USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1135 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -119:sc= 0.0502 (180deg=-0.0402) USER MOD Single : A 9 THR OG1 : rot 131:sc= 0.0371 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= 0.234 X(o=0.23,f=-0.045) USER MOD Single : A 24 LYS NZ :NH3+ -168:sc= 0.919 (180deg=0.826) USER MOD Single : A 25 HIS : no HD1:sc= 0.191 K(o=0.19,f=-0.71) USER MOD Single : A 28 ASN : amide:sc= -0.308 K(o=-0.31,f=-0.98) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 31:sc= 0.0873 USER MOD Single : A 34 THR OG1 : rot 170:sc= 0.00892 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -167:sc= -1.18 (180deg=-1.67) USER MOD Single : A 39 LYS NZ :NH3+ 157:sc= 0.755 (180deg=0.0768) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 67 LYS NZ :NH3+ -164:sc= -0.163 (180deg=-0.508) USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0208) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= -0.63 K(o=-0.63,f=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 178:sc= 1.1 (180deg=1.09) USER MOD Single : A 100 LYS NZ :NH3+ -168:sc= -0.0185 (180deg=-0.178) USER MOD Single : A 101 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0557) USER MOD Single : A 102 LYS NZ :NH3+ 155:sc= 0.689 (180deg=0.241) USER MOD Single : A 104 TYR OH : rot 44:sc= 0.0192 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot -140:sc= -0.124 USER MOD Single : A 111 ASN : amide:sc= 0.281 K(o=0.28,f=-4!) USER MOD Single : A 116 LYS NZ :NH3+ -153:sc= 0.954 (180deg=0.143) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -177:sc= 0.113 (180deg=0.0838) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot -18:sc= 0.719 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -0.31 K(o=-0.31,f=-3.2!) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HE2:sc= 0 K(o=0,f=-1.8) USER MOD Single : A 135 HIS : no HD1:sc= -0.226 K(o=-0.23,f=-0.9) USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.712 -2.386 15.986 1.00 72.30 N ATOM 2 CA MET A 1 5.236 -1.149 15.322 1.00 21.14 C ATOM 3 C MET A 1 5.543 -1.202 13.814 1.00 63.22 C ATOM 4 O MET A 1 6.431 -1.943 13.379 1.00 41.04 O ATOM 5 CB MET A 1 5.888 0.104 15.961 1.00 10.43 C ATOM 6 CG MET A 1 5.553 0.333 17.438 1.00 60.43 C ATOM 7 SD MET A 1 6.365 1.815 18.090 1.00 51.34 S ATOM 8 CE MET A 1 5.861 1.806 19.811 1.00 14.51 C ATOM 0 H1 MET A 1 4.905 -2.881 16.417 1.00 72.30 H new ATOM 0 H2 MET A 1 6.163 -3.006 15.283 1.00 72.30 H new ATOM 0 H3 MET A 1 6.402 -2.140 16.724 1.00 72.30 H new ATOM 0 HA MET A 1 4.157 -1.079 15.459 1.00 21.14 H new ATOM 0 HB2 MET A 1 6.970 0.023 15.859 1.00 10.43 H new ATOM 0 HB3 MET A 1 5.580 0.983 15.395 1.00 10.43 H new ATOM 0 HG2 MET A 1 4.474 0.429 17.555 1.00 60.43 H new ATOM 0 HG3 MET A 1 5.861 -0.536 18.020 1.00 60.43 H new ATOM 0 HE1 MET A 1 6.294 2.666 20.321 1.00 14.51 H new ATOM 0 HE2 MET A 1 4.774 1.857 19.872 1.00 14.51 H new ATOM 0 HE3 MET A 1 6.208 0.889 20.287 1.00 14.51 H new ATOM 20 N GLY A 2 4.764 -0.433 13.027 1.00 30.31 N ATOM 21 CA GLY A 2 4.951 -0.330 11.576 1.00 61.32 C ATOM 22 C GLY A 2 3.627 -0.101 10.853 1.00 51.25 C ATOM 23 O GLY A 2 2.556 -0.156 11.474 1.00 34.23 O ATOM 0 H GLY A 2 3.992 0.130 13.383 1.00 30.31 H new ATOM 0 HA2 GLY A 2 5.634 0.490 11.354 1.00 61.32 H new ATOM 0 HA3 GLY A 2 5.417 -1.242 11.203 1.00 61.32 H new ATOM 27 N VAL A 3 3.701 0.172 9.535 1.00 40.33 N ATOM 28 CA VAL A 3 2.517 0.412 8.671 1.00 1.22 C ATOM 29 C VAL A 3 2.701 -0.330 7.331 1.00 50.34 C ATOM 30 O VAL A 3 3.698 -0.124 6.643 1.00 74.43 O ATOM 31 CB VAL A 3 2.287 1.959 8.385 1.00 61.50 C ATOM 32 CG1 VAL A 3 1.192 2.193 7.313 1.00 24.14 C ATOM 33 CG2 VAL A 3 1.945 2.740 9.678 1.00 13.01 C ATOM 0 H VAL A 3 4.587 0.234 9.033 1.00 40.33 H new ATOM 0 HA VAL A 3 1.641 0.037 9.201 1.00 1.22 H new ATOM 0 HB VAL A 3 3.230 2.342 7.995 1.00 61.50 H new ATOM 0 HG11 VAL A 3 1.067 3.263 7.148 1.00 24.14 H new ATOM 0 HG12 VAL A 3 1.488 1.714 6.380 1.00 24.14 H new ATOM 0 HG13 VAL A 3 0.250 1.766 7.656 1.00 24.14 H new ATOM 0 HG21 VAL A 3 1.796 3.793 9.438 1.00 13.01 H new ATOM 0 HG22 VAL A 3 1.033 2.335 10.117 1.00 13.01 H new ATOM 0 HG23 VAL A 3 2.765 2.643 10.389 1.00 13.01 H new ATOM 43 N VAL A 4 1.733 -1.180 6.960 1.00 1.22 N ATOM 44 CA VAL A 4 1.742 -1.870 5.659 1.00 1.31 C ATOM 45 C VAL A 4 0.889 -1.067 4.664 1.00 21.02 C ATOM 46 O VAL A 4 -0.331 -0.960 4.813 1.00 44.14 O ATOM 47 CB VAL A 4 1.210 -3.345 5.786 1.00 51.11 C ATOM 48 CG1 VAL A 4 1.253 -4.093 4.433 1.00 23.00 C ATOM 49 CG2 VAL A 4 2.000 -4.109 6.867 1.00 42.21 C ATOM 0 H VAL A 4 0.929 -1.408 7.545 1.00 1.22 H new ATOM 0 HA VAL A 4 2.768 -1.931 5.297 1.00 1.31 H new ATOM 0 HB VAL A 4 0.164 -3.295 6.089 1.00 51.11 H new ATOM 0 HG11 VAL A 4 0.877 -5.107 4.566 1.00 23.00 H new ATOM 0 HG12 VAL A 4 0.632 -3.568 3.707 1.00 23.00 H new ATOM 0 HG13 VAL A 4 2.280 -4.131 4.071 1.00 23.00 H new ATOM 0 HG21 VAL A 4 1.620 -5.128 6.943 1.00 42.21 H new ATOM 0 HG22 VAL A 4 3.056 -4.134 6.597 1.00 42.21 H new ATOM 0 HG23 VAL A 4 1.883 -3.606 7.827 1.00 42.21 H new ATOM 59 N ILE A 5 1.571 -0.494 3.670 1.00 0.30 N ATOM 60 CA ILE A 5 0.983 0.369 2.649 1.00 52.44 C ATOM 61 C ILE A 5 0.752 -0.461 1.367 1.00 33.33 C ATOM 62 O ILE A 5 1.699 -0.773 0.656 1.00 14.33 O ATOM 63 CB ILE A 5 1.967 1.569 2.339 1.00 15.13 C ATOM 64 CG1 ILE A 5 2.471 2.227 3.665 1.00 4.23 C ATOM 65 CG2 ILE A 5 1.306 2.609 1.404 1.00 72.02 C ATOM 66 CD1 ILE A 5 3.550 3.282 3.492 1.00 2.40 C ATOM 0 H ILE A 5 2.576 -0.623 3.552 1.00 0.30 H new ATOM 0 HA ILE A 5 0.034 0.770 3.004 1.00 52.44 H new ATOM 0 HB ILE A 5 2.835 1.169 1.814 1.00 15.13 H new ATOM 0 HG12 ILE A 5 1.620 2.680 4.174 1.00 4.23 H new ATOM 0 HG13 ILE A 5 2.853 1.443 4.319 1.00 4.23 H new ATOM 0 HG21 ILE A 5 2.007 3.421 1.210 1.00 72.02 H new ATOM 0 HG22 ILE A 5 1.034 2.131 0.463 1.00 72.02 H new ATOM 0 HG23 ILE A 5 0.411 3.009 1.880 1.00 72.02 H new ATOM 0 HD11 ILE A 5 3.832 3.678 4.468 1.00 2.40 H new ATOM 0 HD12 ILE A 5 4.423 2.835 3.016 1.00 2.40 H new ATOM 0 HD13 ILE A 5 3.171 4.091 2.868 1.00 2.40 H new ATOM 78 N LEU A 6 -0.507 -0.803 1.079 1.00 61.43 N ATOM 79 CA LEU A 6 -0.868 -1.592 -0.106 1.00 72.12 C ATOM 80 C LEU A 6 -1.312 -0.627 -1.205 1.00 74.43 C ATOM 81 O LEU A 6 -2.438 -0.130 -1.183 1.00 21.14 O ATOM 82 CB LEU A 6 -2.028 -2.561 0.268 1.00 31.14 C ATOM 83 CG LEU A 6 -1.781 -3.454 1.514 1.00 14.40 C ATOM 84 CD1 LEU A 6 -3.045 -4.226 1.916 1.00 73.03 C ATOM 85 CD2 LEU A 6 -0.603 -4.401 1.278 1.00 64.54 C ATOM 0 H LEU A 6 -1.305 -0.542 1.659 1.00 61.43 H new ATOM 0 HA LEU A 6 -0.020 -2.179 -0.458 1.00 72.12 H new ATOM 0 HB2 LEU A 6 -2.929 -1.972 0.438 1.00 31.14 H new ATOM 0 HB3 LEU A 6 -2.227 -3.208 -0.587 1.00 31.14 H new ATOM 0 HG LEU A 6 -1.526 -2.798 2.347 1.00 14.40 H new ATOM 0 HD11 LEU A 6 -2.833 -4.840 2.792 1.00 73.03 H new ATOM 0 HD12 LEU A 6 -3.842 -3.521 2.151 1.00 73.03 H new ATOM 0 HD13 LEU A 6 -3.358 -4.866 1.091 1.00 73.03 H new ATOM 0 HD21 LEU A 6 -0.448 -5.017 2.164 1.00 64.54 H new ATOM 0 HD22 LEU A 6 -0.817 -5.042 0.423 1.00 64.54 H new ATOM 0 HD23 LEU A 6 0.297 -3.819 1.079 1.00 64.54 H new ATOM 97 N VAL A 7 -0.417 -0.351 -2.158 1.00 13.34 N ATOM 98 CA VAL A 7 -0.706 0.561 -3.265 1.00 63.32 C ATOM 99 C VAL A 7 -1.220 -0.247 -4.470 1.00 21.21 C ATOM 100 O VAL A 7 -0.450 -0.917 -5.164 1.00 11.41 O ATOM 101 CB VAL A 7 0.559 1.417 -3.651 1.00 43.02 C ATOM 102 CG1 VAL A 7 0.233 2.427 -4.769 1.00 3.13 C ATOM 103 CG2 VAL A 7 1.127 2.140 -2.407 1.00 52.50 C ATOM 0 H VAL A 7 0.521 -0.751 -2.183 1.00 13.34 H new ATOM 0 HA VAL A 7 -1.479 1.262 -2.950 1.00 63.32 H new ATOM 0 HB VAL A 7 1.320 0.736 -4.032 1.00 43.02 H new ATOM 0 HG11 VAL A 7 1.127 3.002 -5.012 1.00 3.13 H new ATOM 0 HG12 VAL A 7 -0.106 1.891 -5.656 1.00 3.13 H new ATOM 0 HG13 VAL A 7 -0.552 3.103 -4.431 1.00 3.13 H new ATOM 0 HG21 VAL A 7 2.000 2.726 -2.694 1.00 52.50 H new ATOM 0 HG22 VAL A 7 0.367 2.801 -1.992 1.00 52.50 H new ATOM 0 HG23 VAL A 7 1.415 1.403 -1.658 1.00 52.50 H new ATOM 113 N LEU A 8 -2.545 -0.179 -4.674 1.00 24.22 N ATOM 114 CA LEU A 8 -3.248 -0.820 -5.789 1.00 62.23 C ATOM 115 C LEU A 8 -3.296 0.155 -6.965 1.00 73.02 C ATOM 116 O LEU A 8 -4.062 1.119 -6.944 1.00 11.42 O ATOM 117 CB LEU A 8 -4.689 -1.235 -5.367 1.00 63.11 C ATOM 118 CG LEU A 8 -4.824 -2.483 -4.430 1.00 74.44 C ATOM 119 CD1 LEU A 8 -4.126 -2.290 -3.072 1.00 74.31 C ATOM 120 CD2 LEU A 8 -6.305 -2.846 -4.236 1.00 25.22 C ATOM 0 H LEU A 8 -3.169 0.336 -4.052 1.00 24.22 H new ATOM 0 HA LEU A 8 -2.715 -1.724 -6.082 1.00 62.23 H new ATOM 0 HB2 LEU A 8 -5.154 -0.385 -4.868 1.00 63.11 H new ATOM 0 HB3 LEU A 8 -5.265 -1.427 -6.272 1.00 63.11 H new ATOM 0 HG LEU A 8 -4.313 -3.309 -4.924 1.00 74.44 H new ATOM 0 HD11 LEU A 8 -4.254 -3.187 -2.466 1.00 74.31 H new ATOM 0 HD12 LEU A 8 -3.063 -2.108 -3.232 1.00 74.31 H new ATOM 0 HD13 LEU A 8 -4.566 -1.437 -2.555 1.00 74.31 H new ATOM 0 HD21 LEU A 8 -6.384 -3.715 -3.583 1.00 25.22 H new ATOM 0 HD22 LEU A 8 -6.830 -2.004 -3.785 1.00 25.22 H new ATOM 0 HD23 LEU A 8 -6.753 -3.077 -5.203 1.00 25.22 H new ATOM 132 N THR A 9 -2.475 -0.095 -7.989 1.00 0.12 N ATOM 133 CA THR A 9 -2.382 0.782 -9.160 1.00 54.20 C ATOM 134 C THR A 9 -3.053 0.128 -10.377 1.00 4.14 C ATOM 135 O THR A 9 -2.962 -1.095 -10.580 1.00 41.13 O ATOM 136 CB THR A 9 -0.891 1.114 -9.500 1.00 63.52 C ATOM 137 OG1 THR A 9 -0.137 -0.094 -9.700 1.00 44.42 O ATOM 138 CG2 THR A 9 -0.215 1.962 -8.408 1.00 42.13 C ATOM 0 H THR A 9 -1.859 -0.907 -8.030 1.00 0.12 H new ATOM 0 HA THR A 9 -2.899 1.711 -8.919 1.00 54.20 H new ATOM 0 HB THR A 9 -0.904 1.699 -10.420 1.00 63.52 H new ATOM 0 HG1 THR A 9 0.369 -0.029 -10.536 1.00 44.42 H new ATOM 0 HG21 THR A 9 0.818 2.165 -8.692 1.00 42.13 H new ATOM 0 HG22 THR A 9 -0.752 2.904 -8.294 1.00 42.13 H new ATOM 0 HG23 THR A 9 -0.231 1.419 -7.463 1.00 42.13 H new ATOM 146 N GLY A 10 -3.747 0.969 -11.164 1.00 61.32 N ATOM 147 CA GLY A 10 -4.283 0.580 -12.468 1.00 71.12 C ATOM 148 C GLY A 10 -3.235 0.682 -13.578 1.00 1.33 C ATOM 149 O GLY A 10 -3.521 0.373 -14.742 1.00 44.01 O ATOM 0 H GLY A 10 -3.949 1.936 -10.909 1.00 61.32 H new ATOM 0 HA2 GLY A 10 -4.655 -0.443 -12.415 1.00 71.12 H new ATOM 0 HA3 GLY A 10 -5.133 1.216 -12.714 1.00 71.12 H new ATOM 153 N ASP A 11 -2.013 1.109 -13.198 1.00 45.34 N ATOM 154 CA ASP A 11 -0.884 1.291 -14.117 1.00 12.11 C ATOM 155 C ASP A 11 0.446 0.989 -13.393 1.00 23.33 C ATOM 156 O ASP A 11 0.666 1.435 -12.263 1.00 31.12 O ATOM 157 CB ASP A 11 -0.884 2.731 -14.676 1.00 62.02 C ATOM 158 CG ASP A 11 0.271 2.994 -15.654 1.00 44.44 C ATOM 159 OD1 ASP A 11 0.224 2.459 -16.787 1.00 0.52 O ATOM 160 OD2 ASP A 11 1.230 3.704 -15.288 1.00 30.23 O ATOM 0 H ASP A 11 -1.786 1.338 -12.230 1.00 45.34 H new ATOM 0 HA ASP A 11 -0.988 0.595 -14.950 1.00 12.11 H new ATOM 0 HB2 ASP A 11 -1.831 2.919 -15.182 1.00 62.02 H new ATOM 0 HB3 ASP A 11 -0.820 3.437 -13.848 1.00 62.02 H new ATOM 165 N GLU A 12 1.331 0.258 -14.087 1.00 53.43 N ATOM 166 CA GLU A 12 2.614 -0.229 -13.541 1.00 64.21 C ATOM 167 C GLU A 12 3.647 0.907 -13.395 1.00 61.34 C ATOM 168 O GLU A 12 4.407 0.942 -12.419 1.00 11.04 O ATOM 169 CB GLU A 12 3.156 -1.331 -14.486 1.00 60.14 C ATOM 170 CG GLU A 12 4.447 -2.031 -14.024 1.00 33.33 C ATOM 171 CD GLU A 12 4.914 -3.105 -15.015 1.00 4.52 C ATOM 172 OE1 GLU A 12 4.235 -4.152 -15.128 1.00 21.14 O ATOM 173 OE2 GLU A 12 5.952 -2.912 -15.691 1.00 23.11 O ATOM 0 H GLU A 12 1.177 -0.017 -15.057 1.00 53.43 H new ATOM 0 HA GLU A 12 2.444 -0.630 -12.542 1.00 64.21 H new ATOM 0 HB2 GLU A 12 2.381 -2.087 -14.615 1.00 60.14 H new ATOM 0 HB3 GLU A 12 3.335 -0.888 -15.466 1.00 60.14 H new ATOM 0 HG2 GLU A 12 5.235 -1.289 -13.898 1.00 33.33 H new ATOM 0 HG3 GLU A 12 4.281 -2.488 -13.048 1.00 33.33 H new ATOM 180 N ARG A 13 3.644 1.837 -14.367 1.00 2.40 N ATOM 181 CA ARG A 13 4.654 2.915 -14.478 1.00 70.45 C ATOM 182 C ARG A 13 4.507 3.907 -13.296 1.00 54.33 C ATOM 183 O ARG A 13 5.511 4.362 -12.736 1.00 51.23 O ATOM 184 CB ARG A 13 4.493 3.612 -15.866 1.00 63.25 C ATOM 185 CG ARG A 13 5.702 4.428 -16.414 1.00 52.41 C ATOM 186 CD ARG A 13 5.952 5.795 -15.718 1.00 61.02 C ATOM 187 NE ARG A 13 6.473 6.800 -16.671 1.00 1.22 N ATOM 188 CZ ARG A 13 7.642 7.457 -16.583 1.00 21.52 C ATOM 189 NH1 ARG A 13 8.482 7.255 -15.570 1.00 60.03 N ATOM 190 NH2 ARG A 13 7.961 8.321 -17.531 1.00 14.43 N ATOM 0 H ARG A 13 2.939 1.865 -15.103 1.00 2.40 H new ATOM 0 HA ARG A 13 5.662 2.504 -14.419 1.00 70.45 H new ATOM 0 HB2 ARG A 13 4.247 2.844 -16.600 1.00 63.25 H new ATOM 0 HB3 ARG A 13 3.636 4.283 -15.807 1.00 63.25 H new ATOM 0 HG2 ARG A 13 6.602 3.821 -16.319 1.00 52.41 H new ATOM 0 HG3 ARG A 13 5.548 4.604 -17.479 1.00 52.41 H new ATOM 0 HD2 ARG A 13 5.022 6.156 -15.278 1.00 61.02 H new ATOM 0 HD3 ARG A 13 6.661 5.664 -14.901 1.00 61.02 H new ATOM 0 HE ARG A 13 5.885 7.016 -17.476 1.00 1.22 H new ATOM 0 HH11 ARG A 13 8.245 6.588 -14.836 1.00 60.03 H new ATOM 0 HH12 ARG A 13 9.363 7.767 -15.528 1.00 60.03 H new ATOM 0 HH21 ARG A 13 7.324 8.479 -18.312 1.00 14.43 H new ATOM 0 HH22 ARG A 13 8.844 8.829 -17.482 1.00 14.43 H new ATOM 204 N ILE A 14 3.244 4.206 -12.920 1.00 31.51 N ATOM 205 CA ILE A 14 2.922 5.049 -11.751 1.00 35.54 C ATOM 206 C ILE A 14 3.460 4.404 -10.450 1.00 74.25 C ATOM 207 O ILE A 14 4.061 5.089 -9.618 1.00 53.20 O ATOM 208 CB ILE A 14 1.366 5.325 -11.636 1.00 14.42 C ATOM 209 CG1 ILE A 14 0.866 6.164 -12.862 1.00 1.22 C ATOM 210 CG2 ILE A 14 1.005 6.019 -10.296 1.00 13.22 C ATOM 211 CD1 ILE A 14 -0.627 6.473 -12.867 1.00 62.34 C ATOM 0 H ILE A 14 2.421 3.869 -13.419 1.00 31.51 H new ATOM 0 HA ILE A 14 3.415 6.011 -11.894 1.00 35.54 H new ATOM 0 HB ILE A 14 0.854 4.363 -11.647 1.00 14.42 H new ATOM 0 HG12 ILE A 14 1.416 7.105 -12.888 1.00 1.22 H new ATOM 0 HG13 ILE A 14 1.113 5.625 -13.777 1.00 1.22 H new ATOM 0 HG21 ILE A 14 -0.070 6.192 -10.254 1.00 13.22 H new ATOM 0 HG22 ILE A 14 1.303 5.381 -9.464 1.00 13.22 H new ATOM 0 HG23 ILE A 14 1.529 6.973 -10.227 1.00 13.22 H new ATOM 0 HD11 ILE A 14 -0.875 7.057 -13.754 1.00 62.34 H new ATOM 0 HD12 ILE A 14 -1.191 5.541 -12.877 1.00 62.34 H new ATOM 0 HD13 ILE A 14 -0.884 7.043 -11.974 1.00 62.34 H new ATOM 223 N ALA A 15 3.266 3.070 -10.313 1.00 21.02 N ATOM 224 CA ALA A 15 3.744 2.290 -9.148 1.00 20.24 C ATOM 225 C ALA A 15 5.276 2.410 -8.972 1.00 63.23 C ATOM 226 O ALA A 15 5.776 2.478 -7.847 1.00 44.43 O ATOM 227 CB ALA A 15 3.320 0.817 -9.291 1.00 1.12 C ATOM 0 H ALA A 15 2.774 2.506 -11.006 1.00 21.02 H new ATOM 0 HA ALA A 15 3.284 2.703 -8.250 1.00 20.24 H new ATOM 0 HB1 ALA A 15 3.676 0.251 -8.430 1.00 1.12 H new ATOM 0 HB2 ALA A 15 2.233 0.755 -9.342 1.00 1.12 H new ATOM 0 HB3 ALA A 15 3.751 0.401 -10.202 1.00 1.12 H new ATOM 233 N GLU A 16 5.995 2.462 -10.105 1.00 11.44 N ATOM 234 CA GLU A 16 7.460 2.637 -10.141 1.00 13.33 C ATOM 235 C GLU A 16 7.878 4.050 -9.678 1.00 45.11 C ATOM 236 O GLU A 16 8.886 4.201 -8.976 1.00 33.12 O ATOM 237 CB GLU A 16 7.974 2.352 -11.576 1.00 54.42 C ATOM 238 CG GLU A 16 7.817 0.883 -12.022 1.00 24.54 C ATOM 239 CD GLU A 16 8.699 -0.081 -11.215 1.00 55.21 C ATOM 240 OE1 GLU A 16 9.939 -0.031 -11.374 1.00 41.54 O ATOM 241 OE2 GLU A 16 8.176 -0.881 -10.408 1.00 52.23 O ATOM 0 H GLU A 16 5.574 2.383 -11.031 1.00 11.44 H new ATOM 0 HA GLU A 16 7.911 1.929 -9.446 1.00 13.33 H new ATOM 0 HB2 GLU A 16 7.438 2.992 -12.276 1.00 54.42 H new ATOM 0 HB3 GLU A 16 9.027 2.628 -11.635 1.00 54.42 H new ATOM 0 HG2 GLU A 16 6.773 0.586 -11.919 1.00 24.54 H new ATOM 0 HG3 GLU A 16 8.069 0.800 -13.079 1.00 24.54 H new ATOM 248 N GLU A 17 7.086 5.067 -10.070 1.00 75.35 N ATOM 249 CA GLU A 17 7.331 6.480 -9.701 1.00 30.42 C ATOM 250 C GLU A 17 7.160 6.706 -8.193 1.00 65.55 C ATOM 251 O GLU A 17 7.865 7.518 -7.593 1.00 73.43 O ATOM 252 CB GLU A 17 6.380 7.413 -10.481 1.00 60.14 C ATOM 253 CG GLU A 17 6.571 7.385 -12.004 1.00 32.02 C ATOM 254 CD GLU A 17 8.003 7.748 -12.430 1.00 62.13 C ATOM 255 OE1 GLU A 17 8.344 8.952 -12.426 1.00 23.22 O ATOM 256 OE2 GLU A 17 8.791 6.838 -12.772 1.00 52.44 O ATOM 0 H GLU A 17 6.258 4.935 -10.651 1.00 75.35 H new ATOM 0 HA GLU A 17 8.362 6.714 -9.965 1.00 30.42 H new ATOM 0 HB2 GLU A 17 5.351 7.137 -10.251 1.00 60.14 H new ATOM 0 HB3 GLU A 17 6.523 8.434 -10.128 1.00 60.14 H new ATOM 0 HG2 GLU A 17 6.326 6.391 -12.378 1.00 32.02 H new ATOM 0 HG3 GLU A 17 5.871 8.081 -12.467 1.00 32.02 H new ATOM 263 N LEU A 18 6.205 5.987 -7.598 1.00 54.31 N ATOM 264 CA LEU A 18 5.963 6.036 -6.153 1.00 11.34 C ATOM 265 C LEU A 18 7.130 5.346 -5.419 1.00 3.11 C ATOM 266 O LEU A 18 7.749 5.932 -4.532 1.00 64.23 O ATOM 267 CB LEU A 18 4.606 5.355 -5.832 1.00 13.04 C ATOM 268 CG LEU A 18 3.362 5.933 -6.585 1.00 41.41 C ATOM 269 CD1 LEU A 18 2.075 5.204 -6.173 1.00 22.22 C ATOM 270 CD2 LEU A 18 3.232 7.461 -6.393 1.00 24.54 C ATOM 0 H LEU A 18 5.580 5.357 -8.101 1.00 54.31 H new ATOM 0 HA LEU A 18 5.909 7.070 -5.813 1.00 11.34 H new ATOM 0 HB2 LEU A 18 4.689 4.294 -6.066 1.00 13.04 H new ATOM 0 HB3 LEU A 18 4.427 5.432 -4.760 1.00 13.04 H new ATOM 0 HG LEU A 18 3.517 5.757 -7.649 1.00 41.41 H new ATOM 0 HD11 LEU A 18 1.228 5.628 -6.713 1.00 22.22 H new ATOM 0 HD12 LEU A 18 2.164 4.144 -6.412 1.00 22.22 H new ATOM 0 HD13 LEU A 18 1.918 5.322 -5.101 1.00 22.22 H new ATOM 0 HD21 LEU A 18 2.356 7.822 -6.932 1.00 24.54 H new ATOM 0 HD22 LEU A 18 3.124 7.687 -5.332 1.00 24.54 H new ATOM 0 HD23 LEU A 18 4.124 7.953 -6.780 1.00 24.54 H new ATOM 282 N ARG A 19 7.458 4.138 -5.908 1.00 1.15 N ATOM 283 CA ARG A 19 8.463 3.213 -5.337 1.00 34.44 C ATOM 284 C ARG A 19 9.838 3.876 -5.115 1.00 20.25 C ATOM 285 O ARG A 19 10.414 3.785 -4.019 1.00 11.22 O ATOM 286 CB ARG A 19 8.603 2.000 -6.300 1.00 60.30 C ATOM 287 CG ARG A 19 9.514 0.854 -5.812 1.00 12.45 C ATOM 288 CD ARG A 19 9.691 -0.237 -6.885 1.00 23.30 C ATOM 289 NE ARG A 19 10.217 0.310 -8.146 1.00 24.23 N ATOM 290 CZ ARG A 19 11.470 0.755 -8.347 1.00 22.32 C ATOM 291 NH1 ARG A 19 12.388 0.722 -7.378 1.00 50.43 N ATOM 292 NH2 ARG A 19 11.788 1.258 -9.525 1.00 10.14 N ATOM 0 H ARG A 19 7.015 3.760 -6.745 1.00 1.15 H new ATOM 0 HA ARG A 19 8.117 2.899 -4.352 1.00 34.44 H new ATOM 0 HB2 ARG A 19 7.609 1.593 -6.488 1.00 60.30 H new ATOM 0 HB3 ARG A 19 8.986 2.361 -7.255 1.00 60.30 H new ATOM 0 HG2 ARG A 19 10.490 1.257 -5.540 1.00 12.45 H new ATOM 0 HG3 ARG A 19 9.089 0.411 -4.911 1.00 12.45 H new ATOM 0 HD2 ARG A 19 10.369 -1.005 -6.513 1.00 23.30 H new ATOM 0 HD3 ARG A 19 8.732 -0.721 -7.072 1.00 23.30 H new ATOM 0 HE ARG A 19 9.575 0.356 -8.937 1.00 24.23 H new ATOM 0 HH11 ARG A 19 12.146 0.353 -6.459 1.00 50.43 H new ATOM 0 HH12 ARG A 19 13.331 1.066 -7.557 1.00 50.43 H new ATOM 0 HH21 ARG A 19 11.088 1.305 -10.265 1.00 10.14 H new ATOM 0 HH22 ARG A 19 12.734 1.600 -9.695 1.00 10.14 H new ATOM 306 N LYS A 20 10.328 4.554 -6.163 1.00 43.34 N ATOM 307 CA LYS A 20 11.665 5.178 -6.182 1.00 3.34 C ATOM 308 C LYS A 20 11.743 6.387 -5.226 1.00 21.41 C ATOM 309 O LYS A 20 12.790 6.633 -4.612 1.00 70.13 O ATOM 310 CB LYS A 20 12.034 5.567 -7.646 1.00 14.45 C ATOM 311 CG LYS A 20 11.095 6.607 -8.316 1.00 44.32 C ATOM 312 CD LYS A 20 11.262 6.677 -9.858 1.00 34.54 C ATOM 313 CE LYS A 20 12.673 7.083 -10.309 1.00 63.42 C ATOM 314 NZ LYS A 20 12.836 6.954 -11.786 1.00 33.03 N ATOM 0 H LYS A 20 9.806 4.687 -7.029 1.00 43.34 H new ATOM 0 HA LYS A 20 12.397 4.456 -5.819 1.00 3.34 H new ATOM 0 HB2 LYS A 20 13.050 5.962 -7.654 1.00 14.45 H new ATOM 0 HB3 LYS A 20 12.039 4.662 -8.254 1.00 14.45 H new ATOM 0 HG2 LYS A 20 10.060 6.358 -8.080 1.00 44.32 H new ATOM 0 HG3 LYS A 20 11.291 7.591 -7.891 1.00 44.32 H new ATOM 0 HD2 LYS A 20 11.020 5.704 -10.285 1.00 34.54 H new ATOM 0 HD3 LYS A 20 10.542 7.390 -10.260 1.00 34.54 H new ATOM 0 HE2 LYS A 20 12.869 8.112 -10.009 1.00 63.42 H new ATOM 0 HE3 LYS A 20 13.410 6.458 -9.805 1.00 63.42 H new ATOM 0 HZ1 LYS A 20 13.800 7.236 -12.055 1.00 33.03 H new ATOM 0 HZ2 LYS A 20 12.673 5.966 -12.068 1.00 33.03 H new ATOM 0 HZ3 LYS A 20 12.149 7.569 -12.266 1.00 33.03 H new ATOM 328 N GLU A 21 10.616 7.114 -5.079 1.00 51.31 N ATOM 329 CA GLU A 21 10.516 8.267 -4.158 1.00 12.10 C ATOM 330 C GLU A 21 10.487 7.818 -2.686 1.00 30.23 C ATOM 331 O GLU A 21 11.031 8.512 -1.822 1.00 13.24 O ATOM 332 CB GLU A 21 9.279 9.161 -4.493 1.00 1.12 C ATOM 333 CG GLU A 21 9.615 10.442 -5.289 1.00 74.52 C ATOM 334 CD GLU A 21 10.197 10.188 -6.688 1.00 0.03 C ATOM 335 OE1 GLU A 21 9.435 9.829 -7.598 1.00 61.12 O ATOM 336 OE2 GLU A 21 11.405 10.392 -6.893 1.00 2.11 O ATOM 0 H GLU A 21 9.755 6.921 -5.591 1.00 51.31 H new ATOM 0 HA GLU A 21 11.413 8.870 -4.302 1.00 12.10 H new ATOM 0 HB2 GLU A 21 8.563 8.570 -5.064 1.00 1.12 H new ATOM 0 HB3 GLU A 21 8.788 9.444 -3.562 1.00 1.12 H new ATOM 0 HG2 GLU A 21 8.709 11.040 -5.389 1.00 74.52 H new ATOM 0 HG3 GLU A 21 10.327 11.035 -4.715 1.00 74.52 H new ATOM 343 N VAL A 22 9.838 6.665 -2.411 1.00 72.14 N ATOM 344 CA VAL A 22 9.764 6.083 -1.055 1.00 22.44 C ATOM 345 C VAL A 22 11.172 5.728 -0.529 1.00 25.32 C ATOM 346 O VAL A 22 11.464 5.920 0.654 1.00 60.33 O ATOM 347 CB VAL A 22 8.847 4.805 -1.031 1.00 41.54 C ATOM 348 CG1 VAL A 22 8.805 4.159 0.368 1.00 53.23 C ATOM 349 CG2 VAL A 22 7.420 5.133 -1.512 1.00 75.53 C ATOM 0 H VAL A 22 9.353 6.115 -3.120 1.00 72.14 H new ATOM 0 HA VAL A 22 9.324 6.836 -0.402 1.00 22.44 H new ATOM 0 HB VAL A 22 9.287 4.085 -1.721 1.00 41.54 H new ATOM 0 HG11 VAL A 22 8.161 3.280 0.344 1.00 53.23 H new ATOM 0 HG12 VAL A 22 9.812 3.864 0.663 1.00 53.23 H new ATOM 0 HG13 VAL A 22 8.412 4.876 1.088 1.00 53.23 H new ATOM 0 HG21 VAL A 22 6.810 4.230 -1.484 1.00 75.53 H new ATOM 0 HG22 VAL A 22 6.981 5.888 -0.860 1.00 75.53 H new ATOM 0 HG23 VAL A 22 7.459 5.513 -2.533 1.00 75.53 H new ATOM 359 N GLN A 23 12.038 5.233 -1.433 1.00 31.11 N ATOM 360 CA GLN A 23 13.431 4.875 -1.096 1.00 32.31 C ATOM 361 C GLN A 23 14.241 6.122 -0.688 1.00 25.34 C ATOM 362 O GLN A 23 15.091 6.059 0.200 1.00 75.44 O ATOM 363 CB GLN A 23 14.115 4.154 -2.290 1.00 11.44 C ATOM 364 CG GLN A 23 13.428 2.849 -2.737 1.00 11.22 C ATOM 365 CD GLN A 23 13.254 1.834 -1.604 1.00 44.01 C ATOM 366 OE1 GLN A 23 14.139 1.017 -1.343 1.00 54.51 O ATOM 367 NE2 GLN A 23 12.110 1.871 -0.928 1.00 32.44 N ATOM 0 H GLN A 23 11.796 5.070 -2.410 1.00 31.11 H new ATOM 0 HA GLN A 23 13.405 4.193 -0.246 1.00 32.31 H new ATOM 0 HB2 GLN A 23 14.150 4.838 -3.138 1.00 11.44 H new ATOM 0 HB3 GLN A 23 15.147 3.930 -2.018 1.00 11.44 H new ATOM 0 HG2 GLN A 23 12.450 3.087 -3.155 1.00 11.22 H new ATOM 0 HG3 GLN A 23 14.014 2.394 -3.536 1.00 11.22 H new ATOM 0 HE21 GLN A 23 11.397 2.560 -1.169 1.00 32.44 H new ATOM 0 HE22 GLN A 23 11.945 1.211 -0.168 1.00 32.44 H new ATOM 376 N LYS A 24 13.947 7.254 -1.354 1.00 15.12 N ATOM 377 CA LYS A 24 14.610 8.552 -1.095 1.00 52.13 C ATOM 378 C LYS A 24 13.909 9.346 0.024 1.00 35.43 C ATOM 379 O LYS A 24 14.449 10.349 0.491 1.00 64.25 O ATOM 380 CB LYS A 24 14.675 9.375 -2.402 1.00 22.20 C ATOM 381 CG LYS A 24 15.588 8.746 -3.481 1.00 53.31 C ATOM 382 CD LYS A 24 15.587 9.537 -4.806 1.00 72.12 C ATOM 383 CE LYS A 24 14.201 9.586 -5.458 1.00 34.40 C ATOM 384 NZ LYS A 24 14.236 10.256 -6.783 1.00 54.05 N ATOM 0 H LYS A 24 13.242 7.298 -2.089 1.00 15.12 H new ATOM 0 HA LYS A 24 15.624 8.351 -0.749 1.00 52.13 H new ATOM 0 HB2 LYS A 24 13.668 9.481 -2.806 1.00 22.20 H new ATOM 0 HB3 LYS A 24 15.034 10.378 -2.173 1.00 22.20 H new ATOM 0 HG2 LYS A 24 16.607 8.689 -3.099 1.00 53.31 H new ATOM 0 HG3 LYS A 24 15.262 7.724 -3.674 1.00 53.31 H new ATOM 0 HD2 LYS A 24 15.933 10.553 -4.619 1.00 72.12 H new ATOM 0 HD3 LYS A 24 16.295 9.081 -5.498 1.00 72.12 H new ATOM 0 HE2 LYS A 24 13.818 8.572 -5.574 1.00 34.40 H new ATOM 0 HE3 LYS A 24 13.510 10.115 -4.802 1.00 34.40 H new ATOM 0 HZ1 LYS A 24 13.265 10.451 -7.099 1.00 54.05 H new ATOM 0 HZ2 LYS A 24 14.762 11.150 -6.706 1.00 54.05 H new ATOM 0 HZ3 LYS A 24 14.706 9.636 -7.473 1.00 54.05 H new ATOM 398 N HIS A 25 12.697 8.911 0.424 1.00 50.44 N ATOM 399 CA HIS A 25 11.992 9.463 1.605 1.00 12.21 C ATOM 400 C HIS A 25 12.614 8.847 2.863 1.00 30.10 C ATOM 401 O HIS A 25 12.965 9.551 3.819 1.00 4.02 O ATOM 402 CB HIS A 25 10.465 9.158 1.524 1.00 53.23 C ATOM 403 CG HIS A 25 9.607 9.746 2.641 1.00 25.43 C ATOM 404 ND1 HIS A 25 8.787 10.833 2.425 1.00 42.32 N ATOM 405 CD2 HIS A 25 9.439 9.331 3.932 1.00 52.21 C ATOM 406 CE1 HIS A 25 8.148 11.043 3.565 1.00 0.13 C ATOM 407 NE2 HIS A 25 8.507 10.161 4.503 1.00 55.42 N ATOM 0 H HIS A 25 12.181 8.174 -0.056 1.00 50.44 H new ATOM 0 HA HIS A 25 12.101 10.547 1.636 1.00 12.21 H new ATOM 0 HB2 HIS A 25 10.090 9.530 0.570 1.00 53.23 H new ATOM 0 HB3 HIS A 25 10.330 8.076 1.520 1.00 53.23 H new ATOM 0 HD2 HIS A 25 9.944 8.506 4.412 1.00 52.21 H new ATOM 0 HE1 HIS A 25 7.425 11.831 3.718 1.00 0.13 H new ATOM 0 HE2 HIS A 25 8.156 10.114 5.459 1.00 55.42 H new ATOM 415 N ASP A 26 12.780 7.521 2.812 1.00 3.03 N ATOM 416 CA ASP A 26 13.346 6.723 3.898 1.00 53.02 C ATOM 417 C ASP A 26 13.864 5.389 3.305 1.00 10.33 C ATOM 418 O ASP A 26 13.076 4.629 2.725 1.00 61.24 O ATOM 419 CB ASP A 26 12.276 6.483 4.996 1.00 41.22 C ATOM 420 CG ASP A 26 12.831 5.772 6.242 1.00 14.14 C ATOM 421 OD1 ASP A 26 12.860 4.524 6.274 1.00 54.24 O ATOM 422 OD2 ASP A 26 13.229 6.464 7.208 1.00 42.25 O ATOM 0 H ASP A 26 12.519 6.965 1.998 1.00 3.03 H new ATOM 0 HA ASP A 26 14.178 7.249 4.367 1.00 53.02 H new ATOM 0 HB2 ASP A 26 11.849 7.441 5.293 1.00 41.22 H new ATOM 0 HB3 ASP A 26 11.464 5.888 4.578 1.00 41.22 H new ATOM 427 N PRO A 27 15.192 5.071 3.450 1.00 74.11 N ATOM 428 CA PRO A 27 15.821 3.896 2.792 1.00 43.23 C ATOM 429 C PRO A 27 15.551 2.571 3.531 1.00 44.43 C ATOM 430 O PRO A 27 15.989 1.504 3.084 1.00 43.54 O ATOM 431 CB PRO A 27 17.321 4.266 2.831 1.00 74.34 C ATOM 432 CG PRO A 27 17.477 5.029 4.112 1.00 51.21 C ATOM 433 CD PRO A 27 16.185 5.815 4.282 1.00 12.33 C ATOM 0 HA PRO A 27 15.428 3.716 1.791 1.00 43.23 H new ATOM 0 HB2 PRO A 27 17.951 3.377 2.818 1.00 74.34 H new ATOM 0 HB3 PRO A 27 17.605 4.871 1.970 1.00 74.34 H new ATOM 0 HG2 PRO A 27 17.638 4.354 4.953 1.00 51.21 H new ATOM 0 HG3 PRO A 27 18.338 5.696 4.068 1.00 51.21 H new ATOM 0 HD2 PRO A 27 15.878 5.856 5.327 1.00 12.33 H new ATOM 0 HD3 PRO A 27 16.297 6.845 3.942 1.00 12.33 H new ATOM 441 N ASN A 28 14.845 2.650 4.670 1.00 52.24 N ATOM 442 CA ASN A 28 14.545 1.482 5.516 1.00 22.23 C ATOM 443 C ASN A 28 13.111 0.982 5.272 1.00 51.13 C ATOM 444 O ASN A 28 12.706 -0.041 5.841 1.00 34.41 O ATOM 445 CB ASN A 28 14.773 1.834 7.008 1.00 31.44 C ATOM 446 CG ASN A 28 16.191 2.351 7.329 1.00 62.23 C ATOM 447 OD1 ASN A 28 16.373 3.166 8.236 1.00 1.42 O ATOM 448 ND2 ASN A 28 17.207 1.881 6.604 1.00 1.05 N ATOM 0 H ASN A 28 14.466 3.525 5.031 1.00 52.24 H new ATOM 0 HA ASN A 28 15.223 0.672 5.248 1.00 22.23 H new ATOM 0 HB2 ASN A 28 14.047 2.591 7.306 1.00 31.44 H new ATOM 0 HB3 ASN A 28 14.576 0.948 7.612 1.00 31.44 H new ATOM 0 HD21 ASN A 28 18.158 2.195 6.795 1.00 1.05 H new ATOM 0 HD22 ASN A 28 17.033 1.207 5.858 1.00 1.05 H new ATOM 455 N VAL A 29 12.348 1.706 4.426 1.00 52.03 N ATOM 456 CA VAL A 29 11.011 1.262 3.994 1.00 30.41 C ATOM 457 C VAL A 29 11.162 0.223 2.873 1.00 62.33 C ATOM 458 O VAL A 29 11.733 0.526 1.816 1.00 43.11 O ATOM 459 CB VAL A 29 10.107 2.438 3.471 1.00 62.33 C ATOM 460 CG1 VAL A 29 8.661 1.944 3.205 1.00 30.11 C ATOM 461 CG2 VAL A 29 10.122 3.634 4.441 1.00 32.32 C ATOM 0 H VAL A 29 12.638 2.600 4.030 1.00 52.03 H new ATOM 0 HA VAL A 29 10.520 0.838 4.870 1.00 30.41 H new ATOM 0 HB VAL A 29 10.523 2.784 2.525 1.00 62.33 H new ATOM 0 HG11 VAL A 29 8.054 2.774 2.844 1.00 30.11 H new ATOM 0 HG12 VAL A 29 8.679 1.154 2.454 1.00 30.11 H new ATOM 0 HG13 VAL A 29 8.233 1.556 4.130 1.00 30.11 H new ATOM 0 HG21 VAL A 29 9.487 4.429 4.049 1.00 32.32 H new ATOM 0 HG22 VAL A 29 9.748 3.318 5.415 1.00 32.32 H new ATOM 0 HG23 VAL A 29 11.142 4.004 4.547 1.00 32.32 H new ATOM 471 N LYS A 30 10.659 -0.988 3.117 1.00 20.42 N ATOM 472 CA LYS A 30 10.702 -2.096 2.149 1.00 63.14 C ATOM 473 C LYS A 30 9.607 -1.925 1.087 1.00 24.13 C ATOM 474 O LYS A 30 8.472 -1.639 1.423 1.00 45.03 O ATOM 475 CB LYS A 30 10.544 -3.442 2.914 1.00 10.30 C ATOM 476 CG LYS A 30 11.841 -3.916 3.602 1.00 14.23 C ATOM 477 CD LYS A 30 12.908 -4.374 2.583 1.00 11.55 C ATOM 478 CE LYS A 30 12.443 -5.604 1.784 1.00 63.31 C ATOM 479 NZ LYS A 30 13.470 -6.082 0.826 1.00 42.35 N ATOM 0 H LYS A 30 10.206 -1.234 3.997 1.00 20.42 H new ATOM 0 HA LYS A 30 11.660 -2.095 1.630 1.00 63.14 H new ATOM 0 HB2 LYS A 30 9.762 -3.334 3.666 1.00 10.30 H new ATOM 0 HB3 LYS A 30 10.211 -4.210 2.216 1.00 10.30 H new ATOM 0 HG2 LYS A 30 12.245 -3.106 4.209 1.00 14.23 H new ATOM 0 HG3 LYS A 30 11.611 -4.738 4.279 1.00 14.23 H new ATOM 0 HD2 LYS A 30 13.130 -3.557 1.896 1.00 11.55 H new ATOM 0 HD3 LYS A 30 13.834 -4.610 3.107 1.00 11.55 H new ATOM 0 HE2 LYS A 30 12.193 -6.409 2.475 1.00 63.31 H new ATOM 0 HE3 LYS A 30 11.531 -5.356 1.240 1.00 63.31 H new ATOM 0 HZ1 LYS A 30 13.108 -6.911 0.314 1.00 42.35 H new ATOM 0 HZ2 LYS A 30 13.691 -5.325 0.148 1.00 42.35 H new ATOM 0 HZ3 LYS A 30 14.332 -6.345 1.344 1.00 42.35 H new ATOM 493 N THR A 31 9.964 -2.095 -0.192 1.00 3.34 N ATOM 494 CA THR A 31 9.008 -2.000 -1.316 1.00 70.45 C ATOM 495 C THR A 31 8.975 -3.352 -2.053 1.00 31.21 C ATOM 496 O THR A 31 10.006 -3.821 -2.551 1.00 61.30 O ATOM 497 CB THR A 31 9.367 -0.823 -2.294 1.00 71.43 C ATOM 498 OG1 THR A 31 10.745 -0.900 -2.699 1.00 43.01 O ATOM 499 CG2 THR A 31 9.099 0.562 -1.666 1.00 23.42 C ATOM 0 H THR A 31 10.920 -2.302 -0.482 1.00 3.34 H new ATOM 0 HA THR A 31 8.017 -1.776 -0.921 1.00 70.45 H new ATOM 0 HB THR A 31 8.720 -0.933 -3.164 1.00 71.43 H new ATOM 0 HG1 THR A 31 11.028 -1.838 -2.718 1.00 43.01 H new ATOM 0 HG21 THR A 31 9.362 1.342 -2.380 1.00 23.42 H new ATOM 0 HG22 THR A 31 8.043 0.647 -1.409 1.00 23.42 H new ATOM 0 HG23 THR A 31 9.702 0.676 -0.765 1.00 23.42 H new ATOM 507 N VAL A 32 7.778 -3.975 -2.097 1.00 40.13 N ATOM 508 CA VAL A 32 7.592 -5.373 -2.538 1.00 13.31 C ATOM 509 C VAL A 32 6.498 -5.430 -3.639 1.00 60.11 C ATOM 510 O VAL A 32 5.338 -5.134 -3.355 1.00 51.31 O ATOM 511 CB VAL A 32 7.173 -6.292 -1.318 1.00 2.31 C ATOM 512 CG1 VAL A 32 7.074 -7.774 -1.732 1.00 51.11 C ATOM 513 CG2 VAL A 32 8.139 -6.118 -0.121 1.00 51.05 C ATOM 0 H VAL A 32 6.907 -3.518 -1.825 1.00 40.13 H new ATOM 0 HA VAL A 32 8.536 -5.741 -2.941 1.00 13.31 H new ATOM 0 HB VAL A 32 6.182 -5.969 -0.999 1.00 2.31 H new ATOM 0 HG11 VAL A 32 6.784 -8.374 -0.869 1.00 51.11 H new ATOM 0 HG12 VAL A 32 6.326 -7.883 -2.518 1.00 51.11 H new ATOM 0 HG13 VAL A 32 8.041 -8.114 -2.102 1.00 51.11 H new ATOM 0 HG21 VAL A 32 7.822 -6.763 0.699 1.00 51.05 H new ATOM 0 HG22 VAL A 32 9.150 -6.389 -0.427 1.00 51.05 H new ATOM 0 HG23 VAL A 32 8.126 -5.079 0.209 1.00 51.05 H new ATOM 523 N PRO A 33 6.857 -5.785 -4.917 1.00 25.14 N ATOM 524 CA PRO A 33 5.880 -5.855 -6.035 1.00 30.31 C ATOM 525 C PRO A 33 5.035 -7.159 -6.046 1.00 52.23 C ATOM 526 O PRO A 33 5.195 -8.034 -5.185 1.00 44.50 O ATOM 527 CB PRO A 33 6.793 -5.741 -7.279 1.00 44.24 C ATOM 528 CG PRO A 33 8.077 -6.396 -6.863 1.00 75.14 C ATOM 529 CD PRO A 33 8.238 -6.111 -5.380 1.00 31.31 C ATOM 0 HA PRO A 33 5.119 -5.078 -5.971 1.00 30.31 H new ATOM 0 HB2 PRO A 33 6.353 -6.242 -8.142 1.00 44.24 H new ATOM 0 HB3 PRO A 33 6.951 -4.700 -7.561 1.00 44.24 H new ATOM 0 HG2 PRO A 33 8.045 -7.469 -7.052 1.00 75.14 H new ATOM 0 HG3 PRO A 33 8.919 -5.997 -7.429 1.00 75.14 H new ATOM 0 HD2 PRO A 33 8.642 -6.974 -4.850 1.00 31.31 H new ATOM 0 HD3 PRO A 33 8.923 -5.281 -5.206 1.00 31.31 H new ATOM 537 N THR A 34 4.150 -7.262 -7.057 1.00 44.04 N ATOM 538 CA THR A 34 3.160 -8.354 -7.187 1.00 13.13 C ATOM 539 C THR A 34 3.801 -9.735 -7.496 1.00 23.30 C ATOM 540 O THR A 34 3.213 -10.769 -7.166 1.00 54.55 O ATOM 541 CB THR A 34 2.112 -7.999 -8.293 1.00 34.21 C ATOM 542 OG1 THR A 34 2.795 -7.574 -9.485 1.00 35.20 O ATOM 543 CG2 THR A 34 1.148 -6.894 -7.865 1.00 30.13 C ATOM 0 H THR A 34 4.100 -6.582 -7.816 1.00 44.04 H new ATOM 0 HA THR A 34 2.672 -8.444 -6.217 1.00 13.13 H new ATOM 0 HB THR A 34 1.527 -8.901 -8.473 1.00 34.21 H new ATOM 0 HG1 THR A 34 2.154 -7.507 -10.223 1.00 35.20 H new ATOM 0 HG21 THR A 34 0.445 -6.691 -8.673 1.00 30.13 H new ATOM 0 HG22 THR A 34 0.600 -7.213 -6.978 1.00 30.13 H new ATOM 0 HG23 THR A 34 1.710 -5.988 -7.638 1.00 30.13 H new ATOM 551 N LYS A 35 4.985 -9.736 -8.145 1.00 51.43 N ATOM 552 CA LYS A 35 5.737 -10.984 -8.445 1.00 43.13 C ATOM 553 C LYS A 35 6.273 -11.618 -7.145 1.00 62.13 C ATOM 554 O LYS A 35 6.394 -12.842 -7.030 1.00 50.31 O ATOM 555 CB LYS A 35 6.905 -10.706 -9.433 1.00 73.12 C ATOM 556 CG LYS A 35 7.964 -9.720 -8.903 1.00 20.02 C ATOM 557 CD LYS A 35 9.161 -9.526 -9.858 1.00 74.02 C ATOM 558 CE LYS A 35 10.222 -8.574 -9.285 1.00 3.53 C ATOM 559 NZ LYS A 35 11.287 -8.273 -10.273 1.00 62.24 N ATOM 0 H LYS A 35 5.445 -8.887 -8.474 1.00 51.43 H new ATOM 0 HA LYS A 35 5.051 -11.686 -8.918 1.00 43.13 H new ATOM 0 HB2 LYS A 35 7.393 -11.650 -9.674 1.00 73.12 H new ATOM 0 HB3 LYS A 35 6.493 -10.313 -10.363 1.00 73.12 H new ATOM 0 HG2 LYS A 35 7.492 -8.754 -8.725 1.00 20.02 H new ATOM 0 HG3 LYS A 35 8.332 -10.077 -7.941 1.00 20.02 H new ATOM 0 HD2 LYS A 35 9.619 -10.494 -10.063 1.00 74.02 H new ATOM 0 HD3 LYS A 35 8.802 -9.135 -10.810 1.00 74.02 H new ATOM 0 HE2 LYS A 35 9.745 -7.645 -8.971 1.00 3.53 H new ATOM 0 HE3 LYS A 35 10.667 -9.020 -8.396 1.00 3.53 H new ATOM 0 HZ1 LYS A 35 11.983 -7.628 -9.848 1.00 62.24 H new ATOM 0 HZ2 LYS A 35 11.760 -9.156 -10.554 1.00 62.24 H new ATOM 0 HZ3 LYS A 35 10.866 -7.824 -11.111 1.00 62.24 H new ATOM 573 N ASP A 36 6.571 -10.755 -6.161 1.00 11.34 N ATOM 574 CA ASP A 36 7.031 -11.149 -4.821 1.00 42.43 C ATOM 575 C ASP A 36 5.819 -11.321 -3.887 1.00 2.15 C ATOM 576 O ASP A 36 5.856 -10.912 -2.728 1.00 22.12 O ATOM 577 CB ASP A 36 8.016 -10.068 -4.281 1.00 10.43 C ATOM 578 CG ASP A 36 9.398 -10.124 -4.940 1.00 4.22 C ATOM 579 OD1 ASP A 36 9.576 -9.535 -6.022 1.00 22.40 O ATOM 580 OD2 ASP A 36 10.320 -10.771 -4.383 1.00 11.13 O ATOM 0 H ASP A 36 6.497 -9.744 -6.277 1.00 11.34 H new ATOM 0 HA ASP A 36 7.557 -12.103 -4.868 1.00 42.43 H new ATOM 0 HB2 ASP A 36 7.584 -9.080 -4.442 1.00 10.43 H new ATOM 0 HB3 ASP A 36 8.129 -10.195 -3.204 1.00 10.43 H new ATOM 585 N LYS A 37 4.767 -11.995 -4.401 1.00 1.34 N ATOM 586 CA LYS A 37 3.449 -12.096 -3.736 1.00 12.31 C ATOM 587 C LYS A 37 3.527 -12.861 -2.388 1.00 71.41 C ATOM 588 O LYS A 37 2.871 -12.471 -1.409 1.00 32.43 O ATOM 589 CB LYS A 37 2.416 -12.764 -4.701 1.00 31.21 C ATOM 590 CG LYS A 37 0.938 -12.844 -4.194 1.00 43.52 C ATOM 591 CD LYS A 37 0.083 -11.555 -4.424 1.00 42.52 C ATOM 592 CE LYS A 37 0.562 -10.311 -3.651 1.00 43.54 C ATOM 593 NZ LYS A 37 0.704 -10.580 -2.192 1.00 51.23 N ATOM 0 H LYS A 37 4.808 -12.487 -5.294 1.00 1.34 H new ATOM 0 HA LYS A 37 3.116 -11.085 -3.501 1.00 12.31 H new ATOM 0 HB2 LYS A 37 2.424 -12.215 -5.643 1.00 31.21 H new ATOM 0 HB3 LYS A 37 2.757 -13.776 -4.919 1.00 31.21 H new ATOM 0 HG2 LYS A 37 0.446 -13.680 -4.690 1.00 43.52 H new ATOM 0 HG3 LYS A 37 0.949 -13.068 -3.127 1.00 43.52 H new ATOM 0 HD2 LYS A 37 0.080 -11.324 -5.489 1.00 42.52 H new ATOM 0 HD3 LYS A 37 -0.948 -11.766 -4.141 1.00 42.52 H new ATOM 0 HE2 LYS A 37 1.520 -9.981 -4.054 1.00 43.54 H new ATOM 0 HE3 LYS A 37 -0.146 -9.496 -3.802 1.00 43.54 H new ATOM 0 HZ1 LYS A 37 0.811 -9.680 -1.682 1.00 51.23 H new ATOM 0 HZ2 LYS A 37 -0.143 -11.075 -1.846 1.00 51.23 H new ATOM 0 HZ3 LYS A 37 1.543 -11.172 -2.028 1.00 51.23 H new ATOM 607 N GLU A 38 4.332 -13.931 -2.361 1.00 51.15 N ATOM 608 CA GLU A 38 4.568 -14.753 -1.152 1.00 45.30 C ATOM 609 C GLU A 38 5.517 -14.001 -0.204 1.00 52.34 C ATOM 610 O GLU A 38 5.371 -14.051 1.021 1.00 60.02 O ATOM 611 CB GLU A 38 5.192 -16.142 -1.507 1.00 54.05 C ATOM 612 CG GLU A 38 4.414 -16.988 -2.547 1.00 41.34 C ATOM 613 CD GLU A 38 4.561 -16.489 -3.999 1.00 31.24 C ATOM 614 OE1 GLU A 38 5.642 -16.682 -4.590 1.00 51.32 O ATOM 615 OE2 GLU A 38 3.607 -15.899 -4.547 1.00 11.34 O ATOM 0 H GLU A 38 4.845 -14.259 -3.180 1.00 51.15 H new ATOM 0 HA GLU A 38 3.605 -14.928 -0.672 1.00 45.30 H new ATOM 0 HB2 GLU A 38 6.202 -15.979 -1.882 1.00 54.05 H new ATOM 0 HB3 GLU A 38 5.283 -16.723 -0.589 1.00 54.05 H new ATOM 0 HG2 GLU A 38 4.760 -18.020 -2.492 1.00 41.34 H new ATOM 0 HG3 GLU A 38 3.357 -16.991 -2.280 1.00 41.34 H new ATOM 622 N LYS A 39 6.494 -13.309 -0.827 1.00 51.54 N ATOM 623 CA LYS A 39 7.551 -12.535 -0.144 1.00 72.43 C ATOM 624 C LYS A 39 6.941 -11.372 0.683 1.00 43.33 C ATOM 625 O LYS A 39 7.522 -10.965 1.686 1.00 64.22 O ATOM 626 CB LYS A 39 8.580 -12.012 -1.215 1.00 45.02 C ATOM 627 CG LYS A 39 10.067 -12.355 -0.975 1.00 2.11 C ATOM 628 CD LYS A 39 10.690 -11.609 0.214 1.00 21.21 C ATOM 629 CE LYS A 39 12.192 -11.903 0.393 1.00 13.42 C ATOM 630 NZ LYS A 39 12.766 -11.171 1.554 1.00 32.32 N ATOM 0 H LYS A 39 6.571 -13.272 -1.843 1.00 51.54 H new ATOM 0 HA LYS A 39 8.077 -13.179 0.560 1.00 72.43 H new ATOM 0 HB2 LYS A 39 8.291 -12.411 -2.187 1.00 45.02 H new ATOM 0 HB3 LYS A 39 8.487 -10.928 -1.275 1.00 45.02 H new ATOM 0 HG2 LYS A 39 10.161 -13.428 -0.808 1.00 2.11 H new ATOM 0 HG3 LYS A 39 10.634 -12.122 -1.876 1.00 2.11 H new ATOM 0 HD2 LYS A 39 10.550 -10.537 0.076 1.00 21.21 H new ATOM 0 HD3 LYS A 39 10.161 -11.885 1.126 1.00 21.21 H new ATOM 0 HE2 LYS A 39 12.338 -12.974 0.531 1.00 13.42 H new ATOM 0 HE3 LYS A 39 12.727 -11.622 -0.514 1.00 13.42 H new ATOM 0 HZ1 LYS A 39 13.623 -11.660 1.883 1.00 32.32 H new ATOM 0 HZ2 LYS A 39 13.009 -10.201 1.267 1.00 32.32 H new ATOM 0 HZ3 LYS A 39 12.068 -11.140 2.324 1.00 32.32 H new ATOM 644 N VAL A 40 5.753 -10.881 0.244 1.00 2.12 N ATOM 645 CA VAL A 40 4.975 -9.834 0.950 1.00 14.11 C ATOM 646 C VAL A 40 4.741 -10.226 2.424 1.00 0.14 C ATOM 647 O VAL A 40 5.058 -9.455 3.329 1.00 1.34 O ATOM 648 CB VAL A 40 3.568 -9.596 0.259 1.00 22.34 C ATOM 649 CG1 VAL A 40 2.697 -8.600 1.053 1.00 73.43 C ATOM 650 CG2 VAL A 40 3.717 -9.136 -1.208 1.00 4.12 C ATOM 0 H VAL A 40 5.307 -11.204 -0.615 1.00 2.12 H new ATOM 0 HA VAL A 40 5.559 -8.915 0.901 1.00 14.11 H new ATOM 0 HB VAL A 40 3.058 -10.560 0.258 1.00 22.34 H new ATOM 0 HG11 VAL A 40 1.742 -8.466 0.545 1.00 73.43 H new ATOM 0 HG12 VAL A 40 2.522 -8.989 2.056 1.00 73.43 H new ATOM 0 HG13 VAL A 40 3.210 -7.641 1.120 1.00 73.43 H new ATOM 0 HG21 VAL A 40 2.730 -8.984 -1.644 1.00 4.12 H new ATOM 0 HG22 VAL A 40 4.276 -8.201 -1.241 1.00 4.12 H new ATOM 0 HG23 VAL A 40 4.251 -9.898 -1.776 1.00 4.12 H new ATOM 660 N LYS A 41 4.231 -11.464 2.615 1.00 33.14 N ATOM 661 CA LYS A 41 3.877 -12.033 3.932 1.00 34.13 C ATOM 662 C LYS A 41 5.069 -11.980 4.906 1.00 21.30 C ATOM 663 O LYS A 41 4.911 -11.663 6.096 1.00 50.24 O ATOM 664 CB LYS A 41 3.402 -13.506 3.738 1.00 70.53 C ATOM 665 CG LYS A 41 3.039 -14.240 5.040 1.00 23.22 C ATOM 666 CD LYS A 41 2.690 -15.733 4.837 1.00 71.54 C ATOM 667 CE LYS A 41 2.320 -16.420 6.164 1.00 72.44 C ATOM 668 NZ LYS A 41 1.902 -17.835 5.975 1.00 51.23 N ATOM 0 H LYS A 41 4.051 -12.106 1.843 1.00 33.14 H new ATOM 0 HA LYS A 41 3.074 -11.438 4.366 1.00 34.13 H new ATOM 0 HB2 LYS A 41 2.533 -13.510 3.080 1.00 70.53 H new ATOM 0 HB3 LYS A 41 4.189 -14.063 3.230 1.00 70.53 H new ATOM 0 HG2 LYS A 41 3.875 -14.163 5.735 1.00 23.22 H new ATOM 0 HG3 LYS A 41 2.191 -13.738 5.505 1.00 23.22 H new ATOM 0 HD2 LYS A 41 1.858 -15.820 4.139 1.00 71.54 H new ATOM 0 HD3 LYS A 41 3.539 -16.247 4.386 1.00 71.54 H new ATOM 0 HE2 LYS A 41 3.175 -16.384 6.839 1.00 72.44 H new ATOM 0 HE3 LYS A 41 1.512 -15.867 6.643 1.00 72.44 H new ATOM 0 HZ1 LYS A 41 1.663 -18.253 6.897 1.00 51.23 H new ATOM 0 HZ2 LYS A 41 1.069 -17.871 5.353 1.00 51.23 H new ATOM 0 HZ3 LYS A 41 2.681 -18.372 5.543 1.00 51.23 H new ATOM 682 N GLU A 42 6.262 -12.273 4.363 1.00 14.24 N ATOM 683 CA GLU A 42 7.515 -12.280 5.118 1.00 61.13 C ATOM 684 C GLU A 42 7.880 -10.859 5.572 1.00 4.44 C ATOM 685 O GLU A 42 8.066 -10.619 6.765 1.00 1.43 O ATOM 686 CB GLU A 42 8.648 -12.887 4.249 1.00 53.41 C ATOM 687 CG GLU A 42 8.389 -14.328 3.782 1.00 14.13 C ATOM 688 CD GLU A 42 8.288 -15.331 4.944 1.00 63.44 C ATOM 689 OE1 GLU A 42 9.347 -15.693 5.515 1.00 72.40 O ATOM 690 OE2 GLU A 42 7.164 -15.753 5.301 1.00 54.13 O ATOM 0 H GLU A 42 6.379 -12.513 3.379 1.00 14.24 H new ATOM 0 HA GLU A 42 7.388 -12.895 6.009 1.00 61.13 H new ATOM 0 HB2 GLU A 42 8.795 -12.255 3.373 1.00 53.41 H new ATOM 0 HB3 GLU A 42 9.577 -12.864 4.818 1.00 53.41 H new ATOM 0 HG2 GLU A 42 7.465 -14.356 3.205 1.00 14.13 H new ATOM 0 HG3 GLU A 42 9.192 -14.636 3.113 1.00 14.13 H new ATOM 697 N GLU A 43 7.906 -9.916 4.607 1.00 64.20 N ATOM 698 CA GLU A 43 8.395 -8.542 4.837 1.00 71.33 C ATOM 699 C GLU A 43 7.463 -7.742 5.777 1.00 73.11 C ATOM 700 O GLU A 43 7.901 -6.765 6.381 1.00 15.41 O ATOM 701 CB GLU A 43 8.612 -7.777 3.501 1.00 31.41 C ATOM 702 CG GLU A 43 9.432 -8.508 2.413 1.00 21.12 C ATOM 703 CD GLU A 43 10.704 -9.200 2.924 1.00 63.01 C ATOM 704 OE1 GLU A 43 11.776 -8.570 2.974 1.00 42.43 O ATOM 705 OE2 GLU A 43 10.643 -10.401 3.239 1.00 51.25 O ATOM 0 H GLU A 43 7.590 -10.085 3.652 1.00 64.20 H new ATOM 0 HA GLU A 43 9.361 -8.638 5.333 1.00 71.33 H new ATOM 0 HB2 GLU A 43 7.635 -7.533 3.085 1.00 31.41 H new ATOM 0 HB3 GLU A 43 9.108 -6.833 3.725 1.00 31.41 H new ATOM 0 HG2 GLU A 43 8.795 -9.254 1.937 1.00 21.12 H new ATOM 0 HG3 GLU A 43 9.711 -7.789 1.643 1.00 21.12 H new ATOM 712 N ILE A 44 6.168 -8.134 5.847 1.00 41.22 N ATOM 713 CA ILE A 44 5.205 -7.578 6.824 1.00 22.03 C ATOM 714 C ILE A 44 5.670 -7.903 8.265 1.00 0.30 C ATOM 715 O ILE A 44 5.710 -7.024 9.132 1.00 75.10 O ATOM 716 CB ILE A 44 3.747 -8.142 6.589 1.00 74.11 C ATOM 717 CG1 ILE A 44 3.199 -7.703 5.196 1.00 70.42 C ATOM 718 CG2 ILE A 44 2.773 -7.710 7.717 1.00 11.12 C ATOM 719 CD1 ILE A 44 1.852 -8.302 4.837 1.00 51.03 C ATOM 0 H ILE A 44 5.765 -8.840 5.231 1.00 41.22 H new ATOM 0 HA ILE A 44 5.172 -6.497 6.684 1.00 22.03 H new ATOM 0 HB ILE A 44 3.814 -9.230 6.610 1.00 74.11 H new ATOM 0 HG12 ILE A 44 3.117 -6.616 5.177 1.00 70.42 H new ATOM 0 HG13 ILE A 44 3.923 -7.981 4.430 1.00 70.42 H new ATOM 0 HG21 ILE A 44 1.782 -8.118 7.518 1.00 11.12 H new ATOM 0 HG22 ILE A 44 3.135 -8.086 8.674 1.00 11.12 H new ATOM 0 HG23 ILE A 44 2.717 -6.622 7.752 1.00 11.12 H new ATOM 0 HD11 ILE A 44 1.545 -7.945 3.854 1.00 51.03 H new ATOM 0 HD12 ILE A 44 1.930 -9.389 4.820 1.00 51.03 H new ATOM 0 HD13 ILE A 44 1.111 -8.003 5.579 1.00 51.03 H new ATOM 731 N GLU A 45 6.052 -9.180 8.490 1.00 1.24 N ATOM 732 CA GLU A 45 6.546 -9.648 9.797 1.00 3.00 C ATOM 733 C GLU A 45 7.923 -9.026 10.120 1.00 52.23 C ATOM 734 O GLU A 45 8.214 -8.681 11.275 1.00 30.35 O ATOM 735 CB GLU A 45 6.616 -11.194 9.847 1.00 34.43 C ATOM 736 CG GLU A 45 7.059 -11.731 11.225 1.00 0.14 C ATOM 737 CD GLU A 45 7.121 -13.258 11.314 1.00 45.14 C ATOM 738 OE1 GLU A 45 7.937 -13.872 10.592 1.00 35.02 O ATOM 739 OE2 GLU A 45 6.384 -13.854 12.138 1.00 1.21 O ATOM 0 H GLU A 45 6.026 -9.907 7.775 1.00 1.24 H new ATOM 0 HA GLU A 45 5.838 -9.320 10.558 1.00 3.00 H new ATOM 0 HB2 GLU A 45 5.637 -11.605 9.600 1.00 34.43 H new ATOM 0 HB3 GLU A 45 7.311 -11.546 9.085 1.00 34.43 H new ATOM 0 HG2 GLU A 45 8.042 -11.324 11.462 1.00 0.14 H new ATOM 0 HG3 GLU A 45 6.370 -11.362 11.985 1.00 0.14 H new ATOM 746 N LYS A 46 8.751 -8.861 9.076 1.00 74.41 N ATOM 747 CA LYS A 46 10.073 -8.223 9.187 1.00 60.04 C ATOM 748 C LYS A 46 9.917 -6.716 9.500 1.00 21.30 C ATOM 749 O LYS A 46 10.754 -6.132 10.192 1.00 54.52 O ATOM 750 CB LYS A 46 10.900 -8.464 7.890 1.00 60.00 C ATOM 751 CG LYS A 46 11.104 -9.970 7.542 1.00 52.53 C ATOM 752 CD LYS A 46 12.077 -10.204 6.358 1.00 31.44 C ATOM 753 CE LYS A 46 12.041 -11.651 5.812 1.00 43.22 C ATOM 754 NZ LYS A 46 12.373 -12.682 6.824 1.00 22.20 N ATOM 0 H LYS A 46 8.523 -9.167 8.130 1.00 74.41 H new ATOM 0 HA LYS A 46 10.621 -8.675 10.014 1.00 60.04 H new ATOM 0 HB2 LYS A 46 10.400 -7.973 7.055 1.00 60.00 H new ATOM 0 HB3 LYS A 46 11.876 -7.991 8.000 1.00 60.00 H new ATOM 0 HG2 LYS A 46 11.483 -10.490 8.422 1.00 52.53 H new ATOM 0 HG3 LYS A 46 10.138 -10.413 7.301 1.00 52.53 H new ATOM 0 HD2 LYS A 46 11.830 -9.513 5.552 1.00 31.44 H new ATOM 0 HD3 LYS A 46 13.092 -9.970 6.679 1.00 31.44 H new ATOM 0 HE2 LYS A 46 11.047 -11.854 5.413 1.00 43.22 H new ATOM 0 HE3 LYS A 46 12.741 -11.733 4.981 1.00 43.22 H new ATOM 0 HZ1 LYS A 46 12.329 -13.625 6.387 1.00 22.20 H new ATOM 0 HZ2 LYS A 46 13.332 -12.514 7.189 1.00 22.20 H new ATOM 0 HZ3 LYS A 46 11.691 -12.632 7.608 1.00 22.20 H new ATOM 768 N ALA A 47 8.817 -6.114 9.004 1.00 71.12 N ATOM 769 CA ALA A 47 8.469 -4.700 9.258 1.00 14.22 C ATOM 770 C ALA A 47 8.066 -4.477 10.732 1.00 51.41 C ATOM 771 O ALA A 47 8.303 -3.403 11.282 1.00 55.23 O ATOM 772 CB ALA A 47 7.353 -4.249 8.303 1.00 14.20 C ATOM 0 H ALA A 47 8.141 -6.597 8.413 1.00 71.12 H new ATOM 0 HA ALA A 47 9.353 -4.090 9.069 1.00 14.22 H new ATOM 0 HB1 ALA A 47 7.105 -3.206 8.500 1.00 14.20 H new ATOM 0 HB2 ALA A 47 7.692 -4.353 7.272 1.00 14.20 H new ATOM 0 HB3 ALA A 47 6.469 -4.867 8.459 1.00 14.20 H new ATOM 778 N ARG A 48 7.456 -5.507 11.359 1.00 45.22 N ATOM 779 CA ARG A 48 7.157 -5.498 12.814 1.00 13.41 C ATOM 780 C ARG A 48 8.470 -5.455 13.616 1.00 25.42 C ATOM 781 O ARG A 48 8.664 -4.603 14.489 1.00 24.33 O ATOM 782 CB ARG A 48 6.394 -6.787 13.225 1.00 32.34 C ATOM 783 CG ARG A 48 5.063 -7.039 12.507 1.00 14.14 C ATOM 784 CD ARG A 48 4.537 -8.460 12.747 1.00 12.32 C ATOM 785 NE ARG A 48 4.319 -8.772 14.167 1.00 63.34 N ATOM 786 CZ ARG A 48 3.883 -9.956 14.642 1.00 35.35 C ATOM 787 NH1 ARG A 48 3.589 -10.966 13.817 1.00 4.51 N ATOM 788 NH2 ARG A 48 3.788 -10.131 15.950 1.00 21.50 N ATOM 0 H ARG A 48 7.159 -6.358 10.882 1.00 45.22 H new ATOM 0 HA ARG A 48 6.545 -4.621 13.025 1.00 13.41 H new ATOM 0 HB2 ARG A 48 7.046 -7.643 13.050 1.00 32.34 H new ATOM 0 HB3 ARG A 48 6.203 -6.746 14.297 1.00 32.34 H new ATOM 0 HG2 ARG A 48 4.323 -6.316 12.852 1.00 14.14 H new ATOM 0 HG3 ARG A 48 5.193 -6.877 11.437 1.00 14.14 H new ATOM 0 HD2 ARG A 48 3.599 -8.588 12.207 1.00 12.32 H new ATOM 0 HD3 ARG A 48 5.245 -9.176 12.330 1.00 12.32 H new ATOM 0 HE ARG A 48 4.513 -8.035 14.846 1.00 63.34 H new ATOM 0 HH11 ARG A 48 3.693 -10.848 12.809 1.00 4.51 H new ATOM 0 HH12 ARG A 48 3.260 -11.854 14.195 1.00 4.51 H new ATOM 0 HH21 ARG A 48 4.043 -9.375 16.586 1.00 21.50 H new ATOM 0 HH22 ARG A 48 3.460 -11.022 16.323 1.00 21.50 H new ATOM 802 N LYS A 49 9.361 -6.392 13.251 1.00 53.13 N ATOM 803 CA LYS A 49 10.605 -6.694 13.978 1.00 1.12 C ATOM 804 C LYS A 49 11.584 -5.501 13.961 1.00 34.15 C ATOM 805 O LYS A 49 12.228 -5.200 14.971 1.00 14.34 O ATOM 806 CB LYS A 49 11.253 -7.959 13.345 1.00 21.15 C ATOM 807 CG LYS A 49 12.461 -8.524 14.121 1.00 64.20 C ATOM 808 CD LYS A 49 13.033 -9.809 13.477 1.00 73.32 C ATOM 809 CE LYS A 49 14.153 -10.444 14.317 1.00 25.20 C ATOM 810 NZ LYS A 49 14.662 -11.708 13.720 1.00 13.44 N ATOM 0 H LYS A 49 9.233 -6.974 12.423 1.00 53.13 H new ATOM 0 HA LYS A 49 10.369 -6.884 15.025 1.00 1.12 H new ATOM 0 HB2 LYS A 49 10.494 -8.737 13.265 1.00 21.15 H new ATOM 0 HB3 LYS A 49 11.571 -7.718 12.331 1.00 21.15 H new ATOM 0 HG2 LYS A 49 13.244 -7.767 14.169 1.00 64.20 H new ATOM 0 HG3 LYS A 49 12.161 -8.738 15.147 1.00 64.20 H new ATOM 0 HD2 LYS A 49 12.229 -10.533 13.344 1.00 73.32 H new ATOM 0 HD3 LYS A 49 13.417 -9.573 12.485 1.00 73.32 H new ATOM 0 HE2 LYS A 49 14.975 -9.735 14.416 1.00 25.20 H new ATOM 0 HE3 LYS A 49 13.781 -10.644 15.322 1.00 25.20 H new ATOM 0 HZ1 LYS A 49 15.415 -12.098 14.322 1.00 13.44 H new ATOM 0 HZ2 LYS A 49 13.885 -12.396 13.649 1.00 13.44 H new ATOM 0 HZ3 LYS A 49 15.042 -11.515 12.771 1.00 13.44 H new ATOM 824 N GLN A 50 11.664 -4.826 12.802 1.00 64.35 N ATOM 825 CA GLN A 50 12.561 -3.670 12.590 1.00 34.43 C ATOM 826 C GLN A 50 11.856 -2.343 12.942 1.00 51.53 C ATOM 827 O GLN A 50 12.518 -1.301 13.032 1.00 24.24 O ATOM 828 CB GLN A 50 13.063 -3.653 11.117 1.00 14.42 C ATOM 829 CG GLN A 50 13.762 -4.960 10.674 1.00 53.34 C ATOM 830 CD GLN A 50 14.248 -4.945 9.221 1.00 12.51 C ATOM 831 OE1 GLN A 50 14.644 -3.906 8.691 1.00 13.12 O ATOM 832 NE2 GLN A 50 14.206 -6.097 8.560 1.00 45.52 N ATOM 0 H GLN A 50 11.108 -5.065 11.981 1.00 64.35 H new ATOM 0 HA GLN A 50 13.418 -3.773 13.255 1.00 34.43 H new ATOM 0 HB2 GLN A 50 12.216 -3.465 10.458 1.00 14.42 H new ATOM 0 HB3 GLN A 50 13.756 -2.822 10.990 1.00 14.42 H new ATOM 0 HG2 GLN A 50 14.613 -5.145 11.329 1.00 53.34 H new ATOM 0 HG3 GLN A 50 13.071 -5.793 10.807 1.00 53.34 H new ATOM 0 HE21 GLN A 50 13.873 -6.941 9.026 1.00 45.52 H new ATOM 0 HE22 GLN A 50 14.507 -6.137 7.586 1.00 45.52 H new ATOM 841 N GLY A 51 10.513 -2.395 13.136 1.00 74.51 N ATOM 842 CA GLY A 51 9.715 -1.210 13.499 1.00 50.44 C ATOM 843 C GLY A 51 9.545 -0.231 12.335 1.00 63.53 C ATOM 844 O GLY A 51 9.491 0.986 12.537 1.00 40.44 O ATOM 0 H GLY A 51 9.965 -3.251 13.045 1.00 74.51 H new ATOM 0 HA2 GLY A 51 8.732 -1.531 13.844 1.00 50.44 H new ATOM 0 HA3 GLY A 51 10.194 -0.697 14.333 1.00 50.44 H new ATOM 848 N ARG A 52 9.455 -0.781 11.114 1.00 14.05 N ATOM 849 CA ARG A 52 9.435 -0.008 9.854 1.00 71.25 C ATOM 850 C ARG A 52 8.126 -0.219 9.069 1.00 14.31 C ATOM 851 O ARG A 52 7.393 -1.176 9.329 1.00 71.25 O ATOM 852 CB ARG A 52 10.673 -0.416 8.993 1.00 55.24 C ATOM 853 CG ARG A 52 11.998 0.161 9.529 1.00 4.32 C ATOM 854 CD ARG A 52 12.011 1.704 9.475 1.00 70.24 C ATOM 855 NE ARG A 52 13.117 2.293 10.234 1.00 53.42 N ATOM 856 CZ ARG A 52 13.566 3.546 10.085 1.00 31.04 C ATOM 857 NH1 ARG A 52 13.022 4.359 9.187 1.00 72.12 N ATOM 858 NH2 ARG A 52 14.552 3.983 10.852 1.00 50.13 N ATOM 0 H ARG A 52 9.393 -1.789 10.968 1.00 14.05 H new ATOM 0 HA ARG A 52 9.485 1.054 10.094 1.00 71.25 H new ATOM 0 HB2 ARG A 52 10.744 -1.503 8.961 1.00 55.24 H new ATOM 0 HB3 ARG A 52 10.524 -0.076 7.968 1.00 55.24 H new ATOM 0 HG2 ARG A 52 12.149 -0.169 10.557 1.00 4.32 H new ATOM 0 HG3 ARG A 52 12.829 -0.231 8.943 1.00 4.32 H new ATOM 0 HD2 ARG A 52 12.079 2.025 8.436 1.00 70.24 H new ATOM 0 HD3 ARG A 52 11.067 2.084 9.865 1.00 70.24 H new ATOM 0 HE ARG A 52 13.579 1.705 10.927 1.00 53.42 H new ATOM 0 HH11 ARG A 52 12.254 4.031 8.602 1.00 72.12 H new ATOM 0 HH12 ARG A 52 13.372 5.311 9.083 1.00 72.12 H new ATOM 0 HH21 ARG A 52 14.965 3.367 11.552 1.00 50.13 H new ATOM 0 HH22 ARG A 52 14.898 4.936 10.743 1.00 50.13 H new ATOM 872 N PRO A 53 7.781 0.718 8.128 1.00 50.03 N ATOM 873 CA PRO A 53 6.719 0.483 7.137 1.00 60.24 C ATOM 874 C PRO A 53 7.206 -0.361 5.934 1.00 32.42 C ATOM 875 O PRO A 53 8.413 -0.597 5.749 1.00 13.12 O ATOM 876 CB PRO A 53 6.320 1.915 6.716 1.00 3.21 C ATOM 877 CG PRO A 53 7.585 2.706 6.837 1.00 2.53 C ATOM 878 CD PRO A 53 8.346 2.101 8.004 1.00 25.03 C ATOM 0 HA PRO A 53 5.887 -0.096 7.539 1.00 60.24 H new ATOM 0 HB2 PRO A 53 5.934 1.936 5.697 1.00 3.21 H new ATOM 0 HB3 PRO A 53 5.538 2.315 7.361 1.00 3.21 H new ATOM 0 HG2 PRO A 53 8.170 2.650 5.919 1.00 2.53 H new ATOM 0 HG3 PRO A 53 7.371 3.760 7.015 1.00 2.53 H new ATOM 0 HD2 PRO A 53 9.419 2.078 7.812 1.00 25.03 H new ATOM 0 HD3 PRO A 53 8.198 2.676 8.918 1.00 25.03 H new ATOM 886 N ILE A 54 6.241 -0.793 5.117 1.00 71.54 N ATOM 887 CA ILE A 54 6.479 -1.598 3.912 1.00 10.22 C ATOM 888 C ILE A 54 5.421 -1.219 2.861 1.00 43.25 C ATOM 889 O ILE A 54 4.228 -1.328 3.119 1.00 42.25 O ATOM 890 CB ILE A 54 6.421 -3.157 4.220 1.00 72.34 C ATOM 891 CG1 ILE A 54 6.412 -3.997 2.893 1.00 61.03 C ATOM 892 CG2 ILE A 54 5.226 -3.514 5.137 1.00 51.02 C ATOM 893 CD1 ILE A 54 6.034 -5.462 3.051 1.00 31.14 C ATOM 0 H ILE A 54 5.254 -0.590 5.276 1.00 71.54 H new ATOM 0 HA ILE A 54 7.481 -1.388 3.538 1.00 10.22 H new ATOM 0 HB ILE A 54 7.327 -3.420 4.766 1.00 72.34 H new ATOM 0 HG12 ILE A 54 5.716 -3.533 2.194 1.00 61.03 H new ATOM 0 HG13 ILE A 54 7.402 -3.941 2.441 1.00 61.03 H new ATOM 0 HG21 ILE A 54 5.220 -4.588 5.325 1.00 51.02 H new ATOM 0 HG22 ILE A 54 5.321 -2.981 6.083 1.00 51.02 H new ATOM 0 HG23 ILE A 54 4.295 -3.226 4.650 1.00 51.02 H new ATOM 0 HD11 ILE A 54 6.058 -5.951 2.077 1.00 31.14 H new ATOM 0 HD12 ILE A 54 6.742 -5.950 3.720 1.00 31.14 H new ATOM 0 HD13 ILE A 54 5.030 -5.536 3.469 1.00 31.14 H new ATOM 905 N VAL A 55 5.862 -0.764 1.681 1.00 12.14 N ATOM 906 CA VAL A 55 4.961 -0.432 0.571 1.00 32.32 C ATOM 907 C VAL A 55 4.868 -1.631 -0.389 1.00 1.53 C ATOM 908 O VAL A 55 5.796 -1.908 -1.152 1.00 74.35 O ATOM 909 CB VAL A 55 5.456 0.840 -0.209 1.00 30.31 C ATOM 910 CG1 VAL A 55 4.399 1.320 -1.215 1.00 73.42 C ATOM 911 CG2 VAL A 55 5.856 1.968 0.760 1.00 64.24 C ATOM 0 H VAL A 55 6.849 -0.616 1.470 1.00 12.14 H new ATOM 0 HA VAL A 55 3.977 -0.210 0.983 1.00 32.32 H new ATOM 0 HB VAL A 55 6.346 0.558 -0.772 1.00 30.31 H new ATOM 0 HG11 VAL A 55 4.769 2.201 -1.739 1.00 73.42 H new ATOM 0 HG12 VAL A 55 4.196 0.528 -1.935 1.00 73.42 H new ATOM 0 HG13 VAL A 55 3.481 1.573 -0.685 1.00 73.42 H new ATOM 0 HG21 VAL A 55 6.194 2.834 0.191 1.00 64.24 H new ATOM 0 HG22 VAL A 55 4.996 2.247 1.369 1.00 64.24 H new ATOM 0 HG23 VAL A 55 6.662 1.623 1.408 1.00 64.24 H new ATOM 921 N VAL A 56 3.745 -2.343 -0.315 1.00 22.10 N ATOM 922 CA VAL A 56 3.422 -3.470 -1.192 1.00 41.23 C ATOM 923 C VAL A 56 2.645 -2.968 -2.414 1.00 31.03 C ATOM 924 O VAL A 56 1.528 -2.467 -2.271 1.00 61.52 O ATOM 925 CB VAL A 56 2.548 -4.532 -0.436 1.00 4.43 C ATOM 926 CG1 VAL A 56 2.307 -5.786 -1.306 1.00 1.31 C ATOM 927 CG2 VAL A 56 3.174 -4.897 0.928 1.00 62.21 C ATOM 0 H VAL A 56 3.017 -2.149 0.372 1.00 22.10 H new ATOM 0 HA VAL A 56 4.356 -3.936 -1.506 1.00 41.23 H new ATOM 0 HB VAL A 56 1.574 -4.083 -0.241 1.00 4.43 H new ATOM 0 HG11 VAL A 56 1.699 -6.501 -0.753 1.00 1.31 H new ATOM 0 HG12 VAL A 56 1.788 -5.500 -2.221 1.00 1.31 H new ATOM 0 HG13 VAL A 56 3.264 -6.243 -1.559 1.00 1.31 H new ATOM 0 HG21 VAL A 56 2.548 -5.634 1.430 1.00 62.21 H new ATOM 0 HG22 VAL A 56 4.170 -5.312 0.772 1.00 62.21 H new ATOM 0 HG23 VAL A 56 3.247 -4.002 1.546 1.00 62.21 H new ATOM 937 N PHE A 57 3.233 -3.099 -3.605 1.00 3.04 N ATOM 938 CA PHE A 57 2.574 -2.726 -4.856 1.00 72.32 C ATOM 939 C PHE A 57 1.737 -3.905 -5.353 1.00 11.15 C ATOM 940 O PHE A 57 2.273 -4.943 -5.744 1.00 51.54 O ATOM 941 CB PHE A 57 3.629 -2.272 -5.886 1.00 21.23 C ATOM 942 CG PHE A 57 4.351 -1.014 -5.414 1.00 34.14 C ATOM 943 CD1 PHE A 57 3.778 0.246 -5.607 1.00 33.45 C ATOM 944 CD2 PHE A 57 5.572 -1.088 -4.741 1.00 73.13 C ATOM 945 CE1 PHE A 57 4.395 1.385 -5.139 1.00 32.44 C ATOM 946 CE2 PHE A 57 6.191 0.054 -4.280 1.00 35.42 C ATOM 947 CZ PHE A 57 5.602 1.291 -4.482 1.00 1.52 C ATOM 0 H PHE A 57 4.177 -3.466 -3.728 1.00 3.04 H new ATOM 0 HA PHE A 57 1.899 -1.885 -4.698 1.00 72.32 H new ATOM 0 HB2 PHE A 57 4.352 -3.071 -6.047 1.00 21.23 H new ATOM 0 HB3 PHE A 57 3.147 -2.080 -6.845 1.00 21.23 H new ATOM 0 HD1 PHE A 57 2.837 0.328 -6.131 1.00 33.45 H new ATOM 0 HD2 PHE A 57 6.036 -2.050 -4.580 1.00 73.13 H new ATOM 0 HE1 PHE A 57 3.933 2.350 -5.287 1.00 32.44 H new ATOM 0 HE2 PHE A 57 7.136 -0.016 -3.761 1.00 35.42 H new ATOM 0 HZ PHE A 57 6.091 2.185 -4.123 1.00 1.52 H new ATOM 957 N VAL A 58 0.418 -3.736 -5.233 1.00 53.45 N ATOM 958 CA VAL A 58 -0.607 -4.705 -5.642 1.00 21.23 C ATOM 959 C VAL A 58 -1.363 -4.144 -6.873 1.00 61.04 C ATOM 960 O VAL A 58 -1.371 -2.934 -7.091 1.00 75.13 O ATOM 961 CB VAL A 58 -1.598 -4.988 -4.443 1.00 15.43 C ATOM 962 CG1 VAL A 58 -2.656 -6.051 -4.800 1.00 41.25 C ATOM 963 CG2 VAL A 58 -0.824 -5.410 -3.173 1.00 15.13 C ATOM 0 H VAL A 58 0.017 -2.888 -4.833 1.00 53.45 H new ATOM 0 HA VAL A 58 -0.139 -5.651 -5.914 1.00 21.23 H new ATOM 0 HB VAL A 58 -2.124 -4.054 -4.242 1.00 15.43 H new ATOM 0 HG11 VAL A 58 -3.313 -6.211 -3.945 1.00 41.25 H new ATOM 0 HG12 VAL A 58 -3.244 -5.707 -5.651 1.00 41.25 H new ATOM 0 HG13 VAL A 58 -2.159 -6.987 -5.056 1.00 41.25 H new ATOM 0 HG21 VAL A 58 -1.529 -5.599 -2.363 1.00 15.13 H new ATOM 0 HG22 VAL A 58 -0.255 -6.317 -3.378 1.00 15.13 H new ATOM 0 HG23 VAL A 58 -0.141 -4.612 -2.881 1.00 15.13 H new ATOM 973 N ARG A 59 -1.912 -5.025 -7.727 1.00 51.05 N ATOM 974 CA ARG A 59 -2.776 -4.600 -8.853 1.00 72.22 C ATOM 975 C ARG A 59 -4.206 -4.315 -8.347 1.00 44.23 C ATOM 976 O ARG A 59 -4.622 -4.853 -7.310 1.00 12.53 O ATOM 977 CB ARG A 59 -2.803 -5.696 -9.950 1.00 3.10 C ATOM 978 CG ARG A 59 -1.415 -6.067 -10.519 1.00 40.30 C ATOM 979 CD ARG A 59 -0.680 -4.880 -11.164 1.00 24.15 C ATOM 980 NE ARG A 59 0.669 -5.264 -11.622 1.00 73.12 N ATOM 981 CZ ARG A 59 1.357 -4.663 -12.603 1.00 34.41 C ATOM 982 NH1 ARG A 59 0.849 -3.622 -13.268 1.00 24.52 N ATOM 983 NH2 ARG A 59 2.558 -5.109 -12.920 1.00 73.33 N ATOM 0 H ARG A 59 -1.776 -6.034 -7.663 1.00 51.05 H new ATOM 0 HA ARG A 59 -2.368 -3.685 -9.283 1.00 72.22 H new ATOM 0 HB2 ARG A 59 -3.264 -6.593 -9.538 1.00 3.10 H new ATOM 0 HB3 ARG A 59 -3.439 -5.358 -10.768 1.00 3.10 H new ATOM 0 HG2 ARG A 59 -0.799 -6.473 -9.717 1.00 40.30 H new ATOM 0 HG3 ARG A 59 -1.534 -6.857 -11.261 1.00 40.30 H new ATOM 0 HD2 ARG A 59 -1.260 -4.507 -12.008 1.00 24.15 H new ATOM 0 HD3 ARG A 59 -0.603 -4.064 -10.445 1.00 24.15 H new ATOM 0 HE ARG A 59 1.115 -6.052 -11.153 1.00 73.12 H new ATOM 0 HH11 ARG A 59 -0.079 -3.270 -13.033 1.00 24.52 H new ATOM 0 HH12 ARG A 59 1.389 -3.179 -14.011 1.00 24.52 H new ATOM 0 HH21 ARG A 59 2.955 -5.904 -12.420 1.00 73.33 H new ATOM 0 HH22 ARG A 59 3.089 -4.658 -13.665 1.00 73.33 H new ATOM 997 N GLY A 60 -4.941 -3.468 -9.091 1.00 70.44 N ATOM 998 CA GLY A 60 -6.339 -3.145 -8.769 1.00 4.42 C ATOM 999 C GLY A 60 -7.268 -4.361 -8.859 1.00 44.25 C ATOM 1000 O GLY A 60 -8.204 -4.484 -8.069 1.00 22.24 O ATOM 0 H GLY A 60 -4.586 -2.995 -9.922 1.00 70.44 H new ATOM 0 HA2 GLY A 60 -6.388 -2.730 -7.762 1.00 4.42 H new ATOM 0 HA3 GLY A 60 -6.694 -2.372 -9.450 1.00 4.42 H new ATOM 1004 N GLY A 61 -6.989 -5.258 -9.831 1.00 75.25 N ATOM 1005 CA GLY A 61 -7.732 -6.525 -9.991 1.00 13.54 C ATOM 1006 C GLY A 61 -7.373 -7.566 -8.930 1.00 74.32 C ATOM 1007 O GLY A 61 -8.098 -8.546 -8.733 1.00 1.50 O ATOM 0 H GLY A 61 -6.249 -5.125 -10.520 1.00 75.25 H new ATOM 0 HA2 GLY A 61 -8.802 -6.321 -9.945 1.00 13.54 H new ATOM 0 HA3 GLY A 61 -7.529 -6.937 -10.980 1.00 13.54 H new ATOM 1011 N ASP A 62 -6.246 -7.339 -8.245 1.00 60.42 N ATOM 1012 CA ASP A 62 -5.776 -8.180 -7.129 1.00 52.11 C ATOM 1013 C ASP A 62 -6.224 -7.575 -5.788 1.00 50.34 C ATOM 1014 O ASP A 62 -5.592 -7.825 -4.762 1.00 63.11 O ATOM 1015 CB ASP A 62 -4.219 -8.296 -7.156 1.00 51.42 C ATOM 1016 CG ASP A 62 -3.657 -9.109 -8.328 1.00 1.24 C ATOM 1017 OD1 ASP A 62 -4.008 -8.817 -9.490 1.00 34.40 O ATOM 1018 OD2 ASP A 62 -2.826 -10.021 -8.102 1.00 10.43 O ATOM 0 H ASP A 62 -5.624 -6.557 -8.450 1.00 60.42 H new ATOM 0 HA ASP A 62 -6.209 -9.174 -7.238 1.00 52.11 H new ATOM 0 HB2 ASP A 62 -3.794 -7.293 -7.191 1.00 51.42 H new ATOM 0 HB3 ASP A 62 -3.886 -8.751 -6.223 1.00 51.42 H new ATOM 1023 N ASP A 63 -7.330 -6.803 -5.796 1.00 12.40 N ATOM 1024 CA ASP A 63 -7.865 -6.162 -4.572 1.00 21.12 C ATOM 1025 C ASP A 63 -8.421 -7.213 -3.593 1.00 12.50 C ATOM 1026 O ASP A 63 -8.514 -6.945 -2.387 1.00 53.33 O ATOM 1027 CB ASP A 63 -8.955 -5.107 -4.909 1.00 22.43 C ATOM 1028 CG ASP A 63 -10.279 -5.723 -5.383 1.00 1.22 C ATOM 1029 OD1 ASP A 63 -10.295 -6.347 -6.464 1.00 71.40 O ATOM 1030 OD2 ASP A 63 -11.305 -5.591 -4.673 1.00 33.33 O ATOM 0 H ASP A 63 -7.873 -6.607 -6.637 1.00 12.40 H new ATOM 0 HA ASP A 63 -7.035 -5.646 -4.090 1.00 21.12 H new ATOM 0 HB2 ASP A 63 -9.143 -4.496 -4.026 1.00 22.43 H new ATOM 0 HB3 ASP A 63 -8.576 -4.440 -5.683 1.00 22.43 H new ATOM 1035 N GLU A 64 -8.805 -8.394 -4.135 1.00 35.04 N ATOM 1036 CA GLU A 64 -9.218 -9.557 -3.325 1.00 2.11 C ATOM 1037 C GLU A 64 -8.009 -10.210 -2.641 1.00 63.13 C ATOM 1038 O GLU A 64 -8.145 -10.778 -1.569 1.00 62.53 O ATOM 1039 CB GLU A 64 -10.008 -10.600 -4.154 1.00 54.15 C ATOM 1040 CG GLU A 64 -11.387 -10.108 -4.626 1.00 73.43 C ATOM 1041 CD GLU A 64 -12.250 -11.222 -5.235 1.00 62.32 C ATOM 1042 OE1 GLU A 64 -12.957 -11.924 -4.477 1.00 33.31 O ATOM 1043 OE2 GLU A 64 -12.218 -11.417 -6.471 1.00 22.22 O ATOM 0 H GLU A 64 -8.836 -8.563 -5.140 1.00 35.04 H new ATOM 0 HA GLU A 64 -9.891 -9.181 -2.554 1.00 2.11 H new ATOM 0 HB2 GLU A 64 -9.416 -10.881 -5.025 1.00 54.15 H new ATOM 0 HB3 GLU A 64 -10.140 -11.501 -3.555 1.00 54.15 H new ATOM 0 HG2 GLU A 64 -11.917 -9.667 -3.782 1.00 73.43 H new ATOM 0 HG3 GLU A 64 -11.251 -9.318 -5.364 1.00 73.43 H new ATOM 1050 N ARG A 65 -6.828 -10.125 -3.269 1.00 55.12 N ATOM 1051 CA ARG A 65 -5.566 -10.538 -2.630 1.00 54.31 C ATOM 1052 C ARG A 65 -5.125 -9.474 -1.609 1.00 3.15 C ATOM 1053 O ARG A 65 -4.625 -9.813 -0.542 1.00 20.32 O ATOM 1054 CB ARG A 65 -4.459 -10.774 -3.699 1.00 51.34 C ATOM 1055 CG ARG A 65 -4.733 -11.989 -4.616 1.00 42.14 C ATOM 1056 CD ARG A 65 -3.630 -12.224 -5.667 1.00 72.03 C ATOM 1057 NE ARG A 65 -3.869 -13.455 -6.442 1.00 42.41 N ATOM 1058 CZ ARG A 65 -3.343 -13.739 -7.649 1.00 34.43 C ATOM 1059 NH1 ARG A 65 -2.533 -12.880 -8.274 1.00 41.23 N ATOM 1060 NH2 ARG A 65 -3.644 -14.888 -8.239 1.00 23.02 N ATOM 0 H ARG A 65 -6.718 -9.774 -4.220 1.00 55.12 H new ATOM 0 HA ARG A 65 -5.728 -11.480 -2.105 1.00 54.31 H new ATOM 0 HB2 ARG A 65 -4.363 -9.879 -4.314 1.00 51.34 H new ATOM 0 HB3 ARG A 65 -3.503 -10.918 -3.195 1.00 51.34 H new ATOM 0 HG2 ARG A 65 -4.835 -12.883 -4.001 1.00 42.14 H new ATOM 0 HG3 ARG A 65 -5.685 -11.843 -5.126 1.00 42.14 H new ATOM 0 HD2 ARG A 65 -3.585 -11.371 -6.344 1.00 72.03 H new ATOM 0 HD3 ARG A 65 -2.662 -12.289 -5.170 1.00 72.03 H new ATOM 0 HE ARG A 65 -4.487 -14.153 -6.028 1.00 42.41 H new ATOM 0 HH11 ARG A 65 -2.301 -11.988 -7.837 1.00 41.23 H new ATOM 0 HH12 ARG A 65 -2.146 -13.116 -9.188 1.00 41.23 H new ATOM 0 HH21 ARG A 65 -4.270 -15.549 -7.779 1.00 23.02 H new ATOM 0 HH22 ARG A 65 -3.250 -15.111 -9.153 1.00 23.02 H new ATOM 1074 N ALA A 66 -5.370 -8.191 -1.944 1.00 44.12 N ATOM 1075 CA ALA A 66 -4.925 -7.035 -1.140 1.00 52.41 C ATOM 1076 C ALA A 66 -5.644 -6.962 0.214 1.00 71.43 C ATOM 1077 O ALA A 66 -5.032 -6.601 1.207 1.00 54.35 O ATOM 1078 CB ALA A 66 -5.117 -5.734 -1.928 1.00 63.34 C ATOM 0 H ALA A 66 -5.885 -7.927 -2.784 1.00 44.12 H new ATOM 0 HA ALA A 66 -3.864 -7.169 -0.931 1.00 52.41 H new ATOM 0 HB1 ALA A 66 -4.785 -4.890 -1.323 1.00 63.34 H new ATOM 0 HB2 ALA A 66 -4.531 -5.775 -2.846 1.00 63.34 H new ATOM 0 HB3 ALA A 66 -6.171 -5.611 -2.175 1.00 63.34 H new ATOM 1084 N LYS A 67 -6.948 -7.312 0.234 1.00 32.23 N ATOM 1085 CA LYS A 67 -7.753 -7.362 1.485 1.00 10.02 C ATOM 1086 C LYS A 67 -7.299 -8.514 2.404 1.00 45.43 C ATOM 1087 O LYS A 67 -7.481 -8.437 3.620 1.00 5.33 O ATOM 1088 CB LYS A 67 -9.276 -7.482 1.178 1.00 53.52 C ATOM 1089 CG LYS A 67 -9.627 -8.593 0.163 1.00 51.33 C ATOM 1090 CD LYS A 67 -11.131 -8.960 0.080 1.00 44.14 C ATOM 1091 CE LYS A 67 -11.540 -9.996 1.141 1.00 4.05 C ATOM 1092 NZ LYS A 67 -10.774 -11.269 1.008 1.00 11.31 N ATOM 0 H LYS A 67 -7.472 -7.566 -0.603 1.00 32.23 H new ATOM 0 HA LYS A 67 -7.584 -6.422 2.010 1.00 10.02 H new ATOM 0 HB2 LYS A 67 -9.810 -7.673 2.109 1.00 53.52 H new ATOM 0 HB3 LYS A 67 -9.635 -6.527 0.794 1.00 53.52 H new ATOM 0 HG2 LYS A 67 -9.291 -8.279 -0.825 1.00 51.33 H new ATOM 0 HG3 LYS A 67 -9.064 -9.490 0.421 1.00 51.33 H new ATOM 0 HD2 LYS A 67 -11.730 -8.058 0.207 1.00 44.14 H new ATOM 0 HD3 LYS A 67 -11.352 -9.353 -0.912 1.00 44.14 H new ATOM 0 HE2 LYS A 67 -11.379 -9.579 2.135 1.00 4.05 H new ATOM 0 HE3 LYS A 67 -12.606 -10.204 1.052 1.00 4.05 H new ATOM 0 HZ1 LYS A 67 -11.252 -12.020 1.546 1.00 11.31 H new ATOM 0 HZ2 LYS A 67 -10.723 -11.540 0.005 1.00 11.31 H new ATOM 0 HZ3 LYS A 67 -9.812 -11.136 1.380 1.00 11.31 H new ATOM 1106 N ASP A 68 -6.760 -9.598 1.811 1.00 14.43 N ATOM 1107 CA ASP A 68 -6.176 -10.728 2.575 1.00 55.31 C ATOM 1108 C ASP A 68 -4.789 -10.373 3.139 1.00 74.12 C ATOM 1109 O ASP A 68 -4.442 -10.794 4.245 1.00 71.12 O ATOM 1110 CB ASP A 68 -6.113 -12.018 1.714 1.00 42.11 C ATOM 1111 CG ASP A 68 -7.487 -12.697 1.583 1.00 14.51 C ATOM 1112 OD1 ASP A 68 -7.854 -13.501 2.470 1.00 34.31 O ATOM 1113 OD2 ASP A 68 -8.217 -12.421 0.620 1.00 34.23 O ATOM 0 H ASP A 68 -6.715 -9.718 0.799 1.00 14.43 H new ATOM 0 HA ASP A 68 -6.836 -10.922 3.421 1.00 55.31 H new ATOM 0 HB2 ASP A 68 -5.735 -11.772 0.722 1.00 42.11 H new ATOM 0 HB3 ASP A 68 -5.405 -12.717 2.161 1.00 42.11 H new ATOM 1118 N ILE A 69 -4.001 -9.600 2.359 1.00 53.44 N ATOM 1119 CA ILE A 69 -2.708 -9.048 2.821 1.00 13.33 C ATOM 1120 C ILE A 69 -2.977 -8.049 3.961 1.00 2.22 C ATOM 1121 O ILE A 69 -2.246 -7.995 4.948 1.00 20.21 O ATOM 1122 CB ILE A 69 -1.933 -8.302 1.668 1.00 4.25 C ATOM 1123 CG1 ILE A 69 -1.698 -9.217 0.428 1.00 5.30 C ATOM 1124 CG2 ILE A 69 -0.588 -7.744 2.181 1.00 63.11 C ATOM 1125 CD1 ILE A 69 -1.207 -8.468 -0.806 1.00 55.33 C ATOM 0 H ILE A 69 -4.240 -9.343 1.401 1.00 53.44 H new ATOM 0 HA ILE A 69 -2.089 -9.880 3.157 1.00 13.33 H new ATOM 0 HB ILE A 69 -2.563 -7.472 1.349 1.00 4.25 H new ATOM 0 HG12 ILE A 69 -0.970 -9.986 0.688 1.00 5.30 H new ATOM 0 HG13 ILE A 69 -2.629 -9.729 0.184 1.00 5.30 H new ATOM 0 HG21 ILE A 69 -0.072 -7.234 1.368 1.00 63.11 H new ATOM 0 HG22 ILE A 69 -0.772 -7.040 2.992 1.00 63.11 H new ATOM 0 HG23 ILE A 69 0.031 -8.564 2.546 1.00 63.11 H new ATOM 0 HD11 ILE A 69 -1.067 -9.171 -1.627 1.00 55.33 H new ATOM 0 HD12 ILE A 69 -1.944 -7.718 -1.093 1.00 55.33 H new ATOM 0 HD13 ILE A 69 -0.259 -7.979 -0.581 1.00 55.33 H new ATOM 1137 N ALA A 70 -4.069 -7.286 3.783 1.00 11.13 N ATOM 1138 CA ALA A 70 -4.537 -6.274 4.727 1.00 71.14 C ATOM 1139 C ALA A 70 -4.946 -6.914 6.047 1.00 34.12 C ATOM 1140 O ALA A 70 -4.558 -6.445 7.114 1.00 74.42 O ATOM 1141 CB ALA A 70 -5.716 -5.510 4.108 1.00 3.14 C ATOM 0 H ALA A 70 -4.661 -7.363 2.956 1.00 11.13 H new ATOM 0 HA ALA A 70 -3.725 -5.577 4.934 1.00 71.14 H new ATOM 0 HB1 ALA A 70 -6.068 -4.754 4.810 1.00 3.14 H new ATOM 0 HB2 ALA A 70 -5.393 -5.027 3.186 1.00 3.14 H new ATOM 0 HB3 ALA A 70 -6.526 -6.206 3.888 1.00 3.14 H new ATOM 1147 N GLU A 71 -5.720 -8.006 5.952 1.00 21.55 N ATOM 1148 CA GLU A 71 -6.195 -8.731 7.125 1.00 13.20 C ATOM 1149 C GLU A 71 -5.013 -9.336 7.899 1.00 41.21 C ATOM 1150 O GLU A 71 -4.933 -9.181 9.111 1.00 62.03 O ATOM 1151 CB GLU A 71 -7.215 -9.818 6.718 1.00 65.41 C ATOM 1152 CG GLU A 71 -7.882 -10.531 7.914 1.00 50.55 C ATOM 1153 CD GLU A 71 -8.629 -9.569 8.865 1.00 61.14 C ATOM 1154 OE1 GLU A 71 -9.773 -9.165 8.548 1.00 55.11 O ATOM 1155 OE2 GLU A 71 -8.090 -9.226 9.944 1.00 53.11 O ATOM 0 H GLU A 71 -6.028 -8.403 5.065 1.00 21.55 H new ATOM 0 HA GLU A 71 -6.704 -8.029 7.785 1.00 13.20 H new ATOM 0 HB2 GLU A 71 -7.990 -9.362 6.101 1.00 65.41 H new ATOM 0 HB3 GLU A 71 -6.712 -10.561 6.100 1.00 65.41 H new ATOM 0 HG2 GLU A 71 -8.584 -11.275 7.538 1.00 50.55 H new ATOM 0 HG3 GLU A 71 -7.120 -11.068 8.478 1.00 50.55 H new ATOM 1162 N TYR A 72 -4.075 -9.969 7.161 1.00 55.51 N ATOM 1163 CA TYR A 72 -2.857 -10.565 7.742 1.00 5.02 C ATOM 1164 C TYR A 72 -2.048 -9.496 8.499 1.00 15.44 C ATOM 1165 O TYR A 72 -1.718 -9.678 9.665 1.00 23.13 O ATOM 1166 CB TYR A 72 -1.983 -11.223 6.630 1.00 33.44 C ATOM 1167 CG TYR A 72 -0.641 -11.801 7.128 1.00 13.34 C ATOM 1168 CD1 TYR A 72 -0.587 -13.006 7.836 1.00 45.54 C ATOM 1169 CD2 TYR A 72 0.565 -11.118 6.922 1.00 23.15 C ATOM 1170 CE1 TYR A 72 0.617 -13.506 8.308 1.00 61.14 C ATOM 1171 CE2 TYR A 72 1.765 -11.620 7.388 1.00 53.04 C ATOM 1172 CZ TYR A 72 1.785 -12.808 8.089 1.00 53.02 C ATOM 1173 OH TYR A 72 2.979 -13.307 8.574 1.00 2.52 O ATOM 0 H TYR A 72 -4.143 -10.080 6.149 1.00 55.51 H new ATOM 0 HA TYR A 72 -3.155 -11.341 8.447 1.00 5.02 H new ATOM 0 HB2 TYR A 72 -2.556 -12.022 6.161 1.00 33.44 H new ATOM 0 HB3 TYR A 72 -1.780 -10.481 5.858 1.00 33.44 H new ATOM 0 HD1 TYR A 72 -1.498 -13.556 8.018 1.00 45.54 H new ATOM 0 HD2 TYR A 72 0.556 -10.179 6.388 1.00 23.15 H new ATOM 0 HE1 TYR A 72 0.640 -14.442 8.847 1.00 61.14 H new ATOM 0 HE2 TYR A 72 2.684 -11.084 7.204 1.00 53.04 H new ATOM 0 HH TYR A 72 3.709 -12.698 8.335 1.00 2.52 H new ATOM 1183 N ALA A 73 -1.803 -8.367 7.813 1.00 12.21 N ATOM 1184 CA ALA A 73 -1.025 -7.226 8.328 1.00 55.23 C ATOM 1185 C ALA A 73 -1.664 -6.591 9.581 1.00 24.02 C ATOM 1186 O ALA A 73 -0.962 -6.099 10.469 1.00 23.24 O ATOM 1187 CB ALA A 73 -0.890 -6.182 7.219 1.00 51.00 C ATOM 0 H ALA A 73 -2.147 -8.218 6.864 1.00 12.21 H new ATOM 0 HA ALA A 73 -0.044 -7.594 8.630 1.00 55.23 H new ATOM 0 HB1 ALA A 73 -0.316 -5.332 7.588 1.00 51.00 H new ATOM 0 HB2 ALA A 73 -0.377 -6.623 6.364 1.00 51.00 H new ATOM 0 HB3 ALA A 73 -1.881 -5.846 6.913 1.00 51.00 H new ATOM 1193 N GLN A 74 -3.003 -6.607 9.620 1.00 35.33 N ATOM 1194 CA GLN A 74 -3.794 -6.071 10.740 1.00 4.52 C ATOM 1195 C GLN A 74 -3.699 -7.020 11.957 1.00 43.23 C ATOM 1196 O GLN A 74 -3.615 -6.570 13.105 1.00 2.31 O ATOM 1197 CB GLN A 74 -5.257 -5.878 10.272 1.00 22.34 C ATOM 1198 CG GLN A 74 -6.180 -5.184 11.280 1.00 45.43 C ATOM 1199 CD GLN A 74 -7.549 -4.860 10.683 1.00 2.42 C ATOM 1200 OE1 GLN A 74 -7.770 -3.764 10.151 1.00 43.41 O ATOM 1201 NE2 GLN A 74 -8.455 -5.815 10.722 1.00 42.33 N ATOM 0 H GLN A 74 -3.574 -6.995 8.869 1.00 35.33 H new ATOM 0 HA GLN A 74 -3.401 -5.104 11.053 1.00 4.52 H new ATOM 0 HB2 GLN A 74 -5.253 -5.298 9.349 1.00 22.34 H new ATOM 0 HB3 GLN A 74 -5.677 -6.855 10.033 1.00 22.34 H new ATOM 0 HG2 GLN A 74 -6.309 -5.824 12.153 1.00 45.43 H new ATOM 0 HG3 GLN A 74 -5.710 -4.264 11.627 1.00 45.43 H new ATOM 0 HE21 GLN A 74 -8.238 -6.706 11.169 1.00 42.33 H new ATOM 0 HE22 GLN A 74 -9.374 -5.664 10.305 1.00 42.33 H new ATOM 1210 N LYS A 75 -3.667 -8.339 11.664 1.00 21.53 N ATOM 1211 CA LYS A 75 -3.471 -9.416 12.669 1.00 0.42 C ATOM 1212 C LYS A 75 -2.016 -9.421 13.197 1.00 63.43 C ATOM 1213 O LYS A 75 -1.752 -9.892 14.310 1.00 25.15 O ATOM 1214 CB LYS A 75 -3.819 -10.788 12.042 1.00 5.24 C ATOM 1215 CG LYS A 75 -5.294 -10.933 11.592 1.00 54.21 C ATOM 1216 CD LYS A 75 -5.554 -12.259 10.844 1.00 41.34 C ATOM 1217 CE LYS A 75 -5.318 -13.484 11.735 1.00 42.44 C ATOM 1218 NZ LYS A 75 -6.334 -13.589 12.820 1.00 55.11 N ATOM 0 H LYS A 75 -3.777 -8.693 10.714 1.00 21.53 H new ATOM 0 HA LYS A 75 -4.136 -9.228 13.512 1.00 0.42 H new ATOM 0 HB2 LYS A 75 -3.172 -10.954 11.181 1.00 5.24 H new ATOM 0 HB3 LYS A 75 -3.594 -11.571 12.766 1.00 5.24 H new ATOM 0 HG2 LYS A 75 -5.944 -10.878 12.465 1.00 54.21 H new ATOM 0 HG3 LYS A 75 -5.557 -10.096 10.945 1.00 54.21 H new ATOM 0 HD2 LYS A 75 -6.580 -12.272 10.477 1.00 41.34 H new ATOM 0 HD3 LYS A 75 -4.903 -12.316 9.972 1.00 41.34 H new ATOM 0 HE2 LYS A 75 -5.345 -14.387 11.125 1.00 42.44 H new ATOM 0 HE3 LYS A 75 -4.322 -13.426 12.175 1.00 42.44 H new ATOM 0 HZ1 LYS A 75 -6.189 -14.474 13.347 1.00 55.11 H new ATOM 0 HZ2 LYS A 75 -6.235 -12.781 13.467 1.00 55.11 H new ATOM 0 HZ3 LYS A 75 -7.287 -13.585 12.404 1.00 55.11 H new ATOM 1232 N GLU A 76 -1.086 -8.894 12.374 1.00 53.10 N ATOM 1233 CA GLU A 76 0.336 -8.700 12.739 1.00 55.24 C ATOM 1234 C GLU A 76 0.507 -7.532 13.740 1.00 60.44 C ATOM 1235 O GLU A 76 1.576 -7.377 14.348 1.00 51.52 O ATOM 1236 CB GLU A 76 1.172 -8.434 11.455 1.00 43.11 C ATOM 1237 CG GLU A 76 1.267 -9.618 10.470 1.00 2.03 C ATOM 1238 CD GLU A 76 2.019 -10.845 11.014 1.00 62.13 C ATOM 1239 OE1 GLU A 76 3.256 -10.924 10.847 1.00 21.11 O ATOM 1240 OE2 GLU A 76 1.381 -11.743 11.604 1.00 62.32 O ATOM 0 H GLU A 76 -1.302 -8.587 11.426 1.00 53.10 H new ATOM 0 HA GLU A 76 0.693 -9.608 13.225 1.00 55.24 H new ATOM 0 HB2 GLU A 76 0.740 -7.581 10.931 1.00 43.11 H new ATOM 0 HB3 GLU A 76 2.181 -8.148 11.752 1.00 43.11 H new ATOM 0 HG2 GLU A 76 0.259 -9.922 10.189 1.00 2.03 H new ATOM 0 HG3 GLU A 76 1.763 -9.278 9.561 1.00 2.03 H new ATOM 1247 N GLY A 77 -0.553 -6.719 13.894 1.00 32.30 N ATOM 1248 CA GLY A 77 -0.553 -5.580 14.817 1.00 33.54 C ATOM 1249 C GLY A 77 -0.046 -4.304 14.166 1.00 24.33 C ATOM 1250 O GLY A 77 0.404 -3.383 14.856 1.00 31.45 O ATOM 0 H GLY A 77 -1.428 -6.836 13.383 1.00 32.30 H new ATOM 0 HA2 GLY A 77 -1.565 -5.417 15.188 1.00 33.54 H new ATOM 0 HA3 GLY A 77 0.069 -5.816 15.680 1.00 33.54 H new ATOM 1254 N LEU A 78 -0.107 -4.261 12.819 1.00 71.33 N ATOM 1255 CA LEU A 78 0.341 -3.107 12.022 1.00 11.54 C ATOM 1256 C LEU A 78 -0.870 -2.345 11.460 1.00 53.55 C ATOM 1257 O LEU A 78 -1.966 -2.910 11.333 1.00 71.23 O ATOM 1258 CB LEU A 78 1.269 -3.577 10.861 1.00 70.13 C ATOM 1259 CG LEU A 78 2.513 -4.422 11.280 1.00 54.13 C ATOM 1260 CD1 LEU A 78 3.381 -4.789 10.061 1.00 62.14 C ATOM 1261 CD2 LEU A 78 3.349 -3.701 12.356 1.00 23.13 C ATOM 0 H LEU A 78 -0.470 -5.029 12.255 1.00 71.33 H new ATOM 0 HA LEU A 78 0.906 -2.436 12.669 1.00 11.54 H new ATOM 0 HB2 LEU A 78 0.674 -4.165 10.162 1.00 70.13 H new ATOM 0 HB3 LEU A 78 1.617 -2.696 10.321 1.00 70.13 H new ATOM 0 HG LEU A 78 2.141 -5.350 11.715 1.00 54.13 H new ATOM 0 HD11 LEU A 78 4.238 -5.377 10.389 1.00 62.14 H new ATOM 0 HD12 LEU A 78 2.789 -5.372 9.355 1.00 62.14 H new ATOM 0 HD13 LEU A 78 3.730 -3.878 9.575 1.00 62.14 H new ATOM 0 HD21 LEU A 78 4.207 -4.318 12.624 1.00 23.13 H new ATOM 0 HD22 LEU A 78 3.697 -2.745 11.966 1.00 23.13 H new ATOM 0 HD23 LEU A 78 2.735 -3.530 13.240 1.00 23.13 H new ATOM 1273 N ARG A 79 -0.655 -1.059 11.122 1.00 45.25 N ATOM 1274 CA ARG A 79 -1.694 -0.206 10.522 1.00 74.45 C ATOM 1275 C ARG A 79 -1.720 -0.475 9.017 1.00 52.14 C ATOM 1276 O ARG A 79 -0.682 -0.384 8.359 1.00 64.10 O ATOM 1277 CB ARG A 79 -1.445 1.318 10.763 1.00 3.24 C ATOM 1278 CG ARG A 79 -1.317 1.772 12.241 1.00 43.45 C ATOM 1279 CD ARG A 79 0.040 1.413 12.873 1.00 41.43 C ATOM 1280 NE ARG A 79 0.242 2.037 14.186 1.00 2.24 N ATOM 1281 CZ ARG A 79 1.439 2.359 14.697 1.00 4.43 C ATOM 1282 NH1 ARG A 79 2.557 2.117 14.009 1.00 63.00 N ATOM 1283 NH2 ARG A 79 1.513 2.900 15.897 1.00 1.41 N ATOM 0 H ARG A 79 0.239 -0.586 11.257 1.00 45.25 H new ATOM 0 HA ARG A 79 -2.644 -0.452 10.995 1.00 74.45 H new ATOM 0 HB2 ARG A 79 -0.533 1.602 10.238 1.00 3.24 H new ATOM 0 HB3 ARG A 79 -2.263 1.874 10.305 1.00 3.24 H new ATOM 0 HG2 ARG A 79 -1.462 2.851 12.296 1.00 43.45 H new ATOM 0 HG3 ARG A 79 -2.115 1.313 12.825 1.00 43.45 H new ATOM 0 HD2 ARG A 79 0.112 0.330 12.976 1.00 41.43 H new ATOM 0 HD3 ARG A 79 0.841 1.723 12.202 1.00 41.43 H new ATOM 0 HE ARG A 79 -0.585 2.240 14.748 1.00 2.24 H new ATOM 0 HH11 ARG A 79 2.505 1.684 13.087 1.00 63.00 H new ATOM 0 HH12 ARG A 79 3.464 2.365 14.405 1.00 63.00 H new ATOM 0 HH21 ARG A 79 0.662 3.072 16.432 1.00 1.41 H new ATOM 0 HH22 ARG A 79 2.421 3.147 16.290 1.00 1.41 H new ATOM 1297 N VAL A 80 -2.887 -0.816 8.482 1.00 70.02 N ATOM 1298 CA VAL A 80 -3.058 -1.084 7.055 1.00 1.23 C ATOM 1299 C VAL A 80 -3.557 0.174 6.348 1.00 73.11 C ATOM 1300 O VAL A 80 -4.648 0.665 6.644 1.00 2.44 O ATOM 1301 CB VAL A 80 -4.070 -2.249 6.816 1.00 4.11 C ATOM 1302 CG1 VAL A 80 -4.227 -2.551 5.310 1.00 10.34 C ATOM 1303 CG2 VAL A 80 -3.657 -3.501 7.616 1.00 75.24 C ATOM 0 H VAL A 80 -3.745 -0.915 9.025 1.00 70.02 H new ATOM 0 HA VAL A 80 -2.090 -1.379 6.649 1.00 1.23 H new ATOM 0 HB VAL A 80 -5.048 -1.935 7.181 1.00 4.11 H new ATOM 0 HG11 VAL A 80 -4.938 -3.366 5.175 1.00 10.34 H new ATOM 0 HG12 VAL A 80 -4.593 -1.662 4.797 1.00 10.34 H new ATOM 0 HG13 VAL A 80 -3.261 -2.838 4.894 1.00 10.34 H new ATOM 0 HG21 VAL A 80 -4.375 -4.301 7.436 1.00 75.24 H new ATOM 0 HG22 VAL A 80 -2.666 -3.825 7.299 1.00 75.24 H new ATOM 0 HG23 VAL A 80 -3.638 -3.263 8.680 1.00 75.24 H new ATOM 1313 N ILE A 81 -2.727 0.712 5.449 1.00 71.12 N ATOM 1314 CA ILE A 81 -3.079 1.843 4.587 1.00 20.14 C ATOM 1315 C ILE A 81 -3.141 1.333 3.133 1.00 42.13 C ATOM 1316 O ILE A 81 -2.142 0.882 2.595 1.00 41.31 O ATOM 1317 CB ILE A 81 -2.062 3.056 4.769 1.00 42.23 C ATOM 1318 CG1 ILE A 81 -2.449 3.970 5.996 1.00 24.50 C ATOM 1319 CG2 ILE A 81 -1.938 3.911 3.481 1.00 50.23 C ATOM 1320 CD1 ILE A 81 -2.370 3.326 7.377 1.00 43.23 C ATOM 0 H ILE A 81 -1.778 0.369 5.298 1.00 71.12 H new ATOM 0 HA ILE A 81 -4.055 2.240 4.867 1.00 20.14 H new ATOM 0 HB ILE A 81 -1.089 2.609 4.972 1.00 42.23 H new ATOM 0 HG12 ILE A 81 -1.797 4.844 5.989 1.00 24.50 H new ATOM 0 HG13 ILE A 81 -3.467 4.330 5.845 1.00 24.50 H new ATOM 0 HG21 ILE A 81 -1.235 4.726 3.652 1.00 50.23 H new ATOM 0 HG22 ILE A 81 -1.579 3.287 2.663 1.00 50.23 H new ATOM 0 HG23 ILE A 81 -2.914 4.322 3.222 1.00 50.23 H new ATOM 0 HD11 ILE A 81 -2.659 4.054 8.135 1.00 43.23 H new ATOM 0 HD12 ILE A 81 -3.045 2.471 7.419 1.00 43.23 H new ATOM 0 HD13 ILE A 81 -1.349 2.992 7.565 1.00 43.23 H new ATOM 1332 N VAL A 82 -4.339 1.360 2.530 1.00 11.41 N ATOM 1333 CA VAL A 82 -4.567 0.907 1.143 1.00 14.33 C ATOM 1334 C VAL A 82 -4.699 2.139 0.227 1.00 62.41 C ATOM 1335 O VAL A 82 -5.611 2.930 0.401 1.00 34.55 O ATOM 1336 CB VAL A 82 -5.872 0.013 1.053 1.00 44.23 C ATOM 1337 CG1 VAL A 82 -6.156 -0.448 -0.400 1.00 1.51 C ATOM 1338 CG2 VAL A 82 -5.788 -1.195 2.022 1.00 45.31 C ATOM 0 H VAL A 82 -5.184 1.698 2.991 1.00 11.41 H new ATOM 0 HA VAL A 82 -3.721 0.300 0.820 1.00 14.33 H new ATOM 0 HB VAL A 82 -6.713 0.633 1.362 1.00 44.23 H new ATOM 0 HG11 VAL A 82 -7.059 -1.058 -0.418 1.00 1.51 H new ATOM 0 HG12 VAL A 82 -6.295 0.425 -1.038 1.00 1.51 H new ATOM 0 HG13 VAL A 82 -5.314 -1.035 -0.767 1.00 1.51 H new ATOM 0 HG21 VAL A 82 -6.697 -1.791 1.940 1.00 45.31 H new ATOM 0 HG22 VAL A 82 -4.926 -1.810 1.763 1.00 45.31 H new ATOM 0 HG23 VAL A 82 -5.682 -0.834 3.045 1.00 45.31 H new ATOM 1348 N ILE A 83 -3.757 2.332 -0.709 1.00 33.22 N ATOM 1349 CA ILE A 83 -3.771 3.481 -1.639 1.00 24.12 C ATOM 1350 C ILE A 83 -4.129 3.020 -3.052 1.00 21.44 C ATOM 1351 O ILE A 83 -3.345 2.337 -3.710 1.00 23.32 O ATOM 1352 CB ILE A 83 -2.388 4.224 -1.644 1.00 64.55 C ATOM 1353 CG1 ILE A 83 -2.029 4.641 -0.191 1.00 61.12 C ATOM 1354 CG2 ILE A 83 -2.392 5.448 -2.607 1.00 54.30 C ATOM 1355 CD1 ILE A 83 -0.683 5.284 -0.039 1.00 41.14 C ATOM 0 H ILE A 83 -2.967 1.702 -0.845 1.00 33.22 H new ATOM 0 HA ILE A 83 -4.531 4.182 -1.294 1.00 24.12 H new ATOM 0 HB ILE A 83 -1.624 3.543 -2.019 1.00 64.55 H new ATOM 0 HG12 ILE A 83 -2.790 5.332 0.173 1.00 61.12 H new ATOM 0 HG13 ILE A 83 -2.069 3.758 0.447 1.00 61.12 H new ATOM 0 HG21 ILE A 83 -1.417 5.934 -2.581 1.00 54.30 H new ATOM 0 HG22 ILE A 83 -2.603 5.112 -3.622 1.00 54.30 H new ATOM 0 HG23 ILE A 83 -3.159 6.156 -2.293 1.00 54.30 H new ATOM 0 HD11 ILE A 83 -0.519 5.541 1.007 1.00 41.14 H new ATOM 0 HD12 ILE A 83 0.091 4.590 -0.368 1.00 41.14 H new ATOM 0 HD13 ILE A 83 -0.641 6.189 -0.646 1.00 41.14 H new ATOM 1367 N ILE A 84 -5.329 3.382 -3.499 1.00 64.12 N ATOM 1368 CA ILE A 84 -5.804 3.084 -4.853 1.00 44.23 C ATOM 1369 C ILE A 84 -5.430 4.261 -5.770 1.00 53.33 C ATOM 1370 O ILE A 84 -5.764 5.417 -5.472 1.00 25.12 O ATOM 1371 CB ILE A 84 -7.360 2.865 -4.869 1.00 63.13 C ATOM 1372 CG1 ILE A 84 -7.773 1.877 -3.736 1.00 43.22 C ATOM 1373 CG2 ILE A 84 -7.839 2.356 -6.256 1.00 63.20 C ATOM 1374 CD1 ILE A 84 -9.258 1.793 -3.502 1.00 13.24 C ATOM 0 H ILE A 84 -6.005 3.893 -2.931 1.00 64.12 H new ATOM 0 HA ILE A 84 -5.335 2.165 -5.205 1.00 44.23 H new ATOM 0 HB ILE A 84 -7.846 3.824 -4.687 1.00 63.13 H new ATOM 0 HG12 ILE A 84 -7.398 0.883 -3.981 1.00 43.22 H new ATOM 0 HG13 ILE A 84 -7.287 2.181 -2.809 1.00 43.22 H new ATOM 0 HG21 ILE A 84 -8.919 2.213 -6.238 1.00 63.20 H new ATOM 0 HG22 ILE A 84 -7.583 3.089 -7.021 1.00 63.20 H new ATOM 0 HG23 ILE A 84 -7.352 1.408 -6.484 1.00 63.20 H new ATOM 0 HD11 ILE A 84 -9.460 1.085 -2.699 1.00 13.24 H new ATOM 0 HD12 ILE A 84 -9.639 2.776 -3.224 1.00 13.24 H new ATOM 0 HD13 ILE A 84 -9.752 1.458 -4.414 1.00 13.24 H new ATOM 1386 N VAL A 85 -4.700 3.963 -6.852 1.00 24.23 N ATOM 1387 CA VAL A 85 -4.289 4.947 -7.855 1.00 20.44 C ATOM 1388 C VAL A 85 -4.940 4.569 -9.191 1.00 34.23 C ATOM 1389 O VAL A 85 -4.489 3.633 -9.866 1.00 20.42 O ATOM 1390 CB VAL A 85 -2.722 5.006 -8.020 1.00 31.52 C ATOM 1391 CG1 VAL A 85 -2.308 6.266 -8.816 1.00 10.22 C ATOM 1392 CG2 VAL A 85 -2.001 4.914 -6.649 1.00 64.34 C ATOM 0 H VAL A 85 -4.375 3.018 -7.056 1.00 24.23 H new ATOM 0 HA VAL A 85 -4.613 5.935 -7.529 1.00 20.44 H new ATOM 0 HB VAL A 85 -2.405 4.135 -8.594 1.00 31.52 H new ATOM 0 HG11 VAL A 85 -1.223 6.290 -8.920 1.00 10.22 H new ATOM 0 HG12 VAL A 85 -2.767 6.239 -9.804 1.00 10.22 H new ATOM 0 HG13 VAL A 85 -2.642 7.158 -8.285 1.00 10.22 H new ATOM 0 HG21 VAL A 85 -0.923 4.958 -6.801 1.00 64.34 H new ATOM 0 HG22 VAL A 85 -2.312 5.746 -6.018 1.00 64.34 H new ATOM 0 HG23 VAL A 85 -2.261 3.973 -6.164 1.00 64.34 H new ATOM 1402 N SER A 86 -6.018 5.273 -9.536 1.00 24.43 N ATOM 1403 CA SER A 86 -6.773 5.072 -10.776 1.00 41.33 C ATOM 1404 C SER A 86 -7.409 6.412 -11.170 1.00 52.52 C ATOM 1405 O SER A 86 -7.905 7.139 -10.305 1.00 70.23 O ATOM 1406 CB SER A 86 -7.883 3.988 -10.597 1.00 24.30 C ATOM 1407 OG SER A 86 -7.353 2.708 -10.256 1.00 43.24 O ATOM 0 H SER A 86 -6.400 6.015 -8.950 1.00 24.43 H new ATOM 0 HA SER A 86 -6.097 4.722 -11.556 1.00 41.33 H new ATOM 0 HB2 SER A 86 -8.576 4.309 -9.819 1.00 24.30 H new ATOM 0 HB3 SER A 86 -8.456 3.905 -11.520 1.00 24.30 H new ATOM 0 HG SER A 86 -8.087 2.067 -10.154 1.00 43.24 H new ATOM 1413 N GLN A 87 -7.390 6.742 -12.474 1.00 15.15 N ATOM 1414 CA GLN A 87 -8.062 7.951 -13.004 1.00 42.34 C ATOM 1415 C GLN A 87 -9.595 7.826 -12.873 1.00 1.12 C ATOM 1416 O GLN A 87 -10.306 8.820 -12.898 1.00 65.42 O ATOM 1417 CB GLN A 87 -7.664 8.207 -14.488 1.00 74.11 C ATOM 1418 CG GLN A 87 -8.216 7.175 -15.503 1.00 10.21 C ATOM 1419 CD GLN A 87 -7.920 7.496 -16.977 1.00 34.32 C ATOM 1420 OE1 GLN A 87 -7.782 6.588 -17.802 1.00 22.22 O ATOM 1421 NE2 GLN A 87 -7.854 8.777 -17.340 1.00 40.24 N ATOM 0 H GLN A 87 -6.915 6.188 -13.186 1.00 15.15 H new ATOM 0 HA GLN A 87 -7.732 8.804 -12.411 1.00 42.34 H new ATOM 0 HB2 GLN A 87 -8.013 9.199 -14.776 1.00 74.11 H new ATOM 0 HB3 GLN A 87 -6.576 8.218 -14.560 1.00 74.11 H new ATOM 0 HG2 GLN A 87 -7.798 6.196 -15.268 1.00 10.21 H new ATOM 0 HG3 GLN A 87 -9.296 7.100 -15.372 1.00 10.21 H new ATOM 0 HE21 GLN A 87 -7.971 9.512 -16.642 1.00 40.24 H new ATOM 0 HE22 GLN A 87 -7.687 9.023 -18.316 1.00 40.24 H new ATOM 1430 N ASP A 88 -10.071 6.581 -12.726 1.00 71.44 N ATOM 1431 CA ASP A 88 -11.503 6.253 -12.658 1.00 61.33 C ATOM 1432 C ASP A 88 -12.020 6.405 -11.208 1.00 11.20 C ATOM 1433 O ASP A 88 -11.570 5.679 -10.318 1.00 63.01 O ATOM 1434 CB ASP A 88 -11.701 4.796 -13.161 1.00 61.32 C ATOM 1435 CG ASP A 88 -13.175 4.442 -13.429 1.00 33.12 C ATOM 1436 OD1 ASP A 88 -13.927 4.215 -12.465 1.00 41.14 O ATOM 1437 OD2 ASP A 88 -13.586 4.399 -14.615 1.00 3.50 O ATOM 0 H ASP A 88 -9.465 5.764 -12.650 1.00 71.44 H new ATOM 0 HA ASP A 88 -12.071 6.937 -13.288 1.00 61.33 H new ATOM 0 HB2 ASP A 88 -11.128 4.654 -14.077 1.00 61.32 H new ATOM 0 HB3 ASP A 88 -11.297 4.105 -12.421 1.00 61.32 H new ATOM 1442 N GLU A 89 -12.960 7.354 -11.000 1.00 63.15 N ATOM 1443 CA GLU A 89 -13.625 7.604 -9.692 1.00 2.43 C ATOM 1444 C GLU A 89 -14.307 6.356 -9.117 1.00 34.20 C ATOM 1445 O GLU A 89 -14.187 6.085 -7.931 1.00 41.34 O ATOM 1446 CB GLU A 89 -14.681 8.750 -9.824 1.00 14.33 C ATOM 1447 CG GLU A 89 -14.114 10.158 -9.615 1.00 12.53 C ATOM 1448 CD GLU A 89 -13.684 10.436 -8.158 1.00 12.54 C ATOM 1449 OE1 GLU A 89 -14.526 10.920 -7.362 1.00 25.11 O ATOM 1450 OE2 GLU A 89 -12.512 10.189 -7.802 1.00 73.00 O ATOM 0 H GLU A 89 -13.285 7.976 -11.740 1.00 63.15 H new ATOM 0 HA GLU A 89 -12.834 7.896 -9.001 1.00 2.43 H new ATOM 0 HB2 GLU A 89 -15.135 8.697 -10.813 1.00 14.33 H new ATOM 0 HB3 GLU A 89 -15.477 8.580 -9.099 1.00 14.33 H new ATOM 0 HG2 GLU A 89 -13.256 10.297 -10.272 1.00 12.53 H new ATOM 0 HG3 GLU A 89 -14.864 10.891 -9.911 1.00 12.53 H new ATOM 1457 N GLU A 90 -15.032 5.621 -9.966 1.00 63.20 N ATOM 1458 CA GLU A 90 -15.848 4.476 -9.529 1.00 22.34 C ATOM 1459 C GLU A 90 -14.942 3.334 -9.014 1.00 31.42 C ATOM 1460 O GLU A 90 -15.314 2.608 -8.098 1.00 14.33 O ATOM 1461 CB GLU A 90 -16.773 4.018 -10.685 1.00 43.12 C ATOM 1462 CG GLU A 90 -17.632 5.162 -11.277 1.00 71.13 C ATOM 1463 CD GLU A 90 -18.535 4.718 -12.442 1.00 65.44 C ATOM 1464 OE1 GLU A 90 -18.091 4.755 -13.610 1.00 23.42 O ATOM 1465 OE2 GLU A 90 -19.692 4.328 -12.196 1.00 12.21 O ATOM 0 H GLU A 90 -15.072 5.798 -10.970 1.00 63.20 H new ATOM 0 HA GLU A 90 -16.485 4.777 -8.697 1.00 22.34 H new ATOM 0 HB2 GLU A 90 -16.163 3.584 -11.478 1.00 43.12 H new ATOM 0 HB3 GLU A 90 -17.432 3.229 -10.322 1.00 43.12 H new ATOM 0 HG2 GLU A 90 -18.254 5.584 -10.487 1.00 71.13 H new ATOM 0 HG3 GLU A 90 -16.973 5.958 -11.623 1.00 71.13 H new ATOM 1472 N ALA A 91 -13.731 3.225 -9.593 1.00 13.13 N ATOM 1473 CA ALA A 91 -12.692 2.288 -9.125 1.00 73.52 C ATOM 1474 C ALA A 91 -12.125 2.729 -7.756 1.00 74.33 C ATOM 1475 O ALA A 91 -11.897 1.894 -6.867 1.00 14.12 O ATOM 1476 CB ALA A 91 -11.569 2.188 -10.168 1.00 4.23 C ATOM 0 H ALA A 91 -13.446 3.783 -10.397 1.00 13.13 H new ATOM 0 HA ALA A 91 -13.145 1.305 -8.998 1.00 73.52 H new ATOM 0 HB1 ALA A 91 -10.806 1.494 -9.815 1.00 4.23 H new ATOM 0 HB2 ALA A 91 -11.979 1.827 -11.111 1.00 4.23 H new ATOM 0 HB3 ALA A 91 -11.124 3.171 -10.319 1.00 4.23 H new ATOM 1482 N LEU A 92 -11.925 4.058 -7.605 1.00 40.02 N ATOM 1483 CA LEU A 92 -11.368 4.664 -6.380 1.00 73.34 C ATOM 1484 C LEU A 92 -12.332 4.507 -5.185 1.00 42.21 C ATOM 1485 O LEU A 92 -11.969 3.935 -4.166 1.00 3.31 O ATOM 1486 CB LEU A 92 -11.071 6.179 -6.614 1.00 13.53 C ATOM 1487 CG LEU A 92 -9.944 6.525 -7.633 1.00 4.42 C ATOM 1488 CD1 LEU A 92 -9.809 8.056 -7.830 1.00 72.03 C ATOM 1489 CD2 LEU A 92 -8.609 5.897 -7.200 1.00 44.43 C ATOM 0 H LEU A 92 -12.146 4.739 -8.331 1.00 40.02 H new ATOM 0 HA LEU A 92 -10.441 4.141 -6.145 1.00 73.34 H new ATOM 0 HB2 LEU A 92 -11.991 6.658 -6.950 1.00 13.53 H new ATOM 0 HB3 LEU A 92 -10.811 6.626 -5.655 1.00 13.53 H new ATOM 0 HG LEU A 92 -10.221 6.099 -8.597 1.00 4.42 H new ATOM 0 HD11 LEU A 92 -9.014 8.262 -8.547 1.00 72.03 H new ATOM 0 HD12 LEU A 92 -10.750 8.459 -8.206 1.00 72.03 H new ATOM 0 HD13 LEU A 92 -9.568 8.526 -6.876 1.00 72.03 H new ATOM 0 HD21 LEU A 92 -7.836 6.151 -7.925 1.00 44.43 H new ATOM 0 HD22 LEU A 92 -8.327 6.281 -6.220 1.00 44.43 H new ATOM 0 HD23 LEU A 92 -8.716 4.814 -7.148 1.00 44.43 H new ATOM 1501 N ARG A 93 -13.577 4.973 -5.378 1.00 61.35 N ATOM 1502 CA ARG A 93 -14.567 5.193 -4.297 1.00 21.42 C ATOM 1503 C ARG A 93 -15.158 3.872 -3.778 1.00 24.14 C ATOM 1504 O ARG A 93 -15.461 3.751 -2.584 1.00 12.11 O ATOM 1505 CB ARG A 93 -15.695 6.129 -4.814 1.00 32.41 C ATOM 1506 CG ARG A 93 -15.195 7.519 -5.277 1.00 62.34 C ATOM 1507 CD ARG A 93 -16.246 8.299 -6.093 1.00 24.24 C ATOM 1508 NE ARG A 93 -17.412 8.712 -5.291 1.00 61.52 N ATOM 1509 CZ ARG A 93 -17.740 9.986 -5.002 1.00 52.55 C ATOM 1510 NH1 ARG A 93 -16.988 11.005 -5.440 1.00 23.25 N ATOM 1511 NH2 ARG A 93 -18.829 10.236 -4.291 1.00 33.33 N ATOM 0 H ARG A 93 -13.935 5.213 -6.302 1.00 61.35 H new ATOM 0 HA ARG A 93 -14.054 5.663 -3.458 1.00 21.42 H new ATOM 0 HB2 ARG A 93 -16.205 5.642 -5.645 1.00 32.41 H new ATOM 0 HB3 ARG A 93 -16.432 6.264 -4.023 1.00 32.41 H new ATOM 0 HG2 ARG A 93 -14.913 8.107 -4.403 1.00 62.34 H new ATOM 0 HG3 ARG A 93 -14.296 7.393 -5.880 1.00 62.34 H new ATOM 0 HD2 ARG A 93 -15.778 9.184 -6.525 1.00 24.24 H new ATOM 0 HD3 ARG A 93 -16.585 7.680 -6.924 1.00 24.24 H new ATOM 0 HE ARG A 93 -18.017 7.976 -4.927 1.00 61.52 H new ATOM 0 HH11 ARG A 93 -16.155 10.821 -6.000 1.00 23.25 H new ATOM 0 HH12 ARG A 93 -17.248 11.965 -5.214 1.00 23.25 H new ATOM 0 HH21 ARG A 93 -19.414 9.466 -3.966 1.00 33.33 H new ATOM 0 HH22 ARG A 93 -19.083 11.198 -4.069 1.00 33.33 H new ATOM 1525 N LYS A 94 -15.329 2.890 -4.682 1.00 61.22 N ATOM 1526 CA LYS A 94 -15.857 1.562 -4.318 1.00 23.23 C ATOM 1527 C LYS A 94 -14.804 0.755 -3.553 1.00 73.42 C ATOM 1528 O LYS A 94 -15.123 0.099 -2.564 1.00 34.35 O ATOM 1529 CB LYS A 94 -16.351 0.794 -5.565 1.00 41.24 C ATOM 1530 CG LYS A 94 -17.588 1.433 -6.229 1.00 14.24 C ATOM 1531 CD LYS A 94 -18.097 0.627 -7.442 1.00 62.43 C ATOM 1532 CE LYS A 94 -19.337 1.256 -8.085 1.00 11.25 C ATOM 1533 NZ LYS A 94 -19.876 0.418 -9.183 1.00 73.21 N ATOM 0 H LYS A 94 -15.108 2.992 -5.673 1.00 61.22 H new ATOM 0 HA LYS A 94 -16.716 1.708 -3.663 1.00 23.23 H new ATOM 0 HB2 LYS A 94 -15.543 0.742 -6.294 1.00 41.24 H new ATOM 0 HB3 LYS A 94 -16.590 -0.231 -5.280 1.00 41.24 H new ATOM 0 HG2 LYS A 94 -18.387 1.517 -5.493 1.00 14.24 H new ATOM 0 HG3 LYS A 94 -17.341 2.445 -6.549 1.00 14.24 H new ATOM 0 HD2 LYS A 94 -17.303 0.555 -8.185 1.00 62.43 H new ATOM 0 HD3 LYS A 94 -18.331 -0.390 -7.126 1.00 62.43 H new ATOM 0 HE2 LYS A 94 -20.106 1.399 -7.326 1.00 11.25 H new ATOM 0 HE3 LYS A 94 -19.084 2.243 -8.472 1.00 11.25 H new ATOM 0 HZ1 LYS A 94 -20.714 0.878 -9.592 1.00 73.21 H new ATOM 0 HZ2 LYS A 94 -19.151 0.302 -9.919 1.00 73.21 H new ATOM 0 HZ3 LYS A 94 -20.142 -0.515 -8.809 1.00 73.21 H new ATOM 1547 N GLY A 95 -13.546 0.834 -4.008 1.00 72.10 N ATOM 1548 CA GLY A 95 -12.432 0.229 -3.281 1.00 53.34 C ATOM 1549 C GLY A 95 -12.176 0.927 -1.944 1.00 13.31 C ATOM 1550 O GLY A 95 -11.797 0.278 -0.957 1.00 71.45 O ATOM 0 H GLY A 95 -13.280 1.309 -4.871 1.00 72.10 H new ATOM 0 HA2 GLY A 95 -12.644 -0.826 -3.105 1.00 53.34 H new ATOM 0 HA3 GLY A 95 -11.531 0.276 -3.893 1.00 53.34 H new ATOM 1554 N TYR A 96 -12.399 2.263 -1.938 1.00 22.32 N ATOM 1555 CA TYR A 96 -12.182 3.140 -0.773 1.00 14.42 C ATOM 1556 C TYR A 96 -13.062 2.699 0.382 1.00 44.12 C ATOM 1557 O TYR A 96 -12.561 2.263 1.409 1.00 1.03 O ATOM 1558 CB TYR A 96 -12.493 4.618 -1.164 1.00 23.20 C ATOM 1559 CG TYR A 96 -12.400 5.679 -0.050 1.00 65.34 C ATOM 1560 CD1 TYR A 96 -11.188 5.978 0.576 1.00 25.21 C ATOM 1561 CD2 TYR A 96 -13.528 6.393 0.364 1.00 70.42 C ATOM 1562 CE1 TYR A 96 -11.110 6.941 1.567 1.00 34.34 C ATOM 1563 CE2 TYR A 96 -13.452 7.358 1.355 1.00 11.20 C ATOM 1564 CZ TYR A 96 -12.243 7.628 1.954 1.00 45.41 C ATOM 1565 OH TYR A 96 -12.163 8.585 2.947 1.00 2.12 O ATOM 0 H TYR A 96 -12.740 2.765 -2.758 1.00 22.32 H new ATOM 0 HA TYR A 96 -11.141 3.070 -0.459 1.00 14.42 H new ATOM 0 HB2 TYR A 96 -11.809 4.907 -1.962 1.00 23.20 H new ATOM 0 HB3 TYR A 96 -13.500 4.652 -1.579 1.00 23.20 H new ATOM 0 HD1 TYR A 96 -10.295 5.448 0.281 1.00 25.21 H new ATOM 0 HD2 TYR A 96 -14.481 6.188 -0.100 1.00 70.42 H new ATOM 0 HE1 TYR A 96 -10.162 7.155 2.038 1.00 34.34 H new ATOM 0 HE2 TYR A 96 -14.338 7.896 1.656 1.00 11.20 H new ATOM 0 HH TYR A 96 -13.049 8.974 3.098 1.00 2.12 H new ATOM 1575 N GLU A 97 -14.371 2.714 0.137 1.00 13.53 N ATOM 1576 CA GLU A 97 -15.373 2.415 1.158 1.00 3.45 C ATOM 1577 C GLU A 97 -15.358 0.931 1.556 1.00 21.25 C ATOM 1578 O GLU A 97 -15.643 0.605 2.712 1.00 23.03 O ATOM 1579 CB GLU A 97 -16.770 2.866 0.657 1.00 74.44 C ATOM 1580 CG GLU A 97 -16.920 4.398 0.496 1.00 22.15 C ATOM 1581 CD GLU A 97 -16.970 5.157 1.844 1.00 43.31 C ATOM 1582 OE1 GLU A 97 -15.910 5.344 2.487 1.00 64.42 O ATOM 1583 OE2 GLU A 97 -18.077 5.562 2.273 1.00 3.24 O ATOM 0 H GLU A 97 -14.767 2.934 -0.777 1.00 13.53 H new ATOM 0 HA GLU A 97 -15.130 2.973 2.062 1.00 3.45 H new ATOM 0 HB2 GLU A 97 -16.971 2.389 -0.302 1.00 74.44 H new ATOM 0 HB3 GLU A 97 -17.527 2.509 1.355 1.00 74.44 H new ATOM 0 HG2 GLU A 97 -16.086 4.777 -0.095 1.00 22.15 H new ATOM 0 HG3 GLU A 97 -17.830 4.609 -0.065 1.00 22.15 H new ATOM 1590 N ASP A 98 -15.003 0.049 0.593 1.00 34.41 N ATOM 1591 CA ASP A 98 -14.970 -1.413 0.814 1.00 3.32 C ATOM 1592 C ASP A 98 -13.924 -1.798 1.872 1.00 52.42 C ATOM 1593 O ASP A 98 -14.247 -2.474 2.836 1.00 73.13 O ATOM 1594 CB ASP A 98 -14.700 -2.177 -0.510 1.00 63.10 C ATOM 1595 CG ASP A 98 -14.701 -3.711 -0.338 1.00 12.15 C ATOM 1596 OD1 ASP A 98 -15.789 -4.296 -0.134 1.00 72.33 O ATOM 1597 OD2 ASP A 98 -13.618 -4.345 -0.423 1.00 42.20 O ATOM 0 H ASP A 98 -14.734 0.329 -0.350 1.00 34.41 H new ATOM 0 HA ASP A 98 -15.953 -1.703 1.185 1.00 3.32 H new ATOM 0 HB2 ASP A 98 -15.458 -1.900 -1.243 1.00 63.10 H new ATOM 0 HB3 ASP A 98 -13.737 -1.864 -0.913 1.00 63.10 H new ATOM 1602 N LYS A 99 -12.675 -1.340 1.694 1.00 13.30 N ATOM 1603 CA LYS A 99 -11.571 -1.663 2.630 1.00 53.45 C ATOM 1604 C LYS A 99 -11.669 -0.807 3.923 1.00 61.33 C ATOM 1605 O LYS A 99 -11.304 -1.276 5.005 1.00 35.31 O ATOM 1606 CB LYS A 99 -10.174 -1.489 1.942 1.00 41.31 C ATOM 1607 CG LYS A 99 -9.744 -2.630 0.980 1.00 4.14 C ATOM 1608 CD LYS A 99 -10.649 -2.757 -0.264 1.00 50.20 C ATOM 1609 CE LYS A 99 -10.259 -3.929 -1.182 1.00 1.54 C ATOM 1610 NZ LYS A 99 -11.250 -4.104 -2.278 1.00 71.22 N ATOM 0 H LYS A 99 -12.398 -0.745 0.913 1.00 13.30 H new ATOM 0 HA LYS A 99 -11.671 -2.711 2.914 1.00 53.45 H new ATOM 0 HB2 LYS A 99 -10.180 -0.553 1.384 1.00 41.31 H new ATOM 0 HB3 LYS A 99 -9.417 -1.392 2.720 1.00 41.31 H new ATOM 0 HG2 LYS A 99 -8.718 -2.455 0.657 1.00 4.14 H new ATOM 0 HG3 LYS A 99 -9.751 -3.575 1.523 1.00 4.14 H new ATOM 0 HD2 LYS A 99 -11.682 -2.885 0.058 1.00 50.20 H new ATOM 0 HD3 LYS A 99 -10.605 -1.828 -0.833 1.00 50.20 H new ATOM 0 HE2 LYS A 99 -9.271 -3.750 -1.606 1.00 1.54 H new ATOM 0 HE3 LYS A 99 -10.193 -4.847 -0.597 1.00 1.54 H new ATOM 0 HZ1 LYS A 99 -10.945 -4.879 -2.901 1.00 71.22 H new ATOM 0 HZ2 LYS A 99 -12.180 -4.332 -1.872 1.00 71.22 H new ATOM 0 HZ3 LYS A 99 -11.319 -3.224 -2.828 1.00 71.22 H new ATOM 1624 N LYS A 100 -12.189 0.429 3.794 1.00 52.34 N ATOM 1625 CA LYS A 100 -12.282 1.407 4.913 1.00 24.32 C ATOM 1626 C LYS A 100 -13.267 0.938 6.010 1.00 21.34 C ATOM 1627 O LYS A 100 -13.009 1.121 7.209 1.00 34.01 O ATOM 1628 CB LYS A 100 -12.687 2.794 4.350 1.00 73.32 C ATOM 1629 CG LYS A 100 -12.731 3.946 5.365 1.00 44.01 C ATOM 1630 CD LYS A 100 -13.149 5.285 4.713 1.00 64.45 C ATOM 1631 CE LYS A 100 -13.267 6.429 5.732 1.00 40.45 C ATOM 1632 NZ LYS A 100 -14.292 6.140 6.771 1.00 54.34 N ATOM 0 H LYS A 100 -12.559 0.785 2.913 1.00 52.34 H new ATOM 0 HA LYS A 100 -11.304 1.484 5.388 1.00 24.32 H new ATOM 0 HB2 LYS A 100 -11.988 3.061 3.558 1.00 73.32 H new ATOM 0 HB3 LYS A 100 -13.671 2.704 3.890 1.00 73.32 H new ATOM 0 HG2 LYS A 100 -13.431 3.698 6.163 1.00 44.01 H new ATOM 0 HG3 LYS A 100 -11.750 4.059 5.826 1.00 44.01 H new ATOM 0 HD2 LYS A 100 -12.419 5.557 3.951 1.00 64.45 H new ATOM 0 HD3 LYS A 100 -14.105 5.155 4.206 1.00 64.45 H new ATOM 0 HE2 LYS A 100 -12.301 6.591 6.210 1.00 40.45 H new ATOM 0 HE3 LYS A 100 -13.525 7.352 5.214 1.00 40.45 H new ATOM 0 HZ1 LYS A 100 -14.489 7.005 7.315 1.00 54.34 H new ATOM 0 HZ2 LYS A 100 -15.167 5.812 6.314 1.00 54.34 H new ATOM 0 HZ3 LYS A 100 -13.938 5.401 7.412 1.00 54.34 H new ATOM 1646 N LYS A 101 -14.374 0.299 5.584 1.00 44.44 N ATOM 1647 CA LYS A 101 -15.396 -0.268 6.501 1.00 53.34 C ATOM 1648 C LYS A 101 -14.874 -1.557 7.188 1.00 34.13 C ATOM 1649 O LYS A 101 -15.488 -2.063 8.131 1.00 51.23 O ATOM 1650 CB LYS A 101 -16.721 -0.544 5.728 1.00 54.32 C ATOM 1651 CG LYS A 101 -16.648 -1.702 4.713 1.00 21.32 C ATOM 1652 CD LYS A 101 -17.906 -1.814 3.831 1.00 24.10 C ATOM 1653 CE LYS A 101 -17.845 -3.001 2.856 1.00 54.34 C ATOM 1654 NZ LYS A 101 -17.848 -4.302 3.566 1.00 4.45 N ATOM 0 H LYS A 101 -14.590 0.159 4.597 1.00 44.44 H new ATOM 0 HA LYS A 101 -15.600 0.463 7.283 1.00 53.34 H new ATOM 0 HB2 LYS A 101 -17.508 -0.762 6.450 1.00 54.32 H new ATOM 0 HB3 LYS A 101 -17.014 0.364 5.201 1.00 54.32 H new ATOM 0 HG2 LYS A 101 -15.775 -1.563 4.075 1.00 21.32 H new ATOM 0 HG3 LYS A 101 -16.504 -2.639 5.250 1.00 21.32 H new ATOM 0 HD2 LYS A 101 -18.784 -1.918 4.469 1.00 24.10 H new ATOM 0 HD3 LYS A 101 -18.031 -0.891 3.265 1.00 24.10 H new ATOM 0 HE2 LYS A 101 -18.696 -2.957 2.177 1.00 54.34 H new ATOM 0 HE3 LYS A 101 -16.945 -2.923 2.245 1.00 54.34 H new ATOM 0 HZ1 LYS A 101 -17.943 -5.074 2.876 1.00 4.45 H new ATOM 0 HZ2 LYS A 101 -16.957 -4.414 4.090 1.00 4.45 H new ATOM 0 HZ3 LYS A 101 -18.647 -4.333 4.231 1.00 4.45 H new ATOM 1668 N LYS A 102 -13.750 -2.093 6.675 1.00 43.11 N ATOM 1669 CA LYS A 102 -13.063 -3.276 7.236 1.00 30.43 C ATOM 1670 C LYS A 102 -11.857 -2.844 8.120 1.00 11.13 C ATOM 1671 O LYS A 102 -11.028 -3.678 8.514 1.00 72.50 O ATOM 1672 CB LYS A 102 -12.608 -4.185 6.062 1.00 54.35 C ATOM 1673 CG LYS A 102 -13.762 -4.640 5.145 1.00 33.45 C ATOM 1674 CD LYS A 102 -13.295 -5.365 3.860 1.00 24.11 C ATOM 1675 CE LYS A 102 -14.480 -5.660 2.923 1.00 24.33 C ATOM 1676 NZ LYS A 102 -14.069 -6.354 1.675 1.00 4.10 N ATOM 0 H LYS A 102 -13.287 -1.713 5.849 1.00 43.11 H new ATOM 0 HA LYS A 102 -13.745 -3.833 7.878 1.00 30.43 H new ATOM 0 HB2 LYS A 102 -11.871 -3.649 5.464 1.00 54.35 H new ATOM 0 HB3 LYS A 102 -12.110 -5.065 6.468 1.00 54.35 H new ATOM 0 HG2 LYS A 102 -14.419 -5.304 5.707 1.00 33.45 H new ATOM 0 HG3 LYS A 102 -14.354 -3.769 4.864 1.00 33.45 H new ATOM 0 HD2 LYS A 102 -12.561 -4.750 3.339 1.00 24.11 H new ATOM 0 HD3 LYS A 102 -12.798 -6.298 4.126 1.00 24.11 H new ATOM 0 HE2 LYS A 102 -15.210 -6.273 3.451 1.00 24.33 H new ATOM 0 HE3 LYS A 102 -14.976 -4.724 2.666 1.00 24.33 H new ATOM 0 HZ1 LYS A 102 -14.874 -6.893 1.296 1.00 4.10 H new ATOM 0 HZ2 LYS A 102 -13.761 -5.652 0.973 1.00 4.10 H new ATOM 0 HZ3 LYS A 102 -13.284 -7.004 1.882 1.00 4.10 H new ATOM 1690 N GLY A 103 -11.774 -1.523 8.412 1.00 31.34 N ATOM 1691 CA GLY A 103 -10.752 -0.965 9.310 1.00 74.33 C ATOM 1692 C GLY A 103 -9.424 -0.657 8.631 1.00 43.44 C ATOM 1693 O GLY A 103 -8.480 -0.206 9.297 1.00 75.21 O ATOM 0 H GLY A 103 -12.412 -0.825 8.031 1.00 31.34 H new ATOM 0 HA2 GLY A 103 -11.139 -0.050 9.758 1.00 74.33 H new ATOM 0 HA3 GLY A 103 -10.576 -1.669 10.124 1.00 74.33 H new ATOM 1697 N TYR A 104 -9.338 -0.904 7.313 1.00 24.22 N ATOM 1698 CA TYR A 104 -8.134 -0.625 6.519 1.00 24.15 C ATOM 1699 C TYR A 104 -8.205 0.838 6.046 1.00 11.33 C ATOM 1700 O TYR A 104 -9.096 1.186 5.276 1.00 43.41 O ATOM 1701 CB TYR A 104 -8.049 -1.598 5.302 1.00 2.00 C ATOM 1702 CG TYR A 104 -8.316 -3.083 5.627 1.00 1.21 C ATOM 1703 CD1 TYR A 104 -7.776 -3.697 6.765 1.00 55.52 C ATOM 1704 CD2 TYR A 104 -9.127 -3.872 4.795 1.00 3.11 C ATOM 1705 CE1 TYR A 104 -8.027 -5.031 7.049 1.00 35.05 C ATOM 1706 CE2 TYR A 104 -9.372 -5.199 5.080 1.00 33.02 C ATOM 1707 CZ TYR A 104 -8.831 -5.771 6.204 1.00 62.11 C ATOM 1708 OH TYR A 104 -9.087 -7.098 6.477 1.00 34.24 O ATOM 0 H TYR A 104 -10.103 -1.303 6.769 1.00 24.22 H new ATOM 0 HA TYR A 104 -7.239 -0.776 7.122 1.00 24.15 H new ATOM 0 HB2 TYR A 104 -8.765 -1.273 4.547 1.00 2.00 H new ATOM 0 HB3 TYR A 104 -7.057 -1.513 4.858 1.00 2.00 H new ATOM 0 HD1 TYR A 104 -7.153 -3.121 7.433 1.00 55.52 H new ATOM 0 HD2 TYR A 104 -9.568 -3.430 3.914 1.00 3.11 H new ATOM 0 HE1 TYR A 104 -7.596 -5.489 7.927 1.00 35.05 H new ATOM 0 HE2 TYR A 104 -9.990 -5.788 4.418 1.00 33.02 H new ATOM 0 HH TYR A 104 -9.286 -7.203 7.431 1.00 34.24 H new ATOM 1718 N ASP A 105 -7.294 1.686 6.540 1.00 15.01 N ATOM 1719 CA ASP A 105 -7.304 3.135 6.258 1.00 4.51 C ATOM 1720 C ASP A 105 -6.950 3.399 4.780 1.00 51.12 C ATOM 1721 O ASP A 105 -5.795 3.271 4.392 1.00 44.45 O ATOM 1722 CB ASP A 105 -6.294 3.843 7.202 1.00 74.31 C ATOM 1723 CG ASP A 105 -6.465 5.367 7.233 1.00 74.12 C ATOM 1724 OD1 ASP A 105 -7.351 5.859 7.968 1.00 34.34 O ATOM 1725 OD2 ASP A 105 -5.716 6.084 6.541 1.00 34.21 O ATOM 0 H ASP A 105 -6.528 1.392 7.146 1.00 15.01 H new ATOM 0 HA ASP A 105 -8.302 3.534 6.437 1.00 4.51 H new ATOM 0 HB2 ASP A 105 -6.412 3.450 8.212 1.00 74.31 H new ATOM 0 HB3 ASP A 105 -5.279 3.604 6.884 1.00 74.31 H new ATOM 1730 N VAL A 106 -7.948 3.759 3.952 1.00 31.21 N ATOM 1731 CA VAL A 106 -7.750 3.883 2.496 1.00 3.02 C ATOM 1732 C VAL A 106 -7.534 5.347 2.091 1.00 74.32 C ATOM 1733 O VAL A 106 -8.207 6.250 2.593 1.00 74.42 O ATOM 1734 CB VAL A 106 -8.965 3.295 1.681 1.00 55.24 C ATOM 1735 CG1 VAL A 106 -8.677 3.279 0.156 1.00 21.23 C ATOM 1736 CG2 VAL A 106 -9.333 1.889 2.176 1.00 52.51 C ATOM 0 H VAL A 106 -8.896 3.968 4.265 1.00 31.21 H new ATOM 0 HA VAL A 106 -6.859 3.303 2.255 1.00 3.02 H new ATOM 0 HB VAL A 106 -9.817 3.953 1.851 1.00 55.24 H new ATOM 0 HG11 VAL A 106 -9.537 2.867 -0.372 1.00 21.23 H new ATOM 0 HG12 VAL A 106 -8.491 4.296 -0.190 1.00 21.23 H new ATOM 0 HG13 VAL A 106 -7.800 2.663 -0.042 1.00 21.23 H new ATOM 0 HG21 VAL A 106 -10.174 1.508 1.597 1.00 52.51 H new ATOM 0 HG22 VAL A 106 -8.477 1.225 2.054 1.00 52.51 H new ATOM 0 HG23 VAL A 106 -9.609 1.935 3.229 1.00 52.51 H new ATOM 1746 N TYR A 107 -6.551 5.562 1.211 1.00 13.22 N ATOM 1747 CA TYR A 107 -6.361 6.810 0.471 1.00 43.52 C ATOM 1748 C TYR A 107 -6.614 6.525 -1.016 1.00 52.43 C ATOM 1749 O TYR A 107 -6.305 5.432 -1.504 1.00 31.43 O ATOM 1750 CB TYR A 107 -4.928 7.350 0.673 1.00 24.53 C ATOM 1751 CG TYR A 107 -4.593 7.701 2.130 1.00 33.52 C ATOM 1752 CD1 TYR A 107 -5.024 8.903 2.701 1.00 65.41 C ATOM 1753 CD2 TYR A 107 -3.844 6.842 2.929 1.00 73.45 C ATOM 1754 CE1 TYR A 107 -4.719 9.223 4.009 1.00 32.21 C ATOM 1755 CE2 TYR A 107 -3.542 7.156 4.238 1.00 74.42 C ATOM 1756 CZ TYR A 107 -3.978 8.349 4.774 1.00 45.22 C ATOM 1757 OH TYR A 107 -3.669 8.675 6.078 1.00 4.51 O ATOM 0 H TYR A 107 -5.850 4.855 0.989 1.00 13.22 H new ATOM 0 HA TYR A 107 -7.056 7.566 0.836 1.00 43.52 H new ATOM 0 HB2 TYR A 107 -4.216 6.605 0.317 1.00 24.53 H new ATOM 0 HB3 TYR A 107 -4.795 8.239 0.056 1.00 24.53 H new ATOM 0 HD1 TYR A 107 -5.606 9.593 2.108 1.00 65.41 H new ATOM 0 HD2 TYR A 107 -3.491 5.909 2.515 1.00 73.45 H new ATOM 0 HE1 TYR A 107 -5.061 10.156 4.432 1.00 32.21 H new ATOM 0 HE2 TYR A 107 -2.966 6.470 4.841 1.00 74.42 H new ATOM 0 HH TYR A 107 -3.143 7.953 6.480 1.00 4.51 H new ATOM 1767 N THR A 108 -7.188 7.492 -1.725 1.00 52.42 N ATOM 1768 CA THR A 108 -7.480 7.377 -3.164 1.00 33.24 C ATOM 1769 C THR A 108 -6.847 8.552 -3.915 1.00 23.23 C ATOM 1770 O THR A 108 -6.661 9.640 -3.347 1.00 61.13 O ATOM 1771 CB THR A 108 -9.024 7.312 -3.420 1.00 34.13 C ATOM 1772 OG1 THR A 108 -9.689 8.388 -2.733 1.00 32.53 O ATOM 1773 CG2 THR A 108 -9.621 5.970 -2.968 1.00 73.44 C ATOM 0 H THR A 108 -7.468 8.386 -1.322 1.00 52.42 H new ATOM 0 HA THR A 108 -7.048 6.449 -3.537 1.00 33.24 H new ATOM 0 HB THR A 108 -9.179 7.409 -4.495 1.00 34.13 H new ATOM 0 HG1 THR A 108 -10.653 8.338 -2.902 1.00 32.53 H new ATOM 0 HG21 THR A 108 -10.693 5.965 -3.163 1.00 73.44 H new ATOM 0 HG22 THR A 108 -9.148 5.157 -3.520 1.00 73.44 H new ATOM 0 HG23 THR A 108 -9.445 5.835 -1.901 1.00 73.44 H new ATOM 1781 N SER A 109 -6.525 8.318 -5.190 1.00 75.02 N ATOM 1782 CA SER A 109 -5.807 9.280 -6.031 1.00 53.05 C ATOM 1783 C SER A 109 -6.079 8.994 -7.504 1.00 41.00 C ATOM 1784 O SER A 109 -6.187 7.826 -7.893 1.00 14.13 O ATOM 1785 CB SER A 109 -4.296 9.176 -5.737 1.00 21.12 C ATOM 1786 OG SER A 109 -3.834 7.836 -5.840 1.00 55.04 O ATOM 0 H SER A 109 -6.757 7.449 -5.671 1.00 75.02 H new ATOM 0 HA SER A 109 -6.152 10.290 -5.808 1.00 53.05 H new ATOM 0 HB2 SER A 109 -3.745 9.806 -6.435 1.00 21.12 H new ATOM 0 HB3 SER A 109 -4.093 9.556 -4.736 1.00 21.12 H new ATOM 0 HG SER A 109 -3.190 7.656 -5.124 1.00 55.04 H new ATOM 1792 N ARG A 110 -6.198 10.059 -8.315 1.00 3.52 N ATOM 1793 CA ARG A 110 -6.263 9.917 -9.773 1.00 42.30 C ATOM 1794 C ARG A 110 -4.887 9.473 -10.279 1.00 42.14 C ATOM 1795 O ARG A 110 -4.765 8.471 -10.987 1.00 61.31 O ATOM 1796 CB ARG A 110 -6.650 11.244 -10.483 1.00 42.14 C ATOM 1797 CG ARG A 110 -8.013 11.855 -10.101 1.00 34.44 C ATOM 1798 CD ARG A 110 -9.229 11.076 -10.633 1.00 54.24 C ATOM 1799 NE ARG A 110 -10.465 11.866 -10.439 1.00 33.34 N ATOM 1800 CZ ARG A 110 -11.539 11.874 -11.247 1.00 23.11 C ATOM 1801 NH1 ARG A 110 -11.595 11.126 -12.339 1.00 40.20 N ATOM 1802 NH2 ARG A 110 -12.557 12.670 -10.961 1.00 63.22 N ATOM 0 H ARG A 110 -6.251 11.022 -7.984 1.00 3.52 H new ATOM 0 HA ARG A 110 -7.034 9.182 -10.003 1.00 42.30 H new ATOM 0 HB2 ARG A 110 -5.875 11.981 -10.275 1.00 42.14 H new ATOM 0 HB3 ARG A 110 -6.643 11.070 -11.559 1.00 42.14 H new ATOM 0 HG2 ARG A 110 -8.080 11.912 -9.015 1.00 34.44 H new ATOM 0 HG3 ARG A 110 -8.058 12.877 -10.478 1.00 34.44 H new ATOM 0 HD2 ARG A 110 -9.093 10.853 -11.691 1.00 54.24 H new ATOM 0 HD3 ARG A 110 -9.314 10.121 -10.115 1.00 54.24 H new ATOM 0 HE ARG A 110 -10.506 12.462 -9.612 1.00 33.34 H new ATOM 0 HH11 ARG A 110 -10.810 10.523 -12.585 1.00 40.20 H new ATOM 0 HH12 ARG A 110 -12.423 11.153 -12.933 1.00 40.20 H new ATOM 0 HH21 ARG A 110 -12.521 13.268 -10.135 1.00 63.22 H new ATOM 0 HH22 ARG A 110 -13.378 12.685 -11.566 1.00 63.22 H new ATOM 1816 N ASN A 111 -3.839 10.199 -9.834 1.00 63.15 N ATOM 1817 CA ASN A 111 -2.515 10.137 -10.475 1.00 54.33 C ATOM 1818 C ASN A 111 -1.385 10.036 -9.434 1.00 31.22 C ATOM 1819 O ASN A 111 -1.636 10.071 -8.225 1.00 65.12 O ATOM 1820 CB ASN A 111 -2.331 11.384 -11.391 1.00 44.15 C ATOM 1821 CG ASN A 111 -2.071 12.688 -10.627 1.00 53.15 C ATOM 1822 OD1 ASN A 111 -0.927 13.053 -10.374 1.00 2.24 O ATOM 1823 ND2 ASN A 111 -3.116 13.393 -10.246 1.00 40.24 N ATOM 0 H ASN A 111 -3.887 10.832 -9.036 1.00 63.15 H new ATOM 0 HA ASN A 111 -2.460 9.234 -11.083 1.00 54.33 H new ATOM 0 HB2 ASN A 111 -1.499 11.202 -12.072 1.00 44.15 H new ATOM 0 HB3 ASN A 111 -3.224 11.506 -12.004 1.00 44.15 H new ATOM 0 HD21 ASN A 111 -2.984 14.262 -9.729 1.00 40.24 H new ATOM 0 HD22 ASN A 111 -4.058 13.070 -10.468 1.00 40.24 H new ATOM 1830 N GLU A 112 -0.149 9.944 -9.967 1.00 44.10 N ATOM 1831 CA GLU A 112 1.108 9.768 -9.213 1.00 71.31 C ATOM 1832 C GLU A 112 1.318 10.838 -8.131 1.00 54.02 C ATOM 1833 O GLU A 112 1.637 10.490 -6.999 1.00 45.43 O ATOM 1834 CB GLU A 112 2.297 9.733 -10.228 1.00 55.51 C ATOM 1835 CG GLU A 112 3.737 9.754 -9.633 1.00 61.12 C ATOM 1836 CD GLU A 112 4.411 11.145 -9.669 1.00 63.52 C ATOM 1837 OE1 GLU A 112 5.045 11.486 -10.688 1.00 23.21 O ATOM 1838 OE2 GLU A 112 4.315 11.905 -8.684 1.00 5.02 O ATOM 0 H GLU A 112 0.006 9.992 -10.974 1.00 44.10 H new ATOM 0 HA GLU A 112 1.054 8.824 -8.671 1.00 71.31 H new ATOM 0 HB2 GLU A 112 2.196 8.835 -10.837 1.00 55.51 H new ATOM 0 HB3 GLU A 112 2.195 10.586 -10.898 1.00 55.51 H new ATOM 0 HG2 GLU A 112 3.698 9.407 -8.600 1.00 61.12 H new ATOM 0 HG3 GLU A 112 4.357 9.047 -10.184 1.00 61.12 H new ATOM 1845 N ASP A 113 1.132 12.132 -8.488 1.00 24.34 N ATOM 1846 CA ASP A 113 1.386 13.272 -7.564 1.00 35.23 C ATOM 1847 C ASP A 113 0.569 13.142 -6.274 1.00 11.44 C ATOM 1848 O ASP A 113 1.087 13.316 -5.165 1.00 71.02 O ATOM 1849 CB ASP A 113 1.072 14.631 -8.248 1.00 70.14 C ATOM 1850 CG ASP A 113 2.030 14.950 -9.411 1.00 70.14 C ATOM 1851 OD1 ASP A 113 1.787 14.472 -10.541 1.00 31.42 O ATOM 1852 OD2 ASP A 113 3.029 15.681 -9.197 1.00 54.02 O ATOM 0 H ASP A 113 0.806 12.416 -9.412 1.00 24.34 H new ATOM 0 HA ASP A 113 2.445 13.243 -7.308 1.00 35.23 H new ATOM 0 HB2 ASP A 113 0.048 14.617 -8.621 1.00 70.14 H new ATOM 0 HB3 ASP A 113 1.130 15.428 -7.506 1.00 70.14 H new ATOM 1857 N GLU A 114 -0.712 12.801 -6.456 1.00 32.03 N ATOM 1858 CA GLU A 114 -1.675 12.641 -5.365 1.00 43.33 C ATOM 1859 C GLU A 114 -1.353 11.388 -4.537 1.00 61.53 C ATOM 1860 O GLU A 114 -1.317 11.445 -3.305 1.00 63.43 O ATOM 1861 CB GLU A 114 -3.093 12.586 -5.958 1.00 53.03 C ATOM 1862 CG GLU A 114 -3.475 13.858 -6.732 1.00 71.32 C ATOM 1863 CD GLU A 114 -4.847 13.755 -7.380 1.00 21.22 C ATOM 1864 OE1 GLU A 114 -5.053 12.804 -8.149 1.00 15.14 O ATOM 1865 OE2 GLU A 114 -5.731 14.601 -7.117 1.00 4.44 O ATOM 0 H GLU A 114 -1.112 12.627 -7.378 1.00 32.03 H new ATOM 0 HA GLU A 114 -1.612 13.492 -4.687 1.00 43.33 H new ATOM 0 HB2 GLU A 114 -3.168 11.727 -6.624 1.00 53.03 H new ATOM 0 HB3 GLU A 114 -3.811 12.429 -5.153 1.00 53.03 H new ATOM 0 HG2 GLU A 114 -3.460 14.711 -6.053 1.00 71.32 H new ATOM 0 HG3 GLU A 114 -2.727 14.050 -7.501 1.00 71.32 H new ATOM 1872 N ALA A 115 -1.054 10.290 -5.253 1.00 54.13 N ATOM 1873 CA ALA A 115 -0.735 8.972 -4.667 1.00 42.12 C ATOM 1874 C ALA A 115 0.521 9.019 -3.788 1.00 31.32 C ATOM 1875 O ALA A 115 0.609 8.324 -2.779 1.00 45.33 O ATOM 1876 CB ALA A 115 -0.529 7.960 -5.798 1.00 62.41 C ATOM 0 H ALA A 115 -1.026 10.291 -6.273 1.00 54.13 H new ATOM 0 HA ALA A 115 -1.569 8.676 -4.031 1.00 42.12 H new ATOM 0 HB1 ALA A 115 -0.293 6.984 -5.374 1.00 62.41 H new ATOM 0 HB2 ALA A 115 -1.440 7.887 -6.392 1.00 62.41 H new ATOM 0 HB3 ALA A 115 0.293 8.288 -6.434 1.00 62.41 H new ATOM 1882 N LYS A 116 1.473 9.862 -4.207 1.00 34.21 N ATOM 1883 CA LYS A 116 2.797 10.010 -3.584 1.00 63.44 C ATOM 1884 C LYS A 116 2.689 10.741 -2.245 1.00 21.12 C ATOM 1885 O LYS A 116 3.304 10.340 -1.259 1.00 13.24 O ATOM 1886 CB LYS A 116 3.701 10.780 -4.574 1.00 45.21 C ATOM 1887 CG LYS A 116 5.165 10.997 -4.129 1.00 13.14 C ATOM 1888 CD LYS A 116 6.049 11.471 -5.305 1.00 23.13 C ATOM 1889 CE LYS A 116 6.171 10.404 -6.415 1.00 31.31 C ATOM 1890 NZ LYS A 116 6.884 10.922 -7.614 1.00 65.10 N ATOM 0 H LYS A 116 1.341 10.477 -5.010 1.00 34.21 H new ATOM 0 HA LYS A 116 3.229 9.032 -3.373 1.00 63.44 H new ATOM 0 HB2 LYS A 116 3.707 10.243 -5.523 1.00 45.21 H new ATOM 0 HB3 LYS A 116 3.251 11.755 -4.762 1.00 45.21 H new ATOM 0 HG2 LYS A 116 5.197 11.735 -3.327 1.00 13.14 H new ATOM 0 HG3 LYS A 116 5.565 10.068 -3.723 1.00 13.14 H new ATOM 0 HD2 LYS A 116 5.629 12.384 -5.727 1.00 23.13 H new ATOM 0 HD3 LYS A 116 7.043 11.719 -4.932 1.00 23.13 H new ATOM 0 HE2 LYS A 116 6.702 9.535 -6.025 1.00 31.31 H new ATOM 0 HE3 LYS A 116 5.176 10.066 -6.704 1.00 31.31 H new ATOM 0 HZ1 LYS A 116 6.567 10.403 -8.458 1.00 65.10 H new ATOM 0 HZ2 LYS A 116 6.675 11.934 -7.732 1.00 65.10 H new ATOM 0 HZ3 LYS A 116 7.909 10.792 -7.492 1.00 65.10 H new ATOM 1904 N LYS A 117 1.877 11.809 -2.232 1.00 42.44 N ATOM 1905 CA LYS A 117 1.612 12.609 -1.022 1.00 63.32 C ATOM 1906 C LYS A 117 0.767 11.798 -0.022 1.00 51.34 C ATOM 1907 O LYS A 117 0.916 11.938 1.189 1.00 12.32 O ATOM 1908 CB LYS A 117 0.905 13.929 -1.414 1.00 33.25 C ATOM 1909 CG LYS A 117 1.749 14.810 -2.359 1.00 43.14 C ATOM 1910 CD LYS A 117 1.005 16.070 -2.855 1.00 5.10 C ATOM 1911 CE LYS A 117 1.814 16.855 -3.902 1.00 64.42 C ATOM 1912 NZ LYS A 117 1.106 18.087 -4.354 1.00 41.32 N ATOM 0 H LYS A 117 1.384 12.144 -3.060 1.00 42.44 H new ATOM 0 HA LYS A 117 2.556 12.856 -0.537 1.00 63.32 H new ATOM 0 HB2 LYS A 117 -0.045 13.696 -1.895 1.00 33.25 H new ATOM 0 HB3 LYS A 117 0.675 14.493 -0.510 1.00 33.25 H new ATOM 0 HG2 LYS A 117 2.659 15.115 -1.842 1.00 43.14 H new ATOM 0 HG3 LYS A 117 2.055 14.216 -3.220 1.00 43.14 H new ATOM 0 HD2 LYS A 117 0.047 15.777 -3.285 1.00 5.10 H new ATOM 0 HD3 LYS A 117 0.789 16.719 -2.006 1.00 5.10 H new ATOM 0 HE2 LYS A 117 2.782 17.128 -3.481 1.00 64.42 H new ATOM 0 HE3 LYS A 117 2.010 16.215 -4.762 1.00 64.42 H new ATOM 0 HZ1 LYS A 117 1.688 18.583 -5.059 1.00 41.32 H new ATOM 0 HZ2 LYS A 117 0.194 17.827 -4.780 1.00 41.32 H new ATOM 0 HZ3 LYS A 117 0.942 18.712 -3.539 1.00 41.32 H new ATOM 1926 N LYS A 118 -0.116 10.939 -0.565 1.00 22.53 N ATOM 1927 CA LYS A 118 -0.950 10.011 0.222 1.00 4.41 C ATOM 1928 C LYS A 118 -0.125 8.819 0.739 1.00 25.03 C ATOM 1929 O LYS A 118 -0.480 8.202 1.748 1.00 32.31 O ATOM 1930 CB LYS A 118 -2.184 9.557 -0.600 1.00 43.03 C ATOM 1931 CG LYS A 118 -3.200 10.697 -0.879 1.00 70.22 C ATOM 1932 CD LYS A 118 -3.800 11.341 0.425 1.00 11.41 C ATOM 1933 CE LYS A 118 -3.570 12.866 0.541 1.00 4.31 C ATOM 1934 NZ LYS A 118 -2.125 13.233 0.663 1.00 11.51 N ATOM 0 H LYS A 118 -0.272 10.869 -1.571 1.00 22.53 H new ATOM 0 HA LYS A 118 -1.319 10.540 1.101 1.00 4.41 H new ATOM 0 HB2 LYS A 118 -1.845 9.144 -1.550 1.00 43.03 H new ATOM 0 HB3 LYS A 118 -2.690 8.753 -0.065 1.00 43.03 H new ATOM 0 HG2 LYS A 118 -2.709 11.474 -1.465 1.00 70.22 H new ATOM 0 HG3 LYS A 118 -4.014 10.305 -1.488 1.00 70.22 H new ATOM 0 HD2 LYS A 118 -4.871 11.143 0.455 1.00 11.41 H new ATOM 0 HD3 LYS A 118 -3.361 10.851 1.294 1.00 11.41 H new ATOM 0 HE2 LYS A 118 -3.991 13.359 -0.335 1.00 4.31 H new ATOM 0 HE3 LYS A 118 -4.109 13.244 1.409 1.00 4.31 H new ATOM 0 HZ1 LYS A 118 -2.037 14.262 0.788 1.00 11.51 H new ATOM 0 HZ2 LYS A 118 -1.712 12.748 1.485 1.00 11.51 H new ATOM 0 HZ3 LYS A 118 -1.620 12.945 -0.199 1.00 11.51 H new ATOM 1948 N LEU A 119 0.966 8.496 0.023 1.00 60.32 N ATOM 1949 CA LEU A 119 1.924 7.452 0.432 1.00 62.35 C ATOM 1950 C LEU A 119 2.779 7.987 1.597 1.00 72.04 C ATOM 1951 O LEU A 119 3.050 7.261 2.565 1.00 73.43 O ATOM 1952 CB LEU A 119 2.777 6.998 -0.805 1.00 73.31 C ATOM 1953 CG LEU A 119 3.217 5.494 -0.833 1.00 51.15 C ATOM 1954 CD1 LEU A 119 3.724 5.078 -2.230 1.00 72.03 C ATOM 1955 CD2 LEU A 119 4.269 5.184 0.244 1.00 45.25 C ATOM 0 H LEU A 119 1.209 8.951 -0.857 1.00 60.32 H new ATOM 0 HA LEU A 119 1.404 6.564 0.791 1.00 62.35 H new ATOM 0 HB2 LEU A 119 2.204 7.203 -1.709 1.00 73.31 H new ATOM 0 HB3 LEU A 119 3.673 7.617 -0.848 1.00 73.31 H new ATOM 0 HG LEU A 119 2.330 4.902 -0.607 1.00 51.15 H new ATOM 0 HD11 LEU A 119 4.020 4.029 -2.212 1.00 72.03 H new ATOM 0 HD12 LEU A 119 2.929 5.218 -2.962 1.00 72.03 H new ATOM 0 HD13 LEU A 119 4.581 5.693 -2.504 1.00 72.03 H new ATOM 0 HD21 LEU A 119 4.546 4.131 0.190 1.00 45.25 H new ATOM 0 HD22 LEU A 119 5.152 5.801 0.078 1.00 45.25 H new ATOM 0 HD23 LEU A 119 3.856 5.400 1.229 1.00 45.25 H new ATOM 1967 N LYS A 120 3.132 9.287 1.505 1.00 35.40 N ATOM 1968 CA LYS A 120 3.871 10.009 2.551 1.00 11.35 C ATOM 1969 C LYS A 120 3.104 10.031 3.880 1.00 35.21 C ATOM 1970 O LYS A 120 3.736 10.051 4.931 1.00 31.52 O ATOM 1971 CB LYS A 120 4.164 11.466 2.124 1.00 3.34 C ATOM 1972 CG LYS A 120 5.236 11.629 1.028 1.00 24.33 C ATOM 1973 CD LYS A 120 5.552 13.119 0.776 1.00 40.11 C ATOM 1974 CE LYS A 120 6.050 13.831 2.052 1.00 34.24 C ATOM 1975 NZ LYS A 120 6.107 15.301 1.896 1.00 43.43 N ATOM 0 H LYS A 120 2.908 9.865 0.695 1.00 35.40 H new ATOM 0 HA LYS A 120 4.809 9.472 2.691 1.00 11.35 H new ATOM 0 HB2 LYS A 120 3.236 11.917 1.772 1.00 3.34 H new ATOM 0 HB3 LYS A 120 4.478 12.028 3.003 1.00 3.34 H new ATOM 0 HG2 LYS A 120 6.146 11.106 1.324 1.00 24.33 H new ATOM 0 HG3 LYS A 120 4.889 11.166 0.104 1.00 24.33 H new ATOM 0 HD2 LYS A 120 6.309 13.202 -0.004 1.00 40.11 H new ATOM 0 HD3 LYS A 120 4.658 13.621 0.407 1.00 40.11 H new ATOM 0 HE2 LYS A 120 5.390 13.583 2.883 1.00 34.24 H new ATOM 0 HE3 LYS A 120 7.041 13.458 2.309 1.00 34.24 H new ATOM 0 HZ1 LYS A 120 6.447 15.731 2.780 1.00 43.43 H new ATOM 0 HZ2 LYS A 120 6.757 15.543 1.121 1.00 43.43 H new ATOM 0 HZ3 LYS A 120 5.157 15.664 1.678 1.00 43.43 H new ATOM 1989 N GLU A 121 1.747 10.038 3.813 1.00 23.24 N ATOM 1990 CA GLU A 121 0.891 10.033 5.022 1.00 2.00 C ATOM 1991 C GLU A 121 1.297 8.867 5.941 1.00 61.33 C ATOM 1992 O GLU A 121 1.721 9.072 7.074 1.00 61.11 O ATOM 1993 CB GLU A 121 -0.617 9.885 4.656 1.00 22.20 C ATOM 1994 CG GLU A 121 -1.175 10.939 3.679 1.00 51.30 C ATOM 1995 CD GLU A 121 -1.078 12.395 4.156 1.00 31.33 C ATOM 1996 OE1 GLU A 121 -1.442 12.681 5.316 1.00 62.05 O ATOM 1997 OE2 GLU A 121 -0.681 13.272 3.355 1.00 12.01 O ATOM 0 H GLU A 121 1.226 10.047 2.936 1.00 23.24 H new ATOM 0 HA GLU A 121 1.032 10.986 5.531 1.00 2.00 H new ATOM 0 HB2 GLU A 121 -0.771 8.897 4.222 1.00 22.20 H new ATOM 0 HB3 GLU A 121 -1.201 9.924 5.576 1.00 22.20 H new ATOM 0 HG2 GLU A 121 -0.644 10.849 2.731 1.00 51.30 H new ATOM 0 HG3 GLU A 121 -2.222 10.708 3.481 1.00 51.30 H new ATOM 2004 N ALA A 122 1.281 7.663 5.348 1.00 35.34 N ATOM 2005 CA ALA A 122 1.513 6.393 6.049 1.00 54.54 C ATOM 2006 C ALA A 122 2.989 6.197 6.439 1.00 62.44 C ATOM 2007 O ALA A 122 3.286 5.554 7.461 1.00 31.31 O ATOM 2008 CB ALA A 122 1.035 5.255 5.156 1.00 30.04 C ATOM 0 H ALA A 122 1.103 7.544 4.351 1.00 35.34 H new ATOM 0 HA ALA A 122 0.951 6.404 6.983 1.00 54.54 H new ATOM 0 HB1 ALA A 122 1.199 4.303 5.661 1.00 30.04 H new ATOM 0 HB2 ALA A 122 -0.028 5.377 4.949 1.00 30.04 H new ATOM 0 HB3 ALA A 122 1.591 5.270 4.219 1.00 30.04 H new ATOM 2014 N LEU A 123 3.906 6.747 5.613 1.00 23.23 N ATOM 2015 CA LEU A 123 5.358 6.747 5.898 1.00 32.43 C ATOM 2016 C LEU A 123 5.645 7.528 7.196 1.00 72.34 C ATOM 2017 O LEU A 123 6.372 7.064 8.074 1.00 1.43 O ATOM 2018 CB LEU A 123 6.151 7.362 4.705 1.00 75.40 C ATOM 2019 CG LEU A 123 6.119 6.542 3.378 1.00 1.25 C ATOM 2020 CD1 LEU A 123 6.801 7.299 2.217 1.00 51.41 C ATOM 2021 CD2 LEU A 123 6.743 5.145 3.572 1.00 62.44 C ATOM 0 H LEU A 123 3.662 7.202 4.733 1.00 23.23 H new ATOM 0 HA LEU A 123 5.686 5.716 6.031 1.00 32.43 H new ATOM 0 HB2 LEU A 123 5.756 8.358 4.505 1.00 75.40 H new ATOM 0 HB3 LEU A 123 7.190 7.486 5.009 1.00 75.40 H new ATOM 0 HG LEU A 123 5.072 6.409 3.106 1.00 1.25 H new ATOM 0 HD11 LEU A 123 6.757 6.693 1.312 1.00 51.41 H new ATOM 0 HD12 LEU A 123 6.286 8.244 2.047 1.00 51.41 H new ATOM 0 HD13 LEU A 123 7.843 7.495 2.472 1.00 51.41 H new ATOM 0 HD21 LEU A 123 6.707 4.596 2.631 1.00 62.44 H new ATOM 0 HD22 LEU A 123 7.780 5.251 3.891 1.00 62.44 H new ATOM 0 HD23 LEU A 123 6.184 4.599 4.332 1.00 62.44 H new ATOM 2033 N GLU A 124 5.025 8.706 7.309 1.00 21.03 N ATOM 2034 CA GLU A 124 5.203 9.603 8.461 1.00 21.23 C ATOM 2035 C GLU A 124 4.409 9.123 9.693 1.00 55.14 C ATOM 2036 O GLU A 124 4.816 9.390 10.829 1.00 41.22 O ATOM 2037 CB GLU A 124 4.869 11.059 8.057 1.00 65.35 C ATOM 2038 CG GLU A 124 5.723 11.560 6.863 1.00 41.24 C ATOM 2039 CD GLU A 124 5.742 13.080 6.710 1.00 1.10 C ATOM 2040 OE1 GLU A 124 4.732 13.660 6.243 1.00 12.11 O ATOM 2041 OE2 GLU A 124 6.766 13.712 7.060 1.00 21.21 O ATOM 0 H GLU A 124 4.383 9.068 6.604 1.00 21.03 H new ATOM 0 HA GLU A 124 6.250 9.579 8.763 1.00 21.23 H new ATOM 0 HB2 GLU A 124 3.813 11.126 7.796 1.00 65.35 H new ATOM 0 HB3 GLU A 124 5.028 11.715 8.913 1.00 65.35 H new ATOM 0 HG2 GLU A 124 6.746 11.204 6.986 1.00 41.24 H new ATOM 0 HG3 GLU A 124 5.340 11.117 5.944 1.00 41.24 H new ATOM 2048 N LYS A 125 3.287 8.397 9.462 1.00 63.22 N ATOM 2049 CA LYS A 125 2.483 7.792 10.555 1.00 23.22 C ATOM 2050 C LYS A 125 3.248 6.633 11.239 1.00 45.31 C ATOM 2051 O LYS A 125 3.075 6.403 12.433 1.00 73.33 O ATOM 2052 CB LYS A 125 1.096 7.280 10.036 1.00 71.32 C ATOM 2053 CG LYS A 125 0.069 8.357 9.565 1.00 24.42 C ATOM 2054 CD LYS A 125 -0.632 9.171 10.701 1.00 30.15 C ATOM 2055 CE LYS A 125 0.211 10.323 11.288 1.00 33.14 C ATOM 2056 NZ LYS A 125 -0.539 11.092 12.329 1.00 75.42 N ATOM 0 H LYS A 125 2.918 8.216 8.529 1.00 63.22 H new ATOM 0 HA LYS A 125 2.306 8.577 11.290 1.00 23.22 H new ATOM 0 HB2 LYS A 125 1.277 6.599 9.204 1.00 71.32 H new ATOM 0 HB3 LYS A 125 0.632 6.696 10.831 1.00 71.32 H new ATOM 0 HG2 LYS A 125 0.582 9.057 8.906 1.00 24.42 H new ATOM 0 HG3 LYS A 125 -0.700 7.863 8.970 1.00 24.42 H new ATOM 0 HD2 LYS A 125 -1.563 9.583 10.312 1.00 30.15 H new ATOM 0 HD3 LYS A 125 -0.898 8.487 11.507 1.00 30.15 H new ATOM 0 HE2 LYS A 125 1.124 9.918 11.724 1.00 33.14 H new ATOM 0 HE3 LYS A 125 0.512 10.997 10.486 1.00 33.14 H new ATOM 0 HZ1 LYS A 125 0.063 11.856 12.697 1.00 75.42 H new ATOM 0 HZ2 LYS A 125 -1.398 11.500 11.908 1.00 75.42 H new ATOM 0 HZ3 LYS A 125 -0.804 10.455 13.107 1.00 75.42 H new ATOM 2070 N SER A 126 4.085 5.909 10.471 1.00 41.20 N ATOM 2071 CA SER A 126 4.891 4.786 11.013 1.00 63.01 C ATOM 2072 C SER A 126 6.093 5.302 11.826 1.00 74.11 C ATOM 2073 O SER A 126 6.596 4.609 12.718 1.00 61.44 O ATOM 2074 CB SER A 126 5.374 3.873 9.871 1.00 35.24 C ATOM 2075 OG SER A 126 6.182 4.581 8.960 1.00 40.21 O ATOM 0 H SER A 126 4.224 6.077 9.475 1.00 41.20 H new ATOM 0 HA SER A 126 4.253 4.209 11.683 1.00 63.01 H new ATOM 0 HB2 SER A 126 5.936 3.035 10.284 1.00 35.24 H new ATOM 0 HB3 SER A 126 4.514 3.454 9.349 1.00 35.24 H new ATOM 0 HG SER A 126 6.033 5.543 9.070 1.00 40.21 H new ATOM 2081 N GLY A 127 6.553 6.517 11.488 1.00 13.35 N ATOM 2082 CA GLY A 127 7.645 7.170 12.208 1.00 35.24 C ATOM 2083 C GLY A 127 8.608 7.918 11.291 1.00 15.32 C ATOM 2084 O GLY A 127 9.335 8.799 11.759 1.00 73.53 O ATOM 0 H GLY A 127 6.179 7.066 10.714 1.00 13.35 H new ATOM 0 HA2 GLY A 127 7.227 7.869 12.933 1.00 35.24 H new ATOM 0 HA3 GLY A 127 8.199 6.420 12.772 1.00 35.24 H new ATOM 2088 N SER A 128 8.615 7.571 9.988 1.00 32.31 N ATOM 2089 CA SER A 128 9.532 8.165 8.995 1.00 63.34 C ATOM 2090 C SER A 128 9.092 9.602 8.625 1.00 14.35 C ATOM 2091 O SER A 128 8.485 9.842 7.577 1.00 3.32 O ATOM 2092 CB SER A 128 9.614 7.241 7.748 1.00 44.21 C ATOM 2093 OG SER A 128 10.021 5.924 8.113 1.00 63.44 O ATOM 0 H SER A 128 7.985 6.871 9.595 1.00 32.31 H new ATOM 0 HA SER A 128 10.530 8.245 9.427 1.00 63.34 H new ATOM 0 HB2 SER A 128 8.642 7.202 7.256 1.00 44.21 H new ATOM 0 HB3 SER A 128 10.319 7.657 7.029 1.00 44.21 H new ATOM 0 HG SER A 128 10.064 5.361 7.312 1.00 63.44 H new ATOM 2099 N LEU A 129 9.388 10.545 9.541 1.00 52.12 N ATOM 2100 CA LEU A 129 9.050 11.978 9.397 1.00 42.44 C ATOM 2101 C LEU A 129 10.108 12.706 8.556 1.00 42.40 C ATOM 2102 O LEU A 129 11.276 12.302 8.521 1.00 11.43 O ATOM 2103 CB LEU A 129 8.968 12.659 10.799 1.00 13.34 C ATOM 2104 CG LEU A 129 7.793 12.217 11.725 1.00 23.13 C ATOM 2105 CD1 LEU A 129 7.941 12.809 13.147 1.00 62.03 C ATOM 2106 CD2 LEU A 129 6.429 12.591 11.112 1.00 13.22 C ATOM 0 H LEU A 129 9.874 10.332 10.412 1.00 52.12 H new ATOM 0 HA LEU A 129 8.084 12.043 8.897 1.00 42.44 H new ATOM 0 HB2 LEU A 129 9.904 12.471 11.324 1.00 13.34 H new ATOM 0 HB3 LEU A 129 8.897 13.736 10.650 1.00 13.34 H new ATOM 0 HG LEU A 129 7.836 11.131 11.811 1.00 23.13 H new ATOM 0 HD11 LEU A 129 7.106 12.481 13.766 1.00 62.03 H new ATOM 0 HD12 LEU A 129 8.877 12.466 13.588 1.00 62.03 H new ATOM 0 HD13 LEU A 129 7.945 13.897 13.089 1.00 62.03 H new ATOM 0 HD21 LEU A 129 5.630 12.270 11.780 1.00 13.22 H new ATOM 0 HD22 LEU A 129 6.376 13.671 10.975 1.00 13.22 H new ATOM 0 HD23 LEU A 129 6.316 12.097 10.147 1.00 13.22 H new ATOM 2118 N GLU A 130 9.681 13.797 7.907 1.00 14.03 N ATOM 2119 CA GLU A 130 10.574 14.780 7.264 1.00 24.21 C ATOM 2120 C GLU A 130 10.817 15.949 8.248 1.00 73.13 C ATOM 2121 O GLU A 130 10.611 17.126 7.912 1.00 20.03 O ATOM 2122 CB GLU A 130 9.939 15.278 5.928 1.00 13.30 C ATOM 2123 CG GLU A 130 9.796 14.195 4.834 1.00 53.52 C ATOM 2124 CD GLU A 130 11.151 13.602 4.389 1.00 15.43 C ATOM 2125 OE1 GLU A 130 12.043 14.378 3.963 1.00 4.21 O ATOM 2126 OE2 GLU A 130 11.338 12.366 4.454 1.00 64.31 O ATOM 0 H GLU A 130 8.692 14.028 7.810 1.00 14.03 H new ATOM 0 HA GLU A 130 11.533 14.322 7.022 1.00 24.21 H new ATOM 0 HB2 GLU A 130 8.953 15.690 6.142 1.00 13.30 H new ATOM 0 HB3 GLU A 130 10.547 16.093 5.535 1.00 13.30 H new ATOM 0 HG2 GLU A 130 9.159 13.392 5.206 1.00 53.52 H new ATOM 0 HG3 GLU A 130 9.293 14.625 3.968 1.00 53.52 H new ATOM 2133 N HIS A 131 11.242 15.577 9.484 1.00 12.41 N ATOM 2134 CA HIS A 131 11.551 16.521 10.589 1.00 32.44 C ATOM 2135 C HIS A 131 10.257 17.287 11.022 1.00 72.12 C ATOM 2136 O HIS A 131 9.141 16.823 10.748 1.00 2.42 O ATOM 2137 CB HIS A 131 12.732 17.461 10.155 1.00 43.44 C ATOM 2138 CG HIS A 131 13.425 18.210 11.273 1.00 23.53 C ATOM 2139 ND1 HIS A 131 13.153 19.533 11.525 1.00 12.35 N ATOM 2140 CD2 HIS A 131 14.343 17.774 12.169 1.00 4.33 C ATOM 2141 CE1 HIS A 131 13.902 19.870 12.556 1.00 34.23 C ATOM 2142 NE2 HIS A 131 14.640 18.838 12.984 1.00 53.14 N ATOM 0 H HIS A 131 11.381 14.600 9.743 1.00 12.41 H new ATOM 0 HA HIS A 131 11.888 15.982 11.474 1.00 32.44 H new ATOM 0 HB2 HIS A 131 13.475 16.860 9.631 1.00 43.44 H new ATOM 0 HB3 HIS A 131 12.348 18.188 9.440 1.00 43.44 H new ATOM 0 HD2 HIS A 131 14.761 16.780 12.230 1.00 4.33 H new ATOM 0 HE1 HIS A 131 13.918 20.855 13.000 1.00 34.23 H new ATOM 0 HE2 HIS A 131 15.296 18.842 13.765 1.00 53.14 H new ATOM 2150 N HIS A 132 10.408 18.424 11.726 1.00 64.22 N ATOM 2151 CA HIS A 132 9.300 19.340 12.072 1.00 33.14 C ATOM 2152 C HIS A 132 8.915 20.274 10.903 1.00 71.15 C ATOM 2153 O HIS A 132 8.175 21.246 11.119 1.00 20.31 O ATOM 2154 CB HIS A 132 9.676 20.170 13.335 1.00 34.22 C ATOM 2155 CG HIS A 132 9.674 19.371 14.608 1.00 43.24 C ATOM 2156 ND1 HIS A 132 10.746 18.592 14.967 1.00 14.52 N ATOM 2157 CD2 HIS A 132 8.698 19.237 15.542 1.00 30.44 C ATOM 2158 CE1 HIS A 132 10.401 18.007 16.099 1.00 4.23 C ATOM 2159 NE2 HIS A 132 9.170 18.369 16.487 1.00 62.11 N ATOM 0 H HIS A 132 11.313 18.738 12.076 1.00 64.22 H new ATOM 0 HA HIS A 132 8.424 18.728 12.284 1.00 33.14 H new ATOM 0 HB2 HIS A 132 10.665 20.605 13.191 1.00 34.22 H new ATOM 0 HB3 HIS A 132 8.975 20.999 13.436 1.00 34.22 H new ATOM 0 HD2 HIS A 132 7.734 19.723 15.539 1.00 30.44 H new ATOM 0 HE1 HIS A 132 11.032 17.322 16.645 1.00 4.23 H new ATOM 0 HE2 HIS A 132 8.680 18.057 17.325 1.00 62.11 H new ATOM 2167 N HIS A 133 9.391 19.971 9.667 1.00 21.44 N ATOM 2168 CA HIS A 133 8.980 20.702 8.458 1.00 2.22 C ATOM 2169 C HIS A 133 7.555 20.265 8.045 1.00 63.01 C ATOM 2170 O HIS A 133 7.358 19.402 7.180 1.00 22.40 O ATOM 2171 CB HIS A 133 9.991 20.525 7.299 1.00 71.44 C ATOM 2172 CG HIS A 133 9.649 21.317 6.055 1.00 64.02 C ATOM 2173 ND1 HIS A 133 9.491 20.745 4.809 1.00 70.42 N ATOM 2174 CD2 HIS A 133 9.411 22.642 5.884 1.00 20.51 C ATOM 2175 CE1 HIS A 133 9.185 21.679 3.932 1.00 52.22 C ATOM 2176 NE2 HIS A 133 9.127 22.836 4.556 1.00 13.33 N ATOM 0 H HIS A 133 10.061 19.222 9.490 1.00 21.44 H new ATOM 0 HA HIS A 133 8.967 21.767 8.689 1.00 2.22 H new ATOM 0 HB2 HIS A 133 10.981 20.823 7.646 1.00 71.44 H new ATOM 0 HB3 HIS A 133 10.049 19.468 7.039 1.00 71.44 H new ATOM 0 HD2 HIS A 133 9.440 23.402 6.651 1.00 20.51 H new ATOM 0 HE1 HIS A 133 9.011 21.522 2.878 1.00 52.22 H new ATOM 0 HE2 HIS A 133 8.906 23.732 4.122 1.00 13.33 H new ATOM 2185 N HIS A 134 6.590 20.833 8.765 1.00 45.31 N ATOM 2186 CA HIS A 134 5.143 20.696 8.530 1.00 44.04 C ATOM 2187 C HIS A 134 4.530 22.018 9.017 1.00 62.12 C ATOM 2188 O HIS A 134 3.890 22.750 8.258 1.00 54.33 O ATOM 2189 CB HIS A 134 4.521 19.501 9.315 1.00 75.33 C ATOM 2190 CG HIS A 134 5.055 18.138 8.957 1.00 62.42 C ATOM 2191 ND1 HIS A 134 6.115 17.542 9.619 1.00 10.33 N ATOM 2192 CD2 HIS A 134 4.677 17.262 7.999 1.00 5.24 C ATOM 2193 CE1 HIS A 134 6.355 16.362 9.080 1.00 45.02 C ATOM 2194 NE2 HIS A 134 5.499 16.177 8.099 1.00 55.21 N ATOM 0 H HIS A 134 6.798 21.429 9.566 1.00 45.31 H new ATOM 0 HA HIS A 134 4.944 20.495 7.477 1.00 44.04 H new ATOM 0 HB2 HIS A 134 4.682 19.666 10.380 1.00 75.33 H new ATOM 0 HB3 HIS A 134 3.443 19.504 9.151 1.00 75.33 H new ATOM 0 HD1 HIS A 134 6.629 17.950 10.400 1.00 10.33 H new ATOM 0 HD2 HIS A 134 3.875 17.396 7.288 1.00 5.24 H new ATOM 0 HE1 HIS A 134 7.122 15.668 9.391 1.00 45.02 H new ATOM 2203 N HIS A 135 4.774 22.296 10.313 1.00 54.01 N ATOM 2204 CA HIS A 135 4.540 23.600 10.945 1.00 41.54 C ATOM 2205 C HIS A 135 5.361 23.650 12.241 1.00 34.35 C ATOM 2206 O HIS A 135 5.022 22.975 13.223 1.00 33.33 O ATOM 2207 CB HIS A 135 3.040 23.862 11.254 1.00 14.21 C ATOM 2208 CG HIS A 135 2.770 25.200 11.929 1.00 30.21 C ATOM 2209 ND1 HIS A 135 3.067 25.448 13.257 1.00 25.41 N ATOM 2210 CD2 HIS A 135 2.257 26.362 11.452 1.00 24.00 C ATOM 2211 CE1 HIS A 135 2.750 26.689 13.560 1.00 12.14 C ATOM 2212 NE2 HIS A 135 2.258 27.267 12.486 1.00 42.33 N ATOM 0 H HIS A 135 5.148 21.601 10.960 1.00 54.01 H new ATOM 0 HA HIS A 135 4.848 24.380 10.249 1.00 41.54 H new ATOM 0 HB2 HIS A 135 2.475 23.816 10.323 1.00 14.21 H new ATOM 0 HB3 HIS A 135 2.667 23.062 11.894 1.00 14.21 H new ATOM 0 HD2 HIS A 135 1.911 26.542 10.445 1.00 24.00 H new ATOM 0 HE1 HIS A 135 2.873 27.154 14.527 1.00 12.14 H new ATOM 0 HE2 HIS A 135 1.930 28.231 12.430 1.00 42.33 H new ATOM 2221 N HIS A 136 6.449 24.416 12.225 1.00 21.13 N ATOM 2222 CA HIS A 136 7.251 24.692 13.420 1.00 12.23 C ATOM 2223 C HIS A 136 6.778 26.035 14.033 1.00 32.25 C ATOM 2224 O HIS A 136 7.060 27.097 13.433 1.00 0.31 O ATOM 2225 CB HIS A 136 8.760 24.740 13.052 1.00 13.45 C ATOM 2226 CG HIS A 136 9.661 24.938 14.246 1.00 71.22 C ATOM 2227 ND1 HIS A 136 9.942 26.181 14.780 1.00 60.45 N ATOM 2228 CD2 HIS A 136 10.321 24.045 15.020 1.00 21.12 C ATOM 2229 CE1 HIS A 136 10.731 26.037 15.827 1.00 43.50 C ATOM 2230 NE2 HIS A 136 10.969 24.756 15.992 1.00 35.23 N ATOM 2231 OXT HIS A 136 6.123 26.025 15.098 1.00 37.59 O ATOM 0 H HIS A 136 6.803 24.866 11.381 1.00 21.13 H new ATOM 0 HA HIS A 136 7.118 23.898 14.155 1.00 12.23 H new ATOM 0 HB2 HIS A 136 9.034 23.812 12.549 1.00 13.45 H new ATOM 0 HB3 HIS A 136 8.928 25.549 12.341 1.00 13.45 H new ATOM 0 HD2 HIS A 136 10.334 22.972 14.894 1.00 21.12 H new ATOM 0 HE1 HIS A 136 11.116 26.836 16.443 1.00 43.50 H new ATOM 0 HE2 HIS A 136 11.547 24.354 16.730 1.00 35.23 H new TER 2240 HIS A 136