USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1077 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 3 THR OG1 : rot 45:sc= 0.13 USER MOD Single : A 9 SER OG : rot 140:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0.358 K(o=0.36,f=-2.4!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 86:sc= 1.17 USER MOD Single : A 28 ASN : amide:sc= 0.753 K(o=0.75,f=-7.6!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 32:sc= 0.139 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0726) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -143:sc= 1.01 (180deg=-0.0105) USER MOD Single : A 46 LYS NZ :NH3+ 172:sc= 0.213 (180deg=0.102) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.0218 X(o=-0.022,f=-0.15) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -98:sc= 0.361 USER MOD Single : A 74 GLN : amide:sc= -0.419 K(o=-0.42,f=-1.1) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -143:sc= 0.869 (180deg=-1.27!) USER MOD Single : A 87 GLN : amide:sc= -0.543 K(o=-0.54,f=-2.9!) USER MOD Single : A 89 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0.342 X(o=0.34,f=-0.045) USER MOD Single : A 100 LYS NZ :NH3+ 146:sc= -0.379 (180deg=-1.88!) USER MOD Single : A 101 LYS NZ :NH3+ -127:sc= -0.101 (180deg=-1.16) USER MOD Single : A 109 THR OG1 : rot 115:sc= 0.593 USER MOD Single : A 111 ASN : amide:sc= -0.442 X(o=-0.44,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -178:sc= 0.778 (180deg=0.772) USER MOD Single : A 117 LYS NZ :NH3+ 164:sc= 0.427 (180deg=0.218) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 155:sc= 0.736 (180deg=0.286) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -0.074 -13.344 -1.466 1.00 3.00 N ATOM 21 CA GLY A 2 0.910 -12.303 -1.186 1.00 4.21 C ATOM 22 C GLY A 2 0.401 -10.932 -1.565 1.00 63.01 C ATOM 23 O GLY A 2 1.143 -10.118 -2.121 1.00 11.42 O ATOM 0 HA2 GLY A 2 1.162 -12.317 -0.126 1.00 4.21 H new ATOM 0 HA3 GLY A 2 1.828 -12.514 -1.734 1.00 4.21 H new ATOM 27 N THR A 3 -0.883 -10.684 -1.264 1.00 50.50 N ATOM 28 CA THR A 3 -1.554 -9.425 -1.572 1.00 24.22 C ATOM 29 C THR A 3 -1.014 -8.296 -0.671 1.00 43.43 C ATOM 30 O THR A 3 -1.312 -8.239 0.532 1.00 40.23 O ATOM 31 CB THR A 3 -3.104 -9.576 -1.426 1.00 52.31 C ATOM 32 OG1 THR A 3 -3.429 -10.189 -0.163 1.00 50.31 O ATOM 33 CG2 THR A 3 -3.705 -10.418 -2.567 1.00 41.13 C ATOM 0 H THR A 3 -1.484 -11.362 -0.796 1.00 50.50 H new ATOM 0 HA THR A 3 -1.343 -9.160 -2.608 1.00 24.22 H new ATOM 0 HB THR A 3 -3.533 -8.575 -1.474 1.00 52.31 H new ATOM 0 HG1 THR A 3 -2.895 -9.776 0.548 1.00 50.31 H new ATOM 0 HG21 THR A 3 -4.783 -10.500 -2.430 1.00 41.13 H new ATOM 0 HG22 THR A 3 -3.496 -9.937 -3.523 1.00 41.13 H new ATOM 0 HG23 THR A 3 -3.261 -11.414 -2.557 1.00 41.13 H new ATOM 41 N VAL A 4 -0.191 -7.422 -1.275 1.00 32.31 N ATOM 42 CA VAL A 4 0.436 -6.289 -0.593 1.00 52.34 C ATOM 43 C VAL A 4 -0.267 -5.039 -1.108 1.00 74.32 C ATOM 44 O VAL A 4 -0.168 -4.724 -2.297 1.00 53.00 O ATOM 45 CB VAL A 4 1.991 -6.204 -0.899 1.00 23.13 C ATOM 46 CG1 VAL A 4 2.666 -5.061 -0.099 1.00 0.13 C ATOM 47 CG2 VAL A 4 2.687 -7.560 -0.629 1.00 55.24 C ATOM 0 H VAL A 4 0.057 -7.488 -2.262 1.00 32.31 H new ATOM 0 HA VAL A 4 0.338 -6.397 0.487 1.00 52.34 H new ATOM 0 HB VAL A 4 2.104 -5.974 -1.958 1.00 23.13 H new ATOM 0 HG11 VAL A 4 3.730 -5.032 -0.333 1.00 0.13 H new ATOM 0 HG12 VAL A 4 2.209 -4.109 -0.369 1.00 0.13 H new ATOM 0 HG13 VAL A 4 2.534 -5.237 0.969 1.00 0.13 H new ATOM 0 HG21 VAL A 4 3.751 -7.472 -0.847 1.00 55.24 H new ATOM 0 HG22 VAL A 4 2.552 -7.836 0.417 1.00 55.24 H new ATOM 0 HG23 VAL A 4 2.248 -8.328 -1.266 1.00 55.24 H new ATOM 57 N VAL A 5 -0.998 -4.351 -0.227 1.00 33.33 N ATOM 58 CA VAL A 5 -1.740 -3.138 -0.583 1.00 22.44 C ATOM 59 C VAL A 5 -1.102 -1.935 0.135 1.00 44.10 C ATOM 60 O VAL A 5 -1.160 -1.811 1.352 1.00 52.23 O ATOM 61 CB VAL A 5 -3.290 -3.297 -0.279 1.00 14.54 C ATOM 62 CG1 VAL A 5 -3.939 -4.302 -1.264 1.00 61.01 C ATOM 63 CG2 VAL A 5 -3.570 -3.740 1.175 1.00 41.10 C ATOM 0 H VAL A 5 -1.092 -4.619 0.753 1.00 33.33 H new ATOM 0 HA VAL A 5 -1.674 -2.964 -1.657 1.00 22.44 H new ATOM 0 HB VAL A 5 -3.735 -2.311 -0.413 1.00 14.54 H new ATOM 0 HG11 VAL A 5 -5.001 -4.397 -1.039 1.00 61.01 H new ATOM 0 HG12 VAL A 5 -3.815 -3.942 -2.285 1.00 61.01 H new ATOM 0 HG13 VAL A 5 -3.458 -5.275 -1.161 1.00 61.01 H new ATOM 0 HG21 VAL A 5 -4.645 -3.833 1.326 1.00 41.10 H new ATOM 0 HG22 VAL A 5 -3.093 -4.702 1.360 1.00 41.10 H new ATOM 0 HG23 VAL A 5 -3.169 -2.998 1.865 1.00 41.10 H new ATOM 73 N ILE A 6 -0.461 -1.055 -0.644 1.00 44.50 N ATOM 74 CA ILE A 6 0.323 0.066 -0.114 1.00 24.54 C ATOM 75 C ILE A 6 -0.524 1.337 -0.180 1.00 44.51 C ATOM 76 O ILE A 6 -0.736 1.879 -1.266 1.00 54.11 O ATOM 77 CB ILE A 6 1.679 0.300 -0.903 1.00 3.20 C ATOM 78 CG1 ILE A 6 2.559 -1.002 -1.020 1.00 40.41 C ATOM 79 CG2 ILE A 6 2.492 1.440 -0.245 1.00 33.45 C ATOM 80 CD1 ILE A 6 2.154 -1.967 -2.128 1.00 24.53 C ATOM 0 H ILE A 6 -0.472 -1.101 -1.663 1.00 44.50 H new ATOM 0 HA ILE A 6 0.589 -0.179 0.914 1.00 24.54 H new ATOM 0 HB ILE A 6 1.405 0.584 -1.919 1.00 3.20 H new ATOM 0 HG12 ILE A 6 3.596 -0.706 -1.180 1.00 40.41 H new ATOM 0 HG13 ILE A 6 2.522 -1.532 -0.068 1.00 40.41 H new ATOM 0 HG21 ILE A 6 3.420 1.590 -0.796 1.00 33.45 H new ATOM 0 HG22 ILE A 6 1.908 2.360 -0.261 1.00 33.45 H new ATOM 0 HG23 ILE A 6 2.722 1.174 0.787 1.00 33.45 H new ATOM 0 HD11 ILE A 6 2.822 -2.828 -2.123 1.00 24.53 H new ATOM 0 HD12 ILE A 6 1.130 -2.301 -1.963 1.00 24.53 H new ATOM 0 HD13 ILE A 6 2.220 -1.463 -3.092 1.00 24.53 H new ATOM 92 N VAL A 7 -0.994 1.817 0.975 1.00 42.24 N ATOM 93 CA VAL A 7 -1.788 3.041 1.054 1.00 20.55 C ATOM 94 C VAL A 7 -0.848 4.242 1.154 1.00 41.31 C ATOM 95 O VAL A 7 -0.184 4.448 2.172 1.00 34.30 O ATOM 96 CB VAL A 7 -2.779 3.037 2.269 1.00 53.33 C ATOM 97 CG1 VAL A 7 -3.655 4.321 2.291 1.00 43.42 C ATOM 98 CG2 VAL A 7 -3.647 1.769 2.248 1.00 53.43 C ATOM 0 H VAL A 7 -0.834 1.368 1.877 1.00 42.24 H new ATOM 0 HA VAL A 7 -2.393 3.104 0.150 1.00 20.55 H new ATOM 0 HB VAL A 7 -2.191 3.033 3.187 1.00 53.33 H new ATOM 0 HG11 VAL A 7 -4.331 4.286 3.146 1.00 43.42 H new ATOM 0 HG12 VAL A 7 -3.013 5.198 2.372 1.00 43.42 H new ATOM 0 HG13 VAL A 7 -4.237 4.380 1.371 1.00 43.42 H new ATOM 0 HG21 VAL A 7 -4.330 1.781 3.098 1.00 53.43 H new ATOM 0 HG22 VAL A 7 -4.221 1.736 1.322 1.00 53.43 H new ATOM 0 HG23 VAL A 7 -3.007 0.889 2.309 1.00 53.43 H new ATOM 108 N VAL A 8 -0.763 5.000 0.061 1.00 33.34 N ATOM 109 CA VAL A 8 0.036 6.221 -0.012 1.00 34.22 C ATOM 110 C VAL A 8 -0.895 7.446 -0.048 1.00 13.05 C ATOM 111 O VAL A 8 -2.000 7.402 -0.607 1.00 13.35 O ATOM 112 CB VAL A 8 0.979 6.219 -1.267 1.00 1.44 C ATOM 113 CG1 VAL A 8 1.759 7.541 -1.394 1.00 42.31 C ATOM 114 CG2 VAL A 8 1.934 5.003 -1.255 1.00 61.21 C ATOM 0 H VAL A 8 -1.252 4.781 -0.807 1.00 33.34 H new ATOM 0 HA VAL A 8 0.668 6.268 0.875 1.00 34.22 H new ATOM 0 HB VAL A 8 0.343 6.130 -2.148 1.00 1.44 H new ATOM 0 HG11 VAL A 8 2.401 7.502 -2.274 1.00 42.31 H new ATOM 0 HG12 VAL A 8 1.057 8.369 -1.493 1.00 42.31 H new ATOM 0 HG13 VAL A 8 2.372 7.689 -0.505 1.00 42.31 H new ATOM 0 HG21 VAL A 8 2.572 5.033 -2.138 1.00 61.21 H new ATOM 0 HG22 VAL A 8 2.553 5.035 -0.358 1.00 61.21 H new ATOM 0 HG23 VAL A 8 1.351 4.082 -1.260 1.00 61.21 H new ATOM 124 N SER A 9 -0.434 8.532 0.572 1.00 14.14 N ATOM 125 CA SER A 9 -1.083 9.844 0.542 1.00 2.21 C ATOM 126 C SER A 9 0.016 10.916 0.561 1.00 61.23 C ATOM 127 O SER A 9 1.172 10.613 0.859 1.00 23.52 O ATOM 128 CB SER A 9 -2.027 10.005 1.760 1.00 72.42 C ATOM 129 OG SER A 9 -3.055 9.029 1.767 1.00 15.44 O ATOM 0 H SER A 9 0.424 8.524 1.124 1.00 14.14 H new ATOM 0 HA SER A 9 -1.688 9.947 -0.359 1.00 2.21 H new ATOM 0 HB2 SER A 9 -1.448 9.928 2.680 1.00 72.42 H new ATOM 0 HB3 SER A 9 -2.472 11.000 1.745 1.00 72.42 H new ATOM 0 HG SER A 9 -3.202 8.715 2.684 1.00 15.44 H new ATOM 135 N ASN A 10 -0.331 12.157 0.209 1.00 61.20 N ATOM 136 CA ASN A 10 0.587 13.316 0.378 1.00 54.31 C ATOM 137 C ASN A 10 0.356 13.970 1.746 1.00 60.41 C ATOM 138 O ASN A 10 1.180 14.747 2.222 1.00 71.22 O ATOM 139 CB ASN A 10 0.389 14.358 -0.758 1.00 45.05 C ATOM 140 CG ASN A 10 0.713 13.824 -2.160 1.00 24.24 C ATOM 141 OD1 ASN A 10 0.594 12.634 -2.442 1.00 44.22 O ATOM 142 ND2 ASN A 10 1.098 14.707 -3.060 1.00 22.33 N ATOM 0 H ASN A 10 -1.236 12.398 -0.195 1.00 61.20 H new ATOM 0 HA ASN A 10 1.613 12.951 0.324 1.00 54.31 H new ATOM 0 HB2 ASN A 10 -0.644 14.705 -0.743 1.00 45.05 H new ATOM 0 HB3 ASN A 10 1.019 15.224 -0.556 1.00 45.05 H new ATOM 0 HD21 ASN A 10 1.304 14.407 -4.013 1.00 22.33 H new ATOM 0 HD22 ASN A 10 1.190 15.690 -2.803 1.00 22.33 H new ATOM 149 N ASP A 11 -0.778 13.624 2.368 1.00 40.10 N ATOM 150 CA ASP A 11 -1.213 14.171 3.662 1.00 12.23 C ATOM 151 C ASP A 11 -0.931 13.149 4.783 1.00 15.41 C ATOM 152 O ASP A 11 -0.966 11.929 4.556 1.00 25.00 O ATOM 153 CB ASP A 11 -2.721 14.518 3.565 1.00 2.10 C ATOM 154 CG ASP A 11 -3.285 15.302 4.773 1.00 23.54 C ATOM 155 OD1 ASP A 11 -3.532 14.691 5.835 1.00 52.20 O ATOM 156 OD2 ASP A 11 -3.518 16.525 4.653 1.00 72.40 O ATOM 0 H ASP A 11 -1.432 12.944 1.980 1.00 40.10 H new ATOM 0 HA ASP A 11 -0.660 15.079 3.904 1.00 12.23 H new ATOM 0 HB2 ASP A 11 -2.887 15.103 2.660 1.00 2.10 H new ATOM 0 HB3 ASP A 11 -3.286 13.592 3.455 1.00 2.10 H new ATOM 161 N GLU A 12 -0.674 13.677 5.988 1.00 31.20 N ATOM 162 CA GLU A 12 -0.279 12.892 7.177 1.00 43.24 C ATOM 163 C GLU A 12 -1.516 12.255 7.838 1.00 1.34 C ATOM 164 O GLU A 12 -1.548 11.047 8.109 1.00 35.52 O ATOM 165 CB GLU A 12 0.462 13.819 8.188 1.00 42.22 C ATOM 166 CG GLU A 12 1.682 14.559 7.597 1.00 32.43 C ATOM 167 CD GLU A 12 2.356 15.531 8.583 1.00 2.31 C ATOM 168 OE1 GLU A 12 3.241 15.100 9.357 1.00 62.43 O ATOM 169 OE2 GLU A 12 2.003 16.735 8.595 1.00 71.45 O ATOM 0 H GLU A 12 -0.734 14.678 6.172 1.00 31.20 H new ATOM 0 HA GLU A 12 0.391 12.090 6.869 1.00 43.24 H new ATOM 0 HB2 GLU A 12 -0.244 14.556 8.572 1.00 42.22 H new ATOM 0 HB3 GLU A 12 0.792 13.220 9.037 1.00 42.22 H new ATOM 0 HG2 GLU A 12 2.416 13.824 7.267 1.00 32.43 H new ATOM 0 HG3 GLU A 12 1.366 15.113 6.713 1.00 32.43 H new ATOM 176 N ARG A 13 -2.538 13.101 8.046 1.00 4.22 N ATOM 177 CA ARG A 13 -3.791 12.754 8.744 1.00 10.20 C ATOM 178 C ARG A 13 -4.644 11.762 7.949 1.00 31.31 C ATOM 179 O ARG A 13 -5.437 11.025 8.534 1.00 52.41 O ATOM 180 CB ARG A 13 -4.605 14.039 9.001 1.00 34.14 C ATOM 181 CG ARG A 13 -3.899 15.072 9.910 1.00 44.01 C ATOM 182 CD ARG A 13 -4.432 16.504 9.696 1.00 44.45 C ATOM 183 NE ARG A 13 -4.091 17.014 8.345 1.00 70.11 N ATOM 184 CZ ARG A 13 -3.263 18.043 8.083 1.00 3.31 C ATOM 185 NH1 ARG A 13 -2.668 18.716 9.066 1.00 63.31 N ATOM 186 NH2 ARG A 13 -3.028 18.395 6.825 1.00 53.52 N ATOM 0 H ARG A 13 -2.517 14.069 7.726 1.00 4.22 H new ATOM 0 HA ARG A 13 -3.522 12.275 9.685 1.00 10.20 H new ATOM 0 HB2 ARG A 13 -4.830 14.509 8.044 1.00 34.14 H new ATOM 0 HB3 ARG A 13 -5.558 13.766 9.454 1.00 34.14 H new ATOM 0 HG2 ARG A 13 -4.037 14.788 10.953 1.00 44.01 H new ATOM 0 HG3 ARG A 13 -2.827 15.053 9.713 1.00 44.01 H new ATOM 0 HD2 ARG A 13 -5.514 16.514 9.828 1.00 44.45 H new ATOM 0 HD3 ARG A 13 -4.012 17.167 10.453 1.00 44.45 H new ATOM 0 HE ARG A 13 -4.520 16.545 7.547 1.00 70.11 H new ATOM 0 HH11 ARG A 13 -2.836 18.455 10.038 1.00 63.31 H new ATOM 0 HH12 ARG A 13 -2.044 19.493 8.847 1.00 63.31 H new ATOM 0 HH21 ARG A 13 -3.474 17.887 6.061 1.00 53.52 H new ATOM 0 HH22 ARG A 13 -2.401 19.174 6.622 1.00 53.52 H new ATOM 200 N ILE A 14 -4.503 11.781 6.611 1.00 42.52 N ATOM 201 CA ILE A 14 -5.237 10.859 5.732 1.00 12.44 C ATOM 202 C ILE A 14 -4.760 9.412 5.970 1.00 52.30 C ATOM 203 O ILE A 14 -5.579 8.512 6.053 1.00 21.14 O ATOM 204 CB ILE A 14 -5.126 11.281 4.214 1.00 50.00 C ATOM 205 CG1 ILE A 14 -5.817 12.667 3.983 1.00 44.11 C ATOM 206 CG2 ILE A 14 -5.716 10.214 3.257 1.00 31.43 C ATOM 207 CD1 ILE A 14 -7.286 12.742 4.395 1.00 35.22 C ATOM 0 H ILE A 14 -3.886 12.426 6.117 1.00 42.52 H new ATOM 0 HA ILE A 14 -6.296 10.912 5.984 1.00 12.44 H new ATOM 0 HB ILE A 14 -4.065 11.365 3.981 1.00 50.00 H new ATOM 0 HG12 ILE A 14 -5.263 13.427 4.534 1.00 44.11 H new ATOM 0 HG13 ILE A 14 -5.740 12.921 2.926 1.00 44.11 H new ATOM 0 HG21 ILE A 14 -5.614 10.554 2.226 1.00 31.43 H new ATOM 0 HG22 ILE A 14 -5.179 9.274 3.384 1.00 31.43 H new ATOM 0 HG23 ILE A 14 -6.771 10.063 3.487 1.00 31.43 H new ATOM 0 HD11 ILE A 14 -7.670 13.742 4.194 1.00 35.22 H new ATOM 0 HD12 ILE A 14 -7.861 12.012 3.826 1.00 35.22 H new ATOM 0 HD13 ILE A 14 -7.377 12.526 5.459 1.00 35.22 H new ATOM 219 N LEU A 15 -3.438 9.212 6.154 1.00 15.32 N ATOM 220 CA LEU A 15 -2.887 7.885 6.517 1.00 2.53 C ATOM 221 C LEU A 15 -3.424 7.417 7.881 1.00 41.21 C ATOM 222 O LEU A 15 -3.699 6.233 8.069 1.00 44.12 O ATOM 223 CB LEU A 15 -1.338 7.909 6.558 1.00 42.34 C ATOM 224 CG LEU A 15 -0.622 8.107 5.193 1.00 31.33 C ATOM 225 CD1 LEU A 15 0.901 8.154 5.391 1.00 20.05 C ATOM 226 CD2 LEU A 15 -1.024 7.006 4.179 1.00 51.40 C ATOM 0 H LEU A 15 -2.735 9.945 6.059 1.00 15.32 H new ATOM 0 HA LEU A 15 -3.209 7.185 5.746 1.00 2.53 H new ATOM 0 HB2 LEU A 15 -1.025 8.709 7.229 1.00 42.34 H new ATOM 0 HB3 LEU A 15 -0.992 6.972 6.995 1.00 42.34 H new ATOM 0 HG LEU A 15 -0.943 9.062 4.776 1.00 31.33 H new ATOM 0 HD11 LEU A 15 1.389 8.293 4.426 1.00 20.05 H new ATOM 0 HD12 LEU A 15 1.157 8.984 6.050 1.00 20.05 H new ATOM 0 HD13 LEU A 15 1.239 7.219 5.837 1.00 20.05 H new ATOM 0 HD21 LEU A 15 -0.506 7.174 3.235 1.00 51.40 H new ATOM 0 HD22 LEU A 15 -0.749 6.029 4.575 1.00 51.40 H new ATOM 0 HD23 LEU A 15 -2.101 7.040 4.013 1.00 51.40 H new ATOM 238 N GLU A 16 -3.552 8.369 8.822 1.00 64.12 N ATOM 239 CA GLU A 16 -3.981 8.094 10.205 1.00 51.34 C ATOM 240 C GLU A 16 -5.463 7.680 10.256 1.00 13.34 C ATOM 241 O GLU A 16 -5.815 6.665 10.876 1.00 2.34 O ATOM 242 CB GLU A 16 -3.702 9.334 11.099 1.00 71.11 C ATOM 243 CG GLU A 16 -2.217 9.738 11.119 1.00 12.51 C ATOM 244 CD GLU A 16 -1.914 10.921 12.048 1.00 62.31 C ATOM 245 OE1 GLU A 16 -2.209 12.076 11.676 1.00 14.02 O ATOM 246 OE2 GLU A 16 -1.377 10.702 13.158 1.00 31.23 O ATOM 0 H GLU A 16 -3.360 9.355 8.644 1.00 64.12 H new ATOM 0 HA GLU A 16 -3.404 7.254 10.592 1.00 51.34 H new ATOM 0 HB2 GLU A 16 -4.297 10.174 10.741 1.00 71.11 H new ATOM 0 HB3 GLU A 16 -4.029 9.122 12.117 1.00 71.11 H new ATOM 0 HG2 GLU A 16 -1.620 8.881 11.430 1.00 12.51 H new ATOM 0 HG3 GLU A 16 -1.905 9.993 10.106 1.00 12.51 H new ATOM 253 N GLU A 17 -6.309 8.449 9.556 1.00 73.44 N ATOM 254 CA GLU A 17 -7.759 8.205 9.476 1.00 73.01 C ATOM 255 C GLU A 17 -8.067 6.957 8.617 1.00 61.34 C ATOM 256 O GLU A 17 -9.066 6.285 8.828 1.00 42.43 O ATOM 257 CB GLU A 17 -8.476 9.466 8.924 1.00 22.12 C ATOM 258 CG GLU A 17 -10.013 9.361 8.869 1.00 43.42 C ATOM 259 CD GLU A 17 -10.701 10.704 8.600 1.00 55.13 C ATOM 260 OE1 GLU A 17 -10.835 11.088 7.417 1.00 3.10 O ATOM 261 OE2 GLU A 17 -11.104 11.386 9.572 1.00 11.40 O ATOM 0 H GLU A 17 -6.005 9.265 9.025 1.00 73.44 H new ATOM 0 HA GLU A 17 -8.137 8.005 10.478 1.00 73.01 H new ATOM 0 HB2 GLU A 17 -8.206 10.321 9.543 1.00 22.12 H new ATOM 0 HB3 GLU A 17 -8.103 9.669 7.920 1.00 22.12 H new ATOM 0 HG2 GLU A 17 -10.295 8.653 8.089 1.00 43.42 H new ATOM 0 HG3 GLU A 17 -10.377 8.956 9.813 1.00 43.42 H new ATOM 268 N LEU A 18 -7.213 6.678 7.630 1.00 32.43 N ATOM 269 CA LEU A 18 -7.307 5.454 6.801 1.00 31.05 C ATOM 270 C LEU A 18 -6.755 4.218 7.544 1.00 22.01 C ATOM 271 O LEU A 18 -7.182 3.090 7.253 1.00 62.13 O ATOM 272 CB LEU A 18 -6.628 5.667 5.418 1.00 60.51 C ATOM 273 CG LEU A 18 -7.530 6.284 4.282 1.00 12.52 C ATOM 274 CD1 LEU A 18 -8.283 7.563 4.731 1.00 31.33 C ATOM 275 CD2 LEU A 18 -6.686 6.549 3.017 1.00 11.04 C ATOM 0 H LEU A 18 -6.435 7.287 7.376 1.00 32.43 H new ATOM 0 HA LEU A 18 -8.362 5.254 6.614 1.00 31.05 H new ATOM 0 HB2 LEU A 18 -5.764 6.316 5.558 1.00 60.51 H new ATOM 0 HB3 LEU A 18 -6.251 4.705 5.071 1.00 60.51 H new ATOM 0 HG LEU A 18 -8.300 5.548 4.050 1.00 12.52 H new ATOM 0 HD11 LEU A 18 -8.886 7.939 3.905 1.00 31.33 H new ATOM 0 HD12 LEU A 18 -8.931 7.326 5.575 1.00 31.33 H new ATOM 0 HD13 LEU A 18 -7.562 8.324 5.030 1.00 31.33 H new ATOM 0 HD21 LEU A 18 -7.320 6.975 2.239 1.00 11.04 H new ATOM 0 HD22 LEU A 18 -5.884 7.248 3.255 1.00 11.04 H new ATOM 0 HD23 LEU A 18 -6.257 5.612 2.663 1.00 11.04 H new ATOM 287 N LEU A 19 -5.792 4.427 8.485 1.00 41.24 N ATOM 288 CA LEU A 19 -5.213 3.319 9.289 1.00 73.20 C ATOM 289 C LEU A 19 -6.307 2.631 10.081 1.00 73.32 C ATOM 290 O LEU A 19 -6.451 1.414 10.013 1.00 1.12 O ATOM 291 CB LEU A 19 -4.117 3.791 10.284 1.00 4.42 C ATOM 292 CG LEU A 19 -3.475 2.644 11.159 1.00 1.33 C ATOM 293 CD1 LEU A 19 -2.477 1.790 10.349 1.00 42.34 C ATOM 294 CD2 LEU A 19 -2.843 3.180 12.457 1.00 14.40 C ATOM 0 H LEU A 19 -5.405 5.345 8.702 1.00 41.24 H new ATOM 0 HA LEU A 19 -4.748 2.637 8.577 1.00 73.20 H new ATOM 0 HB2 LEU A 19 -3.325 4.286 9.722 1.00 4.42 H new ATOM 0 HB3 LEU A 19 -4.549 4.538 10.950 1.00 4.42 H new ATOM 0 HG LEU A 19 -4.294 1.988 11.456 1.00 1.33 H new ATOM 0 HD11 LEU A 19 -2.059 1.013 10.989 1.00 42.34 H new ATOM 0 HD12 LEU A 19 -2.993 1.328 9.507 1.00 42.34 H new ATOM 0 HD13 LEU A 19 -1.673 2.425 9.977 1.00 42.34 H new ATOM 0 HD21 LEU A 19 -2.416 2.352 13.023 1.00 14.40 H new ATOM 0 HD22 LEU A 19 -2.058 3.895 12.211 1.00 14.40 H new ATOM 0 HD23 LEU A 19 -3.608 3.673 13.057 1.00 14.40 H new ATOM 306 N GLU A 20 -7.080 3.451 10.810 1.00 4.34 N ATOM 307 CA GLU A 20 -8.162 2.975 11.667 1.00 35.11 C ATOM 308 C GLU A 20 -9.249 2.254 10.860 1.00 32.14 C ATOM 309 O GLU A 20 -9.858 1.344 11.377 1.00 0.12 O ATOM 310 CB GLU A 20 -8.768 4.138 12.483 1.00 31.34 C ATOM 311 CG GLU A 20 -9.399 5.250 11.638 1.00 74.32 C ATOM 312 CD GLU A 20 -10.023 6.368 12.474 1.00 34.25 C ATOM 313 OE1 GLU A 20 -9.284 7.278 12.909 1.00 1.41 O ATOM 314 OE2 GLU A 20 -11.248 6.327 12.725 1.00 33.04 O ATOM 0 H GLU A 20 -6.967 4.465 10.817 1.00 4.34 H new ATOM 0 HA GLU A 20 -7.735 2.252 12.362 1.00 35.11 H new ATOM 0 HB2 GLU A 20 -9.526 3.736 13.155 1.00 31.34 H new ATOM 0 HB3 GLU A 20 -7.987 4.573 13.107 1.00 31.34 H new ATOM 0 HG2 GLU A 20 -8.638 5.676 10.985 1.00 74.32 H new ATOM 0 HG3 GLU A 20 -10.165 4.817 10.994 1.00 74.32 H new ATOM 321 N VAL A 21 -9.456 2.662 9.588 1.00 41.41 N ATOM 322 CA VAL A 21 -10.438 2.012 8.691 1.00 64.44 C ATOM 323 C VAL A 21 -10.068 0.537 8.471 1.00 43.34 C ATOM 324 O VAL A 21 -10.879 -0.355 8.714 1.00 53.33 O ATOM 325 CB VAL A 21 -10.526 2.744 7.298 1.00 41.54 C ATOM 326 CG1 VAL A 21 -11.465 2.007 6.312 1.00 31.22 C ATOM 327 CG2 VAL A 21 -10.959 4.208 7.483 1.00 32.30 C ATOM 0 H VAL A 21 -8.955 3.440 9.159 1.00 41.41 H new ATOM 0 HA VAL A 21 -11.413 2.077 9.175 1.00 64.44 H new ATOM 0 HB VAL A 21 -9.529 2.730 6.858 1.00 41.54 H new ATOM 0 HG11 VAL A 21 -11.495 2.547 5.366 1.00 31.22 H new ATOM 0 HG12 VAL A 21 -11.093 0.997 6.142 1.00 31.22 H new ATOM 0 HG13 VAL A 21 -12.469 1.958 6.734 1.00 31.22 H new ATOM 0 HG21 VAL A 21 -11.014 4.697 6.510 1.00 32.30 H new ATOM 0 HG22 VAL A 21 -11.938 4.240 7.961 1.00 32.30 H new ATOM 0 HG23 VAL A 21 -10.232 4.726 8.109 1.00 32.30 H new ATOM 337 N VAL A 22 -8.813 0.308 8.059 1.00 3.14 N ATOM 338 CA VAL A 22 -8.274 -1.041 7.817 1.00 24.55 C ATOM 339 C VAL A 22 -8.228 -1.850 9.128 1.00 65.33 C ATOM 340 O VAL A 22 -8.682 -2.998 9.195 1.00 63.52 O ATOM 341 CB VAL A 22 -6.829 -0.965 7.198 1.00 64.15 C ATOM 342 CG1 VAL A 22 -6.238 -2.375 6.968 1.00 3.22 C ATOM 343 CG2 VAL A 22 -6.828 -0.140 5.886 1.00 74.33 C ATOM 0 H VAL A 22 -8.140 1.054 7.883 1.00 3.14 H new ATOM 0 HA VAL A 22 -8.936 -1.541 7.110 1.00 24.55 H new ATOM 0 HB VAL A 22 -6.189 -0.454 7.917 1.00 64.15 H new ATOM 0 HG11 VAL A 22 -5.240 -2.286 6.540 1.00 3.22 H new ATOM 0 HG12 VAL A 22 -6.179 -2.904 7.919 1.00 3.22 H new ATOM 0 HG13 VAL A 22 -6.878 -2.931 6.283 1.00 3.22 H new ATOM 0 HG21 VAL A 22 -5.817 -0.104 5.480 1.00 74.33 H new ATOM 0 HG22 VAL A 22 -7.494 -0.608 5.161 1.00 74.33 H new ATOM 0 HG23 VAL A 22 -7.172 0.873 6.093 1.00 74.33 H new ATOM 353 N LEU A 23 -7.711 -1.183 10.165 1.00 21.53 N ATOM 354 CA LEU A 23 -7.428 -1.774 11.476 1.00 63.44 C ATOM 355 C LEU A 23 -8.725 -2.222 12.196 1.00 33.13 C ATOM 356 O LEU A 23 -8.752 -3.283 12.827 1.00 74.24 O ATOM 357 CB LEU A 23 -6.635 -0.738 12.318 1.00 72.41 C ATOM 358 CG LEU A 23 -5.977 -1.257 13.626 1.00 51.34 C ATOM 359 CD1 LEU A 23 -4.860 -2.280 13.346 1.00 14.22 C ATOM 360 CD2 LEU A 23 -5.451 -0.083 14.474 1.00 44.34 C ATOM 0 H LEU A 23 -7.472 -0.193 10.114 1.00 21.53 H new ATOM 0 HA LEU A 23 -6.829 -2.675 11.346 1.00 63.44 H new ATOM 0 HB2 LEU A 23 -5.852 -0.316 11.688 1.00 72.41 H new ATOM 0 HB3 LEU A 23 -7.310 0.078 12.577 1.00 72.41 H new ATOM 0 HG LEU A 23 -6.749 -1.776 14.194 1.00 51.34 H new ATOM 0 HD11 LEU A 23 -4.429 -2.615 14.289 1.00 14.22 H new ATOM 0 HD12 LEU A 23 -5.275 -3.135 12.813 1.00 14.22 H new ATOM 0 HD13 LEU A 23 -4.084 -1.815 12.738 1.00 14.22 H new ATOM 0 HD21 LEU A 23 -4.994 -0.469 15.385 1.00 44.34 H new ATOM 0 HD22 LEU A 23 -4.708 0.474 13.903 1.00 44.34 H new ATOM 0 HD23 LEU A 23 -6.278 0.577 14.734 1.00 44.34 H new ATOM 372 N LYS A 24 -9.806 -1.422 12.068 1.00 23.20 N ATOM 373 CA LYS A 24 -11.098 -1.697 12.747 1.00 44.12 C ATOM 374 C LYS A 24 -11.912 -2.740 11.969 1.00 11.42 C ATOM 375 O LYS A 24 -12.671 -3.510 12.565 1.00 42.32 O ATOM 376 CB LYS A 24 -11.939 -0.392 12.938 1.00 32.34 C ATOM 377 CG LYS A 24 -12.660 0.149 11.668 1.00 10.10 C ATOM 378 CD LYS A 24 -13.232 1.578 11.847 1.00 62.53 C ATOM 379 CE LYS A 24 -14.296 1.680 12.952 1.00 21.05 C ATOM 380 NZ LYS A 24 -14.737 3.088 13.163 1.00 25.21 N ATOM 0 H LYS A 24 -9.812 -0.576 11.498 1.00 23.20 H new ATOM 0 HA LYS A 24 -10.866 -2.096 13.735 1.00 44.12 H new ATOM 0 HB2 LYS A 24 -12.690 -0.577 13.706 1.00 32.34 H new ATOM 0 HB3 LYS A 24 -11.280 0.389 13.317 1.00 32.34 H new ATOM 0 HG2 LYS A 24 -11.959 0.148 10.833 1.00 10.10 H new ATOM 0 HG3 LYS A 24 -13.472 -0.529 11.404 1.00 10.10 H new ATOM 0 HD2 LYS A 24 -12.415 2.262 12.077 1.00 62.53 H new ATOM 0 HD3 LYS A 24 -13.667 1.907 10.903 1.00 62.53 H new ATOM 0 HE2 LYS A 24 -15.156 1.065 12.687 1.00 21.05 H new ATOM 0 HE3 LYS A 24 -13.893 1.281 13.883 1.00 21.05 H new ATOM 0 HZ1 LYS A 24 -15.455 3.118 13.915 1.00 25.21 H new ATOM 0 HZ2 LYS A 24 -13.921 3.670 13.440 1.00 25.21 H new ATOM 0 HZ3 LYS A 24 -15.144 3.460 12.281 1.00 25.21 H new ATOM 394 N SER A 25 -11.760 -2.741 10.628 1.00 62.32 N ATOM 395 CA SER A 25 -12.455 -3.689 9.743 1.00 70.34 C ATOM 396 C SER A 25 -11.920 -5.121 9.948 1.00 31.12 C ATOM 397 O SER A 25 -12.671 -6.101 9.819 1.00 1.51 O ATOM 398 CB SER A 25 -12.314 -3.247 8.273 1.00 53.54 C ATOM 399 OG SER A 25 -12.966 -2.011 8.032 1.00 75.31 O ATOM 0 H SER A 25 -11.154 -2.086 10.134 1.00 62.32 H new ATOM 0 HA SER A 25 -13.515 -3.692 9.998 1.00 70.34 H new ATOM 0 HB2 SER A 25 -11.258 -3.157 8.020 1.00 53.54 H new ATOM 0 HB3 SER A 25 -12.734 -4.013 7.621 1.00 53.54 H new ATOM 0 HG SER A 25 -12.358 -1.273 8.246 1.00 75.31 H new ATOM 405 N ASP A 26 -10.618 -5.220 10.273 1.00 42.43 N ATOM 406 CA ASP A 26 -9.986 -6.475 10.707 1.00 0.10 C ATOM 407 C ASP A 26 -8.648 -6.154 11.406 1.00 53.51 C ATOM 408 O ASP A 26 -7.744 -5.595 10.773 1.00 44.40 O ATOM 409 CB ASP A 26 -9.757 -7.454 9.525 1.00 44.21 C ATOM 410 CG ASP A 26 -9.279 -8.848 9.995 1.00 61.42 C ATOM 411 OD1 ASP A 26 -8.063 -9.062 10.116 1.00 61.41 O ATOM 412 OD2 ASP A 26 -10.130 -9.738 10.243 1.00 3.14 O ATOM 0 H ASP A 26 -9.975 -4.429 10.241 1.00 42.43 H new ATOM 0 HA ASP A 26 -10.661 -6.972 11.404 1.00 0.10 H new ATOM 0 HB2 ASP A 26 -10.684 -7.562 8.962 1.00 44.21 H new ATOM 0 HB3 ASP A 26 -9.018 -7.030 8.844 1.00 44.21 H new ATOM 417 N PRO A 27 -8.504 -6.496 12.726 1.00 44.01 N ATOM 418 CA PRO A 27 -7.275 -6.202 13.507 1.00 40.51 C ATOM 419 C PRO A 27 -6.107 -7.171 13.200 1.00 22.21 C ATOM 420 O PRO A 27 -4.954 -6.887 13.543 1.00 64.04 O ATOM 421 CB PRO A 27 -7.768 -6.360 14.965 1.00 61.14 C ATOM 422 CG PRO A 27 -8.820 -7.423 14.883 1.00 52.21 C ATOM 423 CD PRO A 27 -9.537 -7.173 13.574 1.00 24.24 C ATOM 0 HA PRO A 27 -6.860 -5.221 13.276 1.00 40.51 H new ATOM 0 HB2 PRO A 27 -6.956 -6.653 15.630 1.00 61.14 H new ATOM 0 HB3 PRO A 27 -8.175 -5.426 15.351 1.00 61.14 H new ATOM 0 HG2 PRO A 27 -8.376 -8.418 14.905 1.00 52.21 H new ATOM 0 HG3 PRO A 27 -9.508 -7.362 15.726 1.00 52.21 H new ATOM 0 HD2 PRO A 27 -9.879 -8.103 13.121 1.00 24.24 H new ATOM 0 HD3 PRO A 27 -10.416 -6.544 13.713 1.00 24.24 H new ATOM 431 N ASN A 28 -6.422 -8.310 12.563 1.00 64.23 N ATOM 432 CA ASN A 28 -5.463 -9.409 12.329 1.00 63.22 C ATOM 433 C ASN A 28 -4.670 -9.191 11.015 1.00 1.43 C ATOM 434 O ASN A 28 -3.627 -9.825 10.801 1.00 35.42 O ATOM 435 CB ASN A 28 -6.255 -10.740 12.305 1.00 34.22 C ATOM 436 CG ASN A 28 -5.392 -11.998 12.260 1.00 30.21 C ATOM 437 OD1 ASN A 28 -4.313 -12.058 12.850 1.00 54.31 O ATOM 438 ND2 ASN A 28 -5.869 -13.011 11.563 1.00 33.54 N ATOM 0 H ASN A 28 -7.354 -8.498 12.193 1.00 64.23 H new ATOM 0 HA ASN A 28 -4.725 -9.438 13.131 1.00 63.22 H new ATOM 0 HB2 ASN A 28 -6.891 -10.784 13.189 1.00 34.22 H new ATOM 0 HB3 ASN A 28 -6.915 -10.738 11.438 1.00 34.22 H new ATOM 0 HD21 ASN A 28 -5.340 -13.881 11.500 1.00 33.54 H new ATOM 0 HD22 ASN A 28 -6.767 -12.925 11.087 1.00 33.54 H new ATOM 445 N VAL A 29 -5.176 -8.294 10.139 1.00 11.14 N ATOM 446 CA VAL A 29 -4.456 -7.841 8.930 1.00 3.35 C ATOM 447 C VAL A 29 -3.206 -7.037 9.347 1.00 14.33 C ATOM 448 O VAL A 29 -3.273 -6.228 10.284 1.00 72.33 O ATOM 449 CB VAL A 29 -5.384 -6.979 7.979 1.00 0.52 C ATOM 450 CG1 VAL A 29 -4.591 -6.322 6.824 1.00 52.31 C ATOM 451 CG2 VAL A 29 -6.532 -7.844 7.408 1.00 32.32 C ATOM 0 H VAL A 29 -6.094 -7.865 10.251 1.00 11.14 H new ATOM 0 HA VAL A 29 -4.151 -8.721 8.364 1.00 3.35 H new ATOM 0 HB VAL A 29 -5.804 -6.178 8.587 1.00 0.52 H new ATOM 0 HG11 VAL A 29 -5.271 -5.742 6.200 1.00 52.31 H new ATOM 0 HG12 VAL A 29 -3.826 -5.664 7.236 1.00 52.31 H new ATOM 0 HG13 VAL A 29 -4.117 -7.097 6.221 1.00 52.31 H new ATOM 0 HG21 VAL A 29 -7.158 -7.234 6.757 1.00 32.32 H new ATOM 0 HG22 VAL A 29 -6.114 -8.672 6.836 1.00 32.32 H new ATOM 0 HG23 VAL A 29 -7.134 -8.236 8.227 1.00 32.32 H new ATOM 461 N LYS A 30 -2.080 -7.284 8.654 1.00 60.13 N ATOM 462 CA LYS A 30 -0.767 -6.699 8.974 1.00 72.20 C ATOM 463 C LYS A 30 -0.714 -5.197 8.584 1.00 61.34 C ATOM 464 O LYS A 30 -0.273 -4.836 7.492 1.00 15.24 O ATOM 465 CB LYS A 30 0.343 -7.541 8.261 1.00 41.23 C ATOM 466 CG LYS A 30 1.808 -7.106 8.525 1.00 52.34 C ATOM 467 CD LYS A 30 2.187 -7.120 10.021 1.00 20.32 C ATOM 468 CE LYS A 30 2.182 -8.530 10.635 1.00 62.44 C ATOM 469 NZ LYS A 30 2.140 -8.479 12.121 1.00 4.55 N ATOM 0 H LYS A 30 -2.057 -7.904 7.845 1.00 60.13 H new ATOM 0 HA LYS A 30 -0.594 -6.736 10.050 1.00 72.20 H new ATOM 0 HB2 LYS A 30 0.234 -8.581 8.568 1.00 41.23 H new ATOM 0 HB3 LYS A 30 0.163 -7.505 7.187 1.00 41.23 H new ATOM 0 HG2 LYS A 30 2.481 -7.769 7.980 1.00 52.34 H new ATOM 0 HG3 LYS A 30 1.959 -6.102 8.128 1.00 52.34 H new ATOM 0 HD2 LYS A 30 3.178 -6.682 10.142 1.00 20.32 H new ATOM 0 HD3 LYS A 30 1.490 -6.489 10.572 1.00 20.32 H new ATOM 0 HE2 LYS A 30 1.321 -9.086 10.265 1.00 62.44 H new ATOM 0 HE3 LYS A 30 3.072 -9.071 10.314 1.00 62.44 H new ATOM 0 HZ1 LYS A 30 2.138 -9.447 12.502 1.00 4.55 H new ATOM 0 HZ2 LYS A 30 2.975 -7.970 12.475 1.00 4.55 H new ATOM 0 HZ3 LYS A 30 1.278 -7.985 12.427 1.00 4.55 H new ATOM 483 N THR A 31 -1.224 -4.343 9.485 1.00 51.20 N ATOM 484 CA THR A 31 -1.225 -2.879 9.318 1.00 75.52 C ATOM 485 C THR A 31 0.149 -2.313 9.745 1.00 41.43 C ATOM 486 O THR A 31 0.494 -2.321 10.935 1.00 62.12 O ATOM 487 CB THR A 31 -2.367 -2.224 10.171 1.00 33.12 C ATOM 488 OG1 THR A 31 -2.215 -2.594 11.547 1.00 21.25 O ATOM 489 CG2 THR A 31 -3.775 -2.632 9.700 1.00 32.34 C ATOM 0 H THR A 31 -1.652 -4.651 10.358 1.00 51.20 H new ATOM 0 HA THR A 31 -1.406 -2.643 8.269 1.00 75.52 H new ATOM 0 HB THR A 31 -2.275 -1.145 10.044 1.00 33.12 H new ATOM 0 HG1 THR A 31 -1.263 -2.699 11.754 1.00 21.25 H new ATOM 0 HG21 THR A 31 -4.523 -2.148 10.328 1.00 32.34 H new ATOM 0 HG22 THR A 31 -3.916 -2.323 8.664 1.00 32.34 H new ATOM 0 HG23 THR A 31 -3.884 -3.714 9.774 1.00 32.34 H new ATOM 497 N VAL A 32 0.943 -1.861 8.761 1.00 54.31 N ATOM 498 CA VAL A 32 2.301 -1.330 8.995 1.00 40.10 C ATOM 499 C VAL A 32 2.431 0.078 8.373 1.00 23.14 C ATOM 500 O VAL A 32 2.361 0.230 7.155 1.00 43.42 O ATOM 501 CB VAL A 32 3.392 -2.308 8.379 1.00 54.42 C ATOM 502 CG1 VAL A 32 4.825 -1.735 8.479 1.00 72.21 C ATOM 503 CG2 VAL A 32 3.328 -3.712 9.031 1.00 43.33 C ATOM 0 H VAL A 32 0.664 -1.852 7.780 1.00 54.31 H new ATOM 0 HA VAL A 32 2.470 -1.258 10.069 1.00 40.10 H new ATOM 0 HB VAL A 32 3.151 -2.405 7.320 1.00 54.42 H new ATOM 0 HG11 VAL A 32 5.531 -2.442 8.044 1.00 72.21 H new ATOM 0 HG12 VAL A 32 4.878 -0.790 7.938 1.00 72.21 H new ATOM 0 HG13 VAL A 32 5.078 -1.568 9.526 1.00 72.21 H new ATOM 0 HG21 VAL A 32 4.088 -4.355 8.586 1.00 43.33 H new ATOM 0 HG22 VAL A 32 3.509 -3.624 10.102 1.00 43.33 H new ATOM 0 HG23 VAL A 32 2.342 -4.146 8.864 1.00 43.33 H new ATOM 513 N ARG A 33 2.598 1.107 9.226 1.00 24.52 N ATOM 514 CA ARG A 33 3.033 2.451 8.793 1.00 40.45 C ATOM 515 C ARG A 33 4.477 2.631 9.257 1.00 4.13 C ATOM 516 O ARG A 33 4.733 2.875 10.441 1.00 4.01 O ATOM 517 CB ARG A 33 2.116 3.574 9.355 1.00 42.25 C ATOM 518 CG ARG A 33 2.586 5.021 9.012 1.00 11.12 C ATOM 519 CD ARG A 33 1.436 6.045 8.974 1.00 2.43 C ATOM 520 NE ARG A 33 0.680 6.108 10.241 1.00 55.13 N ATOM 521 CZ ARG A 33 -0.629 5.854 10.374 1.00 62.42 C ATOM 522 NH1 ARG A 33 -1.355 5.495 9.318 1.00 62.12 N ATOM 523 NH2 ARG A 33 -1.207 5.966 11.563 1.00 2.44 N ATOM 0 H ARG A 33 2.436 1.032 10.230 1.00 24.52 H new ATOM 0 HA ARG A 33 2.964 2.530 7.708 1.00 40.45 H new ATOM 0 HB2 ARG A 33 1.107 3.431 8.967 1.00 42.25 H new ATOM 0 HB3 ARG A 33 2.058 3.471 10.439 1.00 42.25 H new ATOM 0 HG2 ARG A 33 3.323 5.340 9.749 1.00 11.12 H new ATOM 0 HG3 ARG A 33 3.087 5.012 8.044 1.00 11.12 H new ATOM 0 HD2 ARG A 33 1.842 7.031 8.750 1.00 2.43 H new ATOM 0 HD3 ARG A 33 0.755 5.789 8.163 1.00 2.43 H new ATOM 0 HE ARG A 33 1.196 6.366 11.083 1.00 55.13 H new ATOM 0 HH11 ARG A 33 -0.915 5.412 8.401 1.00 62.12 H new ATOM 0 HH12 ARG A 33 -2.351 5.303 9.425 1.00 62.12 H new ATOM 0 HH21 ARG A 33 -0.655 6.245 12.374 1.00 2.44 H new ATOM 0 HH22 ARG A 33 -2.203 5.773 11.666 1.00 2.44 H new ATOM 537 N THR A 34 5.414 2.453 8.325 1.00 0.20 N ATOM 538 CA THR A 34 6.845 2.407 8.632 1.00 2.24 C ATOM 539 C THR A 34 7.648 3.004 7.469 1.00 60.32 C ATOM 540 O THR A 34 7.508 2.577 6.314 1.00 34.35 O ATOM 541 CB THR A 34 7.275 0.929 8.934 1.00 61.34 C ATOM 542 OG1 THR A 34 6.621 0.488 10.138 1.00 34.44 O ATOM 543 CG2 THR A 34 8.789 0.743 9.094 1.00 4.11 C ATOM 0 H THR A 34 5.202 2.336 7.334 1.00 0.20 H new ATOM 0 HA THR A 34 7.051 3.005 9.520 1.00 2.24 H new ATOM 0 HB THR A 34 6.976 0.335 8.070 1.00 61.34 H new ATOM 0 HG1 THR A 34 6.883 -0.436 10.333 1.00 34.44 H new ATOM 0 HG21 THR A 34 9.007 -0.305 9.301 1.00 4.11 H new ATOM 0 HG22 THR A 34 9.292 1.044 8.175 1.00 4.11 H new ATOM 0 HG23 THR A 34 9.146 1.358 9.920 1.00 4.11 H new ATOM 551 N ASP A 35 8.467 4.015 7.800 1.00 3.43 N ATOM 552 CA ASP A 35 9.334 4.720 6.846 1.00 21.43 C ATOM 553 C ASP A 35 10.632 3.939 6.594 1.00 33.41 C ATOM 554 O ASP A 35 11.332 4.216 5.612 1.00 63.55 O ATOM 555 CB ASP A 35 9.661 6.138 7.376 1.00 1.43 C ATOM 556 CG ASP A 35 10.477 6.132 8.682 1.00 44.32 C ATOM 557 OD1 ASP A 35 9.884 5.886 9.755 1.00 70.33 O ATOM 558 OD2 ASP A 35 11.701 6.387 8.640 1.00 41.32 O ATOM 0 H ASP A 35 8.546 4.370 8.753 1.00 3.43 H new ATOM 0 HA ASP A 35 8.800 4.803 5.899 1.00 21.43 H new ATOM 0 HB2 ASP A 35 10.216 6.684 6.613 1.00 1.43 H new ATOM 0 HB3 ASP A 35 8.729 6.679 7.541 1.00 1.43 H new ATOM 563 N ASP A 36 10.956 2.986 7.500 1.00 1.34 N ATOM 564 CA ASP A 36 12.136 2.116 7.371 1.00 12.14 C ATOM 565 C ASP A 36 11.941 1.247 6.123 1.00 10.11 C ATOM 566 O ASP A 36 11.205 0.256 6.145 1.00 64.42 O ATOM 567 CB ASP A 36 12.346 1.244 8.635 1.00 14.23 C ATOM 568 CG ASP A 36 12.583 2.071 9.900 1.00 62.52 C ATOM 569 OD1 ASP A 36 11.592 2.527 10.521 1.00 53.23 O ATOM 570 OD2 ASP A 36 13.758 2.274 10.282 1.00 71.03 O ATOM 0 H ASP A 36 10.404 2.804 8.338 1.00 1.34 H new ATOM 0 HA ASP A 36 13.034 2.725 7.270 1.00 12.14 H new ATOM 0 HB2 ASP A 36 11.472 0.609 8.781 1.00 14.23 H new ATOM 0 HB3 ASP A 36 13.197 0.582 8.476 1.00 14.23 H new ATOM 575 N LYS A 37 12.595 1.682 5.045 1.00 35.14 N ATOM 576 CA LYS A 37 12.280 1.305 3.663 1.00 14.52 C ATOM 577 C LYS A 37 12.555 -0.195 3.396 1.00 52.40 C ATOM 578 O LYS A 37 11.766 -0.890 2.739 1.00 3.40 O ATOM 579 CB LYS A 37 13.077 2.288 2.729 1.00 33.24 C ATOM 580 CG LYS A 37 14.605 2.044 2.572 1.00 22.02 C ATOM 581 CD LYS A 37 14.931 1.138 1.360 1.00 12.23 C ATOM 582 CE LYS A 37 14.632 1.805 0.006 1.00 22.22 C ATOM 583 NZ LYS A 37 15.467 3.000 -0.235 1.00 43.12 N ATOM 0 H LYS A 37 13.383 2.326 5.110 1.00 35.14 H new ATOM 0 HA LYS A 37 11.215 1.408 3.455 1.00 14.52 H new ATOM 0 HB2 LYS A 37 12.626 2.250 1.737 1.00 33.24 H new ATOM 0 HB3 LYS A 37 12.934 3.301 3.106 1.00 33.24 H new ATOM 0 HG2 LYS A 37 15.114 3.001 2.455 1.00 22.02 H new ATOM 0 HG3 LYS A 37 14.993 1.585 3.481 1.00 22.02 H new ATOM 0 HD2 LYS A 37 15.984 0.860 1.396 1.00 12.23 H new ATOM 0 HD3 LYS A 37 14.355 0.216 1.439 1.00 12.23 H new ATOM 0 HE2 LYS A 37 14.797 1.084 -0.794 1.00 22.22 H new ATOM 0 HE3 LYS A 37 13.580 2.088 -0.031 1.00 22.22 H new ATOM 0 HZ1 LYS A 37 15.325 3.332 -1.210 1.00 43.12 H new ATOM 0 HZ2 LYS A 37 15.196 3.753 0.429 1.00 43.12 H new ATOM 0 HZ3 LYS A 37 16.469 2.758 -0.094 1.00 43.12 H new ATOM 597 N GLU A 38 13.674 -0.670 3.938 1.00 14.23 N ATOM 598 CA GLU A 38 14.094 -2.079 3.868 1.00 62.42 C ATOM 599 C GLU A 38 13.285 -2.947 4.845 1.00 52.11 C ATOM 600 O GLU A 38 13.110 -4.146 4.612 1.00 44.15 O ATOM 601 CB GLU A 38 15.625 -2.213 4.133 1.00 22.23 C ATOM 602 CG GLU A 38 16.109 -1.908 5.574 1.00 63.11 C ATOM 603 CD GLU A 38 15.783 -0.488 6.071 1.00 33.02 C ATOM 604 OE1 GLU A 38 16.371 0.483 5.548 1.00 25.43 O ATOM 605 OE2 GLU A 38 14.898 -0.326 6.937 1.00 73.01 O ATOM 0 H GLU A 38 14.331 -0.080 4.449 1.00 14.23 H new ATOM 0 HA GLU A 38 13.893 -2.441 2.860 1.00 62.42 H new ATOM 0 HB2 GLU A 38 15.927 -3.229 3.880 1.00 22.23 H new ATOM 0 HB3 GLU A 38 16.149 -1.545 3.449 1.00 22.23 H new ATOM 0 HG2 GLU A 38 15.658 -2.630 6.255 1.00 63.11 H new ATOM 0 HG3 GLU A 38 17.188 -2.056 5.620 1.00 63.11 H new ATOM 612 N LYS A 39 12.806 -2.329 5.949 1.00 71.40 N ATOM 613 CA LYS A 39 12.014 -3.033 6.969 1.00 21.51 C ATOM 614 C LYS A 39 10.617 -3.368 6.451 1.00 53.53 C ATOM 615 O LYS A 39 10.048 -4.372 6.852 1.00 2.55 O ATOM 616 CB LYS A 39 11.905 -2.227 8.279 1.00 44.21 C ATOM 617 CG LYS A 39 11.242 -3.002 9.440 1.00 73.40 C ATOM 618 CD LYS A 39 11.170 -2.196 10.749 1.00 74.22 C ATOM 619 CE LYS A 39 10.549 -3.009 11.890 1.00 65.42 C ATOM 620 NZ LYS A 39 10.480 -2.231 13.152 1.00 74.30 N ATOM 0 H LYS A 39 12.958 -1.341 6.151 1.00 71.40 H new ATOM 0 HA LYS A 39 12.544 -3.960 7.186 1.00 21.51 H new ATOM 0 HB2 LYS A 39 12.903 -1.916 8.587 1.00 44.21 H new ATOM 0 HB3 LYS A 39 11.333 -1.319 8.088 1.00 44.21 H new ATOM 0 HG2 LYS A 39 10.234 -3.292 9.145 1.00 73.40 H new ATOM 0 HG3 LYS A 39 11.799 -3.922 9.618 1.00 73.40 H new ATOM 0 HD2 LYS A 39 12.173 -1.878 11.034 1.00 74.22 H new ATOM 0 HD3 LYS A 39 10.583 -1.292 10.586 1.00 74.22 H new ATOM 0 HE2 LYS A 39 9.546 -3.327 11.605 1.00 65.42 H new ATOM 0 HE3 LYS A 39 11.136 -3.913 12.053 1.00 65.42 H new ATOM 0 HZ1 LYS A 39 10.054 -2.817 13.898 1.00 74.30 H new ATOM 0 HZ2 LYS A 39 11.439 -1.949 13.439 1.00 74.30 H new ATOM 0 HZ3 LYS A 39 9.899 -1.381 13.005 1.00 74.30 H new ATOM 634 N VAL A 40 10.070 -2.513 5.568 1.00 10.43 N ATOM 635 CA VAL A 40 8.797 -2.793 4.866 1.00 41.45 C ATOM 636 C VAL A 40 8.856 -4.173 4.153 1.00 2.03 C ATOM 637 O VAL A 40 7.875 -4.924 4.131 1.00 3.21 O ATOM 638 CB VAL A 40 8.451 -1.664 3.820 1.00 75.31 C ATOM 639 CG1 VAL A 40 7.141 -1.978 3.069 1.00 41.34 C ATOM 640 CG2 VAL A 40 8.373 -0.270 4.495 1.00 64.15 C ATOM 0 H VAL A 40 10.490 -1.617 5.320 1.00 10.43 H new ATOM 0 HA VAL A 40 8.009 -2.813 5.618 1.00 41.45 H new ATOM 0 HB VAL A 40 9.262 -1.640 3.092 1.00 75.31 H new ATOM 0 HG11 VAL A 40 6.931 -1.181 2.356 1.00 41.34 H new ATOM 0 HG12 VAL A 40 7.244 -2.924 2.537 1.00 41.34 H new ATOM 0 HG13 VAL A 40 6.321 -2.052 3.783 1.00 41.34 H new ATOM 0 HG21 VAL A 40 8.133 0.484 3.746 1.00 64.15 H new ATOM 0 HG22 VAL A 40 7.598 -0.280 5.261 1.00 64.15 H new ATOM 0 HG23 VAL A 40 9.333 -0.033 4.953 1.00 64.15 H new ATOM 650 N LYS A 41 10.045 -4.492 3.614 1.00 3.14 N ATOM 651 CA LYS A 41 10.329 -5.780 2.949 1.00 23.54 C ATOM 652 C LYS A 41 10.407 -6.935 3.969 1.00 13.32 C ATOM 653 O LYS A 41 9.984 -8.060 3.682 1.00 61.50 O ATOM 654 CB LYS A 41 11.656 -5.679 2.169 1.00 63.11 C ATOM 655 CG LYS A 41 11.670 -4.566 1.107 1.00 3.33 C ATOM 656 CD LYS A 41 13.034 -4.459 0.394 1.00 24.00 C ATOM 657 CE LYS A 41 13.048 -3.408 -0.720 1.00 0.23 C ATOM 658 NZ LYS A 41 14.363 -3.358 -1.422 1.00 42.31 N ATOM 0 H LYS A 41 10.845 -3.859 3.627 1.00 3.14 H new ATOM 0 HA LYS A 41 9.512 -5.995 2.260 1.00 23.54 H new ATOM 0 HB2 LYS A 41 12.469 -5.505 2.874 1.00 63.11 H new ATOM 0 HB3 LYS A 41 11.854 -6.634 1.683 1.00 63.11 H new ATOM 0 HG2 LYS A 41 10.891 -4.759 0.370 1.00 3.33 H new ATOM 0 HG3 LYS A 41 11.433 -3.613 1.579 1.00 3.33 H new ATOM 0 HD2 LYS A 41 13.802 -4.213 1.127 1.00 24.00 H new ATOM 0 HD3 LYS A 41 13.294 -5.430 -0.027 1.00 24.00 H new ATOM 0 HE2 LYS A 41 12.261 -3.632 -1.440 1.00 0.23 H new ATOM 0 HE3 LYS A 41 12.825 -2.428 -0.297 1.00 0.23 H new ATOM 0 HZ1 LYS A 41 14.589 -2.373 -1.666 1.00 42.31 H new ATOM 0 HZ2 LYS A 41 15.104 -3.739 -0.799 1.00 42.31 H new ATOM 0 HZ3 LYS A 41 14.315 -3.928 -2.291 1.00 42.31 H new ATOM 672 N GLU A 42 10.968 -6.635 5.156 1.00 41.23 N ATOM 673 CA GLU A 42 11.047 -7.596 6.275 1.00 61.42 C ATOM 674 C GLU A 42 9.636 -7.901 6.808 1.00 41.01 C ATOM 675 O GLU A 42 9.341 -9.036 7.156 1.00 62.24 O ATOM 676 CB GLU A 42 11.958 -7.041 7.408 1.00 54.44 C ATOM 677 CG GLU A 42 13.399 -6.702 6.956 1.00 13.05 C ATOM 678 CD GLU A 42 14.296 -6.184 8.095 1.00 72.32 C ATOM 679 OE1 GLU A 42 13.992 -5.116 8.659 1.00 73.14 O ATOM 680 OE2 GLU A 42 15.314 -6.838 8.430 1.00 32.35 O ATOM 0 H GLU A 42 11.377 -5.725 5.367 1.00 41.23 H new ATOM 0 HA GLU A 42 11.489 -8.524 5.912 1.00 61.42 H new ATOM 0 HB2 GLU A 42 11.498 -6.143 7.821 1.00 54.44 H new ATOM 0 HB3 GLU A 42 12.005 -7.774 8.213 1.00 54.44 H new ATOM 0 HG2 GLU A 42 13.854 -7.593 6.523 1.00 13.05 H new ATOM 0 HG3 GLU A 42 13.356 -5.950 6.168 1.00 13.05 H new ATOM 687 N GLU A 43 8.760 -6.878 6.816 1.00 61.33 N ATOM 688 CA GLU A 43 7.367 -6.999 7.285 1.00 74.35 C ATOM 689 C GLU A 43 6.504 -7.731 6.247 1.00 23.31 C ATOM 690 O GLU A 43 5.534 -8.414 6.607 1.00 53.00 O ATOM 691 CB GLU A 43 6.776 -5.603 7.621 1.00 62.10 C ATOM 692 CG GLU A 43 7.525 -4.850 8.744 1.00 11.35 C ATOM 693 CD GLU A 43 7.600 -5.629 10.078 1.00 73.14 C ATOM 694 OE1 GLU A 43 6.645 -5.542 10.880 1.00 23.43 O ATOM 695 OE2 GLU A 43 8.610 -6.334 10.329 1.00 32.30 O ATOM 0 H GLU A 43 9.000 -5.940 6.496 1.00 61.33 H new ATOM 0 HA GLU A 43 7.365 -7.592 8.199 1.00 74.35 H new ATOM 0 HB2 GLU A 43 6.786 -4.990 6.719 1.00 62.10 H new ATOM 0 HB3 GLU A 43 5.733 -5.724 7.913 1.00 62.10 H new ATOM 0 HG2 GLU A 43 8.537 -4.628 8.407 1.00 11.35 H new ATOM 0 HG3 GLU A 43 7.031 -3.894 8.920 1.00 11.35 H new ATOM 702 N ILE A 44 6.869 -7.561 4.955 1.00 73.13 N ATOM 703 CA ILE A 44 6.321 -8.352 3.834 1.00 14.23 C ATOM 704 C ILE A 44 6.547 -9.850 4.097 1.00 1.01 C ATOM 705 O ILE A 44 5.613 -10.654 3.985 1.00 21.41 O ATOM 706 CB ILE A 44 6.977 -7.916 2.444 1.00 64.11 C ATOM 707 CG1 ILE A 44 6.148 -6.774 1.765 1.00 44.51 C ATOM 708 CG2 ILE A 44 7.208 -9.104 1.471 1.00 55.23 C ATOM 709 CD1 ILE A 44 6.598 -6.425 0.356 1.00 41.22 C ATOM 0 H ILE A 44 7.556 -6.867 4.662 1.00 73.13 H new ATOM 0 HA ILE A 44 5.250 -8.161 3.765 1.00 14.23 H new ATOM 0 HB ILE A 44 7.968 -7.529 2.682 1.00 64.11 H new ATOM 0 HG12 ILE A 44 5.100 -7.071 1.736 1.00 44.51 H new ATOM 0 HG13 ILE A 44 6.209 -5.880 2.385 1.00 44.51 H new ATOM 0 HG21 ILE A 44 7.656 -8.736 0.548 1.00 55.23 H new ATOM 0 HG22 ILE A 44 7.877 -9.829 1.935 1.00 55.23 H new ATOM 0 HG23 ILE A 44 6.254 -9.581 1.247 1.00 55.23 H new ATOM 0 HD11 ILE A 44 5.971 -5.626 -0.039 1.00 41.22 H new ATOM 0 HD12 ILE A 44 7.636 -6.094 0.377 1.00 41.22 H new ATOM 0 HD13 ILE A 44 6.510 -7.304 -0.282 1.00 41.22 H new ATOM 721 N GLU A 45 7.805 -10.176 4.476 1.00 54.44 N ATOM 722 CA GLU A 45 8.263 -11.543 4.749 1.00 74.24 C ATOM 723 C GLU A 45 7.350 -12.186 5.810 1.00 31.53 C ATOM 724 O GLU A 45 6.855 -13.300 5.616 1.00 2.01 O ATOM 725 CB GLU A 45 9.755 -11.491 5.214 1.00 43.41 C ATOM 726 CG GLU A 45 10.552 -12.813 5.124 1.00 21.24 C ATOM 727 CD GLU A 45 10.015 -13.964 6.002 1.00 63.11 C ATOM 728 OE1 GLU A 45 10.146 -13.897 7.243 1.00 54.23 O ATOM 729 OE2 GLU A 45 9.449 -14.936 5.444 1.00 34.14 O ATOM 0 H GLU A 45 8.538 -9.477 4.601 1.00 54.44 H new ATOM 0 HA GLU A 45 8.208 -12.158 3.851 1.00 74.24 H new ATOM 0 HB2 GLU A 45 10.272 -10.739 4.618 1.00 43.41 H new ATOM 0 HB3 GLU A 45 9.778 -11.148 6.248 1.00 43.41 H new ATOM 0 HG2 GLU A 45 10.561 -13.143 4.085 1.00 21.24 H new ATOM 0 HG3 GLU A 45 11.586 -12.615 5.405 1.00 21.24 H new ATOM 736 N LYS A 46 7.087 -11.419 6.886 1.00 53.45 N ATOM 737 CA LYS A 46 6.252 -11.864 8.020 1.00 45.33 C ATOM 738 C LYS A 46 4.827 -12.178 7.538 1.00 53.42 C ATOM 739 O LYS A 46 4.319 -13.274 7.757 1.00 22.32 O ATOM 740 CB LYS A 46 6.184 -10.770 9.135 1.00 20.43 C ATOM 741 CG LYS A 46 7.523 -10.078 9.449 1.00 11.11 C ATOM 742 CD LYS A 46 8.631 -11.015 9.995 1.00 24.21 C ATOM 743 CE LYS A 46 10.008 -10.310 10.033 1.00 12.14 C ATOM 744 NZ LYS A 46 9.948 -8.975 10.696 1.00 32.10 N ATOM 0 H LYS A 46 7.448 -10.471 6.994 1.00 53.45 H new ATOM 0 HA LYS A 46 6.709 -12.762 8.435 1.00 45.33 H new ATOM 0 HB2 LYS A 46 5.461 -10.011 8.835 1.00 20.43 H new ATOM 0 HB3 LYS A 46 5.805 -11.227 10.049 1.00 20.43 H new ATOM 0 HG2 LYS A 46 7.889 -9.598 8.541 1.00 11.11 H new ATOM 0 HG3 LYS A 46 7.344 -9.288 10.178 1.00 11.11 H new ATOM 0 HD2 LYS A 46 8.365 -11.348 10.998 1.00 24.21 H new ATOM 0 HD3 LYS A 46 8.695 -11.906 9.370 1.00 24.21 H new ATOM 0 HE2 LYS A 46 10.722 -10.942 10.561 1.00 12.14 H new ATOM 0 HE3 LYS A 46 10.380 -10.190 9.015 1.00 12.14 H new ATOM 0 HZ1 LYS A 46 10.912 -8.604 10.818 1.00 32.10 H new ATOM 0 HZ2 LYS A 46 9.397 -8.319 10.107 1.00 32.10 H new ATOM 0 HZ3 LYS A 46 9.494 -9.070 11.627 1.00 32.10 H new ATOM 758 N ALA A 47 4.231 -11.201 6.832 1.00 53.15 N ATOM 759 CA ALA A 47 2.815 -11.228 6.428 1.00 32.21 C ATOM 760 C ALA A 47 2.492 -12.425 5.524 1.00 41.02 C ATOM 761 O ALA A 47 1.613 -13.226 5.851 1.00 24.10 O ATOM 762 CB ALA A 47 2.456 -9.913 5.728 1.00 32.13 C ATOM 0 H ALA A 47 4.724 -10.363 6.523 1.00 53.15 H new ATOM 0 HA ALA A 47 2.212 -11.341 7.329 1.00 32.21 H new ATOM 0 HB1 ALA A 47 1.408 -9.934 5.429 1.00 32.13 H new ATOM 0 HB2 ALA A 47 2.622 -9.080 6.411 1.00 32.13 H new ATOM 0 HB3 ALA A 47 3.082 -9.788 4.845 1.00 32.13 H new ATOM 768 N ARG A 48 3.255 -12.573 4.422 1.00 3.13 N ATOM 769 CA ARG A 48 3.041 -13.651 3.430 1.00 23.25 C ATOM 770 C ARG A 48 3.237 -15.049 4.060 1.00 22.10 C ATOM 771 O ARG A 48 2.561 -16.013 3.683 1.00 43.34 O ATOM 772 CB ARG A 48 3.961 -13.435 2.177 1.00 44.50 C ATOM 773 CG ARG A 48 5.503 -13.399 2.430 1.00 75.31 C ATOM 774 CD ARG A 48 6.180 -14.789 2.519 1.00 71.23 C ATOM 775 NE ARG A 48 7.603 -14.710 2.893 1.00 12.40 N ATOM 776 CZ ARG A 48 8.633 -14.809 2.044 1.00 44.11 C ATOM 777 NH1 ARG A 48 8.442 -14.996 0.746 1.00 20.33 N ATOM 778 NH2 ARG A 48 9.862 -14.738 2.507 1.00 31.35 N ATOM 0 H ARG A 48 4.033 -11.954 4.194 1.00 3.13 H new ATOM 0 HA ARG A 48 2.005 -13.604 3.093 1.00 23.25 H new ATOM 0 HB2 ARG A 48 3.753 -14.231 1.462 1.00 44.50 H new ATOM 0 HB3 ARG A 48 3.673 -12.497 1.702 1.00 44.50 H new ATOM 0 HG2 ARG A 48 5.975 -12.831 1.628 1.00 75.31 H new ATOM 0 HG3 ARG A 48 5.692 -12.858 3.357 1.00 75.31 H new ATOM 0 HD2 ARG A 48 5.650 -15.399 3.251 1.00 71.23 H new ATOM 0 HD3 ARG A 48 6.090 -15.294 1.557 1.00 71.23 H new ATOM 0 HE ARG A 48 7.821 -14.568 3.879 1.00 12.40 H new ATOM 0 HH11 ARG A 48 7.495 -15.067 0.375 1.00 20.33 H new ATOM 0 HH12 ARG A 48 9.242 -15.068 0.118 1.00 20.33 H new ATOM 0 HH21 ARG A 48 10.024 -14.609 3.506 1.00 31.35 H new ATOM 0 HH22 ARG A 48 10.653 -14.812 1.867 1.00 31.35 H new ATOM 792 N LYS A 49 4.159 -15.124 5.043 1.00 3.05 N ATOM 793 CA LYS A 49 4.527 -16.381 5.715 1.00 73.53 C ATOM 794 C LYS A 49 3.475 -16.761 6.772 1.00 11.04 C ATOM 795 O LYS A 49 3.240 -17.944 7.025 1.00 51.41 O ATOM 796 CB LYS A 49 5.940 -16.242 6.342 1.00 41.11 C ATOM 797 CG LYS A 49 6.544 -17.560 6.873 1.00 22.54 C ATOM 798 CD LYS A 49 8.022 -17.411 7.308 1.00 62.41 C ATOM 799 CE LYS A 49 8.660 -18.754 7.679 1.00 70.50 C ATOM 800 NZ LYS A 49 10.104 -18.621 7.997 1.00 1.12 N ATOM 0 H LYS A 49 4.668 -14.311 5.391 1.00 3.05 H new ATOM 0 HA LYS A 49 4.554 -17.187 4.981 1.00 73.53 H new ATOM 0 HB2 LYS A 49 6.615 -15.825 5.594 1.00 41.11 H new ATOM 0 HB3 LYS A 49 5.890 -15.525 7.162 1.00 41.11 H new ATOM 0 HG2 LYS A 49 5.954 -17.909 7.721 1.00 22.54 H new ATOM 0 HG3 LYS A 49 6.473 -18.324 6.099 1.00 22.54 H new ATOM 0 HD2 LYS A 49 8.591 -16.952 6.500 1.00 62.41 H new ATOM 0 HD3 LYS A 49 8.080 -16.736 8.162 1.00 62.41 H new ATOM 0 HE2 LYS A 49 8.138 -19.177 8.537 1.00 70.50 H new ATOM 0 HE3 LYS A 49 8.535 -19.454 6.853 1.00 70.50 H new ATOM 0 HZ1 LYS A 49 10.493 -19.554 8.242 1.00 1.12 H new ATOM 0 HZ2 LYS A 49 10.608 -18.242 7.170 1.00 1.12 H new ATOM 0 HZ3 LYS A 49 10.224 -17.974 8.802 1.00 1.12 H new ATOM 814 N GLN A 50 2.817 -15.738 7.356 1.00 23.21 N ATOM 815 CA GLN A 50 1.728 -15.931 8.336 1.00 63.54 C ATOM 816 C GLN A 50 0.353 -15.973 7.627 1.00 10.33 C ATOM 817 O GLN A 50 -0.682 -15.989 8.299 1.00 54.22 O ATOM 818 CB GLN A 50 1.754 -14.809 9.421 1.00 61.25 C ATOM 819 CG GLN A 50 3.076 -14.703 10.217 1.00 33.34 C ATOM 820 CD GLN A 50 3.511 -15.994 10.930 1.00 1.31 C ATOM 821 OE1 GLN A 50 2.687 -16.807 11.350 1.00 22.33 O ATOM 822 NE2 GLN A 50 4.819 -16.194 11.064 1.00 51.33 N ATOM 0 H GLN A 50 3.025 -14.758 7.162 1.00 23.21 H new ATOM 0 HA GLN A 50 1.885 -16.889 8.832 1.00 63.54 H new ATOM 0 HB2 GLN A 50 1.560 -13.852 8.937 1.00 61.25 H new ATOM 0 HB3 GLN A 50 0.938 -14.983 10.122 1.00 61.25 H new ATOM 0 HG2 GLN A 50 3.870 -14.397 9.535 1.00 33.34 H new ATOM 0 HG3 GLN A 50 2.973 -13.913 10.960 1.00 33.34 H new ATOM 0 HE21 GLN A 50 5.480 -15.504 10.707 1.00 51.33 H new ATOM 0 HE22 GLN A 50 5.161 -17.037 11.524 1.00 51.33 H new ATOM 831 N GLY A 51 0.362 -15.975 6.267 1.00 44.24 N ATOM 832 CA GLY A 51 -0.863 -16.096 5.456 1.00 1.52 C ATOM 833 C GLY A 51 -1.809 -14.907 5.599 1.00 52.41 C ATOM 834 O GLY A 51 -3.029 -15.068 5.592 1.00 1.23 O ATOM 0 H GLY A 51 1.215 -15.893 5.713 1.00 44.24 H new ATOM 0 HA2 GLY A 51 -0.586 -16.205 4.408 1.00 1.52 H new ATOM 0 HA3 GLY A 51 -1.390 -17.006 5.743 1.00 1.52 H new ATOM 838 N ARG A 52 -1.229 -13.710 5.698 1.00 34.22 N ATOM 839 CA ARG A 52 -1.949 -12.461 6.012 1.00 55.41 C ATOM 840 C ARG A 52 -1.682 -11.395 4.927 1.00 1.52 C ATOM 841 O ARG A 52 -0.557 -11.304 4.417 1.00 12.00 O ATOM 842 CB ARG A 52 -1.490 -11.931 7.406 1.00 13.13 C ATOM 843 CG ARG A 52 -2.002 -12.770 8.600 1.00 34.13 C ATOM 844 CD ARG A 52 -1.382 -12.362 9.950 1.00 40.34 C ATOM 845 NE ARG A 52 -2.107 -12.933 11.103 1.00 64.04 N ATOM 846 CZ ARG A 52 -2.050 -14.209 11.525 1.00 4.02 C ATOM 847 NH1 ARG A 52 -1.303 -15.115 10.911 1.00 1.03 N ATOM 848 NH2 ARG A 52 -2.755 -14.564 12.584 1.00 24.14 N ATOM 0 H ARG A 52 -0.228 -13.572 5.561 1.00 34.22 H new ATOM 0 HA ARG A 52 -3.019 -12.667 6.037 1.00 55.41 H new ATOM 0 HB2 ARG A 52 -0.401 -11.907 7.433 1.00 13.13 H new ATOM 0 HB3 ARG A 52 -1.834 -10.903 7.524 1.00 13.13 H new ATOM 0 HG2 ARG A 52 -3.086 -12.673 8.663 1.00 34.13 H new ATOM 0 HG3 ARG A 52 -1.786 -13.822 8.413 1.00 34.13 H new ATOM 0 HD2 ARG A 52 -0.342 -12.688 9.982 1.00 40.34 H new ATOM 0 HD3 ARG A 52 -1.378 -11.275 10.030 1.00 40.34 H new ATOM 0 HE ARG A 52 -2.708 -12.299 11.630 1.00 64.04 H new ATOM 0 HH11 ARG A 52 -0.751 -14.852 10.095 1.00 1.03 H new ATOM 0 HH12 ARG A 52 -1.280 -16.075 11.255 1.00 1.03 H new ATOM 0 HH21 ARG A 52 -3.331 -13.875 13.068 1.00 24.14 H new ATOM 0 HH22 ARG A 52 -2.724 -15.527 12.918 1.00 24.14 H new ATOM 862 N PRO A 53 -2.721 -10.587 4.539 1.00 71.25 N ATOM 863 CA PRO A 53 -2.517 -9.377 3.710 1.00 44.34 C ATOM 864 C PRO A 53 -1.791 -8.280 4.523 1.00 71.23 C ATOM 865 O PRO A 53 -1.989 -8.172 5.742 1.00 25.53 O ATOM 866 CB PRO A 53 -3.967 -8.945 3.314 1.00 11.22 C ATOM 867 CG PRO A 53 -4.849 -10.112 3.686 1.00 41.42 C ATOM 868 CD PRO A 53 -4.162 -10.786 4.852 1.00 61.24 C ATOM 0 HA PRO A 53 -1.891 -9.554 2.835 1.00 44.34 H new ATOM 0 HB2 PRO A 53 -4.266 -8.041 3.845 1.00 11.22 H new ATOM 0 HB3 PRO A 53 -4.034 -8.726 2.248 1.00 11.22 H new ATOM 0 HG2 PRO A 53 -5.849 -9.776 3.961 1.00 41.42 H new ATOM 0 HG3 PRO A 53 -4.964 -10.799 2.848 1.00 41.42 H new ATOM 0 HD2 PRO A 53 -4.437 -10.330 5.803 1.00 61.24 H new ATOM 0 HD3 PRO A 53 -4.420 -11.843 4.919 1.00 61.24 H new ATOM 876 N ILE A 54 -0.948 -7.482 3.855 1.00 61.34 N ATOM 877 CA ILE A 54 -0.170 -6.412 4.507 1.00 64.41 C ATOM 878 C ILE A 54 -0.491 -5.054 3.865 1.00 62.52 C ATOM 879 O ILE A 54 -0.506 -4.919 2.638 1.00 24.24 O ATOM 880 CB ILE A 54 1.373 -6.719 4.471 1.00 21.44 C ATOM 881 CG1 ILE A 54 2.197 -5.565 5.121 1.00 41.31 C ATOM 882 CG2 ILE A 54 1.876 -7.042 3.044 1.00 12.13 C ATOM 883 CD1 ILE A 54 3.676 -5.855 5.273 1.00 64.41 C ATOM 0 H ILE A 54 -0.784 -7.557 2.851 1.00 61.34 H new ATOM 0 HA ILE A 54 -0.460 -6.369 5.557 1.00 64.41 H new ATOM 0 HB ILE A 54 1.530 -7.617 5.068 1.00 21.44 H new ATOM 0 HG12 ILE A 54 2.077 -4.665 4.517 1.00 41.31 H new ATOM 0 HG13 ILE A 54 1.780 -5.347 6.104 1.00 41.31 H new ATOM 0 HG21 ILE A 54 2.946 -7.246 3.073 1.00 12.13 H new ATOM 0 HG22 ILE A 54 1.350 -7.917 2.662 1.00 12.13 H new ATOM 0 HG23 ILE A 54 1.687 -6.191 2.390 1.00 12.13 H new ATOM 0 HD11 ILE A 54 4.169 -4.999 5.733 1.00 64.41 H new ATOM 0 HD12 ILE A 54 3.812 -6.734 5.903 1.00 64.41 H new ATOM 0 HD13 ILE A 54 4.113 -6.041 4.292 1.00 64.41 H new ATOM 895 N VAL A 55 -0.785 -4.059 4.723 1.00 34.34 N ATOM 896 CA VAL A 55 -1.214 -2.723 4.307 1.00 53.42 C ATOM 897 C VAL A 55 -0.165 -1.690 4.752 1.00 12.53 C ATOM 898 O VAL A 55 -0.028 -1.419 5.950 1.00 71.55 O ATOM 899 CB VAL A 55 -2.633 -2.365 4.901 1.00 62.13 C ATOM 900 CG1 VAL A 55 -3.228 -1.125 4.207 1.00 22.15 C ATOM 901 CG2 VAL A 55 -3.599 -3.568 4.799 1.00 21.10 C ATOM 0 H VAL A 55 -0.729 -4.168 5.736 1.00 34.34 H new ATOM 0 HA VAL A 55 -1.302 -2.706 3.221 1.00 53.42 H new ATOM 0 HB VAL A 55 -2.500 -2.129 5.957 1.00 62.13 H new ATOM 0 HG11 VAL A 55 -4.205 -0.902 4.636 1.00 22.15 H new ATOM 0 HG12 VAL A 55 -2.564 -0.273 4.353 1.00 22.15 H new ATOM 0 HG13 VAL A 55 -3.336 -1.322 3.140 1.00 22.15 H new ATOM 0 HG21 VAL A 55 -4.568 -3.293 5.215 1.00 21.10 H new ATOM 0 HG22 VAL A 55 -3.720 -3.850 3.753 1.00 21.10 H new ATOM 0 HG23 VAL A 55 -3.191 -4.411 5.357 1.00 21.10 H new ATOM 911 N ILE A 56 0.580 -1.131 3.780 1.00 54.52 N ATOM 912 CA ILE A 56 1.706 -0.219 4.050 1.00 62.44 C ATOM 913 C ILE A 56 1.265 1.245 3.903 1.00 0.24 C ATOM 914 O ILE A 56 0.985 1.700 2.801 1.00 40.54 O ATOM 915 CB ILE A 56 2.923 -0.523 3.092 1.00 23.20 C ATOM 916 CG1 ILE A 56 3.414 -1.988 3.285 1.00 61.40 C ATOM 917 CG2 ILE A 56 4.096 0.477 3.297 1.00 31.45 C ATOM 918 CD1 ILE A 56 3.909 -2.302 4.694 1.00 3.11 C ATOM 0 H ILE A 56 0.418 -1.299 2.787 1.00 54.52 H new ATOM 0 HA ILE A 56 2.031 -0.383 5.077 1.00 62.44 H new ATOM 0 HB ILE A 56 2.569 -0.398 2.069 1.00 23.20 H new ATOM 0 HG12 ILE A 56 2.598 -2.668 3.039 1.00 61.40 H new ATOM 0 HG13 ILE A 56 4.219 -2.186 2.577 1.00 61.40 H new ATOM 0 HG21 ILE A 56 4.910 0.228 2.616 1.00 31.45 H new ATOM 0 HG22 ILE A 56 3.750 1.490 3.093 1.00 31.45 H new ATOM 0 HG23 ILE A 56 4.451 0.415 4.326 1.00 31.45 H new ATOM 0 HD11 ILE A 56 4.232 -3.342 4.743 1.00 3.11 H new ATOM 0 HD12 ILE A 56 4.747 -1.650 4.939 1.00 3.11 H new ATOM 0 HD13 ILE A 56 3.102 -2.139 5.408 1.00 3.11 H new ATOM 930 N PHE A 57 1.224 1.973 5.024 1.00 12.50 N ATOM 931 CA PHE A 57 0.896 3.405 5.039 1.00 13.43 C ATOM 932 C PHE A 57 2.195 4.226 4.979 1.00 24.51 C ATOM 933 O PHE A 57 2.987 4.214 5.924 1.00 41.11 O ATOM 934 CB PHE A 57 0.078 3.763 6.304 1.00 55.23 C ATOM 935 CG PHE A 57 -1.331 3.198 6.302 1.00 44.53 C ATOM 936 CD1 PHE A 57 -1.578 1.873 6.660 1.00 43.24 C ATOM 937 CD2 PHE A 57 -2.408 3.990 5.918 1.00 1.32 C ATOM 938 CE1 PHE A 57 -2.858 1.366 6.623 1.00 41.01 C ATOM 939 CE2 PHE A 57 -3.678 3.477 5.877 1.00 44.22 C ATOM 940 CZ PHE A 57 -3.905 2.171 6.229 1.00 31.41 C ATOM 0 H PHE A 57 1.417 1.587 5.948 1.00 12.50 H new ATOM 0 HA PHE A 57 0.284 3.643 4.169 1.00 13.43 H new ATOM 0 HB2 PHE A 57 0.606 3.394 7.183 1.00 55.23 H new ATOM 0 HB3 PHE A 57 0.024 4.848 6.396 1.00 55.23 H new ATOM 0 HD1 PHE A 57 -0.759 1.240 6.969 1.00 43.24 H new ATOM 0 HD2 PHE A 57 -2.241 5.022 5.649 1.00 1.32 H new ATOM 0 HE1 PHE A 57 -3.041 0.339 6.902 1.00 41.01 H new ATOM 0 HE2 PHE A 57 -4.502 4.102 5.567 1.00 44.22 H new ATOM 0 HZ PHE A 57 -4.908 1.772 6.197 1.00 31.41 H new ATOM 950 N ILE A 58 2.414 4.908 3.846 1.00 51.13 N ATOM 951 CA ILE A 58 3.579 5.796 3.629 1.00 14.03 C ATOM 952 C ILE A 58 3.143 7.065 2.878 1.00 52.31 C ATOM 953 O ILE A 58 2.054 7.110 2.305 1.00 34.25 O ATOM 954 CB ILE A 58 4.759 5.076 2.872 1.00 53.11 C ATOM 955 CG1 ILE A 58 4.251 4.266 1.647 1.00 20.24 C ATOM 956 CG2 ILE A 58 5.582 4.179 3.838 1.00 52.33 C ATOM 957 CD1 ILE A 58 5.357 3.572 0.866 1.00 23.22 C ATOM 0 H ILE A 58 1.786 4.863 3.044 1.00 51.13 H new ATOM 0 HA ILE A 58 3.963 6.072 4.611 1.00 14.03 H new ATOM 0 HB ILE A 58 5.421 5.854 2.492 1.00 53.11 H new ATOM 0 HG12 ILE A 58 3.537 3.517 1.990 1.00 20.24 H new ATOM 0 HG13 ILE A 58 3.713 4.937 0.978 1.00 20.24 H new ATOM 0 HG21 ILE A 58 6.389 3.696 3.287 1.00 52.33 H new ATOM 0 HG22 ILE A 58 6.003 4.793 4.634 1.00 52.33 H new ATOM 0 HG23 ILE A 58 4.932 3.419 4.271 1.00 52.33 H new ATOM 0 HD11 ILE A 58 4.924 3.028 0.027 1.00 23.22 H new ATOM 0 HD12 ILE A 58 6.060 4.316 0.492 1.00 23.22 H new ATOM 0 HD13 ILE A 58 5.881 2.874 1.519 1.00 23.22 H new ATOM 969 N ARG A 59 4.004 8.093 2.890 1.00 63.15 N ATOM 970 CA ARG A 59 3.623 9.455 2.474 1.00 14.21 C ATOM 971 C ARG A 59 4.732 10.120 1.641 1.00 72.22 C ATOM 972 O ARG A 59 5.871 10.143 2.093 1.00 32.44 O ATOM 973 CB ARG A 59 3.377 10.311 3.744 1.00 72.51 C ATOM 974 CG ARG A 59 2.796 11.716 3.488 1.00 3.32 C ATOM 975 CD ARG A 59 2.815 12.589 4.752 1.00 70.23 C ATOM 976 NE ARG A 59 4.193 12.857 5.217 1.00 10.45 N ATOM 977 CZ ARG A 59 4.716 12.517 6.413 1.00 63.44 C ATOM 978 NH1 ARG A 59 3.994 11.877 7.330 1.00 13.20 N ATOM 979 NH2 ARG A 59 5.975 12.828 6.685 1.00 52.12 N ATOM 0 H ARG A 59 4.977 8.008 3.185 1.00 63.15 H new ATOM 0 HA ARG A 59 2.724 9.389 1.861 1.00 14.21 H new ATOM 0 HB2 ARG A 59 2.697 9.769 4.402 1.00 72.51 H new ATOM 0 HB3 ARG A 59 4.321 10.418 4.279 1.00 72.51 H new ATOM 0 HG2 ARG A 59 3.368 12.206 2.701 1.00 3.32 H new ATOM 0 HG3 ARG A 59 1.772 11.624 3.127 1.00 3.32 H new ATOM 0 HD2 ARG A 59 2.311 13.534 4.548 1.00 70.23 H new ATOM 0 HD3 ARG A 59 2.255 12.093 5.544 1.00 70.23 H new ATOM 0 HE ARG A 59 4.809 13.348 4.569 1.00 10.45 H new ATOM 0 HH11 ARG A 59 3.023 11.633 7.135 1.00 13.20 H new ATOM 0 HH12 ARG A 59 4.412 11.631 8.227 1.00 13.20 H new ATOM 0 HH21 ARG A 59 6.540 13.320 5.993 1.00 52.12 H new ATOM 0 HH22 ARG A 59 6.379 12.575 7.587 1.00 52.12 H new ATOM 993 N GLY A 60 4.364 10.619 0.437 1.00 34.42 N ATOM 994 CA GLY A 60 5.169 11.574 -0.359 1.00 2.11 C ATOM 995 C GLY A 60 6.634 11.189 -0.601 1.00 12.11 C ATOM 996 O GLY A 60 6.992 10.695 -1.670 1.00 72.53 O ATOM 0 H GLY A 60 3.486 10.365 -0.015 1.00 34.42 H new ATOM 0 HA2 GLY A 60 4.685 11.706 -1.327 1.00 2.11 H new ATOM 0 HA3 GLY A 60 5.148 12.541 0.143 1.00 2.11 H new ATOM 1000 N ALA A 61 7.477 11.428 0.414 1.00 15.14 N ATOM 1001 CA ALA A 61 8.922 11.127 0.375 1.00 35.34 C ATOM 1002 C ALA A 61 9.176 9.611 0.471 1.00 72.22 C ATOM 1003 O ALA A 61 10.104 9.079 -0.138 1.00 52.34 O ATOM 1004 CB ALA A 61 9.621 11.869 1.521 1.00 14.10 C ATOM 0 H ALA A 61 7.175 11.840 1.297 1.00 15.14 H new ATOM 0 HA ALA A 61 9.330 11.465 -0.578 1.00 35.34 H new ATOM 0 HB1 ALA A 61 10.689 11.651 1.498 1.00 14.10 H new ATOM 0 HB2 ALA A 61 9.467 12.942 1.407 1.00 14.10 H new ATOM 0 HB3 ALA A 61 9.204 11.542 2.474 1.00 14.10 H new ATOM 1010 N TYR A 62 8.344 8.942 1.268 1.00 54.44 N ATOM 1011 CA TYR A 62 8.378 7.483 1.477 1.00 60.44 C ATOM 1012 C TYR A 62 7.750 6.734 0.280 1.00 55.34 C ATOM 1013 O TYR A 62 8.063 5.576 0.030 1.00 12.33 O ATOM 1014 CB TYR A 62 7.644 7.126 2.789 1.00 4.41 C ATOM 1015 CG TYR A 62 7.996 8.011 3.999 1.00 14.25 C ATOM 1016 CD1 TYR A 62 9.323 8.304 4.326 1.00 41.35 C ATOM 1017 CD2 TYR A 62 6.991 8.560 4.806 1.00 61.02 C ATOM 1018 CE1 TYR A 62 9.628 9.102 5.410 1.00 1.11 C ATOM 1019 CE2 TYR A 62 7.297 9.355 5.889 1.00 62.03 C ATOM 1020 CZ TYR A 62 8.613 9.623 6.186 1.00 23.11 C ATOM 1021 OH TYR A 62 8.917 10.408 7.271 1.00 22.13 O ATOM 0 H TYR A 62 7.608 9.404 1.802 1.00 54.44 H new ATOM 0 HA TYR A 62 9.419 7.168 1.554 1.00 60.44 H new ATOM 0 HB2 TYR A 62 6.570 7.188 2.614 1.00 4.41 H new ATOM 0 HB3 TYR A 62 7.867 6.089 3.041 1.00 4.41 H new ATOM 0 HD1 TYR A 62 10.122 7.900 3.721 1.00 41.35 H new ATOM 0 HD2 TYR A 62 5.956 8.356 4.575 1.00 61.02 H new ATOM 0 HE1 TYR A 62 10.659 9.318 5.650 1.00 1.11 H new ATOM 0 HE2 TYR A 62 6.508 9.765 6.501 1.00 62.03 H new ATOM 0 HH TYR A 62 8.089 10.695 7.709 1.00 22.13 H new ATOM 1031 N GLU A 63 6.817 7.411 -0.396 1.00 33.13 N ATOM 1032 CA GLU A 63 6.068 6.899 -1.575 1.00 62.35 C ATOM 1033 C GLU A 63 6.992 6.325 -2.675 1.00 71.10 C ATOM 1034 O GLU A 63 6.660 5.316 -3.294 1.00 52.11 O ATOM 1035 CB GLU A 63 5.185 8.079 -2.108 1.00 4.54 C ATOM 1036 CG GLU A 63 4.978 8.230 -3.650 1.00 22.43 C ATOM 1037 CD GLU A 63 3.891 7.336 -4.301 1.00 51.14 C ATOM 1038 OE1 GLU A 63 3.816 6.121 -4.011 1.00 20.31 O ATOM 1039 OE2 GLU A 63 3.118 7.858 -5.144 1.00 44.21 O ATOM 0 H GLU A 63 6.545 8.360 -0.140 1.00 33.13 H new ATOM 0 HA GLU A 63 5.445 6.057 -1.275 1.00 62.35 H new ATOM 0 HB2 GLU A 63 4.200 7.986 -1.651 1.00 4.54 H new ATOM 0 HB3 GLU A 63 5.621 9.008 -1.741 1.00 4.54 H new ATOM 0 HG2 GLU A 63 4.732 9.271 -3.859 1.00 22.43 H new ATOM 0 HG3 GLU A 63 5.928 8.022 -4.142 1.00 22.43 H new ATOM 1046 N GLU A 64 8.165 6.946 -2.893 1.00 61.12 N ATOM 1047 CA GLU A 64 9.112 6.487 -3.932 1.00 4.21 C ATOM 1048 C GLU A 64 9.679 5.075 -3.632 1.00 52.23 C ATOM 1049 O GLU A 64 10.028 4.340 -4.563 1.00 1.20 O ATOM 1050 CB GLU A 64 10.211 7.548 -4.211 1.00 75.11 C ATOM 1051 CG GLU A 64 11.034 8.026 -2.996 1.00 31.12 C ATOM 1052 CD GLU A 64 12.154 7.083 -2.534 1.00 2.14 C ATOM 1053 OE1 GLU A 64 12.988 6.672 -3.368 1.00 32.43 O ATOM 1054 OE2 GLU A 64 12.223 6.769 -1.332 1.00 31.42 O ATOM 0 H GLU A 64 8.481 7.762 -2.369 1.00 61.12 H new ATOM 0 HA GLU A 64 8.551 6.379 -4.860 1.00 4.21 H new ATOM 0 HB2 GLU A 64 10.900 7.139 -4.950 1.00 75.11 H new ATOM 0 HB3 GLU A 64 9.737 8.418 -4.665 1.00 75.11 H new ATOM 0 HG2 GLU A 64 11.476 8.993 -3.238 1.00 31.12 H new ATOM 0 HG3 GLU A 64 10.353 8.187 -2.160 1.00 31.12 H new ATOM 1061 N VAL A 65 9.746 4.706 -2.329 1.00 13.22 N ATOM 1062 CA VAL A 65 10.228 3.377 -1.885 1.00 22.23 C ATOM 1063 C VAL A 65 9.399 2.209 -2.501 1.00 61.55 C ATOM 1064 O VAL A 65 9.962 1.135 -2.740 1.00 4.30 O ATOM 1065 CB VAL A 65 10.238 3.221 -0.309 1.00 41.45 C ATOM 1066 CG1 VAL A 65 10.822 1.862 0.110 1.00 64.33 C ATOM 1067 CG2 VAL A 65 11.003 4.364 0.392 1.00 13.02 C ATOM 0 H VAL A 65 9.469 5.318 -1.562 1.00 13.22 H new ATOM 0 HA VAL A 65 11.254 3.318 -2.247 1.00 22.23 H new ATOM 0 HB VAL A 65 9.198 3.275 0.012 1.00 41.45 H new ATOM 0 HG11 VAL A 65 10.816 1.783 1.197 1.00 64.33 H new ATOM 0 HG12 VAL A 65 10.219 1.060 -0.315 1.00 64.33 H new ATOM 0 HG13 VAL A 65 11.846 1.778 -0.254 1.00 64.33 H new ATOM 0 HG21 VAL A 65 10.980 4.209 1.471 1.00 13.02 H new ATOM 0 HG22 VAL A 65 12.038 4.373 0.049 1.00 13.02 H new ATOM 0 HG23 VAL A 65 10.533 5.317 0.152 1.00 13.02 H new ATOM 1077 N VAL A 66 8.086 2.444 -2.800 1.00 52.01 N ATOM 1078 CA VAL A 66 7.137 1.369 -3.225 1.00 32.21 C ATOM 1079 C VAL A 66 7.708 0.526 -4.380 1.00 35.44 C ATOM 1080 O VAL A 66 7.668 -0.700 -4.323 1.00 2.34 O ATOM 1081 CB VAL A 66 5.727 1.929 -3.678 1.00 60.12 C ATOM 1082 CG1 VAL A 66 4.766 0.788 -4.119 1.00 54.32 C ATOM 1083 CG2 VAL A 66 5.078 2.772 -2.570 1.00 44.22 C ATOM 0 H VAL A 66 7.661 3.370 -2.754 1.00 52.01 H new ATOM 0 HA VAL A 66 7.002 0.750 -2.338 1.00 32.21 H new ATOM 0 HB VAL A 66 5.905 2.571 -4.541 1.00 60.12 H new ATOM 0 HG11 VAL A 66 3.810 1.214 -4.422 1.00 54.32 H new ATOM 0 HG12 VAL A 66 5.204 0.247 -4.958 1.00 54.32 H new ATOM 0 HG13 VAL A 66 4.610 0.102 -3.287 1.00 54.32 H new ATOM 0 HG21 VAL A 66 4.112 3.142 -2.913 1.00 44.22 H new ATOM 0 HG22 VAL A 66 4.937 2.158 -1.681 1.00 44.22 H new ATOM 0 HG23 VAL A 66 5.724 3.616 -2.329 1.00 44.22 H new ATOM 1093 N ARG A 67 8.293 1.198 -5.386 1.00 60.23 N ATOM 1094 CA ARG A 67 8.784 0.532 -6.609 1.00 13.03 C ATOM 1095 C ARG A 67 10.029 -0.353 -6.326 1.00 75.33 C ATOM 1096 O ARG A 67 10.251 -1.372 -6.994 1.00 12.21 O ATOM 1097 CB ARG A 67 9.072 1.572 -7.723 1.00 71.11 C ATOM 1098 CG ARG A 67 9.144 0.952 -9.134 1.00 51.42 C ATOM 1099 CD ARG A 67 9.357 1.989 -10.238 1.00 2.01 C ATOM 1100 NE ARG A 67 10.689 2.621 -10.190 1.00 72.44 N ATOM 1101 CZ ARG A 67 11.559 2.685 -11.216 1.00 61.44 C ATOM 1102 NH1 ARG A 67 11.271 2.155 -12.403 1.00 2.35 N ATOM 1103 NH2 ARG A 67 12.731 3.274 -11.038 1.00 22.34 N ATOM 0 H ARG A 67 8.439 2.207 -5.378 1.00 60.23 H new ATOM 0 HA ARG A 67 7.995 -0.133 -6.961 1.00 13.03 H new ATOM 0 HB2 ARG A 67 8.293 2.335 -7.708 1.00 71.11 H new ATOM 0 HB3 ARG A 67 10.015 2.075 -7.506 1.00 71.11 H new ATOM 0 HG2 ARG A 67 9.957 0.227 -9.164 1.00 51.42 H new ATOM 0 HG3 ARG A 67 8.222 0.405 -9.331 1.00 51.42 H new ATOM 0 HD2 ARG A 67 9.223 1.510 -11.208 1.00 2.01 H new ATOM 0 HD3 ARG A 67 8.592 2.761 -10.155 1.00 2.01 H new ATOM 0 HE ARG A 67 10.975 3.044 -9.307 1.00 72.44 H new ATOM 0 HH11 ARG A 67 10.376 1.688 -12.550 1.00 2.35 H new ATOM 0 HH12 ARG A 67 11.945 2.216 -13.166 1.00 2.35 H new ATOM 0 HH21 ARG A 67 12.968 3.674 -10.130 1.00 22.34 H new ATOM 0 HH22 ARG A 67 13.397 3.328 -11.809 1.00 22.34 H new ATOM 1117 N ASP A 68 10.822 0.049 -5.318 1.00 3.14 N ATOM 1118 CA ASP A 68 11.994 -0.725 -4.836 1.00 60.22 C ATOM 1119 C ASP A 68 11.530 -1.964 -4.023 1.00 53.15 C ATOM 1120 O ASP A 68 12.171 -3.030 -4.048 1.00 21.12 O ATOM 1121 CB ASP A 68 12.913 0.203 -3.989 1.00 31.53 C ATOM 1122 CG ASP A 68 14.119 -0.526 -3.370 1.00 62.15 C ATOM 1123 OD1 ASP A 68 14.984 -1.015 -4.126 1.00 63.21 O ATOM 1124 OD2 ASP A 68 14.207 -0.630 -2.130 1.00 53.32 O ATOM 0 H ASP A 68 10.674 0.921 -4.809 1.00 3.14 H new ATOM 0 HA ASP A 68 12.565 -1.092 -5.689 1.00 60.22 H new ATOM 0 HB2 ASP A 68 13.274 1.016 -4.619 1.00 31.53 H new ATOM 0 HB3 ASP A 68 12.323 0.655 -3.191 1.00 31.53 H new ATOM 1129 N ILE A 69 10.394 -1.799 -3.318 1.00 13.13 N ATOM 1130 CA ILE A 69 9.710 -2.884 -2.578 1.00 64.31 C ATOM 1131 C ILE A 69 9.131 -3.922 -3.569 1.00 3.55 C ATOM 1132 O ILE A 69 9.161 -5.129 -3.300 1.00 14.42 O ATOM 1133 CB ILE A 69 8.552 -2.301 -1.676 1.00 2.51 C ATOM 1134 CG1 ILE A 69 9.099 -1.254 -0.663 1.00 15.12 C ATOM 1135 CG2 ILE A 69 7.782 -3.414 -0.932 1.00 13.33 C ATOM 1136 CD1 ILE A 69 8.015 -0.438 0.025 1.00 1.22 C ATOM 0 H ILE A 69 9.918 -0.900 -3.244 1.00 13.13 H new ATOM 0 HA ILE A 69 10.441 -3.372 -1.934 1.00 64.31 H new ATOM 0 HB ILE A 69 7.852 -1.803 -2.347 1.00 2.51 H new ATOM 0 HG12 ILE A 69 9.688 -1.770 0.095 1.00 15.12 H new ATOM 0 HG13 ILE A 69 9.774 -0.576 -1.185 1.00 15.12 H new ATOM 0 HG21 ILE A 69 6.995 -2.968 -0.324 1.00 13.33 H new ATOM 0 HG22 ILE A 69 7.338 -4.096 -1.657 1.00 13.33 H new ATOM 0 HG23 ILE A 69 8.469 -3.965 -0.289 1.00 13.33 H new ATOM 0 HD11 ILE A 69 8.475 0.269 0.715 1.00 1.22 H new ATOM 0 HD12 ILE A 69 7.440 0.107 -0.723 1.00 1.22 H new ATOM 0 HD13 ILE A 69 7.352 -1.105 0.577 1.00 1.22 H new ATOM 1148 N VAL A 70 8.623 -3.414 -4.723 1.00 11.30 N ATOM 1149 CA VAL A 70 8.034 -4.229 -5.807 1.00 32.10 C ATOM 1150 C VAL A 70 8.997 -5.338 -6.267 1.00 43.51 C ATOM 1151 O VAL A 70 8.591 -6.497 -6.383 1.00 13.31 O ATOM 1152 CB VAL A 70 7.647 -3.340 -7.054 1.00 61.12 C ATOM 1153 CG1 VAL A 70 7.264 -4.203 -8.276 1.00 74.21 C ATOM 1154 CG2 VAL A 70 6.504 -2.360 -6.708 1.00 22.43 C ATOM 0 H VAL A 70 8.613 -2.414 -4.924 1.00 11.30 H new ATOM 0 HA VAL A 70 7.133 -4.684 -5.396 1.00 32.10 H new ATOM 0 HB VAL A 70 8.531 -2.760 -7.318 1.00 61.12 H new ATOM 0 HG11 VAL A 70 7.004 -3.554 -9.113 1.00 74.21 H new ATOM 0 HG12 VAL A 70 8.108 -4.834 -8.554 1.00 74.21 H new ATOM 0 HG13 VAL A 70 6.409 -4.831 -8.025 1.00 74.21 H new ATOM 0 HG21 VAL A 70 6.260 -1.762 -7.586 1.00 22.43 H new ATOM 0 HG22 VAL A 70 5.624 -2.923 -6.396 1.00 22.43 H new ATOM 0 HG23 VAL A 70 6.821 -1.703 -5.898 1.00 22.43 H new ATOM 1164 N GLU A 71 10.265 -4.945 -6.519 1.00 52.20 N ATOM 1165 CA GLU A 71 11.321 -5.858 -6.995 1.00 12.33 C ATOM 1166 C GLU A 71 11.459 -7.070 -6.055 1.00 3.31 C ATOM 1167 O GLU A 71 11.357 -8.218 -6.497 1.00 64.33 O ATOM 1168 CB GLU A 71 12.677 -5.103 -7.107 1.00 73.45 C ATOM 1169 CG GLU A 71 13.851 -5.985 -7.577 1.00 64.23 C ATOM 1170 CD GLU A 71 15.209 -5.274 -7.521 1.00 61.20 C ATOM 1171 OE1 GLU A 71 15.816 -5.221 -6.427 1.00 32.53 O ATOM 1172 OE2 GLU A 71 15.687 -4.784 -8.565 1.00 74.22 O ATOM 0 H GLU A 71 10.583 -3.984 -6.397 1.00 52.20 H new ATOM 0 HA GLU A 71 11.040 -6.222 -7.983 1.00 12.33 H new ATOM 0 HB2 GLU A 71 12.561 -4.271 -7.801 1.00 73.45 H new ATOM 0 HB3 GLU A 71 12.924 -4.675 -6.135 1.00 73.45 H new ATOM 0 HG2 GLU A 71 13.893 -6.881 -6.958 1.00 64.23 H new ATOM 0 HG3 GLU A 71 13.663 -6.313 -8.599 1.00 64.23 H new ATOM 1179 N TYR A 72 11.594 -6.772 -4.749 1.00 20.10 N ATOM 1180 CA TYR A 72 11.721 -7.781 -3.683 1.00 23.10 C ATOM 1181 C TYR A 72 10.480 -8.693 -3.638 1.00 71.50 C ATOM 1182 O TYR A 72 10.601 -9.917 -3.541 1.00 14.10 O ATOM 1183 CB TYR A 72 11.922 -7.068 -2.319 1.00 3.52 C ATOM 1184 CG TYR A 72 12.026 -8.007 -1.099 1.00 3.31 C ATOM 1185 CD1 TYR A 72 13.242 -8.598 -0.738 1.00 63.02 C ATOM 1186 CD2 TYR A 72 10.905 -8.301 -0.308 1.00 32.14 C ATOM 1187 CE1 TYR A 72 13.333 -9.433 0.361 1.00 52.42 C ATOM 1188 CE2 TYR A 72 10.999 -9.137 0.788 1.00 34.41 C ATOM 1189 CZ TYR A 72 12.212 -9.697 1.118 1.00 53.43 C ATOM 1190 OH TYR A 72 12.307 -10.534 2.211 1.00 51.53 O ATOM 0 H TYR A 72 11.618 -5.813 -4.402 1.00 20.10 H new ATOM 0 HA TYR A 72 12.587 -8.409 -3.893 1.00 23.10 H new ATOM 0 HB2 TYR A 72 12.828 -6.465 -2.372 1.00 3.52 H new ATOM 0 HB3 TYR A 72 11.091 -6.381 -2.160 1.00 3.52 H new ATOM 0 HD1 TYR A 72 14.125 -8.399 -1.328 1.00 63.02 H new ATOM 0 HD2 TYR A 72 9.950 -7.865 -0.561 1.00 32.14 H new ATOM 0 HE1 TYR A 72 14.281 -9.877 0.625 1.00 52.42 H new ATOM 0 HE2 TYR A 72 10.124 -9.350 1.384 1.00 34.41 H new ATOM 0 HH TYR A 72 12.008 -11.433 1.961 1.00 51.53 H new ATOM 1200 N ALA A 73 9.295 -8.069 -3.740 1.00 10.14 N ATOM 1201 CA ALA A 73 8.005 -8.769 -3.675 1.00 1.05 C ATOM 1202 C ALA A 73 7.830 -9.739 -4.861 1.00 24.21 C ATOM 1203 O ALA A 73 7.276 -10.825 -4.703 1.00 53.51 O ATOM 1204 CB ALA A 73 6.859 -7.750 -3.626 1.00 45.14 C ATOM 0 H ALA A 73 9.206 -7.061 -3.870 1.00 10.14 H new ATOM 0 HA ALA A 73 7.984 -9.366 -2.763 1.00 1.05 H new ATOM 0 HB1 ALA A 73 5.906 -8.276 -3.578 1.00 45.14 H new ATOM 0 HB2 ALA A 73 6.970 -7.120 -2.744 1.00 45.14 H new ATOM 0 HB3 ALA A 73 6.886 -7.129 -4.521 1.00 45.14 H new ATOM 1210 N GLN A 74 8.346 -9.342 -6.039 1.00 73.22 N ATOM 1211 CA GLN A 74 8.313 -10.179 -7.252 1.00 53.13 C ATOM 1212 C GLN A 74 9.288 -11.371 -7.119 1.00 71.11 C ATOM 1213 O GLN A 74 9.025 -12.444 -7.669 1.00 72.55 O ATOM 1214 CB GLN A 74 8.639 -9.349 -8.522 1.00 44.03 C ATOM 1215 CG GLN A 74 7.557 -8.317 -8.937 1.00 60.21 C ATOM 1216 CD GLN A 74 7.827 -7.705 -10.320 1.00 45.44 C ATOM 1217 OE1 GLN A 74 8.474 -8.326 -11.165 1.00 44.45 O ATOM 1218 NE2 GLN A 74 7.284 -6.529 -10.601 1.00 4.25 N ATOM 0 H GLN A 74 8.795 -8.437 -6.176 1.00 73.22 H new ATOM 0 HA GLN A 74 7.300 -10.568 -7.358 1.00 53.13 H new ATOM 0 HB2 GLN A 74 9.578 -8.820 -8.359 1.00 44.03 H new ATOM 0 HB3 GLN A 74 8.800 -10.036 -9.353 1.00 44.03 H new ATOM 0 HG2 GLN A 74 6.581 -8.801 -8.942 1.00 60.21 H new ATOM 0 HG3 GLN A 74 7.514 -7.521 -8.193 1.00 60.21 H new ATOM 0 HE21 GLN A 74 6.752 -6.030 -9.888 1.00 4.25 H new ATOM 0 HE22 GLN A 74 7.398 -6.123 -11.530 1.00 4.25 H new ATOM 1227 N LYS A 75 10.401 -11.178 -6.369 1.00 32.21 N ATOM 1228 CA LYS A 75 11.366 -12.274 -6.068 1.00 52.44 C ATOM 1229 C LYS A 75 10.731 -13.286 -5.093 1.00 63.34 C ATOM 1230 O LYS A 75 11.048 -14.479 -5.117 1.00 72.42 O ATOM 1231 CB LYS A 75 12.706 -11.728 -5.478 1.00 23.20 C ATOM 1232 CG LYS A 75 13.366 -10.604 -6.306 1.00 51.31 C ATOM 1233 CD LYS A 75 13.516 -10.934 -7.814 1.00 64.03 C ATOM 1234 CE LYS A 75 14.084 -9.755 -8.624 1.00 52.21 C ATOM 1235 NZ LYS A 75 14.228 -10.094 -10.067 1.00 54.45 N ATOM 0 H LYS A 75 10.655 -10.278 -5.961 1.00 32.21 H new ATOM 0 HA LYS A 75 11.601 -12.773 -7.009 1.00 52.44 H new ATOM 0 HB2 LYS A 75 12.519 -11.356 -4.471 1.00 23.20 H new ATOM 0 HB3 LYS A 75 13.410 -12.555 -5.387 1.00 23.20 H new ATOM 0 HG2 LYS A 75 12.774 -9.695 -6.201 1.00 51.31 H new ATOM 0 HG3 LYS A 75 14.352 -10.393 -5.891 1.00 51.31 H new ATOM 0 HD2 LYS A 75 14.170 -11.798 -7.930 1.00 64.03 H new ATOM 0 HD3 LYS A 75 12.544 -11.214 -8.219 1.00 64.03 H new ATOM 0 HE2 LYS A 75 13.428 -8.891 -8.517 1.00 52.21 H new ATOM 0 HE3 LYS A 75 15.055 -9.470 -8.219 1.00 52.21 H new ATOM 0 HZ1 LYS A 75 14.613 -9.275 -10.579 1.00 54.45 H new ATOM 0 HZ2 LYS A 75 14.874 -10.903 -10.171 1.00 54.45 H new ATOM 0 HZ3 LYS A 75 13.297 -10.342 -10.460 1.00 54.45 H new ATOM 1249 N GLU A 76 9.816 -12.773 -4.244 1.00 61.21 N ATOM 1250 CA GLU A 76 9.030 -13.579 -3.284 1.00 22.52 C ATOM 1251 C GLU A 76 7.751 -14.156 -3.935 1.00 54.11 C ATOM 1252 O GLU A 76 7.045 -14.958 -3.314 1.00 54.31 O ATOM 1253 CB GLU A 76 8.684 -12.712 -2.034 1.00 23.44 C ATOM 1254 CG GLU A 76 9.912 -12.153 -1.259 1.00 14.15 C ATOM 1255 CD GLU A 76 10.725 -13.188 -0.438 1.00 25.03 C ATOM 1256 OE1 GLU A 76 10.877 -14.358 -0.866 1.00 2.40 O ATOM 1257 OE2 GLU A 76 11.229 -12.836 0.653 1.00 2.33 O ATOM 0 H GLU A 76 9.599 -11.777 -4.205 1.00 61.21 H new ATOM 0 HA GLU A 76 9.635 -14.430 -2.970 1.00 22.52 H new ATOM 0 HB2 GLU A 76 8.063 -11.875 -2.352 1.00 23.44 H new ATOM 0 HB3 GLU A 76 8.084 -13.312 -1.350 1.00 23.44 H new ATOM 0 HG2 GLU A 76 10.583 -11.678 -1.975 1.00 14.15 H new ATOM 0 HG3 GLU A 76 9.565 -11.373 -0.581 1.00 14.15 H new ATOM 1264 N GLY A 77 7.474 -13.747 -5.192 1.00 30.33 N ATOM 1265 CA GLY A 77 6.335 -14.261 -5.968 1.00 71.44 C ATOM 1266 C GLY A 77 4.989 -13.799 -5.418 1.00 1.13 C ATOM 1267 O GLY A 77 4.057 -14.600 -5.269 1.00 30.20 O ATOM 0 H GLY A 77 8.033 -13.055 -5.691 1.00 30.33 H new ATOM 0 HA2 GLY A 77 6.430 -13.935 -7.004 1.00 71.44 H new ATOM 0 HA3 GLY A 77 6.366 -15.351 -5.972 1.00 71.44 H new ATOM 1271 N LEU A 78 4.907 -12.494 -5.115 1.00 54.23 N ATOM 1272 CA LEU A 78 3.746 -11.879 -4.449 1.00 11.35 C ATOM 1273 C LEU A 78 2.834 -11.157 -5.462 1.00 23.54 C ATOM 1274 O LEU A 78 2.881 -11.431 -6.665 1.00 1.11 O ATOM 1275 CB LEU A 78 4.248 -10.911 -3.342 1.00 2.04 C ATOM 1276 CG LEU A 78 5.140 -11.548 -2.236 1.00 34.40 C ATOM 1277 CD1 LEU A 78 5.528 -10.499 -1.190 1.00 25.45 C ATOM 1278 CD2 LEU A 78 4.464 -12.766 -1.576 1.00 15.42 C ATOM 0 H LEU A 78 5.651 -11.829 -5.327 1.00 54.23 H new ATOM 0 HA LEU A 78 3.142 -12.661 -3.989 1.00 11.35 H new ATOM 0 HB2 LEU A 78 4.810 -10.107 -3.817 1.00 2.04 H new ATOM 0 HB3 LEU A 78 3.381 -10.455 -2.865 1.00 2.04 H new ATOM 0 HG LEU A 78 6.048 -11.912 -2.716 1.00 34.40 H new ATOM 0 HD11 LEU A 78 6.151 -10.962 -0.425 1.00 25.45 H new ATOM 0 HD12 LEU A 78 6.082 -9.693 -1.671 1.00 25.45 H new ATOM 0 HD13 LEU A 78 4.627 -10.095 -0.729 1.00 25.45 H new ATOM 0 HD21 LEU A 78 5.123 -13.178 -0.811 1.00 15.42 H new ATOM 0 HD22 LEU A 78 3.525 -12.457 -1.118 1.00 15.42 H new ATOM 0 HD23 LEU A 78 4.266 -13.526 -2.332 1.00 15.42 H new ATOM 1290 N ARG A 79 1.986 -10.261 -4.941 1.00 74.13 N ATOM 1291 CA ARG A 79 0.988 -9.519 -5.711 1.00 3.14 C ATOM 1292 C ARG A 79 1.037 -8.070 -5.192 1.00 22.20 C ATOM 1293 O ARG A 79 0.688 -7.830 -4.038 1.00 52.35 O ATOM 1294 CB ARG A 79 -0.405 -10.195 -5.464 1.00 64.33 C ATOM 1295 CG ARG A 79 -1.506 -9.914 -6.511 1.00 35.55 C ATOM 1296 CD ARG A 79 -2.048 -8.474 -6.508 1.00 24.21 C ATOM 1297 NE ARG A 79 -3.092 -8.305 -7.523 1.00 3.13 N ATOM 1298 CZ ARG A 79 -3.510 -7.142 -8.023 1.00 44.51 C ATOM 1299 NH1 ARG A 79 -3.002 -5.988 -7.612 1.00 64.45 N ATOM 1300 NH2 ARG A 79 -4.455 -7.145 -8.946 1.00 22.54 N ATOM 0 H ARG A 79 1.977 -10.029 -3.948 1.00 74.13 H new ATOM 0 HA ARG A 79 1.171 -9.522 -6.785 1.00 3.14 H new ATOM 0 HB2 ARG A 79 -0.255 -11.273 -5.408 1.00 64.33 H new ATOM 0 HB3 ARG A 79 -0.772 -9.873 -4.489 1.00 64.33 H new ATOM 0 HG2 ARG A 79 -1.110 -10.136 -7.502 1.00 35.55 H new ATOM 0 HG3 ARG A 79 -2.335 -10.600 -6.338 1.00 35.55 H new ATOM 0 HD2 ARG A 79 -2.450 -8.235 -5.524 1.00 24.21 H new ATOM 0 HD3 ARG A 79 -1.234 -7.775 -6.698 1.00 24.21 H new ATOM 0 HE ARG A 79 -3.538 -9.151 -7.878 1.00 3.13 H new ATOM 0 HH11 ARG A 79 -2.274 -5.977 -6.897 1.00 64.45 H new ATOM 0 HH12 ARG A 79 -3.339 -5.112 -8.010 1.00 64.45 H new ATOM 0 HH21 ARG A 79 -4.853 -8.028 -9.265 1.00 22.54 H new ATOM 0 HH22 ARG A 79 -4.787 -6.264 -9.339 1.00 22.54 H new ATOM 1314 N VAL A 80 1.476 -7.109 -6.030 1.00 64.25 N ATOM 1315 CA VAL A 80 1.734 -5.730 -5.577 1.00 54.51 C ATOM 1316 C VAL A 80 0.620 -4.807 -6.090 1.00 52.25 C ATOM 1317 O VAL A 80 0.342 -4.755 -7.294 1.00 24.01 O ATOM 1318 CB VAL A 80 3.135 -5.183 -6.052 1.00 53.05 C ATOM 1319 CG1 VAL A 80 3.453 -3.839 -5.349 1.00 11.10 C ATOM 1320 CG2 VAL A 80 4.260 -6.219 -5.814 1.00 14.40 C ATOM 0 H VAL A 80 1.658 -7.264 -7.022 1.00 64.25 H new ATOM 0 HA VAL A 80 1.748 -5.745 -4.487 1.00 54.51 H new ATOM 0 HB VAL A 80 3.083 -5.007 -7.126 1.00 53.05 H new ATOM 0 HG11 VAL A 80 4.423 -3.473 -5.686 1.00 11.10 H new ATOM 0 HG12 VAL A 80 2.683 -3.108 -5.596 1.00 11.10 H new ATOM 0 HG13 VAL A 80 3.477 -3.990 -4.270 1.00 11.10 H new ATOM 0 HG21 VAL A 80 5.211 -5.808 -6.153 1.00 14.40 H new ATOM 0 HG22 VAL A 80 4.323 -6.450 -4.751 1.00 14.40 H new ATOM 0 HG23 VAL A 80 4.039 -7.130 -6.370 1.00 14.40 H new ATOM 1330 N LEU A 81 -0.019 -4.107 -5.156 1.00 60.35 N ATOM 1331 CA LEU A 81 -1.106 -3.178 -5.439 1.00 11.20 C ATOM 1332 C LEU A 81 -0.902 -1.926 -4.587 1.00 40.31 C ATOM 1333 O LEU A 81 -1.027 -1.992 -3.374 1.00 73.23 O ATOM 1334 CB LEU A 81 -2.453 -3.862 -5.101 1.00 21.11 C ATOM 1335 CG LEU A 81 -3.745 -3.040 -5.392 1.00 52.21 C ATOM 1336 CD1 LEU A 81 -3.865 -2.708 -6.876 1.00 74.11 C ATOM 1337 CD2 LEU A 81 -4.996 -3.781 -4.889 1.00 31.25 C ATOM 0 H LEU A 81 0.209 -4.172 -4.164 1.00 60.35 H new ATOM 0 HA LEU A 81 -1.116 -2.896 -6.492 1.00 11.20 H new ATOM 0 HB2 LEU A 81 -2.510 -4.796 -5.660 1.00 21.11 H new ATOM 0 HB3 LEU A 81 -2.446 -4.123 -4.043 1.00 21.11 H new ATOM 0 HG LEU A 81 -3.670 -2.099 -4.846 1.00 52.21 H new ATOM 0 HD11 LEU A 81 -4.776 -2.134 -7.048 1.00 74.11 H new ATOM 0 HD12 LEU A 81 -3.002 -2.120 -7.188 1.00 74.11 H new ATOM 0 HD13 LEU A 81 -3.903 -3.632 -7.454 1.00 74.11 H new ATOM 0 HD21 LEU A 81 -5.883 -3.185 -5.105 1.00 31.25 H new ATOM 0 HD22 LEU A 81 -5.075 -4.745 -5.392 1.00 31.25 H new ATOM 0 HD23 LEU A 81 -4.918 -3.939 -3.813 1.00 31.25 H new ATOM 1349 N VAL A 82 -0.558 -0.797 -5.208 1.00 11.13 N ATOM 1350 CA VAL A 82 -0.401 0.474 -4.471 1.00 45.13 C ATOM 1351 C VAL A 82 -1.704 1.294 -4.580 1.00 32.04 C ATOM 1352 O VAL A 82 -2.099 1.728 -5.667 1.00 22.10 O ATOM 1353 CB VAL A 82 0.868 1.294 -4.959 1.00 32.32 C ATOM 1354 CG1 VAL A 82 0.888 1.495 -6.488 1.00 20.33 C ATOM 1355 CG2 VAL A 82 0.988 2.653 -4.216 1.00 42.03 C ATOM 0 H VAL A 82 -0.382 -0.728 -6.210 1.00 11.13 H new ATOM 0 HA VAL A 82 -0.220 0.249 -3.420 1.00 45.13 H new ATOM 0 HB VAL A 82 1.741 0.692 -4.706 1.00 32.32 H new ATOM 0 HG11 VAL A 82 1.776 2.061 -6.769 1.00 20.33 H new ATOM 0 HG12 VAL A 82 0.906 0.524 -6.982 1.00 20.33 H new ATOM 0 HG13 VAL A 82 -0.003 2.042 -6.795 1.00 20.33 H new ATOM 0 HG21 VAL A 82 1.867 3.188 -4.575 1.00 42.03 H new ATOM 0 HG22 VAL A 82 0.097 3.251 -4.406 1.00 42.03 H new ATOM 0 HG23 VAL A 82 1.084 2.475 -3.145 1.00 42.03 H new ATOM 1365 N ILE A 83 -2.383 1.474 -3.431 1.00 23.31 N ATOM 1366 CA ILE A 83 -3.631 2.245 -3.340 1.00 73.40 C ATOM 1367 C ILE A 83 -3.277 3.653 -2.829 1.00 41.33 C ATOM 1368 O ILE A 83 -2.987 3.835 -1.655 1.00 61.11 O ATOM 1369 CB ILE A 83 -4.644 1.548 -2.341 1.00 10.11 C ATOM 1370 CG1 ILE A 83 -4.834 0.039 -2.710 1.00 35.41 C ATOM 1371 CG2 ILE A 83 -6.008 2.291 -2.313 1.00 42.10 C ATOM 1372 CD1 ILE A 83 -5.718 -0.740 -1.755 1.00 22.23 C ATOM 0 H ILE A 83 -2.078 1.086 -2.538 1.00 23.31 H new ATOM 0 HA ILE A 83 -4.109 2.299 -4.318 1.00 73.40 H new ATOM 0 HB ILE A 83 -4.219 1.602 -1.339 1.00 10.11 H new ATOM 0 HG12 ILE A 83 -5.259 -0.025 -3.712 1.00 35.41 H new ATOM 0 HG13 ILE A 83 -3.855 -0.438 -2.748 1.00 35.41 H new ATOM 0 HG21 ILE A 83 -6.682 1.789 -1.619 1.00 42.10 H new ATOM 0 HG22 ILE A 83 -5.855 3.321 -1.990 1.00 42.10 H new ATOM 0 HG23 ILE A 83 -6.446 2.285 -3.311 1.00 42.10 H new ATOM 0 HD11 ILE A 83 -5.792 -1.775 -2.090 1.00 22.23 H new ATOM 0 HD12 ILE A 83 -5.286 -0.712 -0.755 1.00 22.23 H new ATOM 0 HD13 ILE A 83 -6.712 -0.294 -1.733 1.00 22.23 H new ATOM 1384 N LYS A 84 -3.298 4.647 -3.720 1.00 1.24 N ATOM 1385 CA LYS A 84 -2.830 6.003 -3.399 1.00 64.23 C ATOM 1386 C LYS A 84 -3.756 7.071 -3.962 1.00 60.31 C ATOM 1387 O LYS A 84 -4.314 6.924 -5.055 1.00 75.22 O ATOM 1388 CB LYS A 84 -1.386 6.205 -3.882 1.00 71.31 C ATOM 1389 CG LYS A 84 -1.146 6.075 -5.390 1.00 61.15 C ATOM 1390 CD LYS A 84 0.351 6.202 -5.711 1.00 72.15 C ATOM 1391 CE LYS A 84 0.643 6.292 -7.202 1.00 63.24 C ATOM 1392 NZ LYS A 84 2.108 6.449 -7.440 1.00 22.13 N ATOM 0 H LYS A 84 -3.636 4.540 -4.676 1.00 1.24 H new ATOM 0 HA LYS A 84 -2.846 6.110 -2.314 1.00 64.23 H new ATOM 0 HB2 LYS A 84 -1.056 7.195 -3.568 1.00 71.31 H new ATOM 0 HB3 LYS A 84 -0.751 5.481 -3.372 1.00 71.31 H new ATOM 0 HG2 LYS A 84 -1.519 5.113 -5.742 1.00 61.15 H new ATOM 0 HG3 LYS A 84 -1.704 6.846 -5.921 1.00 61.15 H new ATOM 0 HD2 LYS A 84 0.747 7.089 -5.216 1.00 72.15 H new ATOM 0 HD3 LYS A 84 0.878 5.343 -5.296 1.00 72.15 H new ATOM 0 HE2 LYS A 84 0.281 5.395 -7.704 1.00 63.24 H new ATOM 0 HE3 LYS A 84 0.106 7.137 -7.633 1.00 63.24 H new ATOM 0 HZ1 LYS A 84 2.262 7.091 -8.244 1.00 22.13 H new ATOM 0 HZ2 LYS A 84 2.557 6.845 -6.590 1.00 22.13 H new ATOM 0 HZ3 LYS A 84 2.527 5.521 -7.653 1.00 22.13 H new ATOM 1406 N VAL A 85 -3.933 8.135 -3.182 1.00 72.44 N ATOM 1407 CA VAL A 85 -4.785 9.262 -3.549 1.00 22.31 C ATOM 1408 C VAL A 85 -3.969 10.254 -4.407 1.00 43.53 C ATOM 1409 O VAL A 85 -2.978 10.821 -3.930 1.00 51.22 O ATOM 1410 CB VAL A 85 -5.337 9.967 -2.248 1.00 44.24 C ATOM 1411 CG1 VAL A 85 -6.405 11.028 -2.575 1.00 32.50 C ATOM 1412 CG2 VAL A 85 -5.878 8.933 -1.235 1.00 10.43 C ATOM 0 H VAL A 85 -3.486 8.239 -2.271 1.00 72.44 H new ATOM 0 HA VAL A 85 -5.637 8.908 -4.130 1.00 22.31 H new ATOM 0 HB VAL A 85 -4.496 10.484 -1.787 1.00 44.24 H new ATOM 0 HG11 VAL A 85 -6.757 11.487 -1.651 1.00 32.50 H new ATOM 0 HG12 VAL A 85 -5.972 11.794 -3.219 1.00 32.50 H new ATOM 0 HG13 VAL A 85 -7.243 10.555 -3.087 1.00 32.50 H new ATOM 0 HG21 VAL A 85 -6.250 9.450 -0.351 1.00 10.43 H new ATOM 0 HG22 VAL A 85 -6.689 8.366 -1.692 1.00 10.43 H new ATOM 0 HG23 VAL A 85 -5.077 8.253 -0.947 1.00 10.43 H new ATOM 1422 N ALA A 86 -4.378 10.425 -5.685 1.00 41.21 N ATOM 1423 CA ALA A 86 -3.690 11.308 -6.641 1.00 61.43 C ATOM 1424 C ALA A 86 -3.965 12.782 -6.310 1.00 73.10 C ATOM 1425 O ALA A 86 -4.943 13.373 -6.783 1.00 53.15 O ATOM 1426 CB ALA A 86 -4.101 10.977 -8.085 1.00 55.24 C ATOM 0 H ALA A 86 -5.193 9.954 -6.077 1.00 41.21 H new ATOM 0 HA ALA A 86 -2.617 11.138 -6.554 1.00 61.43 H new ATOM 0 HB1 ALA A 86 -3.580 11.642 -8.773 1.00 55.24 H new ATOM 0 HB2 ALA A 86 -3.838 9.943 -8.310 1.00 55.24 H new ATOM 0 HB3 ALA A 86 -5.177 11.110 -8.197 1.00 55.24 H new ATOM 1432 N GLN A 87 -3.109 13.342 -5.449 1.00 74.34 N ATOM 1433 CA GLN A 87 -3.230 14.723 -4.967 1.00 24.43 C ATOM 1434 C GLN A 87 -2.723 15.726 -6.019 1.00 2.10 C ATOM 1435 O GLN A 87 -3.478 16.594 -6.471 1.00 45.24 O ATOM 1436 CB GLN A 87 -2.448 14.869 -3.643 1.00 72.21 C ATOM 1437 CG GLN A 87 -3.042 14.080 -2.461 1.00 14.44 C ATOM 1438 CD GLN A 87 -4.460 14.519 -2.093 1.00 55.33 C ATOM 1439 OE1 GLN A 87 -5.442 13.994 -2.606 1.00 2.13 O ATOM 1440 NE2 GLN A 87 -4.580 15.504 -1.219 1.00 42.02 N ATOM 0 H GLN A 87 -2.306 12.846 -5.063 1.00 74.34 H new ATOM 0 HA GLN A 87 -4.282 14.946 -4.790 1.00 24.43 H new ATOM 0 HB2 GLN A 87 -1.421 14.540 -3.804 1.00 72.21 H new ATOM 0 HB3 GLN A 87 -2.406 15.925 -3.375 1.00 72.21 H new ATOM 0 HG2 GLN A 87 -3.050 13.019 -2.709 1.00 14.44 H new ATOM 0 HG3 GLN A 87 -2.395 14.199 -1.592 1.00 14.44 H new ATOM 0 HE21 GLN A 87 -3.747 15.924 -0.806 1.00 42.02 H new ATOM 0 HE22 GLN A 87 -5.505 15.844 -0.957 1.00 42.02 H new ATOM 1449 N ASP A 88 -1.444 15.566 -6.425 1.00 35.10 N ATOM 1450 CA ASP A 88 -0.777 16.479 -7.385 1.00 3.43 C ATOM 1451 C ASP A 88 -1.414 16.373 -8.779 1.00 33.11 C ATOM 1452 O ASP A 88 -1.381 17.329 -9.561 1.00 3.45 O ATOM 1453 CB ASP A 88 0.728 16.131 -7.538 1.00 4.33 C ATOM 1454 CG ASP A 88 1.453 15.892 -6.214 1.00 42.45 C ATOM 1455 OD1 ASP A 88 1.703 16.865 -5.470 1.00 63.21 O ATOM 1456 OD2 ASP A 88 1.764 14.725 -5.906 1.00 64.21 O ATOM 0 H ASP A 88 -0.847 14.806 -6.100 1.00 35.10 H new ATOM 0 HA ASP A 88 -0.894 17.487 -6.987 1.00 3.43 H new ATOM 0 HB2 ASP A 88 0.822 15.239 -8.157 1.00 4.33 H new ATOM 0 HB3 ASP A 88 1.225 16.942 -8.070 1.00 4.33 H new ATOM 1461 N GLN A 89 -1.975 15.175 -9.058 1.00 3.32 N ATOM 1462 CA GLN A 89 -2.365 14.730 -10.400 1.00 71.54 C ATOM 1463 C GLN A 89 -1.108 14.684 -11.294 1.00 1.13 C ATOM 1464 O GLN A 89 -0.388 13.703 -11.232 1.00 55.44 O ATOM 1465 CB GLN A 89 -3.512 15.586 -11.016 1.00 71.12 C ATOM 1466 CG GLN A 89 -4.789 15.654 -10.163 1.00 33.44 C ATOM 1467 CD GLN A 89 -5.864 16.531 -10.799 1.00 74.31 C ATOM 1468 OE1 GLN A 89 -6.702 16.060 -11.563 1.00 51.55 O ATOM 1469 NE2 GLN A 89 -5.823 17.827 -10.527 1.00 24.44 N ATOM 0 H GLN A 89 -2.170 14.481 -8.336 1.00 3.32 H new ATOM 0 HA GLN A 89 -2.785 13.727 -10.327 1.00 71.54 H new ATOM 0 HB2 GLN A 89 -3.145 16.599 -11.178 1.00 71.12 H new ATOM 0 HB3 GLN A 89 -3.766 15.179 -11.995 1.00 71.12 H new ATOM 0 HG2 GLN A 89 -5.182 14.647 -10.020 1.00 33.44 H new ATOM 0 HG3 GLN A 89 -4.543 16.043 -9.175 1.00 33.44 H new ATOM 0 HE21 GLN A 89 -5.116 18.192 -9.889 1.00 24.44 H new ATOM 0 HE22 GLN A 89 -6.498 18.460 -10.956 1.00 24.44 H new ATOM 1478 N GLU A 90 -0.782 15.811 -11.972 1.00 55.21 N ATOM 1479 CA GLU A 90 0.277 15.883 -13.014 1.00 25.20 C ATOM 1480 C GLU A 90 1.662 15.427 -12.494 1.00 61.25 C ATOM 1481 O GLU A 90 2.324 14.593 -13.129 1.00 4.33 O ATOM 1482 CB GLU A 90 0.363 17.329 -13.580 1.00 40.31 C ATOM 1483 CG GLU A 90 1.343 17.502 -14.759 1.00 33.35 C ATOM 1484 CD GLU A 90 1.491 18.970 -15.190 1.00 42.21 C ATOM 1485 OE1 GLU A 90 0.691 19.443 -16.026 1.00 13.11 O ATOM 1486 OE2 GLU A 90 2.394 19.662 -14.671 1.00 53.14 O ATOM 0 H GLU A 90 -1.249 16.704 -11.812 1.00 55.21 H new ATOM 0 HA GLU A 90 -0.004 15.191 -13.808 1.00 25.20 H new ATOM 0 HB2 GLU A 90 -0.631 17.638 -13.903 1.00 40.31 H new ATOM 0 HB3 GLU A 90 0.660 18.002 -12.776 1.00 40.31 H new ATOM 0 HG2 GLU A 90 2.320 17.109 -14.476 1.00 33.35 H new ATOM 0 HG3 GLU A 90 0.995 16.911 -15.606 1.00 33.35 H new ATOM 1493 N LEU A 91 2.084 15.974 -11.338 1.00 1.11 N ATOM 1494 CA LEU A 91 3.375 15.619 -10.706 1.00 51.11 C ATOM 1495 C LEU A 91 3.359 14.158 -10.211 1.00 44.41 C ATOM 1496 O LEU A 91 4.356 13.436 -10.350 1.00 44.22 O ATOM 1497 CB LEU A 91 3.690 16.602 -9.540 1.00 3.32 C ATOM 1498 CG LEU A 91 5.008 16.346 -8.731 1.00 65.31 C ATOM 1499 CD1 LEU A 91 6.261 16.486 -9.624 1.00 42.25 C ATOM 1500 CD2 LEU A 91 5.087 17.271 -7.490 1.00 65.21 C ATOM 0 H LEU A 91 1.548 16.668 -10.818 1.00 1.11 H new ATOM 0 HA LEU A 91 4.165 15.707 -11.452 1.00 51.11 H new ATOM 0 HB2 LEU A 91 3.735 17.611 -9.950 1.00 3.32 H new ATOM 0 HB3 LEU A 91 2.854 16.578 -8.841 1.00 3.32 H new ATOM 0 HG LEU A 91 4.982 15.316 -8.376 1.00 65.31 H new ATOM 0 HD11 LEU A 91 7.155 16.302 -9.028 1.00 42.25 H new ATOM 0 HD12 LEU A 91 6.211 15.762 -10.437 1.00 42.25 H new ATOM 0 HD13 LEU A 91 6.302 17.494 -10.038 1.00 42.25 H new ATOM 0 HD21 LEU A 91 6.011 17.073 -6.947 1.00 65.21 H new ATOM 0 HD22 LEU A 91 5.071 18.313 -7.811 1.00 65.21 H new ATOM 0 HD23 LEU A 91 4.235 17.079 -6.838 1.00 65.21 H new ATOM 1512 N LEU A 92 2.198 13.719 -9.686 1.00 61.31 N ATOM 1513 CA LEU A 92 2.031 12.359 -9.141 1.00 62.12 C ATOM 1514 C LEU A 92 1.968 11.321 -10.288 1.00 44.30 C ATOM 1515 O LEU A 92 2.361 10.171 -10.089 1.00 41.45 O ATOM 1516 CB LEU A 92 0.776 12.309 -8.209 1.00 33.30 C ATOM 1517 CG LEU A 92 0.570 11.001 -7.336 1.00 43.32 C ATOM 1518 CD1 LEU A 92 -0.017 11.330 -5.938 1.00 13.14 C ATOM 1519 CD2 LEU A 92 -0.319 9.957 -8.063 1.00 24.23 C ATOM 0 H LEU A 92 1.357 14.293 -9.628 1.00 61.31 H new ATOM 0 HA LEU A 92 2.896 12.098 -8.531 1.00 62.12 H new ATOM 0 HB2 LEU A 92 0.824 13.162 -7.532 1.00 33.30 H new ATOM 0 HB3 LEU A 92 -0.110 12.444 -8.829 1.00 33.30 H new ATOM 0 HG LEU A 92 1.558 10.563 -7.194 1.00 43.32 H new ATOM 0 HD11 LEU A 92 -0.143 10.408 -5.370 1.00 13.14 H new ATOM 0 HD12 LEU A 92 0.663 11.994 -5.405 1.00 13.14 H new ATOM 0 HD13 LEU A 92 -0.984 11.819 -6.055 1.00 13.14 H new ATOM 0 HD21 LEU A 92 -0.436 9.076 -7.432 1.00 24.23 H new ATOM 0 HD22 LEU A 92 -1.298 10.391 -8.265 1.00 24.23 H new ATOM 0 HD23 LEU A 92 0.152 9.670 -9.003 1.00 24.23 H new ATOM 1531 N GLU A 93 1.532 11.764 -11.502 1.00 13.44 N ATOM 1532 CA GLU A 93 1.421 10.905 -12.712 1.00 43.34 C ATOM 1533 C GLU A 93 2.779 10.327 -13.132 1.00 31.31 C ATOM 1534 O GLU A 93 2.835 9.269 -13.770 1.00 72.11 O ATOM 1535 CB GLU A 93 0.815 11.686 -13.912 1.00 62.41 C ATOM 1536 CG GLU A 93 -0.681 12.024 -13.800 1.00 63.11 C ATOM 1537 CD GLU A 93 -1.584 10.797 -13.627 1.00 13.21 C ATOM 1538 OE1 GLU A 93 -1.781 10.055 -14.620 1.00 62.32 O ATOM 1539 OE2 GLU A 93 -2.121 10.582 -12.512 1.00 35.34 O ATOM 0 H GLU A 93 1.248 12.730 -11.666 1.00 13.44 H new ATOM 0 HA GLU A 93 0.756 10.085 -12.441 1.00 43.34 H new ATOM 0 HB2 GLU A 93 1.371 12.616 -14.035 1.00 62.41 H new ATOM 0 HB3 GLU A 93 0.970 11.100 -14.818 1.00 62.41 H new ATOM 0 HG2 GLU A 93 -0.830 12.694 -12.954 1.00 63.11 H new ATOM 0 HG3 GLU A 93 -0.989 12.566 -14.694 1.00 63.11 H new ATOM 1546 N ARG A 94 3.855 11.043 -12.784 1.00 51.53 N ATOM 1547 CA ARG A 94 5.224 10.626 -13.075 1.00 3.35 C ATOM 1548 C ARG A 94 5.540 9.262 -12.415 1.00 44.33 C ATOM 1549 O ARG A 94 5.967 8.319 -13.093 1.00 14.42 O ATOM 1550 CB ARG A 94 6.208 11.728 -12.593 1.00 0.20 C ATOM 1551 CG ARG A 94 7.705 11.386 -12.760 1.00 61.44 C ATOM 1552 CD ARG A 94 8.108 11.119 -14.224 1.00 40.22 C ATOM 1553 NE ARG A 94 9.500 10.643 -14.320 1.00 24.34 N ATOM 1554 CZ ARG A 94 9.914 9.589 -15.042 1.00 61.11 C ATOM 1555 NH1 ARG A 94 9.054 8.865 -15.760 1.00 13.42 N ATOM 1556 NH2 ARG A 94 11.200 9.267 -15.040 1.00 62.24 N ATOM 0 H ARG A 94 3.795 11.933 -12.290 1.00 51.53 H new ATOM 0 HA ARG A 94 5.339 10.496 -14.151 1.00 3.35 H new ATOM 0 HB2 ARG A 94 5.997 12.647 -13.141 1.00 0.20 H new ATOM 0 HB3 ARG A 94 6.013 11.933 -11.540 1.00 0.20 H new ATOM 0 HG2 ARG A 94 8.305 12.208 -12.369 1.00 61.44 H new ATOM 0 HG3 ARG A 94 7.939 10.507 -12.159 1.00 61.44 H new ATOM 0 HD2 ARG A 94 7.437 10.377 -14.658 1.00 40.22 H new ATOM 0 HD3 ARG A 94 7.993 12.033 -14.807 1.00 40.22 H new ATOM 0 HE ARG A 94 10.207 11.157 -13.794 1.00 24.34 H new ATOM 0 HH11 ARG A 94 8.064 9.109 -15.767 1.00 13.42 H new ATOM 0 HH12 ARG A 94 9.387 8.068 -16.302 1.00 13.42 H new ATOM 0 HH21 ARG A 94 11.863 9.818 -14.494 1.00 62.24 H new ATOM 0 HH22 ARG A 94 11.527 8.469 -15.584 1.00 62.24 H new ATOM 1570 N PHE A 95 5.292 9.161 -11.098 1.00 35.34 N ATOM 1571 CA PHE A 95 5.540 7.921 -10.340 1.00 54.34 C ATOM 1572 C PHE A 95 4.387 6.912 -10.539 1.00 1.44 C ATOM 1573 O PHE A 95 4.614 5.705 -10.565 1.00 4.23 O ATOM 1574 CB PHE A 95 5.765 8.227 -8.834 1.00 71.45 C ATOM 1575 CG PHE A 95 6.357 7.047 -8.051 1.00 60.50 C ATOM 1576 CD1 PHE A 95 7.686 6.658 -8.253 1.00 70.15 C ATOM 1577 CD2 PHE A 95 5.595 6.320 -7.135 1.00 1.32 C ATOM 1578 CE1 PHE A 95 8.229 5.589 -7.560 1.00 53.10 C ATOM 1579 CE2 PHE A 95 6.141 5.251 -6.443 1.00 1.23 C ATOM 1580 CZ PHE A 95 7.455 4.886 -6.656 1.00 73.51 C ATOM 0 H PHE A 95 4.919 9.925 -10.534 1.00 35.34 H new ATOM 0 HA PHE A 95 6.451 7.465 -10.727 1.00 54.34 H new ATOM 0 HB2 PHE A 95 6.431 9.085 -8.741 1.00 71.45 H new ATOM 0 HB3 PHE A 95 4.814 8.511 -8.383 1.00 71.45 H new ATOM 0 HD1 PHE A 95 8.297 7.199 -8.960 1.00 70.15 H new ATOM 0 HD2 PHE A 95 4.565 6.595 -6.963 1.00 1.32 H new ATOM 0 HE1 PHE A 95 9.258 5.305 -7.726 1.00 53.10 H new ATOM 0 HE2 PHE A 95 5.537 4.702 -5.735 1.00 1.23 H new ATOM 0 HZ PHE A 95 7.878 4.052 -6.117 1.00 73.51 H new ATOM 1590 N TYR A 96 3.159 7.438 -10.687 1.00 74.52 N ATOM 1591 CA TYR A 96 1.930 6.637 -10.880 1.00 50.33 C ATOM 1592 C TYR A 96 2.045 5.709 -12.105 1.00 14.54 C ATOM 1593 O TYR A 96 1.840 4.491 -11.996 1.00 61.42 O ATOM 1594 CB TYR A 96 0.714 7.595 -11.013 1.00 13.05 C ATOM 1595 CG TYR A 96 -0.577 6.980 -11.568 1.00 72.01 C ATOM 1596 CD1 TYR A 96 -1.309 6.048 -10.841 1.00 53.21 C ATOM 1597 CD2 TYR A 96 -1.077 7.358 -12.818 1.00 13.44 C ATOM 1598 CE1 TYR A 96 -2.483 5.521 -11.339 1.00 40.30 C ATOM 1599 CE2 TYR A 96 -2.250 6.829 -13.317 1.00 75.51 C ATOM 1600 CZ TYR A 96 -2.950 5.912 -12.574 1.00 63.34 C ATOM 1601 OH TYR A 96 -4.121 5.370 -13.070 1.00 64.44 O ATOM 0 H TYR A 96 2.986 8.443 -10.676 1.00 74.52 H new ATOM 0 HA TYR A 96 1.788 5.994 -10.012 1.00 50.33 H new ATOM 0 HB2 TYR A 96 0.499 8.013 -10.030 1.00 13.05 H new ATOM 0 HB3 TYR A 96 1.002 8.426 -11.657 1.00 13.05 H new ATOM 0 HD1 TYR A 96 -0.953 5.732 -9.872 1.00 53.21 H new ATOM 0 HD2 TYR A 96 -0.532 8.081 -13.407 1.00 13.44 H new ATOM 0 HE1 TYR A 96 -3.038 4.799 -10.758 1.00 40.30 H new ATOM 0 HE2 TYR A 96 -2.615 7.135 -14.286 1.00 75.51 H new ATOM 0 HH TYR A 96 -4.311 5.753 -13.952 1.00 64.44 H new ATOM 1611 N GLU A 97 2.404 6.311 -13.245 1.00 11.44 N ATOM 1612 CA GLU A 97 2.551 5.609 -14.523 1.00 71.41 C ATOM 1613 C GLU A 97 3.768 4.677 -14.514 1.00 42.53 C ATOM 1614 O GLU A 97 3.731 3.601 -15.124 1.00 73.05 O ATOM 1615 CB GLU A 97 2.674 6.634 -15.673 1.00 24.33 C ATOM 1616 CG GLU A 97 2.811 5.992 -17.062 1.00 32.32 C ATOM 1617 CD GLU A 97 2.908 7.006 -18.198 1.00 42.05 C ATOM 1618 OE1 GLU A 97 3.976 7.633 -18.341 1.00 33.30 O ATOM 1619 OE2 GLU A 97 1.947 7.139 -18.981 1.00 32.44 O ATOM 0 H GLU A 97 2.602 7.310 -13.305 1.00 11.44 H new ATOM 0 HA GLU A 97 1.663 4.996 -14.677 1.00 71.41 H new ATOM 0 HB2 GLU A 97 1.797 7.281 -15.667 1.00 24.33 H new ATOM 0 HB3 GLU A 97 3.540 7.270 -15.490 1.00 24.33 H new ATOM 0 HG2 GLU A 97 3.699 5.359 -17.074 1.00 32.32 H new ATOM 0 HG3 GLU A 97 1.954 5.342 -17.239 1.00 32.32 H new ATOM 1626 N GLN A 98 4.821 5.100 -13.785 1.00 25.10 N ATOM 1627 CA GLN A 98 6.112 4.407 -13.744 1.00 3.25 C ATOM 1628 C GLN A 98 5.932 2.927 -13.340 1.00 41.51 C ATOM 1629 O GLN A 98 6.375 2.032 -14.060 1.00 70.54 O ATOM 1630 CB GLN A 98 7.077 5.146 -12.777 1.00 74.31 C ATOM 1631 CG GLN A 98 8.494 4.556 -12.684 1.00 42.00 C ATOM 1632 CD GLN A 98 9.213 4.478 -14.033 1.00 4.24 C ATOM 1633 OE1 GLN A 98 9.886 5.423 -14.451 1.00 42.11 O ATOM 1634 NE2 GLN A 98 9.080 3.353 -14.723 1.00 34.43 N ATOM 0 H GLN A 98 4.793 5.939 -13.206 1.00 25.10 H new ATOM 0 HA GLN A 98 6.550 4.418 -14.742 1.00 3.25 H new ATOM 0 HB2 GLN A 98 7.155 6.186 -13.092 1.00 74.31 H new ATOM 0 HB3 GLN A 98 6.636 5.147 -11.780 1.00 74.31 H new ATOM 0 HG2 GLN A 98 9.087 5.163 -12.000 1.00 42.00 H new ATOM 0 HG3 GLN A 98 8.435 3.556 -12.254 1.00 42.00 H new ATOM 0 HE21 GLN A 98 8.516 2.589 -14.350 1.00 34.43 H new ATOM 0 HE22 GLN A 98 9.542 3.252 -15.627 1.00 34.43 H new ATOM 1643 N LEU A 99 5.188 2.693 -12.241 1.00 3.12 N ATOM 1644 CA LEU A 99 4.930 1.331 -11.717 1.00 51.01 C ATOM 1645 C LEU A 99 4.114 0.493 -12.710 1.00 61.31 C ATOM 1646 O LEU A 99 4.322 -0.715 -12.821 1.00 21.14 O ATOM 1647 CB LEU A 99 4.214 1.378 -10.335 1.00 74.12 C ATOM 1648 CG LEU A 99 5.118 1.721 -9.112 1.00 62.02 C ATOM 1649 CD1 LEU A 99 5.696 3.131 -9.232 1.00 73.10 C ATOM 1650 CD2 LEU A 99 4.353 1.538 -7.786 1.00 60.41 C ATOM 0 H LEU A 99 4.751 3.434 -11.693 1.00 3.12 H new ATOM 0 HA LEU A 99 5.900 0.853 -11.583 1.00 51.01 H new ATOM 0 HB2 LEU A 99 3.412 2.114 -10.388 1.00 74.12 H new ATOM 0 HB3 LEU A 99 3.746 0.410 -10.157 1.00 74.12 H new ATOM 0 HG LEU A 99 5.954 1.022 -9.109 1.00 62.02 H new ATOM 0 HD11 LEU A 99 6.322 3.343 -8.365 1.00 73.10 H new ATOM 0 HD12 LEU A 99 6.296 3.202 -10.139 1.00 73.10 H new ATOM 0 HD13 LEU A 99 4.883 3.855 -9.277 1.00 73.10 H new ATOM 0 HD21 LEU A 99 5.009 1.784 -6.951 1.00 60.41 H new ATOM 0 HD22 LEU A 99 3.485 2.197 -7.773 1.00 60.41 H new ATOM 0 HD23 LEU A 99 4.024 0.503 -7.696 1.00 60.41 H new ATOM 1662 N LYS A 100 3.204 1.153 -13.442 1.00 34.14 N ATOM 1663 CA LYS A 100 2.345 0.483 -14.433 1.00 24.22 C ATOM 1664 C LYS A 100 3.185 0.000 -15.637 1.00 52.02 C ATOM 1665 O LYS A 100 2.883 -1.033 -16.246 1.00 24.22 O ATOM 1666 CB LYS A 100 1.204 1.430 -14.900 1.00 12.24 C ATOM 1667 CG LYS A 100 0.392 2.081 -13.753 1.00 55.13 C ATOM 1668 CD LYS A 100 -0.939 2.746 -14.210 1.00 33.12 C ATOM 1669 CE LYS A 100 -0.784 4.008 -15.079 1.00 35.44 C ATOM 1670 NZ LYS A 100 -0.265 3.746 -16.450 1.00 62.02 N ATOM 0 H LYS A 100 3.043 2.157 -13.366 1.00 34.14 H new ATOM 0 HA LYS A 100 1.890 -0.388 -13.962 1.00 24.22 H new ATOM 0 HB2 LYS A 100 1.635 2.220 -15.515 1.00 12.24 H new ATOM 0 HB3 LYS A 100 0.521 0.867 -15.536 1.00 12.24 H new ATOM 0 HG2 LYS A 100 0.167 1.320 -13.005 1.00 55.13 H new ATOM 0 HG3 LYS A 100 1.012 2.833 -13.266 1.00 55.13 H new ATOM 0 HD2 LYS A 100 -1.520 2.011 -14.767 1.00 33.12 H new ATOM 0 HD3 LYS A 100 -1.519 3.005 -13.324 1.00 33.12 H new ATOM 0 HE2 LYS A 100 -1.752 4.502 -15.158 1.00 35.44 H new ATOM 0 HE3 LYS A 100 -0.112 4.702 -14.575 1.00 35.44 H new ATOM 0 HZ1 LYS A 100 -0.695 4.417 -17.118 1.00 62.02 H new ATOM 0 HZ2 LYS A 100 0.768 3.863 -16.458 1.00 62.02 H new ATOM 0 HZ3 LYS A 100 -0.505 2.774 -16.732 1.00 62.02 H new ATOM 1684 N LYS A 101 4.249 0.766 -15.953 1.00 20.22 N ATOM 1685 CA LYS A 101 5.235 0.405 -16.993 1.00 62.04 C ATOM 1686 C LYS A 101 6.142 -0.762 -16.526 1.00 55.05 C ATOM 1687 O LYS A 101 6.511 -1.625 -17.332 1.00 55.32 O ATOM 1688 CB LYS A 101 6.082 1.657 -17.408 1.00 53.32 C ATOM 1689 CG LYS A 101 5.405 2.567 -18.463 1.00 22.21 C ATOM 1690 CD LYS A 101 6.306 3.743 -18.917 1.00 14.42 C ATOM 1691 CE LYS A 101 5.823 4.419 -20.219 1.00 10.03 C ATOM 1692 NZ LYS A 101 4.473 5.033 -20.106 1.00 62.30 N ATOM 0 H LYS A 101 4.449 1.654 -15.493 1.00 20.22 H new ATOM 0 HA LYS A 101 4.691 0.060 -17.872 1.00 62.04 H new ATOM 0 HB2 LYS A 101 6.293 2.249 -16.517 1.00 53.32 H new ATOM 0 HB3 LYS A 101 7.041 1.318 -17.800 1.00 53.32 H new ATOM 0 HG2 LYS A 101 5.135 1.967 -19.332 1.00 22.21 H new ATOM 0 HG3 LYS A 101 4.478 2.965 -18.050 1.00 22.21 H new ATOM 0 HD2 LYS A 101 6.346 4.488 -18.123 1.00 14.42 H new ATOM 0 HD3 LYS A 101 7.323 3.377 -19.062 1.00 14.42 H new ATOM 0 HE2 LYS A 101 6.540 5.188 -20.507 1.00 10.03 H new ATOM 0 HE3 LYS A 101 5.811 3.679 -21.020 1.00 10.03 H new ATOM 0 HZ1 LYS A 101 3.865 4.678 -20.871 1.00 62.30 H new ATOM 0 HZ2 LYS A 101 4.054 4.784 -19.187 1.00 62.30 H new ATOM 0 HZ3 LYS A 101 4.555 6.067 -20.181 1.00 62.30 H new ATOM 1706 N ASP A 102 6.480 -0.783 -15.220 1.00 61.34 N ATOM 1707 CA ASP A 102 7.276 -1.880 -14.602 1.00 73.32 C ATOM 1708 C ASP A 102 6.429 -3.155 -14.422 1.00 54.04 C ATOM 1709 O ASP A 102 6.976 -4.261 -14.323 1.00 10.41 O ATOM 1710 CB ASP A 102 7.873 -1.438 -13.234 1.00 4.32 C ATOM 1711 CG ASP A 102 8.997 -0.399 -13.380 1.00 61.14 C ATOM 1712 OD1 ASP A 102 10.155 -0.790 -13.635 1.00 1.33 O ATOM 1713 OD2 ASP A 102 8.734 0.809 -13.252 1.00 61.22 O ATOM 0 H ASP A 102 6.214 -0.049 -14.563 1.00 61.34 H new ATOM 0 HA ASP A 102 8.097 -2.106 -15.283 1.00 73.32 H new ATOM 0 HB2 ASP A 102 7.079 -1.022 -12.614 1.00 4.32 H new ATOM 0 HB3 ASP A 102 8.260 -2.313 -12.712 1.00 4.32 H new ATOM 1718 N GLY A 103 5.098 -2.980 -14.370 1.00 3.42 N ATOM 1719 CA GLY A 103 4.154 -4.086 -14.223 1.00 51.41 C ATOM 1720 C GLY A 103 3.676 -4.224 -12.788 1.00 30.20 C ATOM 1721 O GLY A 103 3.965 -5.217 -12.114 1.00 45.32 O ATOM 0 H GLY A 103 4.652 -2.065 -14.429 1.00 3.42 H new ATOM 0 HA2 GLY A 103 3.298 -3.925 -14.879 1.00 51.41 H new ATOM 0 HA3 GLY A 103 4.628 -5.015 -14.540 1.00 51.41 H new ATOM 1725 N VAL A 104 2.992 -3.171 -12.307 1.00 61.43 N ATOM 1726 CA VAL A 104 2.365 -3.127 -10.972 1.00 61.13 C ATOM 1727 C VAL A 104 0.943 -2.595 -11.126 1.00 71.11 C ATOM 1728 O VAL A 104 0.709 -1.648 -11.893 1.00 12.32 O ATOM 1729 CB VAL A 104 3.157 -2.200 -9.971 1.00 40.01 C ATOM 1730 CG1 VAL A 104 2.498 -2.154 -8.570 1.00 11.02 C ATOM 1731 CG2 VAL A 104 4.620 -2.646 -9.859 1.00 50.42 C ATOM 0 H VAL A 104 2.857 -2.313 -12.842 1.00 61.43 H new ATOM 0 HA VAL A 104 2.370 -4.136 -10.559 1.00 61.13 H new ATOM 0 HB VAL A 104 3.125 -1.190 -10.379 1.00 40.01 H new ATOM 0 HG11 VAL A 104 3.079 -1.504 -7.916 1.00 11.02 H new ATOM 0 HG12 VAL A 104 1.483 -1.767 -8.658 1.00 11.02 H new ATOM 0 HG13 VAL A 104 2.468 -3.159 -8.149 1.00 11.02 H new ATOM 0 HG21 VAL A 104 5.147 -1.993 -9.164 1.00 50.42 H new ATOM 0 HG22 VAL A 104 4.661 -3.672 -9.494 1.00 50.42 H new ATOM 0 HG23 VAL A 104 5.093 -2.590 -10.839 1.00 50.42 H new ATOM 1741 N ASP A 105 0.003 -3.212 -10.407 1.00 25.54 N ATOM 1742 CA ASP A 105 -1.397 -2.794 -10.410 1.00 42.23 C ATOM 1743 C ASP A 105 -1.556 -1.627 -9.416 1.00 5.44 C ATOM 1744 O ASP A 105 -0.940 -1.643 -8.341 1.00 13.01 O ATOM 1745 CB ASP A 105 -2.289 -3.995 -10.016 1.00 54.31 C ATOM 1746 CG ASP A 105 -3.741 -3.898 -10.508 1.00 4.50 C ATOM 1747 OD1 ASP A 105 -3.996 -3.318 -11.588 1.00 1.32 O ATOM 1748 OD2 ASP A 105 -4.629 -4.441 -9.833 1.00 22.44 O ATOM 0 H ASP A 105 0.193 -4.015 -9.807 1.00 25.54 H new ATOM 0 HA ASP A 105 -1.703 -2.459 -11.401 1.00 42.23 H new ATOM 0 HB2 ASP A 105 -1.844 -4.907 -10.413 1.00 54.31 H new ATOM 0 HB3 ASP A 105 -2.292 -4.088 -8.930 1.00 54.31 H new ATOM 1753 N VAL A 106 -2.380 -0.630 -9.764 1.00 12.22 N ATOM 1754 CA VAL A 106 -2.478 0.627 -9.010 1.00 21.51 C ATOM 1755 C VAL A 106 -3.955 0.985 -8.815 1.00 21.23 C ATOM 1756 O VAL A 106 -4.794 0.743 -9.695 1.00 51.12 O ATOM 1757 CB VAL A 106 -1.733 1.812 -9.744 1.00 24.02 C ATOM 1758 CG1 VAL A 106 -0.221 1.526 -9.943 1.00 34.33 C ATOM 1759 CG2 VAL A 106 -2.406 2.125 -11.094 1.00 63.53 C ATOM 0 H VAL A 106 -2.997 -0.672 -10.575 1.00 12.22 H new ATOM 0 HA VAL A 106 -1.994 0.482 -8.044 1.00 21.51 H new ATOM 0 HB VAL A 106 -1.812 2.686 -9.098 1.00 24.02 H new ATOM 0 HG11 VAL A 106 0.245 2.370 -10.451 1.00 34.33 H new ATOM 0 HG12 VAL A 106 0.253 1.381 -8.972 1.00 34.33 H new ATOM 0 HG13 VAL A 106 -0.097 0.626 -10.545 1.00 34.33 H new ATOM 0 HG21 VAL A 106 -1.878 2.944 -11.583 1.00 63.53 H new ATOM 0 HG22 VAL A 106 -2.373 1.241 -11.730 1.00 63.53 H new ATOM 0 HG23 VAL A 106 -3.444 2.412 -10.925 1.00 63.53 H new ATOM 1769 N ARG A 107 -4.267 1.545 -7.653 1.00 62.04 N ATOM 1770 CA ARG A 107 -5.616 1.965 -7.313 1.00 3.11 C ATOM 1771 C ARG A 107 -5.550 3.443 -6.908 1.00 22.33 C ATOM 1772 O ARG A 107 -5.064 3.765 -5.830 1.00 60.11 O ATOM 1773 CB ARG A 107 -6.161 1.078 -6.135 1.00 72.14 C ATOM 1774 CG ARG A 107 -7.565 0.475 -6.351 1.00 12.41 C ATOM 1775 CD ARG A 107 -7.569 -0.860 -7.113 1.00 51.13 C ATOM 1776 NE ARG A 107 -7.033 -0.756 -8.482 1.00 11.52 N ATOM 1777 CZ ARG A 107 -6.623 -1.799 -9.214 1.00 73.02 C ATOM 1778 NH1 ARG A 107 -6.686 -3.025 -8.721 1.00 72.02 N ATOM 1779 NH2 ARG A 107 -6.124 -1.613 -10.426 1.00 71.24 N ATOM 0 H ARG A 107 -3.584 1.721 -6.916 1.00 62.04 H new ATOM 0 HA ARG A 107 -6.294 1.845 -8.158 1.00 3.11 H new ATOM 0 HB2 ARG A 107 -5.458 0.263 -5.961 1.00 72.14 H new ATOM 0 HB3 ARG A 107 -6.180 1.682 -5.228 1.00 72.14 H new ATOM 0 HG2 ARG A 107 -8.038 0.327 -5.380 1.00 12.41 H new ATOM 0 HG3 ARG A 107 -8.176 1.194 -6.897 1.00 12.41 H new ATOM 0 HD2 ARG A 107 -6.981 -1.589 -6.556 1.00 51.13 H new ATOM 0 HD3 ARG A 107 -8.589 -1.240 -7.159 1.00 51.13 H new ATOM 0 HE ARG A 107 -6.970 0.173 -8.899 1.00 11.52 H new ATOM 0 HH11 ARG A 107 -7.048 -3.178 -7.780 1.00 72.02 H new ATOM 0 HH12 ARG A 107 -6.373 -3.817 -9.282 1.00 72.02 H new ATOM 0 HH21 ARG A 107 -6.050 -0.670 -10.808 1.00 71.24 H new ATOM 0 HH22 ARG A 107 -5.814 -2.413 -10.978 1.00 71.24 H new ATOM 1793 N VAL A 108 -6.018 4.343 -7.782 1.00 2.54 N ATOM 1794 CA VAL A 108 -6.145 5.770 -7.450 1.00 53.00 C ATOM 1795 C VAL A 108 -7.609 6.104 -7.199 1.00 10.45 C ATOM 1796 O VAL A 108 -8.500 5.653 -7.928 1.00 62.44 O ATOM 1797 CB VAL A 108 -5.522 6.730 -8.537 1.00 63.54 C ATOM 1798 CG1 VAL A 108 -3.977 6.704 -8.454 1.00 1.34 C ATOM 1799 CG2 VAL A 108 -6.025 6.389 -9.966 1.00 15.14 C ATOM 0 H VAL A 108 -6.316 4.108 -8.729 1.00 2.54 H new ATOM 0 HA VAL A 108 -5.564 5.943 -6.544 1.00 53.00 H new ATOM 0 HB VAL A 108 -5.858 7.745 -8.323 1.00 63.54 H new ATOM 0 HG11 VAL A 108 -3.561 7.371 -9.209 1.00 1.34 H new ATOM 0 HG12 VAL A 108 -3.660 7.034 -7.465 1.00 1.34 H new ATOM 0 HG13 VAL A 108 -3.620 5.689 -8.629 1.00 1.34 H new ATOM 0 HG21 VAL A 108 -5.572 7.073 -10.684 1.00 15.14 H new ATOM 0 HG22 VAL A 108 -5.747 5.365 -10.215 1.00 15.14 H new ATOM 0 HG23 VAL A 108 -7.110 6.489 -10.003 1.00 15.14 H new ATOM 1809 N THR A 109 -7.839 6.844 -6.124 1.00 60.45 N ATOM 1810 CA THR A 109 -9.165 7.287 -5.709 1.00 44.42 C ATOM 1811 C THR A 109 -9.297 8.795 -5.958 1.00 33.15 C ATOM 1812 O THR A 109 -10.402 9.301 -6.171 1.00 51.44 O ATOM 1813 CB THR A 109 -9.363 6.977 -4.198 1.00 4.32 C ATOM 1814 OG1 THR A 109 -8.370 7.682 -3.429 1.00 72.31 O ATOM 1815 CG2 THR A 109 -9.242 5.468 -3.918 1.00 23.51 C ATOM 0 H THR A 109 -7.095 7.160 -5.502 1.00 60.45 H new ATOM 0 HA THR A 109 -9.927 6.761 -6.284 1.00 44.42 H new ATOM 0 HB THR A 109 -10.363 7.302 -3.912 1.00 4.32 H new ATOM 0 HG1 THR A 109 -8.810 8.344 -2.856 1.00 72.31 H new ATOM 0 HG21 THR A 109 -9.385 5.283 -2.853 1.00 23.51 H new ATOM 0 HG22 THR A 109 -10.002 4.931 -4.485 1.00 23.51 H new ATOM 0 HG23 THR A 109 -8.253 5.121 -4.217 1.00 23.51 H new ATOM 1823 N ASP A 110 -8.125 9.490 -5.888 1.00 72.31 N ATOM 1824 CA ASP A 110 -7.963 10.974 -5.985 1.00 51.24 C ATOM 1825 C ASP A 110 -8.919 11.766 -5.044 1.00 73.13 C ATOM 1826 O ASP A 110 -9.062 12.987 -5.162 1.00 1.50 O ATOM 1827 CB ASP A 110 -8.002 11.494 -7.462 1.00 53.51 C ATOM 1828 CG ASP A 110 -9.365 11.389 -8.178 1.00 71.14 C ATOM 1829 OD1 ASP A 110 -10.222 12.282 -7.993 1.00 32.40 O ATOM 1830 OD2 ASP A 110 -9.572 10.434 -8.958 1.00 15.41 O ATOM 0 H ASP A 110 -7.232 9.015 -5.757 1.00 72.31 H new ATOM 0 HA ASP A 110 -6.958 11.178 -5.616 1.00 51.24 H new ATOM 0 HB2 ASP A 110 -7.690 12.538 -7.467 1.00 53.51 H new ATOM 0 HB3 ASP A 110 -7.265 10.938 -8.042 1.00 53.51 H new ATOM 1835 N ASN A 111 -9.476 11.042 -4.054 1.00 34.41 N ATOM 1836 CA ASN A 111 -10.402 11.554 -3.036 1.00 73.41 C ATOM 1837 C ASN A 111 -10.105 10.817 -1.729 1.00 45.42 C ATOM 1838 O ASN A 111 -9.733 9.631 -1.741 1.00 2.22 O ATOM 1839 CB ASN A 111 -11.889 11.328 -3.434 1.00 55.41 C ATOM 1840 CG ASN A 111 -12.378 12.142 -4.644 1.00 22.40 C ATOM 1841 OD1 ASN A 111 -13.183 11.660 -5.443 1.00 21.21 O ATOM 1842 ND2 ASN A 111 -11.949 13.392 -4.769 1.00 22.12 N ATOM 0 H ASN A 111 -9.283 10.047 -3.941 1.00 34.41 H new ATOM 0 HA ASN A 111 -10.258 12.629 -2.932 1.00 73.41 H new ATOM 0 HB2 ASN A 111 -12.034 10.269 -3.647 1.00 55.41 H new ATOM 0 HB3 ASN A 111 -12.518 11.569 -2.577 1.00 55.41 H new ATOM 0 HD21 ASN A 111 -12.286 13.972 -5.537 1.00 22.12 H new ATOM 0 HD22 ASN A 111 -11.283 13.772 -4.097 1.00 22.12 H new ATOM 1849 N GLU A 112 -10.307 11.518 -0.619 1.00 20.31 N ATOM 1850 CA GLU A 112 -9.915 11.052 0.723 1.00 34.54 C ATOM 1851 C GLU A 112 -10.903 9.986 1.215 1.00 61.40 C ATOM 1852 O GLU A 112 -10.509 8.911 1.685 1.00 11.14 O ATOM 1853 CB GLU A 112 -9.860 12.239 1.740 1.00 45.22 C ATOM 1854 CG GLU A 112 -9.138 13.523 1.243 1.00 53.13 C ATOM 1855 CD GLU A 112 -9.990 14.388 0.292 1.00 41.13 C ATOM 1856 OE1 GLU A 112 -11.003 14.964 0.747 1.00 73.10 O ATOM 1857 OE2 GLU A 112 -9.685 14.457 -0.918 1.00 33.44 O ATOM 0 H GLU A 112 -10.751 12.436 -0.616 1.00 20.31 H new ATOM 0 HA GLU A 112 -8.917 10.618 0.654 1.00 34.54 H new ATOM 0 HB2 GLU A 112 -10.881 12.503 2.017 1.00 45.22 H new ATOM 0 HB3 GLU A 112 -9.363 11.893 2.646 1.00 45.22 H new ATOM 0 HG2 GLU A 112 -8.850 14.124 2.106 1.00 53.13 H new ATOM 0 HG3 GLU A 112 -8.218 13.237 0.733 1.00 53.13 H new ATOM 1864 N ASP A 113 -12.199 10.314 1.072 1.00 63.01 N ATOM 1865 CA ASP A 113 -13.321 9.467 1.517 1.00 44.14 C ATOM 1866 C ASP A 113 -13.521 8.265 0.592 1.00 42.21 C ATOM 1867 O ASP A 113 -13.958 7.209 1.044 1.00 43.13 O ATOM 1868 CB ASP A 113 -14.619 10.304 1.625 1.00 31.31 C ATOM 1869 CG ASP A 113 -14.490 11.407 2.680 1.00 33.25 C ATOM 1870 OD1 ASP A 113 -14.492 11.072 3.884 1.00 24.10 O ATOM 1871 OD2 ASP A 113 -14.363 12.601 2.320 1.00 4.11 O ATOM 0 H ASP A 113 -12.501 11.186 0.638 1.00 63.01 H new ATOM 0 HA ASP A 113 -13.075 9.078 2.505 1.00 44.14 H new ATOM 0 HB2 ASP A 113 -14.847 10.750 0.657 1.00 31.31 H new ATOM 0 HB3 ASP A 113 -15.454 9.651 1.880 1.00 31.31 H new ATOM 1876 N GLU A 114 -13.205 8.434 -0.706 1.00 33.30 N ATOM 1877 CA GLU A 114 -13.196 7.314 -1.663 1.00 22.23 C ATOM 1878 C GLU A 114 -12.070 6.320 -1.338 1.00 44.31 C ATOM 1879 O GLU A 114 -12.220 5.142 -1.602 1.00 32.33 O ATOM 1880 CB GLU A 114 -13.089 7.802 -3.135 1.00 15.00 C ATOM 1881 CG GLU A 114 -14.424 8.291 -3.737 1.00 52.33 C ATOM 1882 CD GLU A 114 -15.516 7.194 -3.779 1.00 62.12 C ATOM 1883 OE1 GLU A 114 -15.294 6.131 -4.414 1.00 3.12 O ATOM 1884 OE2 GLU A 114 -16.606 7.389 -3.197 1.00 41.04 O ATOM 0 H GLU A 114 -12.953 9.334 -1.114 1.00 33.30 H new ATOM 0 HA GLU A 114 -14.152 6.800 -1.560 1.00 22.23 H new ATOM 0 HB2 GLU A 114 -12.362 8.612 -3.186 1.00 15.00 H new ATOM 0 HB3 GLU A 114 -12.703 6.988 -3.749 1.00 15.00 H new ATOM 0 HG2 GLU A 114 -14.790 9.136 -3.153 1.00 52.33 H new ATOM 0 HG3 GLU A 114 -14.246 8.656 -4.749 1.00 52.33 H new ATOM 1891 N ALA A 115 -10.950 6.816 -0.778 1.00 35.15 N ATOM 1892 CA ALA A 115 -9.826 5.955 -0.345 1.00 33.40 C ATOM 1893 C ALA A 115 -10.226 5.143 0.890 1.00 54.01 C ATOM 1894 O ALA A 115 -10.072 3.930 0.912 1.00 70.24 O ATOM 1895 CB ALA A 115 -8.583 6.804 -0.068 1.00 23.05 C ATOM 0 H ALA A 115 -10.797 7.811 -0.613 1.00 35.15 H new ATOM 0 HA ALA A 115 -9.586 5.256 -1.146 1.00 33.40 H new ATOM 0 HB1 ALA A 115 -7.764 6.158 0.249 1.00 23.05 H new ATOM 0 HB2 ALA A 115 -8.295 7.335 -0.976 1.00 23.05 H new ATOM 0 HB3 ALA A 115 -8.803 7.525 0.720 1.00 23.05 H new ATOM 1901 N LYS A 116 -10.778 5.851 1.888 1.00 13.04 N ATOM 1902 CA LYS A 116 -11.330 5.280 3.135 1.00 73.21 C ATOM 1903 C LYS A 116 -12.338 4.139 2.848 1.00 63.14 C ATOM 1904 O LYS A 116 -12.183 3.004 3.320 1.00 54.41 O ATOM 1905 CB LYS A 116 -12.009 6.463 3.878 1.00 33.21 C ATOM 1906 CG LYS A 116 -12.962 6.117 5.043 1.00 61.23 C ATOM 1907 CD LYS A 116 -13.681 7.385 5.564 1.00 63.13 C ATOM 1908 CE LYS A 116 -12.715 8.416 6.183 1.00 73.23 C ATOM 1909 NZ LYS A 116 -13.373 9.729 6.447 1.00 54.33 N ATOM 0 H LYS A 116 -10.857 6.867 1.852 1.00 13.04 H new ATOM 0 HA LYS A 116 -10.544 4.828 3.740 1.00 73.21 H new ATOM 0 HB2 LYS A 116 -11.224 7.112 4.266 1.00 33.21 H new ATOM 0 HB3 LYS A 116 -12.569 7.044 3.145 1.00 33.21 H new ATOM 0 HG2 LYS A 116 -13.700 5.387 4.710 1.00 61.23 H new ATOM 0 HG3 LYS A 116 -12.399 5.654 5.854 1.00 61.23 H new ATOM 0 HD2 LYS A 116 -14.223 7.852 4.742 1.00 63.13 H new ATOM 0 HD3 LYS A 116 -14.421 7.095 6.310 1.00 63.13 H new ATOM 0 HE2 LYS A 116 -12.315 8.020 7.116 1.00 73.23 H new ATOM 0 HE3 LYS A 116 -11.869 8.565 5.512 1.00 73.23 H new ATOM 0 HZ1 LYS A 116 -12.674 10.397 6.831 1.00 54.33 H new ATOM 0 HZ2 LYS A 116 -13.762 10.107 5.560 1.00 54.33 H new ATOM 0 HZ3 LYS A 116 -14.142 9.600 7.135 1.00 54.33 H new ATOM 1923 N LYS A 117 -13.328 4.470 2.015 1.00 31.42 N ATOM 1924 CA LYS A 117 -14.439 3.586 1.622 1.00 15.40 C ATOM 1925 C LYS A 117 -13.933 2.383 0.802 1.00 11.42 C ATOM 1926 O LYS A 117 -14.369 1.245 1.020 1.00 75.41 O ATOM 1927 CB LYS A 117 -15.490 4.469 0.857 1.00 71.14 C ATOM 1928 CG LYS A 117 -16.512 3.770 -0.087 1.00 61.23 C ATOM 1929 CD LYS A 117 -16.006 3.648 -1.558 1.00 13.32 C ATOM 1930 CE LYS A 117 -17.151 3.524 -2.578 1.00 23.35 C ATOM 1931 NZ LYS A 117 -17.971 4.765 -2.627 1.00 20.11 N ATOM 0 H LYS A 117 -13.384 5.390 1.579 1.00 31.42 H new ATOM 0 HA LYS A 117 -14.919 3.143 2.495 1.00 15.40 H new ATOM 0 HB2 LYS A 117 -16.057 5.027 1.602 1.00 71.14 H new ATOM 0 HB3 LYS A 117 -14.939 5.199 0.264 1.00 71.14 H new ATOM 0 HG2 LYS A 117 -16.731 2.774 0.299 1.00 61.23 H new ATOM 0 HG3 LYS A 117 -17.448 4.329 -0.077 1.00 61.23 H new ATOM 0 HD2 LYS A 117 -15.402 4.522 -1.802 1.00 13.32 H new ATOM 0 HD3 LYS A 117 -15.356 2.777 -1.642 1.00 13.32 H new ATOM 0 HE2 LYS A 117 -16.739 3.319 -3.566 1.00 23.35 H new ATOM 0 HE3 LYS A 117 -17.785 2.677 -2.315 1.00 23.35 H new ATOM 0 HZ1 LYS A 117 -18.551 4.764 -3.490 1.00 20.11 H new ATOM 0 HZ2 LYS A 117 -18.591 4.804 -1.793 1.00 20.11 H new ATOM 0 HZ3 LYS A 117 -17.344 5.595 -2.632 1.00 20.11 H new ATOM 1945 N ARG A 118 -12.987 2.646 -0.123 1.00 34.44 N ATOM 1946 CA ARG A 118 -12.473 1.623 -1.057 1.00 24.25 C ATOM 1947 C ARG A 118 -11.505 0.665 -0.351 1.00 1.35 C ATOM 1948 O ARG A 118 -11.380 -0.471 -0.762 1.00 63.30 O ATOM 1949 CB ARG A 118 -11.816 2.286 -2.293 1.00 54.12 C ATOM 1950 CG ARG A 118 -11.631 1.372 -3.525 1.00 15.34 C ATOM 1951 CD ARG A 118 -11.256 2.177 -4.787 1.00 22.22 C ATOM 1952 NE ARG A 118 -12.217 3.278 -5.035 1.00 41.20 N ATOM 1953 CZ ARG A 118 -12.075 4.269 -5.937 1.00 1.10 C ATOM 1954 NH1 ARG A 118 -11.002 4.337 -6.733 1.00 72.03 N ATOM 1955 NH2 ARG A 118 -12.999 5.224 -6.000 1.00 52.14 N ATOM 0 H ARG A 118 -12.561 3.565 -0.243 1.00 34.44 H new ATOM 0 HA ARG A 118 -13.318 1.031 -1.409 1.00 24.25 H new ATOM 0 HB2 ARG A 118 -12.422 3.143 -2.587 1.00 54.12 H new ATOM 0 HB3 ARG A 118 -10.839 2.671 -2.000 1.00 54.12 H new ATOM 0 HG2 ARG A 118 -10.853 0.637 -3.318 1.00 15.34 H new ATOM 0 HG3 ARG A 118 -12.552 0.818 -3.708 1.00 15.34 H new ATOM 0 HD2 ARG A 118 -10.253 2.587 -4.673 1.00 22.22 H new ATOM 0 HD3 ARG A 118 -11.232 1.512 -5.650 1.00 22.22 H new ATOM 0 HE ARG A 118 -13.066 3.286 -4.470 1.00 41.20 H new ATOM 0 HH11 ARG A 118 -10.270 3.630 -6.664 1.00 72.03 H new ATOM 0 HH12 ARG A 118 -10.916 5.096 -7.409 1.00 72.03 H new ATOM 0 HH21 ARG A 118 -13.801 5.200 -5.371 1.00 52.14 H new ATOM 0 HH22 ARG A 118 -12.905 5.981 -6.678 1.00 52.14 H new ATOM 1969 N LEU A 119 -10.823 1.136 0.717 1.00 41.40 N ATOM 1970 CA LEU A 119 -9.963 0.267 1.556 1.00 74.32 C ATOM 1971 C LEU A 119 -10.816 -0.791 2.256 1.00 62.52 C ATOM 1972 O LEU A 119 -10.507 -1.980 2.211 1.00 72.12 O ATOM 1973 CB LEU A 119 -9.164 1.085 2.612 1.00 54.23 C ATOM 1974 CG LEU A 119 -7.959 1.910 2.068 1.00 2.54 C ATOM 1975 CD1 LEU A 119 -7.242 2.660 3.210 1.00 11.52 C ATOM 1976 CD2 LEU A 119 -6.982 1.009 1.282 1.00 60.02 C ATOM 0 H LEU A 119 -10.850 2.110 1.019 1.00 41.40 H new ATOM 0 HA LEU A 119 -9.242 -0.217 0.897 1.00 74.32 H new ATOM 0 HB2 LEU A 119 -9.852 1.769 3.109 1.00 54.23 H new ATOM 0 HB3 LEU A 119 -8.794 0.397 3.372 1.00 54.23 H new ATOM 0 HG LEU A 119 -8.346 2.658 1.376 1.00 2.54 H new ATOM 0 HD11 LEU A 119 -6.405 3.228 2.803 1.00 11.52 H new ATOM 0 HD12 LEU A 119 -7.942 3.341 3.694 1.00 11.52 H new ATOM 0 HD13 LEU A 119 -6.872 1.941 3.941 1.00 11.52 H new ATOM 0 HD21 LEU A 119 -6.150 1.609 0.913 1.00 60.02 H new ATOM 0 HD22 LEU A 119 -6.602 0.226 1.938 1.00 60.02 H new ATOM 0 HD23 LEU A 119 -7.504 0.555 0.439 1.00 60.02 H new ATOM 1988 N LYS A 120 -11.909 -0.327 2.874 1.00 31.04 N ATOM 1989 CA LYS A 120 -12.877 -1.191 3.564 1.00 21.51 C ATOM 1990 C LYS A 120 -13.493 -2.217 2.583 1.00 10.44 C ATOM 1991 O LYS A 120 -13.620 -3.406 2.902 1.00 21.42 O ATOM 1992 CB LYS A 120 -13.974 -0.307 4.209 1.00 61.11 C ATOM 1993 CG LYS A 120 -15.049 -1.082 4.994 1.00 25.42 C ATOM 1994 CD LYS A 120 -16.116 -0.162 5.629 1.00 75.23 C ATOM 1995 CE LYS A 120 -17.230 -0.959 6.329 1.00 23.23 C ATOM 1996 NZ LYS A 120 -18.193 -0.071 7.035 1.00 1.44 N ATOM 0 H LYS A 120 -12.149 0.664 2.910 1.00 31.04 H new ATOM 0 HA LYS A 120 -12.368 -1.755 4.346 1.00 21.51 H new ATOM 0 HB2 LYS A 120 -13.497 0.407 4.881 1.00 61.11 H new ATOM 0 HB3 LYS A 120 -14.463 0.271 3.425 1.00 61.11 H new ATOM 0 HG2 LYS A 120 -15.539 -1.790 4.325 1.00 25.42 H new ATOM 0 HG3 LYS A 120 -14.568 -1.666 5.779 1.00 25.42 H new ATOM 0 HD2 LYS A 120 -15.638 0.501 6.350 1.00 75.23 H new ATOM 0 HD3 LYS A 120 -16.554 0.470 4.857 1.00 75.23 H new ATOM 0 HE2 LYS A 120 -17.764 -1.559 5.592 1.00 23.23 H new ATOM 0 HE3 LYS A 120 -16.786 -1.652 7.043 1.00 23.23 H new ATOM 0 HZ1 LYS A 120 -18.927 -0.649 7.493 1.00 1.44 H new ATOM 0 HZ2 LYS A 120 -17.689 0.484 7.756 1.00 1.44 H new ATOM 0 HZ3 LYS A 120 -18.637 0.574 6.350 1.00 1.44 H new ATOM 2010 N GLU A 121 -13.823 -1.738 1.370 1.00 41.13 N ATOM 2011 CA GLU A 121 -14.425 -2.555 0.295 1.00 33.33 C ATOM 2012 C GLU A 121 -13.427 -3.644 -0.168 1.00 4.45 C ATOM 2013 O GLU A 121 -13.759 -4.837 -0.222 1.00 64.43 O ATOM 2014 CB GLU A 121 -14.836 -1.602 -0.876 1.00 30.53 C ATOM 2015 CG GLU A 121 -15.852 -2.158 -1.908 1.00 22.20 C ATOM 2016 CD GLU A 121 -15.318 -3.273 -2.833 1.00 44.21 C ATOM 2017 OE1 GLU A 121 -14.510 -2.971 -3.744 1.00 11.20 O ATOM 2018 OE2 GLU A 121 -15.723 -4.447 -2.673 1.00 12.14 O ATOM 0 H GLU A 121 -13.679 -0.764 1.104 1.00 41.13 H new ATOM 0 HA GLU A 121 -15.314 -3.071 0.656 1.00 33.33 H new ATOM 0 HB2 GLU A 121 -15.255 -0.693 -0.443 1.00 30.53 H new ATOM 0 HB3 GLU A 121 -13.932 -1.313 -1.412 1.00 30.53 H new ATOM 0 HG2 GLU A 121 -16.718 -2.541 -1.369 1.00 22.20 H new ATOM 0 HG3 GLU A 121 -16.202 -1.333 -2.528 1.00 22.20 H new ATOM 2025 N LEU A 122 -12.188 -3.205 -0.454 1.00 55.02 N ATOM 2026 CA LEU A 122 -11.106 -4.065 -0.966 1.00 5.24 C ATOM 2027 C LEU A 122 -10.604 -5.053 0.097 1.00 61.14 C ATOM 2028 O LEU A 122 -10.054 -6.075 -0.256 1.00 54.11 O ATOM 2029 CB LEU A 122 -9.924 -3.229 -1.540 1.00 61.33 C ATOM 2030 CG LEU A 122 -10.217 -2.453 -2.868 1.00 50.45 C ATOM 2031 CD1 LEU A 122 -8.999 -1.613 -3.314 1.00 31.42 C ATOM 2032 CD2 LEU A 122 -10.676 -3.411 -3.991 1.00 5.20 C ATOM 0 H LEU A 122 -11.907 -2.232 -0.335 1.00 55.02 H new ATOM 0 HA LEU A 122 -11.534 -4.646 -1.783 1.00 5.24 H new ATOM 0 HB2 LEU A 122 -9.612 -2.510 -0.783 1.00 61.33 H new ATOM 0 HB3 LEU A 122 -9.081 -3.898 -1.711 1.00 61.33 H new ATOM 0 HG LEU A 122 -11.036 -1.763 -2.666 1.00 50.45 H new ATOM 0 HD11 LEU A 122 -9.238 -1.088 -4.239 1.00 31.42 H new ATOM 0 HD12 LEU A 122 -8.753 -0.888 -2.538 1.00 31.42 H new ATOM 0 HD13 LEU A 122 -8.145 -2.270 -3.480 1.00 31.42 H new ATOM 0 HD21 LEU A 122 -10.871 -2.840 -4.899 1.00 5.20 H new ATOM 0 HD22 LEU A 122 -9.894 -4.145 -4.185 1.00 5.20 H new ATOM 0 HD23 LEU A 122 -11.587 -3.924 -3.682 1.00 5.20 H new ATOM 2044 N LEU A 123 -10.754 -4.726 1.393 1.00 13.23 N ATOM 2045 CA LEU A 123 -10.349 -5.641 2.497 1.00 70.03 C ATOM 2046 C LEU A 123 -11.105 -6.990 2.409 1.00 61.23 C ATOM 2047 O LEU A 123 -10.511 -8.056 2.605 1.00 61.14 O ATOM 2048 CB LEU A 123 -10.538 -4.962 3.898 1.00 44.03 C ATOM 2049 CG LEU A 123 -9.222 -4.578 4.660 1.00 44.25 C ATOM 2050 CD1 LEU A 123 -8.347 -3.582 3.859 1.00 14.35 C ATOM 2051 CD2 LEU A 123 -9.558 -4.035 6.060 1.00 31.51 C ATOM 0 H LEU A 123 -11.150 -3.841 1.710 1.00 13.23 H new ATOM 0 HA LEU A 123 -9.286 -5.854 2.382 1.00 70.03 H new ATOM 0 HB2 LEU A 123 -11.133 -4.059 3.764 1.00 44.03 H new ATOM 0 HB3 LEU A 123 -11.117 -5.635 4.530 1.00 44.03 H new ATOM 0 HG LEU A 123 -8.627 -5.485 4.772 1.00 44.25 H new ATOM 0 HD11 LEU A 123 -7.448 -3.348 4.429 1.00 14.35 H new ATOM 0 HD12 LEU A 123 -8.066 -4.030 2.906 1.00 14.35 H new ATOM 0 HD13 LEU A 123 -8.911 -2.667 3.678 1.00 14.35 H new ATOM 0 HD21 LEU A 123 -8.636 -3.772 6.579 1.00 31.51 H new ATOM 0 HD22 LEU A 123 -10.187 -3.150 5.966 1.00 31.51 H new ATOM 0 HD23 LEU A 123 -10.089 -4.798 6.628 1.00 31.51 H new ATOM 2063 N GLU A 124 -12.402 -6.920 2.073 1.00 4.00 N ATOM 2064 CA GLU A 124 -13.253 -8.113 1.835 1.00 74.22 C ATOM 2065 C GLU A 124 -12.822 -8.860 0.552 1.00 1.32 C ATOM 2066 O GLU A 124 -13.059 -10.058 0.397 1.00 20.50 O ATOM 2067 CB GLU A 124 -14.737 -7.668 1.720 1.00 12.44 C ATOM 2068 CG GLU A 124 -15.267 -6.900 2.948 1.00 60.33 C ATOM 2069 CD GLU A 124 -15.336 -7.752 4.230 1.00 53.13 C ATOM 2070 OE1 GLU A 124 -14.303 -7.900 4.929 1.00 43.54 O ATOM 2071 OE2 GLU A 124 -16.423 -8.282 4.550 1.00 31.21 O ATOM 0 H GLU A 124 -12.898 -6.037 1.957 1.00 4.00 H new ATOM 0 HA GLU A 124 -13.136 -8.798 2.675 1.00 74.22 H new ATOM 0 HB2 GLU A 124 -14.848 -7.039 0.837 1.00 12.44 H new ATOM 0 HB3 GLU A 124 -15.357 -8.550 1.562 1.00 12.44 H new ATOM 0 HG2 GLU A 124 -14.626 -6.037 3.130 1.00 60.33 H new ATOM 0 HG3 GLU A 124 -16.262 -6.516 2.724 1.00 60.33 H new ATOM 2078 N LYS A 125 -12.184 -8.106 -0.346 1.00 64.22 N ATOM 2079 CA LYS A 125 -11.781 -8.548 -1.691 1.00 63.32 C ATOM 2080 C LYS A 125 -10.238 -8.796 -1.768 1.00 50.51 C ATOM 2081 O LYS A 125 -9.687 -8.993 -2.848 1.00 73.02 O ATOM 2082 CB LYS A 125 -12.257 -7.415 -2.652 1.00 34.40 C ATOM 2083 CG LYS A 125 -12.088 -7.663 -4.162 1.00 10.51 C ATOM 2084 CD LYS A 125 -12.650 -6.502 -5.005 1.00 63.15 C ATOM 2085 CE LYS A 125 -14.169 -6.343 -4.853 1.00 62.55 C ATOM 2086 NZ LYS A 125 -14.697 -5.205 -5.651 1.00 23.12 N ATOM 0 H LYS A 125 -11.923 -7.139 -0.155 1.00 64.22 H new ATOM 0 HA LYS A 125 -12.229 -9.503 -1.964 1.00 63.32 H new ATOM 0 HB2 LYS A 125 -13.312 -7.225 -2.456 1.00 34.40 H new ATOM 0 HB3 LYS A 125 -11.716 -6.504 -2.396 1.00 34.40 H new ATOM 0 HG2 LYS A 125 -11.031 -7.798 -4.391 1.00 10.51 H new ATOM 0 HG3 LYS A 125 -12.595 -8.588 -4.436 1.00 10.51 H new ATOM 0 HD2 LYS A 125 -12.160 -5.574 -4.711 1.00 63.15 H new ATOM 0 HD3 LYS A 125 -12.409 -6.670 -6.055 1.00 63.15 H new ATOM 0 HE2 LYS A 125 -14.662 -7.263 -5.166 1.00 62.55 H new ATOM 0 HE3 LYS A 125 -14.413 -6.192 -3.802 1.00 62.55 H new ATOM 0 HZ1 LYS A 125 -15.700 -5.371 -5.870 1.00 23.12 H new ATOM 0 HZ2 LYS A 125 -14.603 -4.325 -5.105 1.00 23.12 H new ATOM 0 HZ3 LYS A 125 -14.158 -5.122 -6.537 1.00 23.12 H new ATOM 2100 N VAL A 126 -9.559 -8.771 -0.582 1.00 51.41 N ATOM 2101 CA VAL A 126 -8.070 -8.931 -0.406 1.00 23.41 C ATOM 2102 C VAL A 126 -7.222 -7.995 -1.316 1.00 62.20 C ATOM 2103 O VAL A 126 -6.022 -8.206 -1.511 1.00 44.12 O ATOM 2104 CB VAL A 126 -7.580 -10.445 -0.497 1.00 74.20 C ATOM 2105 CG1 VAL A 126 -8.373 -11.333 0.488 1.00 12.24 C ATOM 2106 CG2 VAL A 126 -7.609 -11.031 -1.938 1.00 22.24 C ATOM 0 H VAL A 126 -10.041 -8.635 0.307 1.00 51.41 H new ATOM 0 HA VAL A 126 -7.887 -8.604 0.618 1.00 23.41 H new ATOM 0 HB VAL A 126 -6.529 -10.443 -0.207 1.00 74.20 H new ATOM 0 HG11 VAL A 126 -8.024 -12.363 0.411 1.00 12.24 H new ATOM 0 HG12 VAL A 126 -8.221 -10.973 1.506 1.00 12.24 H new ATOM 0 HG13 VAL A 126 -9.434 -11.290 0.243 1.00 12.24 H new ATOM 0 HG21 VAL A 126 -7.262 -12.064 -1.918 1.00 22.24 H new ATOM 0 HG22 VAL A 126 -8.628 -10.998 -2.324 1.00 22.24 H new ATOM 0 HG23 VAL A 126 -6.958 -10.442 -2.584 1.00 22.24 H new ATOM 2116 N GLY A 127 -7.850 -6.914 -1.789 1.00 54.23 N ATOM 2117 CA GLY A 127 -7.241 -5.978 -2.718 1.00 64.02 C ATOM 2118 C GLY A 127 -7.637 -6.322 -4.143 1.00 12.13 C ATOM 2119 O GLY A 127 -8.829 -6.266 -4.470 1.00 40.25 O ATOM 0 H GLY A 127 -8.806 -6.668 -1.530 1.00 54.23 H new ATOM 0 HA2 GLY A 127 -7.556 -4.962 -2.481 1.00 64.02 H new ATOM 0 HA3 GLY A 127 -6.156 -6.008 -2.617 1.00 64.02 H new