ATOM 0 HG2 ARG A 30 -8.984 -3.203 -3.853 1.00 42.43 H new ATOM 0 HG3 ARG A 30 -8.700 -2.006 -5.101 1.00 42.43 H new ATOM 0 HD2 ARG A 30 -10.528 -3.257 -5.928 1.00 50.50 H new ATOM 0 HD3 ARG A 30 -9.158 -3.894 -6.814 1.00 50.50 H new ATOM 0 HE ARG A 30 -9.905 -5.345 -4.334 1.00 11.34 H new ATOM 0 HH11 ARG A 30 -10.090 -5.255 -7.894 1.00 44.42 H new ATOM 0 HH12 ARG A 30 -10.547 -6.957 -8.008 1.00 44.42 H new ATOM 0 HH21 ARG A 30 -10.472 -7.508 -4.532 1.00 4.24 H new ATOM 0 HH22 ARG A 30 -10.760 -8.220 -6.123 1.00 4.24 H new ATOM 523 N ASP A 31 -4.992 -6.098 -5.759 1.00 54.02 N ATOM 524 CA ASP A 31 -3.577 -6.392 -6.050 1.00 42.51 C ATOM 525 C ASP A 31 -3.245 -5.974 -7.496 1.00 42.34 C ATOM 526 O ASP A 31 -3.814 -6.489 -8.468 1.00 45.34 O ATOM 527 CB ASP A 31 -3.250 -7.890 -5.772 1.00 54.12 C ATOM 528 CG ASP A 31 -4.040 -8.900 -6.629 1.00 4.11 C ATOM 529 OD1 ASP A 31 -5.276 -9.012 -6.445 1.00 52.45 O ATOM 530 OD2 ASP A 31 -3.432 -9.600 -7.467 1.00 53.44 O ATOM 0 H ASP A 31 -5.648 -6.551 -6.395 1.00 54.02 H new ATOM 0 HA ASP A 31 -2.942 -5.809 -5.382 1.00 42.51 H new ATOM 0 HB2 ASP A 31 -2.185 -8.051 -5.938 1.00 54.12 H new ATOM 0 HB3 ASP A 31 -3.444 -8.099 -4.720 1.00 54.12 H new ATOM 535 N VAL A 32 -2.345 -4.990 -7.596 1.00 70.30 N ATOM 536 CA VAL A 32 -1.857 -4.427 -8.843 1.00 31.20 C ATOM 537 C VAL A 32 -0.391 -4.865 -9.031 1.00 64.04 C ATOM 538 O VAL A 32 0.463 -4.592 -8.183 1.00 15.31 O ATOM 539 CB VAL A 32 -1.954 -2.851 -8.791 1.00 5.10 C ATOM 540 CG1 VAL A 32 -1.394 -2.213 -10.072 1.00 42.22 C ATOM 541 CG2 VAL A 32 -3.413 -2.384 -8.512 1.00 12.13 C ATOM 0 H VAL A 32 -1.926 -4.553 -6.775 1.00 70.30 H new ATOM 0 HA VAL A 32 -2.459 -4.781 -9.680 1.00 31.20 H new ATOM 0 HB VAL A 32 -1.336 -2.510 -7.960 1.00 5.10 H new ATOM 0 HG11 VAL A 32 -1.476 -1.128 -10.004 1.00 42.22 H new ATOM 0 HG12 VAL A 32 -0.347 -2.491 -10.189 1.00 42.22 H new ATOM 0 HG13 VAL A 32 -1.962 -2.566 -10.933 1.00 42.22 H new ATOM 0 HG21 VAL A 32 -3.447 -1.295 -8.482 1.00 12.13 H new ATOM 0 HG22 VAL A 32 -4.069 -2.746 -9.304 1.00 12.13 H new ATOM 0 HG23 VAL A 32 -3.746 -2.784 -7.554 1.00 12.13 H new ATOM 551 N ASN A 33 -0.119 -5.562 -10.131 1.00 3.13 N ATOM 552 CA ASN A 33 1.248 -5.983 -10.502 1.00 74.35 C ATOM 553 C ASN A 33 1.789 -5.073 -11.624 1.00 2.33 C ATOM 554 O ASN A 33 3.007 -4.966 -11.813 1.00 11.53 O ATOM 555 CB ASN A 33 1.245 -7.471 -10.953 1.00 35.53 C ATOM 556 CG ASN A 33 0.615 -8.459 -9.945 1.00 72.50 C ATOM 557 OD1 ASN A 33 0.046 -9.483 -10.337 1.00 2.20 O ATOM 558 ND2 ASN A 33 0.714 -8.183 -8.647 1.00 33.31 N ATOM 0 H ASN A 33 -0.834 -5.856 -10.797 1.00 3.13 H new ATOM 0 HA ASN A 33 1.901 -5.890 -9.634 1.00 74.35 H new ATOM 0 HB2 ASN A 33 0.707 -7.547 -11.898 1.00 35.53 H new ATOM 0 HB3 ASN A 33 2.273 -7.778 -11.146 1.00 35.53 H new ATOM 0 HD21 ASN A 33 0.317 -8.822 -7.958 1.00 33.31 H new ATOM 0 HD22 ASN A 33 1.187 -7.333 -8.341 1.00 33.31 H new ATOM 565 N ASP A 34 0.862 -4.389 -12.328 1.00 0.25 N ATOM 566 CA ASP A 34 1.166 -3.544 -13.503 1.00 34.10 C ATOM 567 C ASP A 34 0.136 -2.392 -13.610 1.00 4.43 C ATOM 568 O ASP A 34 -0.994 -2.530 -13.142 1.00 34.23 O ATOM 569 CB ASP A 34 1.171 -4.422 -14.782 1.00 43.52 C ATOM 570 CG ASP A 34 1.523 -3.648 -16.063 1.00 33.54 C ATOM 571 OD1 ASP A 34 2.718 -3.374 -16.299 1.00 53.44 O ATOM 572 OD2 ASP A 34 0.603 -3.298 -16.832 1.00 61.24 O ATOM 0 H ASP A 34 -0.131 -4.408 -12.094 1.00 0.25 H new ATOM 0 HA ASP A 34 2.153 -3.096 -13.390 1.00 34.10 H new ATOM 0 HB2 ASP A 34 1.886 -5.234 -14.651 1.00 43.52 H new ATOM 0 HB3 ASP A 34 0.188 -4.878 -14.902 1.00 43.52 H new ATOM 577 N SER A 35 0.535 -1.267 -14.251 1.00 14.42 N ATOM 578 CA SER A 35 -0.269 -0.016 -14.314 1.00 33.34 C ATOM 579 C SER A 35 -1.588 -0.163 -15.105 1.00 35.31 C ATOM 580 O SER A 35 -2.504 0.664 -14.952 1.00 65.12 O ATOM 581 CB SER A 35 0.589 1.135 -14.898 1.00 70.33 C ATOM 582 OG SER A 35 1.151 0.780 -16.153 1.00 52.11 O ATOM 0 H SER A 35 1.427 -1.199 -14.742 1.00 14.42 H new ATOM 0 HA SER A 35 -0.559 0.218 -13.290 1.00 33.34 H new ATOM 0 HB2 SER A 35 -0.027 2.027 -15.013 1.00 70.33 H new ATOM 0 HB3 SER A 35 1.387 1.386 -14.199 1.00 70.33 H new ATOM 0 HG SER A 35 1.685 1.527 -16.496 1.00 52.11 H new ATOM 588 N ASP A 36 -1.680 -1.227 -15.920 1.00 12.53 N ATOM 589 CA ASP A 36 -2.893 -1.535 -16.709 1.00 65.20 C ATOM 590 C ASP A 36 -4.046 -1.990 -15.781 1.00 0.23 C ATOM 591 O ASP A 36 -5.226 -1.881 -16.129 1.00 1.01 O ATOM 592 CB ASP A 36 -2.570 -2.615 -17.771 1.00 40.43 C ATOM 593 CG ASP A 36 -3.720 -2.844 -18.767 1.00 31.13 C ATOM 594 OD1 ASP A 36 -3.930 -1.976 -19.648 1.00 15.11 O ATOM 595 OD2 ASP A 36 -4.421 -3.876 -18.678 1.00 34.53 O ATOM 0 H ASP A 36 -0.922 -1.897 -16.053 1.00 12.53 H new ATOM 0 HA ASP A 36 -3.220 -0.632 -17.224 1.00 65.20 H new ATOM 0 HB2 ASP A 36 -1.675 -2.321 -18.320 1.00 40.43 H new ATOM 0 HB3 ASP A 36 -2.341 -3.554 -17.268 1.00 40.43 H new ATOM 600 N GLU A 37 -3.667 -2.477 -14.593 1.00 10.43 N ATOM 601 CA GLU A 37 -4.601 -2.919 -13.544 1.00 3.24 C ATOM 602 C GLU A 37 -5.099 -1.737 -12.694 1.00 61.11 C ATOM 603 O GLU A 37 -6.311 -1.617 -12.449 1.00 42.22 O ATOM 604 CB GLU A 37 -3.903 -3.971 -12.656 1.00 23.14 C ATOM 605 CG GLU A 37 -3.438 -5.221 -13.420 1.00 21.40 C ATOM 606 CD GLU A 37 -2.602 -6.166 -12.554 1.00 14.54 C ATOM 607 OE1 GLU A 37 -3.165 -6.821 -11.653 1.00 12.40 O ATOM 608 OE2 GLU A 37 -1.379 -6.253 -12.773 1.00 54.30 O ATOM 0 H GLU A 37 -2.687 -2.578 -14.327 1.00 10.43 H new ATOM 0 HA GLU A 37 -5.476 -3.362 -14.020 1.00 3.24 H new ATOM 0 HB2 GLU A 37 -3.041 -3.510 -12.173 1.00 23.14 H new ATOM 0 HB3 GLU A 37 -4.587 -4.275 -11.864 1.00 23.14 H new ATOM 0 HG2 GLU A 37 -4.309 -5.756 -13.797 1.00 21.40 H new ATOM 0 HG3 GLU A 37 -2.852 -4.915 -14.287 1.00 21.40 H new ATOM 615 N LEU A 38 -4.164 -0.853 -12.259 1.00 34.34 N ATOM 616 CA LEU A 38 -4.494 0.239 -11.304 1.00 15.10 C ATOM 617 C LEU A 38 -5.455 1.251 -11.922 1.00 31.01 C ATOM 618 O LEU A 38 -6.322 1.768 -11.238 1.00 34.43 O ATOM 619 CB LEU A 38 -3.221 0.941 -10.708 1.00 52.21 C ATOM 620 CG LEU A 38 -2.326 1.860 -11.638 1.00 13.33 C ATOM 621 CD1 LEU A 38 -2.825 3.332 -11.711 1.00 31.43 C ATOM 622 CD2 LEU A 38 -0.842 1.826 -11.193 1.00 14.42 C ATOM 0 H LEU A 38 -3.187 -0.873 -12.550 1.00 34.34 H new ATOM 0 HA LEU A 38 -5.001 -0.234 -10.463 1.00 15.10 H new ATOM 0 HB2 LEU A 38 -3.549 1.550 -9.866 1.00 52.21 H new ATOM 0 HB3 LEU A 38 -2.577 0.160 -10.304 1.00 52.21 H new ATOM 0 HG LEU A 38 -2.413 1.443 -12.641 1.00 13.33 H new ATOM 0 HD11 LEU A 38 -2.168 3.907 -12.364 1.00 31.43 H new ATOM 0 HD12 LEU A 38 -3.840 3.353 -12.108 1.00 31.43 H new ATOM 0 HD13 LEU A 38 -2.817 3.769 -10.712 1.00 31.43 H new ATOM 0 HD21 LEU A 38 -0.251 2.465 -11.849 1.00 14.42 H new ATOM 0 HD22 LEU A 38 -0.762 2.185 -10.167 1.00 14.42 H new ATOM 0 HD23 LEU A 38 -0.468 0.804 -11.250 1.00 14.42 H new ATOM 634 N LYS A 39 -5.315 1.496 -13.237 1.00 25.25 N ATOM 635 CA LYS A 39 -6.162 2.470 -13.963 1.00 22.03 C ATOM 636 C LYS A 39 -7.657 2.083 -13.902 1.00 23.15 C ATOM 637 O LYS A 39 -8.523 2.952 -13.944 1.00 73.12 O ATOM 638 CB LYS A 39 -5.697 2.601 -15.439 1.00 11.35 C ATOM 639 CG LYS A 39 -5.808 1.301 -16.265 1.00 41.33 C ATOM 640 CD LYS A 39 -5.388 1.474 -17.743 1.00 61.05 C ATOM 641 CE LYS A 39 -3.941 1.954 -17.903 1.00 3.21 C ATOM 642 NZ LYS A 39 -3.554 2.084 -19.330 1.00 60.13 N ATOM 0 H LYS A 39 -4.621 1.033 -13.824 1.00 25.25 H new ATOM 0 HA LYS A 39 -6.049 3.436 -13.470 1.00 22.03 H new ATOM 0 HB2 LYS A 39 -6.289 3.377 -15.925 1.00 11.35 H new ATOM 0 HB3 LYS A 39 -4.660 2.936 -15.451 1.00 11.35 H new ATOM 0 HG2 LYS A 39 -5.185 0.533 -15.806 1.00 41.33 H new ATOM 0 HG3 LYS A 39 -6.836 0.942 -16.227 1.00 41.33 H new ATOM 0 HD2 LYS A 39 -5.509 0.524 -18.263 1.00 61.05 H new ATOM 0 HD3 LYS A 39 -6.057 2.188 -18.224 1.00 61.05 H new ATOM 0 HE2 LYS A 39 -3.821 2.916 -17.405 1.00 3.21 H new ATOM 0 HE3 LYS A 39 -3.269 1.253 -17.407 1.00 3.21 H new ATOM 0 HZ1 LYS A 39 -2.569 2.411 -19.394 1.00 60.13 H new ATOM 0 HZ2 LYS A 39 -3.644 1.160 -19.800 1.00 60.13 H new ATOM 0 HZ3 LYS A 39 -4.178 2.772 -19.798 1.00 60.13 H new ATOM 656 N LYS A 40 -7.924 0.769 -13.773 1.00 61.23 N ATOM 657 CA LYS A 40 -9.284 0.198 -13.752 1.00 71.04 C ATOM 658 C LYS A 40 -9.907 0.288 -12.342 1.00 44.55 C ATOM 659 O LYS A 40 -11.050 0.737 -12.181 1.00 65.55 O ATOM 660 CB LYS A 40 -9.221 -1.286 -14.202 1.00 14.31 C ATOM 661 CG LYS A 40 -8.557 -1.515 -15.581 1.00 71.04 C ATOM 662 CD LYS A 40 -8.404 -3.015 -15.927 1.00 54.22 C ATOM 663 CE LYS A 40 -9.751 -3.740 -16.061 1.00 22.35 C ATOM 664 NZ LYS A 40 -9.574 -5.191 -16.334 1.00 4.15 N ATOM 0 H LYS A 40 -7.191 0.065 -13.679 1.00 61.23 H new ATOM 0 HA LYS A 40 -9.911 0.771 -14.435 1.00 71.04 H new ATOM 0 HB2 LYS A 40 -8.674 -1.856 -13.451 1.00 14.31 H new ATOM 0 HB3 LYS A 40 -10.234 -1.686 -14.231 1.00 14.31 H new ATOM 0 HG2 LYS A 40 -9.153 -1.027 -16.352 1.00 71.04 H new ATOM 0 HG3 LYS A 40 -7.575 -1.042 -15.590 1.00 71.04 H new ATOM 0 HD2 LYS A 40 -7.851 -3.112 -16.861 1.00 54.22 H new ATOM 0 HD3 LYS A 40 -7.811 -3.502 -15.153 1.00 54.22 H new ATOM 0 HE2 LYS A 40 -10.326 -3.610 -15.144 1.00 22.35 H new ATOM 0 HE3 LYS A 40 -10.329 -3.287 -16.866 1.00 22.35 H new ATOM 0 HZ1 LYS A 40 -10.506 -5.645 -16.418 1.00 4.15 H new ATOM 0 HZ2 LYS A 40 -9.047 -5.315 -17.222 1.00 4.15 H new ATOM 0 HZ3 LYS A 40 -9.045 -5.629 -15.553 1.00 4.15 H new ATOM 678 N GLU A 41 -9.131 -0.142 -11.326 1.00 44.44 N ATOM 679 CA GLU A 41 -9.626 -0.261 -9.937 1.00 22.10 C ATOM 680 C GLU A 41 -9.625 1.104 -9.215 1.00 71.32 C ATOM 681 O GLU A 41 -10.410 1.303 -8.289 1.00 30.30 O ATOM 682 CB GLU A 41 -8.847 -1.378 -9.164 1.00 13.44 C ATOM 683 CG GLU A 41 -7.307 -1.229 -9.053 1.00 71.44 C ATOM 684 CD GLU A 41 -6.842 -0.237 -7.968 1.00 33.41 C ATOM 685 OE1 GLU A 41 -7.176 -0.461 -6.786 1.00 14.30 O ATOM 686 OE2 GLU A 41 -6.143 0.744 -8.291 1.00 51.15 O ATOM 0 H GLU A 41 -8.155 -0.414 -11.441 1.00 44.44 H new ATOM 0 HA GLU A 41 -10.669 -0.576 -9.965 1.00 22.10 H new ATOM 0 HB2 GLU A 41 -9.253 -1.435 -8.154 1.00 13.44 H new ATOM 0 HB3 GLU A 41 -9.059 -2.332 -9.647 1.00 13.44 H new ATOM 0 HG2 GLU A 41 -6.873 -2.207 -8.845 1.00 71.44 H new ATOM 0 HG3 GLU A 41 -6.915 -0.905 -10.017 1.00 71.44 H new ATOM 693 N MET A 42 -8.760 2.043 -9.669 1.00 23.11 N ATOM 694 CA MET A 42 -8.760 3.456 -9.195 1.00 42.25 C ATOM 695 C MET A 42 -10.078 4.171 -9.544 1.00 3.30 C ATOM 696 O MET A 42 -10.536 5.039 -8.779 1.00 14.35 O ATOM 697 CB MET A 42 -7.537 4.253 -9.759 1.00 21.25 C ATOM 698 CG MET A 42 -6.256 4.075 -8.940 1.00 44.31 C ATOM 699 SD MET A 42 -6.445 4.753 -7.274 1.00 12.13 S ATOM 700 CE MET A 42 -5.282 3.755 -6.352 1.00 51.45 C ATOM 0 H MET A 42 -8.045 1.848 -10.370 1.00 23.11 H new ATOM 0 HA MET A 42 -8.670 3.425 -8.109 1.00 42.25 H new ATOM 0 HB2 MET A 42 -7.349 3.935 -10.785 1.00 21.25 H new ATOM 0 HB3 MET A 42 -7.790 5.313 -9.795 1.00 21.25 H new ATOM 0 HG2 MET A 42 -6.005 3.016 -8.878 1.00 44.31 H new ATOM 0 HG3 MET A 42 -5.427 4.570 -9.445 1.00 44.31 H new ATOM 0 HE1 MET A 42 -5.760 3.384 -5.445 1.00 51.45 H new ATOM 0 HE2 MET A 42 -4.960 2.912 -6.964 1.00 51.45 H new ATOM 0 HE3 MET A 42 -4.416 4.360 -6.084 1.00 51.45 H new ATOM 710 N LYS A 43 -10.671 3.809 -10.704 1.00 1.12 N ATOM 711 CA LYS A 43 -12.024 4.265 -11.093 1.00 1.51 C ATOM 712 C LYS A 43 -13.023 3.829 -10.009 1.00 53.23 C ATOM 713 O LYS A 43 -13.753 4.646 -9.467 1.00 15.44 O ATOM 714 CB LYS A 43 -12.450 3.659 -12.463 1.00 63.43 C ATOM 715 CG LYS A 43 -11.522 3.993 -13.648 1.00 11.30 C ATOM 716 CD LYS A 43 -11.926 3.241 -14.947 1.00 14.22 C ATOM 717 CE LYS A 43 -10.962 3.507 -16.113 1.00 11.14 C ATOM 718 NZ LYS A 43 -10.911 4.944 -16.491 1.00 53.53 N ATOM 0 H LYS A 43 -10.230 3.198 -11.391 1.00 1.12 H new ATOM 0 HA LYS A 43 -12.014 5.351 -11.191 1.00 1.51 H new ATOM 0 HB2 LYS A 43 -12.506 2.575 -12.361 1.00 63.43 H new ATOM 0 HB3 LYS A 43 -13.455 4.009 -12.700 1.00 63.43 H new ATOM 0 HG2 LYS A 43 -11.544 5.067 -13.832 1.00 11.30 H new ATOM 0 HG3 LYS A 43 -10.496 3.735 -13.386 1.00 11.30 H new ATOM 0 HD2 LYS A 43 -11.959 2.170 -14.746 1.00 14.22 H new ATOM 0 HD3 LYS A 43 -12.932 3.542 -15.238 1.00 14.22 H new ATOM 0 HE2 LYS A 43 -9.962 3.171 -15.838 1.00 11.14 H new ATOM 0 HE3 LYS A 43 -11.270 2.918 -16.977 1.00 11.14 H new ATOM 0 HZ1 LYS A 43 -10.300 5.062 -17.324 1.00 53.53 H new ATOM 0 HZ2 LYS A 43 -11.870 5.278 -16.715 1.00 53.53 H new ATOM 0 HZ3 LYS A 43 -10.527 5.498 -15.699 1.00 53.53 H new ATOM 732 N LYS A 44 -12.956 2.528 -9.662 1.00 73.30 N ATOM 733 CA LYS A 44 -13.858 1.883 -8.684 1.00 54.21 C ATOM 734 C LYS A 44 -13.702 2.471 -7.271 1.00 14.24 C ATOM 735 O LYS A 44 -14.679 2.555 -6.530 1.00 4.04 O ATOM 736 CB LYS A 44 -13.610 0.347 -8.659 1.00 73.51 C ATOM 737 CG LYS A 44 -13.933 -0.373 -9.987 1.00 33.24 C ATOM 738 CD LYS A 44 -15.421 -0.257 -10.396 1.00 61.12 C ATOM 739 CE LYS A 44 -16.388 -0.859 -9.357 1.00 2.40 C ATOM 740 NZ LYS A 44 -17.808 -0.733 -9.785 1.00 20.23 N ATOM 0 H LYS A 44 -12.267 1.888 -10.057 1.00 73.30 H new ATOM 0 HA LYS A 44 -14.881 2.081 -9.005 1.00 54.21 H new ATOM 0 HB2 LYS A 44 -12.566 0.164 -8.405 1.00 73.51 H new ATOM 0 HB3 LYS A 44 -14.213 -0.093 -7.865 1.00 73.51 H new ATOM 0 HG2 LYS A 44 -13.311 0.044 -10.779 1.00 33.24 H new ATOM 0 HG3 LYS A 44 -13.669 -1.427 -9.895 1.00 33.24 H new ATOM 0 HD2 LYS A 44 -15.668 0.794 -10.546 1.00 61.12 H new ATOM 0 HD3 LYS A 44 -15.568 -0.759 -11.352 1.00 61.12 H new ATOM 0 HE2 LYS A 44 -16.147 -1.911 -9.203 1.00 2.40 H new ATOM 0 HE3 LYS A 44 -16.251 -0.357 -8.399 1.00 2.40 H new ATOM 0 HZ1 LYS A 44 -18.427 -1.149 -9.060 1.00 20.23 H new ATOM 0 HZ2 LYS A 44 -18.046 0.272 -9.908 1.00 20.23 H new ATOM 0 HZ3 LYS A 44 -17.945 -1.234 -10.686 1.00 20.23 H new ATOM 754 N LEU A 45 -12.470 2.867 -6.917 1.00 34.41 N ATOM 755 CA LEU A 45 -12.170 3.504 -5.617 1.00 71.40 C ATOM 756 C LEU A 45 -12.865 4.869 -5.497 1.00 25.30 C ATOM 757 O LEU A 45 -13.342 5.229 -4.421 1.00 23.35 O ATOM 758 CB LEU A 45 -10.634 3.644 -5.425 1.00 63.23 C ATOM 759 CG LEU A 45 -9.862 2.300 -5.247 1.00 10.44 C ATOM 760 CD1 LEU A 45 -8.344 2.527 -5.136 1.00 3.23 C ATOM 761 CD2 LEU A 45 -10.408 1.513 -4.039 1.00 54.33 C ATOM 0 H LEU A 45 -11.654 2.757 -7.518 1.00 34.41 H new ATOM 0 HA LEU A 45 -12.559 2.864 -4.825 1.00 71.40 H new ATOM 0 HB2 LEU A 45 -10.223 4.170 -6.287 1.00 63.23 H new ATOM 0 HB3 LEU A 45 -10.449 4.270 -4.552 1.00 63.23 H new ATOM 0 HG LEU A 45 -10.028 1.699 -6.141 1.00 10.44 H new ATOM 0 HD11 LEU A 45 -7.841 1.568 -5.013 1.00 3.23 H new ATOM 0 HD12 LEU A 45 -7.982 3.013 -6.042 1.00 3.23 H new ATOM 0 HD13 LEU A 45 -8.133 3.161 -4.275 1.00 3.23 H new ATOM 0 HD21 LEU A 45 -9.856 0.579 -3.933 1.00 54.33 H new ATOM 0 HD22 LEU A 45 -10.291 2.109 -3.134 1.00 54.33 H new ATOM 0 HD23 LEU A 45 -11.464 1.294 -4.195 1.00 54.33 H new ATOM 773 N ALA A 46 -12.931 5.594 -6.625 1.00 0.21 N ATOM 774 CA ALA A 46 -13.549 6.928 -6.701 1.00 71.10 C ATOM 775 C ALA A 46 -15.087 6.829 -6.816 1.00 13.31 C ATOM 776 O ALA A 46 -15.806 7.614 -6.191 1.00 4.32 O ATOM 777 CB ALA A 46 -12.955 7.700 -7.889 1.00 44.05 C ATOM 0 H ALA A 46 -12.555 5.269 -7.516 1.00 0.21 H new ATOM 0 HA ALA A 46 -13.331 7.469 -5.780 1.00 71.10 H new ATOM 0 HB1 ALA A 46 -13.412 8.688 -7.946 1.00 44.05 H new ATOM 0 HB2 ALA A 46 -11.879 7.805 -7.753 1.00 44.05 H new ATOM 0 HB3 ALA A 46 -13.152 7.155 -8.812 1.00 44.05 H new ATOM 783 N GLU A 47 -15.571 5.846 -7.611 1.00 75.30 N ATOM 784 CA GLU A 47 -17.015 5.624 -7.860 1.00 1.25 C ATOM 785 C GLU A 47 -17.710 5.181 -6.571 1.00 54.45 C ATOM 786 O GLU A 47 -18.667 5.818 -6.113 1.00 22.44 O ATOM 787 CB GLU A 47 -17.235 4.545 -8.971 1.00 41.52 C ATOM 788 CG GLU A 47 -16.743 4.943 -10.376 1.00 34.11 C ATOM 789 CD GLU A 47 -17.436 6.196 -10.925 1.00 71.10 C ATOM 790 OE1 GLU A 47 -18.580 6.088 -11.417 1.00 1.43 O ATOM 791 OE2 GLU A 47 -16.841 7.295 -10.870 1.00 25.43 O ATOM 0 H GLU A 47 -14.969 5.183 -8.099 1.00 75.30 H new ATOM 0 HA GLU A 47 -17.446 6.566 -8.201 1.00 1.25 H new ATOM 0 HB2 GLU A 47 -16.727 3.629 -8.671 1.00 41.52 H new ATOM 0 HB3 GLU A 47 -18.299 4.316 -9.027 1.00 41.52 H new ATOM 0 HG2 GLU A 47 -15.667 5.116 -10.342 1.00 34.11 H new ATOM 0 HG3 GLU A 47 -16.911 4.113 -11.062 1.00 34.11 H new ATOM 798 N GLU A 48 -17.189 4.096 -5.982 1.00 33.25 N ATOM 799 CA GLU A 48 -17.640 3.596 -4.688 1.00 4.42 C ATOM 800 C GLU A 48 -17.107 4.549 -3.615 1.00 3.21 C ATOM 801 O GLU A 48 -15.995 4.388 -3.122 1.00 41.14 O ATOM 802 CB GLU A 48 -17.154 2.135 -4.454 1.00 60.43 C ATOM 803 CG GLU A 48 -17.509 1.136 -5.573 1.00 61.51 C ATOM 804 CD GLU A 48 -19.005 1.137 -5.927 1.00 53.33 C ATOM 805 OE1 GLU A 48 -19.824 0.729 -5.072 1.00 64.20 O ATOM 806 OE2 GLU A 48 -19.368 1.529 -7.058 1.00 55.31 O ATOM 0 H GLU A 48 -16.440 3.542 -6.397 1.00 33.25 H new ATOM 0 HA GLU A 48 -18.729 3.565 -4.648 1.00 4.42 H new ATOM 0 HB2 GLU A 48 -16.071 2.145 -4.329 1.00 60.43 H new ATOM 0 HB3 GLU A 48 -17.580 1.773 -3.518 1.00 60.43 H new ATOM 0 HG2 GLU A 48 -16.930 1.377 -6.465 1.00 61.51 H new ATOM 0 HG3 GLU A 48 -17.215 0.133 -5.264 1.00 61.51 H new ATOM 813 N LYS A 49 -17.877 5.605 -3.359 1.00 64.24 N ATOM 814 CA LYS A 49 -17.494 6.692 -2.461 1.00 15.13 C ATOM 815 C LYS A 49 -17.802 6.273 -1.012 1.00 3.11 C ATOM 816 O LYS A 49 -16.890 6.116 -0.184 1.00 50.32 O ATOM 817 CB LYS A 49 -18.273 7.971 -2.876 1.00 32.04 C ATOM 818 CG LYS A 49 -17.826 9.274 -2.188 1.00 20.23 C ATOM 819 CD LYS A 49 -16.377 9.671 -2.544 1.00 1.31 C ATOM 820 CE LYS A 49 -15.965 11.003 -1.904 1.00 71.43 C ATOM 821 NZ LYS A 49 -16.048 10.966 -0.421 1.00 33.04 N ATOM 0 H LYS A 49 -18.799 5.731 -3.776 1.00 64.24 H new ATOM 0 HA LYS A 49 -16.427 6.906 -2.527 1.00 15.13 H new ATOM 0 HB2 LYS A 49 -18.178 8.099 -3.954 1.00 32.04 H new ATOM 0 HB3 LYS A 49 -19.331 7.815 -2.666 1.00 32.04 H new ATOM 0 HG2 LYS A 49 -18.500 10.081 -2.475 1.00 20.23 H new ATOM 0 HG3 LYS A 49 -17.911 9.157 -1.108 1.00 20.23 H new ATOM 0 HD2 LYS A 49 -15.696 8.886 -2.215 1.00 1.31 H new ATOM 0 HD3 LYS A 49 -16.278 9.745 -3.627 1.00 1.31 H new ATOM 0 HE2 LYS A 49 -14.945 11.247 -2.203 1.00 71.43 H new ATOM 0 HE3 LYS A 49 -16.607 11.799 -2.282 1.00 71.43 H new ATOM 0 HZ1 LYS A 49 -15.649 11.843 -0.029 1.00 33.04 H new ATOM 0 HZ2 LYS A 49 -17.043 10.878 -0.131 1.00 33.04 H new ATOM 0 HZ3 LYS A 49 -15.510 10.151 -0.063 1.00 33.04 H new ATOM 835 N ASN A 50 -19.103 6.037 -0.756 1.00 61.31 N ATOM 836 CA ASN A 50 -19.625 5.655 0.566 1.00 22.11 C ATOM 837 C ASN A 50 -19.541 4.125 0.751 1.00 1.23 C ATOM 838 O ASN A 50 -20.409 3.390 0.263 1.00 30.01 O ATOM 839 CB ASN A 50 -21.091 6.164 0.719 1.00 54.42 C ATOM 840 CG ASN A 50 -21.780 5.730 2.027 1.00 64.13 C ATOM 841 OD1 ASN A 50 -21.690 6.402 3.050 1.00 43.13 O ATOM 842 ND2 ASN A 50 -22.487 4.612 1.992 1.00 41.04 N ATOM 0 H ASN A 50 -19.827 6.108 -1.471 1.00 61.31 H new ATOM 0 HA ASN A 50 -19.018 6.118 1.344 1.00 22.11 H new ATOM 0 HB2 ASN A 50 -21.093 7.253 0.665 1.00 54.42 H new ATOM 0 HB3 ASN A 50 -21.679 5.802 -0.125 1.00 54.42 H new ATOM 0 HD21 ASN A 50 -22.974 4.290 2.829 1.00 41.04 H new ATOM 0 HD22 ASN A 50 -22.545 4.072 1.128 1.00 41.04 H new ATOM 849 N PHE A 51 -18.443 3.677 1.385 1.00 24.51 N ATOM 850 CA PHE A 51 -18.280 2.312 1.937 1.00 62.14 C ATOM 851 C PHE A 51 -16.972 2.258 2.742 1.00 33.01 C ATOM 852 O PHE A 51 -16.263 3.272 2.844 1.00 61.02 O ATOM 853 CB PHE A 51 -18.344 1.188 0.837 1.00 15.25 C ATOM 854 CG PHE A 51 -17.144 1.012 -0.105 1.00 14.35 C ATOM 855 CD1 PHE A 51 -16.420 2.097 -0.592 1.00 2.11 C ATOM 856 CD2 PHE A 51 -16.763 -0.270 -0.528 1.00 62.31 C ATOM 857 CE1 PHE A 51 -15.367 1.907 -1.461 1.00 15.43 C ATOM 858 CE2 PHE A 51 -15.708 -0.450 -1.395 1.00 72.44 C ATOM 859 CZ PHE A 51 -15.008 0.638 -1.859 1.00 64.24 C ATOM 0 H PHE A 51 -17.623 4.265 1.533 1.00 24.51 H new ATOM 0 HA PHE A 51 -19.123 2.105 2.596 1.00 62.14 H new ATOM 0 HB2 PHE A 51 -18.509 0.237 1.344 1.00 15.25 H new ATOM 0 HB3 PHE A 51 -19.223 1.377 0.221 1.00 15.25 H new ATOM 0 HD1 PHE A 51 -16.686 3.098 -0.286 1.00 2.11 H new ATOM 0 HD2 PHE A 51 -17.306 -1.131 -0.168 1.00 62.31 H new ATOM 0 HE1 PHE A 51 -14.819 2.760 -1.833 1.00 15.43 H new ATOM 0 HE2 PHE A 51 -15.431 -1.445 -1.710 1.00 72.44 H new ATOM 0 HZ PHE A 51 -14.177 0.498 -2.535 1.00 64.24 H new ATOM 869 N GLU A 52 -16.660 1.081 3.309 1.00 11.21 N ATOM 870 CA GLU A 52 -15.433 0.863 4.098 1.00 32.14 C ATOM 871 C GLU A 52 -14.160 0.995 3.232 1.00 35.21 C ATOM 872 O GLU A 52 -14.213 0.958 1.993 1.00 51.31 O ATOM 873 CB GLU A 52 -15.444 -0.508 4.834 1.00 1.24 C ATOM 874 CG GLU A 52 -15.575 -1.772 3.952 1.00 72.23 C ATOM 875 CD GLU A 52 -17.027 -2.100 3.564 1.00 23.43 C ATOM 876 OE1 GLU A 52 -17.733 -2.745 4.374 1.00 21.41 O ATOM 877 OE2 GLU A 52 -17.478 -1.703 2.473 1.00 3.14 O ATOM 0 H GLU A 52 -17.250 0.253 3.234 1.00 11.21 H new ATOM 0 HA GLU A 52 -15.415 1.649 4.853 1.00 32.14 H new ATOM 0 HB2 GLU A 52 -14.523 -0.591 5.412 1.00 1.24 H new ATOM 0 HB3 GLU A 52 -16.269 -0.504 5.547 1.00 1.24 H new ATOM 0 HG2 GLU A 52 -14.987 -1.635 3.045 1.00 72.23 H new ATOM 0 HG3 GLU A 52 -15.148 -2.622 4.484 1.00 72.23 H new ATOM 884 N LYS A 53 -13.018 1.124 3.920 1.00 10.02 N ATOM 885 CA LYS A 53 -11.718 1.431 3.306 1.00 52.35 C ATOM 886 C LYS A 53 -11.038 0.174 2.723 1.00 55.03 C ATOM 887 O LYS A 53 -11.360 -0.969 3.087 1.00 12.34 O ATOM 888 CB LYS A 53 -10.831 2.152 4.349 1.00 1.01 C ATOM 889 CG LYS A 53 -10.577 1.357 5.651 1.00 4.23 C ATOM 890 CD LYS A 53 -10.162 2.266 6.826 1.00 61.31 C ATOM 891 CE LYS A 53 -10.191 1.550 8.181 1.00 70.24 C ATOM 892 NZ LYS A 53 -10.063 2.512 9.306 1.00 11.03 N ATOM 0 H LYS A 53 -12.970 1.017 4.933 1.00 10.02 H new ATOM 0 HA LYS A 53 -11.872 2.095 2.455 1.00 52.35 H new ATOM 0 HB2 LYS A 53 -9.870 2.384 3.889 1.00 1.01 H new ATOM 0 HB3 LYS A 53 -11.298 3.102 4.607 1.00 1.01 H new ATOM 0 HG2 LYS A 53 -11.480 0.809 5.921 1.00 4.23 H new ATOM 0 HG3 LYS A 53 -9.796 0.617 5.475 1.00 4.23 H new ATOM 0 HD2 LYS A 53 -9.157 2.647 6.645 1.00 61.31 H new ATOM 0 HD3 LYS A 53 -10.828 3.128 6.863 1.00 61.31 H new ATOM 0 HE2 LYS A 53 -11.123 0.994 8.280 1.00 70.24 H new ATOM 0 HE3 LYS A 53 -9.380 0.823 8.228 1.00 70.24 H new ATOM 0 HZ1 LYS A 53 -9.766 2.005 10.164 1.00 11.03 H new ATOM 0 HZ2 LYS A 53 -9.353 3.234 9.067 1.00 11.03 H new ATOM 0 HZ3 LYS A 53 -10.980 2.972 9.476 1.00 11.03 H new ATOM 906 N ILE A 54 -10.091 0.428 1.800 1.00 23.04 N ATOM 907 CA ILE A 54 -9.513 -0.589 0.898 1.00 25.41 C ATOM 908 C ILE A 54 -7.999 -0.671 1.132 1.00 0.31 C ATOM 909 O ILE A 54 -7.350 0.327 1.483 1.00 34.13 O ATOM 910 CB ILE A 54 -9.793 -0.250 -0.638 1.00 14.45 C ATOM 911 CG1 ILE A 54 -11.323 -0.079 -0.938 1.00 24.44 C ATOM 912 CG2 ILE A 54 -9.166 -1.285 -1.611 1.00 41.20 C ATOM 913 CD1 ILE A 54 -11.888 1.269 -0.544 1.00 53.53 C ATOM 0 H ILE A 54 -9.700 1.359 1.657 1.00 23.04 H new ATOM 0 HA ILE A 54 -9.987 -1.545 1.122 1.00 25.41 H new ATOM 0 HB ILE A 54 -9.301 0.706 -0.816 1.00 14.45 H new ATOM 0 HG12 ILE A 54 -11.492 -0.233 -2.004 1.00 24.44 H new ATOM 0 HG13 ILE A 54 -11.874 -0.859 -0.412 1.00 24.44 H new ATOM 0 HG21 ILE A 54 -9.391 -1.000 -2.639 1.00 41.20 H new ATOM 0 HG22 ILE A 54 -8.086 -1.310 -1.469 1.00 41.20 H new ATOM 0 HG23 ILE A 54 -9.581 -2.272 -1.409 1.00 41.20 H new ATOM 0 HD11 ILE A 54 -12.950 1.303 -0.786 1.00 53.53 H new ATOM 0 HD12 ILE A 54 -11.754 1.420 0.527 1.00 53.53 H new ATOM 0 HD13 ILE A 54 -11.367 2.056 -1.089 1.00 53.53 H new ATOM 925 N LEU A 55 -7.454 -1.870 0.929 1.00 55.00 N ATOM 926 CA LEU A 55 -6.023 -2.134 0.988 1.00 51.42 C ATOM 927 C LEU A 55 -5.525 -2.501 -0.418 1.00 13.42 C ATOM 928 O LEU A 55 -6.042 -3.433 -1.049 1.00 24.50 O ATOM 929 CB LEU A 55 -5.753 -3.257 2.019 1.00 11.31 C ATOM 930 CG LEU A 55 -4.241 -3.626 2.271 1.00 44.11 C ATOM 931 CD1 LEU A 55 -3.951 -3.825 3.778 1.00 73.21 C ATOM 932 CD2 LEU A 55 -3.793 -4.860 1.444 1.00 14.04 C ATOM 0 H LEU A 55 -8.009 -2.699 0.715 1.00 55.00 H new ATOM 0 HA LEU A 55 -5.476 -1.250 1.315 1.00 51.42 H new ATOM 0 HB2 LEU A 55 -6.196 -2.962 2.970 1.00 11.31 H new ATOM 0 HB3 LEU A 55 -6.274 -4.156 1.690 1.00 11.31 H new ATOM 0 HG LEU A 55 -3.648 -2.779 1.926 1.00 44.11 H new ATOM 0 HD11 LEU A 55 -2.900 -4.078 3.916 1.00 73.21 H new ATOM 0 HD12 LEU A 55 -4.176 -2.904 4.317 1.00 73.21 H new ATOM 0 HD13 LEU A 55 -4.573 -4.633 4.165 1.00 73.21 H new ATOM 0 HD21 LEU A 55 -2.745 -5.076 1.651 1.00 14.04 H new ATOM 0 HD22 LEU A 55 -4.402 -5.722 1.718 1.00 14.04 H new ATOM 0 HD23 LEU A 55 -3.917 -4.651 0.382 1.00 14.04 H new ATOM 944 N ILE A 56 -4.542 -1.733 -0.900 1.00 12.23 N ATOM 945 CA ILE A 56 -3.869 -1.961 -2.186 1.00 42.52 C ATOM 946 C ILE A 56 -2.536 -2.690 -1.908 1.00 13.42 C ATOM 947 O ILE A 56 -1.839 -2.354 -0.952 1.00 52.43 O ATOM 948 CB ILE A 56 -3.564 -0.590 -2.932 1.00 34.40 C ATOM 949 CG1 ILE A 56 -4.811 0.362 -2.938 1.00 31.43 C ATOM 950 CG2 ILE A 56 -3.041 -0.834 -4.377 1.00 53.45 C ATOM 951 CD1 ILE A 56 -6.050 -0.185 -3.629 1.00 43.43 C ATOM 0 H ILE A 56 -4.184 -0.920 -0.399 1.00 12.23 H new ATOM 0 HA ILE A 56 -4.520 -2.556 -2.826 1.00 42.52 H new ATOM 0 HB ILE A 56 -2.775 -0.090 -2.370 1.00 34.40 H new ATOM 0 HG12 ILE A 56 -5.068 0.602 -1.906 1.00 31.43 H new ATOM 0 HG13 ILE A 56 -4.530 1.297 -3.422 1.00 31.43 H new ATOM 0 HG21 ILE A 56 -2.842 0.123 -4.859 1.00 53.45 H new ATOM 0 HG22 ILE A 56 -2.121 -1.418 -4.337 1.00 53.45 H new ATOM 0 HG23 ILE A 56 -3.792 -1.379 -4.949 1.00 53.45 H new ATOM 0 HD11 ILE A 56 -6.852 0.552 -3.576 1.00 43.43 H new ATOM 0 HD12 ILE A 56 -5.821 -0.397 -4.673 1.00 43.43 H new ATOM 0 HD13 ILE A 56 -6.367 -1.103 -3.134 1.00 43.43 H new ATOM 963 N ILE A 57 -2.211 -3.701 -2.713 1.00 73.11 N ATOM 964 CA ILE A 57 -0.866 -4.299 -2.768 1.00 14.22 C ATOM 965 C ILE A 57 -0.341 -4.036 -4.177 1.00 41.15 C ATOM 966 O ILE A 57 -0.984 -4.417 -5.146 1.00 43.22 O ATOM 967 CB ILE A 57 -0.867 -5.855 -2.483 1.00 21.10 C ATOM 968 CG1 ILE A 57 -1.495 -6.166 -1.087 1.00 21.22 C ATOM 969 CG2 ILE A 57 0.572 -6.443 -2.594 1.00 14.02 C ATOM 970 CD1 ILE A 57 -1.604 -7.642 -0.743 1.00 12.23 C ATOM 0 H ILE A 57 -2.875 -4.136 -3.353 1.00 73.11 H new ATOM 0 HA ILE A 57 -0.241 -3.854 -1.994 1.00 14.22 H new ATOM 0 HB ILE A 57 -1.484 -6.336 -3.242 1.00 21.10 H new ATOM 0 HG12 ILE A 57 -0.898 -5.673 -0.320 1.00 21.22 H new ATOM 0 HG13 ILE A 57 -2.491 -5.725 -1.048 1.00 21.22 H new ATOM 0 HG21 ILE A 57 0.544 -7.514 -2.394 1.00 14.02 H new ATOM 0 HG22 ILE A 57 0.958 -6.272 -3.599 1.00 14.02 H new ATOM 0 HG23 ILE A 57 1.222 -5.955 -1.867 1.00 14.02 H new ATOM 0 HD11 ILE A 57 -2.052 -7.753 0.245 1.00 12.23 H new ATOM 0 HD12 ILE A 57 -2.228 -8.143 -1.483 1.00 12.23 H new ATOM 0 HD13 ILE A 57 -0.610 -8.090 -0.743 1.00 12.23 H new ATOM 982 N SER A 58 0.804 -3.369 -4.286 1.00 4.15 N ATOM 983 CA SER A 58 1.408 -3.028 -5.569 1.00 20.34 C ATOM 984 C SER A 58 2.867 -3.495 -5.572 1.00 74.13 C ATOM 985 O SER A 58 3.686 -3.033 -4.761 1.00 31.34 O ATOM 986 CB SER A 58 1.302 -1.520 -5.828 1.00 51.54 C ATOM 987 OG SER A 58 1.771 -1.185 -7.120 1.00 13.25 O ATOM 0 H SER A 58 1.342 -3.048 -3.481 1.00 4.15 H new ATOM 0 HA SER A 58 0.875 -3.533 -6.374 1.00 20.34 H new ATOM 0 HB2 SER A 58 0.265 -1.203 -5.722 1.00 51.54 H new ATOM 0 HB3 SER A 58 1.879 -0.979 -5.078 1.00 51.54 H new ATOM 0 HG SER A 58 2.750 -1.148 -7.113 1.00 13.25 H new ATOM 993 N ASN A 59 3.154 -4.436 -6.480 1.00 62.44 N ATOM 994 CA ASN A 59 4.481 -5.045 -6.635 1.00 74.41 C ATOM 995 C ASN A 59 5.503 -3.998 -7.115 1.00 42.32 C ATOM 996 O ASN A 59 6.520 -3.764 -6.456 1.00 32.00 O ATOM 997 CB ASN A 59 4.411 -6.230 -7.647 1.00 72.13 C ATOM 998 CG ASN A 59 3.527 -7.403 -7.193 1.00 33.53 C ATOM 999 OD1 ASN A 59 2.549 -7.231 -6.462 1.00 33.33 O ATOM 1000 ND2 ASN A 59 3.846 -8.605 -7.658 1.00 52.12 N ATOM 0 H ASN A 59 2.463 -4.800 -7.136 1.00 62.44 H new ATOM 0 HA ASN A 59 4.804 -5.425 -5.666 1.00 74.41 H new ATOM 0 HB2 ASN A 59 4.036 -5.856 -8.600 1.00 72.13 H new ATOM 0 HB3 ASN A 59 5.421 -6.600 -7.825 1.00 72.13 H new ATOM 0 HD21 ASN A 59 3.276 -9.415 -7.412 1.00 52.12 H new ATOM 0 HD22 ASN A 59 4.661 -8.719 -8.261 1.00 52.12 H new ATOM 1007 N ASP A 60 5.193 -3.354 -8.250 1.00 42.42 N ATOM 1008 CA ASP A 60 6.111 -2.405 -8.915 1.00 31.25 C ATOM 1009 C ASP A 60 5.983 -1.007 -8.261 1.00 64.24 C ATOM 1010 O ASP A 60 4.891 -0.600 -7.844 1.00 4.12 O ATOM 1011 CB ASP A 60 5.826 -2.367 -10.444 1.00 13.50 C ATOM 1012 CG ASP A 60 6.927 -1.666 -11.268 1.00 31.43 C ATOM 1013 OD1 ASP A 60 7.072 -0.433 -11.172 1.00 34.32 O ATOM 1014 OD2 ASP A 60 7.646 -2.347 -12.029 1.00 23.22 O ATOM 0 H ASP A 60 4.303 -3.473 -8.735 1.00 42.42 H new ATOM 0 HA ASP A 60 7.141 -2.736 -8.786 1.00 31.25 H new ATOM 0 HB2 ASP A 60 5.708 -3.388 -10.807 1.00 13.50 H new ATOM 0 HB3 ASP A 60 4.878 -1.857 -10.614 1.00 13.50 H new ATOM 1019 N LYS A 61 7.116 -0.281 -8.188 1.00 61.13 N ATOM 1020 CA LYS A 61 7.257 0.942 -7.363 1.00 51.30 C ATOM 1021 C LYS A 61 6.845 2.233 -8.096 1.00 33.04 C ATOM 1022 O LYS A 61 6.507 3.230 -7.436 1.00 64.53 O ATOM 1023 CB LYS A 61 8.707 1.040 -6.821 1.00 73.23 C ATOM 1024 CG LYS A 61 9.147 -0.217 -6.032 1.00 55.34 C ATOM 1025 CD LYS A 61 10.545 -0.089 -5.390 1.00 65.01 C ATOM 1026 CE LYS A 61 10.611 1.017 -4.326 1.00 72.12 C ATOM 1027 NZ LYS A 61 11.901 0.998 -3.592 1.00 75.24 N ATOM 0 H LYS A 61 7.964 -0.525 -8.700 1.00 61.13 H new ATOM 0 HA LYS A 61 6.559 0.850 -6.531 1.00 51.30 H new ATOM 0 HB2 LYS A 61 9.391 1.195 -7.656 1.00 73.23 H new ATOM 0 HB3 LYS A 61 8.789 1.914 -6.175 1.00 73.23 H new ATOM 0 HG2 LYS A 61 8.415 -0.419 -5.250 1.00 55.34 H new ATOM 0 HG3 LYS A 61 9.142 -1.076 -6.703 1.00 55.34 H new ATOM 0 HD2 LYS A 61 10.820 -1.041 -4.936 1.00 65.01 H new ATOM 0 HD3 LYS A 61 11.280 0.117 -6.168 1.00 65.01 H new ATOM 0 HE2 LYS A 61 10.478 1.988 -4.802 1.00 72.12 H new ATOM 0 HE3 LYS A 61 9.789 0.893 -3.621 1.00 72.12 H new ATOM 0 HZ1 LYS A 61 11.743 1.285 -2.605 1.00 75.24 H new ATOM 0 HZ2 LYS A 61 12.299 0.037 -3.614 1.00 75.24 H new ATOM 0 HZ3 LYS A 61 12.566 1.658 -4.042 1.00 75.24 H new ATOM 1041 N GLN A 62 6.867 2.216 -9.447 1.00 33.05 N ATOM 1042 CA GLN A 62 6.402 3.366 -10.266 1.00 24.24 C ATOM 1043 C GLN A 62 4.874 3.518 -10.114 1.00 25.55 C ATOM 1044 O GLN A 62 4.326 4.626 -10.224 1.00 0.34 O ATOM 1045 CB GLN A 62 6.786 3.188 -11.773 1.00 35.32 C ATOM 1046 CG GLN A 62 5.894 2.205 -12.577 1.00 44.24 C ATOM 1047 CD GLN A 62 6.422 1.883 -13.975 1.00 3.32 C ATOM 1048 OE1 GLN A 62 6.102 2.574 -14.944 1.00 65.04 O ATOM 1049 NE2 GLN A 62 7.216 0.827 -14.087 1.00 72.53 N ATOM 0 H GLN A 62 7.200 1.423 -9.995 1.00 33.05 H new ATOM 0 HA GLN A 62 6.897 4.269 -9.908 1.00 24.24 H new ATOM 0 HB2 GLN A 62 6.749 4.164 -12.257 1.00 35.32 H new ATOM 0 HB3 GLN A 62 7.819 2.843 -11.829 1.00 35.32 H new ATOM 0 HG2 GLN A 62 5.797 1.276 -12.014 1.00 44.24 H new ATOM 0 HG3 GLN A 62 4.894 2.629 -12.667 1.00 44.24 H new ATOM 0 HE21 GLN A 62 7.458 0.281 -13.260 1.00 72.53 H new ATOM 0 HE22 GLN A 62 7.585 0.561 -15.000 1.00 72.53 H new ATOM 1058 N LEU A 63 4.213 2.369 -9.829 1.00 60.43 N ATOM 1059 CA LEU A 63 2.755 2.278 -9.650 1.00 43.20 C ATOM 1060 C LEU A 63 2.350 3.003 -8.367 1.00 51.31 C ATOM 1061 O LEU A 63 1.358 3.740 -8.348 1.00 14.03 O ATOM 1062 CB LEU A 63 2.299 0.794 -9.562 1.00 13.52 C ATOM 1063 CG LEU A 63 2.860 -0.187 -10.632 1.00 63.43 C ATOM 1064 CD1 LEU A 63 2.236 -1.593 -10.475 1.00 64.21 C ATOM 1065 CD2 LEU A 63 2.696 0.362 -12.058 1.00 43.04 C ATOM 0 H LEU A 63 4.689 1.474 -9.717 1.00 60.43 H new ATOM 0 HA LEU A 63 2.274 2.743 -10.511 1.00 43.20 H new ATOM 0 HB2 LEU A 63 2.574 0.414 -8.578 1.00 13.52 H new ATOM 0 HB3 LEU A 63 1.211 0.771 -9.620 1.00 13.52 H new ATOM 0 HG LEU A 63 3.932 -0.283 -10.461 1.00 63.43 H new ATOM 0 HD11 LEU A 63 2.645 -2.259 -11.235 1.00 64.21 H new ATOM 0 HD12 LEU A 63 2.468 -1.986 -9.485 1.00 64.21 H new ATOM 0 HD13 LEU A 63 1.155 -1.527 -10.595 1.00 64.21 H new ATOM 0 HD21 LEU A 63 3.101 -0.355 -12.773 1.00 43.04 H new ATOM 0 HD22 LEU A 63 1.638 0.524 -12.266 1.00 43.04 H new ATOM 0 HD23 LEU A 63 3.232 1.307 -12.148 1.00 43.04 H new ATOM 1077 N LEU A 64 3.147 2.749 -7.301 1.00 1.44 N ATOM 1078 CA LEU A 64 2.981 3.369 -5.978 1.00 43.32 C ATOM 1079 C LEU A 64 2.942 4.890 -6.109 1.00 13.01 C ATOM 1080 O LEU A 64 1.925 5.495 -5.821 1.00 22.14 O ATOM 1081 CB LEU A 64 4.147 2.964 -5.037 1.00 13.21 C ATOM 1082 CG LEU A 64 4.284 1.447 -4.732 1.00 44.03 C ATOM 1083 CD1 LEU A 64 5.624 1.162 -4.046 1.00 31.40 C ATOM 1084 CD2 LEU A 64 3.096 0.932 -3.888 1.00 62.01 C ATOM 0 H LEU A 64 3.931 2.098 -7.344 1.00 1.44 H new ATOM 0 HA LEU A 64 2.041 3.018 -5.553 1.00 43.32 H new ATOM 0 HB2 LEU A 64 5.081 3.311 -5.479 1.00 13.21 H new ATOM 0 HB3 LEU A 64 4.026 3.494 -4.092 1.00 13.21 H new ATOM 0 HG LEU A 64 4.263 0.905 -5.677 1.00 44.03 H new ATOM 0 HD11 LEU A 64 5.707 0.095 -3.838 1.00 31.40 H new ATOM 0 HD12 LEU A 64 6.440 1.468 -4.700 1.00 31.40 H new ATOM 0 HD13 LEU A 64 5.680 1.719 -3.111 1.00 31.40 H new ATOM 0 HD21 LEU A 64 3.223 -0.133 -3.693 1.00 62.01 H new ATOM 0 HD22 LEU A 64 3.060 1.473 -2.942 1.00 62.01 H new ATOM 0 HD23 LEU A 64 2.166 1.092 -4.433 1.00 62.01 H new ATOM 1096 N LYS A 65 4.041 5.456 -6.652 1.00 30.23 N ATOM 1097 CA LYS A 65 4.256 6.915 -6.778 1.00 41.53 C ATOM 1098 C LYS A 65 3.034 7.627 -7.402 1.00 42.04 C ATOM 1099 O LYS A 65 2.561 8.651 -6.876 1.00 35.41 O ATOM 1100 CB LYS A 65 5.541 7.162 -7.625 1.00 11.23 C ATOM 1101 CG LYS A 65 5.795 8.627 -8.066 1.00 55.35 C ATOM 1102 CD LYS A 65 5.916 9.621 -6.892 1.00 52.25 C ATOM 1103 CE LYS A 65 6.121 11.063 -7.379 1.00 23.11 C ATOM 1104 NZ LYS A 65 6.058 12.040 -6.270 1.00 34.44 N ATOM 0 H LYS A 65 4.816 4.905 -7.021 1.00 30.23 H new ATOM 0 HA LYS A 65 4.385 7.339 -5.782 1.00 41.53 H new ATOM 0 HB2 LYS A 65 6.402 6.823 -7.049 1.00 11.23 H new ATOM 0 HB3 LYS A 65 5.489 6.539 -8.518 1.00 11.23 H new ATOM 0 HG2 LYS A 65 6.710 8.665 -8.657 1.00 55.35 H new ATOM 0 HG3 LYS A 65 4.981 8.946 -8.717 1.00 55.35 H new ATOM 0 HD2 LYS A 65 5.016 9.570 -6.279 1.00 52.25 H new ATOM 0 HD3 LYS A 65 6.752 9.331 -6.256 1.00 52.25 H new ATOM 0 HE2 LYS A 65 7.087 11.143 -7.877 1.00 23.11 H new ATOM 0 HE3 LYS A 65 5.359 11.307 -8.120 1.00 23.11 H new ATOM 0 HZ1 LYS A 65 5.125 12.499 -6.264 1.00 34.44 H new ATOM 0 HZ2 LYS A 65 6.208 11.549 -5.366 1.00 34.44 H new ATOM 0 HZ3 LYS A 65 6.797 12.760 -6.400 1.00 34.44 H new ATOM 1118 N GLU A 66 2.526 7.050 -8.501 1.00 12.30 N ATOM 1119 CA GLU A 66 1.324 7.542 -9.180 1.00 22.25 C ATOM 1120 C GLU A 66 0.071 7.457 -8.279 1.00 0.03 C ATOM 1121 O GLU A 66 -0.594 8.476 -8.036 1.00 74.42 O ATOM 1122 CB GLU A 66 1.114 6.764 -10.504 1.00 22.21 C ATOM 1123 CG GLU A 66 2.263 6.925 -11.525 1.00 25.35 C ATOM 1124 CD GLU A 66 2.527 8.395 -11.911 1.00 43.40 C ATOM 1125 OE1 GLU A 66 1.746 8.954 -12.712 1.00 45.04 O ATOM 1126 OE2 GLU A 66 3.502 9.010 -11.403 1.00 1.44 O ATOM 0 H GLU A 66 2.939 6.229 -8.942 1.00 12.30 H new ATOM 0 HA GLU A 66 1.473 8.598 -9.407 1.00 22.25 H new ATOM 0 HB2 GLU A 66 0.993 5.705 -10.274 1.00 22.21 H new ATOM 0 HB3 GLU A 66 0.185 7.098 -10.965 1.00 22.21 H new ATOM 0 HG2 GLU A 66 3.174 6.496 -11.108 1.00 25.35 H new ATOM 0 HG3 GLU A 66 2.025 6.357 -12.424 1.00 25.35 H new ATOM 1133 N MET A 67 -0.202 6.250 -7.740 1.00 34.22 N ATOM 1134 CA MET A 67 -1.446 5.958 -6.997 1.00 60.43 C ATOM 1135 C MET A 67 -1.547 6.752 -5.680 1.00 41.50 C ATOM 1136 O MET A 67 -2.619 7.247 -5.358 1.00 41.45 O ATOM 1137 CB MET A 67 -1.594 4.436 -6.737 1.00 32.25 C ATOM 1138 CG MET A 67 -1.920 3.609 -7.986 1.00 35.43 C ATOM 1139 SD MET A 67 -2.285 1.881 -7.604 1.00 71.22 S ATOM 1140 CE MET A 67 -0.702 1.278 -7.034 1.00 41.41 C ATOM 0 H MET A 67 0.431 5.453 -7.807 1.00 34.22 H new ATOM 0 HA MET A 67 -2.273 6.284 -7.628 1.00 60.43 H new ATOM 0 HB2 MET A 67 -0.668 4.063 -6.300 1.00 32.25 H new ATOM 0 HB3 MET A 67 -2.380 4.281 -5.998 1.00 32.25 H new ATOM 0 HG2 MET A 67 -2.775 4.052 -8.497 1.00 35.43 H new ATOM 0 HG3 MET A 67 -1.078 3.654 -8.676 1.00 35.43 H new ATOM 0 HE1 MET A 67 -0.363 0.473 -7.686 1.00 41.41 H new ATOM 0 HE2 MET A 67 0.025 2.090 -7.052 1.00 41.41 H new ATOM 0 HE3 MET A 67 -0.801 0.903 -6.015 1.00 41.41 H new ATOM 1150 N LEU A 68 -0.422 6.878 -4.946 1.00 32.50 N ATOM 1151 CA LEU A 68 -0.321 7.684 -3.700 1.00 1.03 C ATOM 1152 C LEU A 68 -0.902 9.108 -3.904 1.00 40.44 C ATOM 1153 O LEU A 68 -1.660 9.617 -3.071 1.00 73.23 O ATOM 1154 CB LEU A 68 1.173 7.790 -3.239 1.00 43.20 C ATOM 1155 CG LEU A 68 1.918 6.453 -2.898 1.00 3.31 C ATOM 1156 CD1 LEU A 68 3.436 6.678 -2.744 1.00 61.31 C ATOM 1157 CD2 LEU A 68 1.343 5.768 -1.648 1.00 34.34 C ATOM 0 H LEU A 68 0.454 6.420 -5.200 1.00 32.50 H new ATOM 0 HA LEU A 68 -0.904 7.178 -2.930 1.00 1.03 H new ATOM 0 HB2 LEU A 68 1.733 8.297 -4.025 1.00 43.20 H new ATOM 0 HB3 LEU A 68 1.209 8.430 -2.358 1.00 43.20 H new ATOM 0 HG LEU A 68 1.754 5.783 -3.742 1.00 3.31 H new ATOM 0 HD11 LEU A 68 3.922 5.731 -2.508 1.00 61.31 H new ATOM 0 HD12 LEU A 68 3.842 7.072 -3.676 1.00 61.31 H new ATOM 0 HD13 LEU A 68 3.618 7.390 -1.939 1.00 61.31 H new ATOM 0 HD21 LEU A 68 1.892 4.847 -1.453 1.00 34.34 H new ATOM 0 HD22 LEU A 68 1.438 6.435 -0.791 1.00 34.34 H new ATOM 0 HD23 LEU A 68 0.291 5.536 -1.812 1.00 34.34 H new ATOM 1169 N GLU A 69 -0.553 9.711 -5.057 1.00 52.22 N ATOM 1170 CA GLU A 69 -0.935 11.096 -5.404 1.00 51.14 C ATOM 1171 C GLU A 69 -2.349 11.174 -6.004 1.00 24.11 C ATOM 1172 O GLU A 69 -3.016 12.204 -5.874 1.00 24.20 O ATOM 1173 CB GLU A 69 0.142 11.711 -6.333 1.00 50.11 C ATOM 1174 CG GLU A 69 1.560 11.664 -5.717 1.00 33.33 C ATOM 1175 CD GLU A 69 2.647 12.333 -6.572 1.00 4.43 C ATOM 1176 OE1 GLU A 69 2.827 11.929 -7.737 1.00 54.00 O ATOM 1177 OE2 GLU A 69 3.353 13.242 -6.074 1.00 2.11 O ATOM 0 H GLU A 69 0.004 9.251 -5.777 1.00 52.22 H new ATOM 0 HA GLU A 69 -0.976 11.689 -4.490 1.00 51.14 H new ATOM 0 HB2 GLU A 69 0.145 11.176 -7.283 1.00 50.11 H new ATOM 0 HB3 GLU A 69 -0.121 12.746 -6.551 1.00 50.11 H new ATOM 0 HG2 GLU A 69 1.535 12.147 -4.740 1.00 33.33 H new ATOM 0 HG3 GLU A 69 1.836 10.623 -5.550 1.00 33.33 H new ATOM 1184 N LEU A 70 -2.796 10.072 -6.644 1.00 64.25 N ATOM 1185 CA LEU A 70 -4.185 9.929 -7.138 1.00 33.23 C ATOM 1186 C LEU A 70 -5.177 9.942 -5.956 1.00 14.04 C ATOM 1187 O LEU A 70 -6.121 10.724 -5.932 1.00 53.13 O ATOM 1188 CB LEU A 70 -4.349 8.616 -7.961 1.00 35.34 C ATOM 1189 CG LEU A 70 -3.564 8.546 -9.307 1.00 51.24 C ATOM 1190 CD1 LEU A 70 -3.721 7.156 -9.973 1.00 72.53 C ATOM 1191 CD2 LEU A 70 -3.988 9.689 -10.255 1.00 61.33 C ATOM 0 H LEU A 70 -2.209 9.260 -6.833 1.00 64.25 H new ATOM 0 HA LEU A 70 -4.402 10.773 -7.792 1.00 33.23 H new ATOM 0 HB2 LEU A 70 -4.035 7.779 -7.337 1.00 35.34 H new ATOM 0 HB3 LEU A 70 -5.409 8.475 -8.174 1.00 35.34 H new ATOM 0 HG LEU A 70 -2.505 8.681 -9.089 1.00 51.24 H new ATOM 0 HD11 LEU A 70 -3.163 7.136 -10.909 1.00 72.53 H new ATOM 0 HD12 LEU A 70 -3.335 6.387 -9.304 1.00 72.53 H new ATOM 0 HD13 LEU A 70 -4.775 6.966 -10.174 1.00 72.53 H new ATOM 0 HD21 LEU A 70 -3.426 9.617 -11.186 1.00 61.33 H new ATOM 0 HD22 LEU A 70 -5.054 9.609 -10.468 1.00 61.33 H new ATOM 0 HD23 LEU A 70 -3.784 10.649 -9.781 1.00 61.33 H new ATOM 1203 N ILE A 71 -4.897 9.089 -4.966 1.00 53.23 N ATOM 1204 CA ILE A 71 -5.714 8.908 -3.748 1.00 43.34 C ATOM 1205 C ILE A 71 -5.805 10.222 -2.935 1.00 73.13 C ATOM 1206 O ILE A 71 -6.868 10.559 -2.376 1.00 72.03 O ATOM 1207 CB ILE A 71 -5.092 7.739 -2.892 1.00 31.04 C ATOM 1208 CG1 ILE A 71 -5.122 6.398 -3.703 1.00 64.31 C ATOM 1209 CG2 ILE A 71 -5.787 7.574 -1.525 1.00 13.12 C ATOM 1210 CD1 ILE A 71 -4.225 5.304 -3.151 1.00 54.52 C ATOM 0 H ILE A 71 -4.075 8.486 -4.984 1.00 53.23 H new ATOM 0 HA ILE A 71 -6.734 8.644 -4.028 1.00 43.34 H new ATOM 0 HB ILE A 71 -4.056 8.004 -2.683 1.00 31.04 H new ATOM 0 HG12 ILE A 71 -6.147 6.029 -3.731 1.00 64.31 H new ATOM 0 HG13 ILE A 71 -4.829 6.605 -4.732 1.00 64.31 H new ATOM 0 HG21 ILE A 71 -5.320 6.756 -0.976 1.00 13.12 H new ATOM 0 HG22 ILE A 71 -5.689 8.497 -0.953 1.00 13.12 H new ATOM 0 HG23 ILE A 71 -6.843 7.352 -1.678 1.00 13.12 H new ATOM 0 HD11 ILE A 71 -4.310 4.414 -3.775 1.00 54.52 H new ATOM 0 HD12 ILE A 71 -3.191 5.648 -3.149 1.00 54.52 H new ATOM 0 HD13 ILE A 71 -4.529 5.063 -2.132 1.00 54.52 H new ATOM 1222 N SER A 72 -4.693 10.977 -2.930 1.00 24.42 N ATOM 1223 CA SER A 72 -4.604 12.277 -2.250 1.00 24.11 C ATOM 1224 C SER A 72 -5.595 13.291 -2.873 1.00 72.53 C ATOM 1225 O SER A 72 -6.337 13.969 -2.147 1.00 2.41 O ATOM 1226 CB SER A 72 -3.154 12.814 -2.311 1.00 32.31 C ATOM 1227 OG SER A 72 -2.992 13.991 -1.527 1.00 35.23 O ATOM 0 H SER A 72 -3.830 10.701 -3.399 1.00 24.42 H new ATOM 0 HA SER A 72 -4.878 12.141 -1.204 1.00 24.11 H new ATOM 0 HB2 SER A 72 -2.467 12.045 -1.958 1.00 32.31 H new ATOM 0 HB3 SER A 72 -2.889 13.028 -3.346 1.00 32.31 H new ATOM 0 HG SER A 72 -2.064 14.300 -1.588 1.00 35.23 H new ATOM 1233 N LYS A 73 -5.637 13.352 -4.227 1.00 2.42 N ATOM 1234 CA LYS A 73 -6.523 14.289 -4.963 1.00 31.34 C ATOM 1235 C LYS A 73 -7.960 13.735 -5.101 1.00 63.32 C ATOM 1236 O LYS A 73 -8.867 14.466 -5.500 1.00 13.24 O ATOM 1237 CB LYS A 73 -5.899 14.705 -6.342 1.00 63.21 C ATOM 1238 CG LYS A 73 -5.550 13.563 -7.342 1.00 4.43 C ATOM 1239 CD LYS A 73 -6.752 13.021 -8.168 1.00 54.51 C ATOM 1240 CE LYS A 73 -7.339 14.060 -9.137 1.00 43.32 C ATOM 1241 NZ LYS A 73 -6.389 14.414 -10.219 1.00 31.15 N ATOM 0 H LYS A 73 -5.066 12.762 -4.833 1.00 2.42 H new ATOM 0 HA LYS A 73 -6.605 15.200 -4.370 1.00 31.34 H new ATOM 0 HB2 LYS A 73 -6.594 15.385 -6.835 1.00 63.21 H new ATOM 0 HB3 LYS A 73 -4.988 15.269 -6.143 1.00 63.21 H new ATOM 0 HG2 LYS A 73 -4.788 13.925 -8.032 1.00 4.43 H new ATOM 0 HG3 LYS A 73 -5.109 12.736 -6.786 1.00 4.43 H new ATOM 0 HD2 LYS A 73 -6.431 12.147 -8.734 1.00 54.51 H new ATOM 0 HD3 LYS A 73 -7.534 12.689 -7.485 1.00 54.51 H new ATOM 0 HE2 LYS A 73 -8.257 13.668 -9.575 1.00 43.32 H new ATOM 0 HE3 LYS A 73 -7.609 14.959 -8.583 1.00 43.32 H new ATOM 0 HZ1 LYS A 73 -6.855 15.052 -10.895 1.00 31.15 H new ATOM 0 HZ2 LYS A 73 -5.559 14.889 -9.811 1.00 31.15 H new ATOM 0 HZ3 LYS A 73 -6.085 13.550 -10.711 1.00 31.15 H new ATOM 1255 N LEU A 74 -8.149 12.428 -4.797 1.00 53.24 N ATOM 1256 CA LEU A 74 -9.495 11.841 -4.587 1.00 10.03 C ATOM 1257 C LEU A 74 -10.060 12.370 -3.257 1.00 4.05 C ATOM 1258 O LEU A 74 -11.274 12.535 -3.095 1.00 11.20 O ATOM 1259 CB LEU A 74 -9.455 10.278 -4.555 1.00 64.33 C ATOM 1260 CG LEU A 74 -9.075 9.550 -5.884 1.00 15.34 C ATOM 1261 CD1 LEU A 74 -8.997 8.010 -5.684 1.00 11.45 C ATOM 1262 CD2 LEU A 74 -10.042 9.934 -7.028 1.00 34.31 C ATOM 0 H LEU A 74 -7.386 11.760 -4.692 1.00 53.24 H new ATOM 0 HA LEU A 74 -10.131 12.133 -5.423 1.00 10.03 H new ATOM 0 HB2 LEU A 74 -8.744 9.973 -3.787 1.00 64.33 H new ATOM 0 HB3 LEU A 74 -10.436 9.921 -4.242 1.00 64.33 H new ATOM 0 HG LEU A 74 -8.080 9.886 -6.175 1.00 15.34 H new ATOM 0 HD11 LEU A 74 -8.731 7.534 -6.627 1.00 11.45 H new ATOM 0 HD12 LEU A 74 -8.241 7.778 -4.934 1.00 11.45 H new ATOM 0 HD13 LEU A 74 -9.965 7.637 -5.350 1.00 11.45 H new ATOM 0 HD21 LEU A 74 -9.752 9.412 -7.940 1.00 34.31 H new ATOM 0 HD22 LEU A 74 -11.059 9.651 -6.755 1.00 34.31 H new ATOM 0 HD23 LEU A 74 -9.997 11.010 -7.196 1.00 34.31 H new ATOM 1274 N GLY A 75 -9.144 12.609 -2.307 1.00 60.41 N ATOM 1275 CA GLY A 75 -9.480 13.176 -0.999 1.00 75.04 C ATOM 1276 C GLY A 75 -9.457 12.132 0.102 1.00 62.43 C ATOM 1277 O GLY A 75 -9.901 12.392 1.223 1.00 23.13 O ATOM 0 H GLY A 75 -8.150 12.414 -2.427 1.00 60.41 H new ATOM 0 HA2 GLY A 75 -8.775 13.971 -0.758 1.00 75.04 H new ATOM 0 HA3 GLY A 75 -10.470 13.631 -1.045 1.00 75.04 H new ATOM 1281 N TYR A 76 -8.943 10.935 -0.231 1.00 62.34 N ATOM 1282 CA TYR A 76 -8.778 9.829 0.719 1.00 34.10 C ATOM 1283 C TYR A 76 -7.416 9.943 1.405 1.00 3.42 C ATOM 1284 O TYR A 76 -6.463 10.482 0.813 1.00 51.42 O ATOM 1285 CB TYR A 76 -8.873 8.471 -0.020 1.00 42.20 C ATOM 1286 CG TYR A 76 -10.144 8.247 -0.847 1.00 45.22 C ATOM 1287 CD1 TYR A 76 -11.374 8.758 -0.438 1.00 15.45 C ATOM 1288 CD2 TYR A 76 -10.111 7.504 -2.031 1.00 2.03 C ATOM 1289 CE1 TYR A 76 -12.515 8.548 -1.177 1.00 61.24 C ATOM 1290 CE2 TYR A 76 -11.253 7.290 -2.776 1.00 22.44 C ATOM 1291 CZ TYR A 76 -12.452 7.815 -2.341 1.00 71.34 C ATOM 1292 OH TYR A 76 -13.603 7.592 -3.062 1.00 24.53 O ATOM 0 H TYR A 76 -8.629 10.710 -1.175 1.00 62.34 H new ATOM 0 HA TYR A 76 -9.570 9.882 1.466 1.00 34.10 H new ATOM 0 HB2 TYR A 76 -8.011 8.378 -0.681 1.00 42.20 H new ATOM 0 HB3 TYR A 76 -8.797 7.672 0.717 1.00 42.20 H new ATOM 0 HD1 TYR A 76 -11.433 9.330 0.476 1.00 15.45 H new ATOM 0 HD2 TYR A 76 -9.173 7.089 -2.369 1.00 2.03 H new ATOM 0 HE1 TYR A 76 -13.458 8.957 -0.845 1.00 61.24 H new ATOM 0 HE2 TYR A 76 -11.208 6.717 -3.690 1.00 22.44 H new ATOM 0 HH TYR A 76 -13.462 6.844 -3.680 1.00 24.53 H new ATOM 1302 N LYS A 77 -7.317 9.427 2.642 1.00 52.43 N ATOM 1303 CA LYS A 77 -6.044 9.389 3.359 1.00 14.24 C ATOM 1304 C LYS A 77 -5.143 8.308 2.738 1.00 64.15 C ATOM 1305 O LYS A 77 -5.610 7.215 2.403 1.00 4.22 O ATOM 1306 CB LYS A 77 -6.235 9.129 4.878 1.00 14.14 C ATOM 1307 CG LYS A 77 -4.892 9.149 5.640 1.00 12.35 C ATOM 1308 CD LYS A 77 -4.998 8.864 7.148 1.00 70.23 C ATOM 1309 CE LYS A 77 -3.605 8.888 7.792 1.00 71.34 C ATOM 1310 NZ LYS A 77 -3.653 8.691 9.256 1.00 11.31 N ATOM 0 H LYS A 77 -8.103 9.034 3.159 1.00 52.43 H new ATOM 0 HA LYS A 77 -5.571 10.366 3.262 1.00 14.24 H new ATOM 0 HB2 LYS A 77 -6.900 9.885 5.295 1.00 14.14 H new ATOM 0 HB3 LYS A 77 -6.720 8.164 5.023 1.00 14.14 H new ATOM 0 HG2 LYS A 77 -4.226 8.412 5.192 1.00 12.35 H new ATOM 0 HG3 LYS A 77 -4.427 10.125 5.501 1.00 12.35 H new ATOM 0 HD2 LYS A 77 -5.638 9.608 7.622 1.00 70.23 H new ATOM 0 HD3 LYS A 77 -5.465 7.892 7.310 1.00 70.23 H new ATOM 0 HE2 LYS A 77 -2.988 8.109 7.344 1.00 71.34 H new ATOM 0 HE3 LYS A 77 -3.124 9.841 7.573 1.00 71.34 H new ATOM 0 HZ1 LYS A 77 -2.857 8.090 9.552 1.00 11.31 H new ATOM 0 HZ2 LYS A 77 -3.586 9.613 9.733 1.00 11.31 H new ATOM 0 HZ3 LYS A 77 -4.549 8.231 9.515 1.00 11.31 H new ATOM 1324 N VAL A 78 -3.862 8.645 2.575 1.00 33.13 N ATOM 1325 CA VAL A 78 -2.850 7.767 1.980 1.00 41.43 C ATOM 1326 C VAL A 78 -1.894 7.251 3.073 1.00 61.13 C ATOM 1327 O VAL A 78 -1.435 8.023 3.934 1.00 14.12 O ATOM 1328 CB VAL A 78 -2.018 8.532 0.881 1.00 52.44 C ATOM 1329 CG1 VAL A 78 -1.078 7.580 0.115 1.00 63.11 C ATOM 1330 CG2 VAL A 78 -2.935 9.321 -0.084 1.00 14.41 C ATOM 0 H VAL A 78 -3.491 9.552 2.858 1.00 33.13 H new ATOM 0 HA VAL A 78 -3.363 6.927 1.512 1.00 41.43 H new ATOM 0 HB VAL A 78 -1.392 9.258 1.400 1.00 52.44 H new ATOM 0 HG11 VAL A 78 -0.521 8.143 -0.634 1.00 63.11 H new ATOM 0 HG12 VAL A 78 -0.381 7.117 0.813 1.00 63.11 H new ATOM 0 HG13 VAL A 78 -1.666 6.806 -0.377 1.00 63.11 H new ATOM 0 HG21 VAL A 78 -2.325 9.835 -0.827 1.00 14.41 H new ATOM 0 HG22 VAL A 78 -3.614 8.632 -0.586 1.00 14.41 H new ATOM 0 HG23 VAL A 78 -3.513 10.053 0.480 1.00 14.41 H new ATOM 1340 N PHE A 79 -1.615 5.946 3.024 1.00 24.00 N ATOM 1341 CA PHE A 79 -0.579 5.289 3.831 1.00 13.43 C ATOM 1342 C PHE A 79 0.217 4.368 2.896 1.00 35.20 C ATOM 1343 O PHE A 79 -0.340 3.812 1.941 1.00 51.42 O ATOM 1344 CB PHE A 79 -1.223 4.487 4.998 1.00 60.42 C ATOM 1345 CG PHE A 79 -0.220 3.881 6.001 1.00 44.00 C ATOM 1346 CD1 PHE A 79 0.315 2.603 5.814 1.00 21.21 C ATOM 1347 CD2 PHE A 79 0.183 4.590 7.132 1.00 21.34 C ATOM 1348 CE1 PHE A 79 1.209 2.059 6.719 1.00 23.50 C ATOM 1349 CE2 PHE A 79 1.079 4.045 8.035 1.00 40.21 C ATOM 1350 CZ PHE A 79 1.591 2.781 7.825 1.00 63.51 C ATOM 0 H PHE A 79 -2.113 5.301 2.410 1.00 24.00 H new ATOM 0 HA PHE A 79 0.085 6.027 4.282 1.00 13.43 H new ATOM 0 HB2 PHE A 79 -1.903 5.144 5.539 1.00 60.42 H new ATOM 0 HB3 PHE A 79 -1.825 3.682 4.577 1.00 60.42 H new ATOM 0 HD1 PHE A 79 0.025 2.029 4.946 1.00 21.21 H new ATOM 0 HD2 PHE A 79 -0.210 5.581 7.306 1.00 21.34 H new ATOM 0 HE1 PHE A 79 1.606 1.068 6.557 1.00 23.50 H new ATOM 0 HE2 PHE A 79 1.378 4.610 8.906 1.00 40.21 H new ATOM 0 HZ PHE A 79 2.292 2.359 8.530 1.00 63.51 H new ATOM 1360 N LEU A 80 1.512 4.221 3.165 1.00 44.55 N ATOM 1361 CA LEU A 80 2.402 3.337 2.394 1.00 54.25 C ATOM 1362 C LEU A 80 3.175 2.439 3.382 1.00 10.51 C ATOM 1363 O LEU A 80 3.541 2.877 4.467 1.00 65.23 O ATOM 1364 CB LEU A 80 3.358 4.202 1.506 1.00 32.51 C ATOM 1365 CG LEU A 80 4.354 3.445 0.557 1.00 33.33 C ATOM 1366 CD1 LEU A 80 3.617 2.565 -0.471 1.00 11.34 C ATOM 1367 CD2 LEU A 80 5.316 4.441 -0.142 1.00 11.31 C ATOM 0 H LEU A 80 1.982 4.711 3.926 1.00 44.55 H new ATOM 0 HA LEU A 80 1.832 2.695 1.723 1.00 54.25 H new ATOM 0 HB2 LEU A 80 2.742 4.859 0.891 1.00 32.51 H new ATOM 0 HB3 LEU A 80 3.944 4.841 2.167 1.00 32.51 H new ATOM 0 HG LEU A 80 4.950 2.776 1.178 1.00 33.33 H new ATOM 0 HD11 LEU A 80 4.345 2.060 -1.106 1.00 11.34 H new ATOM 0 HD12 LEU A 80 3.015 1.822 0.052 1.00 11.34 H new ATOM 0 HD13 LEU A 80 2.969 3.189 -1.087 1.00 11.34 H new ATOM 0 HD21 LEU A 80 5.996 3.893 -0.794 1.00 11.31 H new ATOM 0 HD22 LEU A 80 4.738 5.150 -0.734 1.00 11.31 H new ATOM 0 HD23 LEU A 80 5.891 4.981 0.611 1.00 11.31 H new ATOM 1379 N LEU A 81 3.358 1.174 3.015 1.00 31.15 N ATOM 1380 CA LEU A 81 4.159 0.195 3.770 1.00 13.23 C ATOM 1381 C LEU A 81 4.989 -0.568 2.742 1.00 74.55 C ATOM 1382 O LEU A 81 4.439 -1.302 1.926 1.00 61.23 O ATOM 1383 CB LEU A 81 3.237 -0.765 4.594 1.00 44.31 C ATOM 1384 CG LEU A 81 3.915 -2.036 5.224 1.00 4.31 C ATOM 1385 CD1 LEU A 81 5.087 -1.680 6.173 1.00 52.33 C ATOM 1386 CD2 LEU A 81 2.868 -2.935 5.928 1.00 22.34 C ATOM 0 H LEU A 81 2.947 0.785 2.166 1.00 31.15 H new ATOM 0 HA LEU A 81 4.806 0.688 4.495 1.00 13.23 H new ATOM 0 HB2 LEU A 81 2.782 -0.189 5.400 1.00 44.31 H new ATOM 0 HB3 LEU A 81 2.428 -1.099 3.944 1.00 44.31 H new ATOM 0 HG LEU A 81 4.349 -2.602 4.400 1.00 4.31 H new ATOM 0 HD11 LEU A 81 5.517 -2.595 6.579 1.00 52.33 H new ATOM 0 HD12 LEU A 81 5.851 -1.134 5.619 1.00 52.33 H new ATOM 0 HD13 LEU A 81 4.718 -1.059 6.990 1.00 52.33 H new ATOM 0 HD21 LEU A 81 3.365 -3.806 6.355 1.00 22.34 H new ATOM 0 HD22 LEU A 81 2.379 -2.371 6.722 1.00 22.34 H new ATOM 0 HD23 LEU A 81 2.122 -3.261 5.203 1.00 22.34 H new ATOM 1398 N LEU A 82 6.311 -0.382 2.780 1.00 31.21 N ATOM 1399 CA LEU A 82 7.230 -0.919 1.764 1.00 50.45 C ATOM 1400 C LEU A 82 8.257 -1.878 2.389 1.00 64.51 C ATOM 1401 O LEU A 82 8.597 -1.757 3.580 1.00 30.13 O ATOM 1402 CB LEU A 82 7.903 0.254 0.955 1.00 44.02 C ATOM 1403 CG LEU A 82 8.192 1.606 1.711 1.00 2.04 C ATOM 1404 CD1 LEU A 82 9.252 1.480 2.813 1.00 11.24 C ATOM 1405 CD2 LEU A 82 8.575 2.733 0.729 1.00 42.34 C ATOM 0 H LEU A 82 6.779 0.146 3.517 1.00 31.21 H new ATOM 0 HA LEU A 82 6.656 -1.512 1.052 1.00 50.45 H new ATOM 0 HB2 LEU A 82 8.849 -0.115 0.558 1.00 44.02 H new ATOM 0 HB3 LEU A 82 7.264 0.479 0.101 1.00 44.02 H new ATOM 0 HG LEU A 82 7.255 1.866 2.204 1.00 2.04 H new ATOM 0 HD11 LEU A 82 9.398 2.449 3.289 1.00 11.24 H new ATOM 0 HD12 LEU A 82 8.919 0.756 3.557 1.00 11.24 H new ATOM 0 HD13 LEU A 82 10.193 1.145 2.376 1.00 11.24 H new ATOM 0 HD21 LEU A 82 8.767 3.650 1.285 1.00 42.34 H new ATOM 0 HD22 LEU A 82 9.472 2.447 0.179 1.00 42.34 H new ATOM 0 HD23 LEU A 82 7.757 2.898 0.028 1.00 42.34 H new ATOM 1417 N GLN A 83 8.708 -2.845 1.569 1.00 25.43 N ATOM 1418 CA GLN A 83 9.794 -3.761 1.906 1.00 72.13 C ATOM 1419 C GLN A 83 10.568 -4.068 0.614 1.00 4.10 C ATOM 1420 O GLN A 83 10.034 -4.661 -0.339 1.00 21.12 O ATOM 1421 CB GLN A 83 9.280 -5.041 2.659 1.00 21.11 C ATOM 1422 CG GLN A 83 8.503 -6.123 1.857 1.00 63.41 C ATOM 1423 CD GLN A 83 9.372 -7.261 1.279 1.00 3.25 C ATOM 1424 OE1 GLN A 83 9.072 -7.813 0.222 1.00 24.41 O ATOM 1425 NE2 GLN A 83 10.439 -7.648 1.977 1.00 22.24 N ATOM 0 H GLN A 83 8.317 -3.008 0.641 1.00 25.43 H new ATOM 0 HA GLN A 83 10.476 -3.296 2.618 1.00 72.13 H new ATOM 0 HB2 GLN A 83 10.144 -5.525 3.114 1.00 21.11 H new ATOM 0 HB3 GLN A 83 8.636 -4.708 3.473 1.00 21.11 H new ATOM 0 HG2 GLN A 83 7.745 -6.560 2.507 1.00 63.41 H new ATOM 0 HG3 GLN A 83 7.977 -5.636 1.036 1.00 63.41 H new ATOM 0 HE21 GLN A 83 10.674 -7.179 2.852 1.00 22.24 H new ATOM 0 HE22 GLN A 83 11.021 -8.413 1.636 1.00 22.24 H new ATOM 1434 N ASP A 84 11.785 -3.536 0.546 1.00 4.25 N ATOM 1435 CA ASP A 84 12.761 -3.877 -0.491 1.00 54.23 C ATOM 1436 C ASP A 84 13.806 -4.798 0.123 1.00 2.34 C ATOM 1437 O ASP A 84 14.023 -4.780 1.350 1.00 31.13 O ATOM 1438 CB ASP A 84 13.450 -2.605 -1.045 1.00 72.42 C ATOM 1439 CG ASP A 84 12.487 -1.639 -1.738 1.00 32.44 C ATOM 1440 OD1 ASP A 84 12.211 -1.830 -2.942 1.00 70.13 O ATOM 1441 OD2 ASP A 84 12.012 -0.672 -1.094 1.00 11.11 O ATOM 0 H ASP A 84 12.128 -2.848 1.216 1.00 4.25 H new ATOM 0 HA ASP A 84 12.251 -4.370 -1.319 1.00 54.23 H new ATOM 0 HB2 ASP A 84 13.946 -2.085 -0.226 1.00 72.42 H new ATOM 0 HB3 ASP A 84 14.226 -2.901 -1.751 1.00 72.42 H new ATOM 1446 N GLN A 85 14.437 -5.616 -0.728 1.00 34.01 N ATOM 1447 CA GLN A 85 15.617 -6.405 -0.338 1.00 1.35 C ATOM 1448 C GLN A 85 16.823 -5.464 -0.141 1.00 1.54 C ATOM 1449 O GLN A 85 17.695 -5.729 0.682 1.00 20.54 O ATOM 1450 CB GLN A 85 15.915 -7.489 -1.409 1.00 72.13 C ATOM 1451 CG GLN A 85 14.737 -8.464 -1.681 1.00 40.02 C ATOM 1452 CD GLN A 85 14.306 -9.284 -0.450 1.00 74.35 C ATOM 1453 OE1 GLN A 85 15.123 -9.620 0.406 1.00 34.12 O ATOM 1454 NE2 GLN A 85 13.026 -9.618 -0.353 1.00 73.10 N ATOM 0 H GLN A 85 14.150 -5.751 -1.697 1.00 34.01 H new ATOM 0 HA GLN A 85 15.421 -6.916 0.605 1.00 1.35 H new ATOM 0 HB2 GLN A 85 16.185 -6.995 -2.343 1.00 72.13 H new ATOM 0 HB3 GLN A 85 16.783 -8.067 -1.092 1.00 72.13 H new ATOM 0 HG2 GLN A 85 13.882 -7.893 -2.042 1.00 40.02 H new ATOM 0 HG3 GLN A 85 15.023 -9.149 -2.479 1.00 40.02 H new ATOM 0 HE21 GLN A 85 12.367 -9.328 -1.075 1.00 73.10 H new ATOM 0 HE22 GLN A 85 12.701 -10.165 0.444 1.00 73.10 H new ATOM 1463 N ASP A 86 16.836 -4.358 -0.900 1.00 53.12 N ATOM 1464 CA ASP A 86 17.829 -3.282 -0.756 1.00 65.21 C ATOM 1465 C ASP A 86 17.316 -2.253 0.262 1.00 31.30 C ATOM 1466 O ASP A 86 16.410 -1.472 -0.051 1.00 33.12 O ATOM 1467 CB ASP A 86 18.093 -2.605 -2.122 1.00 40.30 C ATOM 1468 CG ASP A 86 18.720 -3.575 -3.125 1.00 24.23 C ATOM 1469 OD1 ASP A 86 17.972 -4.266 -3.852 1.00 32.42 O ATOM 1470 OD2 ASP A 86 19.966 -3.678 -3.169 1.00 13.11 O ATOM 0 H ASP A 86 16.153 -4.184 -1.637 1.00 53.12 H new ATOM 0 HA ASP A 86 18.769 -3.704 -0.400 1.00 65.21 H new ATOM 0 HB2 ASP A 86 17.156 -2.221 -2.525 1.00 40.30 H new ATOM 0 HB3 ASP A 86 18.754 -1.749 -1.982 1.00 40.30 H new ATOM 1475 N GLU A 87 17.898 -2.271 1.479 1.00 45.22 N ATOM 1476 CA GLU A 87 17.496 -1.377 2.590 1.00 34.51 C ATOM 1477 C GLU A 87 17.725 0.116 2.246 1.00 51.31 C ATOM 1478 O GLU A 87 16.990 1.006 2.714 1.00 31.24 O ATOM 1479 CB GLU A 87 18.239 -1.772 3.898 1.00 52.52 C ATOM 1480 CG GLU A 87 17.743 -1.055 5.171 1.00 4.44 C ATOM 1481 CD GLU A 87 16.232 -1.216 5.382 1.00 5.01 C ATOM 1482 OE1 GLU A 87 15.802 -2.277 5.858 1.00 41.13 O ATOM 1483 OE2 GLU A 87 15.466 -0.276 5.076 1.00 1.14 O ATOM 0 H GLU A 87 18.660 -2.905 1.721 1.00 45.22 H new ATOM 0 HA GLU A 87 16.425 -1.504 2.746 1.00 34.51 H new ATOM 0 HB2 GLU A 87 18.141 -2.848 4.043 1.00 52.52 H new ATOM 0 HB3 GLU A 87 19.301 -1.563 3.772 1.00 52.52 H new ATOM 0 HG2 GLU A 87 18.272 -1.451 6.038 1.00 4.44 H new ATOM 0 HG3 GLU A 87 17.987 0.005 5.106 1.00 4.44 H new ATOM 1490 N ASN A 88 18.738 0.352 1.404 1.00 51.33 N ATOM 1491 CA ASN A 88 19.093 1.692 0.901 1.00 41.13 C ATOM 1492 C ASN A 88 17.941 2.352 0.107 1.00 2.41 C ATOM 1493 O ASN A 88 17.897 3.575 0.008 1.00 40.25 O ATOM 1494 CB ASN A 88 20.368 1.618 0.030 1.00 21.25 C ATOM 1495 CG ASN A 88 21.610 1.200 0.826 1.00 13.13 C ATOM 1496 OD1 ASN A 88 21.900 0.015 0.971 1.00 72.24 O ATOM 1497 ND2 ASN A 88 22.336 2.167 1.377 1.00 74.24 N ATOM 0 H ASN A 88 19.343 -0.387 1.047 1.00 51.33 H new ATOM 0 HA ASN A 88 19.283 2.319 1.772 1.00 41.13 H new ATOM 0 HB2 ASN A 88 20.207 0.909 -0.782 1.00 21.25 H new ATOM 0 HB3 ASN A 88 20.546 2.591 -0.428 1.00 21.25 H new ATOM 0 HD21 ASN A 88 23.156 1.933 1.936 1.00 74.24 H new ATOM 0 HD22 ASN A 88 22.073 3.143 1.241 1.00 74.24 H new ATOM 1504 N GLU A 89 17.018 1.543 -0.447 1.00 14.53 N ATOM 1505 CA GLU A 89 15.868 2.062 -1.222 1.00 41.13 C ATOM 1506 C GLU A 89 14.741 2.582 -0.323 1.00 34.11 C ATOM 1507 O GLU A 89 14.124 3.596 -0.658 1.00 15.22 O ATOM 1508 CB GLU A 89 15.301 1.000 -2.196 1.00 53.13 C ATOM 1509 CG GLU A 89 16.206 0.699 -3.399 1.00 21.13 C ATOM 1510 CD GLU A 89 15.492 -0.131 -4.473 1.00 53.11 C ATOM 1511 OE1 GLU A 89 14.525 0.392 -5.090 1.00 10.44 O ATOM 1512 OE2 GLU A 89 15.870 -1.298 -4.695 1.00 74.44 O ATOM 0 H GLU A 89 17.044 0.526 -0.374 1.00 14.53 H new ATOM 0 HA GLU A 89 16.258 2.900 -1.800 1.00 41.13 H new ATOM 0 HB2 GLU A 89 15.128 0.075 -1.646 1.00 53.13 H new ATOM 0 HB3 GLU A 89 14.332 1.340 -2.561 1.00 53.13 H new ATOM 0 HG2 GLU A 89 16.549 1.637 -3.836 1.00 21.13 H new ATOM 0 HG3 GLU A 89 17.092 0.163 -3.059 1.00 21.13 H new ATOM 1519 N LEU A 90 14.467 1.888 0.802 1.00 11.45 N ATOM 1520 CA LEU A 90 13.314 2.219 1.674 1.00 13.22 C ATOM 1521 C LEU A 90 13.455 3.623 2.268 1.00 61.34 C ATOM 1522 O LEU A 90 12.512 4.398 2.249 1.00 31.21 O ATOM 1523 CB LEU A 90 13.110 1.197 2.828 1.00 3.24 C ATOM 1524 CG LEU A 90 12.757 -0.268 2.402 1.00 32.30 C ATOM 1525 CD1 LEU A 90 14.008 -1.086 2.092 1.00 64.15 C ATOM 1526 CD2 LEU A 90 11.897 -0.971 3.459 1.00 41.14 C ATOM 0 H LEU A 90 15.024 1.098 1.129 1.00 11.45 H new ATOM 0 HA LEU A 90 12.436 2.175 1.029 1.00 13.22 H new ATOM 0 HB2 LEU A 90 14.021 1.169 3.426 1.00 3.24 H new ATOM 0 HB3 LEU A 90 12.315 1.566 3.476 1.00 3.24 H new ATOM 0 HG LEU A 90 12.172 -0.197 1.485 1.00 32.30 H new ATOM 0 HD11 LEU A 90 13.719 -2.096 1.801 1.00 64.15 H new ATOM 0 HD12 LEU A 90 14.557 -0.616 1.276 1.00 64.15 H new ATOM 0 HD13 LEU A 90 14.642 -1.131 2.978 1.00 64.15 H new ATOM 0 HD21 LEU A 90 11.672 -1.985 3.129 1.00 41.14 H new ATOM 0 HD22 LEU A 90 12.440 -1.009 4.403 1.00 41.14 H new ATOM 0 HD23 LEU A 90 10.967 -0.419 3.597 1.00 41.14 H new ATOM 1538 N GLU A 91 14.653 3.918 2.783 1.00 51.35 N ATOM 1539 CA GLU A 91 14.983 5.219 3.404 1.00 44.42 C ATOM 1540 C GLU A 91 14.844 6.394 2.406 1.00 30.21 C ATOM 1541 O GLU A 91 14.302 7.452 2.754 1.00 52.13 O ATOM 1542 CB GLU A 91 16.422 5.163 3.990 1.00 61.45 C ATOM 1543 CG GLU A 91 17.486 4.679 2.987 1.00 63.50 C ATOM 1544 CD GLU A 91 18.902 4.597 3.562 1.00 41.33 C ATOM 1545 OE1 GLU A 91 19.262 3.552 4.148 1.00 44.54 O ATOM 1546 OE2 GLU A 91 19.669 5.576 3.423 1.00 2.35 O ATOM 0 H GLU A 91 15.432 3.260 2.784 1.00 51.35 H new ATOM 0 HA GLU A 91 14.268 5.402 4.206 1.00 44.42 H new ATOM 0 HB2 GLU A 91 16.698 6.156 4.346 1.00 61.45 H new ATOM 0 HB3 GLU A 91 16.426 4.501 4.856 1.00 61.45 H new ATOM 0 HG2 GLU A 91 17.199 3.695 2.617 1.00 63.50 H new ATOM 0 HG3 GLU A 91 17.493 5.352 2.130 1.00 63.50 H new ATOM 1553 N GLU A 92 15.310 6.184 1.160 1.00 54.41 N ATOM 1554 CA GLU A 92 15.347 7.237 0.128 1.00 3.25 C ATOM 1555 C GLU A 92 13.957 7.474 -0.483 1.00 1.31 C ATOM 1556 O GLU A 92 13.597 8.614 -0.807 1.00 75.55 O ATOM 1557 CB GLU A 92 16.384 6.874 -0.965 1.00 40.11 C ATOM 1558 CG GLU A 92 17.815 6.706 -0.419 1.00 54.14 C ATOM 1559 CD GLU A 92 18.880 6.526 -1.514 1.00 43.10 C ATOM 1560 OE1 GLU A 92 19.061 5.394 -2.013 1.00 23.32 O ATOM 1561 OE2 GLU A 92 19.548 7.518 -1.876 1.00 31.43 O ATOM 0 H GLU A 92 15.670 5.284 0.842 1.00 54.41 H new ATOM 0 HA GLU A 92 15.653 8.170 0.602 1.00 3.25 H new ATOM 0 HB2 GLU A 92 16.078 5.948 -1.453 1.00 40.11 H new ATOM 0 HB3 GLU A 92 16.383 7.652 -1.729 1.00 40.11 H new ATOM 0 HG2 GLU A 92 18.069 7.579 0.182 1.00 54.14 H new ATOM 0 HG3 GLU A 92 17.841 5.843 0.246 1.00 54.14 H new ATOM 1568 N PHE A 93 13.187 6.392 -0.643 1.00 33.41 N ATOM 1569 CA PHE A 93 11.797 6.471 -1.116 1.00 10.10 C ATOM 1570 C PHE A 93 10.927 7.124 -0.019 1.00 42.44 C ATOM 1571 O PHE A 93 10.106 7.992 -0.318 1.00 24.33 O ATOM 1572 CB PHE A 93 11.280 5.055 -1.525 1.00 40.42 C ATOM 1573 CG PHE A 93 10.007 5.020 -2.400 1.00 4.25 C ATOM 1574 CD1 PHE A 93 9.624 6.103 -3.208 1.00 73.34 C ATOM 1575 CD2 PHE A 93 9.202 3.883 -2.424 1.00 51.22 C ATOM 1576 CE1 PHE A 93 8.478 6.037 -3.993 1.00 5.34 C ATOM 1577 CE2 PHE A 93 8.066 3.821 -3.207 1.00 5.44 C ATOM 1578 CZ PHE A 93 7.702 4.895 -3.991 1.00 63.35 C ATOM 0 H PHE A 93 13.505 5.442 -0.450 1.00 33.41 H new ATOM 0 HA PHE A 93 11.738 7.094 -2.008 1.00 10.10 H new ATOM 0 HB2 PHE A 93 12.078 4.540 -2.060 1.00 40.42 H new ATOM 0 HB3 PHE A 93 11.087 4.485 -0.616 1.00 40.42 H new ATOM 0 HD1 PHE A 93 10.227 6.999 -3.220 1.00 73.34 H new ATOM 0 HD2 PHE A 93 9.472 3.032 -1.817 1.00 51.22 H new ATOM 0 HE1 PHE A 93 8.195 6.880 -4.605 1.00 5.34 H new ATOM 0 HE2 PHE A 93 7.460 2.927 -3.205 1.00 5.44 H new ATOM 0 HZ PHE A 93 6.813 4.843 -4.602 1.00 63.35 H new ATOM 1588 N LYS A 94 11.183 6.753 1.262 1.00 1.00 N ATOM 1589 CA LYS A 94 10.464 7.311 2.433 1.00 40.13 C ATOM 1590 C LYS A 94 10.609 8.824 2.540 1.00 1.02 C ATOM 1591 O LYS A 94 9.608 9.515 2.631 1.00 72.44 O ATOM 1592 CB LYS A 94 10.917 6.670 3.785 1.00 73.24 C ATOM 1593 CG LYS A 94 10.168 5.371 4.144 1.00 4.32 C ATOM 1594 CD LYS A 94 10.214 5.043 5.653 1.00 34.22 C ATOM 1595 CE LYS A 94 9.627 6.162 6.532 1.00 4.02 C ATOM 1596 NZ LYS A 94 9.539 5.767 7.960 1.00 23.45 N ATOM 0 H LYS A 94 11.891 6.062 1.510 1.00 1.00 H new ATOM 0 HA LYS A 94 9.417 7.062 2.258 1.00 40.13 H new ATOM 0 HB2 LYS A 94 11.985 6.460 3.736 1.00 73.24 H new ATOM 0 HB3 LYS A 94 10.771 7.395 4.586 1.00 73.24 H new ATOM 0 HG2 LYS A 94 9.128 5.459 3.829 1.00 4.32 H new ATOM 0 HG3 LYS A 94 10.602 4.542 3.585 1.00 4.32 H new ATOM 0 HD2 LYS A 94 9.664 4.120 5.835 1.00 34.22 H new ATOM 0 HD3 LYS A 94 11.248 4.862 5.948 1.00 34.22 H new ATOM 0 HE2 LYS A 94 10.246 7.055 6.441 1.00 4.02 H new ATOM 0 HE3 LYS A 94 8.634 6.424 6.168 1.00 4.02 H new ATOM 0 HZ1 LYS A 94 9.774 6.583 8.561 1.00 23.45 H new ATOM 0 HZ2 LYS A 94 8.573 5.447 8.173 1.00 23.45 H new ATOM 0 HZ3 LYS A 94 10.209 4.994 8.148 1.00 23.45 H new ATOM 1610 N ARG A 95 11.861 9.326 2.521 1.00 11.10 N ATOM 1611 CA ARG A 95 12.146 10.760 2.760 1.00 34.43 C ATOM 1612 C ARG A 95 11.384 11.669 1.763 1.00 31.12 C ATOM 1613 O ARG A 95 11.057 12.817 2.076 1.00 65.11 O ATOM 1614 CB ARG A 95 13.678 11.042 2.698 1.00 31.52 C ATOM 1615 CG ARG A 95 14.323 10.844 1.309 1.00 74.41 C ATOM 1616 CD ARG A 95 15.858 10.972 1.316 1.00 61.14 C ATOM 1617 NE ARG A 95 16.317 12.303 1.756 1.00 61.13 N ATOM 1618 CZ ARG A 95 17.556 12.797 1.563 1.00 45.34 C ATOM 1619 NH1 ARG A 95 18.484 12.086 0.930 1.00 54.34 N ATOM 1620 NH2 ARG A 95 17.847 14.008 2.015 1.00 1.53 N ATOM 0 H ARG A 95 12.692 8.762 2.343 1.00 11.10 H new ATOM 0 HA ARG A 95 11.791 10.998 3.763 1.00 34.43 H new ATOM 0 HB2 ARG A 95 13.857 12.067 3.022 1.00 31.52 H new ATOM 0 HB3 ARG A 95 14.181 10.390 3.412 1.00 31.52 H new ATOM 0 HG2 ARG A 95 14.051 9.859 0.929 1.00 74.41 H new ATOM 0 HG3 ARG A 95 13.909 11.578 0.618 1.00 74.41 H new ATOM 0 HD2 ARG A 95 16.279 10.211 1.974 1.00 61.14 H new ATOM 0 HD3 ARG A 95 16.239 10.774 0.314 1.00 61.14 H new ATOM 0 HE ARG A 95 15.645 12.895 2.244 1.00 61.13 H new ATOM 0 HH11 ARG A 95 18.263 11.153 0.583 1.00 54.34 H new ATOM 0 HH12 ARG A 95 19.417 12.474 0.792 1.00 54.34 H new ATOM 0 HH21 ARG A 95 17.137 14.555 2.502 1.00 1.53 H new ATOM 0 HH22 ARG A 95 18.781 14.394 1.876 1.00 1.53 H new ATOM 1634 N LYS A 96 11.078 11.110 0.580 1.00 32.20 N ATOM 1635 CA LYS A 96 10.297 11.787 -0.459 1.00 52.11 C ATOM 1636 C LYS A 96 8.791 11.735 -0.136 1.00 51.53 C ATOM 1637 O LYS A 96 8.140 12.775 -0.106 1.00 11.24 O ATOM 1638 CB LYS A 96 10.618 11.152 -1.844 1.00 45.04 C ATOM 1639 CG LYS A 96 12.098 11.323 -2.267 1.00 35.24 C ATOM 1640 CD LYS A 96 12.529 12.815 -2.295 1.00 14.42 C ATOM 1641 CE LYS A 96 14.029 13.013 -2.541 1.00 43.13 C ATOM 1642 NZ LYS A 96 14.465 12.465 -3.847 1.00 33.34 N ATOM 0 H LYS A 96 11.370 10.168 0.320 1.00 32.20 H new ATOM 0 HA LYS A 96 10.575 12.840 -0.493 1.00 52.11 H new ATOM 0 HB2 LYS A 96 10.376 10.090 -1.814 1.00 45.04 H new ATOM 0 HB3 LYS A 96 9.976 11.604 -2.601 1.00 45.04 H new ATOM 0 HG2 LYS A 96 12.738 10.774 -1.576 1.00 35.24 H new ATOM 0 HG3 LYS A 96 12.245 10.885 -3.254 1.00 35.24 H new ATOM 0 HD2 LYS A 96 11.970 13.332 -3.075 1.00 14.42 H new ATOM 0 HD3 LYS A 96 12.260 13.281 -1.347 1.00 14.42 H new ATOM 0 HE2 LYS A 96 14.264 14.077 -2.500 1.00 43.13 H new ATOM 0 HE3 LYS A 96 14.592 12.531 -1.742 1.00 43.13 H new ATOM 0 HZ1 LYS A 96 15.486 12.623 -3.966 1.00 33.34 H new ATOM 0 HZ2 LYS A 96 14.267 11.445 -3.879 1.00 33.34 H new ATOM 0 HZ3 LYS A 96 13.949 12.942 -4.613 1.00 33.34 H new ATOM 1656 N ILE A 97 8.276 10.529 0.172 1.00 24.24 N ATOM 1657 CA ILE A 97 6.829 10.281 0.415 1.00 22.04 C ATOM 1658 C ILE A 97 6.342 11.030 1.688 1.00 11.11 C ATOM 1659 O ILE A 97 5.235 11.592 1.707 1.00 22.11 O ATOM 1660 CB ILE A 97 6.553 8.722 0.510 1.00 61.53 C ATOM 1661 CG1 ILE A 97 7.004 7.993 -0.804 1.00 14.53 C ATOM 1662 CG2 ILE A 97 5.084 8.385 0.833 1.00 22.40 C ATOM 1663 CD1 ILE A 97 6.439 8.561 -2.104 1.00 25.21 C ATOM 0 H ILE A 97 8.850 9.690 0.261 1.00 24.24 H new ATOM 0 HA ILE A 97 6.258 10.675 -0.426 1.00 22.04 H new ATOM 0 HB ILE A 97 7.150 8.358 1.346 1.00 61.53 H new ATOM 0 HG12 ILE A 97 8.092 8.023 -0.859 1.00 14.53 H new ATOM 0 HG13 ILE A 97 6.717 6.944 -0.732 1.00 14.53 H new ATOM 0 HG21 ILE A 97 4.962 7.303 0.884 1.00 22.40 H new ATOM 0 HG22 ILE A 97 4.812 8.827 1.792 1.00 22.40 H new ATOM 0 HG23 ILE A 97 4.438 8.787 0.052 1.00 22.40 H new ATOM 0 HD11 ILE A 97 6.815 7.982 -2.948 1.00 25.21 H new ATOM 0 HD12 ILE A 97 5.351 8.506 -2.083 1.00 25.21 H new ATOM 0 HD13 ILE A 97 6.747 9.601 -2.211 1.00 25.21 H new ATOM 1675 N GLU A 98 7.197 11.035 2.725 1.00 53.25 N ATOM 1676 CA GLU A 98 7.046 11.873 3.936 1.00 50.32 C ATOM 1677 C GLU A 98 6.875 13.366 3.581 1.00 22.52 C ATOM 1678 O GLU A 98 5.966 14.040 4.081 1.00 72.41 O ATOM 1679 CB GLU A 98 8.288 11.694 4.859 1.00 35.13 C ATOM 1680 CG GLU A 98 8.396 10.327 5.556 1.00 72.24 C ATOM 1681 CD GLU A 98 7.233 10.052 6.524 1.00 22.34 C ATOM 1682 OE1 GLU A 98 7.167 10.709 7.592 1.00 10.33 O ATOM 1683 OE2 GLU A 98 6.397 9.175 6.243 1.00 44.33 O ATOM 0 H GLU A 98 8.030 10.447 2.749 1.00 53.25 H new ATOM 0 HA GLU A 98 6.145 11.546 4.456 1.00 50.32 H new ATOM 0 HB2 GLU A 98 9.188 11.853 4.265 1.00 35.13 H new ATOM 0 HB3 GLU A 98 8.269 12.472 5.622 1.00 35.13 H new ATOM 0 HG2 GLU A 98 8.426 9.542 4.801 1.00 72.24 H new ATOM 0 HG3 GLU A 98 9.337 10.278 6.104 1.00 72.24 H new ATOM 1690 N SER A 99 7.757 13.857 2.694 1.00 72.23 N ATOM 1691 CA SER A 99 7.773 15.265 2.255 1.00 61.31 C ATOM 1692 C SER A 99 6.548 15.589 1.359 1.00 33.30 C ATOM 1693 O SER A 99 6.125 16.746 1.273 1.00 3.35 O ATOM 1694 CB SER A 99 9.106 15.561 1.525 1.00 72.02 C ATOM 1695 OG SER A 99 9.215 16.923 1.141 1.00 41.43 O ATOM 0 H SER A 99 8.482 13.287 2.259 1.00 72.23 H new ATOM 0 HA SER A 99 7.702 15.911 3.130 1.00 61.31 H new ATOM 0 HB2 SER A 99 9.941 15.301 2.176 1.00 72.02 H new ATOM 0 HB3 SER A 99 9.182 14.928 0.641 1.00 72.02 H new ATOM 0 HG SER A 99 10.071 17.067 0.685 1.00 41.43 H new ATOM 1701 N GLN A 100 5.964 14.544 0.720 1.00 61.22 N ATOM 1702 CA GLN A 100 4.716 14.673 -0.081 1.00 52.41 C ATOM 1703 C GLN A 100 3.472 14.798 0.827 1.00 64.42 C ATOM 1704 O GLN A 100 2.370 15.074 0.343 1.00 31.53 O ATOM 1705 CB GLN A 100 4.540 13.466 -1.054 1.00 13.23 C ATOM 1706 CG GLN A 100 5.721 13.195 -2.021 1.00 73.44 C ATOM 1707 CD GLN A 100 5.855 14.129 -3.241 1.00 11.02 C ATOM 1708 OE1 GLN A 100 6.362 13.713 -4.274 1.00 10.51 O ATOM 1709 NE2 GLN A 100 5.448 15.381 -3.155 1.00 51.03 N ATOM 0 H GLN A 100 6.339 13.596 0.743 1.00 61.22 H new ATOM 0 HA GLN A 100 4.809 15.586 -0.669 1.00 52.41 H new ATOM 0 HB2 GLN A 100 4.369 12.568 -0.460 1.00 13.23 H new ATOM 0 HB3 GLN A 100 3.641 13.631 -1.648 1.00 13.23 H new ATOM 0 HG2 GLN A 100 6.647 13.250 -1.449 1.00 73.44 H new ATOM 0 HG3 GLN A 100 5.632 12.172 -2.386 1.00 73.44 H new ATOM 0 HE21 GLN A 100 5.026 15.722 -2.291 1.00 51.03 H new ATOM 0 HE22 GLN A 100 5.555 16.008 -3.952 1.00 51.03 H new ATOM 1718 N GLY A 101 3.668 14.589 2.140 1.00 33.31 N ATOM 1719 CA GLY A 101 2.597 14.711 3.129 1.00 73.42 C ATOM 1720 C GLY A 101 1.874 13.399 3.375 1.00 33.01 C ATOM 1721 O GLY A 101 0.699 13.391 3.764 1.00 64.24 O ATOM 0 H GLY A 101 4.571 14.332 2.539 1.00 33.31 H new ATOM 0 HA2 GLY A 101 3.015 15.072 4.069 1.00 73.42 H new ATOM 0 HA3 GLY A 101 1.879 15.459 2.791 1.00 73.42 H new ATOM 1725 N TYR A 102 2.576 12.279 3.127 1.00 33.05 N ATOM 1726 CA TYR A 102 2.073 10.921 3.410 1.00 62.11 C ATOM 1727 C TYR A 102 2.913 10.310 4.522 1.00 20.54 C ATOM 1728 O TYR A 102 4.057 10.728 4.749 1.00 74.41 O ATOM 1729 CB TYR A 102 2.151 10.009 2.158 1.00 4.20 C ATOM 1730 CG TYR A 102 1.591 10.617 0.873 1.00 32.40 C ATOM 1731 CD1 TYR A 102 0.377 11.302 0.870 1.00 34.33 C ATOM 1732 CD2 TYR A 102 2.276 10.504 -0.340 1.00 4.44 C ATOM 1733 CE1 TYR A 102 -0.126 11.848 -0.285 1.00 72.33 C ATOM 1734 CE2 TYR A 102 1.770 11.049 -1.492 1.00 52.13 C ATOM 1735 CZ TYR A 102 0.574 11.719 -1.456 1.00 12.23 C ATOM 1736 OH TYR A 102 0.084 12.273 -2.601 1.00 54.42 O ATOM 0 H TYR A 102 3.512 12.289 2.723 1.00 33.05 H new ATOM 0 HA TYR A 102 1.027 10.998 3.707 1.00 62.11 H new ATOM 0 HB2 TYR A 102 3.194 9.740 1.989 1.00 4.20 H new ATOM 0 HB3 TYR A 102 1.613 9.085 2.368 1.00 4.20 H new ATOM 0 HD1 TYR A 102 -0.177 11.405 1.791 1.00 34.33 H new ATOM 0 HD2 TYR A 102 3.219 9.979 -0.370 1.00 4.44 H new ATOM 0 HE1 TYR A 102 -1.068 12.376 -0.271 1.00 72.33 H new ATOM 0 HE2 TYR A 102 2.310 10.951 -2.422 1.00 52.13 H new ATOM 0 HH TYR A 102 0.643 13.035 -2.861 1.00 54.42 H new ATOM 1746 N GLU A 103 2.348 9.316 5.205 1.00 23.30 N ATOM 1747 CA GLU A 103 3.056 8.556 6.235 1.00 15.02 C ATOM 1748 C GLU A 103 3.325 7.145 5.708 1.00 12.34 C ATOM 1749 O GLU A 103 2.433 6.485 5.143 1.00 35.23 O ATOM 1750 CB GLU A 103 2.261 8.564 7.564 1.00 10.34 C ATOM 1751 CG GLU A 103 0.773 8.187 7.440 1.00 13.31 C ATOM 1752 CD GLU A 103 0.045 8.198 8.786 1.00 21.12 C ATOM 1753 OE1 GLU A 103 0.152 7.216 9.539 1.00 2.55 O ATOM 1754 OE2 GLU A 103 -0.625 9.201 9.115 1.00 54.21 O ATOM 0 H GLU A 103 1.385 9.014 5.060 1.00 23.30 H new ATOM 0 HA GLU A 103 4.017 9.021 6.458 1.00 15.02 H new ATOM 0 HB2 GLU A 103 2.738 7.872 8.258 1.00 10.34 H new ATOM 0 HB3 GLU A 103 2.332 9.558 8.005 1.00 10.34 H new ATOM 0 HG2 GLU A 103 0.282 8.883 6.761 1.00 13.31 H new ATOM 0 HG3 GLU A 103 0.690 7.195 6.995 1.00 13.31 H new ATOM 1761 N VAL A 104 4.578 6.708 5.862 1.00 23.34 N ATOM 1762 CA VAL A 104 5.062 5.447 5.322 1.00 33.41 C ATOM 1763 C VAL A 104 5.887 4.691 6.374 1.00 45.34 C ATOM 1764 O VAL A 104 6.719 5.275 7.070 1.00 44.12 O ATOM 1765 CB VAL A 104 5.858 5.661 3.967 1.00 14.41 C ATOM 1766 CG1 VAL A 104 6.821 6.866 4.019 1.00 65.05 C ATOM 1767 CG2 VAL A 104 6.593 4.372 3.526 1.00 53.32 C ATOM 0 H VAL A 104 5.289 7.231 6.373 1.00 23.34 H new ATOM 0 HA VAL A 104 4.201 4.826 5.076 1.00 33.41 H new ATOM 0 HB VAL A 104 5.109 5.895 3.210 1.00 14.41 H new ATOM 0 HG11 VAL A 104 7.337 6.961 3.063 1.00 65.05 H new ATOM 0 HG12 VAL A 104 6.255 7.776 4.218 1.00 65.05 H new ATOM 0 HG13 VAL A 104 7.553 6.713 4.812 1.00 65.05 H new ATOM 0 HG21 VAL A 104 7.127 4.558 2.594 1.00 53.32 H new ATOM 0 HG22 VAL A 104 7.303 4.076 4.298 1.00 53.32 H new ATOM 0 HG23 VAL A 104 5.867 3.573 3.375 1.00 53.32 H new ATOM 1777 N ARG A 105 5.592 3.391 6.514 1.00 24.31 N ATOM 1778 CA ARG A 105 6.371 2.452 7.327 1.00 23.14 C ATOM 1779 C ARG A 105 7.351 1.679 6.437 1.00 22.42 C ATOM 1780 O ARG A 105 7.033 1.343 5.290 1.00 51.13 O ATOM 1781 CB ARG A 105 5.428 1.464 8.071 1.00 64.13 C ATOM 1782 CG ARG A 105 4.855 1.967 9.415 1.00 55.31 C ATOM 1783 CD ARG A 105 5.950 2.226 10.466 1.00 42.23 C ATOM 1784 NE ARG A 105 6.952 1.132 10.535 1.00 40.41 N ATOM 1785 CZ ARG A 105 7.855 0.957 11.516 1.00 31.13 C ATOM 1786 NH1 ARG A 105 7.899 1.778 12.556 1.00 24.42 N ATOM 1787 NH2 ARG A 105 8.744 -0.028 11.430 1.00 5.13 N ATOM 0 H ARG A 105 4.791 2.957 6.056 1.00 24.31 H new ATOM 0 HA ARG A 105 6.935 3.016 8.070 1.00 23.14 H new ATOM 0 HB2 ARG A 105 4.596 1.219 7.411 1.00 64.13 H new ATOM 0 HB3 ARG A 105 5.973 0.538 8.254 1.00 64.13 H new ATOM 0 HG2 ARG A 105 4.295 2.886 9.245 1.00 55.31 H new ATOM 0 HG3 ARG A 105 4.151 1.231 9.803 1.00 55.31 H new ATOM 0 HD2 ARG A 105 6.457 3.162 10.233 1.00 42.23 H new ATOM 0 HD3 ARG A 105 5.486 2.350 11.445 1.00 42.23 H new ATOM 0 HE ARG A 105 6.956 0.455 9.772 1.00 40.41 H new ATOM 0 HH11 ARG A 105 7.242 2.556 12.620 1.00 24.42 H new ATOM 0 HH12 ARG A 105 8.590 1.632 13.292 1.00 24.42 H new ATOM 0 HH21 ARG A 105 8.740 -0.649 10.621 1.00 5.13 H new ATOM 0 HH22 ARG A 105 9.430 -0.162 12.173 1.00 5.13 H new ATOM 1801 N LYS A 106 8.534 1.396 6.996 1.00 63.42 N ATOM 1802 CA LYS A 106 9.583 0.597 6.343 1.00 55.05 C ATOM 1803 C LYS A 106 9.830 -0.675 7.167 1.00 24.31 C ATOM 1804 O LYS A 106 9.772 -0.641 8.408 1.00 3.41 O ATOM 1805 CB LYS A 106 10.885 1.442 6.192 1.00 21.30 C ATOM 1806 CG LYS A 106 11.552 1.848 7.524 1.00 52.23 C ATOM 1807 CD LYS A 106 12.623 2.959 7.383 1.00 61.11 C ATOM 1808 CE LYS A 106 13.811 2.564 6.496 1.00 65.31 C ATOM 1809 NZ LYS A 106 14.600 1.463 7.095 1.00 54.20 N ATOM 0 H LYS A 106 8.795 1.719 7.928 1.00 63.42 H new ATOM 0 HA LYS A 106 9.263 0.307 5.342 1.00 55.05 H new ATOM 0 HB2 LYS A 106 11.603 0.874 5.601 1.00 21.30 H new ATOM 0 HB3 LYS A 106 10.652 2.345 5.629 1.00 21.30 H new ATOM 0 HG2 LYS A 106 10.781 2.188 8.215 1.00 52.23 H new ATOM 0 HG3 LYS A 106 12.014 0.967 7.970 1.00 52.23 H new ATOM 0 HD2 LYS A 106 12.154 3.852 6.970 1.00 61.11 H new ATOM 0 HD3 LYS A 106 12.993 3.222 8.374 1.00 61.11 H new ATOM 0 HE2 LYS A 106 13.447 2.259 5.515 1.00 65.31 H new ATOM 0 HE3 LYS A 106 14.454 3.431 6.342 1.00 65.31 H new ATOM 0 HZ1 LYS A 106 15.523 1.827 7.408 1.00 54.20 H new ATOM 0 HZ2 LYS A 106 14.087 1.073 7.911 1.00 54.20 H new ATOM 0 HZ3 LYS A 106 14.745 0.715 6.387 1.00 54.20 H new ATOM 1823 N VAL A 107 10.063 -1.793 6.460 1.00 2.51 N ATOM 1824 CA VAL A 107 10.335 -3.128 7.053 1.00 61.53 C ATOM 1825 C VAL A 107 11.296 -3.911 6.133 1.00 12.34 C ATOM 1826 O VAL A 107 11.484 -3.555 4.975 1.00 41.10 O ATOM 1827 CB VAL A 107 9.029 -3.986 7.282 1.00 54.01 C ATOM 1828 CG1 VAL A 107 8.071 -3.334 8.293 1.00 23.11 C ATOM 1829 CG2 VAL A 107 8.307 -4.272 5.958 1.00 1.42 C ATOM 0 H VAL A 107 10.069 -1.802 5.440 1.00 2.51 H new ATOM 0 HA VAL A 107 10.781 -2.953 8.032 1.00 61.53 H new ATOM 0 HB VAL A 107 9.353 -4.936 7.708 1.00 54.01 H new ATOM 0 HG11 VAL A 107 7.189 -3.962 8.416 1.00 23.11 H new ATOM 0 HG12 VAL A 107 8.575 -3.225 9.253 1.00 23.11 H new ATOM 0 HG13 VAL A 107 7.769 -2.352 7.928 1.00 23.11 H new ATOM 0 HG21 VAL A 107 7.413 -4.864 6.152 1.00 1.42 H new ATOM 0 HG22 VAL A 107 8.024 -3.331 5.487 1.00 1.42 H new ATOM 0 HG23 VAL A 107 8.971 -4.825 5.293 1.00 1.42 H new ATOM 1839 N THR A 108 11.877 -4.986 6.659 1.00 24.15 N ATOM 1840 CA THR A 108 12.821 -5.848 5.911 1.00 63.35 C ATOM 1841 C THR A 108 12.231 -7.257 5.778 1.00 51.34 C ATOM 1842 O THR A 108 12.133 -7.822 4.675 1.00 14.33 O ATOM 1843 CB THR A 108 14.208 -5.919 6.642 1.00 61.14 C ATOM 1844 OG1 THR A 108 14.647 -4.592 6.952 1.00 42.23 O ATOM 1845 CG2 THR A 108 15.292 -6.621 5.797 1.00 70.12 C ATOM 0 H THR A 108 11.714 -5.294 7.617 1.00 24.15 H new ATOM 0 HA THR A 108 12.976 -5.420 4.921 1.00 63.35 H new ATOM 0 HB THR A 108 14.066 -6.507 7.548 1.00 61.14 H new ATOM 0 HG1 THR A 108 14.990 -4.163 6.140 1.00 42.23 H new ATOM 0 HG21 THR A 108 16.230 -6.641 6.352 1.00 70.12 H new ATOM 0 HG22 THR A 108 14.978 -7.642 5.578 1.00 70.12 H new ATOM 0 HG23 THR A 108 15.435 -6.077 4.863 1.00 70.12 H new ATOM 1853 N ASP A 109 11.800 -7.783 6.925 1.00 25.52 N ATOM 1854 CA ASP A 109 11.394 -9.182 7.079 1.00 14.54 C ATOM 1855 C ASP A 109 9.870 -9.326 6.889 1.00 20.54 C ATOM 1856 O ASP A 109 9.111 -8.346 7.004 1.00 65.23 O ATOM 1857 CB ASP A 109 11.831 -9.696 8.483 1.00 61.21 C ATOM 1858 CG ASP A 109 11.788 -11.234 8.612 1.00 2.30 C ATOM 1859 OD1 ASP A 109 12.806 -11.894 8.300 1.00 4.23 O ATOM 1860 OD2 ASP A 109 10.737 -11.789 8.986 1.00 0.04 O ATOM 0 H ASP A 109 11.722 -7.242 7.786 1.00 25.52 H new ATOM 0 HA ASP A 109 11.883 -9.786 6.315 1.00 14.54 H new ATOM 0 HB2 ASP A 109 12.843 -9.349 8.690 1.00 61.21 H new ATOM 0 HB3 ASP A 109 11.182 -9.257 9.241 1.00 61.21 H new ATOM 1865 N ASP A 110 9.461 -10.570 6.599 1.00 22.44 N ATOM 1866 CA ASP A 110 8.058 -11.000 6.471 1.00 73.14 C ATOM 1867 C ASP A 110 7.222 -10.621 7.709 1.00 51.04 C ATOM 1868 O ASP A 110 6.175 -9.979 7.580 1.00 24.41 O ATOM 1869 CB ASP A 110 8.034 -12.546 6.247 1.00 33.03 C ATOM 1870 CG ASP A 110 6.685 -13.217 6.570 1.00 41.44 C ATOM 1871 OD1 ASP A 110 5.744 -13.116 5.760 1.00 70.34 O ATOM 1872 OD2 ASP A 110 6.558 -13.851 7.644 1.00 12.45 O ATOM 0 H ASP A 110 10.120 -11.332 6.441 1.00 22.44 H new ATOM 0 HA ASP A 110 7.609 -10.486 5.621 1.00 73.14 H new ATOM 0 HB2 ASP A 110 8.289 -12.754 5.208 1.00 33.03 H new ATOM 0 HB3 ASP A 110 8.809 -13.002 6.863 1.00 33.03 H new ATOM 1877 N GLU A 111 7.710 -11.035 8.896 1.00 61.12 N ATOM 1878 CA GLU A 111 6.978 -10.894 10.172 1.00 43.53 C ATOM 1879 C GLU A 111 6.677 -9.421 10.507 1.00 43.40 C ATOM 1880 O GLU A 111 5.594 -9.104 11.029 1.00 21.35 O ATOM 1881 CB GLU A 111 7.764 -11.584 11.327 1.00 30.32 C ATOM 1882 CG GLU A 111 9.107 -10.924 11.723 1.00 50.42 C ATOM 1883 CD GLU A 111 9.909 -11.729 12.762 1.00 24.34 C ATOM 1884 OE1 GLU A 111 9.387 -11.964 13.874 1.00 64.33 O ATOM 1885 OE2 GLU A 111 11.056 -12.139 12.474 1.00 42.34 O ATOM 0 H GLU A 111 8.624 -11.477 8.997 1.00 61.12 H new ATOM 0 HA GLU A 111 6.016 -11.394 10.058 1.00 43.53 H new ATOM 0 HB2 GLU A 111 7.123 -11.615 12.208 1.00 30.32 H new ATOM 0 HB3 GLU A 111 7.960 -12.617 11.040 1.00 30.32 H new ATOM 0 HG2 GLU A 111 9.716 -10.794 10.828 1.00 50.42 H new ATOM 0 HG3 GLU A 111 8.909 -9.929 12.121 1.00 50.42 H new ATOM 1892 N GLU A 112 7.629 -8.530 10.175 1.00 64.00 N ATOM 1893 CA GLU A 112 7.491 -7.085 10.403 1.00 3.30 C ATOM 1894 C GLU A 112 6.369 -6.515 9.511 1.00 12.24 C ATOM 1895 O GLU A 112 5.518 -5.750 9.980 1.00 54.41 O ATOM 1896 CB GLU A 112 8.827 -6.359 10.101 1.00 63.14 C ATOM 1897 CG GLU A 112 10.051 -6.827 10.910 1.00 35.11 C ATOM 1898 CD GLU A 112 11.304 -5.985 10.601 1.00 41.12 C ATOM 1899 OE1 GLU A 112 11.903 -6.176 9.518 1.00 22.33 O ATOM 1900 OE2 GLU A 112 11.681 -5.114 11.424 1.00 5.31 O ATOM 0 H GLU A 112 8.514 -8.794 9.742 1.00 64.00 H new ATOM 0 HA GLU A 112 7.234 -6.921 11.449 1.00 3.30 H new ATOM 0 HB2 GLU A 112 9.050 -6.479 9.041 1.00 63.14 H new ATOM 0 HB3 GLU A 112 8.686 -5.293 10.279 1.00 63.14 H new ATOM 0 HG2 GLU A 112 9.827 -6.766 11.975 1.00 35.11 H new ATOM 0 HG3 GLU A 112 10.254 -7.874 10.687 1.00 35.11 H new ATOM 1907 N ALA A 113 6.381 -6.934 8.226 1.00 62.40 N ATOM 1908 CA ALA A 113 5.421 -6.475 7.202 1.00 75.10 C ATOM 1909 C ALA A 113 3.972 -6.857 7.564 1.00 24.30 C ATOM 1910 O ALA A 113 3.087 -5.994 7.575 1.00 61.52 O ATOM 1911 CB ALA A 113 5.806 -7.047 5.826 1.00 13.12 C ATOM 0 H ALA A 113 7.062 -7.604 7.870 1.00 62.40 H new ATOM 0 HA ALA A 113 5.467 -5.387 7.162 1.00 75.10 H new ATOM 0 HB1 ALA A 113 5.093 -6.704 5.077 1.00 13.12 H new ATOM 0 HB2 ALA A 113 6.806 -6.707 5.558 1.00 13.12 H new ATOM 0 HB3 ALA A 113 5.792 -8.136 5.868 1.00 13.12 H new ATOM 1917 N LEU A 114 3.771 -8.147 7.916 1.00 64.44 N ATOM 1918 CA LEU A 114 2.446 -8.721 8.263 1.00 72.05 C ATOM 1919 C LEU A 114 1.822 -7.985 9.448 1.00 11.04 C ATOM 1920 O LEU A 114 0.626 -7.648 9.436 1.00 2.22 O ATOM 1921 CB LEU A 114 2.596 -10.219 8.651 1.00 31.51 C ATOM 1922 CG LEU A 114 3.032 -11.186 7.520 1.00 14.14 C ATOM 1923 CD1 LEU A 114 3.341 -12.587 8.092 1.00 71.43 C ATOM 1924 CD2 LEU A 114 1.970 -11.247 6.394 1.00 73.21 C ATOM 0 H LEU A 114 4.529 -8.827 7.968 1.00 64.44 H new ATOM 0 HA LEU A 114 1.804 -8.616 7.388 1.00 72.05 H new ATOM 0 HB2 LEU A 114 3.323 -10.291 9.460 1.00 31.51 H new ATOM 0 HB3 LEU A 114 1.642 -10.566 9.048 1.00 31.51 H new ATOM 0 HG LEU A 114 3.949 -10.800 7.074 1.00 14.14 H new ATOM 0 HD11 LEU A 114 3.645 -13.251 7.283 1.00 71.43 H new ATOM 0 HD12 LEU A 114 4.147 -12.512 8.822 1.00 71.43 H new ATOM 0 HD13 LEU A 114 2.450 -12.988 8.575 1.00 71.43 H new ATOM 0 HD21 LEU A 114 2.304 -11.933 5.616 1.00 73.21 H new ATOM 0 HD22 LEU A 114 1.023 -11.598 6.805 1.00 73.21 H new ATOM 0 HD23 LEU A 114 1.834 -10.253 5.968 1.00 73.21 H new ATOM 1936 N LYS A 115 2.669 -7.751 10.468 1.00 62.13 N ATOM 1937 CA LYS A 115 2.240 -7.150 11.728 1.00 42.42 C ATOM 1938 C LYS A 115 1.734 -5.726 11.488 1.00 50.43 C ATOM 1939 O LYS A 115 0.664 -5.378 11.962 1.00 12.25 O ATOM 1940 CB LYS A 115 3.380 -7.170 12.790 1.00 21.21 C ATOM 1941 CG LYS A 115 2.895 -6.860 14.229 1.00 43.12 C ATOM 1942 CD LYS A 115 4.017 -6.977 15.289 1.00 50.11 C ATOM 1943 CE LYS A 115 3.487 -6.892 16.734 1.00 61.11 C ATOM 1944 NZ LYS A 115 2.827 -5.591 17.028 1.00 34.30 N ATOM 0 H LYS A 115 3.664 -7.975 10.434 1.00 62.13 H new ATOM 0 HA LYS A 115 1.420 -7.747 12.127 1.00 42.42 H new ATOM 0 HB2 LYS A 115 3.857 -8.150 12.780 1.00 21.21 H new ATOM 0 HB3 LYS A 115 4.141 -6.442 12.508 1.00 21.21 H new ATOM 0 HG2 LYS A 115 2.481 -5.852 14.257 1.00 43.12 H new ATOM 0 HG3 LYS A 115 2.086 -7.544 14.488 1.00 43.12 H new ATOM 0 HD2 LYS A 115 4.540 -7.924 15.154 1.00 50.11 H new ATOM 0 HD3 LYS A 115 4.747 -6.184 15.128 1.00 50.11 H new ATOM 0 HE2 LYS A 115 2.777 -7.702 16.905 1.00 61.11 H new ATOM 0 HE3 LYS A 115 4.313 -7.041 17.429 1.00 61.11 H new ATOM 0 HZ1 LYS A 115 2.885 -5.395 18.048 1.00 34.30 H new ATOM 0 HZ2 LYS A 115 3.306 -4.832 16.502 1.00 34.30 H new ATOM 0 HZ3 LYS A 115 1.829 -5.635 16.740 1.00 34.30 H new ATOM 1958 N ILE A 116 2.488 -4.943 10.681 1.00 74.11 N ATOM 1959 CA ILE A 116 2.201 -3.508 10.434 1.00 53.44 C ATOM 1960 C ILE A 116 0.965 -3.297 9.524 1.00 21.10 C ATOM 1961 O ILE A 116 0.289 -2.267 9.640 1.00 75.14 O ATOM 1962 CB ILE A 116 3.475 -2.750 9.888 1.00 2.33 C ATOM 1963 CG1 ILE A 116 4.608 -2.797 10.969 1.00 33.55 C ATOM 1964 CG2 ILE A 116 3.165 -1.286 9.471 1.00 43.43 C ATOM 1965 CD1 ILE A 116 5.848 -1.993 10.644 1.00 32.43 C ATOM 0 H ILE A 116 3.310 -5.286 10.184 1.00 74.11 H new ATOM 0 HA ILE A 116 1.947 -3.067 11.398 1.00 53.44 H new ATOM 0 HB ILE A 116 3.808 -3.260 8.984 1.00 2.33 H new ATOM 0 HG12 ILE A 116 4.200 -2.438 11.914 1.00 33.55 H new ATOM 0 HG13 ILE A 116 4.899 -3.836 11.121 1.00 33.55 H new ATOM 0 HG21 ILE A 116 4.075 -0.812 9.103 1.00 43.43 H new ATOM 0 HG22 ILE A 116 2.411 -1.284 8.684 1.00 43.43 H new ATOM 0 HG23 ILE A 116 2.791 -0.734 10.333 1.00 43.43 H new ATOM 0 HD11 ILE A 116 6.569 -2.093 11.455 1.00 32.43 H new ATOM 0 HD12 ILE A 116 6.289 -2.363 9.719 1.00 32.43 H new ATOM 0 HD13 ILE A 116 5.580 -0.943 10.524 1.00 32.43 H new ATOM 1977 N VAL A 117 0.657 -4.277 8.647 1.00 51.42 N ATOM 1978 CA VAL A 117 -0.634 -4.305 7.908 1.00 52.40 C ATOM 1979 C VAL A 117 -1.822 -4.222 8.911 1.00 44.30 C ATOM 1980 O VAL A 117 -2.789 -3.472 8.707 1.00 71.22 O ATOM 1981 CB VAL A 117 -0.758 -5.612 7.018 1.00 14.45 C ATOM 1982 CG1 VAL A 117 -2.151 -5.737 6.358 1.00 51.53 C ATOM 1983 CG2 VAL A 117 0.358 -5.671 5.946 1.00 52.01 C ATOM 0 H VAL A 117 1.278 -5.057 8.431 1.00 51.42 H new ATOM 0 HA VAL A 117 -0.664 -3.442 7.243 1.00 52.40 H new ATOM 0 HB VAL A 117 -0.635 -6.461 7.690 1.00 14.45 H new ATOM 0 HG11 VAL A 117 -2.189 -6.647 5.759 1.00 51.53 H new ATOM 0 HG12 VAL A 117 -2.918 -5.780 7.132 1.00 51.53 H new ATOM 0 HG13 VAL A 117 -2.329 -4.873 5.718 1.00 51.53 H new ATOM 0 HG21 VAL A 117 0.245 -6.578 5.353 1.00 52.01 H new ATOM 0 HG22 VAL A 117 0.283 -4.800 5.295 1.00 52.01 H new ATOM 0 HG23 VAL A 117 1.332 -5.676 6.435 1.00 52.01 H new ATOM 1993 N ARG A 118 -1.679 -4.973 10.019 1.00 30.25 N ATOM 1994 CA ARG A 118 -2.686 -5.078 11.092 1.00 51.22 C ATOM 1995 C ARG A 118 -2.587 -3.900 12.098 1.00 70.54 C ATOM 1996 O ARG A 118 -3.619 -3.439 12.603 1.00 15.34 O ATOM 1997 CB ARG A 118 -2.504 -6.438 11.806 1.00 65.54 C ATOM 1998 CG ARG A 118 -2.686 -7.665 10.884 1.00 63.15 C ATOM 1999 CD ARG A 118 -2.283 -8.990 11.563 1.00 43.04 C ATOM 2000 NE ARG A 118 -2.982 -9.205 12.851 1.00 42.31 N ATOM 2001 CZ ARG A 118 -3.361 -10.399 13.343 1.00 21.33 C ATOM 2002 NH1 ARG A 118 -3.107 -11.520 12.691 1.00 42.21 N ATOM 2003 NH2 ARG A 118 -3.988 -10.457 14.508 1.00 23.43 N ATOM 0 H ARG A 118 -0.846 -5.534 10.197 1.00 30.25 H new ATOM 0 HA ARG A 118 -3.681 -5.021 10.651 1.00 51.22 H new ATOM 0 HB2 ARG A 118 -1.508 -6.474 12.248 1.00 65.54 H new ATOM 0 HB3 ARG A 118 -3.219 -6.504 12.626 1.00 65.54 H new ATOM 0 HG2 ARG A 118 -3.728 -7.726 10.570 1.00 63.15 H new ATOM 0 HG3 ARG A 118 -2.089 -7.528 9.983 1.00 63.15 H new ATOM 0 HD2 ARG A 118 -2.503 -9.820 10.891 1.00 43.04 H new ATOM 0 HD3 ARG A 118 -1.206 -8.994 11.733 1.00 43.04 H new ATOM 0 HE ARG A 118 -3.194 -8.380 13.412 1.00 42.31 H new ATOM 0 HH11 ARG A 118 -2.615 -11.490 11.798 1.00 42.21 H new ATOM 0 HH12 ARG A 118 -3.403 -12.415 13.081 1.00 42.21 H new ATOM 0 HH21 ARG A 118 -4.181 -9.600 15.027 1.00 23.43 H new ATOM 0 HH22 ARG A 118 -4.278 -11.359 14.887 1.00 23.43 H new ATOM 2017 N GLU A 119 -1.338 -3.445 12.402 1.00 50.23 N ATOM 2018 CA GLU A 119 -1.088 -2.280 13.290 1.00 61.13 C ATOM 2019 C GLU A 119 -1.799 -1.041 12.725 1.00 1.25 C ATOM 2020 O GLU A 119 -2.501 -0.342 13.451 1.00 23.11 O ATOM 2021 CB GLU A 119 0.429 -1.951 13.451 1.00 24.45 C ATOM 2022 CG GLU A 119 1.321 -3.066 14.028 1.00 51.33 C ATOM 2023 CD GLU A 119 0.890 -3.568 15.411 1.00 24.50 C ATOM 2024 OE1 GLU A 119 1.188 -2.895 16.421 1.00 54.41 O ATOM 2025 OE2 GLU A 119 0.277 -4.657 15.503 1.00 1.44 O ATOM 0 H GLU A 119 -0.486 -3.873 12.040 1.00 50.23 H new ATOM 0 HA GLU A 119 -1.477 -2.546 14.273 1.00 61.13 H new ATOM 0 HB2 GLU A 119 0.822 -1.672 12.473 1.00 24.45 H new ATOM 0 HB3 GLU A 119 0.521 -1.075 14.093 1.00 24.45 H new ATOM 0 HG2 GLU A 119 1.325 -3.907 13.334 1.00 51.33 H new ATOM 0 HG3 GLU A 119 2.346 -2.699 14.091 1.00 51.33 H new ATOM 2032 N PHE A 120 -1.626 -0.837 11.399 1.00 52.54 N ATOM 2033 CA PHE A 120 -2.225 0.276 10.613 1.00 31.10 C ATOM 2034 C PHE A 120 -3.706 0.508 10.963 1.00 3.15 C ATOM 2035 O PHE A 120 -4.160 1.643 11.102 1.00 4.55 O ATOM 2036 CB PHE A 120 -2.073 -0.043 9.082 1.00 10.40 C ATOM 2037 CG PHE A 120 -3.054 0.696 8.149 1.00 52.33 C ATOM 2038 CD1 PHE A 120 -2.805 1.996 7.716 1.00 64.23 C ATOM 2039 CD2 PHE A 120 -4.253 0.087 7.740 1.00 13.33 C ATOM 2040 CE1 PHE A 120 -3.711 2.660 6.904 1.00 14.43 C ATOM 2041 CE2 PHE A 120 -5.157 0.757 6.941 1.00 21.14 C ATOM 2042 CZ PHE A 120 -4.886 2.040 6.526 1.00 73.22 C ATOM 0 H PHE A 120 -1.051 -1.456 10.827 1.00 52.54 H new ATOM 0 HA PHE A 120 -1.694 1.194 10.864 1.00 31.10 H new ATOM 0 HB2 PHE A 120 -1.055 0.201 8.777 1.00 10.40 H new ATOM 0 HB3 PHE A 120 -2.200 -1.116 8.938 1.00 10.40 H new ATOM 0 HD1 PHE A 120 -1.895 2.493 8.017 1.00 64.23 H new ATOM 0 HD2 PHE A 120 -4.470 -0.922 8.056 1.00 13.33 H new ATOM 0 HE1 PHE A 120 -3.498 3.664 6.566 1.00 14.43 H new ATOM 0 HE2 PHE A 120 -6.076 0.275 6.642 1.00 21.14 H new ATOM 0 HZ PHE A 120 -5.595 2.565 5.902 1.00 73.22 H new ATOM 2052 N MET A 121 -4.425 -0.601 11.108 1.00 5.44 N ATOM 2053 CA MET A 121 -5.882 -0.616 11.289 1.00 32.33 C ATOM 2054 C MET A 121 -6.347 0.100 12.589 1.00 30.41 C ATOM 2055 O MET A 121 -7.507 0.498 12.685 1.00 5.21 O ATOM 2056 CB MET A 121 -6.363 -2.089 11.166 1.00 35.43 C ATOM 2057 CG MET A 121 -5.978 -2.712 9.801 1.00 24.14 C ATOM 2058 SD MET A 121 -6.426 -4.447 9.599 1.00 74.11 S ATOM 2059 CE MET A 121 -5.916 -4.720 7.894 1.00 42.31 C ATOM 0 H MET A 121 -4.009 -1.532 11.104 1.00 5.44 H new ATOM 0 HA MET A 121 -6.357 -0.026 10.505 1.00 32.33 H new ATOM 0 HB2 MET A 121 -5.927 -2.681 11.971 1.00 35.43 H new ATOM 0 HB3 MET A 121 -7.445 -2.129 11.291 1.00 35.43 H new ATOM 0 HG2 MET A 121 -6.455 -2.135 9.008 1.00 24.14 H new ATOM 0 HG3 MET A 121 -4.901 -2.612 9.664 1.00 24.14 H new ATOM 0 HE1 MET A 121 -6.763 -5.090 7.316 1.00 42.31 H new ATOM 0 HE2 MET A 121 -5.565 -3.782 7.464 1.00 42.31 H new ATOM 0 HE3 MET A 121 -5.111 -5.454 7.868 1.00 42.31 H new ATOM 2069 N GLN A 122 -5.440 0.292 13.573 1.00 73.25 N ATOM 2070 CA GLN A 122 -5.662 1.249 14.692 1.00 3.23 C ATOM 2071 C GLN A 122 -4.899 2.575 14.430 1.00 60.21 C ATOM 2072 O GLN A 122 -5.445 3.670 14.641 1.00 73.01 O ATOM 2073 CB GLN A 122 -5.262 0.658 16.082 1.00 63.55 C ATOM 2074 CG GLN A 122 -3.805 0.166 16.213 1.00 14.30 C ATOM 2075 CD GLN A 122 -3.319 0.102 17.662 1.00 73.33 C ATOM 2076 OE1 GLN A 122 -2.720 1.052 18.159 1.00 70.21 O ATOM 2077 NE2 GLN A 122 -3.602 -0.992 18.349 1.00 41.11 N ATOM 0 H GLN A 122 -4.548 -0.200 13.619 1.00 73.25 H new ATOM 0 HA GLN A 122 -6.733 1.448 14.729 1.00 3.23 H new ATOM 0 HB2 GLN A 122 -5.438 1.419 16.842 1.00 63.55 H new ATOM 0 HB3 GLN A 122 -5.928 -0.176 16.306 1.00 63.55 H new ATOM 0 HG2 GLN A 122 -3.721 -0.824 15.764 1.00 14.30 H new ATOM 0 HG3 GLN A 122 -3.152 0.830 15.646 1.00 14.30 H new ATOM 0 HE21 GLN A 122 -4.101 -1.760 17.901 1.00 41.11 H new ATOM 0 HE22 GLN A 122 -3.321 -1.067 19.327 1.00 41.11 H new ATOM 2086 N LYS A 123 -3.655 2.446 13.911 1.00 32.12 N ATOM 2087 CA LYS A 123 -2.661 3.550 13.815 1.00 3.13 C ATOM 2088 C LYS A 123 -3.095 4.677 12.847 1.00 10.24 C ATOM 2089 O LYS A 123 -2.659 5.820 12.996 1.00 62.11 O ATOM 2090 CB LYS A 123 -1.276 2.992 13.364 1.00 60.22 C ATOM 2091 CG LYS A 123 -0.633 1.953 14.299 1.00 44.25 C ATOM 2092 CD LYS A 123 -0.231 2.505 15.675 1.00 50.34 C ATOM 2093 CE LYS A 123 0.338 1.398 16.580 1.00 51.13 C ATOM 2094 NZ LYS A 123 0.830 1.941 17.869 1.00 72.22 N ATOM 0 H LYS A 123 -3.306 1.562 13.541 1.00 32.12 H new ATOM 0 HA LYS A 123 -2.590 3.985 14.812 1.00 3.13 H new ATOM 0 HB2 LYS A 123 -1.391 2.543 12.378 1.00 60.22 H new ATOM 0 HB3 LYS A 123 -0.587 3.829 13.255 1.00 60.22 H new ATOM 0 HG2 LYS A 123 -1.331 1.128 14.441 1.00 44.25 H new ATOM 0 HG3 LYS A 123 0.252 1.542 13.813 1.00 44.25 H new ATOM 0 HD2 LYS A 123 0.512 3.292 15.550 1.00 50.34 H new ATOM 0 HD3 LYS A 123 -1.098 2.959 16.154 1.00 50.34 H new ATOM 0 HE2 LYS A 123 -0.433 0.652 16.770 1.00 51.13 H new ATOM 0 HE3 LYS A 123 1.153 0.890 16.065 1.00 51.13 H new ATOM 0 HZ1 LYS A 123 1.206 1.166 18.452 1.00 72.22 H new ATOM 0 HZ2 LYS A 123 1.583 2.635 17.688 1.00 72.22 H new ATOM 0 HZ3 LYS A 123 0.046 2.404 18.372 1.00 72.22 H new ATOM 2108 N ALA A 124 -3.991 4.349 11.899 1.00 61.11 N ATOM 2109 CA ALA A 124 -4.364 5.227 10.757 1.00 13.04 C ATOM 2110 C ALA A 124 -5.279 6.413 11.142 1.00 4.22 C ATOM 2111 O ALA A 124 -5.771 7.128 10.255 1.00 23.20 O ATOM 2112 CB ALA A 124 -5.054 4.370 9.682 1.00 42.05 C ATOM 0 H ALA A 124 -4.487 3.458 11.897 1.00 61.11 H new ATOM 0 HA ALA A 124 -3.441 5.672 10.386 1.00 13.04 H new ATOM 0 HB1 ALA A 124 -5.333 5.001 8.838 1.00 42.05 H new ATOM 0 HB2 ALA A 124 -4.370 3.592 9.343 1.00 42.05 H new ATOM 0 HB3 ALA A 124 -5.948 3.909 10.102 1.00 42.05 H new ATOM 2118 N GLY A 125 -5.491 6.625 12.450 1.00 53.33 N ATOM 2119 CA GLY A 125 -6.470 7.600 12.937 1.00 51.35 C ATOM 2120 C GLY A 125 -7.842 6.966 13.127 1.00 51.30 C ATOM 2121 O GLY A 125 -8.751 7.603 13.655 1.00 4.33 O ATOM 0 H GLY A 125 -4.993 6.130 13.190 1.00 53.33 H new ATOM 0 HA2 GLY A 125 -6.128 8.019 13.883 1.00 51.35 H new ATOM 0 HA3 GLY A 125 -6.545 8.426 12.230 1.00 51.35 H new ATOM 2125 N SER A 126 -7.980 5.697 12.674 1.00 25.42 N ATOM 2126 CA SER A 126 -9.175 4.878 12.888 1.00 42.35 C ATOM 2127 C SER A 126 -9.457 4.739 14.393 1.00 51.33 C ATOM 2128 O SER A 126 -10.590 4.921 14.845 1.00 42.55 O ATOM 2129 CB SER A 126 -8.971 3.500 12.225 1.00 14.32 C ATOM 2130 OG SER A 126 -10.124 2.682 12.328 1.00 44.00 O ATOM 0 H SER A 126 -7.251 5.217 12.145 1.00 25.42 H new ATOM 0 HA SER A 126 -10.041 5.358 12.432 1.00 42.35 H new ATOM 0 HB2 SER A 126 -8.718 3.638 11.174 1.00 14.32 H new ATOM 0 HB3 SER A 126 -8.126 2.995 12.693 1.00 14.32 H new ATOM 0 HG SER A 126 -9.873 1.744 12.196 1.00 44.00 H new ATOM 2136 N LEU A 127 -8.401 4.430 15.159 1.00 3.23 N ATOM 2137 CA LEU A 127 -8.443 4.448 16.630 1.00 33.13 C ATOM 2138 C LEU A 127 -7.613 5.665 17.078 1.00 75.51 C ATOM 2139 O LEU A 127 -6.406 5.554 17.321 1.00 62.23 O ATOM 2140 CB LEU A 127 -7.913 3.085 17.196 1.00 34.14 C ATOM 2141 CG LEU A 127 -8.271 2.704 18.683 1.00 71.45 C ATOM 2142 CD1 LEU A 127 -7.965 1.206 18.958 1.00 51.15 C ATOM 2143 CD2 LEU A 127 -7.556 3.605 19.720 1.00 40.43 C ATOM 0 H LEU A 127 -7.494 4.161 14.778 1.00 3.23 H new ATOM 0 HA LEU A 127 -9.456 4.550 17.019 1.00 33.13 H new ATOM 0 HB2 LEU A 127 -8.285 2.290 16.550 1.00 34.14 H new ATOM 0 HB3 LEU A 127 -6.827 3.087 17.106 1.00 34.14 H new ATOM 0 HG LEU A 127 -9.341 2.874 18.800 1.00 71.45 H new ATOM 0 HD11 LEU A 127 -8.220 0.966 19.990 1.00 51.15 H new ATOM 0 HD12 LEU A 127 -8.555 0.584 18.285 1.00 51.15 H new ATOM 0 HD13 LEU A 127 -6.905 1.015 18.792 1.00 51.15 H new ATOM 0 HD21 LEU A 127 -7.840 3.297 20.726 1.00 40.43 H new ATOM 0 HD22 LEU A 127 -6.477 3.510 19.602 1.00 40.43 H new ATOM 0 HD23 LEU A 127 -7.848 4.643 19.562 1.00 40.43 H new ATOM 2155 N GLU A 128 -8.262 6.841 17.091 1.00 45.42 N ATOM 2156 CA GLU A 128 -7.635 8.118 17.471 1.00 61.33 C ATOM 2157 C GLU A 128 -8.025 8.480 18.918 1.00 44.44 C ATOM 2158 O GLU A 128 -9.220 8.598 19.237 1.00 61.32 O ATOM 2159 CB GLU A 128 -8.065 9.237 16.475 1.00 4.21 C ATOM 2160 CG GLU A 128 -7.515 10.649 16.776 1.00 63.30 C ATOM 2161 CD GLU A 128 -5.977 10.720 16.841 1.00 33.44 C ATOM 2162 OE1 GLU A 128 -5.326 10.861 15.781 1.00 14.20 O ATOM 2163 OE2 GLU A 128 -5.409 10.640 17.958 1.00 11.13 O ATOM 0 H GLU A 128 -9.245 6.933 16.836 1.00 45.42 H new ATOM 0 HA GLU A 128 -6.550 8.021 17.424 1.00 61.33 H new ATOM 0 HB2 GLU A 128 -7.746 8.949 15.473 1.00 4.21 H new ATOM 0 HB3 GLU A 128 -9.154 9.287 16.461 1.00 4.21 H new ATOM 0 HG2 GLU A 128 -7.868 11.337 16.008 1.00 63.30 H new ATOM 0 HG3 GLU A 128 -7.925 10.993 17.725 1.00 63.30 H new ATOM 2170 N HIS A 129 -7.008 8.654 19.782 1.00 21.32 N ATOM 2171 CA HIS A 129 -7.202 8.981 21.213 1.00 5.23 C ATOM 2172 C HIS A 129 -7.547 10.473 21.385 1.00 14.13 C ATOM 2173 O HIS A 129 -8.222 10.863 22.345 1.00 64.54 O ATOM 2174 CB HIS A 129 -5.949 8.606 22.039 1.00 64.41 C ATOM 2175 CG HIS A 129 -5.548 7.161 21.929 1.00 54.13 C ATOM 2176 ND1 HIS A 129 -6.144 6.158 22.662 1.00 42.25 N ATOM 2177 CD2 HIS A 129 -4.597 6.556 21.184 1.00 1.23 C ATOM 2178 CE1 HIS A 129 -5.574 5.008 22.375 1.00 53.12 C ATOM 2179 NE2 HIS A 129 -4.632 5.220 21.482 1.00 60.22 N ATOM 0 H HIS A 129 -6.028 8.573 19.511 1.00 21.32 H new ATOM 0 HA HIS A 129 -8.039 8.392 21.588 1.00 5.23 H new ATOM 0 HB2 HIS A 129 -5.115 9.229 21.716 1.00 64.41 H new ATOM 0 HB3 HIS A 129 -6.135 8.841 23.087 1.00 64.41 H new ATOM 0 HD2 HIS A 129 -3.932 7.037 20.483 1.00 1.23 H new ATOM 0 HE1 HIS A 129 -5.835 4.051 22.801 1.00 53.12 H new ATOM 0 HE2 HIS A 129 -4.026 4.506 21.077 1.00 60.22 H new ATOM 2188 N HIS A 130 -7.094 11.296 20.420 1.00 12.22 N ATOM 2189 CA HIS A 130 -7.486 12.719 20.290 1.00 62.11 C ATOM 2190 C HIS A 130 -8.795 12.815 19.476 1.00 44.24 C ATOM 2191 O HIS A 130 -8.928 13.660 18.583 1.00 22.00 O ATOM 2192 CB HIS A 130 -6.355 13.520 19.589 1.00 54.20 C ATOM 2193 CG HIS A 130 -5.037 13.493 20.306 1.00 41.22 C ATOM 2194 ND1 HIS A 130 -4.006 12.649 19.955 1.00 61.14 N ATOM 2195 CD2 HIS A 130 -4.576 14.223 21.348 1.00 55.03 C ATOM 2196 CE1 HIS A 130 -2.974 12.865 20.746 1.00 64.23 C ATOM 2197 NE2 HIS A 130 -3.297 13.815 21.599 1.00 42.12 N ATOM 0 H HIS A 130 -6.439 10.992 19.700 1.00 12.22 H new ATOM 0 HA HIS A 130 -7.647 13.144 21.281 1.00 62.11 H new ATOM 0 HB2 HIS A 130 -6.215 13.123 18.583 1.00 54.20 H new ATOM 0 HB3 HIS A 130 -6.674 14.557 19.481 1.00 54.20 H new ATOM 0 HD1 HIS A 130 -4.037 11.964 19.200 1.00 61.14 H new ATOM 0 HD2 HIS A 130 -5.120 14.988 21.883 1.00 55.03 H new ATOM 0 HE1 HIS A 130 -2.025 12.351 20.702 1.00 64.23 H new ATOM 2206 N HIS A 131 -9.756 11.949 19.839 1.00 40.42 N ATOM 2207 CA HIS A 131 -11.030 11.751 19.133 1.00 1.25 C ATOM 2208 C HIS A 131 -11.801 13.072 18.976 1.00 3.04 C ATOM 2209 O HIS A 131 -12.208 13.689 19.968 1.00 40.41 O ATOM 2210 CB HIS A 131 -11.875 10.677 19.884 1.00 42.21 C ATOM 2211 CG HIS A 131 -12.045 10.913 21.376 1.00 41.40 C ATOM 2212 ND1 HIS A 131 -11.182 10.398 22.325 1.00 24.24 N ATOM 2213 CD2 HIS A 131 -12.981 11.609 22.075 1.00 4.30 C ATOM 2214 CE1 HIS A 131 -11.578 10.770 23.529 1.00 61.04 C ATOM 2215 NE2 HIS A 131 -12.662 11.503 23.407 1.00 54.41 N ATOM 0 H HIS A 131 -9.663 11.349 20.659 1.00 40.42 H new ATOM 0 HA HIS A 131 -10.823 11.393 18.124 1.00 1.25 H new ATOM 0 HB2 HIS A 131 -12.863 10.629 19.425 1.00 42.21 H new ATOM 0 HB3 HIS A 131 -11.408 9.703 19.738 1.00 42.21 H new ATOM 0 HD2 HIS A 131 -13.821 12.146 21.659 1.00 4.30 H new ATOM 0 HE1 HIS A 131 -11.092 10.514 24.459 1.00 61.04 H new ATOM 0 HE2 HIS A 131 -13.182 11.925 24.176 1.00 54.41 H new ATOM 2224 N HIS A 132 -11.937 13.525 17.720 1.00 63.35 N ATOM 2225 CA HIS A 132 -12.662 14.757 17.394 1.00 61.01 C ATOM 2226 C HIS A 132 -14.160 14.543 17.670 1.00 70.42 C ATOM 2227 O HIS A 132 -14.893 14.017 16.822 1.00 72.24 O ATOM 2228 CB HIS A 132 -12.394 15.176 15.922 1.00 42.30 C ATOM 2229 CG HIS A 132 -12.904 16.557 15.569 1.00 12.04 C ATOM 2230 ND1 HIS A 132 -12.099 17.677 15.557 1.00 1.04 N ATOM 2231 CD2 HIS A 132 -14.135 16.995 15.203 1.00 62.11 C ATOM 2232 CE1 HIS A 132 -12.812 18.727 15.202 1.00 13.04 C ATOM 2233 NE2 HIS A 132 -14.048 18.341 14.980 1.00 15.55 N ATOM 0 H HIS A 132 -11.548 13.048 16.907 1.00 63.35 H new ATOM 0 HA HIS A 132 -12.308 15.574 18.022 1.00 61.01 H new ATOM 0 HB2 HIS A 132 -11.321 15.138 15.734 1.00 42.30 H new ATOM 0 HB3 HIS A 132 -12.860 14.448 15.258 1.00 42.30 H new ATOM 0 HD2 HIS A 132 -15.024 16.389 15.105 1.00 62.11 H new ATOM 0 HE1 HIS A 132 -12.442 19.737 15.109 1.00 13.04 H new ATOM 0 HE2 HIS A 132 -14.816 18.946 14.689 1.00 15.55 H new ATOM 2242 N HIS A 133 -14.575 14.897 18.897 1.00 63.04 N ATOM 2243 CA HIS A 133 -15.947 14.719 19.376 1.00 0.12 C ATOM 2244 C HIS A 133 -16.157 15.582 20.619 1.00 31.21 C ATOM 2245 O HIS A 133 -15.312 15.586 21.530 1.00 72.44 O ATOM 2246 CB HIS A 133 -16.231 13.233 19.709 1.00 40.03 C ATOM 2247 CG HIS A 133 -17.668 12.924 20.050 1.00 2.44 C ATOM 2248 ND1 HIS A 133 -18.145 12.892 21.342 1.00 44.35 N ATOM 2249 CD2 HIS A 133 -18.728 12.621 19.261 1.00 52.23 C ATOM 2250 CE1 HIS A 133 -19.420 12.574 21.332 1.00 60.41 C ATOM 2251 NE2 HIS A 133 -19.802 12.404 20.086 1.00 34.31 N ATOM 0 H HIS A 133 -13.956 15.320 19.589 1.00 63.04 H new ATOM 0 HA HIS A 133 -16.638 15.025 18.590 1.00 0.12 H new ATOM 0 HB2 HIS A 133 -15.935 12.621 18.857 1.00 40.03 H new ATOM 0 HB3 HIS A 133 -15.601 12.937 20.548 1.00 40.03 H new ATOM 0 HD2 HIS A 133 -18.727 12.562 18.183 1.00 52.23 H new ATOM 0 HE1 HIS A 133 -20.050 12.470 22.203 1.00 60.41 H new ATOM 0 HE2 HIS A 133 -20.743 12.152 19.782 1.00 34.31 H new ATOM 2260 N HIS A 134 -17.280 16.300 20.643 1.00 72.34 N ATOM 2261 CA HIS A 134 -17.674 17.150 21.771 1.00 25.12 C ATOM 2262 C HIS A 134 -18.324 16.283 22.868 1.00 43.24 C ATOM 2263 O HIS A 134 -19.358 15.641 22.587 1.00 52.14 O ATOM 2264 CB HIS A 134 -18.630 18.272 21.300 1.00 54.12 C ATOM 2265 CG HIS A 134 -18.008 19.219 20.304 1.00 60.14 C ATOM 2266 ND1 HIS A 134 -17.219 20.286 20.677 1.00 23.24 N ATOM 2267 CD2 HIS A 134 -18.050 19.251 18.950 1.00 50.23 C ATOM 2268 CE1 HIS A 134 -16.812 20.929 19.604 1.00 11.35 C ATOM 2269 NE2 HIS A 134 -17.299 20.323 18.542 1.00 74.15 N ATOM 2270 OXT HIS A 134 -17.803 16.237 24.003 1.00 37.83 O ATOM 0 H HIS A 134 -17.949 16.309 19.873 1.00 72.34 H new ATOM 0 HA HIS A 134 -16.788 17.629 22.187 1.00 25.12 H new ATOM 0 HB2 HIS A 134 -19.516 17.819 20.854 1.00 54.12 H new ATOM 0 HB3 HIS A 134 -18.965 18.840 22.168 1.00 54.12 H new ATOM 0 HD2 HIS A 134 -18.578 18.559 18.310 1.00 50.23 H new ATOM 0 HE1 HIS A 134 -16.183 21.807 19.596 1.00 11.35 H new ATOM 0 HE2 HIS A 134 -17.143 20.605 17.574 1.00 74.15 H new TER 2279 HIS A 134