USER MOD reduce.3.24.130724 H: found=0, std=0, add=1290, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1288 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: B 57 LYS NZ :NH3+ -131:sc= 1.75 (180deg=-0.0727) USER MOD Set 1.2: B 64 TYR OH : rot -19:sc= 0.0507 USER MOD Set 2.1: A 50 ASN : amide:sc= 1.04 K(o=2.3,f=-4.7) USER MOD Set 2.2: B 3 LYS NZ :NH3+ -113:sc= 1.28 (180deg=0) USER MOD Single : A 1 MET CE :methyl -135:sc= -0.335 (180deg=-1.34) USER MOD Single : A 1 MET N :NH3+ -161:sc= 1.03 (180deg=-0.045!) USER MOD Single : A 3 LYS NZ :NH3+ -157:sc= -0.655 (180deg=-1.91!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.507 K(o=0.51,f=-0.9) USER MOD Single : A 12 LYS NZ :NH3+ -133:sc= -1.25 (180deg=-3.18!) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= -0.46 X(o=-0.46,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 35 SER OG : rot 180:sc= -0.004 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 77:sc= 0.194 USER MOD Single : A 51 LYS NZ :NH3+ 159:sc= -0.698 (180deg=-1.07) USER MOD Single : A 57 LYS NZ :NH3+ -144:sc= 0.274 (180deg=-2.75!) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 64 TYR OH : rot -77:sc= 0.207 USER MOD Single : A 65 ASN : amide:sc= -1.54 K(o=-1.5,f=-4.6!) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 SER OG : rot 180:sc= -0.0833 USER MOD Single : A 77 HIS : no HE2:sc= 0.0998 K(o=0.1,f=-0.88) USER MOD Single : A 78 HIS : no HD1:sc= 0.157 K(o=0.16,f=-0.65) USER MOD Single : A 79 HIS : no HE2:sc= 0.106 K(o=0.11,f=-0.99) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.14) USER MOD Single : B 1 MET CE :methyl 178:sc= 0 (180deg=-0.00354) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 ASN : amide:sc= -0.669 X(o=-0.67,f=-0.33) USER MOD Single : B 12 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0133) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 24 SER OG : rot -58:sc= 0.112 USER MOD Single : B 31 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0755) USER MOD Single : B 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 39 THR OG1 : rot 76:sc= 0.821 USER MOD Single : B 50 ASN : amide:sc= 0.705 K(o=0.7,f=-4.5!) USER MOD Single : B 51 LYS NZ :NH3+ 164:sc= 0.315 (180deg=0.204) USER MOD Single : B 58 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : B 65 ASN : amide:sc= -3.26! C(o=-3.3!,f=-8.1!) USER MOD Single : B 68 HIS : no HE2:sc= 0.227 K(o=0.23,f=-0.88) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD Single : B 77 HIS : no HD1:sc= -0.042 X(o=-0.042,f=-0.15) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=-0.0018) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.703 16.777 1.964 1.00 24.43 N ATOM 2 CA MET A 1 0.211 16.681 2.092 1.00 24.32 C ATOM 3 C MET A 1 -0.256 15.208 2.186 1.00 24.40 C ATOM 4 O MET A 1 -1.240 14.895 2.865 1.00 22.01 O ATOM 5 CB MET A 1 -0.485 17.404 0.897 1.00 53.23 C ATOM 6 CG MET A 1 -0.299 16.734 -0.480 1.00 72.24 C ATOM 7 SD MET A 1 1.439 16.504 -0.916 1.00 44.14 S ATOM 8 CE MET A 1 1.323 15.658 -2.489 1.00 51.41 C ATOM 0 H1 MET A 1 2.013 17.735 2.223 1.00 24.43 H new ATOM 0 H2 MET A 1 2.151 16.085 2.598 1.00 24.43 H new ATOM 0 H3 MET A 1 1.981 16.577 0.982 1.00 24.43 H new ATOM 0 HA MET A 1 -0.078 17.178 3.018 1.00 24.32 H new ATOM 0 HB2 MET A 1 -1.552 17.473 1.108 1.00 53.23 H new ATOM 0 HB3 MET A 1 -0.105 18.424 0.840 1.00 53.23 H new ATOM 0 HG2 MET A 1 -0.800 15.766 -0.479 1.00 72.24 H new ATOM 0 HG3 MET A 1 -0.783 17.343 -1.244 1.00 72.24 H new ATOM 0 HE1 MET A 1 2.026 14.825 -2.507 1.00 51.41 H new ATOM 0 HE2 MET A 1 0.310 15.280 -2.625 1.00 51.41 H new ATOM 0 HE3 MET A 1 1.563 16.352 -3.294 1.00 51.41 H new ATOM 20 N ASP A 2 0.497 14.325 1.511 1.00 33.53 N ATOM 21 CA ASP A 2 0.195 12.883 1.362 1.00 3.45 C ATOM 22 C ASP A 2 -0.011 12.133 2.701 1.00 15.44 C ATOM 23 O ASP A 2 -0.815 11.204 2.772 1.00 13.15 O ATOM 24 CB ASP A 2 1.347 12.225 0.565 1.00 10.23 C ATOM 25 CG ASP A 2 2.736 12.440 1.204 1.00 73.11 C ATOM 26 OD1 ASP A 2 3.285 13.565 1.080 1.00 2.20 O ATOM 27 OD2 ASP A 2 3.277 11.499 1.830 1.00 62.04 O ATOM 0 H ASP A 2 1.359 14.597 1.038 1.00 33.53 H new ATOM 0 HA ASP A 2 -0.757 12.808 0.836 1.00 3.45 H new ATOM 0 HB2 ASP A 2 1.156 11.155 0.481 1.00 10.23 H new ATOM 0 HB3 ASP A 2 1.355 12.628 -0.448 1.00 10.23 H new ATOM 32 N LYS A 3 0.709 12.568 3.745 1.00 65.32 N ATOM 33 CA LYS A 3 0.777 11.864 5.045 1.00 55.23 C ATOM 34 C LYS A 3 -0.607 11.814 5.761 1.00 52.25 C ATOM 35 O LYS A 3 -0.980 10.779 6.330 1.00 24.52 O ATOM 36 CB LYS A 3 1.856 12.545 5.940 1.00 52.05 C ATOM 37 CG LYS A 3 2.585 11.602 6.921 1.00 20.55 C ATOM 38 CD LYS A 3 3.441 10.507 6.218 1.00 64.12 C ATOM 39 CE LYS A 3 4.744 11.020 5.561 1.00 74.44 C ATOM 40 NZ LYS A 3 4.527 11.906 4.381 1.00 24.22 N ATOM 0 H LYS A 3 1.266 13.422 3.717 1.00 65.32 H new ATOM 0 HA LYS A 3 1.061 10.828 4.862 1.00 55.23 H new ATOM 0 HB2 LYS A 3 2.597 13.015 5.294 1.00 52.05 H new ATOM 0 HB3 LYS A 3 1.381 13.342 6.512 1.00 52.05 H new ATOM 0 HG2 LYS A 3 3.231 12.195 7.569 1.00 20.55 H new ATOM 0 HG3 LYS A 3 1.848 11.118 7.562 1.00 20.55 H new ATOM 0 HD2 LYS A 3 3.698 9.742 6.950 1.00 64.12 H new ATOM 0 HD3 LYS A 3 2.831 10.025 5.454 1.00 64.12 H new ATOM 0 HE2 LYS A 3 5.324 11.563 6.307 1.00 74.44 H new ATOM 0 HE3 LYS A 3 5.344 10.164 5.253 1.00 74.44 H new ATOM 0 HZ1 LYS A 3 5.373 11.893 3.777 1.00 24.22 H new ATOM 0 HZ2 LYS A 3 3.708 11.566 3.837 1.00 24.22 H new ATOM 0 HZ3 LYS A 3 4.348 12.878 4.705 1.00 24.22 H new ATOM 54 N LYS A 4 -1.367 12.935 5.708 1.00 23.04 N ATOM 55 CA LYS A 4 -2.739 12.999 6.284 1.00 31.44 C ATOM 56 C LYS A 4 -3.791 12.400 5.326 1.00 3.00 C ATOM 57 O LYS A 4 -4.861 11.979 5.770 1.00 63.02 O ATOM 58 CB LYS A 4 -3.144 14.453 6.657 1.00 51.41 C ATOM 59 CG LYS A 4 -3.257 15.448 5.473 1.00 15.13 C ATOM 60 CD LYS A 4 -3.936 16.786 5.869 1.00 32.41 C ATOM 61 CE LYS A 4 -3.210 17.529 7.011 1.00 24.13 C ATOM 62 NZ LYS A 4 -1.820 17.903 6.648 1.00 63.35 N ATOM 0 H LYS A 4 -1.058 13.805 5.275 1.00 23.04 H new ATOM 0 HA LYS A 4 -2.714 12.401 7.195 1.00 31.44 H new ATOM 0 HB2 LYS A 4 -4.104 14.422 7.173 1.00 51.41 H new ATOM 0 HB3 LYS A 4 -2.413 14.843 7.366 1.00 51.41 H new ATOM 0 HG2 LYS A 4 -2.261 15.654 5.082 1.00 15.13 H new ATOM 0 HG3 LYS A 4 -3.825 14.983 4.667 1.00 15.13 H new ATOM 0 HD2 LYS A 4 -3.980 17.435 4.994 1.00 32.41 H new ATOM 0 HD3 LYS A 4 -4.964 16.587 6.171 1.00 32.41 H new ATOM 0 HE2 LYS A 4 -3.770 18.428 7.270 1.00 24.13 H new ATOM 0 HE3 LYS A 4 -3.193 16.897 7.899 1.00 24.13 H new ATOM 0 HZ1 LYS A 4 -1.374 18.399 7.446 1.00 63.35 H new ATOM 0 HZ2 LYS A 4 -1.276 17.045 6.427 1.00 63.35 H new ATOM 0 HZ3 LYS A 4 -1.834 18.528 5.817 1.00 63.35 H new ATOM 76 N ILE A 5 -3.498 12.415 4.008 1.00 52.10 N ATOM 77 CA ILE A 5 -4.382 11.814 2.979 1.00 71.31 C ATOM 78 C ILE A 5 -4.483 10.283 3.172 1.00 64.30 C ATOM 79 O ILE A 5 -5.570 9.754 3.410 1.00 33.13 O ATOM 80 CB ILE A 5 -3.897 12.163 1.513 1.00 35.33 C ATOM 81 CG1 ILE A 5 -3.947 13.707 1.284 1.00 64.41 C ATOM 82 CG2 ILE A 5 -4.722 11.414 0.428 1.00 53.32 C ATOM 83 CD1 ILE A 5 -3.429 14.183 -0.073 1.00 13.54 C ATOM 0 H ILE A 5 -2.652 12.839 3.627 1.00 52.10 H new ATOM 0 HA ILE A 5 -5.374 12.246 3.107 1.00 71.31 H new ATOM 0 HB ILE A 5 -2.866 11.823 1.416 1.00 35.33 H new ATOM 0 HG12 ILE A 5 -4.978 14.042 1.399 1.00 64.41 H new ATOM 0 HG13 ILE A 5 -3.365 14.193 2.067 1.00 64.41 H new ATOM 0 HG21 ILE A 5 -4.353 11.685 -0.561 1.00 53.32 H new ATOM 0 HG22 ILE A 5 -4.620 10.338 0.571 1.00 53.32 H new ATOM 0 HG23 ILE A 5 -5.772 11.693 0.512 1.00 53.32 H new ATOM 0 HD11 ILE A 5 -3.507 15.269 -0.132 1.00 13.54 H new ATOM 0 HD12 ILE A 5 -2.386 13.887 -0.189 1.00 13.54 H new ATOM 0 HD13 ILE A 5 -4.024 13.733 -0.868 1.00 13.54 H new ATOM 95 N VAL A 6 -3.329 9.588 3.105 1.00 23.41 N ATOM 96 CA VAL A 6 -3.257 8.123 3.318 1.00 62.52 C ATOM 97 C VAL A 6 -3.699 7.727 4.755 1.00 12.40 C ATOM 98 O VAL A 6 -4.209 6.631 4.962 1.00 43.01 O ATOM 99 CB VAL A 6 -1.818 7.560 3.000 1.00 53.13 C ATOM 100 CG1 VAL A 6 -1.436 7.833 1.520 1.00 62.03 C ATOM 101 CG2 VAL A 6 -0.750 8.130 3.972 1.00 51.43 C ATOM 0 H VAL A 6 -2.427 10.019 2.904 1.00 23.41 H new ATOM 0 HA VAL A 6 -3.957 7.667 2.618 1.00 62.52 H new ATOM 0 HB VAL A 6 -1.844 6.481 3.151 1.00 53.13 H new ATOM 0 HG11 VAL A 6 -0.440 7.437 1.322 1.00 62.03 H new ATOM 0 HG12 VAL A 6 -2.157 7.347 0.863 1.00 62.03 H new ATOM 0 HG13 VAL A 6 -1.442 8.907 1.335 1.00 62.03 H new ATOM 0 HG21 VAL A 6 0.227 7.718 3.720 1.00 51.43 H new ATOM 0 HG22 VAL A 6 -0.720 9.216 3.884 1.00 51.43 H new ATOM 0 HG23 VAL A 6 -1.006 7.856 4.995 1.00 51.43 H new ATOM 111 N GLY A 7 -3.519 8.660 5.720 1.00 21.14 N ATOM 112 CA GLY A 7 -4.025 8.500 7.094 1.00 4.23 C ATOM 113 C GLY A 7 -5.558 8.532 7.184 1.00 44.35 C ATOM 114 O GLY A 7 -6.173 7.718 7.888 1.00 23.04 O ATOM 0 H GLY A 7 -3.022 9.537 5.564 1.00 21.14 H new ATOM 0 HA2 GLY A 7 -3.664 7.555 7.499 1.00 4.23 H new ATOM 0 HA3 GLY A 7 -3.615 9.293 7.720 1.00 4.23 H new ATOM 118 N ALA A 8 -6.168 9.479 6.446 1.00 12.54 N ATOM 119 CA ALA A 8 -7.636 9.663 6.399 1.00 55.23 C ATOM 120 C ALA A 8 -8.346 8.444 5.759 1.00 61.02 C ATOM 121 O ALA A 8 -9.337 7.929 6.290 1.00 1.35 O ATOM 122 CB ALA A 8 -7.978 10.953 5.634 1.00 70.33 C ATOM 0 H ALA A 8 -5.657 10.142 5.863 1.00 12.54 H new ATOM 0 HA ALA A 8 -7.999 9.748 7.423 1.00 55.23 H new ATOM 0 HB1 ALA A 8 -9.060 11.082 5.603 1.00 70.33 H new ATOM 0 HB2 ALA A 8 -7.525 11.806 6.139 1.00 70.33 H new ATOM 0 HB3 ALA A 8 -7.592 10.886 4.617 1.00 70.33 H new ATOM 128 N ASN A 9 -7.806 7.980 4.619 1.00 14.31 N ATOM 129 CA ASN A 9 -8.341 6.807 3.890 1.00 34.13 C ATOM 130 C ASN A 9 -8.098 5.480 4.650 1.00 45.30 C ATOM 131 O ASN A 9 -8.887 4.538 4.526 1.00 31.34 O ATOM 132 CB ASN A 9 -7.738 6.741 2.466 1.00 60.32 C ATOM 133 CG ASN A 9 -8.142 7.947 1.610 1.00 54.11 C ATOM 134 OD1 ASN A 9 -9.252 8.008 1.091 1.00 40.22 O ATOM 135 ND2 ASN A 9 -7.242 8.889 1.407 1.00 33.55 N ATOM 0 H ASN A 9 -6.990 8.402 4.175 1.00 14.31 H new ATOM 0 HA ASN A 9 -9.421 6.935 3.815 1.00 34.13 H new ATOM 0 HB2 ASN A 9 -6.651 6.694 2.535 1.00 60.32 H new ATOM 0 HB3 ASN A 9 -8.066 5.824 1.977 1.00 60.32 H new ATOM 0 HD21 ASN A 9 -7.463 9.686 0.810 1.00 33.55 H new ATOM 0 HD22 ASN A 9 -6.324 8.821 1.847 1.00 33.55 H new ATOM 142 N ALA A 10 -7.025 5.433 5.464 1.00 51.22 N ATOM 143 CA ALA A 10 -6.662 4.238 6.261 1.00 44.31 C ATOM 144 C ALA A 10 -7.666 3.982 7.404 1.00 22.14 C ATOM 145 O ALA A 10 -8.001 2.831 7.704 1.00 33.20 O ATOM 146 CB ALA A 10 -5.248 4.398 6.817 1.00 13.24 C ATOM 0 H ALA A 10 -6.386 6.218 5.589 1.00 51.22 H new ATOM 0 HA ALA A 10 -6.697 3.371 5.602 1.00 44.31 H new ATOM 0 HB1 ALA A 10 -4.985 3.517 7.402 1.00 13.24 H new ATOM 0 HB2 ALA A 10 -4.543 4.509 5.993 1.00 13.24 H new ATOM 0 HB3 ALA A 10 -5.205 5.282 7.453 1.00 13.24 H new ATOM 152 N GLY A 11 -8.151 5.076 8.022 1.00 11.32 N ATOM 153 CA GLY A 11 -9.158 4.989 9.085 1.00 64.40 C ATOM 154 C GLY A 11 -10.485 4.376 8.609 1.00 24.41 C ATOM 155 O GLY A 11 -11.134 3.617 9.343 1.00 54.13 O ATOM 0 H GLY A 11 -7.859 6.028 7.800 1.00 11.32 H new ATOM 0 HA2 GLY A 11 -8.761 4.390 9.905 1.00 64.40 H new ATOM 0 HA3 GLY A 11 -9.347 5.987 9.481 1.00 64.40 H new ATOM 159 N LYS A 12 -10.883 4.711 7.365 1.00 11.43 N ATOM 160 CA LYS A 12 -12.145 4.227 6.767 1.00 23.33 C ATOM 161 C LYS A 12 -12.049 2.751 6.291 1.00 42.04 C ATOM 162 O LYS A 12 -12.992 1.972 6.492 1.00 4.41 O ATOM 163 CB LYS A 12 -12.593 5.139 5.596 1.00 22.13 C ATOM 164 CG LYS A 12 -14.052 4.890 5.162 1.00 25.24 C ATOM 165 CD LYS A 12 -14.504 5.737 3.959 1.00 33.31 C ATOM 166 CE LYS A 12 -16.018 5.597 3.701 1.00 11.44 C ATOM 167 NZ LYS A 12 -16.442 4.176 3.509 1.00 11.22 N ATOM 0 H LYS A 12 -10.344 5.320 6.750 1.00 11.43 H new ATOM 0 HA LYS A 12 -12.897 4.268 7.555 1.00 23.33 H new ATOM 0 HB2 LYS A 12 -12.481 6.182 5.892 1.00 22.13 H new ATOM 0 HB3 LYS A 12 -11.933 4.977 4.744 1.00 22.13 H new ATOM 0 HG2 LYS A 12 -14.171 3.835 4.915 1.00 25.24 H new ATOM 0 HG3 LYS A 12 -14.711 5.096 6.006 1.00 25.24 H new ATOM 0 HD2 LYS A 12 -14.261 6.784 4.139 1.00 33.31 H new ATOM 0 HD3 LYS A 12 -13.953 5.430 3.070 1.00 33.31 H new ATOM 0 HE2 LYS A 12 -16.566 6.025 4.540 1.00 11.44 H new ATOM 0 HE3 LYS A 12 -16.287 6.175 2.817 1.00 11.44 H new ATOM 0 HZ1 LYS A 12 -17.058 4.107 2.674 1.00 11.22 H new ATOM 0 HZ2 LYS A 12 -15.602 3.579 3.370 1.00 11.22 H new ATOM 0 HZ3 LYS A 12 -16.961 3.852 4.350 1.00 11.22 H new ATOM 181 N VAL A 13 -10.920 2.366 5.641 1.00 14.01 N ATOM 182 CA VAL A 13 -10.723 0.965 5.167 1.00 22.14 C ATOM 183 C VAL A 13 -10.654 -0.022 6.360 1.00 24.05 C ATOM 184 O VAL A 13 -11.140 -1.152 6.270 1.00 1.22 O ATOM 185 CB VAL A 13 -9.461 0.795 4.224 1.00 13.44 C ATOM 186 CG1 VAL A 13 -9.560 1.710 2.981 1.00 3.31 C ATOM 187 CG2 VAL A 13 -8.127 1.031 4.969 1.00 41.11 C ATOM 0 H VAL A 13 -10.142 2.992 5.434 1.00 14.01 H new ATOM 0 HA VAL A 13 -11.596 0.725 4.561 1.00 22.14 H new ATOM 0 HB VAL A 13 -9.464 -0.243 3.891 1.00 13.44 H new ATOM 0 HG11 VAL A 13 -8.679 1.569 2.355 1.00 3.31 H new ATOM 0 HG12 VAL A 13 -10.454 1.455 2.412 1.00 3.31 H new ATOM 0 HG13 VAL A 13 -9.617 2.751 3.299 1.00 3.31 H new ATOM 0 HG21 VAL A 13 -7.296 0.902 4.276 1.00 41.11 H new ATOM 0 HG22 VAL A 13 -8.110 2.044 5.372 1.00 41.11 H new ATOM 0 HG23 VAL A 13 -8.034 0.314 5.785 1.00 41.11 H new ATOM 197 N TRP A 14 -10.078 0.447 7.490 1.00 62.14 N ATOM 198 CA TRP A 14 -10.016 -0.331 8.749 1.00 15.42 C ATOM 199 C TRP A 14 -11.418 -0.473 9.399 1.00 74.12 C ATOM 200 O TRP A 14 -11.707 -1.482 10.043 1.00 73.12 O ATOM 201 CB TRP A 14 -9.017 0.302 9.752 1.00 25.53 C ATOM 202 CG TRP A 14 -8.622 -0.632 10.881 1.00 43.01 C ATOM 203 CD1 TRP A 14 -7.614 -1.549 10.877 1.00 32.33 C ATOM 204 CD2 TRP A 14 -9.255 -0.752 12.160 1.00 0.23 C ATOM 205 NE1 TRP A 14 -7.568 -2.204 12.082 1.00 52.33 N ATOM 206 CE2 TRP A 14 -8.568 -1.737 12.884 1.00 70.12 C ATOM 207 CE3 TRP A 14 -10.331 -0.107 12.750 1.00 54.44 C ATOM 208 CZ2 TRP A 14 -8.928 -2.097 14.181 1.00 44.22 C ATOM 209 CZ3 TRP A 14 -10.701 -0.456 14.035 1.00 25.14 C ATOM 210 CH2 TRP A 14 -9.997 -1.444 14.743 1.00 11.50 C ATOM 0 H TRP A 14 -9.646 1.369 7.556 1.00 62.14 H new ATOM 0 HA TRP A 14 -9.659 -1.329 8.493 1.00 15.42 H new ATOM 0 HB2 TRP A 14 -8.120 0.610 9.215 1.00 25.53 H new ATOM 0 HB3 TRP A 14 -9.460 1.204 10.175 1.00 25.53 H new ATOM 0 HD1 TRP A 14 -6.948 -1.733 10.047 1.00 32.33 H new ATOM 0 HE1 TRP A 14 -6.893 -2.925 12.337 1.00 52.33 H new ATOM 0 HE3 TRP A 14 -10.873 0.658 12.213 1.00 54.44 H new ATOM 0 HZ2 TRP A 14 -8.388 -2.859 14.723 1.00 44.22 H new ATOM 0 HZ3 TRP A 14 -11.542 0.037 14.501 1.00 25.14 H new ATOM 0 HH2 TRP A 14 -10.302 -1.695 15.748 1.00 11.50 H new ATOM 221 N HIS A 15 -12.270 0.557 9.242 1.00 42.34 N ATOM 222 CA HIS A 15 -13.682 0.524 9.713 1.00 12.43 C ATOM 223 C HIS A 15 -14.473 -0.604 8.993 1.00 61.12 C ATOM 224 O HIS A 15 -15.298 -1.296 9.608 1.00 43.43 O ATOM 225 CB HIS A 15 -14.342 1.905 9.468 1.00 24.15 C ATOM 226 CG HIS A 15 -15.715 2.086 10.073 1.00 41.41 C ATOM 227 ND1 HIS A 15 -15.915 2.656 11.313 1.00 34.33 N ATOM 228 CD2 HIS A 15 -16.956 1.796 9.599 1.00 53.54 C ATOM 229 CE1 HIS A 15 -17.204 2.707 11.575 1.00 51.33 C ATOM 230 NE2 HIS A 15 -17.857 2.197 10.553 1.00 24.24 N ATOM 0 H HIS A 15 -12.009 1.433 8.789 1.00 42.34 H new ATOM 0 HA HIS A 15 -13.698 0.310 10.782 1.00 12.43 H new ATOM 0 HB2 HIS A 15 -13.684 2.678 9.865 1.00 24.15 H new ATOM 0 HB3 HIS A 15 -14.413 2.069 8.393 1.00 24.15 H new ATOM 0 HD2 HIS A 15 -17.189 1.336 8.650 1.00 53.54 H new ATOM 0 HE1 HIS A 15 -17.650 3.101 12.476 1.00 51.33 H new ATOM 0 HE2 HIS A 15 -18.871 2.113 10.481 1.00 24.24 H new ATOM 239 N ALA A 16 -14.192 -0.770 7.687 1.00 14.05 N ATOM 240 CA ALA A 16 -14.764 -1.859 6.859 1.00 23.34 C ATOM 241 C ALA A 16 -14.190 -3.253 7.253 1.00 43.31 C ATOM 242 O ALA A 16 -14.884 -4.269 7.150 1.00 22.42 O ATOM 243 CB ALA A 16 -14.517 -1.564 5.373 1.00 24.41 C ATOM 0 H ALA A 16 -13.562 -0.155 7.172 1.00 14.05 H new ATOM 0 HA ALA A 16 -15.838 -1.897 7.043 1.00 23.34 H new ATOM 0 HB1 ALA A 16 -14.939 -2.366 4.768 1.00 24.41 H new ATOM 0 HB2 ALA A 16 -14.992 -0.620 5.106 1.00 24.41 H new ATOM 0 HB3 ALA A 16 -13.445 -1.496 5.189 1.00 24.41 H new ATOM 249 N LEU A 17 -12.914 -3.277 7.691 1.00 53.43 N ATOM 250 CA LEU A 17 -12.248 -4.490 8.242 1.00 53.32 C ATOM 251 C LEU A 17 -12.827 -4.885 9.626 1.00 30.20 C ATOM 252 O LEU A 17 -12.914 -6.070 9.965 1.00 75.32 O ATOM 253 CB LEU A 17 -10.726 -4.235 8.378 1.00 51.44 C ATOM 254 CG LEU A 17 -9.921 -4.089 7.052 1.00 44.34 C ATOM 255 CD1 LEU A 17 -8.513 -3.510 7.321 1.00 12.21 C ATOM 256 CD2 LEU A 17 -9.852 -5.441 6.306 1.00 33.31 C ATOM 0 H LEU A 17 -12.309 -2.456 7.675 1.00 53.43 H new ATOM 0 HA LEU A 17 -12.432 -5.312 7.550 1.00 53.32 H new ATOM 0 HB2 LEU A 17 -10.584 -3.327 8.964 1.00 51.44 H new ATOM 0 HB3 LEU A 17 -10.293 -5.055 8.951 1.00 51.44 H new ATOM 0 HG LEU A 17 -10.443 -3.382 6.407 1.00 44.34 H new ATOM 0 HD11 LEU A 17 -7.971 -3.418 6.380 1.00 12.21 H new ATOM 0 HD12 LEU A 17 -8.606 -2.527 7.784 1.00 12.21 H new ATOM 0 HD13 LEU A 17 -7.967 -4.176 7.990 1.00 12.21 H new ATOM 0 HD21 LEU A 17 -9.286 -5.319 5.383 1.00 33.31 H new ATOM 0 HD22 LEU A 17 -9.360 -6.181 6.938 1.00 33.31 H new ATOM 0 HD23 LEU A 17 -10.861 -5.779 6.071 1.00 33.31 H new ATOM 268 N ASN A 18 -13.196 -3.873 10.435 1.00 42.45 N ATOM 269 CA ASN A 18 -13.802 -4.089 11.773 1.00 50.24 C ATOM 270 C ASN A 18 -15.222 -4.710 11.629 1.00 33.41 C ATOM 271 O ASN A 18 -15.706 -5.403 12.530 1.00 51.24 O ATOM 272 CB ASN A 18 -13.841 -2.744 12.556 1.00 71.30 C ATOM 273 CG ASN A 18 -14.292 -2.861 14.023 1.00 22.13 C ATOM 274 OD1 ASN A 18 -14.947 -1.968 14.553 1.00 21.23 O ATOM 275 ND2 ASN A 18 -13.917 -3.934 14.707 1.00 25.21 N ATOM 0 H ASN A 18 -13.086 -2.890 10.187 1.00 42.45 H new ATOM 0 HA ASN A 18 -13.192 -4.793 12.339 1.00 50.24 H new ATOM 0 HB2 ASN A 18 -12.847 -2.297 12.531 1.00 71.30 H new ATOM 0 HB3 ASN A 18 -14.512 -2.058 12.038 1.00 71.30 H new ATOM 0 HD21 ASN A 18 -14.173 -4.027 15.690 1.00 25.21 H new ATOM 0 HD22 ASN A 18 -13.373 -4.666 14.250 1.00 25.21 H new ATOM 282 N GLU A 19 -15.865 -4.453 10.470 1.00 60.44 N ATOM 283 CA GLU A 19 -17.115 -5.129 10.056 1.00 30.52 C ATOM 284 C GLU A 19 -16.814 -6.553 9.507 1.00 13.35 C ATOM 285 O GLU A 19 -17.473 -7.534 9.887 1.00 3.23 O ATOM 286 CB GLU A 19 -17.838 -4.280 8.971 1.00 34.31 C ATOM 287 CG GLU A 19 -19.079 -4.957 8.345 1.00 65.41 C ATOM 288 CD GLU A 19 -19.731 -4.133 7.222 1.00 45.54 C ATOM 289 OE1 GLU A 19 -19.176 -4.081 6.102 1.00 51.21 O ATOM 290 OE2 GLU A 19 -20.801 -3.523 7.450 1.00 73.35 O ATOM 0 H GLU A 19 -15.531 -3.768 9.792 1.00 60.44 H new ATOM 0 HA GLU A 19 -17.763 -5.227 10.927 1.00 30.52 H new ATOM 0 HB2 GLU A 19 -18.142 -3.332 9.414 1.00 34.31 H new ATOM 0 HB3 GLU A 19 -17.128 -4.048 8.177 1.00 34.31 H new ATOM 0 HG2 GLU A 19 -18.790 -5.930 7.949 1.00 65.41 H new ATOM 0 HG3 GLU A 19 -19.817 -5.137 9.127 1.00 65.41 H new ATOM 297 N ALA A 20 -15.798 -6.646 8.618 1.00 34.53 N ATOM 298 CA ALA A 20 -15.419 -7.907 7.934 1.00 74.13 C ATOM 299 C ALA A 20 -13.934 -7.878 7.471 1.00 32.43 C ATOM 300 O ALA A 20 -13.604 -7.291 6.435 1.00 22.42 O ATOM 301 CB ALA A 20 -16.366 -8.167 6.741 1.00 55.12 C ATOM 0 H ALA A 20 -15.217 -5.850 8.354 1.00 34.53 H new ATOM 0 HA ALA A 20 -15.520 -8.726 8.646 1.00 74.13 H new ATOM 0 HB1 ALA A 20 -16.080 -9.095 6.245 1.00 55.12 H new ATOM 0 HB2 ALA A 20 -17.391 -8.249 7.102 1.00 55.12 H new ATOM 0 HB3 ALA A 20 -16.295 -7.341 6.034 1.00 55.12 H new ATOM 307 N ASP A 21 -13.034 -8.474 8.285 1.00 21.41 N ATOM 308 CA ASP A 21 -11.595 -8.626 7.940 1.00 33.03 C ATOM 309 C ASP A 21 -11.348 -9.909 7.106 1.00 14.55 C ATOM 310 O ASP A 21 -12.257 -10.737 6.939 1.00 23.35 O ATOM 311 CB ASP A 21 -10.725 -8.623 9.227 1.00 3.43 C ATOM 312 CG ASP A 21 -11.108 -9.731 10.224 1.00 72.21 C ATOM 313 OD1 ASP A 21 -10.577 -10.862 10.117 1.00 24.43 O ATOM 314 OD2 ASP A 21 -11.949 -9.482 11.114 1.00 45.13 O ATOM 0 H ASP A 21 -13.279 -8.863 9.196 1.00 21.41 H new ATOM 0 HA ASP A 21 -11.303 -7.774 7.325 1.00 33.03 H new ATOM 0 HB2 ASP A 21 -9.678 -8.740 8.949 1.00 3.43 H new ATOM 0 HB3 ASP A 21 -10.818 -7.654 9.718 1.00 3.43 H new ATOM 319 N GLY A 22 -10.108 -10.072 6.601 1.00 10.33 N ATOM 320 CA GLY A 22 -9.767 -11.208 5.723 1.00 20.54 C ATOM 321 C GLY A 22 -10.325 -11.069 4.299 1.00 52.31 C ATOM 322 O GLY A 22 -10.278 -12.013 3.504 1.00 23.03 O ATOM 0 H GLY A 22 -9.332 -9.436 6.785 1.00 10.33 H new ATOM 0 HA2 GLY A 22 -8.683 -11.305 5.672 1.00 20.54 H new ATOM 0 HA3 GLY A 22 -10.149 -12.128 6.167 1.00 20.54 H new ATOM 326 N ILE A 23 -10.852 -9.872 3.997 1.00 60.30 N ATOM 327 CA ILE A 23 -11.372 -9.505 2.670 1.00 70.43 C ATOM 328 C ILE A 23 -10.182 -9.181 1.722 1.00 5.12 C ATOM 329 O ILE A 23 -9.070 -8.916 2.193 1.00 74.51 O ATOM 330 CB ILE A 23 -12.359 -8.274 2.826 1.00 71.20 C ATOM 331 CG1 ILE A 23 -13.114 -7.943 1.502 1.00 24.44 C ATOM 332 CG2 ILE A 23 -11.617 -7.027 3.370 1.00 54.31 C ATOM 333 CD1 ILE A 23 -14.186 -6.865 1.631 1.00 2.13 C ATOM 0 H ILE A 23 -10.930 -9.119 4.680 1.00 60.30 H new ATOM 0 HA ILE A 23 -11.930 -10.332 2.231 1.00 70.43 H new ATOM 0 HB ILE A 23 -13.114 -8.568 3.555 1.00 71.20 H new ATOM 0 HG12 ILE A 23 -12.387 -7.625 0.755 1.00 24.44 H new ATOM 0 HG13 ILE A 23 -13.579 -8.855 1.127 1.00 24.44 H new ATOM 0 HG21 ILE A 23 -12.319 -6.199 3.466 1.00 54.31 H new ATOM 0 HG22 ILE A 23 -11.189 -7.255 4.346 1.00 54.31 H new ATOM 0 HG23 ILE A 23 -10.820 -6.748 2.681 1.00 54.31 H new ATOM 0 HD11 ILE A 23 -14.657 -6.702 0.661 1.00 2.13 H new ATOM 0 HD12 ILE A 23 -14.939 -7.185 2.351 1.00 2.13 H new ATOM 0 HD13 ILE A 23 -13.729 -5.936 1.973 1.00 2.13 H new ATOM 345 N SER A 24 -10.388 -9.261 0.395 1.00 2.41 N ATOM 346 CA SER A 24 -9.346 -8.867 -0.593 1.00 50.04 C ATOM 347 C SER A 24 -9.304 -7.332 -0.747 1.00 53.32 C ATOM 348 O SER A 24 -10.325 -6.658 -0.581 1.00 60.53 O ATOM 349 CB SER A 24 -9.593 -9.545 -1.962 1.00 23.14 C ATOM 350 OG SER A 24 -9.567 -10.958 -1.843 1.00 4.34 O ATOM 0 H SER A 24 -11.257 -9.591 -0.024 1.00 2.41 H new ATOM 0 HA SER A 24 -8.379 -9.206 -0.220 1.00 50.04 H new ATOM 0 HB2 SER A 24 -10.557 -9.228 -2.360 1.00 23.14 H new ATOM 0 HB3 SER A 24 -8.833 -9.223 -2.674 1.00 23.14 H new ATOM 0 HG SER A 24 -9.727 -11.363 -2.721 1.00 4.34 H new ATOM 356 N ILE A 25 -8.112 -6.798 -1.080 1.00 22.33 N ATOM 357 CA ILE A 25 -7.873 -5.336 -1.231 1.00 31.40 C ATOM 358 C ILE A 25 -8.855 -4.631 -2.246 1.00 12.12 C ATOM 359 O ILE A 25 -9.405 -3.579 -1.903 1.00 41.41 O ATOM 360 CB ILE A 25 -6.371 -5.051 -1.636 1.00 62.11 C ATOM 361 CG1 ILE A 25 -5.390 -5.625 -0.559 1.00 72.14 C ATOM 362 CG2 ILE A 25 -6.116 -3.543 -1.899 1.00 71.23 C ATOM 363 CD1 ILE A 25 -3.903 -5.476 -0.879 1.00 22.43 C ATOM 0 H ILE A 25 -7.281 -7.364 -1.254 1.00 22.33 H new ATOM 0 HA ILE A 25 -8.078 -4.901 -0.253 1.00 31.40 H new ATOM 0 HB ILE A 25 -6.178 -5.567 -2.576 1.00 62.11 H new ATOM 0 HG12 ILE A 25 -5.591 -5.130 0.391 1.00 72.14 H new ATOM 0 HG13 ILE A 25 -5.610 -6.683 -0.420 1.00 72.14 H new ATOM 0 HG21 ILE A 25 -5.072 -3.393 -2.174 1.00 71.23 H new ATOM 0 HG22 ILE A 25 -6.758 -3.202 -2.711 1.00 71.23 H new ATOM 0 HG23 ILE A 25 -6.339 -2.974 -0.997 1.00 71.23 H new ATOM 0 HD11 ILE A 25 -3.312 -5.905 -0.070 1.00 22.43 H new ATOM 0 HD12 ILE A 25 -3.677 -5.997 -1.809 1.00 22.43 H new ATOM 0 HD13 ILE A 25 -3.658 -4.419 -0.986 1.00 22.43 H new ATOM 375 N PRO A 26 -9.110 -5.176 -3.504 1.00 73.51 N ATOM 376 CA PRO A 26 -10.037 -4.524 -4.480 1.00 74.32 C ATOM 377 C PRO A 26 -11.533 -4.562 -4.053 1.00 12.21 C ATOM 378 O PRO A 26 -12.324 -3.719 -4.481 1.00 24.14 O ATOM 379 CB PRO A 26 -9.808 -5.331 -5.790 1.00 34.53 C ATOM 380 CG PRO A 26 -9.375 -6.680 -5.316 1.00 13.44 C ATOM 381 CD PRO A 26 -8.513 -6.411 -4.102 1.00 12.34 C ATOM 0 HA PRO A 26 -9.826 -3.459 -4.572 1.00 74.32 H new ATOM 0 HB2 PRO A 26 -10.719 -5.391 -6.385 1.00 34.53 H new ATOM 0 HB3 PRO A 26 -9.047 -4.866 -6.417 1.00 34.53 H new ATOM 0 HG2 PRO A 26 -10.233 -7.303 -5.061 1.00 13.44 H new ATOM 0 HG3 PRO A 26 -8.816 -7.209 -6.088 1.00 13.44 H new ATOM 0 HD2 PRO A 26 -8.537 -7.246 -3.402 1.00 12.34 H new ATOM 0 HD3 PRO A 26 -7.470 -6.257 -4.379 1.00 12.34 H new ATOM 389 N GLU A 27 -11.896 -5.535 -3.197 1.00 52.54 N ATOM 390 CA GLU A 27 -13.273 -5.682 -2.667 1.00 62.21 C ATOM 391 C GLU A 27 -13.513 -4.609 -1.596 1.00 40.30 C ATOM 392 O GLU A 27 -14.515 -3.895 -1.599 1.00 42.35 O ATOM 393 CB GLU A 27 -13.459 -7.085 -2.040 1.00 31.53 C ATOM 394 CG GLU A 27 -13.190 -8.270 -2.982 1.00 4.24 C ATOM 395 CD GLU A 27 -13.576 -9.620 -2.350 1.00 45.43 C ATOM 396 OE1 GLU A 27 -12.789 -10.164 -1.542 1.00 61.01 O ATOM 397 OE2 GLU A 27 -14.681 -10.136 -2.645 1.00 23.02 O ATOM 0 H GLU A 27 -11.248 -6.242 -2.851 1.00 52.54 H new ATOM 0 HA GLU A 27 -13.986 -5.564 -3.482 1.00 62.21 H new ATOM 0 HB2 GLU A 27 -12.796 -7.170 -1.179 1.00 31.53 H new ATOM 0 HB3 GLU A 27 -14.480 -7.165 -1.666 1.00 31.53 H new ATOM 0 HG2 GLU A 27 -13.751 -8.131 -3.906 1.00 4.24 H new ATOM 0 HG3 GLU A 27 -12.133 -8.286 -3.250 1.00 4.24 H new ATOM 404 N LEU A 28 -12.528 -4.530 -0.696 1.00 15.20 N ATOM 405 CA LEU A 28 -12.419 -3.515 0.363 1.00 1.12 C ATOM 406 C LEU A 28 -12.412 -2.074 -0.223 1.00 32.42 C ATOM 407 O LEU A 28 -13.013 -1.159 0.347 1.00 60.52 O ATOM 408 CB LEU A 28 -11.106 -3.805 1.128 1.00 41.05 C ATOM 409 CG LEU A 28 -10.738 -2.849 2.290 1.00 0.21 C ATOM 410 CD1 LEU A 28 -11.773 -2.908 3.433 1.00 44.12 C ATOM 411 CD2 LEU A 28 -9.312 -3.143 2.789 1.00 22.31 C ATOM 0 H LEU A 28 -11.755 -5.195 -0.682 1.00 15.20 H new ATOM 0 HA LEU A 28 -13.280 -3.569 1.029 1.00 1.12 H new ATOM 0 HB2 LEU A 28 -11.165 -4.817 1.529 1.00 41.05 H new ATOM 0 HB3 LEU A 28 -10.287 -3.794 0.409 1.00 41.05 H new ATOM 0 HG LEU A 28 -10.760 -1.828 1.910 1.00 0.21 H new ATOM 0 HD11 LEU A 28 -11.477 -2.223 4.227 1.00 44.12 H new ATOM 0 HD12 LEU A 28 -12.753 -2.620 3.052 1.00 44.12 H new ATOM 0 HD13 LEU A 28 -11.821 -3.923 3.828 1.00 44.12 H new ATOM 0 HD21 LEU A 28 -9.065 -2.465 3.606 1.00 22.31 H new ATOM 0 HD22 LEU A 28 -9.255 -4.172 3.143 1.00 22.31 H new ATOM 0 HD23 LEU A 28 -8.604 -3.001 1.972 1.00 22.31 H new ATOM 423 N ALA A 29 -11.727 -1.912 -1.375 1.00 2.42 N ATOM 424 CA ALA A 29 -11.677 -0.640 -2.137 1.00 32.00 C ATOM 425 C ALA A 29 -13.088 -0.171 -2.564 1.00 5.24 C ATOM 426 O ALA A 29 -13.424 1.011 -2.457 1.00 30.35 O ATOM 427 CB ALA A 29 -10.765 -0.801 -3.366 1.00 3.21 C ATOM 0 H ALA A 29 -11.189 -2.663 -1.807 1.00 2.42 H new ATOM 0 HA ALA A 29 -11.265 0.128 -1.483 1.00 32.00 H new ATOM 0 HB1 ALA A 29 -10.733 0.137 -3.921 1.00 3.21 H new ATOM 0 HB2 ALA A 29 -9.759 -1.064 -3.040 1.00 3.21 H new ATOM 0 HB3 ALA A 29 -11.156 -1.590 -4.009 1.00 3.21 H new ATOM 433 N ARG A 30 -13.907 -1.133 -3.015 1.00 63.43 N ATOM 434 CA ARG A 30 -15.316 -0.899 -3.407 1.00 42.03 C ATOM 435 C ARG A 30 -16.189 -0.493 -2.192 1.00 32.31 C ATOM 436 O ARG A 30 -17.072 0.357 -2.320 1.00 64.34 O ATOM 437 CB ARG A 30 -15.888 -2.175 -4.070 1.00 5.20 C ATOM 438 CG ARG A 30 -15.238 -2.542 -5.418 1.00 14.24 C ATOM 439 CD ARG A 30 -15.670 -3.927 -5.923 1.00 31.44 C ATOM 440 NE ARG A 30 -17.133 -4.078 -6.014 1.00 72.24 N ATOM 441 CZ ARG A 30 -17.762 -5.137 -6.475 1.00 14.41 C ATOM 442 NH1 ARG A 30 -17.113 -6.164 -6.941 1.00 73.43 N ATOM 443 NH2 ARG A 30 -19.053 -5.161 -6.462 1.00 43.55 N ATOM 0 H ARG A 30 -13.614 -2.104 -3.121 1.00 63.43 H new ATOM 0 HA ARG A 30 -15.337 -0.073 -4.118 1.00 42.03 H new ATOM 0 HB2 ARG A 30 -15.766 -3.012 -3.383 1.00 5.20 H new ATOM 0 HB3 ARG A 30 -16.959 -2.041 -4.222 1.00 5.20 H new ATOM 0 HG2 ARG A 30 -15.502 -1.790 -6.161 1.00 14.24 H new ATOM 0 HG3 ARG A 30 -14.153 -2.520 -5.312 1.00 14.24 H new ATOM 0 HD2 ARG A 30 -15.231 -4.102 -6.905 1.00 31.44 H new ATOM 0 HD3 ARG A 30 -15.273 -4.691 -5.255 1.00 31.44 H new ATOM 0 HE ARG A 30 -17.705 -3.297 -5.693 1.00 72.24 H new ATOM 0 HH11 ARG A 30 -16.093 -6.160 -6.954 1.00 73.43 H new ATOM 0 HH12 ARG A 30 -17.624 -6.973 -7.293 1.00 73.43 H new ATOM 0 HH21 ARG A 30 -19.574 -4.364 -6.097 1.00 43.55 H new ATOM 0 HH22 ARG A 30 -19.552 -5.977 -6.817 1.00 43.55 H new ATOM 457 N LYS A 31 -15.918 -1.103 -1.017 1.00 51.25 N ATOM 458 CA LYS A 31 -16.646 -0.800 0.249 1.00 21.50 C ATOM 459 C LYS A 31 -16.471 0.679 0.670 1.00 52.30 C ATOM 460 O LYS A 31 -17.388 1.309 1.213 1.00 44.31 O ATOM 461 CB LYS A 31 -16.146 -1.727 1.397 1.00 50.42 C ATOM 462 CG LYS A 31 -16.241 -3.243 1.098 1.00 64.35 C ATOM 463 CD LYS A 31 -17.680 -3.732 0.793 1.00 54.42 C ATOM 464 CE LYS A 31 -18.628 -3.605 1.997 1.00 13.21 C ATOM 465 NZ LYS A 31 -20.006 -4.036 1.663 1.00 32.44 N ATOM 0 H LYS A 31 -15.195 -1.815 -0.913 1.00 51.25 H new ATOM 0 HA LYS A 31 -17.705 -0.981 0.065 1.00 21.50 H new ATOM 0 HB2 LYS A 31 -15.108 -1.479 1.618 1.00 50.42 H new ATOM 0 HB3 LYS A 31 -16.724 -1.512 2.296 1.00 50.42 H new ATOM 0 HG2 LYS A 31 -15.600 -3.477 0.248 1.00 64.35 H new ATOM 0 HG3 LYS A 31 -15.852 -3.797 1.952 1.00 64.35 H new ATOM 0 HD2 LYS A 31 -18.083 -3.158 -0.041 1.00 54.42 H new ATOM 0 HD3 LYS A 31 -17.644 -4.774 0.475 1.00 54.42 H new ATOM 0 HE2 LYS A 31 -18.249 -4.208 2.823 1.00 13.21 H new ATOM 0 HE3 LYS A 31 -18.644 -2.570 2.339 1.00 13.21 H new ATOM 0 HZ1 LYS A 31 -20.614 -3.935 2.501 1.00 32.44 H new ATOM 0 HZ2 LYS A 31 -20.378 -3.445 0.892 1.00 32.44 H new ATOM 0 HZ3 LYS A 31 -19.995 -5.031 1.361 1.00 32.44 H new ATOM 479 N VAL A 32 -15.270 1.216 0.406 1.00 61.01 N ATOM 480 CA VAL A 32 -14.890 2.594 0.774 1.00 42.41 C ATOM 481 C VAL A 32 -14.869 3.556 -0.449 1.00 74.24 C ATOM 482 O VAL A 32 -14.465 4.714 -0.310 1.00 11.04 O ATOM 483 CB VAL A 32 -13.496 2.587 1.501 1.00 24.14 C ATOM 484 CG1 VAL A 32 -13.572 1.794 2.832 1.00 73.13 C ATOM 485 CG2 VAL A 32 -12.391 2.023 0.576 1.00 61.32 C ATOM 0 H VAL A 32 -14.528 0.705 -0.072 1.00 61.01 H new ATOM 0 HA VAL A 32 -15.653 2.974 1.454 1.00 42.41 H new ATOM 0 HB VAL A 32 -13.234 3.618 1.740 1.00 24.14 H new ATOM 0 HG11 VAL A 32 -12.596 1.803 3.317 1.00 73.13 H new ATOM 0 HG12 VAL A 32 -14.308 2.256 3.489 1.00 73.13 H new ATOM 0 HG13 VAL A 32 -13.865 0.765 2.626 1.00 73.13 H new ATOM 0 HG21 VAL A 32 -11.437 2.029 1.103 1.00 61.32 H new ATOM 0 HG22 VAL A 32 -12.641 1.001 0.291 1.00 61.32 H new ATOM 0 HG23 VAL A 32 -12.315 2.641 -0.319 1.00 61.32 H new ATOM 495 N ASN A 33 -15.299 3.053 -1.634 1.00 40.25 N ATOM 496 CA ASN A 33 -15.406 3.835 -2.906 1.00 14.34 C ATOM 497 C ASN A 33 -14.047 4.392 -3.425 1.00 34.10 C ATOM 498 O ASN A 33 -14.019 5.313 -4.256 1.00 41.24 O ATOM 499 CB ASN A 33 -16.467 4.974 -2.775 1.00 73.03 C ATOM 500 CG ASN A 33 -17.898 4.453 -2.588 1.00 50.04 C ATOM 501 OD1 ASN A 33 -18.253 3.376 -3.057 1.00 33.33 O ATOM 502 ND2 ASN A 33 -18.737 5.220 -1.919 1.00 41.22 N ATOM 0 H ASN A 33 -15.587 2.080 -1.741 1.00 40.25 H new ATOM 0 HA ASN A 33 -15.739 3.124 -3.662 1.00 14.34 H new ATOM 0 HB2 ASN A 33 -16.206 5.609 -1.928 1.00 73.03 H new ATOM 0 HB3 ASN A 33 -16.429 5.600 -3.666 1.00 73.03 H new ATOM 0 HD21 ASN A 33 -19.703 4.922 -1.783 1.00 41.22 H new ATOM 0 HD22 ASN A 33 -18.420 6.111 -1.538 1.00 41.22 H new ATOM 509 N LEU A 34 -12.928 3.810 -2.964 1.00 33.33 N ATOM 510 CA LEU A 34 -11.566 4.191 -3.417 1.00 62.03 C ATOM 511 C LEU A 34 -11.048 3.196 -4.481 1.00 61.33 C ATOM 512 O LEU A 34 -11.652 2.144 -4.713 1.00 15.25 O ATOM 513 CB LEU A 34 -10.589 4.232 -2.207 1.00 3.45 C ATOM 514 CG LEU A 34 -11.076 5.033 -0.955 1.00 53.44 C ATOM 515 CD1 LEU A 34 -10.047 4.944 0.191 1.00 21.30 C ATOM 516 CD2 LEU A 34 -11.426 6.499 -1.309 1.00 41.42 C ATOM 0 H LEU A 34 -12.934 3.064 -2.269 1.00 33.33 H new ATOM 0 HA LEU A 34 -11.618 5.183 -3.865 1.00 62.03 H new ATOM 0 HB2 LEU A 34 -10.381 3.207 -1.899 1.00 3.45 H new ATOM 0 HB3 LEU A 34 -9.645 4.661 -2.543 1.00 3.45 H new ATOM 0 HG LEU A 34 -11.999 4.571 -0.604 1.00 53.44 H new ATOM 0 HD11 LEU A 34 -10.409 5.509 1.050 1.00 21.30 H new ATOM 0 HD12 LEU A 34 -9.908 3.901 0.475 1.00 21.30 H new ATOM 0 HD13 LEU A 34 -9.095 5.359 -0.141 1.00 21.30 H new ATOM 0 HD21 LEU A 34 -11.760 7.020 -0.412 1.00 41.42 H new ATOM 0 HD22 LEU A 34 -10.544 6.997 -1.711 1.00 41.42 H new ATOM 0 HD23 LEU A 34 -12.221 6.513 -2.054 1.00 41.42 H new ATOM 528 N SER A 35 -9.933 3.555 -5.146 1.00 72.33 N ATOM 529 CA SER A 35 -9.213 2.635 -6.064 1.00 70.20 C ATOM 530 C SER A 35 -8.395 1.583 -5.281 1.00 1.14 C ATOM 531 O SER A 35 -8.020 1.813 -4.126 1.00 25.11 O ATOM 532 CB SER A 35 -8.272 3.430 -7.000 1.00 14.54 C ATOM 533 OG SER A 35 -7.551 2.564 -7.875 1.00 55.41 O ATOM 0 H SER A 35 -9.506 4.478 -5.068 1.00 72.33 H new ATOM 0 HA SER A 35 -9.963 2.115 -6.661 1.00 70.20 H new ATOM 0 HB2 SER A 35 -8.855 4.139 -7.587 1.00 14.54 H new ATOM 0 HB3 SER A 35 -7.570 4.012 -6.403 1.00 14.54 H new ATOM 0 HG SER A 35 -6.967 3.097 -8.454 1.00 55.41 H new ATOM 539 N VAL A 36 -8.107 0.447 -5.945 1.00 41.13 N ATOM 540 CA VAL A 36 -7.323 -0.680 -5.369 1.00 70.23 C ATOM 541 C VAL A 36 -5.931 -0.208 -4.877 1.00 21.12 C ATOM 542 O VAL A 36 -5.484 -0.574 -3.790 1.00 52.14 O ATOM 543 CB VAL A 36 -7.124 -1.828 -6.432 1.00 44.02 C ATOM 544 CG1 VAL A 36 -6.444 -3.081 -5.810 1.00 5.42 C ATOM 545 CG2 VAL A 36 -8.461 -2.186 -7.132 1.00 2.53 C ATOM 0 H VAL A 36 -8.411 0.277 -6.904 1.00 41.13 H new ATOM 0 HA VAL A 36 -7.891 -1.061 -4.520 1.00 70.23 H new ATOM 0 HB VAL A 36 -6.447 -1.449 -7.197 1.00 44.02 H new ATOM 0 HG11 VAL A 36 -6.325 -3.848 -6.575 1.00 5.42 H new ATOM 0 HG12 VAL A 36 -5.465 -2.806 -5.417 1.00 5.42 H new ATOM 0 HG13 VAL A 36 -7.064 -3.468 -5.002 1.00 5.42 H new ATOM 0 HG21 VAL A 36 -8.290 -2.980 -7.859 1.00 2.53 H new ATOM 0 HG22 VAL A 36 -9.182 -2.524 -6.388 1.00 2.53 H new ATOM 0 HG23 VAL A 36 -8.852 -1.306 -7.642 1.00 2.53 H new ATOM 555 N GLU A 37 -5.277 0.616 -5.713 1.00 21.13 N ATOM 556 CA GLU A 37 -3.945 1.205 -5.426 1.00 75.43 C ATOM 557 C GLU A 37 -3.980 2.153 -4.199 1.00 74.12 C ATOM 558 O GLU A 37 -3.057 2.158 -3.378 1.00 75.11 O ATOM 559 CB GLU A 37 -3.438 1.969 -6.675 1.00 3.24 C ATOM 560 CG GLU A 37 -3.440 1.131 -7.969 1.00 32.02 C ATOM 561 CD GLU A 37 -2.883 1.888 -9.185 1.00 73.35 C ATOM 562 OE1 GLU A 37 -3.474 2.923 -9.580 1.00 12.22 O ATOM 563 OE2 GLU A 37 -1.852 1.465 -9.745 1.00 24.12 O ATOM 0 H GLU A 37 -5.656 0.898 -6.617 1.00 21.13 H new ATOM 0 HA GLU A 37 -3.262 0.390 -5.186 1.00 75.43 H new ATOM 0 HB2 GLU A 37 -4.060 2.851 -6.825 1.00 3.24 H new ATOM 0 HB3 GLU A 37 -2.424 2.322 -6.485 1.00 3.24 H new ATOM 0 HG2 GLU A 37 -2.850 0.229 -7.810 1.00 32.02 H new ATOM 0 HG3 GLU A 37 -4.459 0.811 -8.185 1.00 32.02 H new ATOM 570 N SER A 38 -5.071 2.937 -4.091 1.00 33.24 N ATOM 571 CA SER A 38 -5.296 3.886 -2.969 1.00 34.03 C ATOM 572 C SER A 38 -5.557 3.140 -1.639 1.00 24.51 C ATOM 573 O SER A 38 -5.138 3.593 -0.569 1.00 14.41 O ATOM 574 CB SER A 38 -6.490 4.819 -3.299 1.00 64.53 C ATOM 575 OG SER A 38 -6.250 5.579 -4.478 1.00 74.10 O ATOM 0 H SER A 38 -5.825 2.934 -4.777 1.00 33.24 H new ATOM 0 HA SER A 38 -4.392 4.482 -2.845 1.00 34.03 H new ATOM 0 HB2 SER A 38 -7.394 4.223 -3.427 1.00 64.53 H new ATOM 0 HB3 SER A 38 -6.669 5.493 -2.461 1.00 64.53 H new ATOM 0 HG SER A 38 -7.022 6.155 -4.659 1.00 74.10 H new ATOM 581 N THR A 39 -6.247 1.993 -1.736 1.00 54.41 N ATOM 582 CA THR A 39 -6.614 1.159 -0.571 1.00 25.02 C ATOM 583 C THR A 39 -5.410 0.333 -0.049 1.00 43.11 C ATOM 584 O THR A 39 -5.161 0.320 1.149 1.00 61.33 O ATOM 585 CB THR A 39 -7.810 0.224 -0.938 1.00 2.52 C ATOM 586 OG1 THR A 39 -8.946 1.034 -1.291 1.00 62.23 O ATOM 587 CG2 THR A 39 -8.204 -0.740 0.200 1.00 63.04 C ATOM 0 H THR A 39 -6.569 1.613 -2.626 1.00 54.41 H new ATOM 0 HA THR A 39 -6.918 1.826 0.236 1.00 25.02 H new ATOM 0 HB THR A 39 -7.489 -0.394 -1.776 1.00 2.52 H new ATOM 0 HG1 THR A 39 -8.827 1.387 -2.198 1.00 62.23 H new ATOM 0 HG21 THR A 39 -9.041 -1.360 -0.122 1.00 63.04 H new ATOM 0 HG22 THR A 39 -7.355 -1.377 0.448 1.00 63.04 H new ATOM 0 HG23 THR A 39 -8.495 -0.165 1.079 1.00 63.04 H new ATOM 595 N ALA A 40 -4.666 -0.336 -0.961 1.00 23.02 N ATOM 596 CA ALA A 40 -3.443 -1.128 -0.612 1.00 32.21 C ATOM 597 C ALA A 40 -2.362 -0.247 0.061 1.00 24.31 C ATOM 598 O ALA A 40 -1.640 -0.689 0.963 1.00 75.32 O ATOM 599 CB ALA A 40 -2.871 -1.798 -1.876 1.00 65.32 C ATOM 0 H ALA A 40 -4.888 -0.348 -1.957 1.00 23.02 H new ATOM 0 HA ALA A 40 -3.736 -1.895 0.104 1.00 32.21 H new ATOM 0 HB1 ALA A 40 -1.982 -2.372 -1.613 1.00 65.32 H new ATOM 0 HB2 ALA A 40 -3.619 -2.464 -2.305 1.00 65.32 H new ATOM 0 HB3 ALA A 40 -2.606 -1.033 -2.605 1.00 65.32 H new ATOM 605 N LEU A 41 -2.281 1.003 -0.409 1.00 44.50 N ATOM 606 CA LEU A 41 -1.408 2.051 0.164 1.00 4.12 C ATOM 607 C LEU A 41 -1.867 2.401 1.610 1.00 34.31 C ATOM 608 O LEU A 41 -1.060 2.446 2.545 1.00 24.40 O ATOM 609 CB LEU A 41 -1.478 3.303 -0.756 1.00 40.52 C ATOM 610 CG LEU A 41 -0.232 4.243 -0.841 1.00 14.24 C ATOM 611 CD1 LEU A 41 -0.594 5.493 -1.662 1.00 44.22 C ATOM 612 CD2 LEU A 41 0.350 4.619 0.543 1.00 33.04 C ATOM 0 H LEU A 41 -2.825 1.326 -1.209 1.00 44.50 H new ATOM 0 HA LEU A 41 -0.379 1.695 0.219 1.00 4.12 H new ATOM 0 HB2 LEU A 41 -1.702 2.959 -1.766 1.00 40.52 H new ATOM 0 HB3 LEU A 41 -2.325 3.906 -0.430 1.00 40.52 H new ATOM 0 HG LEU A 41 0.563 3.693 -1.344 1.00 14.24 H new ATOM 0 HD11 LEU A 41 0.273 6.151 -1.724 1.00 44.22 H new ATOM 0 HD12 LEU A 41 -0.895 5.194 -2.666 1.00 44.22 H new ATOM 0 HD13 LEU A 41 -1.416 6.020 -1.179 1.00 44.22 H new ATOM 0 HD21 LEU A 41 1.212 5.273 0.410 1.00 33.04 H new ATOM 0 HD22 LEU A 41 -0.410 5.136 1.129 1.00 33.04 H new ATOM 0 HD23 LEU A 41 0.658 3.714 1.066 1.00 33.04 H new ATOM 624 N ALA A 42 -3.182 2.658 1.756 1.00 50.52 N ATOM 625 CA ALA A 42 -3.815 2.988 3.055 1.00 52.32 C ATOM 626 C ALA A 42 -3.673 1.827 4.074 1.00 13.34 C ATOM 627 O ALA A 42 -3.605 2.048 5.285 1.00 74.32 O ATOM 628 CB ALA A 42 -5.290 3.346 2.829 1.00 30.44 C ATOM 0 H ALA A 42 -3.839 2.643 0.976 1.00 50.52 H new ATOM 0 HA ALA A 42 -3.299 3.848 3.482 1.00 52.32 H new ATOM 0 HB1 ALA A 42 -5.756 3.589 3.784 1.00 30.44 H new ATOM 0 HB2 ALA A 42 -5.358 4.206 2.163 1.00 30.44 H new ATOM 0 HB3 ALA A 42 -5.806 2.498 2.379 1.00 30.44 H new ATOM 634 N VAL A 43 -3.612 0.588 3.555 1.00 72.31 N ATOM 635 CA VAL A 43 -3.333 -0.623 4.370 1.00 51.41 C ATOM 636 C VAL A 43 -1.871 -0.603 4.890 1.00 45.41 C ATOM 637 O VAL A 43 -1.598 -1.030 6.015 1.00 14.55 O ATOM 638 CB VAL A 43 -3.619 -1.944 3.554 1.00 61.50 C ATOM 639 CG1 VAL A 43 -3.112 -3.207 4.290 1.00 21.33 C ATOM 640 CG2 VAL A 43 -5.130 -2.080 3.217 1.00 1.33 C ATOM 0 H VAL A 43 -3.753 0.391 2.564 1.00 72.31 H new ATOM 0 HA VAL A 43 -4.006 -0.613 5.227 1.00 51.41 H new ATOM 0 HB VAL A 43 -3.061 -1.863 2.621 1.00 61.50 H new ATOM 0 HG11 VAL A 43 -3.331 -4.090 3.690 1.00 21.33 H new ATOM 0 HG12 VAL A 43 -2.036 -3.131 4.444 1.00 21.33 H new ATOM 0 HG13 VAL A 43 -3.612 -3.291 5.255 1.00 21.33 H new ATOM 0 HG21 VAL A 43 -5.296 -2.999 2.655 1.00 1.33 H new ATOM 0 HG22 VAL A 43 -5.708 -2.110 4.141 1.00 1.33 H new ATOM 0 HG23 VAL A 43 -5.448 -1.226 2.618 1.00 1.33 H new ATOM 650 N GLY A 44 -0.949 -0.084 4.059 1.00 21.44 N ATOM 651 CA GLY A 44 0.442 0.156 4.475 1.00 14.03 C ATOM 652 C GLY A 44 0.579 1.206 5.594 1.00 52.31 C ATOM 653 O GLY A 44 1.509 1.138 6.410 1.00 2.45 O ATOM 0 H GLY A 44 -1.145 0.177 3.093 1.00 21.44 H new ATOM 0 HA2 GLY A 44 0.878 -0.784 4.815 1.00 14.03 H new ATOM 0 HA3 GLY A 44 1.020 0.482 3.610 1.00 14.03 H new ATOM 657 N TRP A 45 -0.350 2.187 5.626 1.00 5.43 N ATOM 658 CA TRP A 45 -0.445 3.168 6.739 1.00 73.33 C ATOM 659 C TRP A 45 -0.964 2.490 8.031 1.00 71.31 C ATOM 660 O TRP A 45 -0.548 2.833 9.139 1.00 75.24 O ATOM 661 CB TRP A 45 -1.361 4.361 6.364 1.00 61.21 C ATOM 662 CG TRP A 45 -1.446 5.417 7.457 1.00 62.52 C ATOM 663 CD1 TRP A 45 -2.386 5.523 8.451 1.00 14.02 C ATOM 664 CD2 TRP A 45 -0.521 6.480 7.682 1.00 1.01 C ATOM 665 NE1 TRP A 45 -2.107 6.598 9.251 1.00 4.34 N ATOM 666 CE2 TRP A 45 -0.971 7.204 8.800 1.00 73.32 C ATOM 667 CE3 TRP A 45 0.640 6.893 7.034 1.00 52.12 C ATOM 668 CZ2 TRP A 45 -0.301 8.319 9.284 1.00 54.32 C ATOM 669 CZ3 TRP A 45 1.306 7.998 7.513 1.00 33.11 C ATOM 670 CH2 TRP A 45 0.835 8.704 8.629 1.00 44.04 C ATOM 0 H TRP A 45 -1.047 2.324 4.894 1.00 5.43 H new ATOM 0 HA TRP A 45 0.559 3.550 6.921 1.00 73.33 H new ATOM 0 HB2 TRP A 45 -0.989 4.823 5.449 1.00 61.21 H new ATOM 0 HB3 TRP A 45 -2.362 3.988 6.149 1.00 61.21 H new ATOM 0 HD1 TRP A 45 -3.224 4.855 8.583 1.00 14.02 H new ATOM 0 HE1 TRP A 45 -2.659 6.898 10.055 1.00 4.34 H new ATOM 0 HE3 TRP A 45 1.011 6.357 6.173 1.00 52.12 H new ATOM 0 HZ2 TRP A 45 -0.663 8.861 10.145 1.00 54.32 H new ATOM 0 HZ3 TRP A 45 2.209 8.328 7.020 1.00 33.11 H new ATOM 0 HH2 TRP A 45 1.380 9.569 8.978 1.00 44.04 H new ATOM 681 N LEU A 46 -1.901 1.547 7.882 1.00 64.33 N ATOM 682 CA LEU A 46 -2.386 0.729 9.012 1.00 52.45 C ATOM 683 C LEU A 46 -1.278 -0.228 9.519 1.00 51.25 C ATOM 684 O LEU A 46 -1.235 -0.553 10.694 1.00 62.22 O ATOM 685 CB LEU A 46 -3.648 -0.058 8.598 1.00 62.44 C ATOM 686 CG LEU A 46 -4.892 0.795 8.221 1.00 63.43 C ATOM 687 CD1 LEU A 46 -6.042 -0.096 7.712 1.00 45.05 C ATOM 688 CD2 LEU A 46 -5.333 1.681 9.408 1.00 45.05 C ATOM 0 H LEU A 46 -2.343 1.327 6.989 1.00 64.33 H new ATOM 0 HA LEU A 46 -2.649 1.396 9.833 1.00 52.45 H new ATOM 0 HB2 LEU A 46 -3.395 -0.690 7.747 1.00 62.44 H new ATOM 0 HB3 LEU A 46 -3.923 -0.722 9.418 1.00 62.44 H new ATOM 0 HG LEU A 46 -4.614 1.460 7.403 1.00 63.43 H new ATOM 0 HD11 LEU A 46 -6.899 0.527 7.456 1.00 45.05 H new ATOM 0 HD12 LEU A 46 -5.714 -0.644 6.828 1.00 45.05 H new ATOM 0 HD13 LEU A 46 -6.327 -0.802 8.491 1.00 45.05 H new ATOM 0 HD21 LEU A 46 -6.205 2.268 9.120 1.00 45.05 H new ATOM 0 HD22 LEU A 46 -5.587 1.049 10.259 1.00 45.05 H new ATOM 0 HD23 LEU A 46 -4.519 2.352 9.684 1.00 45.05 H new ATOM 700 N ALA A 47 -0.404 -0.692 8.603 1.00 21.25 N ATOM 701 CA ALA A 47 0.823 -1.457 8.948 1.00 61.34 C ATOM 702 C ALA A 47 1.840 -0.579 9.734 1.00 41.45 C ATOM 703 O ALA A 47 2.598 -1.089 10.571 1.00 13.40 O ATOM 704 CB ALA A 47 1.454 -2.046 7.670 1.00 4.21 C ATOM 0 H ALA A 47 -0.525 -0.549 7.600 1.00 21.25 H new ATOM 0 HA ALA A 47 0.543 -2.280 9.605 1.00 61.34 H new ATOM 0 HB1 ALA A 47 2.352 -2.605 7.932 1.00 4.21 H new ATOM 0 HB2 ALA A 47 0.740 -2.713 7.186 1.00 4.21 H new ATOM 0 HB3 ALA A 47 1.716 -1.237 6.988 1.00 4.21 H new ATOM 710 N ARG A 48 1.849 0.746 9.453 1.00 23.04 N ATOM 711 CA ARG A 48 2.579 1.742 10.277 1.00 51.15 C ATOM 712 C ARG A 48 1.993 1.803 11.709 1.00 32.24 C ATOM 713 O ARG A 48 2.721 1.669 12.698 1.00 72.41 O ATOM 714 CB ARG A 48 2.501 3.147 9.608 1.00 33.24 C ATOM 715 CG ARG A 48 3.068 4.312 10.455 1.00 23.50 C ATOM 716 CD ARG A 48 2.950 5.677 9.760 1.00 22.11 C ATOM 717 NE ARG A 48 3.582 6.754 10.546 1.00 73.45 N ATOM 718 CZ ARG A 48 4.251 7.780 10.054 1.00 23.30 C ATOM 719 NH1 ARG A 48 4.434 7.921 8.777 1.00 3.31 N ATOM 720 NH2 ARG A 48 4.738 8.661 10.860 1.00 14.13 N ATOM 0 H ARG A 48 1.356 1.152 8.658 1.00 23.04 H new ATOM 0 HA ARG A 48 3.623 1.435 10.345 1.00 51.15 H new ATOM 0 HB2 ARG A 48 3.040 3.111 8.661 1.00 33.24 H new ATOM 0 HB3 ARG A 48 1.459 3.363 9.374 1.00 33.24 H new ATOM 0 HG2 ARG A 48 2.541 4.350 11.408 1.00 23.50 H new ATOM 0 HG3 ARG A 48 4.116 4.114 10.678 1.00 23.50 H new ATOM 0 HD2 ARG A 48 3.417 5.624 8.776 1.00 22.11 H new ATOM 0 HD3 ARG A 48 1.898 5.913 9.602 1.00 22.11 H new ATOM 0 HE ARG A 48 3.494 6.701 11.561 1.00 73.45 H new ATOM 0 HH11 ARG A 48 4.057 7.230 8.128 1.00 3.31 H new ATOM 0 HH12 ARG A 48 4.955 8.723 8.422 1.00 3.31 H new ATOM 0 HH21 ARG A 48 4.604 8.561 11.866 1.00 14.13 H new ATOM 0 HH22 ARG A 48 5.257 9.458 10.491 1.00 14.13 H new ATOM 734 N GLU A 49 0.656 1.952 11.781 1.00 34.10 N ATOM 735 CA GLU A 49 -0.103 2.062 13.051 1.00 31.41 C ATOM 736 C GLU A 49 -0.327 0.680 13.722 1.00 15.12 C ATOM 737 O GLU A 49 -0.938 0.601 14.792 1.00 33.02 O ATOM 738 CB GLU A 49 -1.471 2.754 12.788 1.00 41.40 C ATOM 739 CG GLU A 49 -1.361 4.156 12.143 1.00 11.21 C ATOM 740 CD GLU A 49 -2.710 4.887 11.977 1.00 44.30 C ATOM 741 OE1 GLU A 49 -3.688 4.263 11.503 1.00 60.34 O ATOM 742 OE2 GLU A 49 -2.804 6.090 12.323 1.00 24.42 O ATOM 0 H GLU A 49 0.063 2.000 10.953 1.00 34.10 H new ATOM 0 HA GLU A 49 0.491 2.664 13.738 1.00 31.41 H new ATOM 0 HB2 GLU A 49 -2.070 2.114 12.140 1.00 41.40 H new ATOM 0 HB3 GLU A 49 -2.008 2.842 13.732 1.00 41.40 H new ATOM 0 HG2 GLU A 49 -0.700 4.772 12.752 1.00 11.21 H new ATOM 0 HG3 GLU A 49 -0.892 4.057 11.164 1.00 11.21 H new ATOM 749 N ASN A 50 0.151 -0.398 13.048 1.00 62.44 N ATOM 750 CA ASN A 50 0.119 -1.810 13.534 1.00 4.42 C ATOM 751 C ASN A 50 -1.330 -2.346 13.727 1.00 11.35 C ATOM 752 O ASN A 50 -1.561 -3.315 14.454 1.00 12.20 O ATOM 753 CB ASN A 50 0.957 -1.961 14.830 1.00 54.22 C ATOM 754 CG ASN A 50 2.349 -1.341 14.693 1.00 75.40 C ATOM 755 OD1 ASN A 50 3.271 -1.966 14.208 1.00 24.12 O ATOM 756 ND2 ASN A 50 2.506 -0.098 15.117 1.00 14.41 N ATOM 0 H ASN A 50 0.581 -0.311 12.127 1.00 62.44 H new ATOM 0 HA ASN A 50 0.571 -2.427 12.757 1.00 4.42 H new ATOM 0 HB2 ASN A 50 0.430 -1.488 15.659 1.00 54.22 H new ATOM 0 HB3 ASN A 50 1.055 -3.018 15.077 1.00 54.22 H new ATOM 0 HD21 ASN A 50 3.416 0.356 15.040 1.00 14.41 H new ATOM 0 HD22 ASN A 50 1.717 0.407 15.521 1.00 14.41 H new ATOM 763 N LYS A 51 -2.283 -1.705 13.029 1.00 32.15 N ATOM 764 CA LYS A 51 -3.714 -2.054 13.060 1.00 20.32 C ATOM 765 C LYS A 51 -4.055 -3.284 12.183 1.00 34.54 C ATOM 766 O LYS A 51 -5.118 -3.884 12.358 1.00 42.32 O ATOM 767 CB LYS A 51 -4.558 -0.839 12.595 1.00 44.13 C ATOM 768 CG LYS A 51 -4.583 0.362 13.567 1.00 50.01 C ATOM 769 CD LYS A 51 -5.576 1.461 13.106 1.00 1.31 C ATOM 770 CE LYS A 51 -5.728 2.606 14.120 1.00 33.13 C ATOM 771 NZ LYS A 51 -4.455 3.345 14.336 1.00 71.31 N ATOM 0 H LYS A 51 -2.077 -0.916 12.417 1.00 32.15 H new ATOM 0 HA LYS A 51 -3.954 -2.317 14.090 1.00 20.32 H new ATOM 0 HB2 LYS A 51 -4.174 -0.498 11.633 1.00 44.13 H new ATOM 0 HB3 LYS A 51 -5.583 -1.172 12.429 1.00 44.13 H new ATOM 0 HG2 LYS A 51 -4.861 0.017 14.563 1.00 50.01 H new ATOM 0 HG3 LYS A 51 -3.582 0.787 13.644 1.00 50.01 H new ATOM 0 HD2 LYS A 51 -5.238 1.870 12.154 1.00 1.31 H new ATOM 0 HD3 LYS A 51 -6.552 1.009 12.930 1.00 1.31 H new ATOM 0 HE2 LYS A 51 -6.492 3.299 13.769 1.00 33.13 H new ATOM 0 HE3 LYS A 51 -6.076 2.202 15.071 1.00 33.13 H new ATOM 0 HZ1 LYS A 51 -4.662 4.287 14.724 1.00 71.31 H new ATOM 0 HZ2 LYS A 51 -3.857 2.819 15.005 1.00 71.31 H new ATOM 0 HZ3 LYS A 51 -3.954 3.446 13.430 1.00 71.31 H new ATOM 785 N VAL A 52 -3.170 -3.648 11.228 1.00 21.13 N ATOM 786 CA VAL A 52 -3.424 -4.775 10.285 1.00 32.32 C ATOM 787 C VAL A 52 -2.228 -5.750 10.180 1.00 51.15 C ATOM 788 O VAL A 52 -1.085 -5.394 10.483 1.00 63.03 O ATOM 789 CB VAL A 52 -3.800 -4.278 8.832 1.00 32.12 C ATOM 790 CG1 VAL A 52 -5.141 -3.509 8.822 1.00 50.44 C ATOM 791 CG2 VAL A 52 -2.655 -3.447 8.205 1.00 43.24 C ATOM 0 H VAL A 52 -2.274 -3.183 11.085 1.00 21.13 H new ATOM 0 HA VAL A 52 -4.275 -5.305 10.713 1.00 32.32 H new ATOM 0 HB VAL A 52 -3.935 -5.162 8.209 1.00 32.12 H new ATOM 0 HG11 VAL A 52 -5.366 -3.183 7.806 1.00 50.44 H new ATOM 0 HG12 VAL A 52 -5.938 -4.162 9.178 1.00 50.44 H new ATOM 0 HG13 VAL A 52 -5.066 -2.639 9.474 1.00 50.44 H new ATOM 0 HG21 VAL A 52 -2.947 -3.121 7.207 1.00 43.24 H new ATOM 0 HG22 VAL A 52 -2.455 -2.575 8.828 1.00 43.24 H new ATOM 0 HG23 VAL A 52 -1.755 -4.059 8.139 1.00 43.24 H new ATOM 801 N VAL A 53 -2.534 -6.992 9.742 1.00 1.31 N ATOM 802 CA VAL A 53 -1.538 -8.041 9.415 1.00 72.32 C ATOM 803 C VAL A 53 -1.843 -8.638 8.003 1.00 44.05 C ATOM 804 O VAL A 53 -2.933 -9.153 7.752 1.00 3.30 O ATOM 805 CB VAL A 53 -1.485 -9.167 10.530 1.00 33.52 C ATOM 806 CG1 VAL A 53 -0.779 -8.639 11.813 1.00 24.41 C ATOM 807 CG2 VAL A 53 -2.893 -9.706 10.875 1.00 34.12 C ATOM 0 H VAL A 53 -3.496 -7.300 9.603 1.00 1.31 H new ATOM 0 HA VAL A 53 -0.549 -7.584 9.391 1.00 72.32 H new ATOM 0 HB VAL A 53 -0.905 -9.996 10.123 1.00 33.52 H new ATOM 0 HG11 VAL A 53 -0.754 -9.428 12.565 1.00 24.41 H new ATOM 0 HG12 VAL A 53 0.240 -8.337 11.570 1.00 24.41 H new ATOM 0 HG13 VAL A 53 -1.328 -7.782 12.204 1.00 24.41 H new ATOM 0 HG21 VAL A 53 -2.810 -10.475 11.643 1.00 34.12 H new ATOM 0 HG22 VAL A 53 -3.514 -8.890 11.244 1.00 34.12 H new ATOM 0 HG23 VAL A 53 -3.348 -10.133 9.981 1.00 34.12 H new ATOM 817 N ILE A 54 -0.868 -8.521 7.075 1.00 61.43 N ATOM 818 CA ILE A 54 -1.046 -8.883 5.641 1.00 55.13 C ATOM 819 C ILE A 54 -0.507 -10.315 5.387 1.00 42.40 C ATOM 820 O ILE A 54 0.704 -10.529 5.369 1.00 62.43 O ATOM 821 CB ILE A 54 -0.322 -7.841 4.681 1.00 34.04 C ATOM 822 CG1 ILE A 54 -0.945 -6.400 4.807 1.00 20.54 C ATOM 823 CG2 ILE A 54 -0.339 -8.321 3.199 1.00 43.22 C ATOM 824 CD1 ILE A 54 -0.600 -5.629 6.076 1.00 20.10 C ATOM 0 H ILE A 54 0.066 -8.174 7.293 1.00 61.43 H new ATOM 0 HA ILE A 54 -2.112 -8.854 5.415 1.00 55.13 H new ATOM 0 HB ILE A 54 0.717 -7.783 5.004 1.00 34.04 H new ATOM 0 HG12 ILE A 54 -0.622 -5.810 3.949 1.00 20.54 H new ATOM 0 HG13 ILE A 54 -2.030 -6.488 4.743 1.00 20.54 H new ATOM 0 HG21 ILE A 54 0.164 -7.585 2.572 1.00 43.22 H new ATOM 0 HG22 ILE A 54 0.177 -9.278 3.120 1.00 43.22 H new ATOM 0 HG23 ILE A 54 -1.370 -8.437 2.866 1.00 43.22 H new ATOM 0 HD11 ILE A 54 -1.084 -4.653 6.052 1.00 20.10 H new ATOM 0 HD12 ILE A 54 -0.949 -6.185 6.946 1.00 20.10 H new ATOM 0 HD13 ILE A 54 0.480 -5.497 6.139 1.00 20.10 H new ATOM 836 N GLU A 55 -1.410 -11.287 5.178 1.00 73.24 N ATOM 837 CA GLU A 55 -1.043 -12.723 5.086 1.00 51.55 C ATOM 838 C GLU A 55 -1.380 -13.308 3.685 1.00 13.12 C ATOM 839 O GLU A 55 -2.438 -13.019 3.112 1.00 74.31 O ATOM 840 CB GLU A 55 -1.776 -13.501 6.212 1.00 43.35 C ATOM 841 CG GLU A 55 -1.388 -13.064 7.645 1.00 5.13 C ATOM 842 CD GLU A 55 -2.280 -13.676 8.741 1.00 2.34 C ATOM 843 OE1 GLU A 55 -2.199 -14.907 8.980 1.00 41.34 O ATOM 844 OE2 GLU A 55 -3.069 -12.938 9.365 1.00 15.34 O ATOM 0 H GLU A 55 -2.408 -11.109 5.068 1.00 73.24 H new ATOM 0 HA GLU A 55 0.034 -12.826 5.217 1.00 51.55 H new ATOM 0 HB2 GLU A 55 -2.851 -13.374 6.085 1.00 43.35 H new ATOM 0 HB3 GLU A 55 -1.565 -14.564 6.099 1.00 43.35 H new ATOM 0 HG2 GLU A 55 -0.352 -13.345 7.833 1.00 5.13 H new ATOM 0 HG3 GLU A 55 -1.440 -11.977 7.711 1.00 5.13 H new ATOM 851 N ARG A 56 -0.446 -14.117 3.142 1.00 14.32 N ATOM 852 CA ARG A 56 -0.601 -14.794 1.835 1.00 24.32 C ATOM 853 C ARG A 56 -1.279 -16.167 2.023 1.00 52.33 C ATOM 854 O ARG A 56 -0.641 -17.135 2.462 1.00 21.10 O ATOM 855 CB ARG A 56 0.786 -14.977 1.162 1.00 43.20 C ATOM 856 CG ARG A 56 1.514 -13.667 0.787 1.00 32.50 C ATOM 857 CD ARG A 56 2.942 -13.935 0.272 1.00 35.55 C ATOM 858 NE ARG A 56 3.654 -12.697 -0.097 1.00 52.42 N ATOM 859 CZ ARG A 56 4.964 -12.568 -0.167 1.00 70.25 C ATOM 860 NH1 ARG A 56 5.749 -13.523 0.219 1.00 72.33 N ATOM 861 NH2 ARG A 56 5.478 -11.460 -0.598 1.00 12.11 N ATOM 0 H ARG A 56 0.442 -14.321 3.600 1.00 14.32 H new ATOM 0 HA ARG A 56 -1.229 -14.176 1.193 1.00 24.32 H new ATOM 0 HB2 ARG A 56 1.425 -15.549 1.834 1.00 43.20 H new ATOM 0 HB3 ARG A 56 0.658 -15.574 0.259 1.00 43.20 H new ATOM 0 HG2 ARG A 56 0.944 -13.140 0.022 1.00 32.50 H new ATOM 0 HG3 ARG A 56 1.558 -13.013 1.658 1.00 32.50 H new ATOM 0 HD2 ARG A 56 3.509 -14.460 1.041 1.00 35.55 H new ATOM 0 HD3 ARG A 56 2.894 -14.594 -0.595 1.00 35.55 H new ATOM 0 HE ARG A 56 3.088 -11.877 -0.315 1.00 52.42 H new ATOM 0 HH11 ARG A 56 5.356 -14.391 0.584 1.00 72.33 H new ATOM 0 HH12 ARG A 56 6.761 -13.408 0.158 1.00 72.33 H new ATOM 0 HH21 ARG A 56 4.870 -10.692 -0.881 1.00 12.11 H new ATOM 0 HH22 ARG A 56 6.491 -11.356 -0.654 1.00 12.11 H new ATOM 875 N LYS A 57 -2.586 -16.233 1.736 1.00 33.44 N ATOM 876 CA LYS A 57 -3.388 -17.473 1.839 1.00 22.35 C ATOM 877 C LYS A 57 -3.733 -18.011 0.429 1.00 3.44 C ATOM 878 O LYS A 57 -4.392 -17.322 -0.360 1.00 3.34 O ATOM 879 CB LYS A 57 -4.671 -17.212 2.698 1.00 51.34 C ATOM 880 CG LYS A 57 -4.522 -17.546 4.206 1.00 62.43 C ATOM 881 CD LYS A 57 -3.306 -16.874 4.893 1.00 22.42 C ATOM 882 CE LYS A 57 -3.084 -17.392 6.324 1.00 54.34 C ATOM 883 NZ LYS A 57 -1.864 -16.823 6.950 1.00 73.53 N ATOM 0 H LYS A 57 -3.126 -15.426 1.423 1.00 33.44 H new ATOM 0 HA LYS A 57 -2.803 -18.241 2.344 1.00 22.35 H new ATOM 0 HB2 LYS A 57 -4.951 -16.163 2.598 1.00 51.34 H new ATOM 0 HB3 LYS A 57 -5.492 -17.801 2.289 1.00 51.34 H new ATOM 0 HG2 LYS A 57 -5.431 -17.242 4.725 1.00 62.43 H new ATOM 0 HG3 LYS A 57 -4.437 -18.627 4.320 1.00 62.43 H new ATOM 0 HD2 LYS A 57 -2.410 -17.056 4.300 1.00 22.42 H new ATOM 0 HD3 LYS A 57 -3.457 -15.795 4.919 1.00 22.42 H new ATOM 0 HE2 LYS A 57 -3.952 -17.145 6.936 1.00 54.34 H new ATOM 0 HE3 LYS A 57 -3.006 -18.479 6.306 1.00 54.34 H new ATOM 0 HZ1 LYS A 57 -1.413 -17.543 7.550 1.00 73.53 H new ATOM 0 HZ2 LYS A 57 -1.199 -16.525 6.208 1.00 73.53 H new ATOM 0 HZ3 LYS A 57 -2.124 -16.001 7.532 1.00 73.53 H new ATOM 897 N ASN A 58 -3.266 -19.257 0.137 1.00 12.12 N ATOM 898 CA ASN A 58 -3.412 -19.937 -1.183 1.00 54.31 C ATOM 899 C ASN A 58 -2.771 -19.120 -2.341 1.00 51.21 C ATOM 900 O ASN A 58 -3.189 -19.209 -3.504 1.00 53.10 O ATOM 901 CB ASN A 58 -4.912 -20.248 -1.456 1.00 72.52 C ATOM 902 CG ASN A 58 -5.561 -21.078 -0.338 1.00 11.54 C ATOM 903 OD1 ASN A 58 -4.909 -21.885 0.321 1.00 62.31 O ATOM 904 ND2 ASN A 58 -6.837 -20.872 -0.102 1.00 20.12 N ATOM 0 H ASN A 58 -2.770 -19.826 0.823 1.00 12.12 H new ATOM 0 HA ASN A 58 -2.865 -20.879 -1.141 1.00 54.31 H new ATOM 0 HB2 ASN A 58 -5.458 -19.311 -1.570 1.00 72.52 H new ATOM 0 HB3 ASN A 58 -5.001 -20.786 -2.400 1.00 72.52 H new ATOM 0 HD21 ASN A 58 -7.308 -21.387 0.642 1.00 20.12 H new ATOM 0 HD22 ASN A 58 -7.357 -20.197 -0.663 1.00 20.12 H new ATOM 911 N GLY A 59 -1.702 -18.374 -1.999 1.00 1.15 N ATOM 912 CA GLY A 59 -1.021 -17.465 -2.940 1.00 62.31 C ATOM 913 C GLY A 59 -1.615 -16.041 -2.986 1.00 71.21 C ATOM 914 O GLY A 59 -0.939 -15.094 -3.406 1.00 0.30 O ATOM 0 H GLY A 59 -1.288 -18.385 -1.067 1.00 1.15 H new ATOM 0 HA2 GLY A 59 0.032 -17.399 -2.666 1.00 62.31 H new ATOM 0 HA3 GLY A 59 -1.064 -17.897 -3.940 1.00 62.31 H new ATOM 918 N LEU A 60 -2.880 -15.890 -2.553 1.00 62.13 N ATOM 919 CA LEU A 60 -3.620 -14.603 -2.597 1.00 50.21 C ATOM 920 C LEU A 60 -3.285 -13.719 -1.367 1.00 54.14 C ATOM 921 O LEU A 60 -3.210 -14.210 -0.239 1.00 43.33 O ATOM 922 CB LEU A 60 -5.164 -14.854 -2.673 1.00 35.41 C ATOM 923 CG LEU A 60 -5.738 -15.353 -4.048 1.00 40.43 C ATOM 924 CD1 LEU A 60 -5.230 -16.760 -4.429 1.00 73.32 C ATOM 925 CD2 LEU A 60 -7.285 -15.285 -4.061 1.00 14.42 C ATOM 0 H LEU A 60 -3.425 -16.657 -2.160 1.00 62.13 H new ATOM 0 HA LEU A 60 -3.305 -14.073 -3.495 1.00 50.21 H new ATOM 0 HB2 LEU A 60 -5.426 -15.587 -1.910 1.00 35.41 H new ATOM 0 HB3 LEU A 60 -5.672 -13.926 -2.411 1.00 35.41 H new ATOM 0 HG LEU A 60 -5.362 -14.674 -4.813 1.00 40.43 H new ATOM 0 HD11 LEU A 60 -5.658 -17.054 -5.387 1.00 73.32 H new ATOM 0 HD12 LEU A 60 -4.143 -16.746 -4.506 1.00 73.32 H new ATOM 0 HD13 LEU A 60 -5.530 -17.475 -3.663 1.00 73.32 H new ATOM 0 HD21 LEU A 60 -7.657 -15.636 -5.024 1.00 14.42 H new ATOM 0 HD22 LEU A 60 -7.684 -15.916 -3.266 1.00 14.42 H new ATOM 0 HD23 LEU A 60 -7.605 -14.255 -3.902 1.00 14.42 H new ATOM 937 N ILE A 61 -3.095 -12.407 -1.611 1.00 0.32 N ATOM 938 CA ILE A 61 -2.841 -11.408 -0.554 1.00 24.24 C ATOM 939 C ILE A 61 -4.192 -10.960 0.059 1.00 33.12 C ATOM 940 O ILE A 61 -5.025 -10.356 -0.631 1.00 34.25 O ATOM 941 CB ILE A 61 -2.055 -10.134 -1.099 1.00 52.22 C ATOM 942 CG1 ILE A 61 -0.648 -10.517 -1.703 1.00 72.43 C ATOM 943 CG2 ILE A 61 -1.900 -9.055 0.009 1.00 44.13 C ATOM 944 CD1 ILE A 61 -0.672 -11.106 -3.106 1.00 13.32 C ATOM 0 H ILE A 61 -3.113 -12.009 -2.550 1.00 0.32 H new ATOM 0 HA ILE A 61 -2.213 -11.878 0.202 1.00 24.24 H new ATOM 0 HB ILE A 61 -2.654 -9.715 -1.908 1.00 52.22 H new ATOM 0 HG12 ILE A 61 -0.022 -9.624 -1.714 1.00 72.43 H new ATOM 0 HG13 ILE A 61 -0.169 -11.234 -1.036 1.00 72.43 H new ATOM 0 HG21 ILE A 61 -1.360 -8.197 -0.392 1.00 44.13 H new ATOM 0 HG22 ILE A 61 -2.886 -8.737 0.348 1.00 44.13 H new ATOM 0 HG23 ILE A 61 -1.345 -9.473 0.849 1.00 44.13 H new ATOM 0 HD11 ILE A 61 0.346 -11.333 -3.423 1.00 13.32 H new ATOM 0 HD12 ILE A 61 -1.264 -12.021 -3.106 1.00 13.32 H new ATOM 0 HD13 ILE A 61 -1.115 -10.387 -3.795 1.00 13.32 H new ATOM 956 N GLU A 62 -4.407 -11.285 1.346 1.00 43.14 N ATOM 957 CA GLU A 62 -5.606 -10.865 2.113 1.00 40.15 C ATOM 958 C GLU A 62 -5.149 -10.071 3.350 1.00 1.00 C ATOM 959 O GLU A 62 -4.164 -10.444 4.003 1.00 74.32 O ATOM 960 CB GLU A 62 -6.459 -12.093 2.550 1.00 23.43 C ATOM 961 CG GLU A 62 -6.968 -12.963 1.389 1.00 33.32 C ATOM 962 CD GLU A 62 -7.907 -14.100 1.841 1.00 70.41 C ATOM 963 OE1 GLU A 62 -7.454 -15.018 2.562 1.00 55.24 O ATOM 964 OE2 GLU A 62 -9.105 -14.096 1.461 1.00 41.31 O ATOM 0 H GLU A 62 -3.754 -11.849 1.891 1.00 43.14 H new ATOM 0 HA GLU A 62 -6.232 -10.241 1.476 1.00 40.15 H new ATOM 0 HB2 GLU A 62 -5.862 -12.714 3.218 1.00 23.43 H new ATOM 0 HB3 GLU A 62 -7.315 -11.739 3.124 1.00 23.43 H new ATOM 0 HG2 GLU A 62 -7.494 -12.330 0.674 1.00 33.32 H new ATOM 0 HG3 GLU A 62 -6.114 -13.393 0.866 1.00 33.32 H new ATOM 971 N ILE A 63 -5.854 -8.969 3.667 1.00 13.53 N ATOM 972 CA ILE A 63 -5.492 -8.096 4.803 1.00 53.00 C ATOM 973 C ILE A 63 -6.439 -8.343 6.007 1.00 12.10 C ATOM 974 O ILE A 63 -7.673 -8.314 5.895 1.00 73.14 O ATOM 975 CB ILE A 63 -5.411 -6.559 4.407 1.00 21.14 C ATOM 976 CG1 ILE A 63 -6.799 -5.904 4.092 1.00 2.21 C ATOM 977 CG2 ILE A 63 -4.439 -6.377 3.213 1.00 31.20 C ATOM 978 CD1 ILE A 63 -7.457 -6.336 2.798 1.00 14.11 C ATOM 0 H ILE A 63 -6.679 -8.660 3.153 1.00 13.53 H new ATOM 0 HA ILE A 63 -4.481 -8.369 5.107 1.00 53.00 H new ATOM 0 HB ILE A 63 -5.034 -6.034 5.285 1.00 21.14 H new ATOM 0 HG12 ILE A 63 -7.479 -6.127 4.914 1.00 2.21 H new ATOM 0 HG13 ILE A 63 -6.671 -4.822 4.068 1.00 2.21 H new ATOM 0 HG21 ILE A 63 -4.386 -5.322 2.944 1.00 31.20 H new ATOM 0 HG22 ILE A 63 -3.447 -6.730 3.494 1.00 31.20 H new ATOM 0 HG23 ILE A 63 -4.800 -6.951 2.359 1.00 31.20 H new ATOM 0 HD11 ILE A 63 -8.410 -5.820 2.684 1.00 14.11 H new ATOM 0 HD12 ILE A 63 -6.807 -6.087 1.959 1.00 14.11 H new ATOM 0 HD13 ILE A 63 -7.628 -7.412 2.818 1.00 14.11 H new ATOM 990 N TYR A 64 -5.817 -8.662 7.141 1.00 10.33 N ATOM 991 CA TYR A 64 -6.487 -8.989 8.417 1.00 52.15 C ATOM 992 C TYR A 64 -6.254 -7.851 9.429 1.00 63.23 C ATOM 993 O TYR A 64 -5.470 -6.948 9.168 1.00 1.12 O ATOM 994 CB TYR A 64 -5.900 -10.323 8.958 1.00 43.54 C ATOM 995 CG TYR A 64 -6.095 -11.521 8.017 1.00 63.33 C ATOM 996 CD1 TYR A 64 -5.157 -11.819 7.022 1.00 43.33 C ATOM 997 CD2 TYR A 64 -7.217 -12.343 8.114 1.00 65.20 C ATOM 998 CE1 TYR A 64 -5.330 -12.887 6.168 1.00 22.53 C ATOM 999 CE2 TYR A 64 -7.392 -13.416 7.259 1.00 14.40 C ATOM 1000 CZ TYR A 64 -6.444 -13.683 6.288 1.00 4.45 C ATOM 1001 OH TYR A 64 -6.614 -14.746 5.429 1.00 24.42 O ATOM 0 H TYR A 64 -4.800 -8.704 7.208 1.00 10.33 H new ATOM 0 HA TYR A 64 -7.560 -9.100 8.262 1.00 52.15 H new ATOM 0 HB2 TYR A 64 -4.834 -10.190 9.143 1.00 43.54 H new ATOM 0 HB3 TYR A 64 -6.364 -10.549 9.918 1.00 43.54 H new ATOM 0 HD1 TYR A 64 -4.279 -11.199 6.921 1.00 43.33 H new ATOM 0 HD2 TYR A 64 -7.962 -12.139 8.869 1.00 65.20 H new ATOM 0 HE1 TYR A 64 -4.593 -13.098 5.407 1.00 22.53 H new ATOM 0 HE2 TYR A 64 -8.266 -14.044 7.349 1.00 14.40 H new ATOM 0 HH TYR A 64 -6.921 -14.417 4.558 1.00 24.42 H new ATOM 1011 N ASN A 65 -6.937 -7.894 10.578 1.00 65.31 N ATOM 1012 CA ASN A 65 -6.722 -6.912 11.673 1.00 1.14 C ATOM 1013 C ASN A 65 -5.701 -7.419 12.717 1.00 74.15 C ATOM 1014 O ASN A 65 -5.323 -8.591 12.733 1.00 72.53 O ATOM 1015 CB ASN A 65 -8.070 -6.593 12.364 1.00 74.22 C ATOM 1016 CG ASN A 65 -9.049 -5.850 11.461 1.00 34.31 C ATOM 1017 OD1 ASN A 65 -8.652 -5.052 10.624 1.00 64.34 O ATOM 1018 ND2 ASN A 65 -10.331 -6.110 11.625 1.00 62.11 N ATOM 0 H ASN A 65 -7.647 -8.596 10.784 1.00 65.31 H new ATOM 0 HA ASN A 65 -6.311 -6.006 11.227 1.00 1.14 H new ATOM 0 HB2 ASN A 65 -8.529 -7.524 12.698 1.00 74.22 H new ATOM 0 HB3 ASN A 65 -7.881 -5.994 13.255 1.00 74.22 H new ATOM 0 HD21 ASN A 65 -11.025 -5.640 11.044 1.00 62.11 H new ATOM 0 HD22 ASN A 65 -10.629 -6.781 12.333 1.00 62.11 H new ATOM 1025 N GLU A 66 -5.273 -6.495 13.594 1.00 22.14 N ATOM 1026 CA GLU A 66 -4.454 -6.799 14.795 1.00 12.35 C ATOM 1027 C GLU A 66 -5.204 -7.740 15.785 1.00 51.14 C ATOM 1028 O GLU A 66 -4.584 -8.413 16.618 1.00 54.22 O ATOM 1029 CB GLU A 66 -4.075 -5.468 15.497 1.00 13.14 C ATOM 1030 CG GLU A 66 -5.289 -4.629 15.966 1.00 24.52 C ATOM 1031 CD GLU A 66 -4.907 -3.282 16.605 1.00 72.35 C ATOM 1032 OE1 GLU A 66 -4.191 -3.286 17.630 1.00 43.53 O ATOM 1033 OE2 GLU A 66 -5.329 -2.211 16.102 1.00 64.54 O ATOM 0 H GLU A 66 -5.485 -5.502 13.494 1.00 22.14 H new ATOM 0 HA GLU A 66 -3.553 -7.323 14.476 1.00 12.35 H new ATOM 0 HB2 GLU A 66 -3.447 -5.691 16.360 1.00 13.14 H new ATOM 0 HB3 GLU A 66 -3.475 -4.868 14.813 1.00 13.14 H new ATOM 0 HG2 GLU A 66 -5.941 -4.443 15.113 1.00 24.52 H new ATOM 0 HG3 GLU A 66 -5.864 -5.211 16.686 1.00 24.52 H new ATOM 1040 N GLY A 67 -6.546 -7.781 15.660 1.00 0.15 N ATOM 1041 CA GLY A 67 -7.387 -8.714 16.414 1.00 63.34 C ATOM 1042 C GLY A 67 -7.296 -10.177 15.926 1.00 71.45 C ATOM 1043 O GLY A 67 -7.995 -11.044 16.460 1.00 74.32 O ATOM 0 H GLY A 67 -7.069 -7.168 15.034 1.00 0.15 H new ATOM 0 HA2 GLY A 67 -7.103 -8.674 17.466 1.00 63.34 H new ATOM 0 HA3 GLY A 67 -8.424 -8.385 16.351 1.00 63.34 H new ATOM 1047 N HIS A 68 -6.457 -10.440 14.893 1.00 13.21 N ATOM 1048 CA HIS A 68 -6.145 -11.811 14.404 1.00 75.02 C ATOM 1049 C HIS A 68 -5.413 -12.633 15.498 1.00 3.24 C ATOM 1050 O HIS A 68 -5.569 -13.857 15.593 1.00 41.15 O ATOM 1051 CB HIS A 68 -5.277 -11.709 13.117 1.00 22.22 C ATOM 1052 CG HIS A 68 -5.143 -12.984 12.325 1.00 24.10 C ATOM 1053 ND1 HIS A 68 -6.097 -13.406 11.430 1.00 22.33 N ATOM 1054 CD2 HIS A 68 -4.149 -13.903 12.261 1.00 70.13 C ATOM 1055 CE1 HIS A 68 -5.701 -14.520 10.854 1.00 63.13 C ATOM 1056 NE2 HIS A 68 -4.520 -14.847 11.334 1.00 0.51 N ATOM 0 H HIS A 68 -5.975 -9.707 14.373 1.00 13.21 H new ATOM 0 HA HIS A 68 -7.075 -12.329 14.170 1.00 75.02 H new ATOM 0 HB2 HIS A 68 -5.705 -10.943 12.470 1.00 22.22 H new ATOM 0 HB3 HIS A 68 -4.280 -11.369 13.398 1.00 22.22 H new ATOM 0 HD2 HIS A 68 -3.233 -13.895 12.834 1.00 70.13 H new ATOM 0 HE1 HIS A 68 -6.254 -15.075 10.110 1.00 63.13 H new ATOM 0 HE2 HIS A 68 -3.972 -15.664 11.063 1.00 0.51 H new ATOM 1065 N PHE A 69 -4.611 -11.929 16.311 1.00 64.11 N ATOM 1066 CA PHE A 69 -3.935 -12.497 17.501 1.00 53.21 C ATOM 1067 C PHE A 69 -4.561 -11.931 18.803 1.00 54.20 C ATOM 1068 O PHE A 69 -5.400 -11.020 18.757 1.00 53.31 O ATOM 1069 CB PHE A 69 -2.401 -12.220 17.434 1.00 50.14 C ATOM 1070 CG PHE A 69 -1.991 -10.743 17.297 1.00 44.24 C ATOM 1071 CD1 PHE A 69 -1.836 -9.924 18.422 1.00 32.33 C ATOM 1072 CD2 PHE A 69 -1.749 -10.177 16.039 1.00 65.01 C ATOM 1073 CE1 PHE A 69 -1.460 -8.596 18.293 1.00 34.22 C ATOM 1074 CE2 PHE A 69 -1.372 -8.848 15.914 1.00 23.13 C ATOM 1075 CZ PHE A 69 -1.230 -8.059 17.040 1.00 41.20 C ATOM 0 H PHE A 69 -4.408 -10.940 16.165 1.00 64.11 H new ATOM 0 HA PHE A 69 -4.079 -13.577 17.509 1.00 53.21 H new ATOM 0 HB2 PHE A 69 -1.939 -12.623 18.335 1.00 50.14 H new ATOM 0 HB3 PHE A 69 -1.988 -12.772 16.589 1.00 50.14 H new ATOM 0 HD1 PHE A 69 -2.012 -10.333 19.406 1.00 32.33 H new ATOM 0 HD2 PHE A 69 -1.858 -10.785 15.153 1.00 65.01 H new ATOM 0 HE1 PHE A 69 -1.347 -7.980 19.173 1.00 34.22 H new ATOM 0 HE2 PHE A 69 -1.189 -8.429 14.935 1.00 23.13 H new ATOM 0 HZ PHE A 69 -0.940 -7.024 16.941 1.00 41.20 H new ATOM 1085 N ASP A 70 -4.137 -12.470 19.963 1.00 40.35 N ATOM 1086 CA ASP A 70 -4.603 -11.998 21.285 1.00 35.41 C ATOM 1087 C ASP A 70 -3.941 -10.642 21.630 1.00 63.52 C ATOM 1088 O ASP A 70 -2.827 -10.601 22.166 1.00 63.52 O ATOM 1089 CB ASP A 70 -4.302 -13.061 22.380 1.00 64.14 C ATOM 1090 CG ASP A 70 -4.939 -14.422 22.069 1.00 45.12 C ATOM 1091 OD1 ASP A 70 -6.160 -14.581 22.267 1.00 24.24 O ATOM 1092 OD2 ASP A 70 -4.228 -15.332 21.591 1.00 61.42 O ATOM 0 H ASP A 70 -3.468 -13.238 20.012 1.00 40.35 H new ATOM 0 HA ASP A 70 -5.683 -11.852 21.247 1.00 35.41 H new ATOM 0 HB2 ASP A 70 -3.223 -13.182 22.477 1.00 64.14 H new ATOM 0 HB3 ASP A 70 -4.670 -12.702 23.341 1.00 64.14 H new ATOM 1097 N PHE A 71 -4.606 -9.537 21.244 1.00 22.35 N ATOM 1098 CA PHE A 71 -4.113 -8.170 21.511 1.00 13.43 C ATOM 1099 C PHE A 71 -4.367 -7.769 22.990 1.00 63.51 C ATOM 1100 O PHE A 71 -3.475 -7.230 23.659 1.00 31.23 O ATOM 1101 CB PHE A 71 -4.780 -7.161 20.536 1.00 74.01 C ATOM 1102 CG PHE A 71 -4.290 -5.721 20.705 1.00 23.31 C ATOM 1103 CD1 PHE A 71 -2.986 -5.369 20.347 1.00 30.40 C ATOM 1104 CD2 PHE A 71 -5.114 -4.729 21.245 1.00 71.10 C ATOM 1105 CE1 PHE A 71 -2.529 -4.075 20.515 1.00 33.21 C ATOM 1106 CE2 PHE A 71 -4.651 -3.436 21.414 1.00 51.31 C ATOM 1107 CZ PHE A 71 -3.360 -3.111 21.051 1.00 62.00 C ATOM 0 H PHE A 71 -5.494 -9.564 20.742 1.00 22.35 H new ATOM 0 HA PHE A 71 -3.036 -8.150 21.344 1.00 13.43 H new ATOM 0 HB2 PHE A 71 -4.591 -7.481 19.511 1.00 74.01 H new ATOM 0 HB3 PHE A 71 -5.860 -7.187 20.684 1.00 74.01 H new ATOM 0 HD1 PHE A 71 -2.326 -6.118 19.934 1.00 30.40 H new ATOM 0 HD2 PHE A 71 -6.125 -4.975 21.534 1.00 71.10 H new ATOM 0 HE1 PHE A 71 -1.521 -3.818 20.227 1.00 33.21 H new ATOM 0 HE2 PHE A 71 -5.301 -2.680 21.830 1.00 51.31 H new ATOM 0 HZ PHE A 71 -2.999 -2.102 21.186 1.00 62.00 H new ATOM 1117 N SER A 72 -5.594 -8.046 23.480 1.00 30.31 N ATOM 1118 CA SER A 72 -6.008 -7.763 24.885 1.00 60.14 C ATOM 1119 C SER A 72 -5.273 -8.676 25.899 1.00 42.23 C ATOM 1120 O SER A 72 -4.684 -9.696 25.524 1.00 23.22 O ATOM 1121 CB SER A 72 -7.545 -7.933 25.036 1.00 60.13 C ATOM 1122 OG SER A 72 -7.985 -7.674 26.367 1.00 63.41 O ATOM 0 H SER A 72 -6.331 -8.472 22.918 1.00 30.31 H new ATOM 0 HA SER A 72 -5.732 -6.732 25.106 1.00 60.14 H new ATOM 0 HB2 SER A 72 -8.053 -7.257 24.349 1.00 60.13 H new ATOM 0 HB3 SER A 72 -7.827 -8.947 24.752 1.00 60.13 H new ATOM 0 HG SER A 72 -8.957 -7.790 26.419 1.00 63.41 H new ATOM 1128 N PHE A 73 -5.320 -8.296 27.186 1.00 74.53 N ATOM 1129 CA PHE A 73 -4.670 -9.052 28.285 1.00 14.31 C ATOM 1130 C PHE A 73 -5.618 -10.128 28.891 1.00 4.20 C ATOM 1131 O PHE A 73 -5.156 -11.055 29.567 1.00 33.45 O ATOM 1132 CB PHE A 73 -4.183 -8.060 29.375 1.00 54.10 C ATOM 1133 CG PHE A 73 -3.183 -7.021 28.857 1.00 11.42 C ATOM 1134 CD1 PHE A 73 -1.868 -7.385 28.565 1.00 3.04 C ATOM 1135 CD2 PHE A 73 -3.557 -5.690 28.646 1.00 52.13 C ATOM 1136 CE1 PHE A 73 -0.964 -6.456 28.085 1.00 73.30 C ATOM 1137 CE2 PHE A 73 -2.650 -4.763 28.168 1.00 62.42 C ATOM 1138 CZ PHE A 73 -1.354 -5.146 27.884 1.00 71.32 C ATOM 0 H PHE A 73 -5.808 -7.457 27.501 1.00 74.53 H new ATOM 0 HA PHE A 73 -3.813 -9.587 27.875 1.00 14.31 H new ATOM 0 HB2 PHE A 73 -5.046 -7.543 29.796 1.00 54.10 H new ATOM 0 HB3 PHE A 73 -3.722 -8.623 30.186 1.00 54.10 H new ATOM 0 HD1 PHE A 73 -1.552 -8.407 28.716 1.00 3.04 H new ATOM 0 HD2 PHE A 73 -4.570 -5.382 28.860 1.00 52.13 H new ATOM 0 HE1 PHE A 73 0.050 -6.755 27.866 1.00 73.30 H new ATOM 0 HE2 PHE A 73 -2.955 -3.738 28.016 1.00 62.42 H new ATOM 0 HZ PHE A 73 -0.647 -4.423 27.506 1.00 71.32 H new ATOM 1148 N GLY A 74 -6.942 -9.997 28.626 1.00 64.32 N ATOM 1149 CA GLY A 74 -7.950 -10.968 29.106 1.00 41.24 C ATOM 1150 C GLY A 74 -8.200 -10.895 30.622 1.00 10.20 C ATOM 1151 O GLY A 74 -8.241 -11.918 31.310 1.00 70.54 O ATOM 0 H GLY A 74 -7.334 -9.228 28.083 1.00 64.32 H new ATOM 0 HA2 GLY A 74 -8.890 -10.793 28.582 1.00 41.24 H new ATOM 0 HA3 GLY A 74 -7.624 -11.976 28.848 1.00 41.24 H new ATOM 1155 N LEU A 75 -8.408 -9.669 31.126 1.00 73.32 N ATOM 1156 CA LEU A 75 -8.474 -9.373 32.583 1.00 42.22 C ATOM 1157 C LEU A 75 -9.884 -9.616 33.196 1.00 50.45 C ATOM 1158 O LEU A 75 -10.034 -9.620 34.423 1.00 23.43 O ATOM 1159 CB LEU A 75 -8.042 -7.902 32.815 1.00 53.41 C ATOM 1160 CG LEU A 75 -6.640 -7.507 32.252 1.00 12.31 C ATOM 1161 CD1 LEU A 75 -6.372 -6.000 32.414 1.00 62.22 C ATOM 1162 CD2 LEU A 75 -5.515 -8.357 32.886 1.00 62.04 C ATOM 0 H LEU A 75 -8.537 -8.845 30.539 1.00 73.32 H new ATOM 0 HA LEU A 75 -7.797 -10.062 33.089 1.00 42.22 H new ATOM 0 HB2 LEU A 75 -8.790 -7.249 32.366 1.00 53.41 H new ATOM 0 HB3 LEU A 75 -8.050 -7.706 33.887 1.00 53.41 H new ATOM 0 HG LEU A 75 -6.645 -7.722 31.183 1.00 12.31 H new ATOM 0 HD11 LEU A 75 -5.388 -5.760 32.012 1.00 62.22 H new ATOM 0 HD12 LEU A 75 -7.132 -5.435 31.874 1.00 62.22 H new ATOM 0 HD13 LEU A 75 -6.406 -5.736 33.471 1.00 62.22 H new ATOM 0 HD21 LEU A 75 -4.553 -8.055 32.471 1.00 62.04 H new ATOM 0 HD22 LEU A 75 -5.508 -8.205 33.965 1.00 62.04 H new ATOM 0 HD23 LEU A 75 -5.689 -9.411 32.669 1.00 62.04 H new ATOM 1174 N GLU A 76 -10.907 -9.805 32.343 1.00 23.24 N ATOM 1175 CA GLU A 76 -12.302 -10.035 32.796 1.00 13.04 C ATOM 1176 C GLU A 76 -12.470 -11.463 33.368 1.00 22.32 C ATOM 1177 O GLU A 76 -12.380 -12.448 32.628 1.00 4.44 O ATOM 1178 CB GLU A 76 -13.295 -9.811 31.620 1.00 2.54 C ATOM 1179 CG GLU A 76 -14.786 -9.986 31.984 1.00 11.13 C ATOM 1180 CD GLU A 76 -15.731 -9.781 30.786 1.00 52.25 C ATOM 1181 OE1 GLU A 76 -15.987 -10.754 30.041 1.00 22.15 O ATOM 1182 OE2 GLU A 76 -16.227 -8.653 30.582 1.00 4.40 O ATOM 0 H GLU A 76 -10.798 -9.804 31.329 1.00 23.24 H new ATOM 0 HA GLU A 76 -12.523 -9.320 33.589 1.00 13.04 H new ATOM 0 HB2 GLU A 76 -13.148 -8.805 31.226 1.00 2.54 H new ATOM 0 HB3 GLU A 76 -13.048 -10.506 30.818 1.00 2.54 H new ATOM 0 HG2 GLU A 76 -14.939 -10.985 32.392 1.00 11.13 H new ATOM 0 HG3 GLU A 76 -15.047 -9.277 32.770 1.00 11.13 H new ATOM 1189 N HIS A 77 -12.685 -11.562 34.690 1.00 62.32 N ATOM 1190 CA HIS A 77 -12.962 -12.845 35.385 1.00 43.22 C ATOM 1191 C HIS A 77 -14.402 -12.836 35.942 1.00 15.41 C ATOM 1192 O HIS A 77 -14.752 -11.970 36.750 1.00 32.33 O ATOM 1193 CB HIS A 77 -11.931 -13.071 36.522 1.00 74.52 C ATOM 1194 CG HIS A 77 -10.514 -13.189 36.028 1.00 2.22 C ATOM 1195 ND1 HIS A 77 -9.699 -12.100 35.827 1.00 70.23 N ATOM 1196 CD2 HIS A 77 -9.780 -14.270 35.670 1.00 20.04 C ATOM 1197 CE1 HIS A 77 -8.536 -12.496 35.369 1.00 10.43 C ATOM 1198 NE2 HIS A 77 -8.554 -13.806 35.262 1.00 45.11 N ATOM 0 H HIS A 77 -12.673 -10.756 35.315 1.00 62.32 H new ATOM 0 HA HIS A 77 -12.869 -13.667 34.675 1.00 43.22 H new ATOM 0 HB2 HIS A 77 -11.994 -12.244 37.229 1.00 74.52 H new ATOM 0 HB3 HIS A 77 -12.195 -13.977 37.067 1.00 74.52 H new ATOM 0 HD1 HIS A 77 -9.960 -11.130 36.007 1.00 70.23 H new ATOM 0 HD2 HIS A 77 -10.099 -15.301 35.700 1.00 20.04 H new ATOM 0 HE1 HIS A 77 -7.704 -11.854 35.121 1.00 10.43 H new ATOM 1207 N HIS A 78 -15.233 -13.792 35.496 1.00 73.20 N ATOM 1208 CA HIS A 78 -16.650 -13.880 35.904 1.00 72.31 C ATOM 1209 C HIS A 78 -16.794 -14.617 37.253 1.00 43.33 C ATOM 1210 O HIS A 78 -16.496 -15.810 37.363 1.00 62.13 O ATOM 1211 CB HIS A 78 -17.493 -14.562 34.798 1.00 71.33 C ATOM 1212 CG HIS A 78 -17.617 -13.727 33.555 1.00 72.25 C ATOM 1213 ND1 HIS A 78 -18.542 -12.716 33.433 1.00 62.12 N ATOM 1214 CD2 HIS A 78 -16.925 -13.735 32.389 1.00 33.23 C ATOM 1215 CE1 HIS A 78 -18.423 -12.145 32.259 1.00 21.22 C ATOM 1216 NE2 HIS A 78 -17.451 -12.742 31.604 1.00 71.43 N ATOM 0 H HIS A 78 -14.946 -14.524 34.846 1.00 73.20 H new ATOM 0 HA HIS A 78 -17.030 -12.868 36.041 1.00 72.31 H new ATOM 0 HB2 HIS A 78 -17.040 -15.520 34.542 1.00 71.33 H new ATOM 0 HB3 HIS A 78 -18.489 -14.775 35.187 1.00 71.33 H new ATOM 0 HD2 HIS A 78 -16.113 -14.398 32.128 1.00 33.23 H new ATOM 0 HE1 HIS A 78 -19.021 -11.324 31.892 1.00 21.22 H new ATOM 0 HE2 HIS A 78 -17.139 -12.504 30.663 1.00 71.43 H new ATOM 1225 N HIS A 79 -17.239 -13.870 38.274 1.00 54.44 N ATOM 1226 CA HIS A 79 -17.496 -14.393 39.628 1.00 21.11 C ATOM 1227 C HIS A 79 -18.700 -13.649 40.250 1.00 61.34 C ATOM 1228 O HIS A 79 -18.732 -12.412 40.267 1.00 71.30 O ATOM 1229 CB HIS A 79 -16.223 -14.265 40.518 1.00 52.35 C ATOM 1230 CG HIS A 79 -15.589 -12.888 40.525 1.00 4.54 C ATOM 1231 ND1 HIS A 79 -16.030 -11.847 41.323 1.00 22.44 N ATOM 1232 CD2 HIS A 79 -14.540 -12.384 39.825 1.00 54.21 C ATOM 1233 CE1 HIS A 79 -15.287 -10.778 41.110 1.00 33.21 C ATOM 1234 NE2 HIS A 79 -14.378 -11.076 40.210 1.00 73.32 N ATOM 0 H HIS A 79 -17.434 -12.873 38.184 1.00 54.44 H new ATOM 0 HA HIS A 79 -17.741 -15.453 39.565 1.00 21.11 H new ATOM 0 HB2 HIS A 79 -16.483 -14.535 41.541 1.00 52.35 H new ATOM 0 HB3 HIS A 79 -15.483 -14.989 40.176 1.00 52.35 H new ATOM 0 HD1 HIS A 79 -16.811 -11.898 41.977 1.00 22.44 H new ATOM 0 HD2 HIS A 79 -13.943 -12.915 39.099 1.00 54.21 H new ATOM 0 HE1 HIS A 79 -15.406 -9.820 41.594 1.00 33.21 H new ATOM 1243 N HIS A 80 -19.700 -14.407 40.733 1.00 33.15 N ATOM 1244 CA HIS A 80 -20.917 -13.836 41.368 1.00 32.43 C ATOM 1245 C HIS A 80 -20.625 -13.374 42.820 1.00 63.43 C ATOM 1246 O HIS A 80 -21.298 -12.484 43.350 1.00 20.34 O ATOM 1247 CB HIS A 80 -22.076 -14.863 41.325 1.00 71.40 C ATOM 1248 CG HIS A 80 -22.399 -15.350 39.932 1.00 53.43 C ATOM 1249 ND1 HIS A 80 -22.643 -16.672 39.635 1.00 4.53 N ATOM 1250 CD2 HIS A 80 -22.497 -14.687 38.751 1.00 32.33 C ATOM 1251 CE1 HIS A 80 -22.874 -16.802 38.346 1.00 63.11 C ATOM 1252 NE2 HIS A 80 -22.791 -15.616 37.786 1.00 32.20 N ATOM 0 H HIS A 80 -19.695 -15.426 40.698 1.00 33.15 H new ATOM 0 HA HIS A 80 -21.221 -12.955 40.802 1.00 32.43 H new ATOM 0 HB2 HIS A 80 -21.816 -15.718 41.949 1.00 71.40 H new ATOM 0 HB3 HIS A 80 -22.968 -14.411 41.759 1.00 71.40 H new ATOM 0 HD2 HIS A 80 -22.367 -13.626 38.600 1.00 32.33 H new ATOM 0 HE1 HIS A 80 -23.095 -17.727 37.835 1.00 63.11 H new ATOM 0 HE2 HIS A 80 -22.924 -15.418 36.794 1.00 32.20 H new ATOM 1261 N HIS A 81 -19.622 -14.009 43.447 1.00 4.32 N ATOM 1262 CA HIS A 81 -19.033 -13.568 44.730 1.00 41.43 C ATOM 1263 C HIS A 81 -17.691 -12.848 44.440 1.00 72.31 C ATOM 1264 O HIS A 81 -16.891 -13.343 43.639 1.00 42.03 O ATOM 1265 CB HIS A 81 -18.810 -14.791 45.659 1.00 41.21 C ATOM 1266 CG HIS A 81 -20.072 -15.545 45.984 1.00 3.12 C ATOM 1267 ND1 HIS A 81 -20.964 -15.123 46.940 1.00 44.41 N ATOM 1268 CD2 HIS A 81 -20.594 -16.686 45.470 1.00 1.43 C ATOM 1269 CE1 HIS A 81 -21.975 -15.961 47.003 1.00 61.24 C ATOM 1270 NE2 HIS A 81 -21.778 -16.920 46.124 1.00 3.44 N ATOM 0 H HIS A 81 -19.189 -14.855 43.076 1.00 4.32 H new ATOM 0 HA HIS A 81 -19.710 -12.879 45.235 1.00 41.43 H new ATOM 0 HB2 HIS A 81 -18.103 -15.472 45.185 1.00 41.21 H new ATOM 0 HB3 HIS A 81 -18.351 -14.451 46.588 1.00 41.21 H new ATOM 0 HD2 HIS A 81 -20.160 -17.296 44.692 1.00 1.43 H new ATOM 0 HE1 HIS A 81 -22.824 -15.876 47.665 1.00 61.24 H new ATOM 0 HE2 HIS A 81 -22.403 -17.708 45.956 1.00 3.44 H new ATOM 1279 N HIS A 82 -17.468 -11.678 45.080 1.00 64.15 N ATOM 1280 CA HIS A 82 -16.295 -10.795 44.815 1.00 3.15 C ATOM 1281 C HIS A 82 -14.938 -11.530 44.963 1.00 25.01 C ATOM 1282 O HIS A 82 -13.906 -11.083 44.453 1.00 0.41 O ATOM 1283 CB HIS A 82 -16.347 -9.552 45.745 1.00 23.31 C ATOM 1284 CG HIS A 82 -16.341 -9.873 47.218 1.00 2.42 C ATOM 1285 ND1 HIS A 82 -15.187 -10.138 47.922 1.00 2.53 N ATOM 1286 CD2 HIS A 82 -17.354 -9.996 48.114 1.00 53.54 C ATOM 1287 CE1 HIS A 82 -15.486 -10.417 49.170 1.00 5.30 C ATOM 1288 NE2 HIS A 82 -16.789 -10.336 49.314 1.00 61.51 N ATOM 0 H HIS A 82 -18.094 -11.313 45.798 1.00 64.15 H new ATOM 0 HA HIS A 82 -16.361 -10.478 43.774 1.00 3.15 H new ATOM 0 HB2 HIS A 82 -15.494 -8.911 45.522 1.00 23.31 H new ATOM 0 HB3 HIS A 82 -17.245 -8.979 45.515 1.00 23.31 H new ATOM 0 HD2 HIS A 82 -18.406 -9.853 47.917 1.00 53.54 H new ATOM 0 HE1 HIS A 82 -14.780 -10.670 49.947 1.00 5.30 H new ATOM 0 HE2 HIS A 82 -17.299 -10.500 50.182 1.00 61.51 H new TER 1297 HIS A 82 ATOM 1298 N MET B 1 1.825 -12.830 10.696 1.00 12.35 N ATOM 1299 CA MET B 1 2.619 -12.097 9.701 1.00 11.35 C ATOM 1300 C MET B 1 3.853 -11.422 10.349 1.00 74.22 C ATOM 1301 O MET B 1 3.747 -10.824 11.428 1.00 4.54 O ATOM 1302 CB MET B 1 1.730 -11.043 8.992 1.00 64.23 C ATOM 1303 CG MET B 1 2.469 -10.144 7.987 1.00 73.22 C ATOM 1304 SD MET B 1 3.385 -11.095 6.750 1.00 74.34 S ATOM 1305 CE MET B 1 4.006 -9.798 5.673 1.00 42.44 C ATOM 0 H1 MET B 1 1.006 -13.270 10.230 1.00 12.35 H new ATOM 0 H2 MET B 1 2.413 -13.568 11.134 1.00 12.35 H new ATOM 0 H3 MET B 1 1.493 -12.171 11.429 1.00 12.35 H new ATOM 0 HA MET B 1 2.986 -12.810 8.963 1.00 11.35 H new ATOM 0 HB2 MET B 1 0.924 -11.560 8.471 1.00 64.23 H new ATOM 0 HB3 MET B 1 1.266 -10.411 9.750 1.00 64.23 H new ATOM 0 HG2 MET B 1 1.749 -9.498 7.484 1.00 73.22 H new ATOM 0 HG3 MET B 1 3.159 -9.494 8.525 1.00 73.22 H new ATOM 0 HE1 MET B 1 4.618 -10.240 4.887 1.00 42.44 H new ATOM 0 HE2 MET B 1 3.168 -9.265 5.224 1.00 42.44 H new ATOM 0 HE3 MET B 1 4.610 -9.101 6.254 1.00 42.44 H new ATOM 1315 N ASP B 2 5.020 -11.521 9.674 1.00 25.42 N ATOM 1316 CA ASP B 2 6.257 -10.825 10.095 1.00 42.32 C ATOM 1317 C ASP B 2 6.365 -9.429 9.438 1.00 52.32 C ATOM 1318 O ASP B 2 6.265 -9.287 8.213 1.00 24.15 O ATOM 1319 CB ASP B 2 7.511 -11.667 9.768 1.00 15.23 C ATOM 1320 CG ASP B 2 7.542 -12.999 10.523 1.00 13.14 C ATOM 1321 OD1 ASP B 2 7.603 -12.979 11.771 1.00 33.13 O ATOM 1322 OD2 ASP B 2 7.525 -14.069 9.883 1.00 25.34 O ATOM 0 H ASP B 2 5.131 -12.081 8.829 1.00 25.42 H new ATOM 0 HA ASP B 2 6.203 -10.693 11.176 1.00 42.32 H new ATOM 0 HB2 ASP B 2 7.544 -11.861 8.696 1.00 15.23 H new ATOM 0 HB3 ASP B 2 8.404 -11.093 10.016 1.00 15.23 H new ATOM 1327 N LYS B 3 6.594 -8.414 10.278 1.00 2.32 N ATOM 1328 CA LYS B 3 6.725 -6.999 9.859 1.00 15.53 C ATOM 1329 C LYS B 3 8.039 -6.751 9.061 1.00 41.01 C ATOM 1330 O LYS B 3 8.118 -5.842 8.233 1.00 13.33 O ATOM 1331 CB LYS B 3 6.674 -6.110 11.130 1.00 63.33 C ATOM 1332 CG LYS B 3 6.616 -4.583 10.876 1.00 34.22 C ATOM 1333 CD LYS B 3 6.651 -3.751 12.182 1.00 73.24 C ATOM 1334 CE LYS B 3 5.462 -4.045 13.113 1.00 64.10 C ATOM 1335 NZ LYS B 3 5.603 -3.364 14.423 1.00 11.25 N ATOM 0 H LYS B 3 6.696 -8.546 11.284 1.00 2.32 H new ATOM 0 HA LYS B 3 5.904 -6.745 9.189 1.00 15.53 H new ATOM 0 HB2 LYS B 3 5.801 -6.396 11.717 1.00 63.33 H new ATOM 0 HB3 LYS B 3 7.552 -6.326 11.738 1.00 63.33 H new ATOM 0 HG2 LYS B 3 7.456 -4.293 10.244 1.00 34.22 H new ATOM 0 HG3 LYS B 3 5.706 -4.346 10.325 1.00 34.22 H new ATOM 0 HD2 LYS B 3 7.581 -3.957 12.713 1.00 73.24 H new ATOM 0 HD3 LYS B 3 6.655 -2.690 11.931 1.00 73.24 H new ATOM 0 HE2 LYS B 3 4.538 -3.722 12.634 1.00 64.10 H new ATOM 0 HE3 LYS B 3 5.381 -5.121 13.270 1.00 64.10 H new ATOM 0 HZ1 LYS B 3 5.737 -4.074 15.171 1.00 11.25 H new ATOM 0 HZ2 LYS B 3 6.426 -2.729 14.397 1.00 11.25 H new ATOM 0 HZ3 LYS B 3 4.745 -2.811 14.621 1.00 11.25 H new ATOM 1349 N LYS B 4 9.056 -7.592 9.317 1.00 3.13 N ATOM 1350 CA LYS B 4 10.372 -7.520 8.634 1.00 73.33 C ATOM 1351 C LYS B 4 10.289 -7.834 7.109 1.00 11.52 C ATOM 1352 O LYS B 4 11.166 -7.422 6.340 1.00 72.01 O ATOM 1353 CB LYS B 4 11.360 -8.492 9.322 1.00 53.32 C ATOM 1354 CG LYS B 4 10.918 -9.981 9.307 1.00 34.23 C ATOM 1355 CD LYS B 4 11.915 -10.916 10.029 1.00 71.55 C ATOM 1356 CE LYS B 4 13.299 -10.967 9.353 1.00 54.34 C ATOM 1357 NZ LYS B 4 14.246 -11.859 10.070 1.00 64.54 N ATOM 0 H LYS B 4 8.995 -8.344 10.003 1.00 3.13 H new ATOM 0 HA LYS B 4 10.725 -6.492 8.720 1.00 73.33 H new ATOM 0 HB2 LYS B 4 12.330 -8.410 8.832 1.00 53.32 H new ATOM 0 HB3 LYS B 4 11.497 -8.178 10.357 1.00 53.32 H new ATOM 0 HG2 LYS B 4 9.940 -10.068 9.780 1.00 34.23 H new ATOM 0 HG3 LYS B 4 10.804 -10.310 8.274 1.00 34.23 H new ATOM 0 HD2 LYS B 4 12.034 -10.583 11.060 1.00 71.55 H new ATOM 0 HD3 LYS B 4 11.498 -11.923 10.065 1.00 71.55 H new ATOM 0 HE2 LYS B 4 13.186 -11.312 8.325 1.00 54.34 H new ATOM 0 HE3 LYS B 4 13.715 -9.961 9.307 1.00 54.34 H new ATOM 0 HZ1 LYS B 4 15.162 -11.860 9.578 1.00 64.54 H new ATOM 0 HZ2 LYS B 4 14.376 -11.516 11.043 1.00 64.54 H new ATOM 0 HZ3 LYS B 4 13.863 -12.826 10.092 1.00 64.54 H new ATOM 1371 N ILE B 5 9.245 -8.587 6.697 1.00 30.20 N ATOM 1372 CA ILE B 5 9.019 -8.957 5.275 1.00 33.33 C ATOM 1373 C ILE B 5 8.737 -7.704 4.403 1.00 42.04 C ATOM 1374 O ILE B 5 9.402 -7.489 3.386 1.00 54.42 O ATOM 1375 CB ILE B 5 7.829 -9.988 5.133 1.00 25.01 C ATOM 1376 CG1 ILE B 5 8.118 -11.291 5.952 1.00 43.21 C ATOM 1377 CG2 ILE B 5 7.530 -10.328 3.645 1.00 30.21 C ATOM 1378 CD1 ILE B 5 6.982 -12.315 5.958 1.00 31.41 C ATOM 0 H ILE B 5 8.538 -8.955 7.333 1.00 30.20 H new ATOM 0 HA ILE B 5 9.934 -9.429 4.918 1.00 33.33 H new ATOM 0 HB ILE B 5 6.939 -9.512 5.544 1.00 25.01 H new ATOM 0 HG12 ILE B 5 9.013 -11.765 5.548 1.00 43.21 H new ATOM 0 HG13 ILE B 5 8.342 -11.013 6.982 1.00 43.21 H new ATOM 0 HG21 ILE B 5 6.706 -11.039 3.593 1.00 30.21 H new ATOM 0 HG22 ILE B 5 7.258 -9.417 3.111 1.00 30.21 H new ATOM 0 HG23 ILE B 5 8.417 -10.766 3.187 1.00 30.21 H new ATOM 0 HD11 ILE B 5 7.276 -13.181 6.550 1.00 31.41 H new ATOM 0 HD12 ILE B 5 6.089 -11.865 6.392 1.00 31.41 H new ATOM 0 HD13 ILE B 5 6.770 -12.629 4.936 1.00 31.41 H new ATOM 1390 N VAL B 6 7.754 -6.880 4.825 1.00 33.12 N ATOM 1391 CA VAL B 6 7.375 -5.638 4.099 1.00 33.41 C ATOM 1392 C VAL B 6 8.527 -4.599 4.090 1.00 12.25 C ATOM 1393 O VAL B 6 8.616 -3.781 3.176 1.00 52.21 O ATOM 1394 CB VAL B 6 6.050 -5.000 4.671 1.00 71.41 C ATOM 1395 CG1 VAL B 6 4.900 -6.032 4.642 1.00 12.01 C ATOM 1396 CG2 VAL B 6 6.246 -4.422 6.095 1.00 53.44 C ATOM 0 H VAL B 6 7.204 -7.049 5.667 1.00 33.12 H new ATOM 0 HA VAL B 6 7.182 -5.930 3.067 1.00 33.41 H new ATOM 0 HB VAL B 6 5.784 -4.162 4.026 1.00 71.41 H new ATOM 0 HG11 VAL B 6 3.993 -5.577 5.040 1.00 12.01 H new ATOM 0 HG12 VAL B 6 4.725 -6.353 3.615 1.00 12.01 H new ATOM 0 HG13 VAL B 6 5.170 -6.895 5.251 1.00 12.01 H new ATOM 0 HG21 VAL B 6 5.307 -3.994 6.446 1.00 53.44 H new ATOM 0 HG22 VAL B 6 6.557 -5.218 6.771 1.00 53.44 H new ATOM 0 HG23 VAL B 6 7.012 -3.647 6.071 1.00 53.44 H new ATOM 1406 N GLY B 7 9.400 -4.665 5.116 1.00 43.24 N ATOM 1407 CA GLY B 7 10.622 -3.848 5.171 1.00 54.13 C ATOM 1408 C GLY B 7 11.629 -4.199 4.064 1.00 74.11 C ATOM 1409 O GLY B 7 12.176 -3.311 3.397 1.00 30.44 O ATOM 0 H GLY B 7 9.277 -5.280 5.920 1.00 43.24 H new ATOM 0 HA2 GLY B 7 10.353 -2.795 5.089 1.00 54.13 H new ATOM 0 HA3 GLY B 7 11.098 -3.981 6.143 1.00 54.13 H new ATOM 1413 N ALA B 8 11.855 -5.514 3.872 1.00 32.05 N ATOM 1414 CA ALA B 8 12.739 -6.051 2.807 1.00 11.15 C ATOM 1415 C ALA B 8 12.175 -5.762 1.389 1.00 62.14 C ATOM 1416 O ALA B 8 12.928 -5.434 0.464 1.00 63.34 O ATOM 1417 CB ALA B 8 12.942 -7.560 3.012 1.00 51.43 C ATOM 0 H ALA B 8 11.431 -6.239 4.450 1.00 32.05 H new ATOM 0 HA ALA B 8 13.702 -5.545 2.879 1.00 11.15 H new ATOM 0 HB1 ALA B 8 13.591 -7.950 2.228 1.00 51.43 H new ATOM 0 HB2 ALA B 8 13.401 -7.737 3.985 1.00 51.43 H new ATOM 0 HB3 ALA B 8 11.978 -8.066 2.969 1.00 51.43 H new ATOM 1423 N ASN B 9 10.838 -5.894 1.243 1.00 42.23 N ATOM 1424 CA ASN B 9 10.107 -5.553 -0.007 1.00 61.32 C ATOM 1425 C ASN B 9 10.269 -4.050 -0.351 1.00 13.24 C ATOM 1426 O ASN B 9 10.522 -3.681 -1.501 1.00 54.31 O ATOM 1427 CB ASN B 9 8.594 -5.900 0.137 1.00 31.24 C ATOM 1428 CG ASN B 9 8.319 -7.393 0.351 1.00 33.50 C ATOM 1429 OD1 ASN B 9 9.033 -8.253 -0.150 1.00 31.42 O ATOM 1430 ND2 ASN B 9 7.273 -7.713 1.096 1.00 45.55 N ATOM 0 H ASN B 9 10.231 -6.240 1.986 1.00 42.23 H new ATOM 0 HA ASN B 9 10.534 -6.143 -0.818 1.00 61.32 H new ATOM 0 HB2 ASN B 9 8.181 -5.340 0.976 1.00 31.24 H new ATOM 0 HB3 ASN B 9 8.068 -5.568 -0.758 1.00 31.24 H new ATOM 0 HD21 ASN B 9 7.047 -8.693 1.263 1.00 45.55 H new ATOM 0 HD22 ASN B 9 6.693 -6.979 1.503 1.00 45.55 H new ATOM 1437 N ALA B 10 10.179 -3.207 0.690 1.00 62.44 N ATOM 1438 CA ALA B 10 10.222 -1.734 0.566 1.00 64.33 C ATOM 1439 C ALA B 10 11.652 -1.202 0.314 1.00 44.11 C ATOM 1440 O ALA B 10 11.827 -0.101 -0.220 1.00 24.03 O ATOM 1441 CB ALA B 10 9.639 -1.111 1.831 1.00 43.01 C ATOM 0 H ALA B 10 10.073 -3.528 1.652 1.00 62.44 H new ATOM 0 HA ALA B 10 9.627 -1.452 -0.303 1.00 64.33 H new ATOM 0 HB1 ALA B 10 9.667 -0.025 1.748 1.00 43.01 H new ATOM 0 HB2 ALA B 10 8.607 -1.439 1.956 1.00 43.01 H new ATOM 0 HB3 ALA B 10 10.226 -1.424 2.695 1.00 43.01 H new ATOM 1447 N GLY B 11 12.667 -1.988 0.727 1.00 32.35 N ATOM 1448 CA GLY B 11 14.074 -1.693 0.411 1.00 21.21 C ATOM 1449 C GLY B 11 14.351 -1.685 -1.095 1.00 12.12 C ATOM 1450 O GLY B 11 15.056 -0.812 -1.615 1.00 13.44 O ATOM 0 H GLY B 11 12.535 -2.834 1.282 1.00 32.35 H new ATOM 0 HA2 GLY B 11 14.341 -0.723 0.831 1.00 21.21 H new ATOM 0 HA3 GLY B 11 14.713 -2.435 0.890 1.00 21.21 H new ATOM 1454 N LYS B 12 13.750 -2.665 -1.786 1.00 3.35 N ATOM 1455 CA LYS B 12 13.824 -2.808 -3.255 1.00 71.30 C ATOM 1456 C LYS B 12 13.009 -1.689 -3.975 1.00 64.30 C ATOM 1457 O LYS B 12 13.457 -1.134 -4.990 1.00 63.42 O ATOM 1458 CB LYS B 12 13.291 -4.211 -3.641 1.00 11.42 C ATOM 1459 CG LYS B 12 13.402 -4.571 -5.136 1.00 43.25 C ATOM 1460 CD LYS B 12 12.800 -5.959 -5.461 1.00 11.12 C ATOM 1461 CE LYS B 12 13.504 -7.123 -4.744 1.00 13.44 C ATOM 1462 NZ LYS B 12 14.933 -7.240 -5.133 1.00 5.33 N ATOM 0 H LYS B 12 13.191 -3.391 -1.339 1.00 3.35 H new ATOM 0 HA LYS B 12 14.861 -2.705 -3.576 1.00 71.30 H new ATOM 0 HB2 LYS B 12 13.834 -4.959 -3.063 1.00 11.42 H new ATOM 0 HB3 LYS B 12 12.244 -4.278 -3.345 1.00 11.42 H new ATOM 0 HG2 LYS B 12 12.892 -3.811 -5.728 1.00 43.25 H new ATOM 0 HG3 LYS B 12 14.451 -4.556 -5.433 1.00 43.25 H new ATOM 0 HD2 LYS B 12 11.745 -5.960 -5.187 1.00 11.12 H new ATOM 0 HD3 LYS B 12 12.850 -6.124 -6.537 1.00 11.12 H new ATOM 0 HE2 LYS B 12 13.433 -6.979 -3.666 1.00 13.44 H new ATOM 0 HE3 LYS B 12 12.989 -8.055 -4.976 1.00 13.44 H new ATOM 0 HZ1 LYS B 12 15.349 -8.078 -4.678 1.00 5.33 H new ATOM 0 HZ2 LYS B 12 15.005 -7.336 -6.166 1.00 5.33 H new ATOM 0 HZ3 LYS B 12 15.447 -6.389 -4.828 1.00 5.33 H new ATOM 1476 N VAL B 13 11.813 -1.376 -3.425 1.00 1.41 N ATOM 1477 CA VAL B 13 10.913 -0.310 -3.946 1.00 53.11 C ATOM 1478 C VAL B 13 11.584 1.091 -3.909 1.00 4.21 C ATOM 1479 O VAL B 13 11.543 1.844 -4.893 1.00 51.41 O ATOM 1480 CB VAL B 13 9.548 -0.298 -3.146 1.00 62.04 C ATOM 1481 CG1 VAL B 13 8.651 0.906 -3.528 1.00 70.44 C ATOM 1482 CG2 VAL B 13 8.781 -1.634 -3.345 1.00 44.33 C ATOM 0 H VAL B 13 11.440 -1.854 -2.605 1.00 1.41 H new ATOM 0 HA VAL B 13 10.707 -0.540 -4.991 1.00 53.11 H new ATOM 0 HB VAL B 13 9.800 -0.190 -2.091 1.00 62.04 H new ATOM 0 HG11 VAL B 13 7.727 0.868 -2.952 1.00 70.44 H new ATOM 0 HG12 VAL B 13 9.177 1.835 -3.310 1.00 70.44 H new ATOM 0 HG13 VAL B 13 8.417 0.863 -4.592 1.00 70.44 H new ATOM 0 HG21 VAL B 13 7.846 -1.603 -2.786 1.00 44.33 H new ATOM 0 HG22 VAL B 13 8.566 -1.776 -4.404 1.00 44.33 H new ATOM 0 HG23 VAL B 13 9.392 -2.462 -2.985 1.00 44.33 H new ATOM 1492 N TRP B 14 12.221 1.416 -2.771 1.00 50.10 N ATOM 1493 CA TRP B 14 12.909 2.715 -2.584 1.00 71.24 C ATOM 1494 C TRP B 14 14.211 2.792 -3.422 1.00 43.11 C ATOM 1495 O TRP B 14 14.610 3.876 -3.847 1.00 44.52 O ATOM 1496 CB TRP B 14 13.194 3.010 -1.084 1.00 51.22 C ATOM 1497 CG TRP B 14 13.362 4.494 -0.804 1.00 63.25 C ATOM 1498 CD1 TRP B 14 12.372 5.388 -0.503 1.00 23.50 C ATOM 1499 CD2 TRP B 14 14.577 5.249 -0.840 1.00 70.44 C ATOM 1500 NE1 TRP B 14 12.900 6.641 -0.357 1.00 32.51 N ATOM 1501 CE2 TRP B 14 14.251 6.585 -0.554 1.00 43.33 C ATOM 1502 CE3 TRP B 14 15.906 4.914 -1.086 1.00 63.31 C ATOM 1503 CZ2 TRP B 14 15.209 7.591 -0.513 1.00 10.25 C ATOM 1504 CZ3 TRP B 14 16.861 5.908 -1.046 1.00 75.12 C ATOM 1505 CH2 TRP B 14 16.509 7.234 -0.761 1.00 11.23 C ATOM 0 H TRP B 14 12.276 0.798 -1.962 1.00 50.10 H new ATOM 0 HA TRP B 14 12.231 3.488 -2.945 1.00 71.24 H new ATOM 0 HB2 TRP B 14 12.376 2.620 -0.479 1.00 51.22 H new ATOM 0 HB3 TRP B 14 14.097 2.481 -0.778 1.00 51.22 H new ATOM 0 HD1 TRP B 14 11.326 5.141 -0.396 1.00 23.50 H new ATOM 0 HE1 TRP B 14 12.369 7.484 -0.136 1.00 32.51 H new ATOM 0 HE3 TRP B 14 16.184 3.893 -1.304 1.00 63.31 H new ATOM 0 HZ2 TRP B 14 14.940 8.614 -0.294 1.00 10.25 H new ATOM 0 HZ3 TRP B 14 17.895 5.661 -1.237 1.00 75.12 H new ATOM 0 HH2 TRP B 14 17.279 7.991 -0.736 1.00 11.23 H new ATOM 1516 N HIS B 15 14.884 1.641 -3.627 1.00 42.21 N ATOM 1517 CA HIS B 15 16.052 1.543 -4.548 1.00 72.14 C ATOM 1518 C HIS B 15 15.683 2.009 -5.989 1.00 24.51 C ATOM 1519 O HIS B 15 16.493 2.657 -6.668 1.00 53.10 O ATOM 1520 CB HIS B 15 16.610 0.093 -4.565 1.00 24.32 C ATOM 1521 CG HIS B 15 17.719 -0.134 -5.566 1.00 62.30 C ATOM 1522 ND1 HIS B 15 18.963 0.448 -5.456 1.00 50.04 N ATOM 1523 CD2 HIS B 15 17.744 -0.839 -6.726 1.00 4.14 C ATOM 1524 CE1 HIS B 15 19.697 0.119 -6.498 1.00 40.32 C ATOM 1525 NE2 HIS B 15 18.985 -0.660 -7.282 1.00 20.44 N ATOM 0 H HIS B 15 14.644 0.761 -3.170 1.00 42.21 H new ATOM 0 HA HIS B 15 16.829 2.211 -4.175 1.00 72.14 H new ATOM 0 HB2 HIS B 15 16.979 -0.154 -3.569 1.00 24.32 H new ATOM 0 HB3 HIS B 15 15.794 -0.596 -4.782 1.00 24.32 H new ATOM 0 HD2 HIS B 15 16.938 -1.430 -7.134 1.00 4.14 H new ATOM 0 HE1 HIS B 15 20.714 0.436 -6.679 1.00 40.32 H new ATOM 0 HE2 HIS B 15 19.304 -1.066 -8.162 1.00 20.44 H new ATOM 1534 N ALA B 16 14.452 1.674 -6.426 1.00 24.23 N ATOM 1535 CA ALA B 16 13.904 2.129 -7.728 1.00 65.31 C ATOM 1536 C ALA B 16 13.711 3.670 -7.767 1.00 54.12 C ATOM 1537 O ALA B 16 13.868 4.298 -8.818 1.00 3.51 O ATOM 1538 CB ALA B 16 12.580 1.409 -8.024 1.00 15.25 C ATOM 0 H ALA B 16 13.811 1.085 -5.894 1.00 24.23 H new ATOM 0 HA ALA B 16 14.628 1.875 -8.502 1.00 65.31 H new ATOM 0 HB1 ALA B 16 12.186 1.750 -8.982 1.00 15.25 H new ATOM 0 HB2 ALA B 16 12.752 0.333 -8.065 1.00 15.25 H new ATOM 0 HB3 ALA B 16 11.861 1.632 -7.236 1.00 15.25 H new ATOM 1544 N LEU B 17 13.375 4.252 -6.601 1.00 51.01 N ATOM 1545 CA LEU B 17 13.220 5.716 -6.420 1.00 55.22 C ATOM 1546 C LEU B 17 14.579 6.447 -6.399 1.00 25.10 C ATOM 1547 O LEU B 17 14.699 7.562 -6.921 1.00 52.11 O ATOM 1548 CB LEU B 17 12.468 5.987 -5.097 1.00 12.24 C ATOM 1549 CG LEU B 17 10.978 5.569 -5.079 1.00 4.51 C ATOM 1550 CD1 LEU B 17 10.384 5.712 -3.669 1.00 34.54 C ATOM 1551 CD2 LEU B 17 10.187 6.390 -6.114 1.00 12.42 C ATOM 0 H LEU B 17 13.201 3.720 -5.749 1.00 51.01 H new ATOM 0 HA LEU B 17 12.654 6.100 -7.269 1.00 55.22 H new ATOM 0 HB2 LEU B 17 12.984 5.463 -4.292 1.00 12.24 H new ATOM 0 HB3 LEU B 17 12.531 7.052 -4.875 1.00 12.24 H new ATOM 0 HG LEU B 17 10.905 4.517 -5.353 1.00 4.51 H new ATOM 0 HD11 LEU B 17 9.336 5.412 -3.683 1.00 34.54 H new ATOM 0 HD12 LEU B 17 10.934 5.075 -2.976 1.00 34.54 H new ATOM 0 HD13 LEU B 17 10.460 6.750 -3.346 1.00 34.54 H new ATOM 0 HD21 LEU B 17 9.140 6.089 -6.094 1.00 12.42 H new ATOM 0 HD22 LEU B 17 10.264 7.450 -5.873 1.00 12.42 H new ATOM 0 HD23 LEU B 17 10.596 6.213 -7.109 1.00 12.42 H new ATOM 1563 N ASN B 18 15.589 5.805 -5.779 1.00 20.13 N ATOM 1564 CA ASN B 18 16.955 6.361 -5.642 1.00 70.05 C ATOM 1565 C ASN B 18 17.569 6.648 -7.033 1.00 73.21 C ATOM 1566 O ASN B 18 18.231 7.670 -7.236 1.00 23.31 O ATOM 1567 CB ASN B 18 17.845 5.380 -4.830 1.00 64.13 C ATOM 1568 CG ASN B 18 19.288 5.861 -4.669 1.00 42.01 C ATOM 1569 OD1 ASN B 18 20.166 5.507 -5.447 1.00 31.23 O ATOM 1570 ND2 ASN B 18 19.534 6.691 -3.675 1.00 34.01 N ATOM 0 H ASN B 18 15.482 4.883 -5.357 1.00 20.13 H new ATOM 0 HA ASN B 18 16.900 7.306 -5.102 1.00 70.05 H new ATOM 0 HB2 ASN B 18 17.406 5.235 -3.843 1.00 64.13 H new ATOM 0 HB3 ASN B 18 17.847 4.408 -5.324 1.00 64.13 H new ATOM 0 HD21 ASN B 18 20.476 7.057 -3.537 1.00 34.01 H new ATOM 0 HD22 ASN B 18 18.782 6.968 -3.044 1.00 34.01 H new ATOM 1577 N GLU B 19 17.306 5.734 -7.982 1.00 20.13 N ATOM 1578 CA GLU B 19 17.722 5.880 -9.389 1.00 60.15 C ATOM 1579 C GLU B 19 16.768 6.834 -10.159 1.00 22.34 C ATOM 1580 O GLU B 19 17.219 7.760 -10.849 1.00 54.22 O ATOM 1581 CB GLU B 19 17.754 4.482 -10.065 1.00 21.32 C ATOM 1582 CG GLU B 19 18.116 4.506 -11.562 1.00 15.42 C ATOM 1583 CD GLU B 19 18.169 3.109 -12.198 1.00 11.44 C ATOM 1584 OE1 GLU B 19 17.105 2.562 -12.550 1.00 10.44 O ATOM 1585 OE2 GLU B 19 19.274 2.544 -12.348 1.00 71.32 O ATOM 0 H GLU B 19 16.797 4.870 -7.795 1.00 20.13 H new ATOM 0 HA GLU B 19 18.720 6.319 -9.416 1.00 60.15 H new ATOM 0 HB2 GLU B 19 18.474 3.855 -9.540 1.00 21.32 H new ATOM 0 HB3 GLU B 19 16.777 4.013 -9.948 1.00 21.32 H new ATOM 0 HG2 GLU B 19 17.384 5.113 -12.096 1.00 15.42 H new ATOM 0 HG3 GLU B 19 19.084 4.991 -11.687 1.00 15.42 H new ATOM 1592 N ALA B 20 15.444 6.600 -10.017 1.00 63.33 N ATOM 1593 CA ALA B 20 14.404 7.323 -10.789 1.00 13.41 C ATOM 1594 C ALA B 20 13.102 7.506 -9.961 1.00 15.42 C ATOM 1595 O ALA B 20 12.293 6.578 -9.840 1.00 22.24 O ATOM 1596 CB ALA B 20 14.119 6.575 -12.107 1.00 12.11 C ATOM 0 H ALA B 20 15.066 5.909 -9.368 1.00 63.33 H new ATOM 0 HA ALA B 20 14.779 8.320 -11.021 1.00 13.41 H new ATOM 0 HB1 ALA B 20 13.355 7.110 -12.671 1.00 12.11 H new ATOM 0 HB2 ALA B 20 15.033 6.519 -12.698 1.00 12.11 H new ATOM 0 HB3 ALA B 20 13.768 5.567 -11.885 1.00 12.11 H new ATOM 1602 N ASP B 21 12.923 8.708 -9.376 1.00 53.02 N ATOM 1603 CA ASP B 21 11.711 9.059 -8.594 1.00 30.03 C ATOM 1604 C ASP B 21 10.494 9.380 -9.506 1.00 53.21 C ATOM 1605 O ASP B 21 10.616 9.438 -10.738 1.00 10.11 O ATOM 1606 CB ASP B 21 12.020 10.252 -7.652 1.00 65.44 C ATOM 1607 CG ASP B 21 12.410 11.536 -8.404 1.00 42.34 C ATOM 1608 OD1 ASP B 21 13.600 11.714 -8.727 1.00 3.53 O ATOM 1609 OD2 ASP B 21 11.529 12.371 -8.687 1.00 34.04 O ATOM 0 H ASP B 21 13.608 9.462 -9.429 1.00 53.02 H new ATOM 0 HA ASP B 21 11.437 8.189 -7.998 1.00 30.03 H new ATOM 0 HB2 ASP B 21 11.146 10.453 -7.033 1.00 65.44 H new ATOM 0 HB3 ASP B 21 12.830 9.974 -6.978 1.00 65.44 H new ATOM 1614 N GLY B 22 9.321 9.598 -8.879 1.00 44.10 N ATOM 1615 CA GLY B 22 8.086 9.926 -9.610 1.00 22.22 C ATOM 1616 C GLY B 22 7.413 8.720 -10.265 1.00 63.32 C ATOM 1617 O GLY B 22 6.506 8.885 -11.081 1.00 53.24 O ATOM 0 H GLY B 22 9.205 9.552 -7.867 1.00 44.10 H new ATOM 0 HA2 GLY B 22 7.382 10.393 -8.922 1.00 22.22 H new ATOM 0 HA3 GLY B 22 8.316 10.663 -10.379 1.00 22.22 H new ATOM 1621 N ILE B 23 7.842 7.504 -9.883 1.00 15.41 N ATOM 1622 CA ILE B 23 7.379 6.248 -10.513 1.00 71.32 C ATOM 1623 C ILE B 23 5.962 5.854 -9.993 1.00 21.22 C ATOM 1624 O ILE B 23 5.654 6.014 -8.803 1.00 40.13 O ATOM 1625 CB ILE B 23 8.429 5.083 -10.269 1.00 24.34 C ATOM 1626 CG1 ILE B 23 8.136 3.835 -11.172 1.00 30.23 C ATOM 1627 CG2 ILE B 23 8.502 4.685 -8.777 1.00 61.35 C ATOM 1628 CD1 ILE B 23 8.360 4.055 -12.659 1.00 64.23 C ATOM 0 H ILE B 23 8.517 7.361 -9.132 1.00 15.41 H new ATOM 0 HA ILE B 23 7.301 6.410 -11.588 1.00 71.32 H new ATOM 0 HB ILE B 23 9.406 5.472 -10.556 1.00 24.34 H new ATOM 0 HG12 ILE B 23 8.767 3.010 -10.842 1.00 30.23 H new ATOM 0 HG13 ILE B 23 7.102 3.527 -11.017 1.00 30.23 H new ATOM 0 HG21 ILE B 23 9.231 3.885 -8.649 1.00 61.35 H new ATOM 0 HG22 ILE B 23 8.803 5.549 -8.184 1.00 61.35 H new ATOM 0 HG23 ILE B 23 7.523 4.340 -8.444 1.00 61.35 H new ATOM 0 HD11 ILE B 23 8.132 3.137 -13.201 1.00 64.23 H new ATOM 0 HD12 ILE B 23 7.709 4.855 -13.011 1.00 64.23 H new ATOM 0 HD13 ILE B 23 9.400 4.330 -12.833 1.00 64.23 H new ATOM 1640 N SER B 24 5.089 5.387 -10.911 1.00 5.43 N ATOM 1641 CA SER B 24 3.722 4.916 -10.561 1.00 3.10 C ATOM 1642 C SER B 24 3.744 3.447 -10.109 1.00 15.25 C ATOM 1643 O SER B 24 4.574 2.671 -10.578 1.00 64.14 O ATOM 1644 CB SER B 24 2.750 5.096 -11.752 1.00 2.12 C ATOM 1645 OG SER B 24 2.544 6.468 -12.045 1.00 2.43 O ATOM 0 H SER B 24 5.304 5.324 -11.906 1.00 5.43 H new ATOM 0 HA SER B 24 3.366 5.526 -9.731 1.00 3.10 H new ATOM 0 HB2 SER B 24 3.150 4.590 -12.631 1.00 2.12 H new ATOM 0 HB3 SER B 24 1.795 4.624 -11.520 1.00 2.12 H new ATOM 0 HG SER B 24 2.188 6.922 -11.253 1.00 2.43 H new ATOM 1651 N ILE B 25 2.785 3.077 -9.238 1.00 21.43 N ATOM 1652 CA ILE B 25 2.735 1.748 -8.568 1.00 11.12 C ATOM 1653 C ILE B 25 2.794 0.510 -9.550 1.00 11.33 C ATOM 1654 O ILE B 25 3.560 -0.420 -9.277 1.00 10.01 O ATOM 1655 CB ILE B 25 1.470 1.628 -7.627 1.00 54.44 C ATOM 1656 CG1 ILE B 25 1.435 2.802 -6.589 1.00 63.15 C ATOM 1657 CG2 ILE B 25 1.411 0.249 -6.917 1.00 5.31 C ATOM 1658 CD1 ILE B 25 0.235 2.797 -5.643 1.00 23.11 C ATOM 0 H ILE B 25 2.015 3.691 -8.973 1.00 21.43 H new ATOM 0 HA ILE B 25 3.647 1.706 -7.973 1.00 11.12 H new ATOM 0 HB ILE B 25 0.583 1.704 -8.256 1.00 54.44 H new ATOM 0 HG12 ILE B 25 2.347 2.767 -5.993 1.00 63.15 H new ATOM 0 HG13 ILE B 25 1.445 3.747 -7.132 1.00 63.15 H new ATOM 0 HG21 ILE B 25 0.528 0.205 -6.280 1.00 5.31 H new ATOM 0 HG22 ILE B 25 1.359 -0.543 -7.664 1.00 5.31 H new ATOM 0 HG23 ILE B 25 2.305 0.115 -6.308 1.00 5.31 H new ATOM 0 HD11 ILE B 25 0.303 3.648 -4.965 1.00 23.11 H new ATOM 0 HD12 ILE B 25 -0.685 2.868 -6.223 1.00 23.11 H new ATOM 0 HD13 ILE B 25 0.230 1.872 -5.066 1.00 23.11 H new ATOM 1670 N PRO B 26 2.017 0.452 -10.708 1.00 40.35 N ATOM 1671 CA PRO B 26 2.054 -0.729 -11.617 1.00 23.33 C ATOM 1672 C PRO B 26 3.378 -0.848 -12.421 1.00 55.44 C ATOM 1673 O PRO B 26 3.804 -1.951 -12.738 1.00 71.50 O ATOM 1674 CB PRO B 26 0.825 -0.526 -12.540 1.00 43.12 C ATOM 1675 CG PRO B 26 0.627 0.957 -12.583 1.00 53.33 C ATOM 1676 CD PRO B 26 1.053 1.476 -11.218 1.00 14.41 C ATOM 0 HA PRO B 26 2.016 -1.665 -11.060 1.00 23.33 H new ATOM 0 HB2 PRO B 26 1.006 -0.931 -13.536 1.00 43.12 H new ATOM 0 HB3 PRO B 26 -0.056 -1.032 -12.145 1.00 43.12 H new ATOM 0 HG2 PRO B 26 1.224 1.408 -13.376 1.00 53.33 H new ATOM 0 HG3 PRO B 26 -0.414 1.206 -12.788 1.00 53.33 H new ATOM 0 HD2 PRO B 26 1.521 2.457 -11.296 1.00 14.41 H new ATOM 0 HD3 PRO B 26 0.198 1.583 -10.550 1.00 14.41 H new ATOM 1684 N GLU B 27 4.030 0.289 -12.708 1.00 23.23 N ATOM 1685 CA GLU B 27 5.340 0.322 -13.410 1.00 52.10 C ATOM 1686 C GLU B 27 6.450 -0.140 -12.462 1.00 33.23 C ATOM 1687 O GLU B 27 7.277 -0.995 -12.787 1.00 25.14 O ATOM 1688 CB GLU B 27 5.632 1.761 -13.891 1.00 33.34 C ATOM 1689 CG GLU B 27 4.700 2.245 -15.012 1.00 72.24 C ATOM 1690 CD GLU B 27 4.819 1.402 -16.296 1.00 13.14 C ATOM 1691 OE1 GLU B 27 5.907 1.407 -16.922 1.00 15.25 O ATOM 1692 OE2 GLU B 27 3.837 0.735 -16.686 1.00 61.13 O ATOM 0 H GLU B 27 3.673 1.213 -12.465 1.00 23.23 H new ATOM 0 HA GLU B 27 5.304 -0.347 -14.270 1.00 52.10 H new ATOM 0 HB2 GLU B 27 5.548 2.441 -13.043 1.00 33.34 H new ATOM 0 HB3 GLU B 27 6.663 1.814 -14.241 1.00 33.34 H new ATOM 0 HG2 GLU B 27 3.669 2.216 -14.659 1.00 72.24 H new ATOM 0 HG3 GLU B 27 4.928 3.285 -15.244 1.00 72.24 H new ATOM 1699 N LEU B 28 6.414 0.472 -11.282 1.00 33.12 N ATOM 1700 CA LEU B 28 7.250 0.146 -10.121 1.00 65.13 C ATOM 1701 C LEU B 28 7.149 -1.352 -9.743 1.00 72.00 C ATOM 1702 O LEU B 28 8.139 -1.954 -9.342 1.00 74.35 O ATOM 1703 CB LEU B 28 6.767 1.048 -8.970 1.00 34.01 C ATOM 1704 CG LEU B 28 7.385 0.842 -7.567 1.00 3.23 C ATOM 1705 CD1 LEU B 28 8.906 1.106 -7.534 1.00 33.23 C ATOM 1706 CD2 LEU B 28 6.626 1.709 -6.552 1.00 52.15 C ATOM 0 H LEU B 28 5.774 1.244 -11.096 1.00 33.12 H new ATOM 0 HA LEU B 28 8.302 0.323 -10.343 1.00 65.13 H new ATOM 0 HB2 LEU B 28 6.944 2.083 -9.262 1.00 34.01 H new ATOM 0 HB3 LEU B 28 5.688 0.922 -8.880 1.00 34.01 H new ATOM 0 HG LEU B 28 7.275 -0.208 -7.296 1.00 3.23 H new ATOM 0 HD11 LEU B 28 9.281 0.945 -6.523 1.00 33.23 H new ATOM 0 HD12 LEU B 28 9.409 0.425 -8.220 1.00 33.23 H new ATOM 0 HD13 LEU B 28 9.103 2.135 -7.835 1.00 33.23 H new ATOM 0 HD21 LEU B 28 7.056 1.569 -5.560 1.00 52.15 H new ATOM 0 HD22 LEU B 28 6.706 2.758 -6.838 1.00 52.15 H new ATOM 0 HD23 LEU B 28 5.576 1.416 -6.537 1.00 52.15 H new ATOM 1718 N ALA B 29 5.938 -1.926 -9.898 1.00 4.53 N ATOM 1719 CA ALA B 29 5.680 -3.370 -9.685 1.00 70.51 C ATOM 1720 C ALA B 29 6.561 -4.262 -10.600 1.00 25.42 C ATOM 1721 O ALA B 29 7.084 -5.283 -10.159 1.00 4.43 O ATOM 1722 CB ALA B 29 4.188 -3.676 -9.899 1.00 0.41 C ATOM 0 H ALA B 29 5.108 -1.402 -10.175 1.00 4.53 H new ATOM 0 HA ALA B 29 5.950 -3.607 -8.656 1.00 70.51 H new ATOM 0 HB1 ALA B 29 4.008 -4.739 -9.740 1.00 0.41 H new ATOM 0 HB2 ALA B 29 3.593 -3.098 -9.192 1.00 0.41 H new ATOM 0 HB3 ALA B 29 3.904 -3.408 -10.917 1.00 0.41 H new ATOM 1728 N ARG B 30 6.724 -3.848 -11.875 1.00 73.11 N ATOM 1729 CA ARG B 30 7.612 -4.546 -12.846 1.00 52.31 C ATOM 1730 C ARG B 30 9.103 -4.327 -12.477 1.00 34.41 C ATOM 1731 O ARG B 30 9.909 -5.260 -12.571 1.00 61.11 O ATOM 1732 CB ARG B 30 7.343 -4.083 -14.318 1.00 75.12 C ATOM 1733 CG ARG B 30 6.095 -4.702 -15.012 1.00 30.21 C ATOM 1734 CD ARG B 30 4.778 -4.388 -14.290 1.00 71.52 C ATOM 1735 NE ARG B 30 3.583 -4.874 -15.004 1.00 44.11 N ATOM 1736 CZ ARG B 30 2.414 -5.134 -14.446 1.00 13.52 C ATOM 1737 NH1 ARG B 30 2.240 -5.082 -13.156 1.00 72.45 N ATOM 1738 NH2 ARG B 30 1.421 -5.462 -15.201 1.00 71.44 N ATOM 0 H ARG B 30 6.252 -3.031 -12.263 1.00 73.11 H new ATOM 0 HA ARG B 30 7.385 -5.610 -12.787 1.00 52.31 H new ATOM 0 HB2 ARG B 30 7.236 -2.998 -14.323 1.00 75.12 H new ATOM 0 HB3 ARG B 30 8.222 -4.319 -14.918 1.00 75.12 H new ATOM 0 HG2 ARG B 30 6.037 -4.332 -16.036 1.00 30.21 H new ATOM 0 HG3 ARG B 30 6.220 -5.783 -15.071 1.00 30.21 H new ATOM 0 HD2 ARG B 30 4.803 -4.834 -13.296 1.00 71.52 H new ATOM 0 HD3 ARG B 30 4.696 -3.310 -14.154 1.00 71.52 H new ATOM 0 HE ARG B 30 3.665 -5.021 -16.010 1.00 44.11 H new ATOM 0 HH11 ARG B 30 3.019 -4.835 -12.546 1.00 72.45 H new ATOM 0 HH12 ARG B 30 1.325 -5.288 -12.756 1.00 72.45 H new ATOM 0 HH21 ARG B 30 1.545 -5.517 -16.212 1.00 71.44 H new ATOM 0 HH22 ARG B 30 0.511 -5.666 -14.787 1.00 71.44 H new ATOM 1752 N LYS B 31 9.449 -3.089 -12.045 1.00 44.21 N ATOM 1753 CA LYS B 31 10.835 -2.726 -11.618 1.00 44.45 C ATOM 1754 C LYS B 31 11.305 -3.605 -10.427 1.00 43.21 C ATOM 1755 O LYS B 31 12.441 -4.092 -10.401 1.00 71.31 O ATOM 1756 CB LYS B 31 10.912 -1.214 -11.221 1.00 53.01 C ATOM 1757 CG LYS B 31 10.426 -0.217 -12.307 1.00 50.24 C ATOM 1758 CD LYS B 31 11.268 -0.247 -13.603 1.00 1.03 C ATOM 1759 CE LYS B 31 12.684 0.326 -13.417 1.00 51.41 C ATOM 1760 NZ LYS B 31 12.670 1.784 -13.092 1.00 71.32 N ATOM 0 H LYS B 31 8.786 -2.316 -11.981 1.00 44.21 H new ATOM 0 HA LYS B 31 11.498 -2.907 -12.464 1.00 44.45 H new ATOM 0 HB2 LYS B 31 10.318 -1.061 -10.320 1.00 53.01 H new ATOM 0 HB3 LYS B 31 11.945 -0.974 -10.967 1.00 53.01 H new ATOM 0 HG2 LYS B 31 9.388 -0.441 -12.554 1.00 50.24 H new ATOM 0 HG3 LYS B 31 10.445 0.792 -11.895 1.00 50.24 H new ATOM 0 HD2 LYS B 31 11.342 -1.275 -13.957 1.00 1.03 H new ATOM 0 HD3 LYS B 31 10.752 0.320 -14.378 1.00 1.03 H new ATOM 0 HE2 LYS B 31 13.191 -0.217 -12.619 1.00 51.41 H new ATOM 0 HE3 LYS B 31 13.261 0.165 -14.328 1.00 51.41 H new ATOM 0 HZ1 LYS B 31 13.642 2.153 -13.110 1.00 71.32 H new ATOM 0 HZ2 LYS B 31 12.094 2.291 -13.795 1.00 71.32 H new ATOM 0 HZ3 LYS B 31 12.264 1.925 -12.145 1.00 71.32 H new ATOM 1774 N VAL B 32 10.397 -3.804 -9.455 1.00 13.35 N ATOM 1775 CA VAL B 32 10.663 -4.604 -8.236 1.00 72.42 C ATOM 1776 C VAL B 32 10.250 -6.091 -8.407 1.00 21.25 C ATOM 1777 O VAL B 32 10.497 -6.911 -7.516 1.00 60.12 O ATOM 1778 CB VAL B 32 9.952 -3.966 -6.982 1.00 70.10 C ATOM 1779 CG1 VAL B 32 10.367 -2.485 -6.824 1.00 74.44 C ATOM 1780 CG2 VAL B 32 8.410 -4.117 -7.037 1.00 13.53 C ATOM 0 H VAL B 32 9.454 -3.416 -9.489 1.00 13.35 H new ATOM 0 HA VAL B 32 11.740 -4.588 -8.071 1.00 72.42 H new ATOM 0 HB VAL B 32 10.284 -4.516 -6.102 1.00 70.10 H new ATOM 0 HG11 VAL B 32 9.868 -2.058 -5.954 1.00 74.44 H new ATOM 0 HG12 VAL B 32 11.447 -2.422 -6.690 1.00 74.44 H new ATOM 0 HG13 VAL B 32 10.079 -1.929 -7.716 1.00 74.44 H new ATOM 0 HG21 VAL B 32 7.968 -3.661 -6.151 1.00 13.53 H new ATOM 0 HG22 VAL B 32 8.027 -3.621 -7.929 1.00 13.53 H new ATOM 0 HG23 VAL B 32 8.149 -5.175 -7.070 1.00 13.53 H new ATOM 1790 N ASN B 33 9.610 -6.408 -9.560 1.00 63.55 N ATOM 1791 CA ASN B 33 9.218 -7.790 -9.964 1.00 22.10 C ATOM 1792 C ASN B 33 8.129 -8.410 -9.037 1.00 4.41 C ATOM 1793 O ASN B 33 7.942 -9.636 -9.005 1.00 54.34 O ATOM 1794 CB ASN B 33 10.475 -8.705 -10.090 1.00 10.41 C ATOM 1795 CG ASN B 33 11.484 -8.176 -11.122 1.00 61.41 C ATOM 1796 OD1 ASN B 33 11.418 -8.506 -12.299 1.00 21.03 O ATOM 1797 ND2 ASN B 33 12.406 -7.333 -10.690 1.00 3.44 N ATOM 0 H ASN B 33 9.346 -5.703 -10.248 1.00 63.55 H new ATOM 0 HA ASN B 33 8.754 -7.717 -10.948 1.00 22.10 H new ATOM 0 HB2 ASN B 33 10.962 -8.785 -9.118 1.00 10.41 H new ATOM 0 HB3 ASN B 33 10.162 -9.710 -10.374 1.00 10.41 H new ATOM 0 HD21 ASN B 33 13.085 -6.941 -11.343 1.00 3.44 H new ATOM 0 HD22 ASN B 33 12.439 -7.075 -9.704 1.00 3.44 H new ATOM 1804 N LEU B 34 7.384 -7.540 -8.320 1.00 23.51 N ATOM 1805 CA LEU B 34 6.265 -7.946 -7.428 1.00 73.10 C ATOM 1806 C LEU B 34 4.901 -7.534 -8.043 1.00 62.53 C ATOM 1807 O LEU B 34 4.856 -6.777 -9.012 1.00 13.23 O ATOM 1808 CB LEU B 34 6.440 -7.291 -6.023 1.00 14.43 C ATOM 1809 CG LEU B 34 7.812 -7.545 -5.308 1.00 34.34 C ATOM 1810 CD1 LEU B 34 7.889 -6.811 -3.950 1.00 44.40 C ATOM 1811 CD2 LEU B 34 8.099 -9.056 -5.154 1.00 23.15 C ATOM 0 H LEU B 34 7.539 -6.532 -8.341 1.00 23.51 H new ATOM 0 HA LEU B 34 6.281 -9.031 -7.320 1.00 73.10 H new ATOM 0 HB2 LEU B 34 6.302 -6.215 -6.127 1.00 14.43 H new ATOM 0 HB3 LEU B 34 5.643 -7.654 -5.374 1.00 14.43 H new ATOM 0 HG LEU B 34 8.593 -7.129 -5.945 1.00 34.34 H new ATOM 0 HD11 LEU B 34 8.854 -7.010 -3.483 1.00 44.40 H new ATOM 0 HD12 LEU B 34 7.777 -5.739 -4.109 1.00 44.40 H new ATOM 0 HD13 LEU B 34 7.090 -7.166 -3.299 1.00 44.40 H new ATOM 0 HD21 LEU B 34 9.058 -9.195 -4.654 1.00 23.15 H new ATOM 0 HD22 LEU B 34 7.310 -9.518 -4.560 1.00 23.15 H new ATOM 0 HD23 LEU B 34 8.132 -9.522 -6.139 1.00 23.15 H new ATOM 1823 N SER B 35 3.791 -8.028 -7.458 1.00 4.34 N ATOM 1824 CA SER B 35 2.411 -7.644 -7.878 1.00 54.15 C ATOM 1825 C SER B 35 2.079 -6.197 -7.437 1.00 61.13 C ATOM 1826 O SER B 35 2.651 -5.708 -6.464 1.00 62.21 O ATOM 1827 CB SER B 35 1.368 -8.620 -7.280 1.00 20.22 C ATOM 1828 OG SER B 35 0.040 -8.241 -7.628 1.00 12.24 O ATOM 0 H SER B 35 3.815 -8.697 -6.689 1.00 4.34 H new ATOM 0 HA SER B 35 2.369 -7.697 -8.966 1.00 54.15 H new ATOM 0 HB2 SER B 35 1.565 -9.630 -7.639 1.00 20.22 H new ATOM 0 HB3 SER B 35 1.469 -8.642 -6.195 1.00 20.22 H new ATOM 0 HG SER B 35 -0.595 -8.877 -7.237 1.00 12.24 H new ATOM 1834 N VAL B 36 1.133 -5.540 -8.143 1.00 14.03 N ATOM 1835 CA VAL B 36 0.739 -4.123 -7.878 1.00 11.40 C ATOM 1836 C VAL B 36 0.268 -3.904 -6.412 1.00 32.21 C ATOM 1837 O VAL B 36 0.663 -2.928 -5.765 1.00 11.12 O ATOM 1838 CB VAL B 36 -0.386 -3.653 -8.883 1.00 13.22 C ATOM 1839 CG1 VAL B 36 -0.880 -2.207 -8.584 1.00 13.32 C ATOM 1840 CG2 VAL B 36 0.101 -3.778 -10.349 1.00 31.32 C ATOM 0 H VAL B 36 0.618 -5.968 -8.912 1.00 14.03 H new ATOM 0 HA VAL B 36 1.632 -3.517 -8.032 1.00 11.40 H new ATOM 0 HB VAL B 36 -1.240 -4.316 -8.741 1.00 13.22 H new ATOM 0 HG11 VAL B 36 -1.652 -1.931 -9.302 1.00 13.32 H new ATOM 0 HG12 VAL B 36 -1.290 -2.164 -7.575 1.00 13.32 H new ATOM 0 HG13 VAL B 36 -0.044 -1.513 -8.666 1.00 13.32 H new ATOM 0 HG21 VAL B 36 -0.689 -3.449 -11.024 1.00 31.32 H new ATOM 0 HG22 VAL B 36 0.984 -3.156 -10.493 1.00 31.32 H new ATOM 0 HG23 VAL B 36 0.351 -4.817 -10.562 1.00 31.32 H new ATOM 1850 N GLU B 37 -0.562 -4.837 -5.907 1.00 31.21 N ATOM 1851 CA GLU B 37 -1.056 -4.828 -4.501 1.00 12.22 C ATOM 1852 C GLU B 37 0.107 -4.917 -3.480 1.00 34.22 C ATOM 1853 O GLU B 37 0.190 -4.125 -2.534 1.00 65.20 O ATOM 1854 CB GLU B 37 -2.028 -6.017 -4.278 1.00 53.43 C ATOM 1855 CG GLU B 37 -3.271 -6.010 -5.184 1.00 11.31 C ATOM 1856 CD GLU B 37 -4.182 -7.228 -4.952 1.00 61.33 C ATOM 1857 OE1 GLU B 37 -3.784 -8.351 -5.329 1.00 1.22 O ATOM 1858 OE2 GLU B 37 -5.298 -7.074 -4.412 1.00 41.04 O ATOM 0 H GLU B 37 -0.914 -5.622 -6.456 1.00 31.21 H new ATOM 0 HA GLU B 37 -1.575 -3.883 -4.340 1.00 12.22 H new ATOM 0 HB2 GLU B 37 -1.484 -6.948 -4.438 1.00 53.43 H new ATOM 0 HB3 GLU B 37 -2.353 -6.012 -3.238 1.00 53.43 H new ATOM 0 HG2 GLU B 37 -3.840 -5.097 -5.007 1.00 11.31 H new ATOM 0 HG3 GLU B 37 -2.955 -5.991 -6.227 1.00 11.31 H new ATOM 1865 N SER B 38 1.000 -5.893 -3.716 1.00 33.02 N ATOM 1866 CA SER B 38 2.193 -6.165 -2.874 1.00 0.33 C ATOM 1867 C SER B 38 3.165 -4.963 -2.845 1.00 11.41 C ATOM 1868 O SER B 38 3.754 -4.641 -1.806 1.00 71.15 O ATOM 1869 CB SER B 38 2.927 -7.404 -3.434 1.00 45.15 C ATOM 1870 OG SER B 38 2.033 -8.493 -3.620 1.00 10.11 O ATOM 0 H SER B 38 0.918 -6.530 -4.509 1.00 33.02 H new ATOM 0 HA SER B 38 1.856 -6.343 -1.853 1.00 0.33 H new ATOM 0 HB2 SER B 38 3.399 -7.152 -4.384 1.00 45.15 H new ATOM 0 HB3 SER B 38 3.724 -7.697 -2.750 1.00 45.15 H new ATOM 0 HG SER B 38 2.524 -9.262 -3.977 1.00 10.11 H new ATOM 1876 N THR B 39 3.305 -4.316 -4.012 1.00 1.31 N ATOM 1877 CA THR B 39 4.195 -3.159 -4.214 1.00 33.00 C ATOM 1878 C THR B 39 3.657 -1.907 -3.474 1.00 40.02 C ATOM 1879 O THR B 39 4.406 -1.246 -2.765 1.00 40.30 O ATOM 1880 CB THR B 39 4.374 -2.864 -5.744 1.00 71.23 C ATOM 1881 OG1 THR B 39 4.941 -4.018 -6.396 1.00 24.34 O ATOM 1882 CG2 THR B 39 5.273 -1.650 -6.013 1.00 52.15 C ATOM 0 H THR B 39 2.797 -4.584 -4.855 1.00 1.31 H new ATOM 0 HA THR B 39 5.170 -3.404 -3.793 1.00 33.00 H new ATOM 0 HB THR B 39 3.385 -2.638 -6.142 1.00 71.23 H new ATOM 0 HG1 THR B 39 4.250 -4.704 -6.507 1.00 24.34 H new ATOM 0 HG21 THR B 39 5.361 -1.493 -7.088 1.00 52.15 H new ATOM 0 HG22 THR B 39 4.836 -0.764 -5.552 1.00 52.15 H new ATOM 0 HG23 THR B 39 6.262 -1.829 -5.590 1.00 52.15 H new ATOM 1890 N ALA B 40 2.340 -1.625 -3.625 1.00 4.32 N ATOM 1891 CA ALA B 40 1.653 -0.479 -2.952 1.00 61.15 C ATOM 1892 C ALA B 40 1.691 -0.601 -1.406 1.00 64.14 C ATOM 1893 O ALA B 40 1.802 0.400 -0.688 1.00 43.44 O ATOM 1894 CB ALA B 40 0.195 -0.393 -3.432 1.00 52.50 C ATOM 0 H ALA B 40 1.719 -2.180 -4.214 1.00 4.32 H new ATOM 0 HA ALA B 40 2.189 0.431 -3.223 1.00 61.15 H new ATOM 0 HB1 ALA B 40 -0.302 0.443 -2.939 1.00 52.50 H new ATOM 0 HB2 ALA B 40 0.176 -0.242 -4.511 1.00 52.50 H new ATOM 0 HB3 ALA B 40 -0.324 -1.319 -3.186 1.00 52.50 H new ATOM 1900 N LEU B 41 1.599 -1.851 -0.925 1.00 14.11 N ATOM 1901 CA LEU B 41 1.688 -2.200 0.506 1.00 74.53 C ATOM 1902 C LEU B 41 3.146 -1.981 1.024 1.00 43.43 C ATOM 1903 O LEU B 41 3.353 -1.508 2.150 1.00 10.32 O ATOM 1904 CB LEU B 41 1.158 -3.670 0.665 1.00 35.10 C ATOM 1905 CG LEU B 41 1.190 -4.373 2.072 1.00 62.24 C ATOM 1906 CD1 LEU B 41 2.531 -5.080 2.321 1.00 31.24 C ATOM 1907 CD2 LEU B 41 0.837 -3.400 3.219 1.00 20.31 C ATOM 0 H LEU B 41 1.458 -2.662 -1.527 1.00 14.11 H new ATOM 0 HA LEU B 41 1.069 -1.553 1.127 1.00 74.53 H new ATOM 0 HB2 LEU B 41 0.123 -3.680 0.322 1.00 35.10 H new ATOM 0 HB3 LEU B 41 1.728 -4.295 -0.022 1.00 35.10 H new ATOM 0 HG LEU B 41 0.415 -5.139 2.059 1.00 62.24 H new ATOM 0 HD11 LEU B 41 2.516 -5.554 3.302 1.00 31.24 H new ATOM 0 HD12 LEU B 41 2.690 -5.838 1.554 1.00 31.24 H new ATOM 0 HD13 LEU B 41 3.340 -4.350 2.283 1.00 31.24 H new ATOM 0 HD21 LEU B 41 0.872 -3.931 4.170 1.00 20.31 H new ATOM 0 HD22 LEU B 41 1.555 -2.580 3.234 1.00 20.31 H new ATOM 0 HD23 LEU B 41 -0.166 -3.002 3.063 1.00 20.31 H new ATOM 1919 N ALA B 42 4.146 -2.304 0.174 1.00 21.22 N ATOM 1920 CA ALA B 42 5.580 -2.034 0.463 1.00 55.02 C ATOM 1921 C ALA B 42 5.880 -0.505 0.476 1.00 73.54 C ATOM 1922 O ALA B 42 6.704 -0.033 1.263 1.00 60.45 O ATOM 1923 CB ALA B 42 6.469 -2.768 -0.554 1.00 2.21 C ATOM 0 H ALA B 42 3.988 -2.756 -0.727 1.00 21.22 H new ATOM 0 HA ALA B 42 5.807 -2.413 1.459 1.00 55.02 H new ATOM 0 HB1 ALA B 42 7.517 -2.565 -0.335 1.00 2.21 H new ATOM 0 HB2 ALA B 42 6.286 -3.841 -0.489 1.00 2.21 H new ATOM 0 HB3 ALA B 42 6.235 -2.420 -1.560 1.00 2.21 H new ATOM 1929 N VAL B 43 5.186 0.261 -0.396 1.00 74.42 N ATOM 1930 CA VAL B 43 5.240 1.749 -0.398 1.00 30.43 C ATOM 1931 C VAL B 43 4.713 2.325 0.945 1.00 63.13 C ATOM 1932 O VAL B 43 5.209 3.347 1.430 1.00 14.23 O ATOM 1933 CB VAL B 43 4.419 2.361 -1.600 1.00 42.31 C ATOM 1934 CG1 VAL B 43 4.395 3.913 -1.567 1.00 41.04 C ATOM 1935 CG2 VAL B 43 4.953 1.852 -2.961 1.00 30.11 C ATOM 0 H VAL B 43 4.576 -0.127 -1.115 1.00 74.42 H new ATOM 0 HA VAL B 43 6.286 2.030 -0.520 1.00 30.43 H new ATOM 0 HB VAL B 43 3.391 2.018 -1.483 1.00 42.31 H new ATOM 0 HG11 VAL B 43 3.819 4.286 -2.414 1.00 41.04 H new ATOM 0 HG12 VAL B 43 3.935 4.250 -0.638 1.00 41.04 H new ATOM 0 HG13 VAL B 43 5.415 4.294 -1.626 1.00 41.04 H new ATOM 0 HG21 VAL B 43 4.367 2.291 -3.769 1.00 30.11 H new ATOM 0 HG22 VAL B 43 5.998 2.140 -3.072 1.00 30.11 H new ATOM 0 HG23 VAL B 43 4.870 0.766 -3.001 1.00 30.11 H new ATOM 1945 N GLY B 44 3.717 1.636 1.537 1.00 53.04 N ATOM 1946 CA GLY B 44 3.167 2.002 2.852 1.00 33.13 C ATOM 1947 C GLY B 44 4.191 1.931 4.002 1.00 14.21 C ATOM 1948 O GLY B 44 4.090 2.688 4.978 1.00 63.24 O ATOM 0 H GLY B 44 3.276 0.817 1.119 1.00 53.04 H new ATOM 0 HA2 GLY B 44 2.767 3.014 2.798 1.00 33.13 H new ATOM 0 HA3 GLY B 44 2.332 1.341 3.082 1.00 33.13 H new ATOM 1952 N TRP B 45 5.176 1.015 3.883 1.00 24.21 N ATOM 1953 CA TRP B 45 6.319 0.930 4.829 1.00 53.31 C ATOM 1954 C TRP B 45 7.250 2.164 4.685 1.00 31.25 C ATOM 1955 O TRP B 45 7.768 2.685 5.674 1.00 5.32 O ATOM 1956 CB TRP B 45 7.123 -0.381 4.609 1.00 44.30 C ATOM 1957 CG TRP B 45 8.338 -0.516 5.514 1.00 12.23 C ATOM 1958 CD1 TRP B 45 9.644 -0.230 5.209 1.00 53.14 C ATOM 1959 CD2 TRP B 45 8.340 -0.935 6.883 1.00 41.21 C ATOM 1960 NE1 TRP B 45 10.444 -0.468 6.292 1.00 24.20 N ATOM 1961 CE2 TRP B 45 9.672 -0.900 7.331 1.00 3.24 C ATOM 1962 CE3 TRP B 45 7.342 -1.343 7.767 1.00 31.13 C ATOM 1963 CZ2 TRP B 45 10.033 -1.256 8.624 1.00 53.23 C ATOM 1964 CZ3 TRP B 45 7.700 -1.695 9.054 1.00 44.42 C ATOM 1965 CH2 TRP B 45 9.036 -1.651 9.473 1.00 54.22 C ATOM 0 H TRP B 45 5.206 0.319 3.138 1.00 24.21 H new ATOM 0 HA TRP B 45 5.914 0.921 5.841 1.00 53.31 H new ATOM 0 HB2 TRP B 45 6.463 -1.233 4.773 1.00 44.30 H new ATOM 0 HB3 TRP B 45 7.449 -0.426 3.570 1.00 44.30 H new ATOM 0 HD1 TRP B 45 9.991 0.131 4.252 1.00 53.14 H new ATOM 0 HE1 TRP B 45 11.456 -0.343 6.319 1.00 24.20 H new ATOM 0 HE3 TRP B 45 6.310 -1.383 7.452 1.00 31.13 H new ATOM 0 HZ2 TRP B 45 11.063 -1.222 8.947 1.00 53.23 H new ATOM 0 HZ3 TRP B 45 6.936 -2.010 9.750 1.00 44.42 H new ATOM 0 HH2 TRP B 45 9.283 -1.934 10.485 1.00 54.22 H new ATOM 1976 N LEU B 46 7.459 2.616 3.441 1.00 31.21 N ATOM 1977 CA LEU B 46 8.260 3.830 3.148 1.00 12.34 C ATOM 1978 C LEU B 46 7.524 5.115 3.608 1.00 70.13 C ATOM 1979 O LEU B 46 8.159 6.099 4.001 1.00 62.13 O ATOM 1980 CB LEU B 46 8.578 3.892 1.635 1.00 21.54 C ATOM 1981 CG LEU B 46 9.394 2.697 1.062 1.00 22.22 C ATOM 1982 CD1 LEU B 46 9.604 2.834 -0.460 1.00 64.53 C ATOM 1983 CD2 LEU B 46 10.736 2.539 1.810 1.00 64.40 C ATOM 0 H LEU B 46 7.084 2.160 2.609 1.00 31.21 H new ATOM 0 HA LEU B 46 9.194 3.772 3.707 1.00 12.34 H new ATOM 0 HB2 LEU B 46 7.637 3.960 1.088 1.00 21.54 H new ATOM 0 HB3 LEU B 46 9.129 4.811 1.437 1.00 21.54 H new ATOM 0 HG LEU B 46 8.815 1.788 1.224 1.00 22.22 H new ATOM 0 HD11 LEU B 46 10.177 1.982 -0.826 1.00 64.53 H new ATOM 0 HD12 LEU B 46 8.636 2.861 -0.960 1.00 64.53 H new ATOM 0 HD13 LEU B 46 10.147 3.755 -0.671 1.00 64.53 H new ATOM 0 HD21 LEU B 46 11.289 1.698 1.392 1.00 64.40 H new ATOM 0 HD22 LEU B 46 11.324 3.450 1.699 1.00 64.40 H new ATOM 0 HD23 LEU B 46 10.544 2.357 2.867 1.00 64.40 H new ATOM 1995 N ALA B 47 6.179 5.091 3.524 1.00 40.14 N ATOM 1996 CA ALA B 47 5.295 6.138 4.093 1.00 35.01 C ATOM 1997 C ALA B 47 5.381 6.178 5.641 1.00 62.33 C ATOM 1998 O ALA B 47 5.220 7.240 6.247 1.00 44.11 O ATOM 1999 CB ALA B 47 3.845 5.909 3.628 1.00 62.31 C ATOM 0 H ALA B 47 5.668 4.341 3.057 1.00 40.14 H new ATOM 0 HA ALA B 47 5.635 7.107 3.727 1.00 35.01 H new ATOM 0 HB1 ALA B 47 3.201 6.681 4.049 1.00 62.31 H new ATOM 0 HB2 ALA B 47 3.801 5.954 2.540 1.00 62.31 H new ATOM 0 HB3 ALA B 47 3.505 4.930 3.965 1.00 62.31 H new ATOM 2005 N ARG B 48 5.631 5.003 6.264 1.00 13.21 N ATOM 2006 CA ARG B 48 5.946 4.887 7.711 1.00 54.34 C ATOM 2007 C ARG B 48 7.300 5.562 8.049 1.00 74.04 C ATOM 2008 O ARG B 48 7.412 6.304 9.031 1.00 63.11 O ATOM 2009 CB ARG B 48 5.943 3.382 8.127 1.00 21.21 C ATOM 2010 CG ARG B 48 6.572 3.055 9.505 1.00 41.20 C ATOM 2011 CD ARG B 48 6.400 1.577 9.903 1.00 5.04 C ATOM 2012 NE ARG B 48 7.220 1.215 11.080 1.00 13.34 N ATOM 2013 CZ ARG B 48 6.790 0.631 12.181 1.00 42.04 C ATOM 2014 NH1 ARG B 48 5.521 0.403 12.388 1.00 24.30 N ATOM 2015 NH2 ARG B 48 7.652 0.303 13.091 1.00 22.11 N ATOM 0 H ARG B 48 5.620 4.106 5.779 1.00 13.21 H new ATOM 0 HA ARG B 48 5.179 5.411 8.281 1.00 54.34 H new ATOM 0 HB2 ARG B 48 4.912 3.028 8.128 1.00 21.21 H new ATOM 0 HB3 ARG B 48 6.474 2.814 7.364 1.00 21.21 H new ATOM 0 HG2 ARG B 48 7.634 3.299 9.482 1.00 41.20 H new ATOM 0 HG3 ARG B 48 6.116 3.687 10.267 1.00 41.20 H new ATOM 0 HD2 ARG B 48 5.350 1.381 10.120 1.00 5.04 H new ATOM 0 HD3 ARG B 48 6.676 0.942 9.061 1.00 5.04 H new ATOM 0 HE ARG B 48 8.214 1.439 11.035 1.00 13.34 H new ATOM 0 HH11 ARG B 48 4.832 0.679 11.688 1.00 24.30 H new ATOM 0 HH12 ARG B 48 5.218 -0.051 13.250 1.00 24.30 H new ATOM 0 HH21 ARG B 48 8.643 0.498 12.948 1.00 22.11 H new ATOM 0 HH22 ARG B 48 7.340 -0.150 13.950 1.00 22.11 H new ATOM 2029 N GLU B 49 8.313 5.299 7.207 1.00 64.43 N ATOM 2030 CA GLU B 49 9.675 5.868 7.364 1.00 30.11 C ATOM 2031 C GLU B 49 9.774 7.335 6.833 1.00 30.14 C ATOM 2032 O GLU B 49 10.837 7.968 6.936 1.00 31.23 O ATOM 2033 CB GLU B 49 10.693 4.956 6.633 1.00 20.53 C ATOM 2034 CG GLU B 49 10.655 3.468 7.051 1.00 52.05 C ATOM 2035 CD GLU B 49 11.685 2.583 6.314 1.00 35.11 C ATOM 2036 OE1 GLU B 49 11.804 2.682 5.071 1.00 74.21 O ATOM 2037 OE2 GLU B 49 12.374 1.767 6.972 1.00 34.52 O ATOM 0 H GLU B 49 8.218 4.687 6.397 1.00 64.43 H new ATOM 0 HA GLU B 49 9.904 5.907 8.429 1.00 30.11 H new ATOM 0 HB2 GLU B 49 10.511 5.021 5.560 1.00 20.53 H new ATOM 0 HB3 GLU B 49 11.697 5.342 6.810 1.00 20.53 H new ATOM 0 HG2 GLU B 49 10.833 3.398 8.124 1.00 52.05 H new ATOM 0 HG3 GLU B 49 9.655 3.075 6.867 1.00 52.05 H new ATOM 2044 N ASN B 50 8.659 7.839 6.242 1.00 25.34 N ATOM 2045 CA ASN B 50 8.518 9.228 5.708 1.00 72.35 C ATOM 2046 C ASN B 50 9.512 9.538 4.549 1.00 40.20 C ATOM 2047 O ASN B 50 9.770 10.704 4.226 1.00 74.50 O ATOM 2048 CB ASN B 50 8.653 10.273 6.853 1.00 51.21 C ATOM 2049 CG ASN B 50 7.646 10.071 7.990 1.00 54.15 C ATOM 2050 OD1 ASN B 50 6.564 9.533 7.797 1.00 14.31 O ATOM 2051 ND2 ASN B 50 7.989 10.517 9.182 1.00 11.23 N ATOM 0 H ASN B 50 7.813 7.283 6.119 1.00 25.34 H new ATOM 0 HA ASN B 50 7.517 9.300 5.281 1.00 72.35 H new ATOM 0 HB2 ASN B 50 9.663 10.225 7.260 1.00 51.21 H new ATOM 0 HB3 ASN B 50 8.524 11.273 6.438 1.00 51.21 H new ATOM 0 HD21 ASN B 50 7.347 10.417 9.968 1.00 11.23 H new ATOM 0 HD22 ASN B 50 8.897 10.962 9.318 1.00 11.23 H new ATOM 2058 N LYS B 51 10.001 8.476 3.894 1.00 5.13 N ATOM 2059 CA LYS B 51 11.025 8.559 2.823 1.00 2.34 C ATOM 2060 C LYS B 51 10.416 8.807 1.417 1.00 51.15 C ATOM 2061 O LYS B 51 11.163 8.987 0.450 1.00 52.14 O ATOM 2062 CB LYS B 51 11.871 7.247 2.839 1.00 62.54 C ATOM 2063 CG LYS B 51 12.864 7.146 4.025 1.00 21.05 C ATOM 2064 CD LYS B 51 13.333 5.705 4.329 1.00 0.44 C ATOM 2065 CE LYS B 51 13.994 4.981 3.148 1.00 43.31 C ATOM 2066 NZ LYS B 51 14.352 3.589 3.521 1.00 65.10 N ATOM 0 H LYS B 51 9.699 7.522 4.089 1.00 5.13 H new ATOM 0 HA LYS B 51 11.658 9.422 3.027 1.00 2.34 H new ATOM 0 HB2 LYS B 51 11.195 6.392 2.872 1.00 62.54 H new ATOM 0 HB3 LYS B 51 12.429 7.176 1.905 1.00 62.54 H new ATOM 0 HG2 LYS B 51 13.736 7.763 3.809 1.00 21.05 H new ATOM 0 HG3 LYS B 51 12.393 7.560 4.917 1.00 21.05 H new ATOM 0 HD2 LYS B 51 14.038 5.735 5.159 1.00 0.44 H new ATOM 0 HD3 LYS B 51 12.475 5.121 4.661 1.00 0.44 H new ATOM 0 HE2 LYS B 51 13.316 4.971 2.295 1.00 43.31 H new ATOM 0 HE3 LYS B 51 14.888 5.521 2.838 1.00 43.31 H new ATOM 0 HZ1 LYS B 51 14.541 3.037 2.660 1.00 65.10 H new ATOM 0 HZ2 LYS B 51 15.202 3.598 4.121 1.00 65.10 H new ATOM 0 HZ3 LYS B 51 13.564 3.156 4.044 1.00 65.10 H new ATOM 2080 N VAL B 52 9.066 8.833 1.308 1.00 41.15 N ATOM 2081 CA VAL B 52 8.362 8.999 0.004 1.00 32.14 C ATOM 2082 C VAL B 52 7.343 10.157 0.029 1.00 3.24 C ATOM 2083 O VAL B 52 6.721 10.426 1.059 1.00 61.22 O ATOM 2084 CB VAL B 52 7.631 7.674 -0.456 1.00 3.02 C ATOM 2085 CG1 VAL B 52 8.655 6.553 -0.725 1.00 1.31 C ATOM 2086 CG2 VAL B 52 6.558 7.218 0.567 1.00 0.34 C ATOM 0 H VAL B 52 8.438 8.741 2.106 1.00 41.15 H new ATOM 0 HA VAL B 52 9.144 9.237 -0.717 1.00 32.14 H new ATOM 0 HB VAL B 52 7.109 7.894 -1.387 1.00 3.02 H new ATOM 0 HG11 VAL B 52 8.132 5.650 -1.040 1.00 1.31 H new ATOM 0 HG12 VAL B 52 9.341 6.868 -1.511 1.00 1.31 H new ATOM 0 HG13 VAL B 52 9.217 6.347 0.186 1.00 1.31 H new ATOM 0 HG21 VAL B 52 6.081 6.305 0.211 1.00 0.34 H new ATOM 0 HG22 VAL B 52 7.031 7.029 1.531 1.00 0.34 H new ATOM 0 HG23 VAL B 52 5.807 8.000 0.679 1.00 0.34 H new ATOM 2096 N VAL B 53 7.186 10.830 -1.130 1.00 24.12 N ATOM 2097 CA VAL B 53 6.143 11.861 -1.342 1.00 42.03 C ATOM 2098 C VAL B 53 5.120 11.311 -2.359 1.00 64.12 C ATOM 2099 O VAL B 53 5.488 10.990 -3.491 1.00 25.21 O ATOM 2100 CB VAL B 53 6.727 13.218 -1.886 1.00 72.22 C ATOM 2101 CG1 VAL B 53 5.641 14.335 -1.864 1.00 34.52 C ATOM 2102 CG2 VAL B 53 8.004 13.639 -1.118 1.00 32.12 C ATOM 0 H VAL B 53 7.778 10.676 -1.946 1.00 24.12 H new ATOM 0 HA VAL B 53 5.682 12.074 -0.378 1.00 42.03 H new ATOM 0 HB VAL B 53 7.022 13.064 -2.924 1.00 72.22 H new ATOM 0 HG11 VAL B 53 6.067 15.264 -2.244 1.00 34.52 H new ATOM 0 HG12 VAL B 53 4.800 14.038 -2.491 1.00 34.52 H new ATOM 0 HG13 VAL B 53 5.295 14.486 -0.841 1.00 34.52 H new ATOM 0 HG21 VAL B 53 8.378 14.580 -1.522 1.00 32.12 H new ATOM 0 HG22 VAL B 53 7.768 13.766 -0.061 1.00 32.12 H new ATOM 0 HG23 VAL B 53 8.766 12.868 -1.229 1.00 32.12 H new ATOM 2112 N ILE B 54 3.850 11.200 -1.955 1.00 1.44 N ATOM 2113 CA ILE B 54 2.803 10.536 -2.763 1.00 40.11 C ATOM 2114 C ILE B 54 1.826 11.578 -3.371 1.00 62.45 C ATOM 2115 O ILE B 54 1.050 12.221 -2.660 1.00 65.02 O ATOM 2116 CB ILE B 54 2.044 9.485 -1.875 1.00 42.23 C ATOM 2117 CG1 ILE B 54 3.075 8.481 -1.252 1.00 3.22 C ATOM 2118 CG2 ILE B 54 0.938 8.754 -2.675 1.00 60.35 C ATOM 2119 CD1 ILE B 54 2.500 7.470 -0.284 1.00 11.42 C ATOM 0 H ILE B 54 3.513 11.564 -1.064 1.00 1.44 H new ATOM 0 HA ILE B 54 3.272 10.013 -3.597 1.00 40.11 H new ATOM 0 HB ILE B 54 1.539 10.010 -1.064 1.00 42.23 H new ATOM 0 HG12 ILE B 54 3.566 7.943 -2.063 1.00 3.22 H new ATOM 0 HG13 ILE B 54 3.846 9.053 -0.736 1.00 3.22 H new ATOM 0 HG21 ILE B 54 0.435 8.035 -2.028 1.00 60.35 H new ATOM 0 HG22 ILE B 54 0.213 9.481 -3.042 1.00 60.35 H new ATOM 0 HG23 ILE B 54 1.386 8.230 -3.520 1.00 60.35 H new ATOM 0 HD11 ILE B 54 3.298 6.826 0.086 1.00 11.42 H new ATOM 0 HD12 ILE B 54 2.036 7.991 0.553 1.00 11.42 H new ATOM 0 HD13 ILE B 54 1.751 6.863 -0.794 1.00 11.42 H new ATOM 2131 N GLU B 55 1.875 11.720 -4.707 1.00 23.12 N ATOM 2132 CA GLU B 55 1.107 12.736 -5.464 1.00 50.11 C ATOM 2133 C GLU B 55 0.053 12.057 -6.375 1.00 0.54 C ATOM 2134 O GLU B 55 0.316 11.008 -6.959 1.00 64.41 O ATOM 2135 CB GLU B 55 2.099 13.595 -6.302 1.00 72.23 C ATOM 2136 CG GLU B 55 3.170 14.322 -5.451 1.00 60.53 C ATOM 2137 CD GLU B 55 4.149 15.225 -6.225 1.00 63.32 C ATOM 2138 OE1 GLU B 55 4.027 15.368 -7.463 1.00 53.24 O ATOM 2139 OE2 GLU B 55 5.059 15.803 -5.585 1.00 34.43 O ATOM 0 H GLU B 55 2.454 11.128 -5.302 1.00 23.12 H new ATOM 0 HA GLU B 55 0.570 13.382 -4.769 1.00 50.11 H new ATOM 0 HB2 GLU B 55 2.599 12.952 -7.027 1.00 72.23 H new ATOM 0 HB3 GLU B 55 1.535 14.336 -6.869 1.00 72.23 H new ATOM 0 HG2 GLU B 55 2.660 14.930 -4.703 1.00 60.53 H new ATOM 0 HG3 GLU B 55 3.748 13.571 -4.912 1.00 60.53 H new ATOM 2146 N ARG B 56 -1.149 12.656 -6.474 1.00 30.52 N ATOM 2147 CA ARG B 56 -2.273 12.110 -7.275 1.00 44.03 C ATOM 2148 C ARG B 56 -2.592 13.032 -8.472 1.00 1.42 C ATOM 2149 O ARG B 56 -3.169 14.114 -8.308 1.00 22.43 O ATOM 2150 CB ARG B 56 -3.525 11.916 -6.379 1.00 4.22 C ATOM 2151 CG ARG B 56 -3.350 10.866 -5.257 1.00 24.22 C ATOM 2152 CD ARG B 56 -4.595 10.750 -4.368 1.00 10.13 C ATOM 2153 NE ARG B 56 -4.471 9.679 -3.361 1.00 3.24 N ATOM 2154 CZ ARG B 56 -5.483 9.129 -2.721 1.00 64.53 C ATOM 2155 NH1 ARG B 56 -6.704 9.499 -2.963 1.00 52.13 N ATOM 2156 NH2 ARG B 56 -5.268 8.198 -1.843 1.00 30.42 N ATOM 0 H ARG B 56 -1.373 13.532 -6.003 1.00 30.52 H new ATOM 0 HA ARG B 56 -1.977 11.138 -7.671 1.00 44.03 H new ATOM 0 HB2 ARG B 56 -3.785 12.873 -5.927 1.00 4.22 H new ATOM 0 HB3 ARG B 56 -4.365 11.621 -7.008 1.00 4.22 H new ATOM 0 HG2 ARG B 56 -3.132 9.895 -5.702 1.00 24.22 H new ATOM 0 HG3 ARG B 56 -2.491 11.135 -4.642 1.00 24.22 H new ATOM 0 HD2 ARG B 56 -4.767 11.701 -3.864 1.00 10.13 H new ATOM 0 HD3 ARG B 56 -5.467 10.558 -4.993 1.00 10.13 H new ATOM 0 HE ARG B 56 -3.534 9.340 -3.144 1.00 3.24 H new ATOM 0 HH11 ARG B 56 -6.889 10.224 -3.656 1.00 52.13 H new ATOM 0 HH12 ARG B 56 -7.478 9.065 -2.460 1.00 52.13 H new ATOM 0 HH21 ARG B 56 -4.315 7.891 -1.648 1.00 30.42 H new ATOM 0 HH22 ARG B 56 -6.052 7.773 -1.348 1.00 30.42 H new ATOM 2170 N LYS B 57 -2.150 12.607 -9.667 1.00 53.25 N ATOM 2171 CA LYS B 57 -2.378 13.316 -10.950 1.00 11.24 C ATOM 2172 C LYS B 57 -3.330 12.471 -11.824 1.00 61.51 C ATOM 2173 O LYS B 57 -2.958 11.371 -12.229 1.00 43.20 O ATOM 2174 CB LYS B 57 -1.021 13.552 -11.707 1.00 62.13 C ATOM 2175 CG LYS B 57 -0.154 14.740 -11.208 1.00 41.13 C ATOM 2176 CD LYS B 57 0.188 14.687 -9.698 1.00 33.34 C ATOM 2177 CE LYS B 57 1.185 15.768 -9.269 1.00 53.22 C ATOM 2178 NZ LYS B 57 2.527 15.550 -9.875 1.00 62.03 N ATOM 0 H LYS B 57 -1.614 11.746 -9.777 1.00 53.25 H new ATOM 0 HA LYS B 57 -2.824 14.290 -10.747 1.00 11.24 H new ATOM 0 HB2 LYS B 57 -0.427 12.641 -11.636 1.00 62.13 H new ATOM 0 HB3 LYS B 57 -1.241 13.708 -12.763 1.00 62.13 H new ATOM 0 HG2 LYS B 57 0.774 14.762 -11.779 1.00 41.13 H new ATOM 0 HG3 LYS B 57 -0.679 15.672 -11.417 1.00 41.13 H new ATOM 0 HD2 LYS B 57 -0.729 14.797 -9.120 1.00 33.34 H new ATOM 0 HD3 LYS B 57 0.599 13.706 -9.459 1.00 33.34 H new ATOM 0 HE2 LYS B 57 0.808 16.748 -9.562 1.00 53.22 H new ATOM 0 HE3 LYS B 57 1.272 15.772 -8.183 1.00 53.22 H new ATOM 0 HZ1 LYS B 57 3.256 15.613 -9.136 1.00 62.03 H new ATOM 0 HZ2 LYS B 57 2.560 14.608 -10.315 1.00 62.03 H new ATOM 0 HZ3 LYS B 57 2.704 16.276 -10.598 1.00 62.03 H new ATOM 2192 N ASN B 58 -4.559 12.980 -12.088 1.00 55.43 N ATOM 2193 CA ASN B 58 -5.595 12.285 -12.915 1.00 73.33 C ATOM 2194 C ASN B 58 -6.010 10.901 -12.321 1.00 4.51 C ATOM 2195 O ASN B 58 -6.418 9.992 -13.057 1.00 42.44 O ATOM 2196 CB ASN B 58 -5.085 12.118 -14.385 1.00 12.42 C ATOM 2197 CG ASN B 58 -4.813 13.446 -15.100 1.00 42.23 C ATOM 2198 OD1 ASN B 58 -5.479 14.451 -14.862 1.00 54.22 O ATOM 2199 ND2 ASN B 58 -3.825 13.461 -15.972 1.00 31.05 N ATOM 0 H ASN B 58 -4.867 13.886 -11.735 1.00 55.43 H new ATOM 0 HA ASN B 58 -6.487 12.911 -12.907 1.00 73.33 H new ATOM 0 HB2 ASN B 58 -4.170 11.526 -14.377 1.00 12.42 H new ATOM 0 HB3 ASN B 58 -5.824 11.554 -14.954 1.00 12.42 H new ATOM 0 HD21 ASN B 58 -3.597 14.322 -16.469 1.00 31.05 H new ATOM 0 HD22 ASN B 58 -3.289 12.612 -16.150 1.00 31.05 H new ATOM 2206 N GLY B 59 -5.947 10.778 -10.980 1.00 73.13 N ATOM 2207 CA GLY B 59 -6.222 9.503 -10.279 1.00 74.34 C ATOM 2208 C GLY B 59 -5.005 8.560 -10.195 1.00 21.33 C ATOM 2209 O GLY B 59 -5.035 7.557 -9.470 1.00 32.23 O ATOM 0 H GLY B 59 -5.707 11.549 -10.356 1.00 73.13 H new ATOM 0 HA2 GLY B 59 -6.569 9.723 -9.269 1.00 74.34 H new ATOM 0 HA3 GLY B 59 -7.034 8.987 -10.790 1.00 74.34 H new ATOM 2213 N LEU B 60 -3.934 8.893 -10.932 1.00 53.41 N ATOM 2214 CA LEU B 60 -2.684 8.103 -10.979 1.00 53.14 C ATOM 2215 C LEU B 60 -1.764 8.484 -9.795 1.00 13.02 C ATOM 2216 O LEU B 60 -1.498 9.672 -9.567 1.00 41.31 O ATOM 2217 CB LEU B 60 -1.960 8.371 -12.330 1.00 23.31 C ATOM 2218 CG LEU B 60 -0.663 7.549 -12.605 1.00 73.04 C ATOM 2219 CD1 LEU B 60 -0.979 6.047 -12.776 1.00 62.43 C ATOM 2220 CD2 LEU B 60 0.118 8.120 -13.818 1.00 34.41 C ATOM 0 H LEU B 60 -3.907 9.726 -11.520 1.00 53.41 H new ATOM 0 HA LEU B 60 -2.923 7.043 -10.900 1.00 53.14 H new ATOM 0 HB2 LEU B 60 -2.665 8.175 -13.138 1.00 23.31 H new ATOM 0 HB3 LEU B 60 -1.708 9.430 -12.377 1.00 23.31 H new ATOM 0 HG LEU B 60 -0.015 7.643 -11.734 1.00 73.04 H new ATOM 0 HD11 LEU B 60 -0.055 5.500 -12.966 1.00 62.43 H new ATOM 0 HD12 LEU B 60 -1.445 5.667 -11.866 1.00 62.43 H new ATOM 0 HD13 LEU B 60 -1.660 5.912 -13.616 1.00 62.43 H new ATOM 0 HD21 LEU B 60 1.017 7.526 -13.984 1.00 34.41 H new ATOM 0 HD22 LEU B 60 -0.512 8.082 -14.707 1.00 34.41 H new ATOM 0 HD23 LEU B 60 0.399 9.154 -13.616 1.00 34.41 H new ATOM 2232 N ILE B 61 -1.290 7.470 -9.046 1.00 51.52 N ATOM 2233 CA ILE B 61 -0.361 7.670 -7.909 1.00 32.01 C ATOM 2234 C ILE B 61 1.101 7.710 -8.425 1.00 32.20 C ATOM 2235 O ILE B 61 1.536 6.806 -9.138 1.00 25.31 O ATOM 2236 CB ILE B 61 -0.502 6.546 -6.788 1.00 41.52 C ATOM 2237 CG1 ILE B 61 -1.920 6.567 -6.096 1.00 2.41 C ATOM 2238 CG2 ILE B 61 0.627 6.666 -5.721 1.00 0.50 C ATOM 2239 CD1 ILE B 61 -3.079 6.044 -6.932 1.00 11.43 C ATOM 0 H ILE B 61 -1.536 6.493 -9.208 1.00 51.52 H new ATOM 0 HA ILE B 61 -0.626 8.621 -7.446 1.00 32.01 H new ATOM 0 HB ILE B 61 -0.399 5.586 -7.295 1.00 41.52 H new ATOM 0 HG12 ILE B 61 -1.864 5.978 -5.180 1.00 2.41 H new ATOM 0 HG13 ILE B 61 -2.144 7.593 -5.802 1.00 2.41 H new ATOM 0 HG21 ILE B 61 0.503 5.885 -4.970 1.00 0.50 H new ATOM 0 HG22 ILE B 61 1.598 6.554 -6.204 1.00 0.50 H new ATOM 0 HG23 ILE B 61 0.572 7.643 -5.241 1.00 0.50 H new ATOM 0 HD11 ILE B 61 -4.001 6.107 -6.355 1.00 11.43 H new ATOM 0 HD12 ILE B 61 -3.175 6.645 -7.836 1.00 11.43 H new ATOM 0 HD13 ILE B 61 -2.891 5.005 -7.205 1.00 11.43 H new ATOM 2251 N GLU B 62 1.835 8.774 -8.064 1.00 23.34 N ATOM 2252 CA GLU B 62 3.282 8.922 -8.336 1.00 44.45 C ATOM 2253 C GLU B 62 4.010 9.063 -6.984 1.00 5.40 C ATOM 2254 O GLU B 62 3.712 9.988 -6.222 1.00 73.23 O ATOM 2255 CB GLU B 62 3.554 10.198 -9.185 1.00 42.25 C ATOM 2256 CG GLU B 62 2.751 10.326 -10.486 1.00 32.14 C ATOM 2257 CD GLU B 62 3.037 11.656 -11.214 1.00 52.35 C ATOM 2258 OE1 GLU B 62 2.740 12.732 -10.645 1.00 51.13 O ATOM 2259 OE2 GLU B 62 3.600 11.636 -12.334 1.00 10.44 O ATOM 0 H GLU B 62 1.438 9.571 -7.567 1.00 23.34 H new ATOM 0 HA GLU B 62 3.637 8.052 -8.889 1.00 44.45 H new ATOM 0 HB2 GLU B 62 3.348 11.072 -8.567 1.00 42.25 H new ATOM 0 HB3 GLU B 62 4.615 10.226 -9.432 1.00 42.25 H new ATOM 0 HG2 GLU B 62 2.994 9.493 -11.145 1.00 32.14 H new ATOM 0 HG3 GLU B 62 1.686 10.256 -10.263 1.00 32.14 H new ATOM 2266 N ILE B 63 4.947 8.158 -6.671 1.00 70.53 N ATOM 2267 CA ILE B 63 5.759 8.261 -5.442 1.00 24.30 C ATOM 2268 C ILE B 63 7.181 8.769 -5.772 1.00 51.24 C ATOM 2269 O ILE B 63 7.776 8.392 -6.784 1.00 11.15 O ATOM 2270 CB ILE B 63 5.807 6.913 -4.633 1.00 43.15 C ATOM 2271 CG1 ILE B 63 6.558 5.784 -5.405 1.00 52.05 C ATOM 2272 CG2 ILE B 63 4.368 6.465 -4.263 1.00 3.31 C ATOM 2273 CD1 ILE B 63 6.904 4.576 -4.554 1.00 2.05 C ATOM 0 H ILE B 63 5.164 7.346 -7.248 1.00 70.53 H new ATOM 0 HA ILE B 63 5.271 8.990 -4.795 1.00 24.30 H new ATOM 0 HB ILE B 63 6.372 7.097 -3.719 1.00 43.15 H new ATOM 0 HG12 ILE B 63 5.941 5.460 -6.243 1.00 52.05 H new ATOM 0 HG13 ILE B 63 7.476 6.194 -5.825 1.00 52.05 H new ATOM 0 HG21 ILE B 63 4.410 5.531 -3.703 1.00 3.31 H new ATOM 0 HG22 ILE B 63 3.894 7.233 -3.652 1.00 3.31 H new ATOM 0 HG23 ILE B 63 3.788 6.316 -5.174 1.00 3.31 H new ATOM 0 HD11 ILE B 63 7.424 3.838 -5.165 1.00 2.05 H new ATOM 0 HD12 ILE B 63 7.548 4.884 -3.730 1.00 2.05 H new ATOM 0 HD13 ILE B 63 5.989 4.138 -4.155 1.00 2.05 H new ATOM 2285 N TYR B 64 7.692 9.663 -4.916 1.00 2.53 N ATOM 2286 CA TYR B 64 9.010 10.324 -5.080 1.00 63.15 C ATOM 2287 C TYR B 64 9.904 10.027 -3.862 1.00 0.30 C ATOM 2288 O TYR B 64 9.484 9.330 -2.935 1.00 41.30 O ATOM 2289 CB TYR B 64 8.815 11.869 -5.220 1.00 22.44 C ATOM 2290 CG TYR B 64 7.956 12.316 -6.418 1.00 52.43 C ATOM 2291 CD1 TYR B 64 6.573 12.128 -6.429 1.00 13.45 C ATOM 2292 CD2 TYR B 64 8.526 12.925 -7.539 1.00 51.10 C ATOM 2293 CE1 TYR B 64 5.801 12.519 -7.501 1.00 52.14 C ATOM 2294 CE2 TYR B 64 7.751 13.322 -8.616 1.00 52.45 C ATOM 2295 CZ TYR B 64 6.391 13.117 -8.590 1.00 15.54 C ATOM 2296 OH TYR B 64 5.613 13.512 -9.654 1.00 62.41 O ATOM 0 H TYR B 64 7.199 9.958 -4.073 1.00 2.53 H new ATOM 0 HA TYR B 64 9.489 9.937 -5.979 1.00 63.15 H new ATOM 0 HB2 TYR B 64 8.358 12.246 -4.305 1.00 22.44 H new ATOM 0 HB3 TYR B 64 9.796 12.337 -5.302 1.00 22.44 H new ATOM 0 HD1 TYR B 64 6.097 11.665 -5.577 1.00 13.45 H new ATOM 0 HD2 TYR B 64 9.593 13.090 -7.566 1.00 51.10 H new ATOM 0 HE1 TYR B 64 4.733 12.356 -7.486 1.00 52.14 H new ATOM 0 HE2 TYR B 64 8.212 13.791 -9.473 1.00 52.45 H new ATOM 0 HH TYR B 64 4.754 13.041 -9.624 1.00 62.41 H new ATOM 2306 N ASN B 65 11.143 10.546 -3.876 1.00 73.00 N ATOM 2307 CA ASN B 65 12.010 10.555 -2.673 1.00 53.13 C ATOM 2308 C ASN B 65 11.643 11.753 -1.763 1.00 52.42 C ATOM 2309 O ASN B 65 10.986 12.711 -2.209 1.00 64.53 O ATOM 2310 CB ASN B 65 13.518 10.631 -3.057 1.00 23.52 C ATOM 2311 CG ASN B 65 13.976 9.498 -3.975 1.00 55.12 C ATOM 2312 OD1 ASN B 65 13.248 9.070 -4.853 1.00 53.25 O ATOM 2313 ND2 ASN B 65 15.182 8.993 -3.779 1.00 2.32 N ATOM 0 H ASN B 65 11.571 10.965 -4.702 1.00 73.00 H new ATOM 0 HA ASN B 65 11.843 9.622 -2.136 1.00 53.13 H new ATOM 0 HB2 ASN B 65 13.711 11.585 -3.548 1.00 23.52 H new ATOM 0 HB3 ASN B 65 14.117 10.614 -2.147 1.00 23.52 H new ATOM 0 HD21 ASN B 65 15.518 8.231 -4.368 1.00 2.32 H new ATOM 0 HD22 ASN B 65 15.777 9.365 -3.038 1.00 2.32 H new ATOM 2320 N GLU B 66 12.041 11.672 -0.480 1.00 21.41 N ATOM 2321 CA GLU B 66 11.926 12.793 0.481 1.00 43.24 C ATOM 2322 C GLU B 66 12.592 14.087 -0.080 1.00 2.43 C ATOM 2323 O GLU B 66 13.819 14.227 -0.057 1.00 42.45 O ATOM 2324 CB GLU B 66 12.568 12.389 1.840 1.00 5.52 C ATOM 2325 CG GLU B 66 12.418 13.436 2.964 1.00 44.35 C ATOM 2326 CD GLU B 66 13.138 13.051 4.270 1.00 12.35 C ATOM 2327 OE1 GLU B 66 12.718 12.078 4.933 1.00 23.44 O ATOM 2328 OE2 GLU B 66 14.113 13.737 4.656 1.00 52.32 O ATOM 0 H GLU B 66 12.452 10.830 -0.077 1.00 21.41 H new ATOM 0 HA GLU B 66 10.869 13.008 0.637 1.00 43.24 H new ATOM 0 HB2 GLU B 66 12.120 11.453 2.173 1.00 5.52 H new ATOM 0 HB3 GLU B 66 13.629 12.196 1.681 1.00 5.52 H new ATOM 0 HG2 GLU B 66 12.808 14.391 2.613 1.00 44.35 H new ATOM 0 HG3 GLU B 66 11.358 13.582 3.173 1.00 44.35 H new ATOM 2335 N GLY B 67 11.762 14.994 -0.634 1.00 3.14 N ATOM 2336 CA GLY B 67 12.260 16.219 -1.286 1.00 73.30 C ATOM 2337 C GLY B 67 11.137 17.092 -1.852 1.00 45.30 C ATOM 2338 O GLY B 67 11.220 18.324 -1.828 1.00 41.24 O ATOM 0 H GLY B 67 10.746 14.900 -0.642 1.00 3.14 H new ATOM 0 HA2 GLY B 67 12.836 16.799 -0.565 1.00 73.30 H new ATOM 0 HA3 GLY B 67 12.941 15.944 -2.092 1.00 73.30 H new ATOM 2342 N HIS B 68 10.077 16.442 -2.383 1.00 74.24 N ATOM 2343 CA HIS B 68 8.845 17.149 -2.841 1.00 51.21 C ATOM 2344 C HIS B 68 7.960 17.617 -1.650 1.00 74.42 C ATOM 2345 O HIS B 68 6.917 18.245 -1.861 1.00 44.21 O ATOM 2346 CB HIS B 68 8.034 16.271 -3.838 1.00 2.44 C ATOM 2347 CG HIS B 68 8.565 16.262 -5.243 1.00 74.41 C ATOM 2348 ND1 HIS B 68 7.787 16.580 -6.336 1.00 72.21 N ATOM 2349 CD2 HIS B 68 9.797 15.992 -5.729 1.00 72.24 C ATOM 2350 CE1 HIS B 68 8.513 16.515 -7.425 1.00 14.44 C ATOM 2351 NE2 HIS B 68 9.736 16.159 -7.088 1.00 53.12 N ATOM 0 H HIS B 68 10.044 15.430 -2.508 1.00 74.24 H new ATOM 0 HA HIS B 68 9.167 18.047 -3.367 1.00 51.21 H new ATOM 0 HB2 HIS B 68 8.014 15.247 -3.465 1.00 2.44 H new ATOM 0 HB3 HIS B 68 7.003 16.624 -3.856 1.00 2.44 H new ATOM 0 HD1 HIS B 68 6.798 16.828 -6.302 1.00 72.21 H new ATOM 0 HD2 HIS B 68 10.664 15.700 -5.156 1.00 72.24 H new ATOM 0 HE1 HIS B 68 8.168 16.719 -8.428 1.00 14.44 H new ATOM 2360 N PHE B 69 8.375 17.287 -0.406 1.00 11.12 N ATOM 2361 CA PHE B 69 7.855 17.942 0.817 1.00 14.52 C ATOM 2362 C PHE B 69 8.278 19.433 0.828 1.00 44.12 C ATOM 2363 O PHE B 69 7.473 20.324 1.131 1.00 74.12 O ATOM 2364 CB PHE B 69 8.392 17.241 2.093 1.00 43.31 C ATOM 2365 CG PHE B 69 7.984 15.779 2.240 1.00 20.00 C ATOM 2366 CD1 PHE B 69 6.639 15.426 2.307 1.00 21.22 C ATOM 2367 CD2 PHE B 69 8.938 14.762 2.328 1.00 35.15 C ATOM 2368 CE1 PHE B 69 6.261 14.109 2.455 1.00 22.25 C ATOM 2369 CE2 PHE B 69 8.555 13.442 2.476 1.00 53.11 C ATOM 2370 CZ PHE B 69 7.216 13.117 2.537 1.00 13.31 C ATOM 0 H PHE B 69 9.073 16.566 -0.222 1.00 11.12 H new ATOM 0 HA PHE B 69 6.768 17.866 0.813 1.00 14.52 H new ATOM 0 HB2 PHE B 69 9.480 17.301 2.093 1.00 43.31 H new ATOM 0 HB3 PHE B 69 8.042 17.791 2.967 1.00 43.31 H new ATOM 0 HD1 PHE B 69 5.882 16.194 2.242 1.00 21.22 H new ATOM 0 HD2 PHE B 69 9.988 15.010 2.280 1.00 35.15 H new ATOM 0 HE1 PHE B 69 5.213 13.853 2.507 1.00 22.25 H new ATOM 0 HE2 PHE B 69 9.303 12.666 2.544 1.00 53.11 H new ATOM 0 HZ PHE B 69 6.915 12.086 2.649 1.00 13.31 H new ATOM 2380 N ASP B 70 9.562 19.673 0.487 1.00 42.33 N ATOM 2381 CA ASP B 70 10.125 21.027 0.315 1.00 32.45 C ATOM 2382 C ASP B 70 9.539 21.694 -0.949 1.00 71.21 C ATOM 2383 O ASP B 70 9.260 21.014 -1.950 1.00 75.40 O ATOM 2384 CB ASP B 70 11.672 20.956 0.197 1.00 72.14 C ATOM 2385 CG ASP B 70 12.334 20.236 1.380 1.00 24.54 C ATOM 2386 OD1 ASP B 70 12.349 18.979 1.393 1.00 34.01 O ATOM 2387 OD2 ASP B 70 12.821 20.910 2.314 1.00 75.11 O ATOM 0 H ASP B 70 10.240 18.928 0.323 1.00 42.33 H new ATOM 0 HA ASP B 70 9.861 21.623 1.188 1.00 32.45 H new ATOM 0 HB2 ASP B 70 11.937 20.442 -0.727 1.00 72.14 H new ATOM 0 HB3 ASP B 70 12.072 21.968 0.125 1.00 72.14 H new ATOM 2392 N PHE B 71 9.361 23.020 -0.896 1.00 35.13 N ATOM 2393 CA PHE B 71 8.797 23.798 -2.021 1.00 34.14 C ATOM 2394 C PHE B 71 9.530 25.149 -2.199 1.00 64.14 C ATOM 2395 O PHE B 71 10.009 25.753 -1.229 1.00 74.22 O ATOM 2396 CB PHE B 71 7.268 24.029 -1.813 1.00 12.12 C ATOM 2397 CG PHE B 71 6.897 24.906 -0.602 1.00 74.30 C ATOM 2398 CD1 PHE B 71 6.858 24.374 0.692 1.00 33.52 C ATOM 2399 CD2 PHE B 71 6.588 26.266 -0.758 1.00 52.54 C ATOM 2400 CE1 PHE B 71 6.525 25.167 1.779 1.00 45.13 C ATOM 2401 CE2 PHE B 71 6.257 27.053 0.333 1.00 34.24 C ATOM 2402 CZ PHE B 71 6.227 26.503 1.599 1.00 71.02 C ATOM 0 H PHE B 71 9.600 23.586 -0.082 1.00 35.13 H new ATOM 0 HA PHE B 71 8.943 23.218 -2.932 1.00 34.14 H new ATOM 0 HB2 PHE B 71 6.860 24.489 -2.713 1.00 12.12 H new ATOM 0 HB3 PHE B 71 6.782 23.060 -1.702 1.00 12.12 H new ATOM 0 HD1 PHE B 71 7.091 23.331 0.846 1.00 33.52 H new ATOM 0 HD2 PHE B 71 6.609 26.706 -1.744 1.00 52.54 H new ATOM 0 HE1 PHE B 71 6.499 24.738 2.770 1.00 45.13 H new ATOM 0 HE2 PHE B 71 6.022 28.098 0.193 1.00 34.24 H new ATOM 0 HZ PHE B 71 5.970 27.118 2.449 1.00 71.02 H new ATOM 2412 N SER B 72 9.607 25.600 -3.457 1.00 15.43 N ATOM 2413 CA SER B 72 10.055 26.964 -3.824 1.00 35.45 C ATOM 2414 C SER B 72 8.821 27.832 -4.163 1.00 44.31 C ATOM 2415 O SER B 72 7.673 27.397 -3.977 1.00 2.51 O ATOM 2416 CB SER B 72 11.026 26.896 -5.035 1.00 73.34 C ATOM 2417 OG SER B 72 10.394 26.349 -6.188 1.00 40.41 O ATOM 0 H SER B 72 9.359 25.027 -4.264 1.00 15.43 H new ATOM 0 HA SER B 72 10.586 27.414 -2.985 1.00 35.45 H new ATOM 0 HB2 SER B 72 11.395 27.896 -5.262 1.00 73.34 H new ATOM 0 HB3 SER B 72 11.893 26.289 -4.773 1.00 73.34 H new ATOM 0 HG SER B 72 11.033 26.323 -6.930 1.00 40.41 H new ATOM 2423 N PHE B 73 9.054 29.064 -4.642 1.00 2.13 N ATOM 2424 CA PHE B 73 7.969 29.943 -5.125 1.00 1.15 C ATOM 2425 C PHE B 73 7.496 29.461 -6.524 1.00 51.14 C ATOM 2426 O PHE B 73 8.109 29.793 -7.547 1.00 22.22 O ATOM 2427 CB PHE B 73 8.441 31.424 -5.169 1.00 35.13 C ATOM 2428 CG PHE B 73 7.315 32.447 -5.425 1.00 75.14 C ATOM 2429 CD1 PHE B 73 6.483 32.868 -4.381 1.00 43.21 C ATOM 2430 CD2 PHE B 73 7.080 32.982 -6.699 1.00 32.22 C ATOM 2431 CE1 PHE B 73 5.465 33.783 -4.601 1.00 32.14 C ATOM 2432 CE2 PHE B 73 6.061 33.899 -6.913 1.00 13.10 C ATOM 2433 CZ PHE B 73 5.254 34.297 -5.865 1.00 14.32 C ATOM 0 H PHE B 73 9.984 29.478 -4.707 1.00 2.13 H new ATOM 0 HA PHE B 73 7.128 29.889 -4.434 1.00 1.15 H new ATOM 0 HB2 PHE B 73 8.926 31.666 -4.223 1.00 35.13 H new ATOM 0 HB3 PHE B 73 9.194 31.529 -5.950 1.00 35.13 H new ATOM 0 HD1 PHE B 73 6.637 32.473 -3.387 1.00 43.21 H new ATOM 0 HD2 PHE B 73 7.702 32.676 -7.527 1.00 32.22 H new ATOM 0 HE1 PHE B 73 4.835 34.095 -3.781 1.00 32.14 H new ATOM 0 HE2 PHE B 73 5.898 34.303 -7.901 1.00 13.10 H new ATOM 0 HZ PHE B 73 4.460 35.009 -6.034 1.00 14.32 H new ATOM 2443 N GLY B 74 6.433 28.638 -6.540 1.00 5.12 N ATOM 2444 CA GLY B 74 5.913 28.030 -7.774 1.00 4.31 C ATOM 2445 C GLY B 74 4.415 27.740 -7.683 1.00 10.44 C ATOM 2446 O GLY B 74 4.007 26.692 -7.164 1.00 15.24 O ATOM 0 H GLY B 74 5.914 28.378 -5.702 1.00 5.12 H new ATOM 0 HA2 GLY B 74 6.103 28.697 -8.615 1.00 4.31 H new ATOM 0 HA3 GLY B 74 6.450 27.103 -7.976 1.00 4.31 H new ATOM 2450 N LEU B 75 3.598 28.691 -8.173 1.00 51.01 N ATOM 2451 CA LEU B 75 2.127 28.581 -8.160 1.00 74.45 C ATOM 2452 C LEU B 75 1.647 27.594 -9.244 1.00 21.41 C ATOM 2453 O LEU B 75 1.641 27.919 -10.439 1.00 75.44 O ATOM 2454 CB LEU B 75 1.442 29.966 -8.353 1.00 13.41 C ATOM 2455 CG LEU B 75 1.682 31.046 -7.246 1.00 11.31 C ATOM 2456 CD1 LEU B 75 1.396 30.498 -5.829 1.00 23.54 C ATOM 2457 CD2 LEU B 75 3.083 31.688 -7.349 1.00 74.51 C ATOM 0 H LEU B 75 3.939 29.558 -8.589 1.00 51.01 H new ATOM 0 HA LEU B 75 1.838 28.201 -7.180 1.00 74.45 H new ATOM 0 HB2 LEU B 75 1.777 30.378 -9.305 1.00 13.41 H new ATOM 0 HB3 LEU B 75 0.368 29.802 -8.437 1.00 13.41 H new ATOM 0 HG LEU B 75 0.961 31.843 -7.427 1.00 11.31 H new ATOM 0 HD11 LEU B 75 1.576 31.281 -5.093 1.00 23.54 H new ATOM 0 HD12 LEU B 75 0.357 30.173 -5.767 1.00 23.54 H new ATOM 0 HD13 LEU B 75 2.053 29.652 -5.626 1.00 23.54 H new ATOM 0 HD21 LEU B 75 3.202 32.431 -6.560 1.00 74.51 H new ATOM 0 HD22 LEU B 75 3.846 30.917 -7.239 1.00 74.51 H new ATOM 0 HD23 LEU B 75 3.192 32.170 -8.320 1.00 74.51 H new ATOM 2469 N GLU B 76 1.282 26.383 -8.809 1.00 4.01 N ATOM 2470 CA GLU B 76 0.723 25.337 -9.694 1.00 75.15 C ATOM 2471 C GLU B 76 -0.786 25.631 -9.975 1.00 24.03 C ATOM 2472 O GLU B 76 -1.346 26.581 -9.404 1.00 72.52 O ATOM 2473 CB GLU B 76 0.918 23.937 -9.029 1.00 74.01 C ATOM 2474 CG GLU B 76 0.811 22.733 -9.994 1.00 52.05 C ATOM 2475 CD GLU B 76 0.850 21.367 -9.286 1.00 35.54 C ATOM 2476 OE1 GLU B 76 1.930 20.953 -8.818 1.00 4.22 O ATOM 2477 OE2 GLU B 76 -0.202 20.695 -9.195 1.00 14.14 O ATOM 0 H GLU B 76 1.363 26.093 -7.834 1.00 4.01 H new ATOM 0 HA GLU B 76 1.247 25.338 -10.650 1.00 75.15 H new ATOM 0 HB2 GLU B 76 1.896 23.913 -8.549 1.00 74.01 H new ATOM 0 HB3 GLU B 76 0.174 23.819 -8.241 1.00 74.01 H new ATOM 0 HG2 GLU B 76 -0.118 22.813 -10.559 1.00 52.05 H new ATOM 0 HG3 GLU B 76 1.628 22.782 -10.714 1.00 52.05 H new ATOM 2484 N HIS B 77 -1.432 24.827 -10.857 1.00 22.35 N ATOM 2485 CA HIS B 77 -2.881 24.968 -11.186 1.00 35.11 C ATOM 2486 C HIS B 77 -3.767 24.981 -9.908 1.00 13.22 C ATOM 2487 O HIS B 77 -3.513 24.224 -8.959 1.00 62.11 O ATOM 2488 CB HIS B 77 -3.346 23.831 -12.149 1.00 10.32 C ATOM 2489 CG HIS B 77 -3.348 22.446 -11.545 1.00 72.14 C ATOM 2490 ND1 HIS B 77 -4.423 21.932 -10.847 1.00 24.32 N ATOM 2491 CD2 HIS B 77 -2.398 21.479 -11.517 1.00 71.41 C ATOM 2492 CE1 HIS B 77 -4.132 20.723 -10.414 1.00 24.05 C ATOM 2493 NE2 HIS B 77 -2.910 20.419 -10.805 1.00 65.24 N ATOM 0 H HIS B 77 -0.971 24.068 -11.359 1.00 22.35 H new ATOM 0 HA HIS B 77 -3.003 25.928 -11.687 1.00 35.11 H new ATOM 0 HB2 HIS B 77 -4.353 24.060 -12.499 1.00 10.32 H new ATOM 0 HB3 HIS B 77 -2.697 23.829 -13.025 1.00 10.32 H new ATOM 0 HD2 HIS B 77 -1.419 21.531 -11.970 1.00 71.41 H new ATOM 0 HE1 HIS B 77 -4.785 20.087 -9.835 1.00 24.05 H new ATOM 0 HE2 HIS B 77 -2.425 19.543 -10.612 1.00 65.24 H new ATOM 2502 N HIS B 78 -4.785 25.861 -9.892 1.00 42.52 N ATOM 2503 CA HIS B 78 -5.701 26.013 -8.738 1.00 12.04 C ATOM 2504 C HIS B 78 -6.503 24.701 -8.520 1.00 30.14 C ATOM 2505 O HIS B 78 -6.984 24.099 -9.489 1.00 63.32 O ATOM 2506 CB HIS B 78 -6.639 27.230 -8.975 1.00 30.14 C ATOM 2507 CG HIS B 78 -7.279 27.800 -7.727 1.00 61.13 C ATOM 2508 ND1 HIS B 78 -8.641 27.786 -7.486 1.00 43.04 N ATOM 2509 CD2 HIS B 78 -6.729 28.451 -6.668 1.00 64.43 C ATOM 2510 CE1 HIS B 78 -8.896 28.402 -6.346 1.00 43.41 C ATOM 2511 NE2 HIS B 78 -7.757 28.810 -5.832 1.00 60.55 N ATOM 0 H HIS B 78 -4.998 26.484 -10.671 1.00 42.52 H new ATOM 0 HA HIS B 78 -5.126 26.202 -7.831 1.00 12.04 H new ATOM 0 HB2 HIS B 78 -6.068 28.019 -9.465 1.00 30.14 H new ATOM 0 HB3 HIS B 78 -7.428 26.932 -9.665 1.00 30.14 H new ATOM 0 HD2 HIS B 78 -5.679 28.649 -6.513 1.00 64.43 H new ATOM 0 HE1 HIS B 78 -9.874 28.546 -5.910 1.00 43.41 H new ATOM 0 HE2 HIS B 78 -7.653 29.314 -4.951 1.00 60.55 H new ATOM 2520 N HIS B 79 -6.614 24.261 -7.250 1.00 52.21 N ATOM 2521 CA HIS B 79 -7.171 22.928 -6.890 1.00 61.45 C ATOM 2522 C HIS B 79 -8.645 22.767 -7.369 1.00 23.42 C ATOM 2523 O HIS B 79 -9.408 23.740 -7.376 1.00 11.44 O ATOM 2524 CB HIS B 79 -7.044 22.720 -5.356 1.00 5.15 C ATOM 2525 CG HIS B 79 -7.342 21.329 -4.848 1.00 74.11 C ATOM 2526 ND1 HIS B 79 -6.359 20.408 -4.550 1.00 11.24 N ATOM 2527 CD2 HIS B 79 -8.515 20.714 -4.557 1.00 73.40 C ATOM 2528 CE1 HIS B 79 -6.909 19.301 -4.098 1.00 33.24 C ATOM 2529 NE2 HIS B 79 -8.215 19.456 -4.092 1.00 41.11 N ATOM 0 H HIS B 79 -6.323 24.813 -6.443 1.00 52.21 H new ATOM 0 HA HIS B 79 -6.597 22.157 -7.404 1.00 61.45 H new ATOM 0 HB2 HIS B 79 -6.030 22.985 -5.056 1.00 5.15 H new ATOM 0 HB3 HIS B 79 -7.716 23.419 -4.858 1.00 5.15 H new ATOM 0 HD2 HIS B 79 -9.503 21.135 -4.670 1.00 73.40 H new ATOM 0 HE1 HIS B 79 -6.377 18.415 -3.785 1.00 33.24 H new ATOM 0 HE2 HIS B 79 -8.894 18.757 -3.791 1.00 41.11 H new ATOM 2538 N HIS B 80 -9.009 21.529 -7.775 1.00 62.13 N ATOM 2539 CA HIS B 80 -10.338 21.196 -8.354 1.00 63.43 C ATOM 2540 C HIS B 80 -11.525 21.644 -7.458 1.00 50.40 C ATOM 2541 O HIS B 80 -11.647 21.210 -6.311 1.00 14.11 O ATOM 2542 CB HIS B 80 -10.410 19.669 -8.613 1.00 23.33 C ATOM 2543 CG HIS B 80 -11.715 19.176 -9.198 1.00 42.33 C ATOM 2544 ND1 HIS B 80 -12.715 18.614 -8.431 1.00 14.21 N ATOM 2545 CD2 HIS B 80 -12.173 19.140 -10.474 1.00 0.04 C ATOM 2546 CE1 HIS B 80 -13.718 18.257 -9.201 1.00 43.20 C ATOM 2547 NE2 HIS B 80 -13.420 18.563 -10.442 1.00 13.50 N ATOM 0 H HIS B 80 -8.386 20.724 -7.711 1.00 62.13 H new ATOM 0 HA HIS B 80 -10.435 21.749 -9.289 1.00 63.43 H new ATOM 0 HB2 HIS B 80 -9.600 19.393 -9.288 1.00 23.33 H new ATOM 0 HB3 HIS B 80 -10.232 19.148 -7.672 1.00 23.33 H new ATOM 0 HD2 HIS B 80 -11.655 19.498 -11.351 1.00 0.04 H new ATOM 0 HE1 HIS B 80 -14.634 17.790 -8.869 1.00 43.20 H new ATOM 0 HE2 HIS B 80 -14.018 18.399 -11.252 1.00 13.50 H new ATOM 2556 N HIS B 81 -12.380 22.523 -8.013 1.00 74.03 N ATOM 2557 CA HIS B 81 -13.632 22.980 -7.366 1.00 31.53 C ATOM 2558 C HIS B 81 -14.684 21.837 -7.344 1.00 43.42 C ATOM 2559 O HIS B 81 -14.854 21.130 -8.343 1.00 63.11 O ATOM 2560 CB HIS B 81 -14.174 24.226 -8.124 1.00 14.41 C ATOM 2561 CG HIS B 81 -15.462 24.796 -7.581 1.00 32.24 C ATOM 2562 ND1 HIS B 81 -16.703 24.388 -8.022 1.00 23.24 N ATOM 2563 CD2 HIS B 81 -15.699 25.757 -6.652 1.00 3.42 C ATOM 2564 CE1 HIS B 81 -17.640 25.067 -7.398 1.00 52.23 C ATOM 2565 NE2 HIS B 81 -17.064 25.902 -6.562 1.00 13.21 N ATOM 0 H HIS B 81 -12.224 22.941 -8.930 1.00 74.03 H new ATOM 0 HA HIS B 81 -13.427 23.257 -6.332 1.00 31.53 H new ATOM 0 HB2 HIS B 81 -13.412 25.005 -8.102 1.00 14.41 H new ATOM 0 HB3 HIS B 81 -14.326 23.958 -9.170 1.00 14.41 H new ATOM 0 HD2 HIS B 81 -14.957 26.304 -6.090 1.00 3.42 H new ATOM 0 HE1 HIS B 81 -18.704 24.957 -7.547 1.00 52.23 H new ATOM 0 HE2 HIS B 81 -17.551 26.553 -5.946 1.00 13.21 H new ATOM 2574 N HIS B 82 -15.383 21.677 -6.201 1.00 33.01 N ATOM 2575 CA HIS B 82 -16.397 20.609 -6.006 1.00 62.04 C ATOM 2576 C HIS B 82 -17.619 20.782 -6.937 1.00 23.10 C ATOM 2577 O HIS B 82 -18.079 21.897 -7.201 1.00 74.21 O ATOM 2578 CB HIS B 82 -16.865 20.573 -4.532 1.00 71.44 C ATOM 2579 CG HIS B 82 -15.761 20.354 -3.531 1.00 21.34 C ATOM 2580 ND1 HIS B 82 -15.333 21.327 -2.654 1.00 11.53 N ATOM 2581 CD2 HIS B 82 -15.010 19.260 -3.257 1.00 10.54 C ATOM 2582 CE1 HIS B 82 -14.374 20.848 -1.895 1.00 14.21 C ATOM 2583 NE2 HIS B 82 -14.160 19.597 -2.238 1.00 62.20 N ATOM 0 H HIS B 82 -15.264 22.280 -5.387 1.00 33.01 H new ATOM 0 HA HIS B 82 -15.917 19.665 -6.263 1.00 62.04 H new ATOM 0 HB2 HIS B 82 -17.367 21.512 -4.300 1.00 71.44 H new ATOM 0 HB3 HIS B 82 -17.604 19.780 -4.418 1.00 71.44 H new ATOM 0 HD2 HIS B 82 -15.071 18.301 -3.750 1.00 10.54 H new ATOM 0 HE1 HIS B 82 -13.850 21.390 -1.121 1.00 14.21 H new ATOM 0 HE2 HIS B 82 -13.471 18.977 -1.813 1.00 62.20 H new TER 2592 HIS B 82