USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1086 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 111 ASN : amide:sc= 0.305 K(o=0.65,f=-1.4) USER MOD Set 1.2: A 114 LYS NZ :NH3+ 158:sc= 0.34 (180deg=0) USER MOD Set 2.1: A 95 ASN : amide:sc= -1.64 K(o=-1.8,f=-6!) USER MOD Set 2.2: A 103 LYS NZ :NH3+ -157:sc= -0.205 (180deg=-0.961) USER MOD Set 3.1: A 65 ASN : amide:sc= 0.142 K(o=0.4,f=-1.7) USER MOD Set 3.2: A 69 GLN : amide:sc= 0.262 K(o=0.4,f=-0.25) USER MOD Set 4.1: A 18 SER OG : rot 180:sc=-0.00678 USER MOD Set 4.2: A 21 SER OG : rot -46:sc= 0.476 USER MOD Set 5.1: A 13 ASN : amide:sc= -0.734 K(o=-0.11,f=-11!) USER MOD Set 5.2: A 46 TYR OH : rot 2:sc= 0.622 USER MOD Set 6.1: A 7 GLN : amide:sc= 0.691 K(o=1.5,f=-4.3!) USER MOD Set 6.2: A 11 LYS NZ :NH3+ -151:sc= 0.772 (180deg=0) USER MOD Set 7.1: A 9 THR OG1 : rot 72:sc= 0.511 USER MOD Set 7.2: A 42 MET CE :methyl -172:sc= -0.277 (180deg=-0.349) USER MOD Single : A 5 SER OG : rot -24:sc= 0.0736 USER MOD Single : A 10 THR OG1 : rot 62:sc= 1.21 USER MOD Single : A 14 THR OG1 : rot 180:sc= -0.216 USER MOD Single : A 19 GLN : amide:sc= -0.824 K(o=-0.82,f=-0.16) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 67:sc= 0.693 USER MOD Single : A 26 SER OG : rot -32:sc= 0.075 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.43) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -158:sc= -0.06 (180deg=-0.384) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 MET CE :methyl -121:sc= -2.27 (180deg=-7.15!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.0587 K(o=-0.059,f=-1.6!) USER MOD Single : A 54 THR OG1 : rot 81:sc= 0.108 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.0973 X(o=-0.097,f=-0.11) USER MOD Single : A 70 GLN : amide:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : A 72 LYS NZ :NH3+ 167:sc= 0.204 (180deg=0.172) USER MOD Single : A 74 GLN : amide:sc= -0.415 X(o=-0.42,f=-0.42) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -1.45 X(o=-1.4,f=-0.98) USER MOD Single : A 80 GLN : amide:sc= -3.34 K(o=-3.3,f=-5.3!) USER MOD Single : A 82 SER OG : rot 87:sc= 1.17 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= 1.22 K(o=1.2,f=-0.00085) USER MOD Single : A 104 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.246) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -1.76 K(o=-1.8,f=-0.1) USER MOD Single : A 130 SER OG : rot -91:sc= 0.31 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 1.586 -7.036 1.542 1.00 60.43 N ATOM 43 CA SER A 5 1.088 -6.727 2.877 1.00 53.34 C ATOM 44 C SER A 5 0.747 -8.003 3.639 1.00 73.50 C ATOM 45 O SER A 5 0.821 -8.044 4.867 1.00 53.05 O ATOM 46 CB SER A 5 -0.147 -5.827 2.787 1.00 23.43 C ATOM 47 OG SER A 5 -1.177 -6.448 2.037 1.00 24.15 O ATOM 0 HA SER A 5 1.874 -6.201 3.419 1.00 53.34 H new ATOM 0 HB2 SER A 5 -0.509 -5.600 3.790 1.00 23.43 H new ATOM 0 HB3 SER A 5 0.123 -4.878 2.323 1.00 23.43 H new ATOM 0 HG SER A 5 -0.785 -7.104 1.424 1.00 24.15 H new ATOM 53 N GLU A 6 0.373 -9.044 2.901 1.00 60.12 N ATOM 54 CA GLU A 6 0.020 -10.322 3.507 1.00 34.32 C ATOM 55 C GLU A 6 1.219 -10.934 4.225 1.00 63.22 C ATOM 56 O GLU A 6 1.065 -11.634 5.225 1.00 24.41 O ATOM 57 CB GLU A 6 -0.500 -11.291 2.443 1.00 52.44 C ATOM 58 CG GLU A 6 0.571 -11.762 1.474 1.00 62.51 C ATOM 59 CD GLU A 6 -0.003 -12.222 0.148 1.00 60.41 C ATOM 60 OE1 GLU A 6 -1.241 -12.175 -0.010 1.00 41.44 O ATOM 61 OE2 GLU A 6 0.785 -12.630 -0.731 1.00 32.32 O ATOM 0 H GLU A 6 0.307 -9.027 1.883 1.00 60.12 H new ATOM 0 HA GLU A 6 -0.767 -10.142 4.239 1.00 34.32 H new ATOM 0 HB2 GLU A 6 -0.938 -12.158 2.937 1.00 52.44 H new ATOM 0 HB3 GLU A 6 -1.299 -10.806 1.881 1.00 52.44 H new ATOM 0 HG2 GLU A 6 1.278 -10.951 1.298 1.00 62.51 H new ATOM 0 HG3 GLU A 6 1.131 -12.580 1.927 1.00 62.51 H new ATOM 68 N GLN A 7 2.413 -10.665 3.705 1.00 13.34 N ATOM 69 CA GLN A 7 3.638 -11.190 4.296 1.00 43.25 C ATOM 70 C GLN A 7 3.901 -10.557 5.658 1.00 32.12 C ATOM 71 O GLN A 7 4.179 -11.254 6.634 1.00 12.14 O ATOM 72 CB GLN A 7 4.826 -10.937 3.365 1.00 21.24 C ATOM 73 CG GLN A 7 5.201 -12.141 2.516 1.00 34.22 C ATOM 74 CD GLN A 7 6.486 -11.931 1.741 1.00 61.24 C ATOM 75 OE1 GLN A 7 7.549 -11.715 2.324 1.00 33.23 O ATOM 76 NE2 GLN A 7 6.396 -11.994 0.417 1.00 4.33 N ATOM 0 H GLN A 7 2.557 -10.087 2.877 1.00 13.34 H new ATOM 0 HA GLN A 7 3.514 -12.264 4.434 1.00 43.25 H new ATOM 0 HB2 GLN A 7 4.591 -10.099 2.709 1.00 21.24 H new ATOM 0 HB3 GLN A 7 5.688 -10.641 3.962 1.00 21.24 H new ATOM 0 HG2 GLN A 7 5.308 -13.015 3.159 1.00 34.22 H new ATOM 0 HG3 GLN A 7 4.391 -12.355 1.818 1.00 34.22 H new ATOM 0 HE21 GLN A 7 5.495 -12.175 -0.025 1.00 4.33 H new ATOM 0 HE22 GLN A 7 7.228 -11.861 -0.158 1.00 4.33 H new ATOM 85 N PHE A 8 3.811 -9.233 5.717 1.00 3.51 N ATOM 86 CA PHE A 8 4.041 -8.505 6.960 1.00 34.42 C ATOM 87 C PHE A 8 3.094 -8.989 8.055 1.00 4.34 C ATOM 88 O PHE A 8 3.501 -9.186 9.201 1.00 14.43 O ATOM 89 CB PHE A 8 3.857 -7.003 6.738 1.00 13.32 C ATOM 90 CG PHE A 8 4.085 -6.182 7.975 1.00 41.41 C ATOM 91 CD1 PHE A 8 5.346 -6.096 8.542 1.00 3.23 C ATOM 92 CD2 PHE A 8 3.039 -5.495 8.570 1.00 71.21 C ATOM 93 CE1 PHE A 8 5.559 -5.342 9.681 1.00 51.42 C ATOM 94 CE2 PHE A 8 3.246 -4.739 9.708 1.00 14.03 C ATOM 95 CZ PHE A 8 4.508 -4.661 10.264 1.00 74.43 C ATOM 0 H PHE A 8 3.580 -8.642 4.919 1.00 3.51 H new ATOM 0 HA PHE A 8 5.066 -8.694 7.279 1.00 34.42 H new ATOM 0 HB2 PHE A 8 4.545 -6.672 5.960 1.00 13.32 H new ATOM 0 HB3 PHE A 8 2.847 -6.819 6.370 1.00 13.32 H new ATOM 0 HD1 PHE A 8 6.172 -6.624 8.089 1.00 3.23 H new ATOM 0 HD2 PHE A 8 2.050 -5.551 8.139 1.00 71.21 H new ATOM 0 HE1 PHE A 8 6.546 -5.285 10.115 1.00 51.42 H new ATOM 0 HE2 PHE A 8 2.422 -4.210 10.162 1.00 14.03 H new ATOM 0 HZ PHE A 8 4.673 -4.069 11.152 1.00 74.43 H new ATOM 105 N THR A 9 1.829 -9.178 7.695 1.00 12.40 N ATOM 106 CA THR A 9 0.824 -9.636 8.646 1.00 54.33 C ATOM 107 C THR A 9 1.030 -11.104 8.999 1.00 22.04 C ATOM 108 O THR A 9 1.108 -11.466 10.174 1.00 72.00 O ATOM 109 CB THR A 9 -0.601 -9.449 8.091 1.00 51.33 C ATOM 110 OG1 THR A 9 -0.646 -8.303 7.233 1.00 12.10 O ATOM 111 CG2 THR A 9 -1.605 -9.282 9.222 1.00 42.15 C ATOM 0 H THR A 9 1.476 -9.021 6.751 1.00 12.40 H new ATOM 0 HA THR A 9 0.939 -9.029 9.544 1.00 54.33 H new ATOM 0 HB THR A 9 -0.865 -10.340 7.521 1.00 51.33 H new ATOM 0 HG1 THR A 9 -0.178 -8.503 6.396 1.00 12.10 H new ATOM 0 HG21 THR A 9 -2.604 -9.152 8.806 1.00 42.15 H new ATOM 0 HG22 THR A 9 -1.589 -10.168 9.856 1.00 42.15 H new ATOM 0 HG23 THR A 9 -1.342 -8.406 9.816 1.00 42.15 H new ATOM 119 N THR A 10 1.119 -11.948 7.976 1.00 45.21 N ATOM 120 CA THR A 10 1.317 -13.377 8.179 1.00 72.51 C ATOM 121 C THR A 10 2.573 -13.648 8.999 1.00 32.11 C ATOM 122 O THR A 10 2.632 -14.611 9.763 1.00 24.55 O ATOM 123 CB THR A 10 1.423 -14.126 6.837 1.00 74.12 C ATOM 124 OG1 THR A 10 0.222 -13.944 6.078 1.00 11.32 O ATOM 125 CG2 THR A 10 1.665 -15.611 7.063 1.00 10.21 C ATOM 0 H THR A 10 1.057 -11.666 6.998 1.00 45.21 H new ATOM 0 HA THR A 10 0.446 -13.742 8.723 1.00 72.51 H new ATOM 0 HB THR A 10 2.268 -13.716 6.284 1.00 74.12 H new ATOM 0 HG1 THR A 10 0.103 -12.992 5.877 1.00 11.32 H new ATOM 0 HG21 THR A 10 1.736 -16.119 6.101 1.00 10.21 H new ATOM 0 HG22 THR A 10 2.595 -15.748 7.615 1.00 10.21 H new ATOM 0 HG23 THR A 10 0.838 -16.032 7.635 1.00 10.21 H new ATOM 133 N LYS A 11 3.576 -12.792 8.837 1.00 52.14 N ATOM 134 CA LYS A 11 4.831 -12.937 9.564 1.00 44.34 C ATOM 135 C LYS A 11 4.675 -12.492 11.014 1.00 33.33 C ATOM 136 O LYS A 11 5.107 -13.185 11.937 1.00 50.23 O ATOM 137 CB LYS A 11 5.934 -12.121 8.885 1.00 2.34 C ATOM 138 CG LYS A 11 6.495 -12.777 7.636 1.00 43.13 C ATOM 139 CD LYS A 11 7.514 -11.884 6.947 1.00 72.34 C ATOM 140 CE LYS A 11 8.436 -12.687 6.041 1.00 54.41 C ATOM 141 NZ LYS A 11 7.733 -13.166 4.819 1.00 74.22 N ATOM 0 H LYS A 11 3.544 -11.990 8.208 1.00 52.14 H new ATOM 0 HA LYS A 11 5.108 -13.991 9.554 1.00 44.34 H new ATOM 0 HB2 LYS A 11 5.539 -11.139 8.623 1.00 2.34 H new ATOM 0 HB3 LYS A 11 6.745 -11.960 9.596 1.00 2.34 H new ATOM 0 HG2 LYS A 11 6.961 -13.726 7.900 1.00 43.13 H new ATOM 0 HG3 LYS A 11 5.682 -13.003 6.946 1.00 43.13 H new ATOM 0 HD2 LYS A 11 6.997 -11.125 6.361 1.00 72.34 H new ATOM 0 HD3 LYS A 11 8.106 -11.359 7.697 1.00 72.34 H new ATOM 0 HE2 LYS A 11 9.288 -12.071 5.752 1.00 54.41 H new ATOM 0 HE3 LYS A 11 8.832 -13.541 6.591 1.00 54.41 H new ATOM 0 HZ1 LYS A 11 8.167 -14.053 4.494 1.00 74.22 H new ATOM 0 HZ2 LYS A 11 6.730 -13.332 5.038 1.00 74.22 H new ATOM 0 HZ3 LYS A 11 7.810 -12.448 4.070 1.00 74.22 H new ATOM 155 N LEU A 12 4.053 -11.335 11.210 1.00 50.34 N ATOM 156 CA LEU A 12 3.837 -10.798 12.549 1.00 25.40 C ATOM 157 C LEU A 12 3.188 -11.840 13.455 1.00 63.03 C ATOM 158 O LEU A 12 3.450 -11.881 14.656 1.00 35.31 O ATOM 159 CB LEU A 12 2.962 -9.546 12.483 1.00 35.05 C ATOM 160 CG LEU A 12 3.687 -8.234 12.183 1.00 64.34 C ATOM 161 CD1 LEU A 12 2.706 -7.182 11.691 1.00 11.31 C ATOM 162 CD2 LEU A 12 4.429 -7.740 13.416 1.00 20.00 C ATOM 0 H LEU A 12 3.689 -10.750 10.458 1.00 50.34 H new ATOM 0 HA LEU A 12 4.807 -10.533 12.968 1.00 25.40 H new ATOM 0 HB2 LEU A 12 2.200 -9.700 11.719 1.00 35.05 H new ATOM 0 HB3 LEU A 12 2.442 -9.441 13.435 1.00 35.05 H new ATOM 0 HG LEU A 12 4.417 -8.417 11.394 1.00 64.34 H new ATOM 0 HD11 LEU A 12 3.241 -6.255 11.483 1.00 11.31 H new ATOM 0 HD12 LEU A 12 2.221 -7.534 10.780 1.00 11.31 H new ATOM 0 HD13 LEU A 12 1.952 -7.001 12.457 1.00 11.31 H new ATOM 0 HD21 LEU A 12 4.939 -6.805 13.183 1.00 20.00 H new ATOM 0 HD22 LEU A 12 3.719 -7.574 14.226 1.00 20.00 H new ATOM 0 HD23 LEU A 12 5.162 -8.486 13.723 1.00 20.00 H new ATOM 174 N ASN A 13 2.343 -12.681 12.869 1.00 75.32 N ATOM 175 CA ASN A 13 1.657 -13.725 13.623 1.00 41.23 C ATOM 176 C ASN A 13 2.581 -14.913 13.871 1.00 45.10 C ATOM 177 O ASN A 13 2.494 -15.577 14.904 1.00 20.32 O ATOM 178 CB ASN A 13 0.405 -14.186 12.873 1.00 5.13 C ATOM 179 CG ASN A 13 -0.679 -13.126 12.852 1.00 41.12 C ATOM 180 OD1 ASN A 13 -1.284 -12.820 13.879 1.00 2.15 O ATOM 181 ND2 ASN A 13 -0.930 -12.560 11.677 1.00 63.11 N ATOM 0 H ASN A 13 2.116 -12.661 11.875 1.00 75.32 H new ATOM 0 HA ASN A 13 1.363 -13.309 14.587 1.00 41.23 H new ATOM 0 HB2 ASN A 13 0.674 -14.448 11.849 1.00 5.13 H new ATOM 0 HB3 ASN A 13 0.016 -15.090 13.342 1.00 5.13 H new ATOM 0 HD21 ASN A 13 -1.649 -11.841 11.601 1.00 63.11 H new ATOM 0 HD22 ASN A 13 -0.404 -12.845 10.851 1.00 63.11 H new ATOM 188 N THR A 14 3.469 -15.175 12.916 1.00 33.32 N ATOM 189 CA THR A 14 4.409 -16.283 13.030 1.00 0.20 C ATOM 190 C THR A 14 5.766 -15.803 13.532 1.00 11.40 C ATOM 191 O THR A 14 6.783 -16.471 13.339 1.00 13.24 O ATOM 192 CB THR A 14 4.598 -17.000 11.680 1.00 23.21 C ATOM 193 OG1 THR A 14 5.180 -16.104 10.726 1.00 33.15 O ATOM 194 CG2 THR A 14 3.269 -17.519 11.152 1.00 43.52 C ATOM 0 H THR A 14 3.556 -14.635 12.055 1.00 33.32 H new ATOM 0 HA THR A 14 3.986 -16.984 13.749 1.00 0.20 H new ATOM 0 HB THR A 14 5.265 -17.848 11.834 1.00 23.21 H new ATOM 0 HG1 THR A 14 5.298 -16.568 9.871 1.00 33.15 H new ATOM 0 HG21 THR A 14 3.428 -18.021 10.198 1.00 43.52 H new ATOM 0 HG22 THR A 14 2.844 -18.224 11.867 1.00 43.52 H new ATOM 0 HG23 THR A 14 2.582 -16.684 11.013 1.00 43.52 H new ATOM 202 N LEU A 15 5.776 -14.641 14.177 1.00 34.41 N ATOM 203 CA LEU A 15 7.009 -14.072 14.708 1.00 10.53 C ATOM 204 C LEU A 15 7.353 -14.684 16.062 1.00 31.12 C ATOM 205 O LEU A 15 6.505 -14.764 16.951 1.00 63.55 O ATOM 206 CB LEU A 15 6.877 -12.553 14.841 1.00 33.44 C ATOM 207 CG LEU A 15 7.432 -11.727 13.681 1.00 51.02 C ATOM 208 CD1 LEU A 15 7.196 -10.244 13.921 1.00 50.12 C ATOM 209 CD2 LEU A 15 8.915 -12.009 13.487 1.00 13.40 C ATOM 0 H LEU A 15 4.944 -14.075 14.344 1.00 34.41 H new ATOM 0 HA LEU A 15 7.815 -14.301 14.011 1.00 10.53 H new ATOM 0 HB2 LEU A 15 5.821 -12.309 14.962 1.00 33.44 H new ATOM 0 HB3 LEU A 15 7.382 -12.243 15.756 1.00 33.44 H new ATOM 0 HG LEU A 15 6.906 -12.015 12.771 1.00 51.02 H new ATOM 0 HD11 LEU A 15 7.598 -9.672 13.085 1.00 50.12 H new ATOM 0 HD12 LEU A 15 6.126 -10.055 14.009 1.00 50.12 H new ATOM 0 HD13 LEU A 15 7.695 -9.940 14.841 1.00 50.12 H new ATOM 0 HD21 LEU A 15 9.293 -11.412 12.657 1.00 13.40 H new ATOM 0 HD22 LEU A 15 9.457 -11.750 14.397 1.00 13.40 H new ATOM 0 HD23 LEU A 15 9.059 -13.067 13.268 1.00 13.40 H new ATOM 221 N GLU A 16 8.603 -15.112 16.212 1.00 35.41 N ATOM 222 CA GLU A 16 9.058 -15.716 17.459 1.00 60.13 C ATOM 223 C GLU A 16 10.034 -14.795 18.185 1.00 51.42 C ATOM 224 O GLU A 16 10.598 -13.877 17.589 1.00 54.41 O ATOM 225 CB GLU A 16 9.723 -17.067 17.184 1.00 0.42 C ATOM 226 CG GLU A 16 8.765 -18.243 17.258 1.00 35.21 C ATOM 227 CD GLU A 16 9.474 -19.558 17.521 1.00 55.43 C ATOM 228 OE1 GLU A 16 10.704 -19.535 17.735 1.00 13.22 O ATOM 229 OE2 GLU A 16 8.799 -20.608 17.511 1.00 21.43 O ATOM 0 H GLU A 16 9.317 -15.052 15.487 1.00 35.41 H new ATOM 0 HA GLU A 16 8.188 -15.870 18.097 1.00 60.13 H new ATOM 0 HB2 GLU A 16 10.180 -17.043 16.195 1.00 0.42 H new ATOM 0 HB3 GLU A 16 10.528 -17.219 17.903 1.00 0.42 H new ATOM 0 HG2 GLU A 16 8.036 -18.063 18.048 1.00 35.21 H new ATOM 0 HG3 GLU A 16 8.210 -18.314 16.322 1.00 35.21 H new ATOM 236 N ASP A 17 10.227 -15.046 19.475 1.00 63.22 N ATOM 237 CA ASP A 17 11.135 -14.240 20.283 1.00 31.32 C ATOM 238 C ASP A 17 12.580 -14.690 20.089 1.00 12.33 C ATOM 239 O ASP A 17 13.088 -15.521 20.841 1.00 32.51 O ATOM 240 CB ASP A 17 10.753 -14.332 21.761 1.00 23.25 C ATOM 241 CG ASP A 17 10.635 -15.766 22.241 1.00 4.50 C ATOM 242 OD1 ASP A 17 9.640 -16.431 21.885 1.00 42.13 O ATOM 243 OD2 ASP A 17 11.539 -16.222 22.972 1.00 72.31 O ATOM 0 H ASP A 17 9.767 -15.801 19.984 1.00 63.22 H new ATOM 0 HA ASP A 17 11.050 -13.203 19.957 1.00 31.32 H new ATOM 0 HB2 ASP A 17 11.501 -13.812 22.360 1.00 23.25 H new ATOM 0 HB3 ASP A 17 9.804 -13.819 21.921 1.00 23.25 H new ATOM 248 N SER A 18 13.236 -14.134 19.075 1.00 32.43 N ATOM 249 CA SER A 18 14.621 -14.482 18.779 1.00 12.53 C ATOM 250 C SER A 18 15.405 -13.252 18.330 1.00 72.31 C ATOM 251 O SER A 18 14.836 -12.306 17.786 1.00 4.23 O ATOM 252 CB SER A 18 14.678 -15.561 17.696 1.00 11.24 C ATOM 253 OG SER A 18 13.460 -16.282 17.630 1.00 53.40 O ATOM 0 H SER A 18 12.831 -13.441 18.445 1.00 32.43 H new ATOM 0 HA SER A 18 15.076 -14.869 19.691 1.00 12.53 H new ATOM 0 HB2 SER A 18 14.884 -15.100 16.730 1.00 11.24 H new ATOM 0 HB3 SER A 18 15.499 -16.247 17.904 1.00 11.24 H new ATOM 0 HG SER A 18 13.521 -16.964 16.929 1.00 53.40 H new ATOM 259 N GLN A 19 16.713 -13.276 18.562 1.00 43.53 N ATOM 260 CA GLN A 19 17.576 -12.163 18.182 1.00 52.03 C ATOM 261 C GLN A 19 17.694 -12.059 16.665 1.00 63.53 C ATOM 262 O GLN A 19 17.631 -10.967 16.101 1.00 32.44 O ATOM 263 CB GLN A 19 18.963 -12.330 18.803 1.00 25.53 C ATOM 264 CG GLN A 19 19.107 -11.662 20.161 1.00 35.32 C ATOM 265 CD GLN A 19 19.186 -10.152 20.063 1.00 52.41 C ATOM 266 OE1 GLN A 19 20.274 -9.577 20.014 1.00 20.44 O ATOM 267 NE2 GLN A 19 18.030 -9.499 20.033 1.00 40.43 N ATOM 0 H GLN A 19 17.199 -14.053 19.011 1.00 43.53 H new ATOM 0 HA GLN A 19 17.127 -11.244 18.557 1.00 52.03 H new ATOM 0 HB2 GLN A 19 19.180 -13.393 18.906 1.00 25.53 H new ATOM 0 HB3 GLN A 19 19.708 -11.917 18.123 1.00 25.53 H new ATOM 0 HG2 GLN A 19 18.260 -11.938 20.789 1.00 35.32 H new ATOM 0 HG3 GLN A 19 20.004 -12.038 20.653 1.00 35.32 H new ATOM 0 HE21 GLN A 19 17.151 -10.015 20.076 1.00 40.43 H new ATOM 0 HE22 GLN A 19 18.021 -8.481 19.967 1.00 40.43 H new ATOM 276 N GLU A 20 17.867 -13.204 16.010 1.00 1.51 N ATOM 277 CA GLU A 20 17.996 -13.240 14.558 1.00 34.00 C ATOM 278 C GLU A 20 16.639 -13.047 13.887 1.00 51.43 C ATOM 279 O GLU A 20 16.546 -12.462 12.807 1.00 2.15 O ATOM 280 CB GLU A 20 18.613 -14.567 14.112 1.00 42.13 C ATOM 281 CG GLU A 20 19.426 -14.460 12.832 1.00 31.13 C ATOM 282 CD GLU A 20 20.731 -13.715 13.031 1.00 44.31 C ATOM 283 OE1 GLU A 20 21.483 -14.073 13.962 1.00 73.10 O ATOM 284 OE2 GLU A 20 21.002 -12.773 12.256 1.00 34.52 O ATOM 0 H GLU A 20 17.921 -14.117 16.462 1.00 1.51 H new ATOM 0 HA GLU A 20 18.651 -12.423 14.256 1.00 34.00 H new ATOM 0 HB2 GLU A 20 19.253 -14.946 14.909 1.00 42.13 H new ATOM 0 HB3 GLU A 20 17.817 -15.298 13.967 1.00 42.13 H new ATOM 0 HG2 GLU A 20 19.637 -15.461 12.455 1.00 31.13 H new ATOM 0 HG3 GLU A 20 18.834 -13.951 12.071 1.00 31.13 H new ATOM 291 N SER A 21 15.589 -13.543 14.534 1.00 41.35 N ATOM 292 CA SER A 21 14.238 -13.429 13.998 1.00 15.10 C ATOM 293 C SER A 21 13.865 -11.967 13.770 1.00 71.21 C ATOM 294 O SER A 21 13.403 -11.594 12.691 1.00 30.30 O ATOM 295 CB SER A 21 13.233 -14.081 14.950 1.00 54.33 C ATOM 296 OG SER A 21 13.105 -13.333 16.147 1.00 53.03 O ATOM 0 H SER A 21 15.648 -14.027 15.430 1.00 41.35 H new ATOM 0 HA SER A 21 14.209 -13.947 13.039 1.00 15.10 H new ATOM 0 HB2 SER A 21 12.262 -14.159 14.461 1.00 54.33 H new ATOM 0 HB3 SER A 21 13.555 -15.096 15.184 1.00 54.33 H new ATOM 0 HG SER A 21 13.995 -13.089 16.477 1.00 53.03 H new ATOM 302 N ILE A 22 14.069 -11.145 14.793 1.00 10.42 N ATOM 303 CA ILE A 22 13.756 -9.724 14.705 1.00 52.23 C ATOM 304 C ILE A 22 14.574 -9.047 13.610 1.00 24.53 C ATOM 305 O ILE A 22 14.092 -8.144 12.929 1.00 55.55 O ATOM 306 CB ILE A 22 14.015 -9.006 16.042 1.00 4.23 C ATOM 307 CG1 ILE A 22 13.153 -9.616 17.149 1.00 4.04 C ATOM 308 CG2 ILE A 22 13.737 -7.516 15.907 1.00 73.33 C ATOM 309 CD1 ILE A 22 11.670 -9.393 16.953 1.00 43.42 C ATOM 0 H ILE A 22 14.450 -11.438 15.693 1.00 10.42 H new ATOM 0 HA ILE A 22 12.696 -9.650 14.462 1.00 52.23 H new ATOM 0 HB ILE A 22 15.063 -9.137 16.310 1.00 4.23 H new ATOM 0 HG12 ILE A 22 13.347 -10.687 17.201 1.00 4.04 H new ATOM 0 HG13 ILE A 22 13.452 -9.191 18.107 1.00 4.04 H new ATOM 0 HG21 ILE A 22 13.925 -7.023 16.861 1.00 73.33 H new ATOM 0 HG22 ILE A 22 14.390 -7.092 15.144 1.00 73.33 H new ATOM 0 HG23 ILE A 22 12.697 -7.365 15.619 1.00 73.33 H new ATOM 0 HD11 ILE A 22 11.121 -9.852 17.775 1.00 43.42 H new ATOM 0 HD12 ILE A 22 11.463 -8.323 16.931 1.00 43.42 H new ATOM 0 HD13 ILE A 22 11.356 -9.843 16.011 1.00 43.42 H new ATOM 321 N SER A 23 15.816 -9.493 13.447 1.00 70.13 N ATOM 322 CA SER A 23 16.703 -8.930 12.436 1.00 43.30 C ATOM 323 C SER A 23 16.302 -9.396 11.040 1.00 71.11 C ATOM 324 O SER A 23 16.522 -8.695 10.052 1.00 34.02 O ATOM 325 CB SER A 23 18.153 -9.327 12.721 1.00 1.43 C ATOM 326 OG SER A 23 18.977 -9.095 11.592 1.00 1.40 O ATOM 0 H SER A 23 16.230 -10.242 14.002 1.00 70.13 H new ATOM 0 HA SER A 23 16.616 -7.844 12.477 1.00 43.30 H new ATOM 0 HB2 SER A 23 18.528 -8.759 13.572 1.00 1.43 H new ATOM 0 HB3 SER A 23 18.197 -10.381 12.997 1.00 1.43 H new ATOM 0 HG SER A 23 19.898 -9.355 11.801 1.00 1.40 H new ATOM 332 N SER A 24 15.712 -10.585 10.967 1.00 40.02 N ATOM 333 CA SER A 24 15.283 -11.148 9.692 1.00 33.21 C ATOM 334 C SER A 24 14.179 -10.300 9.068 1.00 41.15 C ATOM 335 O SER A 24 14.244 -9.946 7.891 1.00 70.24 O ATOM 336 CB SER A 24 14.791 -12.584 9.885 1.00 52.03 C ATOM 337 OG SER A 24 15.868 -13.458 10.175 1.00 1.41 O ATOM 0 H SER A 24 15.520 -11.177 11.775 1.00 40.02 H new ATOM 0 HA SER A 24 16.139 -11.152 9.018 1.00 33.21 H new ATOM 0 HB2 SER A 24 14.064 -12.617 10.696 1.00 52.03 H new ATOM 0 HB3 SER A 24 14.278 -12.920 8.984 1.00 52.03 H new ATOM 0 HG SER A 24 16.239 -13.239 11.055 1.00 1.41 H new ATOM 343 N ALA A 25 13.166 -9.977 9.865 1.00 22.42 N ATOM 344 CA ALA A 25 12.049 -9.169 9.393 1.00 70.34 C ATOM 345 C ALA A 25 12.453 -7.706 9.247 1.00 33.10 C ATOM 346 O ALA A 25 11.996 -7.014 8.337 1.00 11.25 O ATOM 347 CB ALA A 25 10.865 -9.301 10.339 1.00 1.43 C ATOM 0 H ALA A 25 13.096 -10.263 10.842 1.00 22.42 H new ATOM 0 HA ALA A 25 11.756 -9.537 8.410 1.00 70.34 H new ATOM 0 HB1 ALA A 25 10.038 -8.692 9.974 1.00 1.43 H new ATOM 0 HB2 ALA A 25 10.553 -10.344 10.388 1.00 1.43 H new ATOM 0 HB3 ALA A 25 11.154 -8.961 11.334 1.00 1.43 H new ATOM 353 N SER A 26 13.311 -7.241 10.149 1.00 31.23 N ATOM 354 CA SER A 26 13.773 -5.858 10.124 1.00 74.23 C ATOM 355 C SER A 26 14.352 -5.504 8.758 1.00 62.25 C ATOM 356 O SER A 26 14.108 -4.420 8.228 1.00 1.20 O ATOM 357 CB SER A 26 14.824 -5.629 11.211 1.00 32.03 C ATOM 358 OG SER A 26 16.043 -6.275 10.886 1.00 12.45 O ATOM 0 H SER A 26 13.701 -7.802 10.907 1.00 31.23 H new ATOM 0 HA SER A 26 12.917 -5.211 10.315 1.00 74.23 H new ATOM 0 HB2 SER A 26 14.997 -4.560 11.335 1.00 32.03 H new ATOM 0 HB3 SER A 26 14.453 -6.004 12.165 1.00 32.03 H new ATOM 0 HG SER A 26 15.856 -7.087 10.371 1.00 12.45 H new ATOM 364 N LYS A 27 15.122 -6.427 8.191 1.00 21.44 N ATOM 365 CA LYS A 27 15.737 -6.216 6.886 1.00 21.14 C ATOM 366 C LYS A 27 14.676 -6.115 5.795 1.00 43.00 C ATOM 367 O LYS A 27 14.780 -5.286 4.891 1.00 50.01 O ATOM 368 CB LYS A 27 16.707 -7.356 6.566 1.00 74.10 C ATOM 369 CG LYS A 27 17.969 -7.337 7.411 1.00 52.43 C ATOM 370 CD LYS A 27 18.543 -8.732 7.587 1.00 64.11 C ATOM 371 CE LYS A 27 19.993 -8.684 8.046 1.00 33.31 C ATOM 372 NZ LYS A 27 20.934 -8.562 6.899 1.00 63.41 N ATOM 0 H LYS A 27 15.335 -7.330 8.616 1.00 21.44 H new ATOM 0 HA LYS A 27 16.289 -5.277 6.919 1.00 21.14 H new ATOM 0 HB2 LYS A 27 16.196 -8.308 6.712 1.00 74.10 H new ATOM 0 HB3 LYS A 27 16.984 -7.301 5.513 1.00 74.10 H new ATOM 0 HG2 LYS A 27 18.713 -6.693 6.941 1.00 52.43 H new ATOM 0 HG3 LYS A 27 17.747 -6.908 8.388 1.00 52.43 H new ATOM 0 HD2 LYS A 27 17.948 -9.282 8.315 1.00 64.11 H new ATOM 0 HD3 LYS A 27 18.476 -9.276 6.645 1.00 64.11 H new ATOM 0 HE2 LYS A 27 20.132 -7.840 8.721 1.00 33.31 H new ATOM 0 HE3 LYS A 27 20.225 -9.586 8.612 1.00 33.31 H new ATOM 0 HZ1 LYS A 27 21.911 -8.532 7.253 1.00 63.41 H new ATOM 0 HZ2 LYS A 27 20.819 -9.380 6.267 1.00 63.41 H new ATOM 0 HZ3 LYS A 27 20.730 -7.688 6.374 1.00 63.41 H new ATOM 386 N TRP A 28 13.657 -6.962 5.887 1.00 45.14 N ATOM 387 CA TRP A 28 12.577 -6.966 4.907 1.00 31.10 C ATOM 388 C TRP A 28 11.837 -5.633 4.907 1.00 42.22 C ATOM 389 O TRP A 28 11.528 -5.083 3.849 1.00 72.44 O ATOM 390 CB TRP A 28 11.600 -8.106 5.200 1.00 14.42 C ATOM 391 CG TRP A 28 10.586 -8.312 4.116 1.00 73.31 C ATOM 392 CD1 TRP A 28 10.834 -8.630 2.811 1.00 23.43 C ATOM 393 CD2 TRP A 28 9.163 -8.213 4.243 1.00 61.42 C ATOM 394 NE1 TRP A 28 9.652 -8.735 2.119 1.00 32.14 N ATOM 395 CE2 TRP A 28 8.612 -8.485 2.975 1.00 11.21 C ATOM 396 CE3 TRP A 28 8.301 -7.924 5.304 1.00 60.21 C ATOM 397 CZ2 TRP A 28 7.239 -8.474 2.743 1.00 42.53 C ATOM 398 CZ3 TRP A 28 6.939 -7.913 5.072 1.00 71.15 C ATOM 399 CH2 TRP A 28 6.419 -8.187 3.800 1.00 74.14 C ATOM 0 H TRP A 28 13.556 -7.654 6.629 1.00 45.14 H new ATOM 0 HA TRP A 28 13.015 -7.117 3.920 1.00 31.10 H new ATOM 0 HB2 TRP A 28 12.162 -9.029 5.342 1.00 14.42 H new ATOM 0 HB3 TRP A 28 11.083 -7.900 6.137 1.00 14.42 H new ATOM 0 HD1 TRP A 28 11.816 -8.777 2.386 1.00 23.43 H new ATOM 0 HE1 TRP A 28 9.563 -8.962 1.129 1.00 32.14 H new ATOM 0 HE3 TRP A 28 8.692 -7.713 6.288 1.00 60.21 H new ATOM 0 HZ2 TRP A 28 6.836 -8.685 1.763 1.00 42.53 H new ATOM 0 HZ3 TRP A 28 6.264 -7.689 5.885 1.00 71.15 H new ATOM 0 HH2 TRP A 28 5.349 -8.171 3.651 1.00 74.14 H new ATOM 410 N LEU A 29 11.556 -5.117 6.098 1.00 2.12 N ATOM 411 CA LEU A 29 10.852 -3.846 6.235 1.00 24.42 C ATOM 412 C LEU A 29 11.739 -2.683 5.801 1.00 74.42 C ATOM 413 O LEU A 29 11.253 -1.682 5.272 1.00 31.51 O ATOM 414 CB LEU A 29 10.400 -3.645 7.682 1.00 0.14 C ATOM 415 CG LEU A 29 9.163 -4.433 8.115 1.00 50.11 C ATOM 416 CD1 LEU A 29 9.305 -4.902 9.554 1.00 24.34 C ATOM 417 CD2 LEU A 29 7.908 -3.589 7.949 1.00 11.50 C ATOM 0 H LEU A 29 11.805 -5.559 6.983 1.00 2.12 H new ATOM 0 HA LEU A 29 9.976 -3.872 5.587 1.00 24.42 H new ATOM 0 HB2 LEU A 29 11.226 -3.914 8.340 1.00 0.14 H new ATOM 0 HB3 LEU A 29 10.202 -2.584 7.836 1.00 0.14 H new ATOM 0 HG LEU A 29 9.074 -5.311 7.476 1.00 50.11 H new ATOM 0 HD11 LEU A 29 8.415 -5.461 9.844 1.00 24.34 H new ATOM 0 HD12 LEU A 29 10.181 -5.544 9.643 1.00 24.34 H new ATOM 0 HD13 LEU A 29 9.420 -4.038 10.209 1.00 24.34 H new ATOM 0 HD21 LEU A 29 7.038 -4.166 8.262 1.00 11.50 H new ATOM 0 HD22 LEU A 29 7.989 -2.692 8.563 1.00 11.50 H new ATOM 0 HD23 LEU A 29 7.797 -3.304 6.903 1.00 11.50 H new ATOM 429 N LEU A 30 13.041 -2.823 6.025 1.00 15.30 N ATOM 430 CA LEU A 30 13.996 -1.784 5.655 1.00 60.53 C ATOM 431 C LEU A 30 14.022 -1.582 4.143 1.00 33.20 C ATOM 432 O LEU A 30 14.359 -0.502 3.656 1.00 62.30 O ATOM 433 CB LEU A 30 15.395 -2.149 6.156 1.00 53.23 C ATOM 434 CG LEU A 30 16.112 -1.079 6.980 1.00 62.03 C ATOM 435 CD1 LEU A 30 16.085 0.259 6.257 1.00 62.21 C ATOM 436 CD2 LEU A 30 15.481 -0.955 8.359 1.00 74.14 C ATOM 0 H LEU A 30 13.459 -3.645 6.461 1.00 15.30 H new ATOM 0 HA LEU A 30 13.681 -0.851 6.122 1.00 60.53 H new ATOM 0 HB2 LEU A 30 15.319 -3.054 6.759 1.00 53.23 H new ATOM 0 HB3 LEU A 30 16.016 -2.392 5.294 1.00 53.23 H new ATOM 0 HG LEU A 30 17.152 -1.381 7.105 1.00 62.03 H new ATOM 0 HD11 LEU A 30 16.600 1.008 6.859 1.00 62.21 H new ATOM 0 HD12 LEU A 30 16.584 0.162 5.293 1.00 62.21 H new ATOM 0 HD13 LEU A 30 15.051 0.567 6.101 1.00 62.21 H new ATOM 0 HD21 LEU A 30 16.004 -0.189 8.931 1.00 74.14 H new ATOM 0 HD22 LEU A 30 14.432 -0.677 8.256 1.00 74.14 H new ATOM 0 HD23 LEU A 30 15.554 -1.910 8.880 1.00 74.14 H new ATOM 448 N LEU A 31 13.661 -2.627 3.406 1.00 42.45 N ATOM 449 CA LEU A 31 13.640 -2.563 1.948 1.00 24.52 C ATOM 450 C LEU A 31 12.369 -1.884 1.451 1.00 52.43 C ATOM 451 O LEU A 31 12.384 -1.182 0.440 1.00 63.02 O ATOM 452 CB LEU A 31 13.746 -3.970 1.356 1.00 52.24 C ATOM 453 CG LEU A 31 15.065 -4.703 1.599 1.00 62.43 C ATOM 454 CD1 LEU A 31 15.092 -6.020 0.838 1.00 51.12 C ATOM 455 CD2 LEU A 31 16.244 -3.829 1.196 1.00 13.24 C ATOM 0 H LEU A 31 13.379 -3.528 3.793 1.00 42.45 H new ATOM 0 HA LEU A 31 14.496 -1.972 1.622 1.00 24.52 H new ATOM 0 HB2 LEU A 31 12.937 -4.576 1.763 1.00 52.24 H new ATOM 0 HB3 LEU A 31 13.584 -3.903 0.280 1.00 52.24 H new ATOM 0 HG LEU A 31 15.146 -4.920 2.664 1.00 62.43 H new ATOM 0 HD11 LEU A 31 16.039 -6.528 1.023 1.00 51.12 H new ATOM 0 HD12 LEU A 31 14.270 -6.651 1.174 1.00 51.12 H new ATOM 0 HD13 LEU A 31 14.987 -5.826 -0.229 1.00 51.12 H new ATOM 0 HD21 LEU A 31 17.174 -4.367 1.376 1.00 13.24 H new ATOM 0 HD22 LEU A 31 16.168 -3.580 0.137 1.00 13.24 H new ATOM 0 HD23 LEU A 31 16.235 -2.912 1.785 1.00 13.24 H new ATOM 467 N GLN A 32 11.271 -2.095 2.169 1.00 31.32 N ATOM 468 CA GLN A 32 9.991 -1.501 1.801 1.00 62.22 C ATOM 469 C GLN A 32 9.759 -0.197 2.556 1.00 1.31 C ATOM 470 O GLN A 32 8.627 0.134 2.911 1.00 25.21 O ATOM 471 CB GLN A 32 8.850 -2.479 2.086 1.00 61.32 C ATOM 472 CG GLN A 32 8.583 -2.688 3.568 1.00 45.13 C ATOM 473 CD GLN A 32 7.937 -4.027 3.861 1.00 30.35 C ATOM 474 OE1 GLN A 32 6.898 -4.097 4.519 1.00 22.40 O ATOM 475 NE2 GLN A 32 8.549 -5.100 3.374 1.00 23.12 N ATOM 0 H GLN A 32 11.242 -2.673 3.009 1.00 31.32 H new ATOM 0 HA GLN A 32 10.014 -1.282 0.733 1.00 62.22 H new ATOM 0 HB2 GLN A 32 7.941 -2.112 1.610 1.00 61.32 H new ATOM 0 HB3 GLN A 32 9.084 -3.440 1.628 1.00 61.32 H new ATOM 0 HG2 GLN A 32 9.522 -2.614 4.116 1.00 45.13 H new ATOM 0 HG3 GLN A 32 7.937 -1.890 3.933 1.00 45.13 H new ATOM 0 HE21 GLN A 32 9.408 -4.996 2.834 1.00 23.12 H new ATOM 0 HE22 GLN A 32 8.160 -6.028 3.540 1.00 23.12 H new ATOM 484 N TYR A 33 10.837 0.540 2.799 1.00 42.33 N ATOM 485 CA TYR A 33 10.751 1.808 3.514 1.00 24.35 C ATOM 486 C TYR A 33 9.723 2.730 2.867 1.00 1.33 C ATOM 487 O TYR A 33 9.123 3.573 3.534 1.00 53.51 O ATOM 488 CB TYR A 33 12.119 2.493 3.547 1.00 73.31 C ATOM 489 CG TYR A 33 12.497 3.152 2.240 1.00 53.12 C ATOM 490 CD1 TYR A 33 12.687 2.399 1.088 1.00 32.31 C ATOM 491 CD2 TYR A 33 12.663 4.529 2.157 1.00 52.24 C ATOM 492 CE1 TYR A 33 13.033 2.997 -0.108 1.00 0.02 C ATOM 493 CE2 TYR A 33 13.008 5.136 0.964 1.00 15.34 C ATOM 494 CZ TYR A 33 13.192 4.366 -0.165 1.00 30.13 C ATOM 495 OH TYR A 33 13.535 4.966 -1.355 1.00 24.14 O ATOM 0 H TYR A 33 11.781 0.281 2.511 1.00 42.33 H new ATOM 0 HA TYR A 33 10.432 1.599 4.535 1.00 24.35 H new ATOM 0 HB2 TYR A 33 12.121 3.244 4.337 1.00 73.31 H new ATOM 0 HB3 TYR A 33 12.879 1.756 3.806 1.00 73.31 H new ATOM 0 HD1 TYR A 33 12.562 1.327 1.128 1.00 32.31 H new ATOM 0 HD2 TYR A 33 12.520 5.135 3.039 1.00 52.24 H new ATOM 0 HE1 TYR A 33 13.178 2.396 -0.994 1.00 0.02 H new ATOM 0 HE2 TYR A 33 13.133 6.208 0.916 1.00 15.34 H new ATOM 0 HH TYR A 33 13.606 5.935 -1.224 1.00 24.14 H new ATOM 505 N ARG A 34 9.525 2.563 1.564 1.00 42.02 N ATOM 506 CA ARG A 34 8.570 3.380 0.825 1.00 43.20 C ATOM 507 C ARG A 34 7.196 3.341 1.486 1.00 14.51 C ATOM 508 O ARG A 34 6.420 4.293 1.386 1.00 64.34 O ATOM 509 CB ARG A 34 8.466 2.897 -0.623 1.00 34.34 C ATOM 510 CG ARG A 34 9.811 2.747 -1.314 1.00 1.24 C ATOM 511 CD ARG A 34 9.677 2.859 -2.824 1.00 61.22 C ATOM 512 NE ARG A 34 9.231 1.606 -3.428 1.00 50.22 N ATOM 513 CZ ARG A 34 10.010 0.539 -3.568 1.00 11.32 C ATOM 514 NH1 ARG A 34 11.267 0.573 -3.148 1.00 62.14 N ATOM 515 NH2 ARG A 34 9.531 -0.564 -4.128 1.00 22.44 N ATOM 0 H ARG A 34 10.013 1.869 0.998 1.00 42.02 H new ATOM 0 HA ARG A 34 8.928 4.409 0.832 1.00 43.20 H new ATOM 0 HB2 ARG A 34 7.949 1.937 -0.641 1.00 34.34 H new ATOM 0 HB3 ARG A 34 7.853 3.599 -1.188 1.00 34.34 H new ATOM 0 HG2 ARG A 34 10.495 3.514 -0.951 1.00 1.24 H new ATOM 0 HG3 ARG A 34 10.248 1.782 -1.057 1.00 1.24 H new ATOM 0 HD2 ARG A 34 8.969 3.651 -3.067 1.00 61.22 H new ATOM 0 HD3 ARG A 34 10.637 3.147 -3.253 1.00 61.22 H new ATOM 0 HE ARG A 34 8.269 1.547 -3.761 1.00 50.22 H new ATOM 0 HH11 ARG A 34 11.638 1.420 -2.716 1.00 62.14 H new ATOM 0 HH12 ARG A 34 11.863 -0.247 -3.256 1.00 62.14 H new ATOM 0 HH21 ARG A 34 8.564 -0.593 -4.451 1.00 22.44 H new ATOM 0 HH22 ARG A 34 10.130 -1.383 -4.235 1.00 22.44 H new ATOM 529 N ASP A 35 6.900 2.236 2.161 1.00 5.00 N ATOM 530 CA ASP A 35 5.620 2.073 2.839 1.00 12.22 C ATOM 531 C ASP A 35 5.725 2.483 4.305 1.00 51.43 C ATOM 532 O ASP A 35 5.229 1.789 5.191 1.00 31.40 O ATOM 533 CB ASP A 35 5.144 0.623 2.735 1.00 2.24 C ATOM 534 CG ASP A 35 5.517 -0.015 1.412 1.00 61.02 C ATOM 535 OD1 ASP A 35 5.485 0.691 0.382 1.00 15.20 O ATOM 536 OD2 ASP A 35 5.842 -1.220 1.406 1.00 64.54 O ATOM 0 H ASP A 35 7.530 1.439 2.253 1.00 5.00 H new ATOM 0 HA ASP A 35 4.893 2.722 2.350 1.00 12.22 H new ATOM 0 HB2 ASP A 35 5.577 0.042 3.550 1.00 2.24 H new ATOM 0 HB3 ASP A 35 4.062 0.589 2.859 1.00 2.24 H new ATOM 541 N ALA A 36 6.375 3.616 4.552 1.00 70.13 N ATOM 542 CA ALA A 36 6.544 4.119 5.909 1.00 4.03 C ATOM 543 C ALA A 36 5.197 4.299 6.600 1.00 20.23 C ATOM 544 O ALA A 36 4.910 3.680 7.625 1.00 22.41 O ATOM 545 CB ALA A 36 7.311 5.433 5.893 1.00 1.22 C ATOM 0 H ALA A 36 6.793 4.202 3.830 1.00 70.13 H new ATOM 0 HA ALA A 36 7.117 3.383 6.474 1.00 4.03 H new ATOM 0 HB1 ALA A 36 7.430 5.797 6.913 1.00 1.22 H new ATOM 0 HB2 ALA A 36 8.293 5.276 5.447 1.00 1.22 H new ATOM 0 HB3 ALA A 36 6.760 6.169 5.307 1.00 1.22 H new ATOM 551 N PRO A 37 4.349 5.167 6.029 1.00 61.23 N ATOM 552 CA PRO A 37 3.018 5.448 6.574 1.00 53.23 C ATOM 553 C PRO A 37 2.066 4.267 6.419 1.00 24.51 C ATOM 554 O PRO A 37 1.171 4.065 7.240 1.00 40.22 O ATOM 555 CB PRO A 37 2.536 6.636 5.737 1.00 74.33 C ATOM 556 CG PRO A 37 3.285 6.524 4.454 1.00 74.13 C ATOM 557 CD PRO A 37 4.625 5.940 4.806 1.00 13.02 C ATOM 0 HA PRO A 37 3.050 5.648 7.645 1.00 53.23 H new ATOM 0 HB2 PRO A 37 1.459 6.593 5.572 1.00 74.33 H new ATOM 0 HB3 PRO A 37 2.745 7.582 6.236 1.00 74.33 H new ATOM 0 HG2 PRO A 37 2.755 5.886 3.747 1.00 74.13 H new ATOM 0 HG3 PRO A 37 3.397 7.500 3.981 1.00 74.13 H new ATOM 0 HD2 PRO A 37 5.009 5.305 4.007 1.00 13.02 H new ATOM 0 HD3 PRO A 37 5.369 6.717 4.981 1.00 13.02 H new ATOM 565 N LYS A 38 2.266 3.487 5.362 1.00 21.52 N ATOM 566 CA LYS A 38 1.428 2.323 5.100 1.00 34.21 C ATOM 567 C LYS A 38 1.625 1.257 6.174 1.00 54.34 C ATOM 568 O LYS A 38 0.666 0.818 6.810 1.00 45.03 O ATOM 569 CB LYS A 38 1.747 1.739 3.722 1.00 33.41 C ATOM 570 CG LYS A 38 0.850 2.266 2.615 1.00 32.24 C ATOM 571 CD LYS A 38 -0.477 1.527 2.573 1.00 32.34 C ATOM 572 CE LYS A 38 -1.542 2.334 1.846 1.00 21.34 C ATOM 573 NZ LYS A 38 -1.922 3.559 2.603 1.00 43.25 N ATOM 0 H LYS A 38 3.002 3.640 4.672 1.00 21.52 H new ATOM 0 HA LYS A 38 0.387 2.645 5.119 1.00 34.21 H new ATOM 0 HB2 LYS A 38 2.785 1.961 3.474 1.00 33.41 H new ATOM 0 HB3 LYS A 38 1.655 0.654 3.767 1.00 33.41 H new ATOM 0 HG2 LYS A 38 0.670 3.330 2.767 1.00 32.24 H new ATOM 0 HG3 LYS A 38 1.356 2.162 1.655 1.00 32.24 H new ATOM 0 HD2 LYS A 38 -0.344 0.566 2.075 1.00 32.34 H new ATOM 0 HD3 LYS A 38 -0.809 1.316 3.589 1.00 32.34 H new ATOM 0 HE2 LYS A 38 -1.174 2.616 0.860 1.00 21.34 H new ATOM 0 HE3 LYS A 38 -2.425 1.714 1.691 1.00 21.34 H new ATOM 0 HZ1 LYS A 38 -2.865 3.875 2.301 1.00 43.25 H new ATOM 0 HZ2 LYS A 38 -1.938 3.347 3.621 1.00 43.25 H new ATOM 0 HZ3 LYS A 38 -1.229 4.311 2.417 1.00 43.25 H new ATOM 587 N VAL A 39 2.873 0.847 6.371 1.00 23.43 N ATOM 588 CA VAL A 39 3.196 -0.165 7.370 1.00 61.50 C ATOM 589 C VAL A 39 2.789 0.291 8.767 1.00 45.15 C ATOM 590 O VAL A 39 2.315 -0.504 9.577 1.00 74.01 O ATOM 591 CB VAL A 39 4.700 -0.496 7.368 1.00 64.42 C ATOM 592 CG1 VAL A 39 5.023 -1.525 8.441 1.00 75.43 C ATOM 593 CG2 VAL A 39 5.135 -0.990 5.996 1.00 32.41 C ATOM 0 H VAL A 39 3.677 1.200 5.852 1.00 23.43 H new ATOM 0 HA VAL A 39 2.634 -1.061 7.105 1.00 61.50 H new ATOM 0 HB VAL A 39 5.254 0.415 7.594 1.00 64.42 H new ATOM 0 HG11 VAL A 39 6.090 -1.746 8.424 1.00 75.43 H new ATOM 0 HG12 VAL A 39 4.750 -1.129 9.419 1.00 75.43 H new ATOM 0 HG13 VAL A 39 4.460 -2.439 8.250 1.00 75.43 H new ATOM 0 HG21 VAL A 39 6.201 -1.219 6.013 1.00 32.41 H new ATOM 0 HG22 VAL A 39 4.575 -1.889 5.738 1.00 32.41 H new ATOM 0 HG23 VAL A 39 4.942 -0.216 5.253 1.00 32.41 H new ATOM 603 N ALA A 40 2.979 1.578 9.041 1.00 73.41 N ATOM 604 CA ALA A 40 2.629 2.141 10.339 1.00 42.31 C ATOM 605 C ALA A 40 1.123 2.087 10.573 1.00 4.24 C ATOM 606 O ALA A 40 0.668 1.708 11.652 1.00 52.22 O ATOM 607 CB ALA A 40 3.131 3.574 10.444 1.00 35.04 C ATOM 0 H ALA A 40 3.373 2.249 8.382 1.00 73.41 H new ATOM 0 HA ALA A 40 3.111 1.541 11.111 1.00 42.31 H new ATOM 0 HB1 ALA A 40 2.863 3.983 11.418 1.00 35.04 H new ATOM 0 HB2 ALA A 40 4.215 3.589 10.330 1.00 35.04 H new ATOM 0 HB3 ALA A 40 2.675 4.178 9.659 1.00 35.04 H new ATOM 613 N GLU A 41 0.357 2.469 9.557 1.00 54.21 N ATOM 614 CA GLU A 41 -1.098 2.465 9.655 1.00 53.13 C ATOM 615 C GLU A 41 -1.625 1.049 9.866 1.00 74.45 C ATOM 616 O GLU A 41 -2.421 0.800 10.771 1.00 61.41 O ATOM 617 CB GLU A 41 -1.718 3.069 8.393 1.00 52.11 C ATOM 618 CG GLU A 41 -3.160 3.513 8.576 1.00 42.14 C ATOM 619 CD GLU A 41 -3.636 4.423 7.460 1.00 2.20 C ATOM 620 OE1 GLU A 41 -2.884 5.347 7.086 1.00 42.04 O ATOM 621 OE2 GLU A 41 -4.761 4.211 6.961 1.00 20.23 O ATOM 0 H GLU A 41 0.719 2.785 8.657 1.00 54.21 H new ATOM 0 HA GLU A 41 -1.380 3.071 10.516 1.00 53.13 H new ATOM 0 HB2 GLU A 41 -1.120 3.925 8.078 1.00 52.11 H new ATOM 0 HB3 GLU A 41 -1.672 2.335 7.589 1.00 52.11 H new ATOM 0 HG2 GLU A 41 -3.804 2.635 8.623 1.00 42.14 H new ATOM 0 HG3 GLU A 41 -3.258 4.032 9.530 1.00 42.14 H new ATOM 628 N MET A 42 -1.176 0.125 9.022 1.00 32.23 N ATOM 629 CA MET A 42 -1.602 -1.267 9.116 1.00 2.14 C ATOM 630 C MET A 42 -1.156 -1.883 10.439 1.00 72.45 C ATOM 631 O MET A 42 -1.955 -2.493 11.150 1.00 1.30 O ATOM 632 CB MET A 42 -1.037 -2.075 7.947 1.00 24.50 C ATOM 633 CG MET A 42 -1.968 -3.175 7.462 1.00 3.12 C ATOM 634 SD MET A 42 -2.097 -4.541 8.632 1.00 70.35 S ATOM 635 CE MET A 42 -0.555 -5.399 8.322 1.00 11.32 C ATOM 0 H MET A 42 -0.518 0.315 8.266 1.00 32.23 H new ATOM 0 HA MET A 42 -2.691 -1.292 9.072 1.00 2.14 H new ATOM 0 HB2 MET A 42 -0.824 -1.399 7.119 1.00 24.50 H new ATOM 0 HB3 MET A 42 -0.088 -2.520 8.248 1.00 24.50 H new ATOM 0 HG2 MET A 42 -2.959 -2.756 7.288 1.00 3.12 H new ATOM 0 HG3 MET A 42 -1.609 -3.554 6.505 1.00 3.12 H new ATOM 0 HE1 MET A 42 -0.549 -6.344 8.865 1.00 11.32 H new ATOM 0 HE2 MET A 42 -0.455 -5.594 7.254 1.00 11.32 H new ATOM 0 HE3 MET A 42 0.279 -4.782 8.658 1.00 11.32 H new ATOM 645 N TRP A 43 0.122 -1.721 10.760 1.00 30.54 N ATOM 646 CA TRP A 43 0.673 -2.263 11.998 1.00 71.14 C ATOM 647 C TRP A 43 -0.125 -1.783 13.205 1.00 42.21 C ATOM 648 O TRP A 43 -0.519 -2.578 14.058 1.00 71.32 O ATOM 649 CB TRP A 43 2.140 -1.858 12.147 1.00 64.44 C ATOM 650 CG TRP A 43 2.788 -2.416 13.378 1.00 1.40 C ATOM 651 CD1 TRP A 43 3.370 -3.644 13.514 1.00 53.30 C ATOM 652 CD2 TRP A 43 2.918 -1.765 14.647 1.00 71.30 C ATOM 653 NE1 TRP A 43 3.853 -3.796 14.791 1.00 23.11 N ATOM 654 CE2 TRP A 43 3.589 -2.658 15.506 1.00 45.45 C ATOM 655 CE3 TRP A 43 2.534 -0.516 15.141 1.00 41.31 C ATOM 656 CZ2 TRP A 43 3.883 -2.338 16.829 1.00 72.34 C ATOM 657 CZ3 TRP A 43 2.826 -0.201 16.454 1.00 13.54 C ATOM 658 CH2 TRP A 43 3.495 -1.108 17.286 1.00 63.12 C ATOM 0 H TRP A 43 0.796 -1.220 10.182 1.00 30.54 H new ATOM 0 HA TRP A 43 0.606 -3.350 11.951 1.00 71.14 H new ATOM 0 HB2 TRP A 43 2.693 -2.194 11.270 1.00 64.44 H new ATOM 0 HB3 TRP A 43 2.209 -0.770 12.170 1.00 64.44 H new ATOM 0 HD1 TRP A 43 3.440 -4.386 12.733 1.00 53.30 H new ATOM 0 HE1 TRP A 43 4.331 -4.623 15.149 1.00 23.11 H new ATOM 0 HE3 TRP A 43 2.018 0.191 14.508 1.00 41.31 H new ATOM 0 HZ2 TRP A 43 4.399 -3.036 17.472 1.00 72.34 H new ATOM 0 HZ3 TRP A 43 2.533 0.762 16.846 1.00 13.54 H new ATOM 0 HH2 TRP A 43 3.709 -0.831 18.308 1.00 63.12 H new ATOM 669 N LYS A 44 -0.360 -0.477 13.272 1.00 40.33 N ATOM 670 CA LYS A 44 -1.112 0.110 14.374 1.00 14.31 C ATOM 671 C LYS A 44 -2.515 -0.483 14.452 1.00 33.32 C ATOM 672 O LYS A 44 -2.888 -1.086 15.458 1.00 13.00 O ATOM 673 CB LYS A 44 -1.198 1.629 14.208 1.00 12.23 C ATOM 674 CG LYS A 44 -1.858 2.333 15.382 1.00 73.35 C ATOM 675 CD LYS A 44 -2.528 3.627 14.951 1.00 61.13 C ATOM 676 CE LYS A 44 -3.893 3.369 14.331 1.00 21.23 C ATOM 677 NZ LYS A 44 -4.452 4.592 13.692 1.00 61.14 N ATOM 0 H LYS A 44 -0.040 0.196 12.575 1.00 40.33 H new ATOM 0 HA LYS A 44 -0.587 -0.119 15.301 1.00 14.31 H new ATOM 0 HB2 LYS A 44 -0.193 2.029 14.074 1.00 12.23 H new ATOM 0 HB3 LYS A 44 -1.755 1.856 13.299 1.00 12.23 H new ATOM 0 HG2 LYS A 44 -2.598 1.672 15.835 1.00 73.35 H new ATOM 0 HG3 LYS A 44 -1.111 2.546 16.146 1.00 73.35 H new ATOM 0 HD2 LYS A 44 -2.637 4.286 15.813 1.00 61.13 H new ATOM 0 HD3 LYS A 44 -1.893 4.145 14.232 1.00 61.13 H new ATOM 0 HE2 LYS A 44 -3.810 2.576 13.587 1.00 21.23 H new ATOM 0 HE3 LYS A 44 -4.580 3.015 15.100 1.00 21.23 H new ATOM 0 HZ1 LYS A 44 -5.382 4.375 13.281 1.00 61.14 H new ATOM 0 HZ2 LYS A 44 -4.555 5.341 14.406 1.00 61.14 H new ATOM 0 HZ3 LYS A 44 -3.809 4.916 12.941 1.00 61.14 H new ATOM 691 N GLU A 45 -3.287 -0.309 13.384 1.00 70.42 N ATOM 692 CA GLU A 45 -4.649 -0.829 13.333 1.00 65.11 C ATOM 693 C GLU A 45 -4.672 -2.324 13.637 1.00 62.42 C ATOM 694 O GLU A 45 -5.656 -2.847 14.161 1.00 62.25 O ATOM 695 CB GLU A 45 -5.267 -0.567 11.958 1.00 31.21 C ATOM 696 CG GLU A 45 -6.034 0.742 11.875 1.00 22.11 C ATOM 697 CD GLU A 45 -7.020 0.769 10.723 1.00 23.52 C ATOM 698 OE1 GLU A 45 -6.613 0.453 9.586 1.00 63.42 O ATOM 699 OE2 GLU A 45 -8.199 1.105 10.960 1.00 2.40 O ATOM 0 H GLU A 45 -2.993 0.188 12.543 1.00 70.42 H new ATOM 0 HA GLU A 45 -5.237 -0.313 14.092 1.00 65.11 H new ATOM 0 HB2 GLU A 45 -4.476 -0.563 11.208 1.00 31.21 H new ATOM 0 HB3 GLU A 45 -5.939 -1.388 11.708 1.00 31.21 H new ATOM 0 HG2 GLU A 45 -6.569 0.905 12.810 1.00 22.11 H new ATOM 0 HG3 GLU A 45 -5.329 1.566 11.764 1.00 22.11 H new ATOM 706 N TYR A 46 -3.582 -3.007 13.304 1.00 43.52 N ATOM 707 CA TYR A 46 -3.477 -4.442 13.538 1.00 52.13 C ATOM 708 C TYR A 46 -3.188 -4.735 15.007 1.00 43.22 C ATOM 709 O TYR A 46 -3.696 -5.704 15.570 1.00 54.32 O ATOM 710 CB TYR A 46 -2.379 -5.044 12.660 1.00 23.20 C ATOM 711 CG TYR A 46 -1.969 -6.439 13.075 1.00 70.31 C ATOM 712 CD1 TYR A 46 -2.702 -7.549 12.671 1.00 0.40 C ATOM 713 CD2 TYR A 46 -0.850 -6.648 13.871 1.00 21.22 C ATOM 714 CE1 TYR A 46 -2.332 -8.825 13.048 1.00 20.11 C ATOM 715 CE2 TYR A 46 -0.472 -7.921 14.252 1.00 64.12 C ATOM 716 CZ TYR A 46 -1.216 -9.006 13.838 1.00 21.20 C ATOM 717 OH TYR A 46 -0.843 -10.276 14.216 1.00 11.32 O ATOM 0 H TYR A 46 -2.758 -2.589 12.871 1.00 43.52 H new ATOM 0 HA TYR A 46 -4.432 -4.898 13.277 1.00 52.13 H new ATOM 0 HB2 TYR A 46 -2.724 -5.068 11.626 1.00 23.20 H new ATOM 0 HB3 TYR A 46 -1.505 -4.394 12.689 1.00 23.20 H new ATOM 0 HD1 TYR A 46 -3.576 -7.411 12.052 1.00 0.40 H new ATOM 0 HD2 TYR A 46 -0.265 -5.801 14.198 1.00 21.22 H new ATOM 0 HE1 TYR A 46 -2.913 -9.676 12.726 1.00 20.11 H new ATOM 0 HE2 TYR A 46 0.401 -8.066 14.871 1.00 64.12 H new ATOM 0 HH TYR A 46 -1.454 -10.929 13.816 1.00 11.32 H new ATOM 727 N MET A 47 -2.367 -3.889 15.621 1.00 31.24 N ATOM 728 CA MET A 47 -2.011 -4.055 17.026 1.00 64.44 C ATOM 729 C MET A 47 -3.166 -3.643 17.932 1.00 2.13 C ATOM 730 O MET A 47 -3.249 -4.072 19.084 1.00 63.42 O ATOM 731 CB MET A 47 -0.766 -3.231 17.359 1.00 42.10 C ATOM 732 CG MET A 47 0.491 -3.715 16.653 1.00 14.23 C ATOM 733 SD MET A 47 1.299 -5.070 17.526 1.00 71.14 S ATOM 734 CE MET A 47 2.176 -4.174 18.805 1.00 72.12 C ATOM 0 H MET A 47 -1.936 -3.083 15.169 1.00 31.24 H new ATOM 0 HA MET A 47 -1.796 -5.110 17.199 1.00 64.44 H new ATOM 0 HB2 MET A 47 -0.946 -2.190 17.089 1.00 42.10 H new ATOM 0 HB3 MET A 47 -0.601 -3.257 18.436 1.00 42.10 H new ATOM 0 HG2 MET A 47 0.235 -4.039 15.644 1.00 14.23 H new ATOM 0 HG3 MET A 47 1.190 -2.884 16.553 1.00 14.23 H new ATOM 0 HE1 MET A 47 3.244 -4.374 18.722 1.00 72.12 H new ATOM 0 HE2 MET A 47 1.996 -3.105 18.689 1.00 72.12 H new ATOM 0 HE3 MET A 47 1.822 -4.497 19.784 1.00 72.12 H new ATOM 744 N LEU A 48 -4.055 -2.808 17.407 1.00 52.33 N ATOM 745 CA LEU A 48 -5.206 -2.337 18.169 1.00 13.22 C ATOM 746 C LEU A 48 -6.436 -3.194 17.884 1.00 4.34 C ATOM 747 O LEU A 48 -7.568 -2.717 17.959 1.00 10.53 O ATOM 748 CB LEU A 48 -5.501 -0.874 17.833 1.00 14.13 C ATOM 749 CG LEU A 48 -4.368 0.118 18.099 1.00 60.42 C ATOM 750 CD1 LEU A 48 -4.811 1.535 17.771 1.00 10.04 C ATOM 751 CD2 LEU A 48 -3.904 0.022 19.545 1.00 50.40 C ATOM 0 H LEU A 48 -4.001 -2.443 16.456 1.00 52.33 H new ATOM 0 HA LEU A 48 -4.967 -2.419 19.229 1.00 13.22 H new ATOM 0 HB2 LEU A 48 -5.771 -0.812 16.779 1.00 14.13 H new ATOM 0 HB3 LEU A 48 -6.374 -0.560 18.405 1.00 14.13 H new ATOM 0 HG LEU A 48 -3.528 -0.136 17.452 1.00 60.42 H new ATOM 0 HD11 LEU A 48 -3.992 2.227 17.967 1.00 10.04 H new ATOM 0 HD12 LEU A 48 -5.093 1.594 16.720 1.00 10.04 H new ATOM 0 HD13 LEU A 48 -5.667 1.801 18.391 1.00 10.04 H new ATOM 0 HD21 LEU A 48 -3.097 0.735 19.716 1.00 50.40 H new ATOM 0 HD22 LEU A 48 -4.737 0.250 20.210 1.00 50.40 H new ATOM 0 HD23 LEU A 48 -3.545 -0.987 19.746 1.00 50.40 H new ATOM 763 N ARG A 49 -6.204 -4.462 17.560 1.00 55.52 N ATOM 764 CA ARG A 49 -7.293 -5.385 17.265 1.00 31.41 C ATOM 765 C ARG A 49 -7.425 -6.438 18.362 1.00 10.21 C ATOM 766 O ARG A 49 -6.460 -6.784 19.043 1.00 22.33 O ATOM 767 CB ARG A 49 -7.061 -6.067 15.915 1.00 2.32 C ATOM 768 CG ARG A 49 -7.654 -5.308 14.740 1.00 55.33 C ATOM 769 CD ARG A 49 -7.050 -5.762 13.421 1.00 44.04 C ATOM 770 NE ARG A 49 -7.854 -6.798 12.777 1.00 2.45 N ATOM 771 CZ ARG A 49 -8.978 -6.549 12.115 1.00 32.51 C ATOM 772 NH1 ARG A 49 -9.429 -5.307 12.009 1.00 45.01 N ATOM 773 NH2 ARG A 49 -9.654 -7.545 11.557 1.00 74.41 N ATOM 0 H ARG A 49 -5.273 -4.873 17.495 1.00 55.52 H new ATOM 0 HA ARG A 49 -8.219 -4.812 17.221 1.00 31.41 H new ATOM 0 HB2 ARG A 49 -5.989 -6.185 15.757 1.00 2.32 H new ATOM 0 HB3 ARG A 49 -7.491 -7.068 15.944 1.00 2.32 H new ATOM 0 HG2 ARG A 49 -8.734 -5.457 14.717 1.00 55.33 H new ATOM 0 HG3 ARG A 49 -7.482 -4.240 14.872 1.00 55.33 H new ATOM 0 HD2 ARG A 49 -6.958 -4.907 12.752 1.00 44.04 H new ATOM 0 HD3 ARG A 49 -6.043 -6.141 13.595 1.00 44.04 H new ATOM 0 HE ARG A 49 -7.535 -7.765 12.839 1.00 2.45 H new ATOM 0 HH11 ARG A 49 -8.912 -4.539 12.437 1.00 45.01 H new ATOM 0 HH12 ARG A 49 -10.293 -5.120 11.500 1.00 45.01 H new ATOM 0 HH21 ARG A 49 -9.310 -8.502 11.636 1.00 74.41 H new ATOM 0 HH22 ARG A 49 -10.517 -7.354 11.049 1.00 74.41 H new ATOM 787 N PRO A 50 -8.648 -6.959 18.539 1.00 54.24 N ATOM 788 CA PRO A 50 -8.936 -7.979 19.551 1.00 2.14 C ATOM 789 C PRO A 50 -8.304 -9.325 19.214 1.00 71.12 C ATOM 790 O PRO A 50 -7.747 -9.996 20.083 1.00 13.40 O ATOM 791 CB PRO A 50 -10.463 -8.083 19.526 1.00 23.33 C ATOM 792 CG PRO A 50 -10.850 -7.638 18.158 1.00 34.44 C ATOM 793 CD PRO A 50 -9.845 -6.593 17.763 1.00 51.44 C ATOM 0 HA PRO A 50 -8.530 -7.711 20.526 1.00 2.14 H new ATOM 0 HB2 PRO A 50 -10.794 -9.104 19.719 1.00 23.33 H new ATOM 0 HB3 PRO A 50 -10.916 -7.452 20.291 1.00 23.33 H new ATOM 0 HG2 PRO A 50 -10.840 -8.474 17.458 1.00 34.44 H new ATOM 0 HG3 PRO A 50 -11.861 -7.230 18.152 1.00 34.44 H new ATOM 0 HD2 PRO A 50 -9.649 -6.609 16.691 1.00 51.44 H new ATOM 0 HD3 PRO A 50 -10.192 -5.589 18.009 1.00 51.44 H new ATOM 801 N SER A 51 -8.394 -9.715 17.946 1.00 11.51 N ATOM 802 CA SER A 51 -7.834 -10.983 17.495 1.00 40.15 C ATOM 803 C SER A 51 -6.385 -11.129 17.949 1.00 60.31 C ATOM 804 O SER A 51 -5.970 -12.195 18.406 1.00 50.43 O ATOM 805 CB SER A 51 -7.915 -11.087 15.970 1.00 14.33 C ATOM 806 OG SER A 51 -9.208 -11.494 15.555 1.00 25.42 O ATOM 0 H SER A 51 -8.849 -9.171 17.213 1.00 11.51 H new ATOM 0 HA SER A 51 -8.419 -11.789 17.939 1.00 40.15 H new ATOM 0 HB2 SER A 51 -7.673 -10.123 15.523 1.00 14.33 H new ATOM 0 HB3 SER A 51 -7.173 -11.800 15.611 1.00 14.33 H new ATOM 0 HG SER A 51 -9.235 -11.551 14.577 1.00 25.42 H new ATOM 812 N VAL A 52 -5.619 -10.051 17.820 1.00 40.40 N ATOM 813 CA VAL A 52 -4.216 -10.057 18.218 1.00 53.12 C ATOM 814 C VAL A 52 -4.072 -10.281 19.719 1.00 62.12 C ATOM 815 O VAL A 52 -4.572 -9.498 20.525 1.00 41.45 O ATOM 816 CB VAL A 52 -3.519 -8.737 17.837 1.00 31.25 C ATOM 817 CG1 VAL A 52 -2.057 -8.766 18.255 1.00 64.24 C ATOM 818 CG2 VAL A 52 -3.651 -8.476 16.345 1.00 72.34 C ATOM 0 H VAL A 52 -5.946 -9.162 17.443 1.00 40.40 H new ATOM 0 HA VAL A 52 -3.738 -10.878 17.684 1.00 53.12 H new ATOM 0 HB VAL A 52 -4.008 -7.921 18.369 1.00 31.25 H new ATOM 0 HG11 VAL A 52 -1.581 -7.826 17.978 1.00 64.24 H new ATOM 0 HG12 VAL A 52 -1.990 -8.903 19.334 1.00 64.24 H new ATOM 0 HG13 VAL A 52 -1.551 -9.591 17.753 1.00 64.24 H new ATOM 0 HG21 VAL A 52 -3.153 -7.540 16.094 1.00 72.34 H new ATOM 0 HG22 VAL A 52 -3.189 -9.293 15.790 1.00 72.34 H new ATOM 0 HG23 VAL A 52 -4.706 -8.408 16.079 1.00 72.34 H new ATOM 828 N ASN A 53 -3.383 -11.357 20.087 1.00 15.23 N ATOM 829 CA ASN A 53 -3.173 -11.685 21.493 1.00 44.24 C ATOM 830 C ASN A 53 -1.997 -10.899 22.064 1.00 4.21 C ATOM 831 O ASN A 53 -1.401 -10.065 21.381 1.00 53.21 O ATOM 832 CB ASN A 53 -2.925 -13.186 21.656 1.00 42.22 C ATOM 833 CG ASN A 53 -4.205 -13.995 21.575 1.00 63.22 C ATOM 834 OD1 ASN A 53 -5.293 -13.484 21.838 1.00 32.12 O ATOM 835 ND2 ASN A 53 -4.079 -15.266 21.209 1.00 1.42 N ATOM 0 H ASN A 53 -2.961 -12.016 19.432 1.00 15.23 H new ATOM 0 HA ASN A 53 -4.073 -11.410 22.044 1.00 44.24 H new ATOM 0 HB2 ASN A 53 -2.235 -13.524 20.882 1.00 42.22 H new ATOM 0 HB3 ASN A 53 -2.442 -13.370 22.616 1.00 42.22 H new ATOM 0 HD21 ASN A 53 -4.905 -15.860 21.137 1.00 1.42 H new ATOM 0 HD22 ASN A 53 -3.156 -15.648 21.000 1.00 1.42 H new ATOM 842 N THR A 54 -1.666 -11.171 23.323 1.00 43.32 N ATOM 843 CA THR A 54 -0.562 -10.489 23.987 1.00 22.51 C ATOM 844 C THR A 54 0.769 -10.823 23.324 1.00 64.43 C ATOM 845 O THR A 54 1.553 -9.931 23.000 1.00 25.11 O ATOM 846 CB THR A 54 -0.487 -10.864 25.479 1.00 20.13 C ATOM 847 OG1 THR A 54 -1.667 -11.578 25.865 1.00 63.21 O ATOM 848 CG2 THR A 54 -0.336 -9.621 26.343 1.00 42.45 C ATOM 0 H THR A 54 -2.147 -11.859 23.903 1.00 43.32 H new ATOM 0 HA THR A 54 -0.751 -9.419 23.897 1.00 22.51 H new ATOM 0 HB THR A 54 0.387 -11.499 25.627 1.00 20.13 H new ATOM 0 HG1 THR A 54 -1.583 -12.517 25.598 1.00 63.21 H new ATOM 0 HG21 THR A 54 -0.285 -9.911 27.392 1.00 42.45 H new ATOM 0 HG22 THR A 54 0.578 -9.095 26.067 1.00 42.45 H new ATOM 0 HG23 THR A 54 -1.193 -8.965 26.189 1.00 42.45 H new ATOM 856 N ARG A 55 1.018 -12.113 23.123 1.00 21.41 N ATOM 857 CA ARG A 55 2.256 -12.565 22.498 1.00 14.31 C ATOM 858 C ARG A 55 2.493 -11.839 21.177 1.00 63.41 C ATOM 859 O ARG A 55 3.562 -11.270 20.954 1.00 54.24 O ATOM 860 CB ARG A 55 2.211 -14.076 22.262 1.00 2.41 C ATOM 861 CG ARG A 55 3.540 -14.770 22.510 1.00 43.02 C ATOM 862 CD ARG A 55 3.734 -15.092 23.983 1.00 24.22 C ATOM 863 NE ARG A 55 3.194 -16.403 24.333 1.00 71.24 N ATOM 864 CZ ARG A 55 3.475 -17.036 25.466 1.00 3.33 C ATOM 865 NH1 ARG A 55 4.287 -16.480 26.356 1.00 74.04 N ATOM 866 NH2 ARG A 55 2.944 -18.227 25.713 1.00 43.55 N ATOM 0 H ARG A 55 0.379 -12.864 23.384 1.00 21.41 H new ATOM 0 HA ARG A 55 3.081 -12.335 23.173 1.00 14.31 H new ATOM 0 HB2 ARG A 55 1.455 -14.515 22.913 1.00 2.41 H new ATOM 0 HB3 ARG A 55 1.897 -14.266 21.236 1.00 2.41 H new ATOM 0 HG2 ARG A 55 3.586 -15.689 21.926 1.00 43.02 H new ATOM 0 HG3 ARG A 55 4.354 -14.133 22.165 1.00 43.02 H new ATOM 0 HD2 ARG A 55 4.797 -15.062 24.224 1.00 24.22 H new ATOM 0 HD3 ARG A 55 3.248 -14.327 24.588 1.00 24.22 H new ATOM 0 HE ARG A 55 2.566 -16.858 23.670 1.00 71.24 H new ATOM 0 HH11 ARG A 55 4.697 -15.565 26.171 1.00 74.04 H new ATOM 0 HH12 ARG A 55 4.501 -16.968 27.226 1.00 74.04 H new ATOM 0 HH21 ARG A 55 2.319 -18.658 25.032 1.00 43.55 H new ATOM 0 HH22 ARG A 55 3.161 -18.712 26.584 1.00 43.55 H new ATOM 880 N ARG A 56 1.491 -11.866 20.305 1.00 52.52 N ATOM 881 CA ARG A 56 1.591 -11.212 19.005 1.00 25.33 C ATOM 882 C ARG A 56 1.993 -9.749 19.162 1.00 12.52 C ATOM 883 O ARG A 56 2.861 -9.251 18.445 1.00 54.25 O ATOM 884 CB ARG A 56 0.261 -11.310 18.257 1.00 13.11 C ATOM 885 CG ARG A 56 -0.196 -12.739 18.011 1.00 14.52 C ATOM 886 CD ARG A 56 -1.109 -12.831 16.798 1.00 4.50 C ATOM 887 NE ARG A 56 -1.172 -14.188 16.262 1.00 4.42 N ATOM 888 CZ ARG A 56 -1.934 -15.146 16.776 1.00 33.02 C ATOM 889 NH1 ARG A 56 -2.695 -14.897 17.833 1.00 31.12 N ATOM 890 NH2 ARG A 56 -1.938 -16.356 16.232 1.00 25.44 N ATOM 0 H ARG A 56 0.600 -12.334 20.475 1.00 52.52 H new ATOM 0 HA ARG A 56 2.362 -11.722 18.428 1.00 25.33 H new ATOM 0 HB2 ARG A 56 -0.506 -10.785 18.827 1.00 13.11 H new ATOM 0 HB3 ARG A 56 0.354 -10.797 17.300 1.00 13.11 H new ATOM 0 HG2 ARG A 56 0.673 -13.380 17.863 1.00 14.52 H new ATOM 0 HG3 ARG A 56 -0.720 -13.111 18.891 1.00 14.52 H new ATOM 0 HD2 ARG A 56 -2.111 -12.503 17.073 1.00 4.50 H new ATOM 0 HD3 ARG A 56 -0.753 -12.152 16.024 1.00 4.50 H new ATOM 0 HE ARG A 56 -0.599 -14.412 15.448 1.00 4.42 H new ATOM 0 HH11 ARG A 56 -2.696 -13.968 18.253 1.00 31.12 H new ATOM 0 HH12 ARG A 56 -3.279 -15.635 18.226 1.00 31.12 H new ATOM 0 HH21 ARG A 56 -1.355 -16.551 15.418 1.00 25.44 H new ATOM 0 HH22 ARG A 56 -2.524 -17.091 16.628 1.00 25.44 H new ATOM 904 N LYS A 57 1.355 -9.063 20.105 1.00 20.43 N ATOM 905 CA LYS A 57 1.645 -7.657 20.358 1.00 12.02 C ATOM 906 C LYS A 57 3.103 -7.466 20.764 1.00 72.23 C ATOM 907 O LYS A 57 3.812 -6.633 20.197 1.00 74.41 O ATOM 908 CB LYS A 57 0.724 -7.114 21.454 1.00 64.41 C ATOM 909 CG LYS A 57 -0.654 -6.722 20.951 1.00 0.31 C ATOM 910 CD LYS A 57 -1.685 -6.757 22.066 1.00 34.43 C ATOM 911 CE LYS A 57 -3.101 -6.829 21.514 1.00 21.23 C ATOM 912 NZ LYS A 57 -4.106 -7.044 22.592 1.00 72.34 N ATOM 0 H LYS A 57 0.633 -9.459 20.707 1.00 20.43 H new ATOM 0 HA LYS A 57 1.468 -7.104 19.436 1.00 12.02 H new ATOM 0 HB2 LYS A 57 0.616 -7.869 22.233 1.00 64.41 H new ATOM 0 HB3 LYS A 57 1.194 -6.245 21.915 1.00 64.41 H new ATOM 0 HG2 LYS A 57 -0.615 -5.721 20.522 1.00 0.31 H new ATOM 0 HG3 LYS A 57 -0.957 -7.399 20.152 1.00 0.31 H new ATOM 0 HD2 LYS A 57 -1.499 -7.618 22.708 1.00 34.43 H new ATOM 0 HD3 LYS A 57 -1.580 -5.868 22.688 1.00 34.43 H new ATOM 0 HE2 LYS A 57 -3.331 -5.906 20.982 1.00 21.23 H new ATOM 0 HE3 LYS A 57 -3.167 -7.640 20.789 1.00 21.23 H new ATOM 0 HZ1 LYS A 57 -5.058 -7.087 22.175 1.00 72.34 H new ATOM 0 HZ2 LYS A 57 -3.902 -7.938 23.084 1.00 72.34 H new ATOM 0 HZ3 LYS A 57 -4.061 -6.257 23.271 1.00 72.34 H new ATOM 926 N LEU A 58 3.545 -8.243 21.746 1.00 2.03 N ATOM 927 CA LEU A 58 4.920 -8.161 22.227 1.00 42.42 C ATOM 928 C LEU A 58 5.909 -8.273 21.071 1.00 54.15 C ATOM 929 O LEU A 58 6.784 -7.423 20.903 1.00 1.32 O ATOM 930 CB LEU A 58 5.190 -9.263 23.252 1.00 31.22 C ATOM 931 CG LEU A 58 6.577 -9.256 23.896 1.00 33.32 C ATOM 932 CD1 LEU A 58 7.588 -9.944 22.993 1.00 43.14 C ATOM 933 CD2 LEU A 58 7.015 -7.832 24.203 1.00 12.35 C ATOM 0 H LEU A 58 2.971 -8.937 22.225 1.00 2.03 H new ATOM 0 HA LEU A 58 5.054 -7.190 22.703 1.00 42.42 H new ATOM 0 HB2 LEU A 58 4.444 -9.186 24.043 1.00 31.22 H new ATOM 0 HB3 LEU A 58 5.042 -10.227 22.766 1.00 31.22 H new ATOM 0 HG LEU A 58 6.524 -9.808 24.834 1.00 33.32 H new ATOM 0 HD11 LEU A 58 8.569 -9.929 23.468 1.00 43.14 H new ATOM 0 HD12 LEU A 58 7.282 -10.976 22.824 1.00 43.14 H new ATOM 0 HD13 LEU A 58 7.639 -9.420 22.038 1.00 43.14 H new ATOM 0 HD21 LEU A 58 8.004 -7.846 24.661 1.00 12.35 H new ATOM 0 HD22 LEU A 58 7.051 -7.255 23.279 1.00 12.35 H new ATOM 0 HD23 LEU A 58 6.304 -7.373 24.890 1.00 12.35 H new ATOM 945 N LEU A 59 5.762 -9.326 20.274 1.00 52.42 N ATOM 946 CA LEU A 59 6.640 -9.548 19.131 1.00 63.44 C ATOM 947 C LEU A 59 6.629 -8.346 18.193 1.00 51.34 C ATOM 948 O LEU A 59 7.680 -7.828 17.818 1.00 0.41 O ATOM 949 CB LEU A 59 6.213 -10.806 18.371 1.00 1.24 C ATOM 950 CG LEU A 59 6.810 -12.124 18.866 1.00 13.22 C ATOM 951 CD1 LEU A 59 8.247 -12.271 18.391 1.00 10.23 C ATOM 952 CD2 LEU A 59 6.737 -12.206 20.384 1.00 13.20 C ATOM 0 H LEU A 59 5.043 -10.039 20.398 1.00 52.42 H new ATOM 0 HA LEU A 59 7.655 -9.684 19.506 1.00 63.44 H new ATOM 0 HB2 LEU A 59 5.127 -10.883 18.416 1.00 1.24 H new ATOM 0 HB3 LEU A 59 6.480 -10.681 17.322 1.00 1.24 H new ATOM 0 HG LEU A 59 6.226 -12.944 18.449 1.00 13.22 H new ATOM 0 HD11 LEU A 59 8.655 -13.215 18.753 1.00 10.23 H new ATOM 0 HD12 LEU A 59 8.273 -12.258 17.301 1.00 10.23 H new ATOM 0 HD13 LEU A 59 8.844 -11.445 18.778 1.00 10.23 H new ATOM 0 HD21 LEU A 59 7.166 -13.150 20.718 1.00 13.20 H new ATOM 0 HD22 LEU A 59 7.296 -11.378 20.820 1.00 13.20 H new ATOM 0 HD23 LEU A 59 5.696 -12.148 20.702 1.00 13.20 H new ATOM 964 N GLY A 60 5.432 -7.905 17.818 1.00 54.10 N ATOM 965 CA GLY A 60 5.306 -6.765 16.929 1.00 73.03 C ATOM 966 C GLY A 60 6.045 -5.545 17.441 1.00 23.22 C ATOM 967 O GLY A 60 6.649 -4.804 16.665 1.00 64.35 O ATOM 0 H GLY A 60 4.547 -8.317 18.114 1.00 54.10 H new ATOM 0 HA2 GLY A 60 5.690 -7.032 15.945 1.00 73.03 H new ATOM 0 HA3 GLY A 60 4.251 -6.521 16.804 1.00 73.03 H new ATOM 971 N LEU A 61 5.998 -5.334 18.752 1.00 55.01 N ATOM 972 CA LEU A 61 6.667 -4.194 19.368 1.00 42.30 C ATOM 973 C LEU A 61 8.173 -4.254 19.131 1.00 11.53 C ATOM 974 O LEU A 61 8.786 -3.269 18.719 1.00 42.14 O ATOM 975 CB LEU A 61 6.376 -4.157 20.869 1.00 5.43 C ATOM 976 CG LEU A 61 6.299 -2.767 21.504 1.00 60.52 C ATOM 977 CD1 LEU A 61 7.636 -2.053 21.389 1.00 44.35 C ATOM 978 CD2 LEU A 61 5.195 -1.945 20.855 1.00 61.53 C ATOM 0 H LEU A 61 5.503 -5.938 19.409 1.00 55.01 H new ATOM 0 HA LEU A 61 6.281 -3.285 18.907 1.00 42.30 H new ATOM 0 HB2 LEU A 61 5.431 -4.669 21.048 1.00 5.43 H new ATOM 0 HB3 LEU A 61 7.150 -4.727 21.383 1.00 5.43 H new ATOM 0 HG LEU A 61 6.063 -2.884 22.562 1.00 60.52 H new ATOM 0 HD11 LEU A 61 7.562 -1.066 21.846 1.00 44.35 H new ATOM 0 HD12 LEU A 61 8.404 -2.633 21.901 1.00 44.35 H new ATOM 0 HD13 LEU A 61 7.902 -1.947 20.337 1.00 44.35 H new ATOM 0 HD21 LEU A 61 5.155 -0.959 21.319 1.00 61.53 H new ATOM 0 HD22 LEU A 61 5.400 -1.837 19.790 1.00 61.53 H new ATOM 0 HD23 LEU A 61 4.238 -2.449 20.991 1.00 61.53 H new ATOM 990 N TYR A 62 8.762 -5.415 19.393 1.00 12.13 N ATOM 991 CA TYR A 62 10.196 -5.603 19.209 1.00 31.31 C ATOM 992 C TYR A 62 10.574 -5.500 17.735 1.00 70.24 C ATOM 993 O TYR A 62 11.675 -5.067 17.392 1.00 1.14 O ATOM 994 CB TYR A 62 10.629 -6.961 19.764 1.00 34.42 C ATOM 995 CG TYR A 62 11.039 -6.918 21.219 1.00 61.13 C ATOM 996 CD1 TYR A 62 12.030 -6.047 21.655 1.00 21.34 C ATOM 997 CD2 TYR A 62 10.437 -7.748 22.156 1.00 22.21 C ATOM 998 CE1 TYR A 62 12.409 -6.005 22.983 1.00 1.42 C ATOM 999 CE2 TYR A 62 10.809 -7.711 23.486 1.00 33.31 C ATOM 1000 CZ TYR A 62 11.795 -6.838 23.895 1.00 62.13 C ATOM 1001 OH TYR A 62 12.169 -6.799 25.218 1.00 21.34 O ATOM 0 H TYR A 62 8.269 -6.240 19.734 1.00 12.13 H new ATOM 0 HA TYR A 62 10.713 -4.813 19.754 1.00 31.31 H new ATOM 0 HB2 TYR A 62 9.809 -7.670 19.647 1.00 34.42 H new ATOM 0 HB3 TYR A 62 11.463 -7.337 19.171 1.00 34.42 H new ATOM 0 HD1 TYR A 62 12.512 -5.392 20.944 1.00 21.34 H new ATOM 0 HD2 TYR A 62 9.665 -8.434 21.840 1.00 22.21 H new ATOM 0 HE1 TYR A 62 13.182 -5.323 23.305 1.00 1.42 H new ATOM 0 HE2 TYR A 62 10.330 -8.363 24.202 1.00 33.31 H new ATOM 0 HH TYR A 62 11.639 -7.447 25.727 1.00 21.34 H new ATOM 1011 N LEU A 63 9.653 -5.901 16.865 1.00 11.23 N ATOM 1012 CA LEU A 63 9.887 -5.854 15.426 1.00 3.41 C ATOM 1013 C LEU A 63 9.961 -4.412 14.933 1.00 12.14 C ATOM 1014 O LEU A 63 10.951 -4.002 14.328 1.00 73.53 O ATOM 1015 CB LEU A 63 8.779 -6.602 14.684 1.00 33.22 C ATOM 1016 CG LEU A 63 8.876 -6.605 13.158 1.00 30.42 C ATOM 1017 CD1 LEU A 63 8.249 -5.346 12.581 1.00 50.13 C ATOM 1018 CD2 LEU A 63 10.327 -6.732 12.717 1.00 53.24 C ATOM 0 H LEU A 63 8.737 -6.262 17.131 1.00 11.23 H new ATOM 0 HA LEU A 63 10.842 -6.338 15.223 1.00 3.41 H new ATOM 0 HB2 LEU A 63 8.772 -7.636 15.030 1.00 33.22 H new ATOM 0 HB3 LEU A 63 7.821 -6.165 14.966 1.00 33.22 H new ATOM 0 HG LEU A 63 8.325 -7.466 12.779 1.00 30.42 H new ATOM 0 HD11 LEU A 63 8.327 -5.366 11.494 1.00 50.13 H new ATOM 0 HD12 LEU A 63 7.199 -5.298 12.868 1.00 50.13 H new ATOM 0 HD13 LEU A 63 8.771 -4.470 12.967 1.00 50.13 H new ATOM 0 HD21 LEU A 63 10.378 -6.733 11.628 1.00 53.24 H new ATOM 0 HD22 LEU A 63 10.901 -5.891 13.107 1.00 53.24 H new ATOM 0 HD23 LEU A 63 10.743 -7.664 13.100 1.00 53.24 H new ATOM 1030 N MET A 64 8.907 -3.647 15.200 1.00 43.45 N ATOM 1031 CA MET A 64 8.854 -2.249 14.786 1.00 65.20 C ATOM 1032 C MET A 64 9.955 -1.440 15.464 1.00 44.42 C ATOM 1033 O MET A 64 10.461 -0.470 14.901 1.00 42.31 O ATOM 1034 CB MET A 64 7.487 -1.649 15.116 1.00 13.34 C ATOM 1035 CG MET A 64 7.332 -1.257 16.577 1.00 34.51 C ATOM 1036 SD MET A 64 7.720 0.478 16.876 1.00 33.34 S ATOM 1037 CE MET A 64 6.985 0.715 18.493 1.00 64.12 C ATOM 0 H MET A 64 8.079 -3.971 15.700 1.00 43.45 H new ATOM 0 HA MET A 64 9.009 -2.209 13.708 1.00 65.20 H new ATOM 0 HB2 MET A 64 7.326 -0.769 14.493 1.00 13.34 H new ATOM 0 HB3 MET A 64 6.711 -2.369 14.857 1.00 13.34 H new ATOM 0 HG2 MET A 64 6.309 -1.457 16.896 1.00 34.51 H new ATOM 0 HG3 MET A 64 7.984 -1.881 17.188 1.00 34.51 H new ATOM 0 HE1 MET A 64 7.142 1.744 18.817 1.00 64.12 H new ATOM 0 HE2 MET A 64 5.916 0.510 18.440 1.00 64.12 H new ATOM 0 HE3 MET A 64 7.450 0.035 19.207 1.00 64.12 H new ATOM 1047 N ASN A 65 10.321 -1.845 16.676 1.00 41.14 N ATOM 1048 CA ASN A 65 11.362 -1.156 17.430 1.00 12.11 C ATOM 1049 C ASN A 65 12.725 -1.343 16.772 1.00 43.33 C ATOM 1050 O ASN A 65 13.458 -0.378 16.551 1.00 53.41 O ATOM 1051 CB ASN A 65 11.403 -1.672 18.870 1.00 43.01 C ATOM 1052 CG ASN A 65 12.210 -0.770 19.784 1.00 34.14 C ATOM 1053 OD1 ASN A 65 12.593 0.336 19.403 1.00 11.02 O ATOM 1054 ND2 ASN A 65 12.471 -1.240 20.998 1.00 30.25 N ATOM 0 H ASN A 65 9.912 -2.646 17.157 1.00 41.14 H new ATOM 0 HA ASN A 65 11.126 -0.092 17.438 1.00 12.11 H new ATOM 0 HB2 ASN A 65 10.386 -1.756 19.252 1.00 43.01 H new ATOM 0 HB3 ASN A 65 11.832 -2.674 18.882 1.00 43.01 H new ATOM 0 HD21 ASN A 65 13.009 -0.678 21.658 1.00 30.25 H new ATOM 0 HD22 ASN A 65 12.133 -2.163 21.271 1.00 30.25 H new ATOM 1061 N HIS A 66 13.060 -2.591 16.459 1.00 14.25 N ATOM 1062 CA HIS A 66 14.335 -2.905 15.825 1.00 52.32 C ATOM 1063 C HIS A 66 14.431 -2.255 14.448 1.00 74.25 C ATOM 1064 O HIS A 66 15.496 -1.790 14.042 1.00 71.33 O ATOM 1065 CB HIS A 66 14.508 -4.419 15.701 1.00 52.24 C ATOM 1066 CG HIS A 66 15.939 -4.856 15.654 1.00 24.31 C ATOM 1067 ND1 HIS A 66 16.791 -4.761 16.734 1.00 31.15 N ATOM 1068 CD2 HIS A 66 16.668 -5.396 14.649 1.00 41.30 C ATOM 1069 CE1 HIS A 66 17.982 -5.221 16.395 1.00 31.44 C ATOM 1070 NE2 HIS A 66 17.934 -5.613 15.135 1.00 71.20 N ATOM 0 H HIS A 66 12.466 -3.401 16.634 1.00 14.25 H new ATOM 0 HA HIS A 66 15.133 -2.506 16.452 1.00 52.32 H new ATOM 0 HB2 HIS A 66 14.016 -4.903 16.545 1.00 52.24 H new ATOM 0 HB3 HIS A 66 14.002 -4.762 14.798 1.00 52.24 H new ATOM 0 HD2 HIS A 66 16.319 -5.615 13.651 1.00 41.30 H new ATOM 0 HE1 HIS A 66 18.848 -5.268 17.039 1.00 31.44 H new ATOM 0 HE2 HIS A 66 18.711 -6.012 14.608 1.00 71.20 H new ATOM 1078 N VAL A 67 13.310 -2.227 13.732 1.00 24.44 N ATOM 1079 CA VAL A 67 13.268 -1.635 12.401 1.00 51.21 C ATOM 1080 C VAL A 67 13.524 -0.133 12.459 1.00 24.13 C ATOM 1081 O VAL A 67 14.362 0.394 11.726 1.00 33.44 O ATOM 1082 CB VAL A 67 11.911 -1.887 11.718 1.00 53.54 C ATOM 1083 CG1 VAL A 67 11.874 -1.231 10.345 1.00 32.15 C ATOM 1084 CG2 VAL A 67 11.636 -3.379 11.612 1.00 25.11 C ATOM 0 H VAL A 67 12.420 -2.608 14.052 1.00 24.44 H new ATOM 0 HA VAL A 67 14.055 -2.112 11.817 1.00 51.21 H new ATOM 0 HB VAL A 67 11.128 -1.439 12.330 1.00 53.54 H new ATOM 0 HG11 VAL A 67 10.908 -1.420 9.878 1.00 32.15 H new ATOM 0 HG12 VAL A 67 12.022 -0.156 10.451 1.00 32.15 H new ATOM 0 HG13 VAL A 67 12.666 -1.647 9.722 1.00 32.15 H new ATOM 0 HG21 VAL A 67 10.673 -3.538 11.127 1.00 25.11 H new ATOM 0 HG22 VAL A 67 12.421 -3.853 11.023 1.00 25.11 H new ATOM 0 HG23 VAL A 67 11.616 -3.817 12.610 1.00 25.11 H new ATOM 1094 N VAL A 68 12.798 0.552 13.337 1.00 42.12 N ATOM 1095 CA VAL A 68 12.948 1.994 13.493 1.00 72.02 C ATOM 1096 C VAL A 68 14.366 2.357 13.917 1.00 25.41 C ATOM 1097 O VAL A 68 14.959 3.300 13.394 1.00 13.11 O ATOM 1098 CB VAL A 68 11.955 2.552 14.530 1.00 40.44 C ATOM 1099 CG1 VAL A 68 12.191 4.039 14.748 1.00 12.11 C ATOM 1100 CG2 VAL A 68 10.523 2.290 14.090 1.00 55.31 C ATOM 0 H VAL A 68 12.100 0.132 13.951 1.00 42.12 H new ATOM 0 HA VAL A 68 12.737 2.441 12.521 1.00 72.02 H new ATOM 0 HB VAL A 68 12.119 2.040 15.478 1.00 40.44 H new ATOM 0 HG11 VAL A 68 11.481 4.416 15.484 1.00 12.11 H new ATOM 0 HG12 VAL A 68 13.207 4.197 15.110 1.00 12.11 H new ATOM 0 HG13 VAL A 68 12.055 4.571 13.806 1.00 12.11 H new ATOM 0 HG21 VAL A 68 9.835 2.691 14.834 1.00 55.31 H new ATOM 0 HG22 VAL A 68 10.343 2.775 13.131 1.00 55.31 H new ATOM 0 HG23 VAL A 68 10.364 1.216 13.990 1.00 55.31 H new ATOM 1110 N GLN A 69 14.905 1.600 14.868 1.00 44.21 N ATOM 1111 CA GLN A 69 16.255 1.843 15.363 1.00 64.53 C ATOM 1112 C GLN A 69 17.265 1.825 14.220 1.00 63.20 C ATOM 1113 O GLN A 69 18.222 2.599 14.214 1.00 62.53 O ATOM 1114 CB GLN A 69 16.634 0.793 16.410 1.00 54.44 C ATOM 1115 CG GLN A 69 16.218 1.167 17.823 1.00 2.43 C ATOM 1116 CD GLN A 69 16.369 0.017 18.799 1.00 3.45 C ATOM 1117 OE1 GLN A 69 17.316 -0.765 18.713 1.00 72.42 O ATOM 1118 NE2 GLN A 69 15.435 -0.091 19.737 1.00 54.35 N ATOM 0 H GLN A 69 14.428 0.814 15.310 1.00 44.21 H new ATOM 0 HA GLN A 69 16.273 2.830 15.825 1.00 64.53 H new ATOM 0 HB2 GLN A 69 16.172 -0.157 16.143 1.00 54.44 H new ATOM 0 HB3 GLN A 69 17.713 0.641 16.386 1.00 54.44 H new ATOM 0 HG2 GLN A 69 16.820 2.009 18.164 1.00 2.43 H new ATOM 0 HG3 GLN A 69 15.180 1.499 17.816 1.00 2.43 H new ATOM 0 HE21 GLN A 69 14.667 0.579 19.772 1.00 54.35 H new ATOM 0 HE22 GLN A 69 15.486 -0.844 20.423 1.00 54.35 H new ATOM 1127 N GLN A 70 17.045 0.937 13.256 1.00 70.12 N ATOM 1128 CA GLN A 70 17.937 0.818 12.109 1.00 42.43 C ATOM 1129 C GLN A 70 17.726 1.972 11.134 1.00 45.14 C ATOM 1130 O GLN A 70 18.653 2.387 10.438 1.00 1.14 O ATOM 1131 CB GLN A 70 17.711 -0.516 11.395 1.00 12.43 C ATOM 1132 CG GLN A 70 18.228 -1.716 12.172 1.00 75.12 C ATOM 1133 CD GLN A 70 19.738 -1.719 12.304 1.00 33.35 C ATOM 1134 OE1 GLN A 70 20.277 -1.522 13.394 1.00 61.23 O ATOM 1135 NE2 GLN A 70 20.429 -1.944 11.193 1.00 4.24 N ATOM 0 H GLN A 70 16.257 0.290 13.246 1.00 70.12 H new ATOM 0 HA GLN A 70 18.963 0.857 12.474 1.00 42.43 H new ATOM 0 HB2 GLN A 70 16.644 -0.644 11.211 1.00 12.43 H new ATOM 0 HB3 GLN A 70 18.201 -0.485 10.422 1.00 12.43 H new ATOM 0 HG2 GLN A 70 17.780 -1.721 13.166 1.00 75.12 H new ATOM 0 HG3 GLN A 70 17.909 -2.632 11.674 1.00 75.12 H new ATOM 0 HE21 GLN A 70 19.940 -2.102 10.312 1.00 4.24 H new ATOM 0 HE22 GLN A 70 21.449 -1.959 11.221 1.00 4.24 H new ATOM 1144 N ALA A 71 16.501 2.485 11.088 1.00 5.50 N ATOM 1145 CA ALA A 71 16.170 3.592 10.199 1.00 14.25 C ATOM 1146 C ALA A 71 17.169 4.735 10.349 1.00 74.42 C ATOM 1147 O ALA A 71 17.659 5.278 9.359 1.00 51.13 O ATOM 1148 CB ALA A 71 14.757 4.085 10.475 1.00 74.21 C ATOM 0 H ALA A 71 15.722 2.152 11.656 1.00 5.50 H new ATOM 0 HA ALA A 71 16.224 3.230 9.172 1.00 14.25 H new ATOM 0 HB1 ALA A 71 14.523 4.912 9.804 1.00 74.21 H new ATOM 0 HB2 ALA A 71 14.049 3.272 10.310 1.00 74.21 H new ATOM 0 HB3 ALA A 71 14.685 4.425 11.508 1.00 74.21 H new ATOM 1154 N LYS A 72 17.466 5.095 11.592 1.00 2.44 N ATOM 1155 CA LYS A 72 18.407 6.173 11.873 1.00 44.25 C ATOM 1156 C LYS A 72 19.771 5.879 11.255 1.00 53.21 C ATOM 1157 O LYS A 72 20.435 6.776 10.738 1.00 3.20 O ATOM 1158 CB LYS A 72 18.552 6.372 13.383 1.00 21.00 C ATOM 1159 CG LYS A 72 17.227 6.562 14.101 1.00 22.42 C ATOM 1160 CD LYS A 72 17.432 6.931 15.561 1.00 60.41 C ATOM 1161 CE LYS A 72 18.120 8.280 15.704 1.00 70.35 C ATOM 1162 NZ LYS A 72 17.987 8.827 17.082 1.00 0.10 N ATOM 0 H LYS A 72 17.068 4.656 12.422 1.00 2.44 H new ATOM 0 HA LYS A 72 18.015 7.088 11.429 1.00 44.25 H new ATOM 0 HB2 LYS A 72 19.065 5.509 13.807 1.00 21.00 H new ATOM 0 HB3 LYS A 72 19.184 7.241 13.568 1.00 21.00 H new ATOM 0 HG2 LYS A 72 16.652 7.344 13.605 1.00 22.42 H new ATOM 0 HG3 LYS A 72 16.642 5.645 14.035 1.00 22.42 H new ATOM 0 HD2 LYS A 72 16.468 6.957 16.069 1.00 60.41 H new ATOM 0 HD3 LYS A 72 18.030 6.163 16.051 1.00 60.41 H new ATOM 0 HE2 LYS A 72 19.176 8.177 15.454 1.00 70.35 H new ATOM 0 HE3 LYS A 72 17.691 8.984 14.991 1.00 70.35 H new ATOM 0 HZ1 LYS A 72 18.643 9.625 17.204 1.00 0.10 H new ATOM 0 HZ2 LYS A 72 17.011 9.154 17.233 1.00 0.10 H new ATOM 0 HZ3 LYS A 72 18.214 8.084 17.774 1.00 0.10 H new ATOM 1176 N GLY A 73 20.181 4.616 11.311 1.00 21.33 N ATOM 1177 CA GLY A 73 21.463 4.226 10.752 1.00 14.35 C ATOM 1178 C GLY A 73 21.392 3.976 9.259 1.00 32.42 C ATOM 1179 O GLY A 73 22.404 3.680 8.625 1.00 22.21 O ATOM 0 H GLY A 73 19.649 3.855 11.733 1.00 21.33 H new ATOM 0 HA2 GLY A 73 22.196 5.008 10.952 1.00 14.35 H new ATOM 0 HA3 GLY A 73 21.815 3.324 11.252 1.00 14.35 H new ATOM 1183 N GLN A 74 20.193 4.092 8.697 1.00 1.53 N ATOM 1184 CA GLN A 74 19.995 3.874 7.269 1.00 33.23 C ATOM 1185 C GLN A 74 19.477 5.138 6.592 1.00 52.13 C ATOM 1186 O GLN A 74 18.885 5.080 5.514 1.00 71.13 O ATOM 1187 CB GLN A 74 19.016 2.721 7.040 1.00 64.54 C ATOM 1188 CG GLN A 74 19.483 1.727 5.987 1.00 12.54 C ATOM 1189 CD GLN A 74 20.876 1.197 6.263 1.00 71.24 C ATOM 1190 OE1 GLN A 74 21.763 1.278 5.412 1.00 31.23 O ATOM 1191 NE2 GLN A 74 21.076 0.650 7.456 1.00 63.42 N ATOM 0 H GLN A 74 19.345 4.336 9.208 1.00 1.53 H new ATOM 0 HA GLN A 74 20.958 3.617 6.829 1.00 33.23 H new ATOM 0 HB2 GLN A 74 18.861 2.194 7.982 1.00 64.54 H new ATOM 0 HB3 GLN A 74 18.051 3.129 6.740 1.00 64.54 H new ATOM 0 HG2 GLN A 74 18.783 0.893 5.944 1.00 12.54 H new ATOM 0 HG3 GLN A 74 19.468 2.206 5.008 1.00 12.54 H new ATOM 0 HE21 GLN A 74 20.312 0.604 8.131 1.00 63.42 H new ATOM 0 HE22 GLN A 74 21.993 0.276 7.698 1.00 63.42 H new ATOM 1200 N LYS A 75 19.703 6.281 7.231 1.00 70.12 N ATOM 1201 CA LYS A 75 19.261 7.561 6.690 1.00 35.24 C ATOM 1202 C LYS A 75 17.757 7.552 6.432 1.00 22.03 C ATOM 1203 O LYS A 75 17.304 7.897 5.341 1.00 74.44 O ATOM 1204 CB LYS A 75 20.009 7.877 5.394 1.00 65.43 C ATOM 1205 CG LYS A 75 21.435 8.351 5.615 1.00 41.40 C ATOM 1206 CD LYS A 75 22.406 7.185 5.689 1.00 1.05 C ATOM 1207 CE LYS A 75 23.848 7.652 5.564 1.00 64.51 C ATOM 1208 NZ LYS A 75 24.743 6.563 5.082 1.00 4.22 N ATOM 0 H LYS A 75 20.190 6.347 8.125 1.00 70.12 H new ATOM 0 HA LYS A 75 19.482 8.334 7.427 1.00 35.24 H new ATOM 0 HB2 LYS A 75 20.024 6.986 4.767 1.00 65.43 H new ATOM 0 HB3 LYS A 75 19.461 8.643 4.846 1.00 65.43 H new ATOM 0 HG2 LYS A 75 21.727 9.018 4.804 1.00 41.40 H new ATOM 0 HG3 LYS A 75 21.488 8.929 6.538 1.00 41.40 H new ATOM 0 HD2 LYS A 75 22.273 6.659 6.635 1.00 1.05 H new ATOM 0 HD3 LYS A 75 22.183 6.473 4.894 1.00 1.05 H new ATOM 0 HE2 LYS A 75 23.898 8.495 4.875 1.00 64.51 H new ATOM 0 HE3 LYS A 75 24.199 8.009 6.532 1.00 64.51 H new ATOM 0 HZ1 LYS A 75 25.717 6.920 5.010 1.00 4.22 H new ATOM 0 HZ2 LYS A 75 24.715 5.768 5.752 1.00 4.22 H new ATOM 0 HZ3 LYS A 75 24.423 6.239 4.147 1.00 4.22 H new ATOM 1222 N ILE A 76 16.990 7.158 7.443 1.00 23.42 N ATOM 1223 CA ILE A 76 15.538 7.107 7.325 1.00 3.14 C ATOM 1224 C ILE A 76 14.866 7.739 8.539 1.00 10.33 C ATOM 1225 O ILE A 76 15.143 7.366 9.679 1.00 20.45 O ATOM 1226 CB ILE A 76 15.036 5.659 7.170 1.00 1.52 C ATOM 1227 CG1 ILE A 76 15.995 4.855 6.290 1.00 4.33 C ATOM 1228 CG2 ILE A 76 13.633 5.646 6.583 1.00 34.23 C ATOM 1229 CD1 ILE A 76 15.533 3.439 6.030 1.00 21.33 C ATOM 0 H ILE A 76 17.350 6.870 8.353 1.00 23.42 H new ATOM 0 HA ILE A 76 15.274 7.672 6.431 1.00 3.14 H new ATOM 0 HB ILE A 76 15.001 5.194 8.155 1.00 1.52 H new ATOM 0 HG12 ILE A 76 16.118 5.369 5.337 1.00 4.33 H new ATOM 0 HG13 ILE A 76 16.975 4.827 6.766 1.00 4.33 H new ATOM 0 HG21 ILE A 76 13.292 4.616 6.479 1.00 34.23 H new ATOM 0 HG22 ILE A 76 12.957 6.188 7.244 1.00 34.23 H new ATOM 0 HG23 ILE A 76 13.644 6.125 5.604 1.00 34.23 H new ATOM 0 HD11 ILE A 76 16.261 2.929 5.400 1.00 21.33 H new ATOM 0 HD12 ILE A 76 15.437 2.908 6.977 1.00 21.33 H new ATOM 0 HD13 ILE A 76 14.567 3.458 5.526 1.00 21.33 H new ATOM 1241 N ILE A 77 13.980 8.697 8.286 1.00 24.04 N ATOM 1242 CA ILE A 77 13.266 9.379 9.359 1.00 61.25 C ATOM 1243 C ILE A 77 11.761 9.165 9.239 1.00 20.11 C ATOM 1244 O ILE A 77 11.010 9.440 10.174 1.00 14.40 O ATOM 1245 CB ILE A 77 13.560 10.891 9.358 1.00 21.43 C ATOM 1246 CG1 ILE A 77 15.069 11.139 9.300 1.00 73.10 C ATOM 1247 CG2 ILE A 77 12.957 11.548 10.591 1.00 71.41 C ATOM 1248 CD1 ILE A 77 15.822 10.565 10.480 1.00 54.22 C ATOM 0 H ILE A 77 13.740 9.018 7.348 1.00 24.04 H new ATOM 0 HA ILE A 77 13.618 8.949 10.297 1.00 61.25 H new ATOM 0 HB ILE A 77 13.103 11.335 8.473 1.00 21.43 H new ATOM 0 HG12 ILE A 77 15.465 10.706 8.381 1.00 73.10 H new ATOM 0 HG13 ILE A 77 15.251 12.213 9.251 1.00 73.10 H new ATOM 0 HG21 ILE A 77 13.173 12.616 10.576 1.00 71.41 H new ATOM 0 HG22 ILE A 77 11.878 11.396 10.593 1.00 71.41 H new ATOM 0 HG23 ILE A 77 13.388 11.103 11.488 1.00 71.41 H new ATOM 0 HD11 ILE A 77 16.885 10.779 10.372 1.00 54.22 H new ATOM 0 HD12 ILE A 77 15.453 11.016 11.401 1.00 54.22 H new ATOM 0 HD13 ILE A 77 15.671 9.486 10.518 1.00 54.22 H new ATOM 1260 N GLN A 78 11.329 8.671 8.084 1.00 71.45 N ATOM 1261 CA GLN A 78 9.913 8.419 7.843 1.00 61.52 C ATOM 1262 C GLN A 78 9.399 7.300 8.742 1.00 33.44 C ATOM 1263 O GLN A 78 8.255 7.330 9.196 1.00 13.44 O ATOM 1264 CB GLN A 78 9.680 8.057 6.375 1.00 63.41 C ATOM 1265 CG GLN A 78 9.851 9.230 5.424 1.00 1.53 C ATOM 1266 CD GLN A 78 11.296 9.671 5.295 1.00 72.04 C ATOM 1267 OE1 GLN A 78 11.614 10.849 5.456 1.00 45.54 O ATOM 1268 NE2 GLN A 78 12.180 8.724 5.002 1.00 12.12 N ATOM 0 H GLN A 78 11.939 8.437 7.300 1.00 71.45 H new ATOM 0 HA GLN A 78 9.363 9.330 8.077 1.00 61.52 H new ATOM 0 HB2 GLN A 78 10.373 7.265 6.090 1.00 63.41 H new ATOM 0 HB3 GLN A 78 8.673 7.654 6.264 1.00 63.41 H new ATOM 0 HG2 GLN A 78 9.470 8.954 4.441 1.00 1.53 H new ATOM 0 HG3 GLN A 78 9.249 10.068 5.775 1.00 1.53 H new ATOM 0 HE21 GLN A 78 11.872 7.760 4.877 1.00 12.12 H new ATOM 0 HE22 GLN A 78 13.167 8.961 4.902 1.00 12.12 H new ATOM 1277 N PHE A 79 10.251 6.312 8.996 1.00 31.00 N ATOM 1278 CA PHE A 79 9.882 5.182 9.841 1.00 70.14 C ATOM 1279 C PHE A 79 9.690 5.625 11.288 1.00 31.42 C ATOM 1280 O PHE A 79 8.779 5.161 11.974 1.00 70.05 O ATOM 1281 CB PHE A 79 10.953 4.092 9.767 1.00 60.32 C ATOM 1282 CG PHE A 79 10.579 2.943 8.874 1.00 12.21 C ATOM 1283 CD1 PHE A 79 9.379 2.273 9.051 1.00 11.34 C ATOM 1284 CD2 PHE A 79 11.426 2.534 7.858 1.00 65.35 C ATOM 1285 CE1 PHE A 79 9.033 1.216 8.232 1.00 74.41 C ATOM 1286 CE2 PHE A 79 11.085 1.477 7.035 1.00 63.15 C ATOM 1287 CZ PHE A 79 9.886 0.818 7.221 1.00 22.25 C ATOM 0 H PHE A 79 11.202 6.271 8.629 1.00 31.00 H new ATOM 0 HA PHE A 79 8.938 4.779 9.475 1.00 70.14 H new ATOM 0 HB2 PHE A 79 11.884 4.532 9.409 1.00 60.32 H new ATOM 0 HB3 PHE A 79 11.145 3.714 10.771 1.00 60.32 H new ATOM 0 HD1 PHE A 79 8.707 2.581 9.838 1.00 11.34 H new ATOM 0 HD2 PHE A 79 12.364 3.047 7.707 1.00 65.35 H new ATOM 0 HE1 PHE A 79 8.096 0.701 8.382 1.00 74.41 H new ATOM 0 HE2 PHE A 79 11.756 1.167 6.247 1.00 63.15 H new ATOM 0 HZ PHE A 79 9.616 -0.006 6.578 1.00 22.25 H new ATOM 1297 N GLN A 80 10.555 6.524 11.745 1.00 22.14 N ATOM 1298 CA GLN A 80 10.482 7.028 13.112 1.00 53.35 C ATOM 1299 C GLN A 80 9.203 7.830 13.328 1.00 54.34 C ATOM 1300 O GLN A 80 8.526 7.677 14.345 1.00 63.42 O ATOM 1301 CB GLN A 80 11.701 7.897 13.423 1.00 4.40 C ATOM 1302 CG GLN A 80 13.014 7.297 12.946 1.00 20.24 C ATOM 1303 CD GLN A 80 14.222 8.063 13.447 1.00 43.51 C ATOM 1304 OE1 GLN A 80 14.850 8.813 12.698 1.00 12.34 O ATOM 1305 NE2 GLN A 80 14.555 7.879 14.719 1.00 3.31 N ATOM 0 H GLN A 80 11.314 6.918 11.190 1.00 22.14 H new ATOM 0 HA GLN A 80 10.472 6.173 13.788 1.00 53.35 H new ATOM 0 HB2 GLN A 80 11.568 8.874 12.959 1.00 4.40 H new ATOM 0 HB3 GLN A 80 11.755 8.060 14.499 1.00 4.40 H new ATOM 0 HG2 GLN A 80 13.080 6.262 13.282 1.00 20.24 H new ATOM 0 HG3 GLN A 80 13.026 7.279 11.856 1.00 20.24 H new ATOM 0 HE21 GLN A 80 14.007 7.248 15.304 1.00 3.31 H new ATOM 0 HE22 GLN A 80 15.359 8.368 15.112 1.00 3.31 H new ATOM 1314 N ASP A 81 8.877 8.686 12.365 1.00 21.01 N ATOM 1315 CA ASP A 81 7.678 9.512 12.450 1.00 44.13 C ATOM 1316 C ASP A 81 6.426 8.680 12.191 1.00 11.51 C ATOM 1317 O ASP A 81 5.361 8.955 12.745 1.00 63.22 O ATOM 1318 CB ASP A 81 7.756 10.665 11.448 1.00 51.04 C ATOM 1319 CG ASP A 81 6.952 11.872 11.890 1.00 30.21 C ATOM 1320 OD1 ASP A 81 6.841 12.094 13.114 1.00 74.33 O ATOM 1321 OD2 ASP A 81 6.433 12.594 11.013 1.00 63.23 O ATOM 0 H ASP A 81 9.426 8.826 11.517 1.00 21.01 H new ATOM 0 HA ASP A 81 7.618 9.921 13.459 1.00 44.13 H new ATOM 0 HB2 ASP A 81 8.798 10.956 11.313 1.00 51.04 H new ATOM 0 HB3 ASP A 81 7.392 10.325 10.478 1.00 51.04 H new ATOM 1326 N SER A 82 6.561 7.664 11.346 1.00 71.25 N ATOM 1327 CA SER A 82 5.439 6.795 11.010 1.00 60.05 C ATOM 1328 C SER A 82 5.087 5.884 12.182 1.00 50.40 C ATOM 1329 O SER A 82 3.938 5.834 12.621 1.00 53.32 O ATOM 1330 CB SER A 82 5.771 5.952 9.776 1.00 13.44 C ATOM 1331 OG SER A 82 5.749 6.741 8.599 1.00 34.31 O ATOM 0 H SER A 82 7.436 7.422 10.881 1.00 71.25 H new ATOM 0 HA SER A 82 4.577 7.425 10.790 1.00 60.05 H new ATOM 0 HB2 SER A 82 6.755 5.499 9.895 1.00 13.44 H new ATOM 0 HB3 SER A 82 5.053 5.137 9.685 1.00 13.44 H new ATOM 0 HG SER A 82 6.626 7.159 8.469 1.00 34.31 H new ATOM 1337 N PHE A 83 6.085 5.165 12.685 1.00 50.40 N ATOM 1338 CA PHE A 83 5.882 4.255 13.806 1.00 1.10 C ATOM 1339 C PHE A 83 5.796 5.023 15.122 1.00 51.34 C ATOM 1340 O PHE A 83 5.267 4.521 16.113 1.00 44.42 O ATOM 1341 CB PHE A 83 7.019 3.233 13.873 1.00 51.22 C ATOM 1342 CG PHE A 83 6.801 2.035 12.993 1.00 15.33 C ATOM 1343 CD1 PHE A 83 5.631 1.298 13.082 1.00 14.22 C ATOM 1344 CD2 PHE A 83 7.765 1.647 12.077 1.00 33.23 C ATOM 1345 CE1 PHE A 83 5.428 0.195 12.275 1.00 53.14 C ATOM 1346 CE2 PHE A 83 7.567 0.545 11.267 1.00 61.23 C ATOM 1347 CZ PHE A 83 6.396 -0.181 11.365 1.00 65.31 C ATOM 0 H PHE A 83 7.042 5.195 12.334 1.00 50.40 H new ATOM 0 HA PHE A 83 4.939 3.731 13.649 1.00 1.10 H new ATOM 0 HB2 PHE A 83 7.951 3.719 13.586 1.00 51.22 H new ATOM 0 HB3 PHE A 83 7.137 2.900 14.904 1.00 51.22 H new ATOM 0 HD1 PHE A 83 4.869 1.589 13.790 1.00 14.22 H new ATOM 0 HD2 PHE A 83 8.682 2.212 11.995 1.00 33.23 H new ATOM 0 HE1 PHE A 83 4.513 -0.373 12.356 1.00 53.14 H new ATOM 0 HE2 PHE A 83 8.327 0.252 10.558 1.00 61.23 H new ATOM 0 HZ PHE A 83 6.238 -1.041 10.731 1.00 65.31 H new ATOM 1357 N GLY A 84 6.320 6.245 15.122 1.00 4.23 N ATOM 1358 CA GLY A 84 6.294 7.063 16.321 1.00 55.34 C ATOM 1359 C GLY A 84 4.915 7.623 16.609 1.00 11.45 C ATOM 1360 O GLY A 84 4.481 7.664 17.761 1.00 24.21 O ATOM 0 H GLY A 84 6.762 6.683 14.314 1.00 4.23 H new ATOM 0 HA2 GLY A 84 6.626 6.467 17.171 1.00 55.34 H new ATOM 0 HA3 GLY A 84 7.001 7.885 16.212 1.00 55.34 H new ATOM 1364 N LYS A 85 4.224 8.059 15.562 1.00 75.23 N ATOM 1365 CA LYS A 85 2.886 8.620 15.707 1.00 52.31 C ATOM 1366 C LYS A 85 1.885 7.543 16.111 1.00 15.05 C ATOM 1367 O LYS A 85 0.805 7.844 16.621 1.00 1.50 O ATOM 1368 CB LYS A 85 2.442 9.279 14.399 1.00 71.33 C ATOM 1369 CG LYS A 85 2.053 8.284 13.319 1.00 42.15 C ATOM 1370 CD LYS A 85 0.544 8.160 13.192 1.00 21.40 C ATOM 1371 CE LYS A 85 -0.071 9.419 12.601 1.00 74.42 C ATOM 1372 NZ LYS A 85 -0.048 9.401 11.112 1.00 75.31 N ATOM 0 H LYS A 85 4.569 8.035 14.602 1.00 75.23 H new ATOM 0 HA LYS A 85 2.919 9.374 16.494 1.00 52.31 H new ATOM 0 HB2 LYS A 85 1.594 9.933 14.601 1.00 71.33 H new ATOM 0 HB3 LYS A 85 3.250 9.909 14.027 1.00 71.33 H new ATOM 0 HG2 LYS A 85 2.475 8.599 12.364 1.00 42.15 H new ATOM 0 HG3 LYS A 85 2.481 7.309 13.551 1.00 42.15 H new ATOM 0 HD2 LYS A 85 0.300 7.304 12.562 1.00 21.40 H new ATOM 0 HD3 LYS A 85 0.110 7.968 14.173 1.00 21.40 H new ATOM 0 HE2 LYS A 85 -1.100 9.518 12.947 1.00 74.42 H new ATOM 0 HE3 LYS A 85 0.472 10.292 12.962 1.00 74.42 H new ATOM 0 HZ1 LYS A 85 -0.476 10.276 10.748 1.00 75.31 H new ATOM 0 HZ2 LYS A 85 0.935 9.332 10.781 1.00 75.31 H new ATOM 0 HZ3 LYS A 85 -0.588 8.582 10.766 1.00 75.31 H new ATOM 1386 N VAL A 86 2.250 6.286 15.883 1.00 61.35 N ATOM 1387 CA VAL A 86 1.385 5.163 16.226 1.00 52.43 C ATOM 1388 C VAL A 86 1.945 4.379 17.407 1.00 14.10 C ATOM 1389 O VAL A 86 1.305 3.457 17.912 1.00 13.54 O ATOM 1390 CB VAL A 86 1.202 4.209 15.030 1.00 4.43 C ATOM 1391 CG1 VAL A 86 0.619 4.952 13.838 1.00 1.41 C ATOM 1392 CG2 VAL A 86 2.526 3.554 14.665 1.00 11.32 C ATOM 0 H VAL A 86 3.140 6.019 15.462 1.00 61.35 H new ATOM 0 HA VAL A 86 0.416 5.581 16.498 1.00 52.43 H new ATOM 0 HB VAL A 86 0.501 3.425 15.316 1.00 4.43 H new ATOM 0 HG11 VAL A 86 0.497 4.262 13.003 1.00 1.41 H new ATOM 0 HG12 VAL A 86 -0.351 5.369 14.108 1.00 1.41 H new ATOM 0 HG13 VAL A 86 1.292 5.758 13.547 1.00 1.41 H new ATOM 0 HG21 VAL A 86 2.379 2.883 13.818 1.00 11.32 H new ATOM 0 HG22 VAL A 86 3.251 4.323 14.397 1.00 11.32 H new ATOM 0 HG23 VAL A 86 2.898 2.986 15.518 1.00 11.32 H new ATOM 1402 N ALA A 87 3.144 4.752 17.843 1.00 74.32 N ATOM 1403 CA ALA A 87 3.789 4.085 18.967 1.00 61.12 C ATOM 1404 C ALA A 87 3.123 4.463 20.286 1.00 44.25 C ATOM 1405 O ALA A 87 2.752 3.596 21.075 1.00 32.33 O ATOM 1406 CB ALA A 87 5.271 4.428 19.004 1.00 51.12 C ATOM 0 H ALA A 87 3.688 5.512 17.435 1.00 74.32 H new ATOM 0 HA ALA A 87 3.679 3.009 18.831 1.00 61.12 H new ATOM 0 HB1 ALA A 87 5.740 3.923 19.848 1.00 51.12 H new ATOM 0 HB2 ALA A 87 5.743 4.101 18.078 1.00 51.12 H new ATOM 0 HB3 ALA A 87 5.392 5.506 19.113 1.00 51.12 H new ATOM 1412 N ALA A 88 2.977 5.764 20.517 1.00 34.43 N ATOM 1413 CA ALA A 88 2.354 6.256 21.740 1.00 45.20 C ATOM 1414 C ALA A 88 0.933 5.723 21.886 1.00 25.33 C ATOM 1415 O ALA A 88 0.446 5.528 22.999 1.00 11.22 O ATOM 1416 CB ALA A 88 2.353 7.778 21.756 1.00 64.44 C ATOM 0 H ALA A 88 3.281 6.495 19.874 1.00 34.43 H new ATOM 0 HA ALA A 88 2.938 5.894 22.586 1.00 45.20 H new ATOM 0 HB1 ALA A 88 1.885 8.132 22.675 1.00 64.44 H new ATOM 0 HB2 ALA A 88 3.379 8.143 21.707 1.00 64.44 H new ATOM 0 HB3 ALA A 88 1.794 8.151 20.897 1.00 64.44 H new ATOM 1422 N GLU A 89 0.275 5.489 20.756 1.00 75.14 N ATOM 1423 CA GLU A 89 -1.092 4.979 20.760 1.00 43.32 C ATOM 1424 C GLU A 89 -1.112 3.480 21.041 1.00 70.50 C ATOM 1425 O GLU A 89 -1.743 3.024 21.995 1.00 23.10 O ATOM 1426 CB GLU A 89 -1.771 5.267 19.419 1.00 12.35 C ATOM 1427 CG GLU A 89 -3.289 5.248 19.490 1.00 41.11 C ATOM 1428 CD GLU A 89 -3.863 6.533 20.055 1.00 21.10 C ATOM 1429 OE1 GLU A 89 -3.078 7.363 20.559 1.00 41.03 O ATOM 1430 OE2 GLU A 89 -5.098 6.708 19.993 1.00 70.30 O ATOM 0 H GLU A 89 0.665 5.644 19.826 1.00 75.14 H new ATOM 0 HA GLU A 89 -1.640 5.487 21.553 1.00 43.32 H new ATOM 0 HB2 GLU A 89 -1.445 6.242 19.058 1.00 12.35 H new ATOM 0 HB3 GLU A 89 -1.440 4.529 18.688 1.00 12.35 H new ATOM 0 HG2 GLU A 89 -3.694 5.082 18.492 1.00 41.11 H new ATOM 0 HG3 GLU A 89 -3.610 4.409 20.107 1.00 41.11 H new ATOM 1437 N VAL A 90 -0.418 2.717 20.203 1.00 64.35 N ATOM 1438 CA VAL A 90 -0.355 1.269 20.360 1.00 62.40 C ATOM 1439 C VAL A 90 0.228 0.888 21.716 1.00 3.12 C ATOM 1440 O VAL A 90 -0.392 0.156 22.488 1.00 74.41 O ATOM 1441 CB VAL A 90 0.492 0.619 19.249 1.00 12.50 C ATOM 1442 CG1 VAL A 90 0.603 -0.881 19.470 1.00 21.33 C ATOM 1443 CG2 VAL A 90 -0.102 0.923 17.882 1.00 63.44 C ATOM 0 H VAL A 90 0.109 3.078 19.408 1.00 64.35 H new ATOM 0 HA VAL A 90 -1.378 0.899 20.290 1.00 62.40 H new ATOM 0 HB VAL A 90 1.496 1.042 19.286 1.00 12.50 H new ATOM 0 HG11 VAL A 90 1.205 -1.322 18.675 1.00 21.33 H new ATOM 0 HG12 VAL A 90 1.076 -1.073 20.433 1.00 21.33 H new ATOM 0 HG13 VAL A 90 -0.392 -1.325 19.460 1.00 21.33 H new ATOM 0 HG21 VAL A 90 0.508 0.457 17.108 1.00 63.44 H new ATOM 0 HG22 VAL A 90 -1.117 0.529 17.830 1.00 63.44 H new ATOM 0 HG23 VAL A 90 -0.123 2.002 17.726 1.00 63.44 H new ATOM 1453 N LEU A 91 1.425 1.390 22.001 1.00 14.34 N ATOM 1454 CA LEU A 91 2.093 1.104 23.266 1.00 31.21 C ATOM 1455 C LEU A 91 1.165 1.375 24.446 1.00 2.40 C ATOM 1456 O LEU A 91 1.032 0.548 25.347 1.00 13.51 O ATOM 1457 CB LEU A 91 3.363 1.946 23.397 1.00 51.42 C ATOM 1458 CG LEU A 91 4.484 1.628 22.407 1.00 42.30 C ATOM 1459 CD1 LEU A 91 5.337 2.862 22.152 1.00 73.42 C ATOM 1460 CD2 LEU A 91 5.342 0.482 22.923 1.00 10.21 C ATOM 0 H LEU A 91 1.952 1.997 21.373 1.00 14.34 H new ATOM 0 HA LEU A 91 2.362 0.048 23.275 1.00 31.21 H new ATOM 0 HB2 LEU A 91 3.092 2.996 23.284 1.00 51.42 H new ATOM 0 HB3 LEU A 91 3.753 1.825 24.408 1.00 51.42 H new ATOM 0 HG LEU A 91 4.033 1.322 21.463 1.00 42.30 H new ATOM 0 HD11 LEU A 91 6.130 2.617 21.445 1.00 73.42 H new ATOM 0 HD12 LEU A 91 4.715 3.655 21.738 1.00 73.42 H new ATOM 0 HD13 LEU A 91 5.779 3.199 23.090 1.00 73.42 H new ATOM 0 HD21 LEU A 91 6.135 0.269 22.206 1.00 10.21 H new ATOM 0 HD22 LEU A 91 5.784 0.760 23.880 1.00 10.21 H new ATOM 0 HD23 LEU A 91 4.723 -0.406 23.054 1.00 10.21 H new ATOM 1472 N GLY A 92 0.524 2.540 24.432 1.00 11.24 N ATOM 1473 CA GLY A 92 -0.385 2.899 25.505 1.00 0.23 C ATOM 1474 C GLY A 92 -1.559 1.947 25.613 1.00 33.23 C ATOM 1475 O GLY A 92 -2.115 1.756 26.695 1.00 24.33 O ATOM 0 H GLY A 92 0.618 3.241 23.697 1.00 11.24 H new ATOM 0 HA2 GLY A 92 0.159 2.909 26.450 1.00 0.23 H new ATOM 0 HA3 GLY A 92 -0.756 3.911 25.340 1.00 0.23 H new ATOM 1479 N ARG A 93 -1.940 1.349 24.489 1.00 42.11 N ATOM 1480 CA ARG A 93 -3.058 0.414 24.461 1.00 22.24 C ATOM 1481 C ARG A 93 -2.626 -0.965 24.953 1.00 42.41 C ATOM 1482 O ARG A 93 -3.241 -1.533 25.855 1.00 21.53 O ATOM 1483 CB ARG A 93 -3.626 0.307 23.045 1.00 33.02 C ATOM 1484 CG ARG A 93 -4.738 1.303 22.758 1.00 4.42 C ATOM 1485 CD ARG A 93 -5.974 1.015 23.595 1.00 11.12 C ATOM 1486 NE ARG A 93 -7.191 1.520 22.965 1.00 33.42 N ATOM 1487 CZ ARG A 93 -8.334 1.703 23.617 1.00 73.34 C ATOM 1488 NH1 ARG A 93 -8.416 1.424 24.910 1.00 2.54 N ATOM 1489 NH2 ARG A 93 -9.399 2.165 22.974 1.00 41.51 N ATOM 0 H ARG A 93 -1.490 1.496 23.585 1.00 42.11 H new ATOM 0 HA ARG A 93 -3.832 0.793 25.128 1.00 22.24 H new ATOM 0 HB2 ARG A 93 -2.820 0.458 22.327 1.00 33.02 H new ATOM 0 HB3 ARG A 93 -4.005 -0.703 22.890 1.00 33.02 H new ATOM 0 HG2 ARG A 93 -4.385 2.313 22.964 1.00 4.42 H new ATOM 0 HG3 ARG A 93 -4.997 1.266 21.700 1.00 4.42 H new ATOM 0 HD2 ARG A 93 -6.065 -0.060 23.749 1.00 11.12 H new ATOM 0 HD3 ARG A 93 -5.860 1.470 24.579 1.00 11.12 H new ATOM 0 HE ARG A 93 -7.162 1.744 21.970 1.00 33.42 H new ATOM 0 HH11 ARG A 93 -7.600 1.068 25.408 1.00 2.54 H new ATOM 0 HH12 ARG A 93 -9.295 1.566 25.408 1.00 2.54 H new ATOM 0 HH21 ARG A 93 -9.340 2.380 21.979 1.00 41.51 H new ATOM 0 HH22 ARG A 93 -10.276 2.305 23.475 1.00 41.51 H new ATOM 1503 N ILE A 94 -1.566 -1.495 24.353 1.00 25.31 N ATOM 1504 CA ILE A 94 -1.052 -2.806 24.730 1.00 24.13 C ATOM 1505 C ILE A 94 -0.511 -2.795 26.156 1.00 65.00 C ATOM 1506 O ILE A 94 -0.504 -3.820 26.836 1.00 21.10 O ATOM 1507 CB ILE A 94 0.063 -3.270 23.774 1.00 73.51 C ATOM 1508 CG1 ILE A 94 1.269 -2.334 23.869 1.00 62.22 C ATOM 1509 CG2 ILE A 94 -0.457 -3.331 22.345 1.00 4.12 C ATOM 1510 CD1 ILE A 94 2.419 -2.738 22.973 1.00 42.10 C ATOM 0 H ILE A 94 -1.046 -1.037 23.604 1.00 25.31 H new ATOM 0 HA ILE A 94 -1.888 -3.503 24.666 1.00 24.13 H new ATOM 0 HB ILE A 94 0.381 -4.271 24.068 1.00 73.51 H new ATOM 0 HG12 ILE A 94 0.955 -1.323 23.610 1.00 62.22 H new ATOM 0 HG13 ILE A 94 1.616 -2.306 24.902 1.00 62.22 H new ATOM 0 HG21 ILE A 94 0.342 -3.660 21.681 1.00 4.12 H new ATOM 0 HG22 ILE A 94 -1.288 -4.034 22.290 1.00 4.12 H new ATOM 0 HG23 ILE A 94 -0.798 -2.342 22.039 1.00 4.12 H new ATOM 0 HD11 ILE A 94 3.239 -2.030 23.092 1.00 42.10 H new ATOM 0 HD12 ILE A 94 2.759 -3.737 23.246 1.00 42.10 H new ATOM 0 HD13 ILE A 94 2.088 -2.739 21.934 1.00 42.10 H new ATOM 1522 N ASN A 95 -0.059 -1.628 26.603 1.00 41.54 N ATOM 1523 CA ASN A 95 0.483 -1.482 27.949 1.00 62.13 C ATOM 1524 C ASN A 95 -0.555 -1.868 28.998 1.00 51.31 C ATOM 1525 O ASN A 95 -0.217 -2.411 30.049 1.00 4.42 O ATOM 1526 CB ASN A 95 0.949 -0.043 28.181 1.00 61.34 C ATOM 1527 CG ASN A 95 1.449 0.182 29.595 1.00 75.13 C ATOM 1528 OD1 ASN A 95 2.533 -0.272 29.962 1.00 55.14 O ATOM 1529 ND2 ASN A 95 0.658 0.886 30.396 1.00 35.54 N ATOM 0 H ASN A 95 -0.057 -0.769 26.053 1.00 41.54 H new ATOM 0 HA ASN A 95 1.337 -2.153 28.045 1.00 62.13 H new ATOM 0 HB2 ASN A 95 1.744 0.197 27.475 1.00 61.34 H new ATOM 0 HB3 ASN A 95 0.125 0.640 27.977 1.00 61.34 H new ATOM 0 HD21 ASN A 95 0.941 1.070 31.359 1.00 35.54 H new ATOM 0 HD22 ASN A 95 -0.232 1.243 30.049 1.00 35.54 H new ATOM 1536 N GLN A 96 -1.820 -1.584 28.703 1.00 4.44 N ATOM 1537 CA GLN A 96 -2.907 -1.901 29.622 1.00 51.34 C ATOM 1538 C GLN A 96 -3.373 -3.341 29.437 1.00 63.21 C ATOM 1539 O GLN A 96 -3.639 -4.046 30.410 1.00 63.34 O ATOM 1540 CB GLN A 96 -4.079 -0.942 29.408 1.00 55.25 C ATOM 1541 CG GLN A 96 -3.675 0.524 29.411 1.00 33.41 C ATOM 1542 CD GLN A 96 -4.806 1.442 28.990 1.00 64.24 C ATOM 1543 OE1 GLN A 96 -5.831 1.534 29.666 1.00 44.33 O ATOM 1544 NE2 GLN A 96 -4.624 2.127 27.867 1.00 55.32 N ATOM 0 H GLN A 96 -2.117 -1.136 27.836 1.00 4.44 H new ATOM 0 HA GLN A 96 -2.534 -1.787 30.640 1.00 51.34 H new ATOM 0 HB2 GLN A 96 -4.560 -1.176 28.458 1.00 55.25 H new ATOM 0 HB3 GLN A 96 -4.820 -1.107 30.190 1.00 55.25 H new ATOM 0 HG2 GLN A 96 -3.339 0.802 30.410 1.00 33.41 H new ATOM 0 HG3 GLN A 96 -2.828 0.665 28.739 1.00 33.41 H new ATOM 0 HE21 GLN A 96 -3.758 2.019 27.339 1.00 55.32 H new ATOM 0 HE22 GLN A 96 -5.350 2.761 27.533 1.00 55.32 H new ATOM 1553 N GLU A 97 -3.469 -3.771 28.183 1.00 51.35 N ATOM 1554 CA GLU A 97 -3.904 -5.127 27.872 1.00 72.34 C ATOM 1555 C GLU A 97 -2.839 -6.145 28.269 1.00 3.11 C ATOM 1556 O GLU A 97 -3.110 -7.343 28.356 1.00 0.32 O ATOM 1557 CB GLU A 97 -4.217 -5.257 26.380 1.00 54.14 C ATOM 1558 CG GLU A 97 -5.482 -4.527 25.957 1.00 24.24 C ATOM 1559 CD GLU A 97 -6.731 -5.364 26.153 1.00 50.11 C ATOM 1560 OE1 GLU A 97 -6.823 -6.445 25.535 1.00 63.33 O ATOM 1561 OE2 GLU A 97 -7.617 -4.938 26.923 1.00 3.21 O ATOM 0 H GLU A 97 -3.251 -3.200 27.366 1.00 51.35 H new ATOM 0 HA GLU A 97 -4.809 -5.331 28.445 1.00 72.34 H new ATOM 0 HB2 GLU A 97 -3.375 -4.870 25.806 1.00 54.14 H new ATOM 0 HB3 GLU A 97 -4.316 -6.313 26.129 1.00 54.14 H new ATOM 0 HG2 GLU A 97 -5.574 -3.604 26.530 1.00 24.24 H new ATOM 0 HG3 GLU A 97 -5.400 -4.244 24.908 1.00 24.24 H new ATOM 1568 N PHE A 98 -1.625 -5.659 28.508 1.00 31.24 N ATOM 1569 CA PHE A 98 -0.517 -6.525 28.895 1.00 35.30 C ATOM 1570 C PHE A 98 -0.539 -6.798 30.396 1.00 23.12 C ATOM 1571 O PHE A 98 -0.899 -5.941 31.203 1.00 24.15 O ATOM 1572 CB PHE A 98 0.817 -5.890 28.500 1.00 51.44 C ATOM 1573 CG PHE A 98 1.242 -6.212 27.096 1.00 70.44 C ATOM 1574 CD1 PHE A 98 0.299 -6.494 26.120 1.00 44.12 C ATOM 1575 CD2 PHE A 98 2.584 -6.234 26.751 1.00 11.35 C ATOM 1576 CE1 PHE A 98 0.688 -6.792 24.827 1.00 10.04 C ATOM 1577 CE2 PHE A 98 2.978 -6.531 25.460 1.00 5.45 C ATOM 1578 CZ PHE A 98 2.029 -6.809 24.497 1.00 70.10 C ATOM 0 H PHE A 98 -1.384 -4.670 28.440 1.00 31.24 H new ATOM 0 HA PHE A 98 -0.629 -7.473 28.369 1.00 35.30 H new ATOM 0 HB2 PHE A 98 0.742 -4.808 28.609 1.00 51.44 H new ATOM 0 HB3 PHE A 98 1.589 -6.227 29.191 1.00 51.44 H new ATOM 0 HD1 PHE A 98 -0.751 -6.481 26.372 1.00 44.12 H new ATOM 0 HD2 PHE A 98 3.331 -6.016 27.500 1.00 11.35 H new ATOM 0 HE1 PHE A 98 -0.056 -7.011 24.076 1.00 10.04 H new ATOM 0 HE2 PHE A 98 4.027 -6.546 25.205 1.00 5.45 H new ATOM 0 HZ PHE A 98 2.335 -7.039 23.487 1.00 70.10 H new ATOM 1588 N PRO A 99 -0.144 -8.021 30.780 1.00 34.24 N ATOM 1589 CA PRO A 99 -0.109 -8.436 32.186 1.00 61.42 C ATOM 1590 C PRO A 99 0.989 -7.728 32.972 1.00 62.41 C ATOM 1591 O PRO A 99 1.855 -7.072 32.393 1.00 23.22 O ATOM 1592 CB PRO A 99 0.175 -9.938 32.105 1.00 71.41 C ATOM 1593 CG PRO A 99 0.877 -10.122 30.804 1.00 53.23 C ATOM 1594 CD PRO A 99 0.298 -9.093 29.872 1.00 12.24 C ATOM 0 HA PRO A 99 -1.035 -8.191 32.707 1.00 61.42 H new ATOM 0 HB2 PRO A 99 0.794 -10.269 32.939 1.00 71.41 H new ATOM 0 HB3 PRO A 99 -0.747 -10.518 32.142 1.00 71.41 H new ATOM 0 HG2 PRO A 99 1.952 -9.984 30.918 1.00 53.23 H new ATOM 0 HG3 PRO A 99 0.724 -11.129 30.417 1.00 53.23 H new ATOM 0 HD2 PRO A 99 1.040 -8.735 29.158 1.00 12.24 H new ATOM 0 HD3 PRO A 99 -0.532 -9.497 29.293 1.00 12.24 H new ATOM 1602 N ARG A 100 0.948 -7.866 34.293 1.00 35.11 N ATOM 1603 CA ARG A 100 1.939 -7.239 35.158 1.00 1.43 C ATOM 1604 C ARG A 100 3.342 -7.741 34.831 1.00 42.03 C ATOM 1605 O ARG A 100 4.335 -7.076 35.125 1.00 2.55 O ATOM 1606 CB ARG A 100 1.616 -7.519 36.627 1.00 13.51 C ATOM 1607 CG ARG A 100 2.523 -6.785 37.601 1.00 25.31 C ATOM 1608 CD ARG A 100 1.812 -6.493 38.913 1.00 43.30 C ATOM 1609 NE ARG A 100 2.541 -5.523 39.726 1.00 24.55 N ATOM 1610 CZ ARG A 100 3.602 -5.833 40.464 1.00 31.02 C ATOM 1611 NH1 ARG A 100 4.055 -7.079 40.490 1.00 13.11 N ATOM 1612 NH2 ARG A 100 4.212 -4.895 41.178 1.00 71.24 N ATOM 0 H ARG A 100 0.239 -8.407 34.788 1.00 35.11 H new ATOM 0 HA ARG A 100 1.907 -6.163 34.984 1.00 1.43 H new ATOM 0 HB2 ARG A 100 0.582 -7.236 36.823 1.00 13.51 H new ATOM 0 HB3 ARG A 100 1.693 -8.591 36.809 1.00 13.51 H new ATOM 0 HG2 ARG A 100 3.413 -7.385 37.794 1.00 25.31 H new ATOM 0 HG3 ARG A 100 2.860 -5.850 37.153 1.00 25.31 H new ATOM 0 HD2 ARG A 100 0.811 -6.114 38.706 1.00 43.30 H new ATOM 0 HD3 ARG A 100 1.692 -7.420 39.474 1.00 43.30 H new ATOM 0 HE ARG A 100 2.218 -4.555 39.727 1.00 24.55 H new ATOM 0 HH11 ARG A 100 3.589 -7.803 39.943 1.00 13.11 H new ATOM 0 HH12 ARG A 100 4.869 -7.314 41.057 1.00 13.11 H new ATOM 0 HH21 ARG A 100 3.867 -3.935 41.161 1.00 71.24 H new ATOM 0 HH22 ARG A 100 5.026 -5.134 41.744 1.00 71.24 H new ATOM 1626 N ASP A 101 3.416 -8.919 34.220 1.00 13.52 N ATOM 1627 CA ASP A 101 4.697 -9.510 33.852 1.00 73.21 C ATOM 1628 C ASP A 101 5.287 -8.812 32.631 1.00 51.40 C ATOM 1629 O ASP A 101 6.451 -8.410 32.635 1.00 64.14 O ATOM 1630 CB ASP A 101 4.530 -11.004 33.569 1.00 22.14 C ATOM 1631 CG ASP A 101 4.628 -11.846 34.827 1.00 41.53 C ATOM 1632 OD1 ASP A 101 5.341 -11.431 35.765 1.00 51.42 O ATOM 1633 OD2 ASP A 101 3.991 -12.919 34.873 1.00 3.50 O ATOM 0 H ASP A 101 2.604 -9.483 33.969 1.00 13.52 H new ATOM 0 HA ASP A 101 5.383 -9.380 34.689 1.00 73.21 H new ATOM 0 HB2 ASP A 101 3.564 -11.175 33.095 1.00 22.14 H new ATOM 0 HB3 ASP A 101 5.294 -11.324 32.860 1.00 22.14 H new ATOM 1638 N LEU A 102 4.477 -8.671 31.588 1.00 40.45 N ATOM 1639 CA LEU A 102 4.919 -8.021 30.358 1.00 20.22 C ATOM 1640 C LEU A 102 5.166 -6.533 30.587 1.00 73.44 C ATOM 1641 O LEU A 102 5.973 -5.913 29.895 1.00 64.34 O ATOM 1642 CB LEU A 102 3.878 -8.214 29.254 1.00 42.41 C ATOM 1643 CG LEU A 102 3.720 -9.638 28.721 1.00 23.22 C ATOM 1644 CD1 LEU A 102 2.783 -9.659 27.524 1.00 60.53 C ATOM 1645 CD2 LEU A 102 5.076 -10.222 28.350 1.00 33.23 C ATOM 0 H LEU A 102 3.511 -8.998 31.569 1.00 40.45 H new ATOM 0 HA LEU A 102 5.857 -8.482 30.049 1.00 20.22 H new ATOM 0 HB2 LEU A 102 2.912 -7.880 29.631 1.00 42.41 H new ATOM 0 HB3 LEU A 102 4.137 -7.562 28.420 1.00 42.41 H new ATOM 0 HG LEU A 102 3.284 -10.254 29.508 1.00 23.22 H new ATOM 0 HD11 LEU A 102 2.683 -10.681 27.158 1.00 60.53 H new ATOM 0 HD12 LEU A 102 1.804 -9.282 27.821 1.00 60.53 H new ATOM 0 HD13 LEU A 102 3.189 -9.029 26.733 1.00 60.53 H new ATOM 0 HD21 LEU A 102 4.944 -11.236 27.973 1.00 33.23 H new ATOM 0 HD22 LEU A 102 5.539 -9.605 27.580 1.00 33.23 H new ATOM 0 HD23 LEU A 102 5.717 -10.243 29.232 1.00 33.23 H new ATOM 1657 N LYS A 103 4.466 -5.966 31.563 1.00 30.14 N ATOM 1658 CA LYS A 103 4.611 -4.552 31.887 1.00 55.31 C ATOM 1659 C LYS A 103 6.078 -4.185 32.080 1.00 45.13 C ATOM 1660 O LYS A 103 6.530 -3.131 31.631 1.00 11.25 O ATOM 1661 CB LYS A 103 3.819 -4.213 33.152 1.00 31.41 C ATOM 1662 CG LYS A 103 2.337 -3.996 32.902 1.00 14.41 C ATOM 1663 CD LYS A 103 1.788 -2.862 33.752 1.00 4.31 C ATOM 1664 CE LYS A 103 2.010 -1.511 33.089 1.00 13.21 C ATOM 1665 NZ LYS A 103 3.318 -0.912 33.473 1.00 63.45 N ATOM 0 H LYS A 103 3.792 -6.464 32.144 1.00 30.14 H new ATOM 0 HA LYS A 103 4.217 -3.972 31.052 1.00 55.31 H new ATOM 0 HB2 LYS A 103 3.943 -5.019 33.875 1.00 31.41 H new ATOM 0 HB3 LYS A 103 4.238 -3.314 33.603 1.00 31.41 H new ATOM 0 HG2 LYS A 103 2.174 -3.773 31.848 1.00 14.41 H new ATOM 0 HG3 LYS A 103 1.792 -4.914 33.122 1.00 14.41 H new ATOM 0 HD2 LYS A 103 0.722 -3.015 33.920 1.00 4.31 H new ATOM 0 HD3 LYS A 103 2.270 -2.872 34.730 1.00 4.31 H new ATOM 0 HE2 LYS A 103 1.968 -1.627 32.006 1.00 13.21 H new ATOM 0 HE3 LYS A 103 1.204 -0.833 33.369 1.00 13.21 H new ATOM 0 HZ1 LYS A 103 3.279 0.119 33.343 1.00 63.45 H new ATOM 0 HZ2 LYS A 103 3.519 -1.128 34.470 1.00 63.45 H new ATOM 0 HZ3 LYS A 103 4.070 -1.308 32.874 1.00 63.45 H new ATOM 1679 N LYS A 104 6.820 -5.062 32.748 1.00 12.11 N ATOM 1680 CA LYS A 104 8.238 -4.832 32.998 1.00 31.51 C ATOM 1681 C LYS A 104 9.034 -4.878 31.698 1.00 60.21 C ATOM 1682 O LYS A 104 9.998 -4.133 31.521 1.00 11.23 O ATOM 1683 CB LYS A 104 8.780 -5.877 33.977 1.00 14.52 C ATOM 1684 CG LYS A 104 8.640 -5.474 35.435 1.00 50.50 C ATOM 1685 CD LYS A 104 7.193 -5.535 35.894 1.00 31.24 C ATOM 1686 CE LYS A 104 7.094 -5.690 37.404 1.00 14.43 C ATOM 1687 NZ LYS A 104 5.694 -5.532 37.887 1.00 12.31 N ATOM 0 H LYS A 104 6.462 -5.939 33.126 1.00 12.11 H new ATOM 0 HA LYS A 104 8.348 -3.840 33.436 1.00 31.51 H new ATOM 0 HB2 LYS A 104 8.256 -6.819 33.817 1.00 14.52 H new ATOM 0 HB3 LYS A 104 9.832 -6.057 33.758 1.00 14.52 H new ATOM 0 HG2 LYS A 104 9.248 -6.133 36.055 1.00 50.50 H new ATOM 0 HG3 LYS A 104 9.024 -4.463 35.572 1.00 50.50 H new ATOM 0 HD2 LYS A 104 6.674 -4.628 35.585 1.00 31.24 H new ATOM 0 HD3 LYS A 104 6.691 -6.371 35.407 1.00 31.24 H new ATOM 0 HE2 LYS A 104 7.470 -6.671 37.694 1.00 14.43 H new ATOM 0 HE3 LYS A 104 7.731 -4.949 37.888 1.00 14.43 H new ATOM 0 HZ1 LYS A 104 5.678 -4.879 38.696 1.00 12.31 H new ATOM 0 HZ2 LYS A 104 5.104 -5.149 37.121 1.00 12.31 H new ATOM 0 HZ3 LYS A 104 5.322 -6.457 38.181 1.00 12.31 H new ATOM 1701 N LYS A 105 8.624 -5.757 30.789 1.00 2.41 N ATOM 1702 CA LYS A 105 9.297 -5.898 29.503 1.00 32.12 C ATOM 1703 C LYS A 105 9.078 -4.663 28.636 1.00 52.23 C ATOM 1704 O LYS A 105 9.962 -4.257 27.881 1.00 45.12 O ATOM 1705 CB LYS A 105 8.789 -7.144 28.773 1.00 1.41 C ATOM 1706 CG LYS A 105 8.751 -8.387 29.645 1.00 0.42 C ATOM 1707 CD LYS A 105 10.142 -8.786 30.108 1.00 62.14 C ATOM 1708 CE LYS A 105 10.445 -8.244 31.496 1.00 20.11 C ATOM 1709 NZ LYS A 105 11.488 -9.049 32.191 1.00 72.14 N ATOM 0 H LYS A 105 7.829 -6.382 30.919 1.00 2.41 H new ATOM 0 HA LYS A 105 10.366 -6.004 29.690 1.00 32.12 H new ATOM 0 HB2 LYS A 105 7.787 -6.948 28.391 1.00 1.41 H new ATOM 0 HB3 LYS A 105 9.427 -7.335 27.910 1.00 1.41 H new ATOM 0 HG2 LYS A 105 8.116 -8.205 30.512 1.00 0.42 H new ATOM 0 HG3 LYS A 105 8.302 -9.210 29.088 1.00 0.42 H new ATOM 0 HD2 LYS A 105 10.227 -9.873 30.114 1.00 62.14 H new ATOM 0 HD3 LYS A 105 10.883 -8.413 29.401 1.00 62.14 H new ATOM 0 HE2 LYS A 105 10.778 -7.209 31.417 1.00 20.11 H new ATOM 0 HE3 LYS A 105 9.532 -8.241 32.092 1.00 20.11 H new ATOM 0 HZ1 LYS A 105 11.666 -8.647 33.134 1.00 72.14 H new ATOM 0 HZ2 LYS A 105 11.160 -10.031 32.289 1.00 72.14 H new ATOM 0 HZ3 LYS A 105 12.367 -9.032 31.636 1.00 72.14 H new ATOM 1723 N LEU A 106 7.895 -4.068 28.749 1.00 23.11 N ATOM 1724 CA LEU A 106 7.561 -2.877 27.976 1.00 74.11 C ATOM 1725 C LEU A 106 8.151 -1.627 28.619 1.00 4.41 C ATOM 1726 O LEU A 106 8.665 -0.746 27.930 1.00 42.42 O ATOM 1727 CB LEU A 106 6.043 -2.734 27.855 1.00 55.41 C ATOM 1728 CG LEU A 106 5.523 -1.326 27.560 1.00 72.22 C ATOM 1729 CD1 LEU A 106 6.226 -0.742 26.344 1.00 14.55 C ATOM 1730 CD2 LEU A 106 4.016 -1.348 27.348 1.00 40.41 C ATOM 0 H LEU A 106 7.152 -4.391 29.368 1.00 23.11 H new ATOM 0 HA LEU A 106 7.991 -2.988 26.980 1.00 74.11 H new ATOM 0 HB2 LEU A 106 5.697 -3.400 27.065 1.00 55.41 H new ATOM 0 HB3 LEU A 106 5.590 -3.080 28.784 1.00 55.41 H new ATOM 0 HG LEU A 106 5.740 -0.691 28.419 1.00 72.22 H new ATOM 0 HD11 LEU A 106 5.844 0.260 26.149 1.00 14.55 H new ATOM 0 HD12 LEU A 106 7.298 -0.691 26.533 1.00 14.55 H new ATOM 0 HD13 LEU A 106 6.041 -1.376 25.477 1.00 14.55 H new ATOM 0 HD21 LEU A 106 3.663 -0.338 27.139 1.00 40.41 H new ATOM 0 HD22 LEU A 106 3.776 -1.997 26.506 1.00 40.41 H new ATOM 0 HD23 LEU A 106 3.528 -1.724 28.247 1.00 40.41 H new ATOM 1742 N SER A 107 8.076 -1.557 29.944 1.00 24.24 N ATOM 1743 CA SER A 107 8.602 -0.414 30.681 1.00 44.21 C ATOM 1744 C SER A 107 10.054 -0.141 30.297 1.00 33.43 C ATOM 1745 O SER A 107 10.501 1.006 30.290 1.00 34.34 O ATOM 1746 CB SER A 107 8.499 -0.659 32.187 1.00 33.34 C ATOM 1747 OG SER A 107 9.092 0.400 32.919 1.00 71.33 O ATOM 0 H SER A 107 7.656 -2.279 30.530 1.00 24.24 H new ATOM 0 HA SER A 107 8.005 0.460 30.421 1.00 44.21 H new ATOM 0 HB2 SER A 107 7.452 -0.759 32.471 1.00 33.34 H new ATOM 0 HB3 SER A 107 8.989 -1.599 32.440 1.00 33.34 H new ATOM 0 HG SER A 107 9.011 0.220 33.879 1.00 71.33 H new ATOM 1753 N ARG A 108 10.784 -1.205 29.979 1.00 44.24 N ATOM 1754 CA ARG A 108 12.186 -1.082 29.595 1.00 55.11 C ATOM 1755 C ARG A 108 12.316 -0.747 28.112 1.00 12.20 C ATOM 1756 O ARG A 108 13.300 -0.143 27.685 1.00 23.22 O ATOM 1757 CB ARG A 108 12.937 -2.378 29.904 1.00 74.43 C ATOM 1758 CG ARG A 108 12.464 -3.566 29.082 1.00 62.43 C ATOM 1759 CD ARG A 108 13.494 -4.685 29.077 1.00 31.42 C ATOM 1760 NE ARG A 108 14.643 -4.368 28.234 1.00 63.10 N ATOM 1761 CZ ARG A 108 15.741 -5.114 28.177 1.00 2.42 C ATOM 1762 NH1 ARG A 108 15.838 -6.214 28.910 1.00 31.13 N ATOM 1763 NH2 ARG A 108 16.745 -4.759 27.385 1.00 22.14 N ATOM 0 H ARG A 108 10.429 -2.161 29.980 1.00 44.24 H new ATOM 0 HA ARG A 108 12.625 -0.269 30.173 1.00 55.11 H new ATOM 0 HB2 ARG A 108 14.001 -2.223 29.725 1.00 74.43 H new ATOM 0 HB3 ARG A 108 12.823 -2.611 30.963 1.00 74.43 H new ATOM 0 HG2 ARG A 108 11.523 -3.938 29.486 1.00 62.43 H new ATOM 0 HG3 ARG A 108 12.267 -3.247 28.059 1.00 62.43 H new ATOM 0 HD2 ARG A 108 13.833 -4.870 30.096 1.00 31.42 H new ATOM 0 HD3 ARG A 108 13.028 -5.605 28.724 1.00 31.42 H new ATOM 0 HE ARG A 108 14.601 -3.528 27.657 1.00 63.10 H new ATOM 0 HH11 ARG A 108 15.068 -6.490 29.520 1.00 31.13 H new ATOM 0 HH12 ARG A 108 16.682 -6.785 28.864 1.00 31.13 H new ATOM 0 HH21 ARG A 108 16.674 -3.913 26.820 1.00 22.14 H new ATOM 0 HH22 ARG A 108 17.588 -5.332 27.342 1.00 22.14 H new ATOM 1777 N VAL A 109 11.316 -1.143 27.331 1.00 71.21 N ATOM 1778 CA VAL A 109 11.318 -0.885 25.896 1.00 40.20 C ATOM 1779 C VAL A 109 11.072 0.591 25.603 1.00 33.10 C ATOM 1780 O VAL A 109 11.658 1.158 24.681 1.00 11.30 O ATOM 1781 CB VAL A 109 10.249 -1.726 25.173 1.00 44.23 C ATOM 1782 CG1 VAL A 109 10.130 -1.300 23.717 1.00 30.42 C ATOM 1783 CG2 VAL A 109 10.577 -3.208 25.278 1.00 13.45 C ATOM 0 H VAL A 109 10.494 -1.644 27.668 1.00 71.21 H new ATOM 0 HA VAL A 109 12.303 -1.167 25.525 1.00 40.20 H new ATOM 0 HB VAL A 109 9.287 -1.555 25.657 1.00 44.23 H new ATOM 0 HG11 VAL A 109 9.370 -1.905 23.222 1.00 30.42 H new ATOM 0 HG12 VAL A 109 9.846 -0.249 23.668 1.00 30.42 H new ATOM 0 HG13 VAL A 109 11.088 -1.441 23.217 1.00 30.42 H new ATOM 0 HG21 VAL A 109 9.812 -3.788 24.762 1.00 13.45 H new ATOM 0 HG22 VAL A 109 11.547 -3.399 24.820 1.00 13.45 H new ATOM 0 HG23 VAL A 109 10.607 -3.500 26.328 1.00 13.45 H new ATOM 1793 N VAL A 110 10.200 1.208 26.395 1.00 43.45 N ATOM 1794 CA VAL A 110 9.877 2.620 26.222 1.00 71.54 C ATOM 1795 C VAL A 110 11.064 3.504 26.587 1.00 53.10 C ATOM 1796 O VAL A 110 11.276 4.555 25.984 1.00 12.44 O ATOM 1797 CB VAL A 110 8.664 3.027 27.079 1.00 20.42 C ATOM 1798 CG1 VAL A 110 8.907 2.689 28.542 1.00 1.24 C ATOM 1799 CG2 VAL A 110 8.364 4.508 26.908 1.00 40.01 C ATOM 0 H VAL A 110 9.705 0.753 27.162 1.00 43.45 H new ATOM 0 HA VAL A 110 9.632 2.762 25.169 1.00 71.54 H new ATOM 0 HB VAL A 110 7.795 2.463 26.740 1.00 20.42 H new ATOM 0 HG11 VAL A 110 8.039 2.984 29.132 1.00 1.24 H new ATOM 0 HG12 VAL A 110 9.069 1.616 28.646 1.00 1.24 H new ATOM 0 HG13 VAL A 110 9.787 3.225 28.898 1.00 1.24 H new ATOM 0 HG21 VAL A 110 7.504 4.778 27.521 1.00 40.01 H new ATOM 0 HG22 VAL A 110 9.229 5.093 27.219 1.00 40.01 H new ATOM 0 HG23 VAL A 110 8.143 4.716 25.861 1.00 40.01 H new ATOM 1809 N ASN A 111 11.835 3.070 27.578 1.00 22.14 N ATOM 1810 CA ASN A 111 13.002 3.823 28.025 1.00 72.32 C ATOM 1811 C ASN A 111 14.082 3.842 26.947 1.00 31.35 C ATOM 1812 O ASN A 111 15.011 4.648 27.000 1.00 21.13 O ATOM 1813 CB ASN A 111 13.562 3.218 29.314 1.00 50.21 C ATOM 1814 CG ASN A 111 12.644 3.436 30.501 1.00 31.21 C ATOM 1815 OD1 ASN A 111 11.788 4.320 30.484 1.00 54.11 O ATOM 1816 ND2 ASN A 111 12.819 2.628 31.540 1.00 22.33 N ATOM 0 H ASN A 111 11.673 2.201 28.087 1.00 22.14 H new ATOM 0 HA ASN A 111 12.689 4.849 28.219 1.00 72.32 H new ATOM 0 HB2 ASN A 111 13.720 2.149 29.172 1.00 50.21 H new ATOM 0 HB3 ASN A 111 14.536 3.659 29.526 1.00 50.21 H new ATOM 0 HD21 ASN A 111 12.231 2.727 32.368 1.00 22.33 H new ATOM 0 HD22 ASN A 111 13.541 1.908 31.511 1.00 22.33 H new ATOM 1823 N ILE A 112 13.952 2.949 25.972 1.00 41.23 N ATOM 1824 CA ILE A 112 14.916 2.865 24.881 1.00 33.23 C ATOM 1825 C ILE A 112 14.742 4.022 23.904 1.00 45.23 C ATOM 1826 O ILE A 112 15.720 4.631 23.465 1.00 34.15 O ATOM 1827 CB ILE A 112 14.783 1.536 24.115 1.00 62.35 C ATOM 1828 CG1 ILE A 112 15.146 0.359 25.023 1.00 43.31 C ATOM 1829 CG2 ILE A 112 15.667 1.548 22.876 1.00 11.32 C ATOM 1830 CD1 ILE A 112 14.672 -0.978 24.498 1.00 2.13 C ATOM 0 H ILE A 112 13.190 2.274 25.915 1.00 41.23 H new ATOM 0 HA ILE A 112 15.908 2.919 25.330 1.00 33.23 H new ATOM 0 HB ILE A 112 13.747 1.419 23.798 1.00 62.35 H new ATOM 0 HG12 ILE A 112 16.228 0.328 25.149 1.00 43.31 H new ATOM 0 HG13 ILE A 112 14.715 0.526 26.010 1.00 43.31 H new ATOM 0 HG21 ILE A 112 15.562 0.602 22.345 1.00 11.32 H new ATOM 0 HG22 ILE A 112 15.366 2.366 22.222 1.00 11.32 H new ATOM 0 HG23 ILE A 112 16.707 1.684 23.172 1.00 11.32 H new ATOM 0 HD11 ILE A 112 14.964 -1.766 25.192 1.00 2.13 H new ATOM 0 HD12 ILE A 112 13.587 -0.966 24.399 1.00 2.13 H new ATOM 0 HD13 ILE A 112 15.123 -1.167 23.524 1.00 2.13 H new ATOM 1842 N LEU A 113 13.493 4.323 23.567 1.00 61.32 N ATOM 1843 CA LEU A 113 13.190 5.409 22.642 1.00 44.42 C ATOM 1844 C LEU A 113 13.747 6.733 23.156 1.00 13.23 C ATOM 1845 O LEU A 113 14.284 7.533 22.390 1.00 14.51 O ATOM 1846 CB LEU A 113 11.679 5.524 22.436 1.00 70.13 C ATOM 1847 CG LEU A 113 10.997 4.319 21.786 1.00 41.52 C ATOM 1848 CD1 LEU A 113 11.897 3.705 20.725 1.00 72.12 C ATOM 1849 CD2 LEU A 113 10.626 3.285 22.838 1.00 63.51 C ATOM 0 H LEU A 113 12.673 3.830 23.921 1.00 61.32 H new ATOM 0 HA LEU A 113 13.664 5.182 21.687 1.00 44.42 H new ATOM 0 HB2 LEU A 113 11.213 5.701 23.405 1.00 70.13 H new ATOM 0 HB3 LEU A 113 11.482 6.403 21.822 1.00 70.13 H new ATOM 0 HG LEU A 113 10.081 4.660 21.303 1.00 41.52 H new ATOM 0 HD11 LEU A 113 11.395 2.849 20.273 1.00 72.12 H new ATOM 0 HD12 LEU A 113 12.112 4.447 19.956 1.00 72.12 H new ATOM 0 HD13 LEU A 113 12.830 3.378 21.184 1.00 72.12 H new ATOM 0 HD21 LEU A 113 10.142 2.435 22.358 1.00 63.51 H new ATOM 0 HD22 LEU A 113 11.527 2.948 23.350 1.00 63.51 H new ATOM 0 HD23 LEU A 113 9.943 3.731 23.561 1.00 63.51 H new ATOM 1861 N LYS A 114 13.617 6.957 24.460 1.00 55.15 N ATOM 1862 CA LYS A 114 14.109 8.182 25.079 1.00 71.12 C ATOM 1863 C LYS A 114 15.631 8.167 25.180 1.00 72.12 C ATOM 1864 O LYS A 114 16.275 9.213 25.122 1.00 45.32 O ATOM 1865 CB LYS A 114 13.497 8.356 26.471 1.00 75.15 C ATOM 1866 CG LYS A 114 13.918 7.283 27.459 1.00 20.50 C ATOM 1867 CD LYS A 114 13.470 7.619 28.872 1.00 63.44 C ATOM 1868 CE LYS A 114 11.954 7.610 28.993 1.00 62.32 C ATOM 1869 NZ LYS A 114 11.511 7.400 30.399 1.00 3.40 N ATOM 0 H LYS A 114 13.175 6.306 25.108 1.00 55.15 H new ATOM 0 HA LYS A 114 13.812 9.022 24.451 1.00 71.12 H new ATOM 0 HB2 LYS A 114 13.782 9.332 26.864 1.00 75.15 H new ATOM 0 HB3 LYS A 114 12.410 8.352 26.384 1.00 75.15 H new ATOM 0 HG2 LYS A 114 13.493 6.325 27.160 1.00 20.50 H new ATOM 0 HG3 LYS A 114 15.002 7.172 27.437 1.00 20.50 H new ATOM 0 HD2 LYS A 114 13.896 6.899 29.571 1.00 63.44 H new ATOM 0 HD3 LYS A 114 13.853 8.600 29.152 1.00 63.44 H new ATOM 0 HE2 LYS A 114 11.555 8.555 28.624 1.00 62.32 H new ATOM 0 HE3 LYS A 114 11.544 6.822 28.361 1.00 62.32 H new ATOM 0 HZ1 LYS A 114 10.542 7.760 30.515 1.00 3.40 H new ATOM 0 HZ2 LYS A 114 11.532 6.384 30.622 1.00 3.40 H new ATOM 0 HZ3 LYS A 114 12.149 7.909 31.044 1.00 3.40 H new ATOM 1883 N GLU A 115 16.198 6.974 25.330 1.00 73.24 N ATOM 1884 CA GLU A 115 17.644 6.824 25.438 1.00 42.34 C ATOM 1885 C GLU A 115 18.319 7.068 24.091 1.00 55.54 C ATOM 1886 O GLU A 115 19.260 7.855 23.989 1.00 11.34 O ATOM 1887 CB GLU A 115 17.998 5.427 25.952 1.00 51.24 C ATOM 1888 CG GLU A 115 17.880 5.286 27.460 1.00 74.52 C ATOM 1889 CD GLU A 115 19.098 5.812 28.193 1.00 64.15 C ATOM 1890 OE1 GLU A 115 20.221 5.365 27.876 1.00 14.11 O ATOM 1891 OE2 GLU A 115 18.929 6.671 29.083 1.00 42.43 O ATOM 0 H GLU A 115 15.678 6.098 25.379 1.00 73.24 H new ATOM 0 HA GLU A 115 18.008 7.567 26.147 1.00 42.34 H new ATOM 0 HB2 GLU A 115 17.344 4.697 25.475 1.00 51.24 H new ATOM 0 HB3 GLU A 115 19.018 5.186 25.652 1.00 51.24 H new ATOM 0 HG2 GLU A 115 16.995 5.822 27.803 1.00 74.52 H new ATOM 0 HG3 GLU A 115 17.734 4.236 27.712 1.00 74.52 H new ATOM 1898 N ARG A 116 17.830 6.388 23.059 1.00 21.30 N ATOM 1899 CA ARG A 116 18.386 6.529 21.719 1.00 72.44 C ATOM 1900 C ARG A 116 17.804 7.751 21.015 1.00 42.14 C ATOM 1901 O ARG A 116 18.255 8.130 19.935 1.00 53.34 O ATOM 1902 CB ARG A 116 18.107 5.271 20.893 1.00 24.02 C ATOM 1903 CG ARG A 116 18.372 3.977 21.646 1.00 13.42 C ATOM 1904 CD ARG A 116 19.798 3.919 22.170 1.00 62.03 C ATOM 1905 NE ARG A 116 20.138 2.596 22.687 1.00 72.14 N ATOM 1906 CZ ARG A 116 21.344 2.271 23.138 1.00 31.32 C ATOM 1907 NH1 ARG A 116 22.320 3.168 23.137 1.00 60.00 N ATOM 1908 NH2 ARG A 116 21.575 1.046 23.593 1.00 64.21 N ATOM 0 H ARG A 116 17.050 5.734 23.125 1.00 21.30 H new ATOM 0 HA ARG A 116 19.464 6.663 21.812 1.00 72.44 H new ATOM 0 HB2 ARG A 116 17.067 5.285 20.566 1.00 24.02 H new ATOM 0 HB3 ARG A 116 18.724 5.292 19.995 1.00 24.02 H new ATOM 0 HG2 ARG A 116 17.674 3.890 22.478 1.00 13.42 H new ATOM 0 HG3 ARG A 116 18.191 3.128 20.987 1.00 13.42 H new ATOM 0 HD2 ARG A 116 20.489 4.184 21.370 1.00 62.03 H new ATOM 0 HD3 ARG A 116 19.925 4.660 22.959 1.00 62.03 H new ATOM 0 HE ARG A 116 19.409 1.883 22.702 1.00 72.14 H new ATOM 0 HH11 ARG A 116 22.146 4.111 22.789 1.00 60.00 H new ATOM 0 HH12 ARG A 116 23.245 2.915 23.484 1.00 60.00 H new ATOM 0 HH21 ARG A 116 20.826 0.354 23.596 1.00 64.21 H new ATOM 0 HH22 ARG A 116 22.502 0.797 23.939 1.00 64.21 H new ATOM 1922 N ASN A 117 16.800 8.363 21.635 1.00 63.22 N ATOM 1923 CA ASN A 117 16.156 9.542 21.067 1.00 21.32 C ATOM 1924 C ASN A 117 15.511 9.215 19.724 1.00 52.22 C ATOM 1925 O ASN A 117 15.524 10.032 18.803 1.00 45.24 O ATOM 1926 CB ASN A 117 17.173 10.672 20.896 1.00 64.42 C ATOM 1927 CG ASN A 117 17.924 10.973 22.179 1.00 52.44 C ATOM 1928 OD1 ASN A 117 17.319 11.265 23.211 1.00 43.14 O ATOM 1929 ND2 ASN A 117 19.249 10.905 22.119 1.00 33.40 N ATOM 0 H ASN A 117 16.415 8.062 22.530 1.00 63.22 H new ATOM 0 HA ASN A 117 15.376 9.866 21.755 1.00 21.32 H new ATOM 0 HB2 ASN A 117 17.885 10.401 20.116 1.00 64.42 H new ATOM 0 HB3 ASN A 117 16.659 11.572 20.559 1.00 64.42 H new ATOM 0 HD21 ASN A 117 19.808 11.099 22.950 1.00 33.40 H new ATOM 0 HD22 ASN A 117 19.708 10.659 21.242 1.00 33.40 H new ATOM 1936 N ILE A 118 14.946 8.017 19.621 1.00 63.14 N ATOM 1937 CA ILE A 118 14.294 7.583 18.391 1.00 44.50 C ATOM 1938 C ILE A 118 13.283 8.619 17.910 1.00 23.24 C ATOM 1939 O ILE A 118 13.517 9.320 16.925 1.00 34.43 O ATOM 1940 CB ILE A 118 13.579 6.233 18.579 1.00 21.40 C ATOM 1941 CG1 ILE A 118 14.576 5.160 19.021 1.00 24.24 C ATOM 1942 CG2 ILE A 118 12.883 5.818 17.291 1.00 23.12 C ATOM 1943 CD1 ILE A 118 15.583 4.794 17.953 1.00 22.44 C ATOM 0 H ILE A 118 14.926 7.329 20.374 1.00 63.14 H new ATOM 0 HA ILE A 118 15.077 7.468 17.642 1.00 44.50 H new ATOM 0 HB ILE A 118 12.824 6.344 19.358 1.00 21.40 H new ATOM 0 HG12 ILE A 118 15.108 5.512 19.905 1.00 24.24 H new ATOM 0 HG13 ILE A 118 14.028 4.265 19.314 1.00 24.24 H new ATOM 0 HG21 ILE A 118 12.382 4.861 17.440 1.00 23.12 H new ATOM 0 HG22 ILE A 118 12.148 6.574 17.015 1.00 23.12 H new ATOM 0 HG23 ILE A 118 13.620 5.721 16.494 1.00 23.12 H new ATOM 0 HD11 ILE A 118 16.258 4.028 18.336 1.00 22.44 H new ATOM 0 HD12 ILE A 118 15.061 4.412 17.076 1.00 22.44 H new ATOM 0 HD13 ILE A 118 16.157 5.678 17.676 1.00 22.44 H new ATOM 1955 N PHE A 119 12.160 8.711 18.614 1.00 55.24 N ATOM 1956 CA PHE A 119 11.112 9.662 18.260 1.00 41.04 C ATOM 1957 C PHE A 119 11.395 11.033 18.866 1.00 51.51 C ATOM 1958 O PHE A 119 12.222 11.167 19.768 1.00 33.31 O ATOM 1959 CB PHE A 119 9.750 9.153 18.735 1.00 32.10 C ATOM 1960 CG PHE A 119 9.506 7.705 18.417 1.00 45.33 C ATOM 1961 CD1 PHE A 119 9.629 7.238 17.118 1.00 33.11 C ATOM 1962 CD2 PHE A 119 9.156 6.812 19.416 1.00 21.11 C ATOM 1963 CE1 PHE A 119 9.405 5.907 16.822 1.00 35.55 C ATOM 1964 CE2 PHE A 119 8.931 5.479 19.127 1.00 41.24 C ATOM 1965 CZ PHE A 119 9.057 5.026 17.828 1.00 35.11 C ATOM 0 H PHE A 119 11.952 8.139 19.433 1.00 55.24 H new ATOM 0 HA PHE A 119 11.097 9.760 17.175 1.00 41.04 H new ATOM 0 HB2 PHE A 119 9.673 9.298 19.813 1.00 32.10 H new ATOM 0 HB3 PHE A 119 8.966 9.755 18.275 1.00 32.10 H new ATOM 0 HD1 PHE A 119 9.903 7.922 16.328 1.00 33.11 H new ATOM 0 HD2 PHE A 119 9.058 7.161 20.433 1.00 21.11 H new ATOM 0 HE1 PHE A 119 9.502 5.556 15.805 1.00 35.55 H new ATOM 0 HE2 PHE A 119 8.657 4.793 19.915 1.00 41.24 H new ATOM 0 HZ PHE A 119 8.884 3.985 17.599 1.00 35.11 H new ATOM 1975 N SER A 120 10.703 12.050 18.363 1.00 54.52 N ATOM 1976 CA SER A 120 10.882 13.413 18.851 1.00 73.12 C ATOM 1977 C SER A 120 10.247 13.584 20.228 1.00 45.43 C ATOM 1978 O SER A 120 9.634 12.660 20.762 1.00 62.03 O ATOM 1979 CB SER A 120 10.272 14.414 17.868 1.00 74.35 C ATOM 1980 OG SER A 120 11.207 14.782 16.868 1.00 33.53 O ATOM 0 H SER A 120 10.013 11.956 17.618 1.00 54.52 H new ATOM 0 HA SER A 120 11.952 13.605 18.936 1.00 73.12 H new ATOM 0 HB2 SER A 120 9.389 13.978 17.401 1.00 74.35 H new ATOM 0 HB3 SER A 120 9.942 15.302 18.407 1.00 74.35 H new ATOM 0 HG SER A 120 10.792 15.421 16.252 1.00 33.53 H new ATOM 1986 N LYS A 121 10.400 14.775 20.798 1.00 32.21 N ATOM 1987 CA LYS A 121 9.842 15.071 22.112 1.00 1.03 C ATOM 1988 C LYS A 121 8.320 14.972 22.093 1.00 62.54 C ATOM 1989 O LYS A 121 7.714 14.414 23.007 1.00 24.12 O ATOM 1990 CB LYS A 121 10.267 16.470 22.566 1.00 74.33 C ATOM 1991 CG LYS A 121 10.019 16.732 24.041 1.00 0.11 C ATOM 1992 CD LYS A 121 11.079 16.076 24.910 1.00 43.13 C ATOM 1993 CE LYS A 121 12.414 16.798 24.801 1.00 14.01 C ATOM 1994 NZ LYS A 121 13.279 16.545 25.986 1.00 1.23 N ATOM 0 H LYS A 121 10.906 15.551 20.370 1.00 32.21 H new ATOM 0 HA LYS A 121 10.227 14.334 22.816 1.00 1.03 H new ATOM 0 HB2 LYS A 121 11.328 16.605 22.355 1.00 74.33 H new ATOM 0 HB3 LYS A 121 9.728 17.213 21.978 1.00 74.33 H new ATOM 0 HG2 LYS A 121 10.011 17.806 24.224 1.00 0.11 H new ATOM 0 HG3 LYS A 121 9.035 16.354 24.318 1.00 0.11 H new ATOM 0 HD2 LYS A 121 10.749 16.074 25.949 1.00 43.13 H new ATOM 0 HD3 LYS A 121 11.202 15.035 24.612 1.00 43.13 H new ATOM 0 HE2 LYS A 121 12.930 16.472 23.898 1.00 14.01 H new ATOM 0 HE3 LYS A 121 12.240 17.869 24.700 1.00 14.01 H new ATOM 0 HZ1 LYS A 121 14.179 17.054 25.874 1.00 1.23 H new ATOM 0 HZ2 LYS A 121 12.797 16.879 26.845 1.00 1.23 H new ATOM 0 HZ3 LYS A 121 13.466 15.525 26.068 1.00 1.23 H new ATOM 2008 N GLN A 122 7.710 15.514 21.044 1.00 13.41 N ATOM 2009 CA GLN A 122 6.258 15.485 20.906 1.00 5.33 C ATOM 2010 C GLN A 122 5.739 14.052 20.924 1.00 73.44 C ATOM 2011 O GLN A 122 4.695 13.766 21.510 1.00 33.31 O ATOM 2012 CB GLN A 122 5.834 16.179 19.610 1.00 21.45 C ATOM 2013 CG GLN A 122 5.620 17.676 19.763 1.00 22.24 C ATOM 2014 CD GLN A 122 4.772 18.261 18.651 1.00 30.24 C ATOM 2015 OE1 GLN A 122 5.288 18.887 17.725 1.00 11.13 O ATOM 2016 NE2 GLN A 122 3.462 18.059 18.737 1.00 63.01 N ATOM 0 H GLN A 122 8.198 15.978 20.278 1.00 13.41 H new ATOM 0 HA GLN A 122 5.826 16.019 21.753 1.00 5.33 H new ATOM 0 HB2 GLN A 122 6.595 16.005 18.849 1.00 21.45 H new ATOM 0 HB3 GLN A 122 4.912 15.724 19.249 1.00 21.45 H new ATOM 0 HG2 GLN A 122 5.142 17.875 20.722 1.00 22.24 H new ATOM 0 HG3 GLN A 122 6.588 18.178 19.779 1.00 22.24 H new ATOM 0 HE21 GLN A 122 3.077 17.534 19.522 1.00 63.01 H new ATOM 0 HE22 GLN A 122 2.841 18.429 18.018 1.00 63.01 H new ATOM 2025 N VAL A 123 6.474 13.153 20.276 1.00 33.11 N ATOM 2026 CA VAL A 123 6.087 11.748 20.218 1.00 44.23 C ATOM 2027 C VAL A 123 6.316 11.059 21.558 1.00 4.01 C ATOM 2028 O VAL A 123 5.405 10.450 22.119 1.00 2.32 O ATOM 2029 CB VAL A 123 6.871 10.996 19.126 1.00 74.25 C ATOM 2030 CG1 VAL A 123 6.327 9.586 18.954 1.00 20.51 C ATOM 2031 CG2 VAL A 123 6.818 11.760 17.811 1.00 24.40 C ATOM 0 H VAL A 123 7.340 13.373 19.784 1.00 33.11 H new ATOM 0 HA VAL A 123 5.024 11.722 19.977 1.00 44.23 H new ATOM 0 HB VAL A 123 7.913 10.923 19.436 1.00 74.25 H new ATOM 0 HG11 VAL A 123 6.893 9.070 18.179 1.00 20.51 H new ATOM 0 HG12 VAL A 123 6.421 9.043 19.894 1.00 20.51 H new ATOM 0 HG13 VAL A 123 5.277 9.634 18.666 1.00 20.51 H new ATOM 0 HG21 VAL A 123 7.377 11.215 17.051 1.00 24.40 H new ATOM 0 HG22 VAL A 123 5.781 11.866 17.493 1.00 24.40 H new ATOM 0 HG23 VAL A 123 7.258 12.748 17.946 1.00 24.40 H new ATOM 2041 N VAL A 124 7.540 11.159 22.067 1.00 1.24 N ATOM 2042 CA VAL A 124 7.890 10.547 23.344 1.00 75.14 C ATOM 2043 C VAL A 124 6.960 11.022 24.454 1.00 13.42 C ATOM 2044 O VAL A 124 6.414 10.218 25.208 1.00 72.44 O ATOM 2045 CB VAL A 124 9.345 10.862 23.738 1.00 72.14 C ATOM 2046 CG1 VAL A 124 9.677 10.250 25.090 1.00 73.52 C ATOM 2047 CG2 VAL A 124 10.305 10.365 22.668 1.00 64.12 C ATOM 0 H VAL A 124 8.306 11.658 21.615 1.00 1.24 H new ATOM 0 HA VAL A 124 7.781 9.470 23.219 1.00 75.14 H new ATOM 0 HB VAL A 124 9.455 11.943 23.819 1.00 72.14 H new ATOM 0 HG11 VAL A 124 10.709 10.483 25.351 1.00 73.52 H new ATOM 0 HG12 VAL A 124 9.009 10.659 25.848 1.00 73.52 H new ATOM 0 HG13 VAL A 124 9.551 9.168 25.041 1.00 73.52 H new ATOM 0 HG21 VAL A 124 11.329 10.596 22.962 1.00 64.12 H new ATOM 0 HG22 VAL A 124 10.195 9.287 22.553 1.00 64.12 H new ATOM 0 HG23 VAL A 124 10.080 10.856 21.721 1.00 64.12 H new ATOM 2057 N ASN A 125 6.784 12.336 24.549 1.00 13.40 N ATOM 2058 CA ASN A 125 5.919 12.920 25.568 1.00 2.22 C ATOM 2059 C ASN A 125 4.511 12.339 25.485 1.00 21.33 C ATOM 2060 O ASN A 125 3.782 12.307 26.477 1.00 41.31 O ATOM 2061 CB ASN A 125 5.865 14.441 25.411 1.00 41.14 C ATOM 2062 CG ASN A 125 7.040 15.133 26.074 1.00 11.42 C ATOM 2063 OD1 ASN A 125 6.872 16.133 26.773 1.00 72.11 O ATOM 2064 ND2 ASN A 125 8.238 14.603 25.858 1.00 40.33 N ATOM 0 H ASN A 125 7.229 13.016 23.933 1.00 13.40 H new ATOM 0 HA ASN A 125 6.336 12.677 26.545 1.00 2.22 H new ATOM 0 HB2 ASN A 125 5.849 14.694 24.351 1.00 41.14 H new ATOM 0 HB3 ASN A 125 4.936 14.815 25.842 1.00 41.14 H new ATOM 0 HD21 ASN A 125 9.066 15.025 26.278 1.00 40.33 H new ATOM 0 HD22 ASN A 125 8.331 13.773 25.272 1.00 40.33 H new ATOM 2071 N ASP A 126 4.136 11.879 24.297 1.00 50.12 N ATOM 2072 CA ASP A 126 2.816 11.297 24.084 1.00 20.20 C ATOM 2073 C ASP A 126 2.733 9.901 24.694 1.00 10.25 C ATOM 2074 O ASP A 126 1.704 9.517 25.250 1.00 34.41 O ATOM 2075 CB ASP A 126 2.498 11.233 22.589 1.00 22.13 C ATOM 2076 CG ASP A 126 1.009 11.292 22.311 1.00 1.40 C ATOM 2077 OD1 ASP A 126 0.332 10.257 22.481 1.00 75.15 O ATOM 2078 OD2 ASP A 126 0.521 12.375 21.925 1.00 70.35 O ATOM 0 H ASP A 126 4.728 11.898 23.466 1.00 50.12 H new ATOM 0 HA ASP A 126 2.082 11.934 24.577 1.00 20.20 H new ATOM 0 HB2 ASP A 126 2.993 12.060 22.080 1.00 22.13 H new ATOM 0 HB3 ASP A 126 2.906 10.312 22.173 1.00 22.13 H new ATOM 2083 N ILE A 127 3.822 9.148 24.586 1.00 21.12 N ATOM 2084 CA ILE A 127 3.872 7.795 25.128 1.00 51.55 C ATOM 2085 C ILE A 127 3.649 7.799 26.636 1.00 24.31 C ATOM 2086 O ILE A 127 2.808 7.062 27.150 1.00 3.34 O ATOM 2087 CB ILE A 127 5.219 7.115 24.820 1.00 11.21 C ATOM 2088 CG1 ILE A 127 5.454 7.060 23.309 1.00 21.02 C ATOM 2089 CG2 ILE A 127 5.255 5.717 25.419 1.00 50.03 C ATOM 2090 CD1 ILE A 127 6.906 6.873 22.930 1.00 24.51 C ATOM 0 H ILE A 127 4.682 9.451 24.128 1.00 21.12 H new ATOM 0 HA ILE A 127 3.072 7.232 24.647 1.00 51.55 H new ATOM 0 HB ILE A 127 6.018 7.703 25.271 1.00 11.21 H new ATOM 0 HG12 ILE A 127 4.869 6.242 22.888 1.00 21.02 H new ATOM 0 HG13 ILE A 127 5.085 7.981 22.858 1.00 21.02 H new ATOM 0 HG21 ILE A 127 6.213 5.249 25.193 1.00 50.03 H new ATOM 0 HG22 ILE A 127 5.128 5.781 26.500 1.00 50.03 H new ATOM 0 HG23 ILE A 127 4.449 5.118 24.994 1.00 50.03 H new ATOM 0 HD11 ILE A 127 6.998 6.843 21.844 1.00 24.51 H new ATOM 0 HD12 ILE A 127 7.494 7.703 23.321 1.00 24.51 H new ATOM 0 HD13 ILE A 127 7.274 5.938 23.351 1.00 24.51 H new ATOM 2102 N GLU A 128 4.408 8.634 27.339 1.00 22.20 N ATOM 2103 CA GLU A 128 4.293 8.733 28.789 1.00 15.22 C ATOM 2104 C GLU A 128 2.851 9.019 29.202 1.00 63.42 C ATOM 2105 O GLU A 128 2.317 8.383 30.111 1.00 63.12 O ATOM 2106 CB GLU A 128 5.214 9.832 29.322 1.00 23.15 C ATOM 2107 CG GLU A 128 6.677 9.625 28.967 1.00 50.01 C ATOM 2108 CD GLU A 128 7.613 10.410 29.866 1.00 34.40 C ATOM 2109 OE1 GLU A 128 7.886 11.588 29.555 1.00 21.51 O ATOM 2110 OE2 GLU A 128 8.071 9.845 30.881 1.00 20.33 O ATOM 0 H GLU A 128 5.108 9.251 26.928 1.00 22.20 H new ATOM 0 HA GLU A 128 4.594 7.777 29.218 1.00 15.22 H new ATOM 0 HB2 GLU A 128 4.885 10.793 28.927 1.00 23.15 H new ATOM 0 HB3 GLU A 128 5.116 9.883 30.406 1.00 23.15 H new ATOM 0 HG2 GLU A 128 6.917 8.564 29.037 1.00 50.01 H new ATOM 0 HG3 GLU A 128 6.841 9.921 27.931 1.00 50.01 H new ATOM 2117 N ARG A 129 2.228 9.979 28.527 1.00 2.32 N ATOM 2118 CA ARG A 129 0.850 10.351 28.824 1.00 20.32 C ATOM 2119 C ARG A 129 -0.085 9.159 28.644 1.00 72.40 C ATOM 2120 O ARG A 129 -0.980 8.930 29.458 1.00 24.13 O ATOM 2121 CB ARG A 129 0.404 11.503 27.922 1.00 3.12 C ATOM 2122 CG ARG A 129 1.198 12.783 28.132 1.00 35.40 C ATOM 2123 CD ARG A 129 0.617 13.619 29.262 1.00 25.41 C ATOM 2124 NE ARG A 129 0.980 13.091 30.575 1.00 50.21 N ATOM 2125 CZ ARG A 129 0.338 13.404 31.695 1.00 24.32 C ATOM 2126 NH1 ARG A 129 -0.693 14.236 31.662 1.00 10.32 N ATOM 2127 NH2 ARG A 129 0.728 12.883 32.852 1.00 71.33 N ATOM 0 H ARG A 129 2.656 10.513 27.771 1.00 2.32 H new ATOM 0 HA ARG A 129 0.804 10.674 29.864 1.00 20.32 H new ATOM 0 HB2 ARG A 129 0.496 11.195 26.881 1.00 3.12 H new ATOM 0 HB3 ARG A 129 -0.652 11.706 28.102 1.00 3.12 H new ATOM 0 HG2 ARG A 129 2.236 12.536 28.357 1.00 35.40 H new ATOM 0 HG3 ARG A 129 1.201 13.366 27.211 1.00 35.40 H new ATOM 0 HD2 ARG A 129 0.972 14.646 29.173 1.00 25.41 H new ATOM 0 HD3 ARG A 129 -0.469 13.648 29.170 1.00 25.41 H new ATOM 0 HE ARG A 129 1.769 12.447 30.635 1.00 50.21 H new ATOM 0 HH11 ARG A 129 -0.996 14.638 30.775 1.00 10.32 H new ATOM 0 HH12 ARG A 129 -1.184 14.474 32.524 1.00 10.32 H new ATOM 0 HH21 ARG A 129 1.521 12.242 32.881 1.00 71.33 H new ATOM 0 HH22 ARG A 129 0.235 13.124 33.712 1.00 71.33 H new ATOM 2141 N SER A 130 0.128 8.403 27.572 1.00 73.35 N ATOM 2142 CA SER A 130 -0.699 7.237 27.282 1.00 63.22 C ATOM 2143 C SER A 130 -0.759 6.301 28.485 1.00 22.13 C ATOM 2144 O SER A 130 -1.812 5.747 28.804 1.00 63.44 O ATOM 2145 CB SER A 130 -0.152 6.487 26.065 1.00 2.24 C ATOM 2146 OG SER A 130 0.823 5.534 26.450 1.00 22.51 O ATOM 0 H SER A 130 0.866 8.577 26.890 1.00 73.35 H new ATOM 0 HA SER A 130 -1.709 7.584 27.063 1.00 63.22 H new ATOM 0 HB2 SER A 130 -0.969 5.987 25.545 1.00 2.24 H new ATOM 0 HB3 SER A 130 0.286 7.197 25.363 1.00 2.24 H new ATOM 0 HG SER A 130 1.711 5.948 26.431 1.00 22.51 H new ATOM 2152 N LEU A 131 0.378 6.130 29.151 1.00 61.44 N ATOM 2153 CA LEU A 131 0.457 5.261 30.320 1.00 71.00 C ATOM 2154 C LEU A 131 -0.030 5.986 31.571 1.00 72.24 C ATOM 2155 O LEU A 131 -0.599 5.373 32.473 1.00 23.25 O ATOM 2156 CB LEU A 131 1.893 4.777 30.524 1.00 24.32 C ATOM 2157 CG LEU A 131 2.679 4.451 29.253 1.00 1.25 C ATOM 2158 CD1 LEU A 131 4.038 3.865 29.602 1.00 45.13 C ATOM 2159 CD2 LEU A 131 1.893 3.492 28.371 1.00 11.33 C ATOM 0 H LEU A 131 1.258 6.582 28.901 1.00 61.44 H new ATOM 0 HA LEU A 131 -0.189 4.400 30.147 1.00 71.00 H new ATOM 0 HB2 LEU A 131 2.438 5.542 31.078 1.00 24.32 H new ATOM 0 HB3 LEU A 131 1.869 3.886 31.151 1.00 24.32 H new ATOM 0 HG LEU A 131 2.837 5.376 28.699 1.00 1.25 H new ATOM 0 HD11 LEU A 131 4.583 3.639 28.685 1.00 45.13 H new ATOM 0 HD12 LEU A 131 4.604 4.585 30.193 1.00 45.13 H new ATOM 0 HD13 LEU A 131 3.902 2.950 30.178 1.00 45.13 H new ATOM 0 HD21 LEU A 131 2.467 3.271 27.471 1.00 11.33 H new ATOM 0 HD22 LEU A 131 1.704 2.568 28.917 1.00 11.33 H new ATOM 0 HD23 LEU A 131 0.944 3.949 28.092 1.00 11.33 H new