USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1162 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 17 SER OG : rot 95:sc= 0.206 USER MOD Set 1.2: A 154 ASN : amide:sc= 1.18 K(o=1.4,f=0.25) USER MOD Set 2.1: A 148 GLN : amide:sc= 0.227 K(o=0.43,f=-2.3) USER MOD Set 2.2: A 151 LYS NZ :NH3+ -173:sc= 0.206 (180deg=0) USER MOD Set 3.1: A 143 ASN : amide:sc= -0.0134 X(o=-0.17,f=-0.16) USER MOD Set 3.2: A 147 ASN : amide:sc= -0.156 K(o=-0.17,f=-5!) USER MOD Set 4.1: A 104 HIS : no HD1:sc= 0.605 K(o=0.7,f=-2.2!) USER MOD Set 4.2: A 123 THR OG1 : rot 83:sc= 0.0973 USER MOD Set 5.1: A 76 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Set 5.2: A 82 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 52 THR OG1 : rot 180:sc= -0.106 USER MOD Set 6.2: A 53 LYS NZ :NH3+ -124:sc= 0.868 (180deg=-0.00713) USER MOD Set 7.1: A 15 THR OG1 : rot -63:sc= 0.385 USER MOD Set 7.2: A 117 THR OG1 : rot 61:sc= 0.446 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 22 LYS NZ :NH3+ -140:sc= -0.723 (180deg=-2.85!) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -84:sc= -1.68! USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0.0856 X(o=0.086,f=0) USER MOD Single : A 38 HIS : no HD1:sc= -0.0029 X(o=-0.0029,f=-0.37) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 56 SER OG : rot -77:sc= 0.213 USER MOD Single : A 59 TYR OH : rot 54:sc= 0.324 USER MOD Single : A 62 GLN :FLIP amide:sc= -0.0945 F(o=-1.5,f=-0.095) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 MET CE :methyl 162:sc= -0.0982 (180deg=-0.495) USER MOD Single : A 68 SER OG : rot 180:sc= -0.397 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0131 USER MOD Single : A 74 TYR OH : rot 69:sc= 0.495 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -150:sc= 0.808 (180deg=0.274) USER MOD Single : A 98 THR OG1 : rot -62:sc= 0.371 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -157:sc= -0.232 (180deg=-0.757) USER MOD Single : A 103 MET CE :methyl -171:sc= -2.21 (180deg=-2.26) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.027 X(o=-0.027,f=0.15) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -110:sc= -1.4! USER MOD Single : A 119 THR OG1 : rot -168:sc= 0.201 USER MOD Single : A 120 SER OG : rot 30:sc= -0.266 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.205 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc=-0.00469 X(o=-0.0047,f=-0.49) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 MET CE :methyl -166:sc= -0.0887 (180deg=-0.422) USER MOD Single : A 140 THR OG1 : rot -53:sc= 0.0211 USER MOD Single : A 142 MET CE :methyl -120:sc= -0.787 (180deg=-2.57) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 THR OG1 : rot -72:sc= 0.00208 USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 3.259 -14.762 -2.797 1.00 25.20 N ATOM 35 CA ILE A 3 4.405 -13.827 -3.013 1.00 44.25 C ATOM 36 C ILE A 3 5.580 -14.487 -3.794 1.00 4.12 C ATOM 37 O ILE A 3 5.755 -15.709 -3.785 1.00 44.12 O ATOM 38 CB ILE A 3 4.962 -13.219 -1.657 1.00 22.44 C ATOM 39 CG1 ILE A 3 5.367 -14.339 -0.643 1.00 14.32 C ATOM 40 CG2 ILE A 3 3.943 -12.247 -1.023 1.00 33.11 C ATOM 41 CD1 ILE A 3 6.026 -13.834 0.642 1.00 33.11 C ATOM 0 HA ILE A 3 3.994 -13.018 -3.617 1.00 44.25 H new ATOM 0 HB ILE A 3 5.863 -12.656 -1.902 1.00 22.44 H new ATOM 0 HG12 ILE A 3 4.476 -14.909 -0.378 1.00 14.32 H new ATOM 0 HG13 ILE A 3 6.051 -15.028 -1.139 1.00 14.32 H new ATOM 0 HG21 ILE A 3 4.351 -11.846 -0.095 1.00 33.11 H new ATOM 0 HG22 ILE A 3 3.742 -11.429 -1.715 1.00 33.11 H new ATOM 0 HG23 ILE A 3 3.016 -12.779 -0.811 1.00 33.11 H new ATOM 0 HD11 ILE A 3 6.271 -14.681 1.282 1.00 33.11 H new ATOM 0 HD12 ILE A 3 6.938 -13.291 0.394 1.00 33.11 H new ATOM 0 HD13 ILE A 3 5.339 -13.170 1.166 1.00 33.11 H new ATOM 53 N GLU A 4 6.376 -13.636 -4.475 1.00 52.13 N ATOM 54 CA GLU A 4 7.632 -14.024 -5.163 1.00 54.25 C ATOM 55 C GLU A 4 8.777 -13.094 -4.686 1.00 3.20 C ATOM 56 O GLU A 4 8.756 -11.897 -4.942 1.00 64.24 O ATOM 57 CB GLU A 4 7.451 -13.941 -6.708 1.00 23.05 C ATOM 58 CG GLU A 4 8.714 -14.279 -7.535 1.00 74.42 C ATOM 59 CD GLU A 4 9.257 -15.700 -7.280 1.00 34.13 C ATOM 60 OE1 GLU A 4 8.828 -16.647 -7.968 1.00 62.44 O ATOM 61 OE2 GLU A 4 10.116 -15.878 -6.379 1.00 12.20 O ATOM 0 H GLU A 4 6.163 -12.643 -4.566 1.00 52.13 H new ATOM 0 HA GLU A 4 7.885 -15.055 -4.915 1.00 54.25 H new ATOM 0 HB2 GLU A 4 6.651 -14.620 -7.002 1.00 23.05 H new ATOM 0 HB3 GLU A 4 7.125 -12.934 -6.967 1.00 23.05 H new ATOM 0 HG2 GLU A 4 8.483 -14.172 -8.595 1.00 74.42 H new ATOM 0 HG3 GLU A 4 9.494 -13.554 -7.304 1.00 74.42 H new ATOM 68 N LYS A 5 9.786 -13.650 -3.997 1.00 73.54 N ATOM 69 CA LYS A 5 10.728 -12.844 -3.178 1.00 62.35 C ATOM 70 C LYS A 5 12.153 -12.800 -3.781 1.00 11.23 C ATOM 71 O LYS A 5 12.910 -13.776 -3.688 1.00 53.41 O ATOM 72 CB LYS A 5 10.765 -13.390 -1.724 1.00 31.54 C ATOM 73 CG LYS A 5 9.368 -13.686 -1.096 1.00 50.41 C ATOM 74 CD LYS A 5 8.854 -15.127 -1.371 1.00 71.22 C ATOM 75 CE LYS A 5 9.679 -16.212 -0.658 1.00 43.31 C ATOM 76 NZ LYS A 5 9.122 -17.570 -0.895 1.00 1.44 N ATOM 0 H LYS A 5 9.977 -14.652 -3.986 1.00 73.54 H new ATOM 0 HA LYS A 5 10.360 -11.818 -3.172 1.00 62.35 H new ATOM 0 HB2 LYS A 5 11.354 -14.307 -1.711 1.00 31.54 H new ATOM 0 HB3 LYS A 5 11.285 -12.668 -1.094 1.00 31.54 H new ATOM 0 HG2 LYS A 5 9.423 -13.528 -0.019 1.00 50.41 H new ATOM 0 HG3 LYS A 5 8.644 -12.971 -1.487 1.00 50.41 H new ATOM 0 HD2 LYS A 5 7.814 -15.202 -1.052 1.00 71.22 H new ATOM 0 HD3 LYS A 5 8.872 -15.313 -2.445 1.00 71.22 H new ATOM 0 HE2 LYS A 5 10.710 -16.175 -1.009 1.00 43.31 H new ATOM 0 HE3 LYS A 5 9.700 -16.009 0.413 1.00 43.31 H new ATOM 0 HZ1 LYS A 5 9.704 -18.275 -0.399 1.00 1.44 H new ATOM 0 HZ2 LYS A 5 8.146 -17.612 -0.537 1.00 1.44 H new ATOM 0 HZ3 LYS A 5 9.126 -17.774 -1.915 1.00 1.44 H new ATOM 90 N LYS A 6 12.507 -11.654 -4.397 1.00 72.53 N ATOM 91 CA LYS A 6 13.829 -11.433 -5.031 1.00 52.25 C ATOM 92 C LYS A 6 14.772 -10.606 -4.107 1.00 2.24 C ATOM 93 O LYS A 6 14.865 -9.376 -4.236 1.00 35.05 O ATOM 94 CB LYS A 6 13.652 -10.728 -6.409 1.00 53.01 C ATOM 95 CG LYS A 6 12.660 -11.430 -7.373 1.00 54.34 C ATOM 96 CD LYS A 6 12.636 -10.808 -8.793 1.00 54.44 C ATOM 97 CE LYS A 6 12.279 -9.308 -8.804 1.00 60.14 C ATOM 98 NZ LYS A 6 12.169 -8.778 -10.188 1.00 4.21 N ATOM 0 H LYS A 6 11.883 -10.850 -4.471 1.00 72.53 H new ATOM 0 HA LYS A 6 14.295 -12.405 -5.190 1.00 52.25 H new ATOM 0 HB2 LYS A 6 13.311 -9.707 -6.238 1.00 53.01 H new ATOM 0 HB3 LYS A 6 14.625 -10.662 -6.896 1.00 53.01 H new ATOM 0 HG2 LYS A 6 12.925 -12.484 -7.451 1.00 54.34 H new ATOM 0 HG3 LYS A 6 11.658 -11.384 -6.947 1.00 54.34 H new ATOM 0 HD2 LYS A 6 13.613 -10.944 -9.257 1.00 54.44 H new ATOM 0 HD3 LYS A 6 11.915 -11.349 -9.405 1.00 54.44 H new ATOM 0 HE2 LYS A 6 11.336 -9.155 -8.280 1.00 60.14 H new ATOM 0 HE3 LYS A 6 13.040 -8.749 -8.260 1.00 60.14 H new ATOM 0 HZ1 LYS A 6 11.928 -7.767 -10.154 1.00 4.21 H new ATOM 0 HZ2 LYS A 6 13.077 -8.901 -10.680 1.00 4.21 H new ATOM 0 HZ3 LYS A 6 11.425 -9.294 -10.699 1.00 4.21 H new ATOM 112 N LYS A 7 15.427 -11.310 -3.158 1.00 41.42 N ATOM 113 CA LYS A 7 16.452 -10.755 -2.226 1.00 62.43 C ATOM 114 C LYS A 7 15.902 -9.622 -1.297 1.00 50.42 C ATOM 115 O LYS A 7 15.484 -9.898 -0.162 1.00 23.52 O ATOM 116 CB LYS A 7 17.739 -10.313 -2.989 1.00 20.43 C ATOM 117 CG LYS A 7 18.427 -11.452 -3.787 1.00 12.25 C ATOM 118 CD LYS A 7 19.760 -11.015 -4.441 1.00 65.53 C ATOM 119 CE LYS A 7 20.838 -10.650 -3.402 1.00 11.23 C ATOM 120 NZ LYS A 7 22.103 -10.204 -4.033 1.00 2.22 N ATOM 0 H LYS A 7 15.259 -12.305 -3.009 1.00 41.42 H new ATOM 0 HA LYS A 7 16.726 -11.571 -1.558 1.00 62.43 H new ATOM 0 HB2 LYS A 7 17.482 -9.507 -3.676 1.00 20.43 H new ATOM 0 HB3 LYS A 7 18.451 -9.905 -2.272 1.00 20.43 H new ATOM 0 HG2 LYS A 7 18.615 -12.293 -3.120 1.00 12.25 H new ATOM 0 HG3 LYS A 7 17.748 -11.806 -4.562 1.00 12.25 H new ATOM 0 HD2 LYS A 7 20.130 -11.820 -5.076 1.00 65.53 H new ATOM 0 HD3 LYS A 7 19.579 -10.157 -5.088 1.00 65.53 H new ATOM 0 HE2 LYS A 7 20.460 -9.860 -2.753 1.00 11.23 H new ATOM 0 HE3 LYS A 7 21.036 -11.515 -2.769 1.00 11.23 H new ATOM 0 HZ1 LYS A 7 22.796 -9.970 -3.294 1.00 2.22 H new ATOM 0 HZ2 LYS A 7 22.480 -10.966 -4.632 1.00 2.22 H new ATOM 0 HZ3 LYS A 7 21.922 -9.362 -4.617 1.00 2.22 H new ATOM 134 N ASN A 8 15.899 -8.352 -1.774 1.00 33.32 N ATOM 135 CA ASN A 8 15.354 -7.197 -1.001 1.00 52.30 C ATOM 136 C ASN A 8 14.000 -6.719 -1.583 1.00 33.32 C ATOM 137 O ASN A 8 13.562 -5.606 -1.304 1.00 62.21 O ATOM 138 CB ASN A 8 16.379 -6.028 -0.947 1.00 64.45 C ATOM 139 CG ASN A 8 16.659 -5.403 -2.318 1.00 64.32 C ATOM 140 OD1 ASN A 8 17.514 -5.873 -3.062 1.00 3.15 O ATOM 141 ND2 ASN A 8 15.953 -4.338 -2.657 1.00 14.01 N ATOM 0 H ASN A 8 16.267 -8.097 -2.690 1.00 33.32 H new ATOM 0 HA ASN A 8 15.176 -7.537 0.019 1.00 52.30 H new ATOM 0 HB2 ASN A 8 16.005 -5.257 -0.274 1.00 64.45 H new ATOM 0 HB3 ASN A 8 17.315 -6.394 -0.524 1.00 64.45 H new ATOM 0 HD21 ASN A 8 16.113 -3.886 -3.557 1.00 14.01 H new ATOM 0 HD22 ASN A 8 15.248 -3.969 -2.019 1.00 14.01 H new ATOM 148 N LYS A 9 13.333 -7.585 -2.365 1.00 51.24 N ATOM 149 CA LYS A 9 11.991 -7.307 -2.935 1.00 41.50 C ATOM 150 C LYS A 9 11.014 -8.468 -2.657 1.00 33.34 C ATOM 151 O LYS A 9 11.360 -9.631 -2.834 1.00 53.21 O ATOM 152 CB LYS A 9 12.083 -7.024 -4.470 1.00 74.40 C ATOM 153 CG LYS A 9 12.704 -5.650 -4.808 1.00 61.31 C ATOM 154 CD LYS A 9 12.675 -5.292 -6.315 1.00 42.24 C ATOM 155 CE LYS A 9 13.760 -6.003 -7.138 1.00 11.42 C ATOM 156 NZ LYS A 9 13.833 -5.459 -8.520 1.00 5.12 N ATOM 0 H LYS A 9 13.704 -8.499 -2.623 1.00 51.24 H new ATOM 0 HA LYS A 9 11.603 -6.414 -2.444 1.00 41.50 H new ATOM 0 HB2 LYS A 9 12.677 -7.808 -4.941 1.00 74.40 H new ATOM 0 HB3 LYS A 9 11.084 -7.078 -4.902 1.00 74.40 H new ATOM 0 HG2 LYS A 9 12.172 -4.877 -4.252 1.00 61.31 H new ATOM 0 HG3 LYS A 9 13.738 -5.637 -4.463 1.00 61.31 H new ATOM 0 HD2 LYS A 9 11.697 -5.548 -6.722 1.00 42.24 H new ATOM 0 HD3 LYS A 9 12.795 -4.214 -6.426 1.00 42.24 H new ATOM 0 HE2 LYS A 9 14.726 -5.886 -6.647 1.00 11.42 H new ATOM 0 HE3 LYS A 9 13.549 -7.072 -7.176 1.00 11.42 H new ATOM 0 HZ1 LYS A 9 14.574 -5.959 -9.051 1.00 5.12 H new ATOM 0 HZ2 LYS A 9 12.917 -5.593 -8.995 1.00 5.12 H new ATOM 0 HZ3 LYS A 9 14.058 -4.444 -8.482 1.00 5.12 H new ATOM 170 N ILE A 10 9.789 -8.127 -2.217 1.00 31.15 N ATOM 171 CA ILE A 10 8.668 -9.080 -2.071 1.00 33.34 C ATOM 172 C ILE A 10 7.537 -8.670 -3.045 1.00 5.55 C ATOM 173 O ILE A 10 6.859 -7.656 -2.848 1.00 51.34 O ATOM 174 CB ILE A 10 8.139 -9.138 -0.578 1.00 74.32 C ATOM 175 CG1 ILE A 10 9.248 -9.705 0.378 1.00 13.23 C ATOM 176 CG2 ILE A 10 6.828 -9.964 -0.456 1.00 1.41 C ATOM 177 CD1 ILE A 10 8.855 -9.790 1.847 1.00 72.44 C ATOM 0 H ILE A 10 9.545 -7.173 -1.950 1.00 31.15 H new ATOM 0 HA ILE A 10 9.020 -10.082 -2.317 1.00 33.34 H new ATOM 0 HB ILE A 10 7.905 -8.118 -0.275 1.00 74.32 H new ATOM 0 HG12 ILE A 10 9.527 -10.701 0.035 1.00 13.23 H new ATOM 0 HG13 ILE A 10 10.135 -9.078 0.291 1.00 13.23 H new ATOM 0 HG21 ILE A 10 6.502 -9.977 0.584 1.00 1.41 H new ATOM 0 HG22 ILE A 10 6.053 -9.510 -1.074 1.00 1.41 H new ATOM 0 HG23 ILE A 10 7.009 -10.985 -0.792 1.00 1.41 H new ATOM 0 HD11 ILE A 10 9.687 -10.193 2.424 1.00 72.44 H new ATOM 0 HD12 ILE A 10 8.607 -8.795 2.215 1.00 72.44 H new ATOM 0 HD13 ILE A 10 7.989 -10.443 1.955 1.00 72.44 H new ATOM 189 N ILE A 11 7.396 -9.442 -4.128 1.00 12.34 N ATOM 190 CA ILE A 11 6.339 -9.256 -5.136 1.00 72.12 C ATOM 191 C ILE A 11 5.016 -9.865 -4.607 1.00 11.20 C ATOM 192 O ILE A 11 4.862 -11.083 -4.564 1.00 21.24 O ATOM 193 CB ILE A 11 6.772 -9.938 -6.493 1.00 42.34 C ATOM 194 CG1 ILE A 11 8.113 -9.326 -7.013 1.00 74.15 C ATOM 195 CG2 ILE A 11 5.675 -9.852 -7.574 1.00 50.24 C ATOM 196 CD1 ILE A 11 8.693 -10.027 -8.227 1.00 53.24 C ATOM 0 H ILE A 11 8.018 -10.223 -4.334 1.00 12.34 H new ATOM 0 HA ILE A 11 6.185 -8.193 -5.322 1.00 72.12 H new ATOM 0 HB ILE A 11 6.925 -10.997 -6.283 1.00 42.34 H new ATOM 0 HG12 ILE A 11 7.948 -8.277 -7.259 1.00 74.15 H new ATOM 0 HG13 ILE A 11 8.847 -9.353 -6.208 1.00 74.15 H new ATOM 0 HG21 ILE A 11 6.024 -10.336 -8.486 1.00 50.24 H new ATOM 0 HG22 ILE A 11 4.775 -10.353 -7.219 1.00 50.24 H new ATOM 0 HG23 ILE A 11 5.450 -8.806 -7.782 1.00 50.24 H new ATOM 0 HD11 ILE A 11 9.622 -9.538 -8.520 1.00 53.24 H new ATOM 0 HD12 ILE A 11 8.894 -11.070 -7.983 1.00 53.24 H new ATOM 0 HD13 ILE A 11 7.981 -9.977 -9.051 1.00 53.24 H new ATOM 208 N PHE A 12 4.074 -9.003 -4.212 1.00 21.12 N ATOM 209 CA PHE A 12 2.827 -9.410 -3.530 1.00 62.22 C ATOM 210 C PHE A 12 1.663 -9.439 -4.534 1.00 24.33 C ATOM 211 O PHE A 12 1.479 -8.489 -5.282 1.00 12.42 O ATOM 212 CB PHE A 12 2.502 -8.409 -2.377 1.00 20.44 C ATOM 213 CG PHE A 12 1.572 -8.975 -1.297 1.00 74.34 C ATOM 214 CD1 PHE A 12 0.190 -9.003 -1.469 1.00 51.31 C ATOM 215 CD2 PHE A 12 2.087 -9.488 -0.109 1.00 44.32 C ATOM 216 CE1 PHE A 12 -0.635 -9.526 -0.494 1.00 1.03 C ATOM 217 CE2 PHE A 12 1.257 -10.004 0.862 1.00 21.41 C ATOM 218 CZ PHE A 12 -0.100 -10.025 0.669 1.00 14.51 C ATOM 0 H PHE A 12 4.149 -7.996 -4.354 1.00 21.12 H new ATOM 0 HA PHE A 12 2.962 -10.408 -3.112 1.00 62.22 H new ATOM 0 HB2 PHE A 12 3.435 -8.096 -1.909 1.00 20.44 H new ATOM 0 HB3 PHE A 12 2.044 -7.517 -2.804 1.00 20.44 H new ATOM 0 HD1 PHE A 12 -0.242 -8.610 -2.378 1.00 51.31 H new ATOM 0 HD2 PHE A 12 3.155 -9.481 0.054 1.00 44.32 H new ATOM 0 HE1 PHE A 12 -1.704 -9.543 -0.646 1.00 1.03 H new ATOM 0 HE2 PHE A 12 1.677 -10.393 1.778 1.00 21.41 H new ATOM 0 HZ PHE A 12 -0.748 -10.433 1.430 1.00 14.51 H new ATOM 228 N THR A 13 0.867 -10.514 -4.524 1.00 63.22 N ATOM 229 CA THR A 13 -0.335 -10.636 -5.388 1.00 74.52 C ATOM 230 C THR A 13 -1.548 -11.149 -4.577 1.00 22.35 C ATOM 231 O THR A 13 -1.449 -12.127 -3.822 1.00 11.54 O ATOM 232 CB THR A 13 -0.067 -11.546 -6.640 1.00 2.30 C ATOM 233 OG1 THR A 13 -1.273 -11.730 -7.396 1.00 15.32 O ATOM 234 CG2 THR A 13 0.514 -12.921 -6.273 1.00 63.31 C ATOM 0 H THR A 13 1.027 -11.324 -3.925 1.00 63.22 H new ATOM 0 HA THR A 13 -0.570 -9.639 -5.760 1.00 74.52 H new ATOM 0 HB THR A 13 0.679 -11.024 -7.240 1.00 2.30 H new ATOM 0 HG1 THR A 13 -1.088 -12.298 -8.173 1.00 15.32 H new ATOM 0 HG21 THR A 13 0.676 -13.502 -7.181 1.00 63.31 H new ATOM 0 HG22 THR A 13 1.463 -12.788 -5.753 1.00 63.31 H new ATOM 0 HG23 THR A 13 -0.184 -13.450 -5.624 1.00 63.31 H new ATOM 242 N ARG A 14 -2.693 -10.452 -4.725 1.00 42.52 N ATOM 243 CA ARG A 14 -3.940 -10.755 -3.991 1.00 51.41 C ATOM 244 C ARG A 14 -5.150 -10.374 -4.874 1.00 62.05 C ATOM 245 O ARG A 14 -5.210 -9.262 -5.414 1.00 75.43 O ATOM 246 CB ARG A 14 -3.943 -9.991 -2.624 1.00 1.54 C ATOM 247 CG ARG A 14 -4.911 -10.514 -1.512 1.00 42.43 C ATOM 248 CD ARG A 14 -6.397 -10.193 -1.759 1.00 35.11 C ATOM 249 NE ARG A 14 -7.265 -10.560 -0.620 1.00 52.04 N ATOM 250 CZ ARG A 14 -8.581 -10.453 -0.613 1.00 2.32 C ATOM 251 NH1 ARG A 14 -9.219 -10.059 -1.665 1.00 31.21 N ATOM 252 NH2 ARG A 14 -9.242 -10.754 0.453 1.00 61.11 N ATOM 0 H ARG A 14 -2.780 -9.659 -5.360 1.00 42.52 H new ATOM 0 HA ARG A 14 -4.007 -11.820 -3.770 1.00 51.41 H new ATOM 0 HB2 ARG A 14 -2.929 -10.010 -2.225 1.00 1.54 H new ATOM 0 HB3 ARG A 14 -4.188 -8.947 -2.821 1.00 1.54 H new ATOM 0 HG2 ARG A 14 -4.795 -11.594 -1.425 1.00 42.43 H new ATOM 0 HG3 ARG A 14 -4.613 -10.083 -0.556 1.00 42.43 H new ATOM 0 HD2 ARG A 14 -6.504 -9.127 -1.961 1.00 35.11 H new ATOM 0 HD3 ARG A 14 -6.734 -10.722 -2.650 1.00 35.11 H new ATOM 0 HE ARG A 14 -6.815 -10.922 0.221 1.00 52.04 H new ATOM 0 HH11 ARG A 14 -8.706 -9.826 -2.515 1.00 31.21 H new ATOM 0 HH12 ARG A 14 -10.236 -9.981 -1.645 1.00 31.21 H new ATOM 0 HH21 ARG A 14 -8.748 -11.073 1.286 1.00 61.11 H new ATOM 0 HH22 ARG A 14 -10.259 -10.673 0.463 1.00 61.11 H new ATOM 266 N THR A 15 -6.108 -11.299 -5.007 1.00 44.13 N ATOM 267 CA THR A 15 -7.282 -11.136 -5.895 1.00 22.24 C ATOM 268 C THR A 15 -8.499 -10.544 -5.135 1.00 25.13 C ATOM 269 O THR A 15 -9.032 -11.174 -4.221 1.00 64.32 O ATOM 270 CB THR A 15 -7.668 -12.512 -6.545 1.00 62.54 C ATOM 271 OG1 THR A 15 -6.522 -13.054 -7.223 1.00 25.42 O ATOM 272 CG2 THR A 15 -8.829 -12.390 -7.547 1.00 43.43 C ATOM 0 H THR A 15 -6.098 -12.186 -4.504 1.00 44.13 H new ATOM 0 HA THR A 15 -7.006 -10.432 -6.680 1.00 22.24 H new ATOM 0 HB THR A 15 -7.996 -13.169 -5.740 1.00 62.54 H new ATOM 0 HG1 THR A 15 -6.259 -12.454 -7.952 1.00 25.42 H new ATOM 0 HG21 THR A 15 -9.053 -13.371 -7.965 1.00 43.43 H new ATOM 0 HG22 THR A 15 -9.711 -12.003 -7.037 1.00 43.43 H new ATOM 0 HG23 THR A 15 -8.547 -11.709 -8.350 1.00 43.43 H new ATOM 280 N PHE A 16 -8.915 -9.326 -5.524 1.00 54.41 N ATOM 281 CA PHE A 16 -10.082 -8.620 -4.932 1.00 61.14 C ATOM 282 C PHE A 16 -11.331 -8.791 -5.831 1.00 41.02 C ATOM 283 O PHE A 16 -11.226 -8.690 -7.059 1.00 11.43 O ATOM 284 CB PHE A 16 -9.778 -7.102 -4.786 1.00 14.22 C ATOM 285 CG PHE A 16 -8.460 -6.796 -4.085 1.00 10.12 C ATOM 286 CD1 PHE A 16 -8.355 -6.873 -2.700 1.00 43.31 C ATOM 287 CD2 PHE A 16 -7.322 -6.444 -4.818 1.00 11.44 C ATOM 288 CE1 PHE A 16 -7.160 -6.605 -2.071 1.00 34.01 C ATOM 289 CE2 PHE A 16 -6.126 -6.179 -4.184 1.00 73.15 C ATOM 290 CZ PHE A 16 -6.046 -6.258 -2.812 1.00 51.44 C ATOM 0 H PHE A 16 -8.453 -8.794 -6.262 1.00 54.41 H new ATOM 0 HA PHE A 16 -10.275 -9.054 -3.951 1.00 61.14 H new ATOM 0 HB2 PHE A 16 -9.764 -6.648 -5.777 1.00 14.22 H new ATOM 0 HB3 PHE A 16 -10.590 -6.631 -4.231 1.00 14.22 H new ATOM 0 HD1 PHE A 16 -9.219 -7.146 -2.112 1.00 43.31 H new ATOM 0 HD2 PHE A 16 -7.380 -6.379 -5.894 1.00 11.44 H new ATOM 0 HE1 PHE A 16 -7.093 -6.666 -0.995 1.00 34.01 H new ATOM 0 HE2 PHE A 16 -5.255 -5.910 -4.763 1.00 73.15 H new ATOM 0 HZ PHE A 16 -5.111 -6.048 -2.314 1.00 51.44 H new ATOM 300 N SER A 17 -12.504 -9.046 -5.222 1.00 52.34 N ATOM 301 CA SER A 17 -13.796 -9.023 -5.948 1.00 52.23 C ATOM 302 C SER A 17 -14.325 -7.564 -6.044 1.00 31.41 C ATOM 303 O SER A 17 -14.994 -7.065 -5.129 1.00 11.44 O ATOM 304 CB SER A 17 -14.820 -9.942 -5.229 1.00 44.10 C ATOM 305 OG SER A 17 -15.022 -9.553 -3.874 1.00 43.03 O ATOM 0 H SER A 17 -12.588 -9.270 -4.231 1.00 52.34 H new ATOM 0 HA SER A 17 -13.650 -9.399 -6.961 1.00 52.23 H new ATOM 0 HB2 SER A 17 -15.771 -9.912 -5.761 1.00 44.10 H new ATOM 0 HB3 SER A 17 -14.468 -10.973 -5.262 1.00 44.10 H new ATOM 0 HG SER A 17 -15.806 -8.967 -3.815 1.00 43.03 H new ATOM 311 N ALA A 18 -14.012 -6.891 -7.172 1.00 1.02 N ATOM 312 CA ALA A 18 -14.337 -5.456 -7.378 1.00 63.02 C ATOM 313 C ALA A 18 -14.079 -5.008 -8.843 1.00 24.11 C ATOM 314 O ALA A 18 -13.318 -5.660 -9.567 1.00 23.33 O ATOM 315 CB ALA A 18 -13.527 -4.560 -6.404 1.00 43.22 C ATOM 0 H ALA A 18 -13.530 -7.320 -7.962 1.00 1.02 H new ATOM 0 HA ALA A 18 -15.401 -5.339 -7.171 1.00 63.02 H new ATOM 0 HB1 ALA A 18 -13.782 -3.514 -6.574 1.00 43.22 H new ATOM 0 HB2 ALA A 18 -13.768 -4.830 -5.376 1.00 43.22 H new ATOM 0 HB3 ALA A 18 -12.461 -4.706 -6.577 1.00 43.22 H new ATOM 321 N PRO A 19 -14.769 -3.915 -9.320 1.00 11.14 N ATOM 322 CA PRO A 19 -14.393 -3.191 -10.575 1.00 42.41 C ATOM 323 C PRO A 19 -13.072 -2.371 -10.433 1.00 32.33 C ATOM 324 O PRO A 19 -12.806 -1.799 -9.371 1.00 15.41 O ATOM 325 CB PRO A 19 -15.614 -2.262 -10.809 1.00 14.11 C ATOM 326 CG PRO A 19 -16.150 -2.021 -9.432 1.00 1.14 C ATOM 327 CD PRO A 19 -16.016 -3.344 -8.722 1.00 72.51 C ATOM 0 HA PRO A 19 -14.189 -3.871 -11.402 1.00 42.41 H new ATOM 0 HB2 PRO A 19 -15.321 -1.330 -11.293 1.00 14.11 H new ATOM 0 HB3 PRO A 19 -16.358 -2.734 -11.451 1.00 14.11 H new ATOM 0 HG2 PRO A 19 -15.587 -1.240 -8.921 1.00 1.14 H new ATOM 0 HG3 PRO A 19 -17.189 -1.695 -9.465 1.00 1.14 H new ATOM 0 HD2 PRO A 19 -15.926 -3.217 -7.643 1.00 72.51 H new ATOM 0 HD3 PRO A 19 -16.879 -3.986 -8.896 1.00 72.51 H new ATOM 335 N ILE A 20 -12.293 -2.281 -11.536 1.00 61.15 N ATOM 336 CA ILE A 20 -10.932 -1.655 -11.556 1.00 63.14 C ATOM 337 C ILE A 20 -10.926 -0.174 -11.090 1.00 10.34 C ATOM 338 O ILE A 20 -9.954 0.287 -10.480 1.00 52.35 O ATOM 339 CB ILE A 20 -10.281 -1.776 -13.000 1.00 54.31 C ATOM 340 CG1 ILE A 20 -8.818 -1.220 -13.049 1.00 31.23 C ATOM 341 CG2 ILE A 20 -11.151 -1.075 -14.065 1.00 21.14 C ATOM 342 CD1 ILE A 20 -7.870 -1.825 -12.039 1.00 24.04 C ATOM 0 H ILE A 20 -12.584 -2.639 -12.446 1.00 61.15 H new ATOM 0 HA ILE A 20 -10.333 -2.212 -10.835 1.00 63.14 H new ATOM 0 HB ILE A 20 -10.234 -2.841 -13.226 1.00 54.31 H new ATOM 0 HG12 ILE A 20 -8.415 -1.387 -14.048 1.00 31.23 H new ATOM 0 HG13 ILE A 20 -8.850 -0.142 -12.894 1.00 31.23 H new ATOM 0 HG21 ILE A 20 -10.680 -1.175 -15.043 1.00 21.14 H new ATOM 0 HG22 ILE A 20 -12.138 -1.536 -14.089 1.00 21.14 H new ATOM 0 HG23 ILE A 20 -11.250 -0.018 -13.816 1.00 21.14 H new ATOM 0 HD11 ILE A 20 -6.883 -1.376 -12.152 1.00 24.04 H new ATOM 0 HD12 ILE A 20 -8.242 -1.636 -11.032 1.00 24.04 H new ATOM 0 HD13 ILE A 20 -7.800 -2.900 -12.204 1.00 24.04 H new ATOM 354 N ASN A 21 -12.032 0.527 -11.353 1.00 63.04 N ATOM 355 CA ASN A 21 -12.162 1.972 -11.093 1.00 32.42 C ATOM 356 C ASN A 21 -11.938 2.306 -9.591 1.00 4.04 C ATOM 357 O ASN A 21 -11.037 3.078 -9.255 1.00 3.31 O ATOM 358 CB ASN A 21 -13.555 2.433 -11.582 1.00 13.13 C ATOM 359 CG ASN A 21 -13.782 3.940 -11.525 1.00 44.31 C ATOM 360 OD1 ASN A 21 -12.862 4.732 -11.642 1.00 32.21 O ATOM 361 ND2 ASN A 21 -15.021 4.351 -11.371 1.00 13.41 N ATOM 0 H ASN A 21 -12.871 0.109 -11.755 1.00 63.04 H new ATOM 0 HA ASN A 21 -11.389 2.512 -11.640 1.00 32.42 H new ATOM 0 HB2 ASN A 21 -13.694 2.097 -12.609 1.00 13.13 H new ATOM 0 HB3 ASN A 21 -14.318 1.941 -10.979 1.00 13.13 H new ATOM 0 HD21 ASN A 21 -15.228 5.350 -11.348 1.00 13.41 H new ATOM 0 HD22 ASN A 21 -15.776 3.671 -11.275 1.00 13.41 H new ATOM 368 N LYS A 22 -12.706 1.648 -8.699 1.00 61.24 N ATOM 369 CA LYS A 22 -12.608 1.872 -7.228 1.00 50.34 C ATOM 370 C LYS A 22 -11.295 1.303 -6.629 1.00 31.22 C ATOM 371 O LYS A 22 -10.788 1.813 -5.621 1.00 34.23 O ATOM 372 CB LYS A 22 -13.839 1.274 -6.485 1.00 10.30 C ATOM 373 CG LYS A 22 -14.176 -0.200 -6.812 1.00 31.34 C ATOM 374 CD LYS A 22 -15.266 -0.815 -5.885 1.00 54.33 C ATOM 375 CE LYS A 22 -16.690 -0.238 -6.090 1.00 11.21 C ATOM 376 NZ LYS A 22 -16.831 1.176 -5.654 1.00 11.20 N ATOM 0 H LYS A 22 -13.405 0.954 -8.965 1.00 61.24 H new ATOM 0 HA LYS A 22 -12.596 2.952 -7.080 1.00 50.34 H new ATOM 0 HB2 LYS A 22 -13.667 1.358 -5.412 1.00 10.30 H new ATOM 0 HB3 LYS A 22 -14.711 1.886 -6.717 1.00 10.30 H new ATOM 0 HG2 LYS A 22 -14.513 -0.265 -7.847 1.00 31.34 H new ATOM 0 HG3 LYS A 22 -13.267 -0.797 -6.734 1.00 31.34 H new ATOM 0 HD2 LYS A 22 -15.298 -1.892 -6.049 1.00 54.33 H new ATOM 0 HD3 LYS A 22 -14.971 -0.659 -4.847 1.00 54.33 H new ATOM 0 HE2 LYS A 22 -16.954 -0.311 -7.145 1.00 11.21 H new ATOM 0 HE3 LYS A 22 -17.404 -0.851 -5.540 1.00 11.21 H new ATOM 0 HZ1 LYS A 22 -17.748 1.303 -5.180 1.00 11.20 H new ATOM 0 HZ2 LYS A 22 -16.064 1.414 -4.993 1.00 11.20 H new ATOM 0 HZ3 LYS A 22 -16.780 1.802 -6.483 1.00 11.20 H new ATOM 390 N VAL A 23 -10.762 0.250 -7.267 1.00 60.32 N ATOM 391 CA VAL A 23 -9.515 -0.428 -6.834 1.00 10.34 C ATOM 392 C VAL A 23 -8.285 0.496 -7.003 1.00 52.25 C ATOM 393 O VAL A 23 -7.434 0.584 -6.115 1.00 23.34 O ATOM 394 CB VAL A 23 -9.320 -1.762 -7.642 1.00 61.03 C ATOM 395 CG1 VAL A 23 -7.977 -2.469 -7.308 1.00 53.21 C ATOM 396 CG2 VAL A 23 -10.512 -2.710 -7.391 1.00 64.51 C ATOM 0 H VAL A 23 -11.180 -0.162 -8.101 1.00 60.32 H new ATOM 0 HA VAL A 23 -9.606 -0.666 -5.774 1.00 10.34 H new ATOM 0 HB VAL A 23 -9.282 -1.501 -8.700 1.00 61.03 H new ATOM 0 HG11 VAL A 23 -7.893 -3.385 -7.893 1.00 53.21 H new ATOM 0 HG12 VAL A 23 -7.147 -1.806 -7.550 1.00 53.21 H new ATOM 0 HG13 VAL A 23 -7.949 -2.713 -6.246 1.00 53.21 H new ATOM 0 HG21 VAL A 23 -10.369 -3.632 -7.955 1.00 64.51 H new ATOM 0 HG22 VAL A 23 -10.576 -2.941 -6.328 1.00 64.51 H new ATOM 0 HG23 VAL A 23 -11.435 -2.227 -7.713 1.00 64.51 H new ATOM 406 N PHE A 24 -8.222 1.188 -8.150 1.00 32.34 N ATOM 407 CA PHE A 24 -7.170 2.187 -8.435 1.00 3.35 C ATOM 408 C PHE A 24 -7.298 3.409 -7.489 1.00 32.15 C ATOM 409 O PHE A 24 -6.289 3.949 -7.010 1.00 54.24 O ATOM 410 CB PHE A 24 -7.260 2.630 -9.916 1.00 43.22 C ATOM 411 CG PHE A 24 -6.216 3.668 -10.343 1.00 33.10 C ATOM 412 CD1 PHE A 24 -4.852 3.420 -10.174 1.00 62.22 C ATOM 413 CD2 PHE A 24 -6.596 4.885 -10.922 1.00 34.12 C ATOM 414 CE1 PHE A 24 -3.911 4.353 -10.571 1.00 72.32 C ATOM 415 CE2 PHE A 24 -5.651 5.811 -11.317 1.00 50.00 C ATOM 416 CZ PHE A 24 -4.310 5.544 -11.143 1.00 34.31 C ATOM 0 H PHE A 24 -8.895 1.075 -8.908 1.00 32.34 H new ATOM 0 HA PHE A 24 -6.196 1.731 -8.259 1.00 3.35 H new ATOM 0 HB2 PHE A 24 -7.157 1.750 -10.550 1.00 43.22 H new ATOM 0 HB3 PHE A 24 -8.254 3.039 -10.098 1.00 43.22 H new ATOM 0 HD1 PHE A 24 -4.529 2.491 -9.729 1.00 62.22 H new ATOM 0 HD2 PHE A 24 -7.645 5.103 -11.062 1.00 34.12 H new ATOM 0 HE1 PHE A 24 -2.860 4.149 -10.433 1.00 72.32 H new ATOM 0 HE2 PHE A 24 -5.963 6.744 -11.762 1.00 50.00 H new ATOM 0 HZ PHE A 24 -3.571 6.267 -11.454 1.00 34.31 H new ATOM 426 N ASP A 25 -8.556 3.818 -7.218 1.00 1.20 N ATOM 427 CA ASP A 25 -8.864 4.937 -6.299 1.00 43.22 C ATOM 428 C ASP A 25 -8.462 4.640 -4.831 1.00 42.41 C ATOM 429 O ASP A 25 -8.280 5.564 -4.040 1.00 64.20 O ATOM 430 CB ASP A 25 -10.358 5.324 -6.389 1.00 42.32 C ATOM 431 CG ASP A 25 -10.768 5.910 -7.744 1.00 1.42 C ATOM 432 OD1 ASP A 25 -9.982 6.687 -8.343 1.00 73.42 O ATOM 433 OD2 ASP A 25 -11.900 5.643 -8.203 1.00 63.25 O ATOM 0 H ASP A 25 -9.384 3.385 -7.627 1.00 1.20 H new ATOM 0 HA ASP A 25 -8.258 5.783 -6.624 1.00 43.22 H new ATOM 0 HB2 ASP A 25 -10.965 4.441 -6.188 1.00 42.32 H new ATOM 0 HB3 ASP A 25 -10.583 6.050 -5.608 1.00 42.32 H new ATOM 438 N ALA A 26 -8.333 3.349 -4.474 1.00 43.41 N ATOM 439 CA ALA A 26 -7.845 2.925 -3.135 1.00 75.11 C ATOM 440 C ALA A 26 -6.386 3.387 -2.869 1.00 24.31 C ATOM 441 O ALA A 26 -6.007 3.670 -1.727 1.00 1.14 O ATOM 442 CB ALA A 26 -7.962 1.402 -2.998 1.00 60.30 C ATOM 0 H ALA A 26 -8.560 2.572 -5.094 1.00 43.41 H new ATOM 0 HA ALA A 26 -8.472 3.406 -2.385 1.00 75.11 H new ATOM 0 HB1 ALA A 26 -7.603 1.096 -2.015 1.00 60.30 H new ATOM 0 HB2 ALA A 26 -9.005 1.105 -3.112 1.00 60.30 H new ATOM 0 HB3 ALA A 26 -7.361 0.920 -3.769 1.00 60.30 H new ATOM 448 N TYR A 27 -5.586 3.461 -3.951 1.00 54.24 N ATOM 449 CA TYR A 27 -4.152 3.841 -3.895 1.00 23.21 C ATOM 450 C TYR A 27 -3.924 5.330 -4.274 1.00 13.53 C ATOM 451 O TYR A 27 -2.811 5.847 -4.119 1.00 10.30 O ATOM 452 CB TYR A 27 -3.339 2.912 -4.843 1.00 51.32 C ATOM 453 CG TYR A 27 -3.519 1.412 -4.534 1.00 14.13 C ATOM 454 CD1 TYR A 27 -2.876 0.819 -3.445 1.00 74.04 C ATOM 455 CD2 TYR A 27 -4.350 0.598 -5.315 1.00 33.52 C ATOM 456 CE1 TYR A 27 -3.051 -0.520 -3.150 1.00 2.54 C ATOM 457 CE2 TYR A 27 -4.528 -0.742 -5.016 1.00 4.54 C ATOM 458 CZ TYR A 27 -3.876 -1.295 -3.935 1.00 1.34 C ATOM 459 OH TYR A 27 -4.049 -2.630 -3.630 1.00 63.32 O ATOM 0 H TYR A 27 -5.914 3.259 -4.895 1.00 54.24 H new ATOM 0 HA TYR A 27 -3.810 3.719 -2.867 1.00 23.21 H new ATOM 0 HB2 TYR A 27 -3.642 3.102 -5.873 1.00 51.32 H new ATOM 0 HB3 TYR A 27 -2.282 3.166 -4.769 1.00 51.32 H new ATOM 0 HD1 TYR A 27 -2.229 1.418 -2.821 1.00 74.04 H new ATOM 0 HD2 TYR A 27 -4.861 1.024 -6.166 1.00 33.52 H new ATOM 0 HE1 TYR A 27 -2.541 -0.958 -2.305 1.00 2.54 H new ATOM 0 HE2 TYR A 27 -5.176 -1.352 -5.628 1.00 4.54 H new ATOM 0 HH TYR A 27 -4.661 -3.037 -4.278 1.00 63.32 H new ATOM 469 N THR A 28 -4.979 6.011 -4.787 1.00 25.34 N ATOM 470 CA THR A 28 -4.880 7.425 -5.257 1.00 30.40 C ATOM 471 C THR A 28 -5.696 8.424 -4.421 1.00 22.41 C ATOM 472 O THR A 28 -5.411 9.632 -4.446 1.00 50.44 O ATOM 473 CB THR A 28 -5.309 7.581 -6.751 1.00 14.14 C ATOM 474 OG1 THR A 28 -6.579 6.968 -6.970 1.00 20.14 O ATOM 475 CG2 THR A 28 -4.274 6.986 -7.721 1.00 61.41 C ATOM 0 H THR A 28 -5.910 5.608 -4.888 1.00 25.34 H new ATOM 0 HA THR A 28 -3.823 7.664 -5.138 1.00 30.40 H new ATOM 0 HB THR A 28 -5.376 8.650 -6.952 1.00 14.14 H new ATOM 0 HG1 THR A 28 -6.456 6.008 -7.126 1.00 20.14 H new ATOM 0 HG21 THR A 28 -4.618 7.119 -8.747 1.00 61.41 H new ATOM 0 HG22 THR A 28 -3.318 7.494 -7.590 1.00 61.41 H new ATOM 0 HG23 THR A 28 -4.151 5.923 -7.515 1.00 61.41 H new ATOM 483 N LYS A 29 -6.710 7.939 -3.700 1.00 70.30 N ATOM 484 CA LYS A 29 -7.656 8.796 -2.948 1.00 65.42 C ATOM 485 C LYS A 29 -7.640 8.425 -1.446 1.00 31.02 C ATOM 486 O LYS A 29 -7.813 7.247 -1.097 1.00 54.21 O ATOM 487 CB LYS A 29 -9.079 8.647 -3.559 1.00 34.20 C ATOM 488 CG LYS A 29 -9.186 9.028 -5.058 1.00 23.30 C ATOM 489 CD LYS A 29 -8.693 10.462 -5.349 1.00 44.42 C ATOM 490 CE LYS A 29 -8.641 10.780 -6.850 1.00 10.11 C ATOM 491 NZ LYS A 29 -8.104 12.138 -7.107 1.00 62.41 N ATOM 0 H LYS A 29 -6.906 6.942 -3.615 1.00 70.30 H new ATOM 0 HA LYS A 29 -7.352 9.840 -3.028 1.00 65.42 H new ATOM 0 HB2 LYS A 29 -9.405 7.614 -3.437 1.00 34.20 H new ATOM 0 HB3 LYS A 29 -9.770 9.269 -2.990 1.00 34.20 H new ATOM 0 HG2 LYS A 29 -8.604 8.322 -5.650 1.00 23.30 H new ATOM 0 HG3 LYS A 29 -10.223 8.934 -5.379 1.00 23.30 H new ATOM 0 HD2 LYS A 29 -9.352 11.175 -4.854 1.00 44.42 H new ATOM 0 HD3 LYS A 29 -7.700 10.594 -4.920 1.00 44.42 H new ATOM 0 HE2 LYS A 29 -8.020 10.042 -7.357 1.00 10.11 H new ATOM 0 HE3 LYS A 29 -9.642 10.699 -7.274 1.00 10.11 H new ATOM 0 HZ1 LYS A 29 -8.085 12.315 -8.132 1.00 62.41 H new ATOM 0 HZ2 LYS A 29 -8.711 12.845 -6.645 1.00 62.41 H new ATOM 0 HZ3 LYS A 29 -7.139 12.208 -6.725 1.00 62.41 H new ATOM 505 N ARG A 30 -7.443 9.441 -0.560 1.00 4.13 N ATOM 506 CA ARG A 30 -7.235 9.202 0.891 1.00 64.01 C ATOM 507 C ARG A 30 -8.450 8.585 1.558 1.00 64.13 C ATOM 508 O ARG A 30 -8.286 7.783 2.475 1.00 14.24 O ATOM 509 CB ARG A 30 -6.789 10.490 1.667 1.00 0.42 C ATOM 510 CG ARG A 30 -7.856 11.603 1.957 1.00 10.12 C ATOM 511 CD ARG A 30 -8.715 11.364 3.221 1.00 32.22 C ATOM 512 NE ARG A 30 -9.651 12.469 3.491 1.00 2.14 N ATOM 513 CZ ARG A 30 -10.304 12.661 4.619 1.00 42.34 C ATOM 514 NH1 ARG A 30 -10.150 11.871 5.635 1.00 14.32 N ATOM 515 NH2 ARG A 30 -11.101 13.662 4.728 1.00 13.14 N ATOM 0 H ARG A 30 -7.424 10.426 -0.826 1.00 4.13 H new ATOM 0 HA ARG A 30 -6.416 8.484 0.944 1.00 64.01 H new ATOM 0 HB2 ARG A 30 -6.375 10.172 2.624 1.00 0.42 H new ATOM 0 HB3 ARG A 30 -5.976 10.950 1.105 1.00 0.42 H new ATOM 0 HG2 ARG A 30 -7.344 12.560 2.058 1.00 10.12 H new ATOM 0 HG3 ARG A 30 -8.518 11.685 1.095 1.00 10.12 H new ATOM 0 HD2 ARG A 30 -9.277 10.438 3.103 1.00 32.22 H new ATOM 0 HD3 ARG A 30 -8.059 11.231 4.081 1.00 32.22 H new ATOM 0 HE ARG A 30 -9.807 13.143 2.741 1.00 2.14 H new ATOM 0 HH11 ARG A 30 -9.511 11.078 5.572 1.00 14.32 H new ATOM 0 HH12 ARG A 30 -10.668 12.042 6.497 1.00 14.32 H new ATOM 0 HH21 ARG A 30 -11.225 14.303 3.944 1.00 13.14 H new ATOM 0 HH22 ARG A 30 -11.610 13.816 5.599 1.00 13.14 H new ATOM 529 N GLU A 31 -9.660 8.978 1.087 1.00 53.34 N ATOM 530 CA GLU A 31 -10.950 8.491 1.634 1.00 11.04 C ATOM 531 C GLU A 31 -10.916 6.971 1.796 1.00 54.04 C ATOM 532 O GLU A 31 -11.186 6.442 2.868 1.00 53.13 O ATOM 533 CB GLU A 31 -12.126 8.884 0.689 1.00 25.24 C ATOM 534 CG GLU A 31 -13.495 8.222 1.013 1.00 2.25 C ATOM 535 CD GLU A 31 -14.139 8.718 2.325 1.00 30.01 C ATOM 536 OE1 GLU A 31 -13.862 8.148 3.402 1.00 50.41 O ATOM 537 OE2 GLU A 31 -14.923 9.691 2.283 1.00 71.34 O ATOM 0 H GLU A 31 -9.768 9.640 0.319 1.00 53.34 H new ATOM 0 HA GLU A 31 -11.104 8.955 2.608 1.00 11.04 H new ATOM 0 HB2 GLU A 31 -12.249 9.967 0.721 1.00 25.24 H new ATOM 0 HB3 GLU A 31 -11.850 8.625 -0.333 1.00 25.24 H new ATOM 0 HG2 GLU A 31 -14.183 8.412 0.189 1.00 2.25 H new ATOM 0 HG3 GLU A 31 -13.359 7.142 1.073 1.00 2.25 H new ATOM 544 N LEU A 32 -10.461 6.311 0.736 1.00 23.01 N ATOM 545 CA LEU A 32 -10.407 4.856 0.666 1.00 63.51 C ATOM 546 C LEU A 32 -9.153 4.324 1.385 1.00 0.04 C ATOM 547 O LEU A 32 -9.248 3.351 2.131 1.00 35.22 O ATOM 548 CB LEU A 32 -10.442 4.430 -0.812 1.00 15.12 C ATOM 549 CG LEU A 32 -11.689 4.927 -1.612 1.00 12.35 C ATOM 550 CD1 LEU A 32 -11.547 4.600 -3.099 1.00 2.40 C ATOM 551 CD2 LEU A 32 -13.006 4.353 -1.037 1.00 22.44 C ATOM 0 H LEU A 32 -10.117 6.775 -0.105 1.00 23.01 H new ATOM 0 HA LEU A 32 -11.269 4.426 1.176 1.00 63.51 H new ATOM 0 HB2 LEU A 32 -9.542 4.801 -1.303 1.00 15.12 H new ATOM 0 HB3 LEU A 32 -10.407 3.342 -0.862 1.00 15.12 H new ATOM 0 HG LEU A 32 -11.737 6.011 -1.505 1.00 12.35 H new ATOM 0 HD11 LEU A 32 -12.427 4.955 -3.635 1.00 2.40 H new ATOM 0 HD12 LEU A 32 -10.658 5.090 -3.496 1.00 2.40 H new ATOM 0 HD13 LEU A 32 -11.455 3.521 -3.227 1.00 2.40 H new ATOM 0 HD21 LEU A 32 -13.849 4.722 -1.621 1.00 22.44 H new ATOM 0 HD22 LEU A 32 -12.980 3.264 -1.085 1.00 22.44 H new ATOM 0 HD23 LEU A 32 -13.118 4.668 0.001 1.00 22.44 H new ATOM 563 N PHE A 33 -8.000 5.008 1.188 1.00 24.31 N ATOM 564 CA PHE A 33 -6.688 4.603 1.762 1.00 41.42 C ATOM 565 C PHE A 33 -6.746 4.398 3.299 1.00 24.14 C ATOM 566 O PHE A 33 -6.385 3.334 3.795 1.00 32.02 O ATOM 567 CB PHE A 33 -5.607 5.649 1.396 1.00 52.44 C ATOM 568 CG PHE A 33 -4.191 5.320 1.895 1.00 33.24 C ATOM 569 CD1 PHE A 33 -3.351 4.473 1.167 1.00 11.02 C ATOM 570 CD2 PHE A 33 -3.691 5.877 3.082 1.00 74.01 C ATOM 571 CE1 PHE A 33 -2.067 4.197 1.605 1.00 54.23 C ATOM 572 CE2 PHE A 33 -2.410 5.596 3.517 1.00 71.33 C ATOM 573 CZ PHE A 33 -1.598 4.758 2.777 1.00 51.11 C ATOM 0 H PHE A 33 -7.951 5.858 0.626 1.00 24.31 H new ATOM 0 HA PHE A 33 -6.427 3.639 1.326 1.00 41.42 H new ATOM 0 HB2 PHE A 33 -5.578 5.756 0.312 1.00 52.44 H new ATOM 0 HB3 PHE A 33 -5.905 6.615 1.804 1.00 52.44 H new ATOM 0 HD1 PHE A 33 -3.708 4.028 0.250 1.00 11.02 H new ATOM 0 HD2 PHE A 33 -4.318 6.536 3.665 1.00 74.01 H new ATOM 0 HE1 PHE A 33 -1.431 3.542 1.029 1.00 54.23 H new ATOM 0 HE2 PHE A 33 -2.044 6.031 4.435 1.00 71.33 H new ATOM 0 HZ PHE A 33 -0.595 4.541 3.115 1.00 51.11 H new ATOM 583 N GLU A 34 -7.211 5.418 4.042 1.00 50.23 N ATOM 584 CA GLU A 34 -7.373 5.316 5.520 1.00 34.23 C ATOM 585 C GLU A 34 -8.530 4.371 5.964 1.00 62.13 C ATOM 586 O GLU A 34 -8.647 4.063 7.155 1.00 21.23 O ATOM 587 CB GLU A 34 -7.503 6.718 6.192 1.00 23.43 C ATOM 588 CG GLU A 34 -8.506 7.692 5.540 1.00 13.11 C ATOM 589 CD GLU A 34 -8.713 8.973 6.356 1.00 22.55 C ATOM 590 OE1 GLU A 34 -7.923 9.928 6.197 1.00 3.20 O ATOM 591 OE2 GLU A 34 -9.660 9.028 7.168 1.00 24.24 O ATOM 0 H GLU A 34 -7.482 6.322 3.654 1.00 50.23 H new ATOM 0 HA GLU A 34 -6.452 4.853 5.875 1.00 34.23 H new ATOM 0 HB2 GLU A 34 -7.792 6.574 7.233 1.00 23.43 H new ATOM 0 HB3 GLU A 34 -6.520 7.189 6.196 1.00 23.43 H new ATOM 0 HG2 GLU A 34 -8.152 7.956 4.543 1.00 13.11 H new ATOM 0 HG3 GLU A 34 -9.465 7.188 5.415 1.00 13.11 H new ATOM 598 N GLN A 35 -9.375 3.904 5.020 1.00 73.11 N ATOM 599 CA GLN A 35 -10.409 2.870 5.310 1.00 53.34 C ATOM 600 C GLN A 35 -9.851 1.419 5.205 1.00 51.22 C ATOM 601 O GLN A 35 -10.478 0.487 5.726 1.00 15.31 O ATOM 602 CB GLN A 35 -11.654 3.032 4.381 1.00 1.31 C ATOM 603 CG GLN A 35 -12.496 4.298 4.649 1.00 70.33 C ATOM 604 CD GLN A 35 -13.762 4.387 3.775 1.00 12.34 C ATOM 605 OE1 GLN A 35 -14.830 3.929 4.155 1.00 2.42 O ATOM 606 NE2 GLN A 35 -13.644 4.939 2.582 1.00 62.12 N ATOM 0 H GLN A 35 -9.367 4.222 4.051 1.00 73.11 H new ATOM 0 HA GLN A 35 -10.716 3.032 6.343 1.00 53.34 H new ATOM 0 HB2 GLN A 35 -11.318 3.048 3.344 1.00 1.31 H new ATOM 0 HB3 GLN A 35 -12.293 2.156 4.495 1.00 1.31 H new ATOM 0 HG2 GLN A 35 -12.787 4.317 5.699 1.00 70.33 H new ATOM 0 HG3 GLN A 35 -11.879 5.179 4.473 1.00 70.33 H new ATOM 0 HE21 GLN A 35 -12.745 5.316 2.281 1.00 62.12 H new ATOM 0 HE22 GLN A 35 -14.452 4.988 1.961 1.00 62.12 H new ATOM 615 N TRP A 36 -8.684 1.211 4.544 1.00 60.34 N ATOM 616 CA TRP A 36 -8.109 -0.161 4.369 1.00 74.24 C ATOM 617 C TRP A 36 -6.670 -0.310 4.927 1.00 62.23 C ATOM 618 O TRP A 36 -6.373 -1.299 5.610 1.00 30.22 O ATOM 619 CB TRP A 36 -8.170 -0.614 2.878 1.00 12.10 C ATOM 620 CG TRP A 36 -7.209 0.064 1.910 1.00 62.12 C ATOM 621 CD1 TRP A 36 -7.438 1.176 1.165 1.00 41.04 C ATOM 622 CD2 TRP A 36 -5.884 -0.374 1.553 1.00 22.33 C ATOM 623 NE1 TRP A 36 -6.337 1.489 0.417 1.00 11.02 N ATOM 624 CE2 TRP A 36 -5.371 0.554 0.634 1.00 21.33 C ATOM 625 CE3 TRP A 36 -5.081 -1.449 1.945 1.00 44.22 C ATOM 626 CZ2 TRP A 36 -4.098 0.441 0.095 1.00 52.00 C ATOM 627 CZ3 TRP A 36 -3.815 -1.559 1.411 1.00 41.24 C ATOM 628 CH2 TRP A 36 -3.333 -0.619 0.495 1.00 13.53 C ATOM 0 H TRP A 36 -8.126 1.957 4.128 1.00 60.34 H new ATOM 0 HA TRP A 36 -8.738 -0.821 4.966 1.00 74.24 H new ATOM 0 HB2 TRP A 36 -7.986 -1.688 2.842 1.00 12.10 H new ATOM 0 HB3 TRP A 36 -9.185 -0.453 2.516 1.00 12.10 H new ATOM 0 HD1 TRP A 36 -8.362 1.736 1.163 1.00 41.04 H new ATOM 0 HE1 TRP A 36 -6.253 2.294 -0.204 1.00 11.02 H new ATOM 0 HE3 TRP A 36 -5.445 -2.179 2.652 1.00 44.22 H new ATOM 0 HZ2 TRP A 36 -3.725 1.164 -0.615 1.00 52.00 H new ATOM 0 HZ3 TRP A 36 -3.185 -2.385 1.705 1.00 41.24 H new ATOM 0 HH2 TRP A 36 -2.336 -0.733 0.095 1.00 13.53 H new ATOM 639 N PHE A 37 -5.777 0.657 4.612 1.00 54.42 N ATOM 640 CA PHE A 37 -4.340 0.577 4.962 1.00 14.04 C ATOM 641 C PHE A 37 -4.115 0.793 6.475 1.00 1.52 C ATOM 642 O PHE A 37 -3.842 1.902 6.927 1.00 31.23 O ATOM 643 CB PHE A 37 -3.498 1.579 4.120 1.00 42.25 C ATOM 644 CG PHE A 37 -1.978 1.370 4.254 1.00 2.11 C ATOM 645 CD1 PHE A 37 -1.313 0.445 3.447 1.00 12.12 C ATOM 646 CD2 PHE A 37 -1.221 2.082 5.189 1.00 11.32 C ATOM 647 CE1 PHE A 37 0.049 0.239 3.572 1.00 52.21 C ATOM 648 CE2 PHE A 37 0.140 1.875 5.311 1.00 23.42 C ATOM 649 CZ PHE A 37 0.774 0.956 4.503 1.00 22.33 C ATOM 0 H PHE A 37 -6.030 1.509 4.112 1.00 54.42 H new ATOM 0 HA PHE A 37 -3.999 -0.430 4.719 1.00 14.04 H new ATOM 0 HB2 PHE A 37 -3.778 1.485 3.071 1.00 42.25 H new ATOM 0 HB3 PHE A 37 -3.745 2.596 4.426 1.00 42.25 H new ATOM 0 HD1 PHE A 37 -1.871 -0.119 2.714 1.00 12.12 H new ATOM 0 HD2 PHE A 37 -1.708 2.806 5.826 1.00 11.32 H new ATOM 0 HE1 PHE A 37 0.546 -0.483 2.941 1.00 52.21 H new ATOM 0 HE2 PHE A 37 0.707 2.434 6.040 1.00 23.42 H new ATOM 0 HZ PHE A 37 1.838 0.797 4.598 1.00 22.33 H new ATOM 659 N HIS A 38 -4.269 -0.290 7.233 1.00 2.43 N ATOM 660 CA HIS A 38 -4.036 -0.324 8.682 1.00 60.24 C ATOM 661 C HIS A 38 -3.808 -1.793 9.119 1.00 22.54 C ATOM 662 O HIS A 38 -4.484 -2.697 8.599 1.00 30.35 O ATOM 663 CB HIS A 38 -5.226 0.318 9.457 1.00 74.50 C ATOM 664 CG HIS A 38 -6.560 -0.351 9.241 1.00 64.43 C ATOM 665 ND1 HIS A 38 -6.932 -1.499 9.901 1.00 3.35 N ATOM 666 CD2 HIS A 38 -7.604 -0.032 8.434 1.00 22.45 C ATOM 667 CE1 HIS A 38 -8.129 -1.865 9.506 1.00 64.14 C ATOM 668 NE2 HIS A 38 -8.564 -0.993 8.620 1.00 12.42 N ATOM 0 H HIS A 38 -4.565 -1.189 6.853 1.00 2.43 H new ATOM 0 HA HIS A 38 -3.149 0.263 8.920 1.00 60.24 H new ATOM 0 HB2 HIS A 38 -4.997 0.303 10.523 1.00 74.50 H new ATOM 0 HB3 HIS A 38 -5.309 1.364 9.164 1.00 74.50 H new ATOM 0 HD2 HIS A 38 -7.667 0.818 7.771 1.00 22.45 H new ATOM 0 HE1 HIS A 38 -8.667 -2.736 9.850 1.00 64.14 H new ATOM 0 HE2 HIS A 38 -9.468 -1.027 8.149 1.00 12.42 H new ATOM 677 N PRO A 39 -2.856 -2.069 10.063 1.00 61.14 N ATOM 678 CA PRO A 39 -2.621 -3.442 10.571 1.00 51.11 C ATOM 679 C PRO A 39 -3.762 -3.959 11.487 1.00 51.32 C ATOM 680 O PRO A 39 -4.695 -3.216 11.835 1.00 13.03 O ATOM 681 CB PRO A 39 -1.275 -3.316 11.327 1.00 52.12 C ATOM 682 CG PRO A 39 -1.221 -1.887 11.762 1.00 42.15 C ATOM 683 CD PRO A 39 -1.922 -1.090 10.678 1.00 24.25 C ATOM 0 HA PRO A 39 -2.594 -4.178 9.768 1.00 51.11 H new ATOM 0 HB2 PRO A 39 -1.235 -3.992 12.181 1.00 52.12 H new ATOM 0 HB3 PRO A 39 -0.433 -3.566 10.682 1.00 52.12 H new ATOM 0 HG2 PRO A 39 -1.715 -1.754 12.725 1.00 42.15 H new ATOM 0 HG3 PRO A 39 -0.190 -1.556 11.884 1.00 42.15 H new ATOM 0 HD2 PRO A 39 -2.456 -0.235 11.093 1.00 24.25 H new ATOM 0 HD3 PRO A 39 -1.214 -0.700 9.947 1.00 24.25 H new ATOM 691 N GLN A 40 -3.671 -5.251 11.855 1.00 41.21 N ATOM 692 CA GLN A 40 -4.676 -5.924 12.703 1.00 35.44 C ATOM 693 C GLN A 40 -4.733 -5.287 14.121 1.00 32.33 C ATOM 694 O GLN A 40 -3.686 -5.064 14.740 1.00 14.41 O ATOM 695 CB GLN A 40 -4.347 -7.439 12.794 1.00 61.42 C ATOM 696 CG GLN A 40 -5.410 -8.293 13.521 1.00 34.12 C ATOM 697 CD GLN A 40 -5.023 -9.774 13.627 1.00 30.31 C ATOM 698 OE1 GLN A 40 -5.323 -10.577 12.747 1.00 53.04 O ATOM 699 NE2 GLN A 40 -4.361 -10.148 14.708 1.00 25.54 N ATOM 0 H GLN A 40 -2.901 -5.858 11.574 1.00 41.21 H new ATOM 0 HA GLN A 40 -5.658 -5.797 12.248 1.00 35.44 H new ATOM 0 HB2 GLN A 40 -4.217 -7.829 11.784 1.00 61.42 H new ATOM 0 HB3 GLN A 40 -3.393 -7.559 13.307 1.00 61.42 H new ATOM 0 HG2 GLN A 40 -5.567 -7.892 14.522 1.00 34.12 H new ATOM 0 HG3 GLN A 40 -6.359 -8.209 12.992 1.00 34.12 H new ATOM 0 HE21 GLN A 40 -4.124 -9.461 15.424 1.00 25.54 H new ATOM 0 HE22 GLN A 40 -4.087 -11.123 14.826 1.00 25.54 H new ATOM 708 N ASP A 41 -5.971 -4.975 14.582 1.00 25.24 N ATOM 709 CA ASP A 41 -6.264 -4.342 15.906 1.00 53.13 C ATOM 710 C ASP A 41 -5.877 -2.823 15.961 1.00 41.40 C ATOM 711 O ASP A 41 -6.142 -2.145 16.958 1.00 22.32 O ATOM 712 CB ASP A 41 -5.611 -5.161 17.074 1.00 51.23 C ATOM 713 CG ASP A 41 -6.093 -4.754 18.480 1.00 35.32 C ATOM 714 OD1 ASP A 41 -7.241 -5.095 18.843 1.00 21.34 O ATOM 715 OD2 ASP A 41 -5.338 -4.085 19.223 1.00 2.44 O ATOM 0 H ASP A 41 -6.814 -5.158 14.038 1.00 25.24 H new ATOM 0 HA ASP A 41 -7.346 -4.372 16.038 1.00 53.13 H new ATOM 0 HB2 ASP A 41 -5.822 -6.220 16.922 1.00 51.23 H new ATOM 0 HB3 ASP A 41 -4.529 -5.042 17.025 1.00 51.23 H new ATOM 720 N ALA A 42 -5.298 -2.275 14.869 1.00 61.24 N ATOM 721 CA ALA A 42 -4.825 -0.865 14.823 1.00 32.05 C ATOM 722 C ALA A 42 -5.474 -0.062 13.663 1.00 74.34 C ATOM 723 O ALA A 42 -5.793 -0.608 12.604 1.00 50.23 O ATOM 724 CB ALA A 42 -3.291 -0.837 14.712 1.00 30.50 C ATOM 0 H ALA A 42 -5.145 -2.788 14.001 1.00 61.24 H new ATOM 0 HA ALA A 42 -5.132 -0.380 15.750 1.00 32.05 H new ATOM 0 HB1 ALA A 42 -2.947 0.197 14.678 1.00 30.50 H new ATOM 0 HB2 ALA A 42 -2.854 -1.337 15.577 1.00 30.50 H new ATOM 0 HB3 ALA A 42 -2.983 -1.351 13.802 1.00 30.50 H new ATOM 730 N SER A 43 -5.662 1.242 13.909 1.00 2.10 N ATOM 731 CA SER A 43 -6.186 2.232 12.933 1.00 24.42 C ATOM 732 C SER A 43 -5.038 2.977 12.196 1.00 44.15 C ATOM 733 O SER A 43 -3.855 2.667 12.375 1.00 35.32 O ATOM 734 CB SER A 43 -7.080 3.258 13.675 1.00 74.43 C ATOM 735 OG SER A 43 -8.171 2.629 14.329 1.00 41.21 O ATOM 0 H SER A 43 -5.450 1.658 14.816 1.00 2.10 H new ATOM 0 HA SER A 43 -6.768 1.695 12.184 1.00 24.42 H new ATOM 0 HB2 SER A 43 -6.481 3.800 14.407 1.00 74.43 H new ATOM 0 HB3 SER A 43 -7.457 3.993 12.964 1.00 74.43 H new ATOM 0 HG SER A 43 -8.712 3.306 14.787 1.00 41.21 H new ATOM 741 N VAL A 44 -5.417 3.945 11.341 1.00 24.10 N ATOM 742 CA VAL A 44 -4.470 4.824 10.617 1.00 32.24 C ATOM 743 C VAL A 44 -5.034 6.271 10.543 1.00 65.35 C ATOM 744 O VAL A 44 -6.250 6.477 10.554 1.00 21.12 O ATOM 745 CB VAL A 44 -4.185 4.254 9.177 1.00 31.21 C ATOM 746 CG1 VAL A 44 -5.485 4.164 8.344 1.00 44.54 C ATOM 747 CG2 VAL A 44 -3.079 5.049 8.426 1.00 61.32 C ATOM 0 H VAL A 44 -6.395 4.143 11.129 1.00 24.10 H new ATOM 0 HA VAL A 44 -3.526 4.852 11.161 1.00 32.24 H new ATOM 0 HB VAL A 44 -3.800 3.243 9.310 1.00 31.21 H new ATOM 0 HG11 VAL A 44 -5.257 3.767 7.355 1.00 44.54 H new ATOM 0 HG12 VAL A 44 -6.193 3.504 8.845 1.00 44.54 H new ATOM 0 HG13 VAL A 44 -5.923 5.157 8.244 1.00 44.54 H new ATOM 0 HG21 VAL A 44 -2.924 4.613 7.439 1.00 61.32 H new ATOM 0 HG22 VAL A 44 -3.388 6.089 8.319 1.00 61.32 H new ATOM 0 HG23 VAL A 44 -2.149 5.003 8.993 1.00 61.32 H new ATOM 757 N THR A 45 -4.133 7.261 10.481 1.00 31.21 N ATOM 758 CA THR A 45 -4.475 8.696 10.436 1.00 61.51 C ATOM 759 C THR A 45 -3.681 9.376 9.305 1.00 12.23 C ATOM 760 O THR A 45 -2.457 9.449 9.377 1.00 33.21 O ATOM 761 CB THR A 45 -4.130 9.393 11.799 1.00 14.31 C ATOM 762 OG1 THR A 45 -4.775 8.700 12.884 1.00 24.31 O ATOM 763 CG2 THR A 45 -4.541 10.885 11.819 1.00 23.52 C ATOM 0 H THR A 45 -3.128 7.088 10.460 1.00 31.21 H new ATOM 0 HA THR A 45 -5.545 8.792 10.254 1.00 61.51 H new ATOM 0 HB THR A 45 -3.047 9.348 11.917 1.00 14.31 H new ATOM 0 HG1 THR A 45 -4.553 9.140 13.731 1.00 24.31 H new ATOM 0 HG21 THR A 45 -4.281 11.321 12.783 1.00 23.52 H new ATOM 0 HG22 THR A 45 -4.016 11.418 11.026 1.00 23.52 H new ATOM 0 HG23 THR A 45 -5.616 10.968 11.661 1.00 23.52 H new ATOM 771 N VAL A 46 -4.367 9.843 8.254 1.00 55.21 N ATOM 772 CA VAL A 46 -3.718 10.542 7.119 1.00 2.41 C ATOM 773 C VAL A 46 -3.721 12.078 7.347 1.00 2.33 C ATOM 774 O VAL A 46 -4.778 12.693 7.484 1.00 14.32 O ATOM 775 CB VAL A 46 -4.416 10.174 5.757 1.00 22.20 C ATOM 776 CG1 VAL A 46 -3.766 10.907 4.563 1.00 41.31 C ATOM 777 CG2 VAL A 46 -4.405 8.640 5.530 1.00 4.12 C ATOM 0 H VAL A 46 -5.379 9.752 8.159 1.00 55.21 H new ATOM 0 HA VAL A 46 -2.682 10.209 7.064 1.00 2.41 H new ATOM 0 HB VAL A 46 -5.452 10.508 5.821 1.00 22.20 H new ATOM 0 HG11 VAL A 46 -4.277 10.626 3.642 1.00 41.31 H new ATOM 0 HG12 VAL A 46 -3.848 11.984 4.709 1.00 41.31 H new ATOM 0 HG13 VAL A 46 -2.714 10.629 4.494 1.00 41.31 H new ATOM 0 HG21 VAL A 46 -4.893 8.409 4.583 1.00 4.12 H new ATOM 0 HG22 VAL A 46 -3.375 8.283 5.505 1.00 4.12 H new ATOM 0 HG23 VAL A 46 -4.939 8.148 6.343 1.00 4.12 H new ATOM 787 N TYR A 47 -2.517 12.675 7.396 1.00 53.53 N ATOM 788 CA TYR A 47 -2.319 14.132 7.612 1.00 33.30 C ATOM 789 C TYR A 47 -2.314 14.883 6.256 1.00 70.44 C ATOM 790 O TYR A 47 -2.959 15.927 6.101 1.00 54.11 O ATOM 791 CB TYR A 47 -0.980 14.374 8.374 1.00 0.24 C ATOM 792 CG TYR A 47 -0.901 13.700 9.764 1.00 74.53 C ATOM 793 CD1 TYR A 47 -0.801 12.314 9.887 1.00 73.11 C ATOM 794 CD2 TYR A 47 -0.930 14.447 10.949 1.00 31.24 C ATOM 795 CE1 TYR A 47 -0.734 11.699 11.122 1.00 74.43 C ATOM 796 CE2 TYR A 47 -0.860 13.830 12.190 1.00 52.25 C ATOM 797 CZ TYR A 47 -0.764 12.455 12.269 1.00 2.33 C ATOM 798 OH TYR A 47 -0.702 11.831 13.502 1.00 41.25 O ATOM 0 H TYR A 47 -1.642 12.162 7.287 1.00 53.53 H new ATOM 0 HA TYR A 47 -3.143 14.517 8.213 1.00 33.30 H new ATOM 0 HB2 TYR A 47 -0.156 14.009 7.760 1.00 0.24 H new ATOM 0 HB3 TYR A 47 -0.835 15.447 8.496 1.00 0.24 H new ATOM 0 HD1 TYR A 47 -0.775 11.707 8.994 1.00 73.11 H new ATOM 0 HD2 TYR A 47 -1.008 15.523 10.896 1.00 31.24 H new ATOM 0 HE1 TYR A 47 -0.658 10.624 11.186 1.00 74.43 H new ATOM 0 HE2 TYR A 47 -0.881 14.424 13.092 1.00 52.25 H new ATOM 0 HH TYR A 47 -0.733 12.506 14.212 1.00 41.25 H new ATOM 808 N ASP A 48 -1.581 14.317 5.284 1.00 45.22 N ATOM 809 CA ASP A 48 -1.440 14.856 3.910 1.00 64.51 C ATOM 810 C ASP A 48 -1.604 13.695 2.906 1.00 23.01 C ATOM 811 O ASP A 48 -1.235 12.560 3.224 1.00 20.42 O ATOM 812 CB ASP A 48 -0.039 15.498 3.719 1.00 2.53 C ATOM 813 CG ASP A 48 0.273 16.603 4.739 1.00 44.51 C ATOM 814 OD1 ASP A 48 -0.069 17.777 4.483 1.00 60.14 O ATOM 815 OD2 ASP A 48 0.867 16.303 5.801 1.00 22.32 O ATOM 0 H ASP A 48 -1.057 13.454 5.428 1.00 45.22 H new ATOM 0 HA ASP A 48 -2.201 15.618 3.744 1.00 64.51 H new ATOM 0 HB2 ASP A 48 0.721 14.721 3.794 1.00 2.53 H new ATOM 0 HB3 ASP A 48 0.027 15.913 2.713 1.00 2.53 H new ATOM 820 N PHE A 49 -2.143 13.970 1.702 1.00 24.54 N ATOM 821 CA PHE A 49 -2.318 12.924 0.667 1.00 13.34 C ATOM 822 C PHE A 49 -2.540 13.542 -0.730 1.00 42.41 C ATOM 823 O PHE A 49 -3.480 14.314 -0.939 1.00 63.23 O ATOM 824 CB PHE A 49 -3.502 11.986 1.032 1.00 20.42 C ATOM 825 CG PHE A 49 -3.469 10.602 0.366 1.00 30.22 C ATOM 826 CD1 PHE A 49 -3.914 10.418 -0.941 1.00 41.20 C ATOM 827 CD2 PHE A 49 -3.013 9.484 1.065 1.00 34.24 C ATOM 828 CE1 PHE A 49 -3.901 9.166 -1.523 1.00 55.20 C ATOM 829 CE2 PHE A 49 -3.005 8.238 0.475 1.00 64.34 C ATOM 830 CZ PHE A 49 -3.450 8.078 -0.817 1.00 2.23 C ATOM 0 H PHE A 49 -2.463 14.897 1.421 1.00 24.54 H new ATOM 0 HA PHE A 49 -1.400 12.338 0.634 1.00 13.34 H new ATOM 0 HB2 PHE A 49 -3.518 11.851 2.113 1.00 20.42 H new ATOM 0 HB3 PHE A 49 -4.434 12.481 0.759 1.00 20.42 H new ATOM 0 HD1 PHE A 49 -4.274 11.265 -1.506 1.00 41.20 H new ATOM 0 HD2 PHE A 49 -2.662 9.596 2.080 1.00 34.24 H new ATOM 0 HE1 PHE A 49 -4.247 9.042 -2.538 1.00 55.20 H new ATOM 0 HE2 PHE A 49 -2.648 7.383 1.030 1.00 64.34 H new ATOM 0 HZ PHE A 49 -3.445 7.100 -1.275 1.00 2.23 H new ATOM 840 N ASN A 50 -1.663 13.173 -1.670 1.00 24.22 N ATOM 841 CA ASN A 50 -1.780 13.522 -3.096 1.00 53.12 C ATOM 842 C ASN A 50 -1.026 12.459 -3.933 1.00 34.14 C ATOM 843 O ASN A 50 0.184 12.290 -3.765 1.00 13.33 O ATOM 844 CB ASN A 50 -1.220 14.953 -3.347 1.00 24.41 C ATOM 845 CG ASN A 50 -1.355 15.419 -4.796 1.00 73.05 C ATOM 846 OD1 ASN A 50 -2.258 15.012 -5.519 1.00 65.32 O ATOM 847 ND2 ASN A 50 -0.469 16.285 -5.235 1.00 73.22 N ATOM 0 H ASN A 50 -0.836 12.613 -1.461 1.00 24.22 H new ATOM 0 HA ASN A 50 -2.827 13.527 -3.398 1.00 53.12 H new ATOM 0 HB2 ASN A 50 -1.741 15.657 -2.698 1.00 24.41 H new ATOM 0 HB3 ASN A 50 -0.168 14.977 -3.063 1.00 24.41 H new ATOM 0 HD21 ASN A 50 -0.525 16.631 -6.193 1.00 73.22 H new ATOM 0 HD22 ASN A 50 0.275 16.611 -4.618 1.00 73.22 H new ATOM 854 N ALA A 51 -1.743 11.732 -4.810 1.00 3.14 N ATOM 855 CA ALA A 51 -1.156 10.629 -5.602 1.00 53.25 C ATOM 856 C ALA A 51 -1.110 10.960 -7.110 1.00 43.23 C ATOM 857 O ALA A 51 -2.149 11.000 -7.781 1.00 24.40 O ATOM 858 CB ALA A 51 -1.929 9.338 -5.343 1.00 74.23 C ATOM 0 H ALA A 51 -2.735 11.888 -4.990 1.00 3.14 H new ATOM 0 HA ALA A 51 -0.123 10.494 -5.281 1.00 53.25 H new ATOM 0 HB1 ALA A 51 -1.493 8.529 -5.929 1.00 74.23 H new ATOM 0 HB2 ALA A 51 -1.876 9.088 -4.283 1.00 74.23 H new ATOM 0 HB3 ALA A 51 -2.971 9.474 -5.632 1.00 74.23 H new ATOM 864 N THR A 52 0.116 11.192 -7.613 1.00 13.33 N ATOM 865 CA THR A 52 0.399 11.531 -9.032 1.00 64.41 C ATOM 866 C THR A 52 1.936 11.483 -9.276 1.00 63.10 C ATOM 867 O THR A 52 2.674 10.974 -8.434 1.00 51.01 O ATOM 868 CB THR A 52 -0.187 12.943 -9.425 1.00 11.34 C ATOM 869 OG1 THR A 52 0.001 13.197 -10.830 1.00 71.43 O ATOM 870 CG2 THR A 52 0.444 14.089 -8.602 1.00 41.33 C ATOM 0 H THR A 52 0.958 11.150 -7.039 1.00 13.33 H new ATOM 0 HA THR A 52 -0.094 10.795 -9.668 1.00 64.41 H new ATOM 0 HB THR A 52 -1.253 12.916 -9.198 1.00 11.34 H new ATOM 0 HG1 THR A 52 -0.370 14.076 -11.056 1.00 71.43 H new ATOM 0 HG21 THR A 52 0.008 15.040 -8.909 1.00 41.33 H new ATOM 0 HG22 THR A 52 0.249 13.926 -7.542 1.00 41.33 H new ATOM 0 HG23 THR A 52 1.520 14.111 -8.774 1.00 41.33 H new ATOM 878 N LYS A 53 2.411 11.975 -10.434 1.00 3.42 N ATOM 879 CA LYS A 53 3.856 12.154 -10.693 1.00 43.14 C ATOM 880 C LYS A 53 4.381 13.346 -9.854 1.00 2.24 C ATOM 881 O LYS A 53 4.012 14.496 -10.103 1.00 51.14 O ATOM 882 CB LYS A 53 4.139 12.380 -12.212 1.00 41.12 C ATOM 883 CG LYS A 53 3.927 11.140 -13.128 1.00 13.34 C ATOM 884 CD LYS A 53 2.454 10.678 -13.247 1.00 31.40 C ATOM 885 CE LYS A 53 1.527 11.744 -13.860 1.00 71.15 C ATOM 886 NZ LYS A 53 0.111 11.310 -13.855 1.00 11.12 N ATOM 0 H LYS A 53 1.814 12.258 -11.211 1.00 3.42 H new ATOM 0 HA LYS A 53 4.380 11.245 -10.399 1.00 43.14 H new ATOM 0 HB2 LYS A 53 3.496 13.185 -12.567 1.00 41.12 H new ATOM 0 HB3 LYS A 53 5.168 12.721 -12.325 1.00 41.12 H new ATOM 0 HG2 LYS A 53 4.305 11.370 -14.124 1.00 13.34 H new ATOM 0 HG3 LYS A 53 4.525 10.313 -12.744 1.00 13.34 H new ATOM 0 HD2 LYS A 53 2.412 9.776 -13.858 1.00 31.40 H new ATOM 0 HD3 LYS A 53 2.084 10.411 -12.257 1.00 31.40 H new ATOM 0 HE2 LYS A 53 1.624 12.675 -13.301 1.00 71.15 H new ATOM 0 HE3 LYS A 53 1.840 11.953 -14.883 1.00 71.15 H new ATOM 0 HZ1 LYS A 53 -0.267 11.346 -14.823 1.00 11.12 H new ATOM 0 HZ2 LYS A 53 0.048 10.336 -13.495 1.00 11.12 H new ATOM 0 HZ3 LYS A 53 -0.444 11.942 -13.243 1.00 11.12 H new ATOM 900 N GLY A 54 5.204 13.047 -8.836 1.00 41.23 N ATOM 901 CA GLY A 54 5.683 14.065 -7.881 1.00 24.04 C ATOM 902 C GLY A 54 4.702 14.317 -6.724 1.00 35.41 C ATOM 903 O GLY A 54 4.792 15.348 -6.043 1.00 61.11 O ATOM 0 H GLY A 54 5.553 12.107 -8.651 1.00 41.23 H new ATOM 0 HA2 GLY A 54 6.643 13.748 -7.473 1.00 24.04 H new ATOM 0 HA3 GLY A 54 5.856 15.001 -8.413 1.00 24.04 H new ATOM 907 N GLY A 55 3.764 13.366 -6.512 1.00 23.23 N ATOM 908 CA GLY A 55 2.777 13.439 -5.423 1.00 63.44 C ATOM 909 C GLY A 55 3.375 13.203 -4.029 1.00 65.21 C ATOM 910 O GLY A 55 4.455 12.623 -3.902 1.00 20.01 O ATOM 0 H GLY A 55 3.674 12.531 -7.091 1.00 23.23 H new ATOM 0 HA2 GLY A 55 2.300 14.419 -5.442 1.00 63.44 H new ATOM 0 HA3 GLY A 55 1.996 12.700 -5.603 1.00 63.44 H new ATOM 914 N SER A 56 2.657 13.630 -2.977 1.00 52.34 N ATOM 915 CA SER A 56 3.153 13.553 -1.576 1.00 53.02 C ATOM 916 C SER A 56 2.025 13.164 -0.600 1.00 14.31 C ATOM 917 O SER A 56 0.915 13.693 -0.686 1.00 21.31 O ATOM 918 CB SER A 56 3.758 14.910 -1.143 1.00 24.32 C ATOM 919 OG SER A 56 4.871 15.270 -1.948 1.00 14.14 O ATOM 0 H SER A 56 1.725 14.036 -3.062 1.00 52.34 H new ATOM 0 HA SER A 56 3.922 12.781 -1.544 1.00 53.02 H new ATOM 0 HB2 SER A 56 2.995 15.686 -1.209 1.00 24.32 H new ATOM 0 HB3 SER A 56 4.067 14.854 -0.099 1.00 24.32 H new ATOM 0 HG SER A 56 5.655 14.751 -1.673 1.00 14.14 H new ATOM 925 N ALA A 57 2.336 12.261 0.346 1.00 74.42 N ATOM 926 CA ALA A 57 1.375 11.786 1.364 1.00 12.25 C ATOM 927 C ALA A 57 2.072 11.522 2.718 1.00 41.31 C ATOM 928 O ALA A 57 3.017 10.748 2.785 1.00 32.12 O ATOM 929 CB ALA A 57 0.661 10.508 0.875 1.00 74.13 C ATOM 0 H ALA A 57 3.260 11.838 0.429 1.00 74.42 H new ATOM 0 HA ALA A 57 0.635 12.572 1.514 1.00 12.25 H new ATOM 0 HB1 ALA A 57 -0.043 10.171 1.636 1.00 74.13 H new ATOM 0 HB2 ALA A 57 0.123 10.723 -0.048 1.00 74.13 H new ATOM 0 HB3 ALA A 57 1.399 9.727 0.692 1.00 74.13 H new ATOM 935 N PHE A 58 1.609 12.190 3.786 1.00 42.35 N ATOM 936 CA PHE A 58 2.061 11.924 5.174 1.00 71.13 C ATOM 937 C PHE A 58 0.907 11.259 5.950 1.00 64.12 C ATOM 938 O PHE A 58 -0.242 11.685 5.848 1.00 50.32 O ATOM 939 CB PHE A 58 2.505 13.245 5.875 1.00 0.31 C ATOM 940 CG PHE A 58 3.216 13.054 7.230 1.00 53.03 C ATOM 941 CD1 PHE A 58 2.494 12.848 8.405 1.00 12.53 C ATOM 942 CD2 PHE A 58 4.607 13.078 7.321 1.00 4.12 C ATOM 943 CE1 PHE A 58 3.132 12.672 9.617 1.00 42.40 C ATOM 944 CE2 PHE A 58 5.246 12.904 8.535 1.00 30.30 C ATOM 945 CZ PHE A 58 4.510 12.699 9.681 1.00 13.03 C ATOM 0 H PHE A 58 0.911 12.931 3.719 1.00 42.35 H new ATOM 0 HA PHE A 58 2.923 11.257 5.155 1.00 71.13 H new ATOM 0 HB2 PHE A 58 3.171 13.788 5.205 1.00 0.31 H new ATOM 0 HB3 PHE A 58 1.626 13.871 6.028 1.00 0.31 H new ATOM 0 HD1 PHE A 58 1.415 12.826 8.366 1.00 12.53 H new ATOM 0 HD2 PHE A 58 5.195 13.235 6.429 1.00 4.12 H new ATOM 0 HE1 PHE A 58 2.553 12.513 10.514 1.00 42.40 H new ATOM 0 HE2 PHE A 58 6.325 12.929 8.585 1.00 30.30 H new ATOM 0 HZ PHE A 58 5.011 12.560 10.628 1.00 13.03 H new ATOM 955 N TYR A 59 1.225 10.223 6.734 1.00 21.13 N ATOM 956 CA TYR A 59 0.239 9.519 7.579 1.00 40.23 C ATOM 957 C TYR A 59 0.916 8.930 8.837 1.00 10.52 C ATOM 958 O TYR A 59 2.105 9.154 9.078 1.00 14.10 O ATOM 959 CB TYR A 59 -0.523 8.431 6.756 1.00 35.35 C ATOM 960 CG TYR A 59 0.349 7.320 6.141 1.00 52.05 C ATOM 961 CD1 TYR A 59 0.962 7.485 4.890 1.00 4.33 C ATOM 962 CD2 TYR A 59 0.539 6.102 6.800 1.00 34.34 C ATOM 963 CE1 TYR A 59 1.732 6.479 4.332 1.00 22.33 C ATOM 964 CE2 TYR A 59 1.304 5.099 6.241 1.00 25.42 C ATOM 965 CZ TYR A 59 1.896 5.289 5.010 1.00 11.34 C ATOM 966 OH TYR A 59 2.646 4.279 4.455 1.00 72.12 O ATOM 0 H TYR A 59 2.170 9.845 6.805 1.00 21.13 H new ATOM 0 HA TYR A 59 -0.503 10.240 7.921 1.00 40.23 H new ATOM 0 HB2 TYR A 59 -1.266 7.966 7.405 1.00 35.35 H new ATOM 0 HB3 TYR A 59 -1.067 8.926 5.952 1.00 35.35 H new ATOM 0 HD1 TYR A 59 0.831 8.413 4.353 1.00 4.33 H new ATOM 0 HD2 TYR A 59 0.079 5.943 7.764 1.00 34.34 H new ATOM 0 HE1 TYR A 59 2.202 6.625 3.371 1.00 22.33 H new ATOM 0 HE2 TYR A 59 1.439 4.166 6.767 1.00 25.42 H new ATOM 0 HH TYR A 59 3.531 4.624 4.212 1.00 72.12 H new ATOM 976 N ALA A 60 0.131 8.210 9.650 1.00 43.04 N ATOM 977 CA ALA A 60 0.620 7.547 10.873 1.00 71.30 C ATOM 978 C ALA A 60 -0.274 6.351 11.240 1.00 65.43 C ATOM 979 O ALA A 60 -1.492 6.442 11.169 1.00 42.14 O ATOM 980 CB ALA A 60 0.680 8.544 12.047 1.00 13.30 C ATOM 0 H ALA A 60 -0.865 8.069 9.480 1.00 43.04 H new ATOM 0 HA ALA A 60 1.627 7.180 10.676 1.00 71.30 H new ATOM 0 HB1 ALA A 60 1.043 8.034 12.939 1.00 13.30 H new ATOM 0 HB2 ALA A 60 1.356 9.362 11.796 1.00 13.30 H new ATOM 0 HB3 ALA A 60 -0.317 8.942 12.237 1.00 13.30 H new ATOM 986 N ILE A 61 0.345 5.236 11.634 1.00 24.11 N ATOM 987 CA ILE A 61 -0.367 4.054 12.134 1.00 70.23 C ATOM 988 C ILE A 61 -0.828 4.306 13.589 1.00 4.01 C ATOM 989 O ILE A 61 -0.014 4.315 14.528 1.00 74.02 O ATOM 990 CB ILE A 61 0.551 2.777 12.055 1.00 5.51 C ATOM 991 CG1 ILE A 61 1.010 2.515 10.577 1.00 21.43 C ATOM 992 CG2 ILE A 61 -0.139 1.530 12.669 1.00 0.24 C ATOM 993 CD1 ILE A 61 -0.119 2.343 9.563 1.00 51.31 C ATOM 0 H ILE A 61 1.359 5.125 11.616 1.00 24.11 H new ATOM 0 HA ILE A 61 -1.242 3.875 11.509 1.00 70.23 H new ATOM 0 HB ILE A 61 1.440 2.970 12.655 1.00 5.51 H new ATOM 0 HG12 ILE A 61 1.640 3.345 10.257 1.00 21.43 H new ATOM 0 HG13 ILE A 61 1.631 1.619 10.560 1.00 21.43 H new ATOM 0 HG21 ILE A 61 0.528 0.671 12.594 1.00 0.24 H new ATOM 0 HG22 ILE A 61 -0.369 1.721 13.717 1.00 0.24 H new ATOM 0 HG23 ILE A 61 -1.062 1.321 12.127 1.00 0.24 H new ATOM 0 HD11 ILE A 61 0.304 2.167 8.574 1.00 51.31 H new ATOM 0 HD12 ILE A 61 -0.739 1.493 9.849 1.00 51.31 H new ATOM 0 HD13 ILE A 61 -0.729 3.246 9.541 1.00 51.31 H new ATOM 1005 N GLN A 62 -2.137 4.561 13.749 1.00 1.33 N ATOM 1006 CA GLN A 62 -2.747 4.835 15.057 1.00 13.15 C ATOM 1007 C GLN A 62 -3.060 3.485 15.756 1.00 22.34 C ATOM 1008 O GLN A 62 -4.097 2.875 15.525 1.00 14.24 O ATOM 1009 CB GLN A 62 -4.039 5.702 14.843 1.00 72.11 C ATOM 1010 CG GLN A 62 -4.478 6.587 16.034 1.00 33.54 C ATOM 1011 CD GLN A 62 -4.825 5.816 17.310 1.00 41.32 C ATOM 1012 OE1 GLN A 62 -3.844 5.610 18.168 1.00 4.43 O flip ATOM 1013 NE2 GLN A 62 -5.962 5.404 17.521 1.00 51.22 N flip ATOM 0 H GLN A 62 -2.800 4.583 12.974 1.00 1.33 H new ATOM 0 HA GLN A 62 -2.069 5.397 15.699 1.00 13.15 H new ATOM 0 HB2 GLN A 62 -3.879 6.347 13.979 1.00 72.11 H new ATOM 0 HB3 GLN A 62 -4.862 5.033 14.593 1.00 72.11 H new ATOM 0 HG2 GLN A 62 -3.679 7.293 16.258 1.00 33.54 H new ATOM 0 HG3 GLN A 62 -5.346 7.173 15.733 1.00 33.54 H new ATOM 0 HE21 GLN A 62 -6.702 5.577 16.841 1.00 51.22 H new ATOM 0 HE22 GLN A 62 -6.167 4.888 18.377 1.00 51.22 H new ATOM 1022 N ALA A 63 -2.143 3.048 16.618 1.00 72.13 N ATOM 1023 CA ALA A 63 -2.280 1.812 17.422 1.00 62.13 C ATOM 1024 C ALA A 63 -2.932 2.122 18.805 1.00 3.11 C ATOM 1025 O ALA A 63 -2.841 3.258 19.282 1.00 74.35 O ATOM 1026 CB ALA A 63 -0.887 1.164 17.581 1.00 53.14 C ATOM 0 H ALA A 63 -1.267 3.543 16.787 1.00 72.13 H new ATOM 0 HA ALA A 63 -2.939 1.110 16.911 1.00 62.13 H new ATOM 0 HB1 ALA A 63 -0.975 0.252 18.172 1.00 53.14 H new ATOM 0 HB2 ALA A 63 -0.484 0.922 16.598 1.00 53.14 H new ATOM 0 HB3 ALA A 63 -0.217 1.860 18.086 1.00 53.14 H new ATOM 1032 N PRO A 64 -3.596 1.120 19.482 1.00 41.52 N ATOM 1033 CA PRO A 64 -4.301 1.338 20.791 1.00 2.32 C ATOM 1034 C PRO A 64 -3.424 1.955 21.929 1.00 12.01 C ATOM 1035 O PRO A 64 -3.964 2.571 22.856 1.00 4.42 O ATOM 1036 CB PRO A 64 -4.798 -0.090 21.176 1.00 72.44 C ATOM 1037 CG PRO A 64 -3.986 -1.023 20.326 1.00 1.23 C ATOM 1038 CD PRO A 64 -3.763 -0.290 19.029 1.00 1.34 C ATOM 0 HA PRO A 64 -5.092 2.079 20.676 1.00 2.32 H new ATOM 0 HB2 PRO A 64 -4.646 -0.289 22.237 1.00 72.44 H new ATOM 0 HB3 PRO A 64 -5.864 -0.204 20.980 1.00 72.44 H new ATOM 0 HG2 PRO A 64 -3.039 -1.269 20.806 1.00 1.23 H new ATOM 0 HG3 PRO A 64 -4.513 -1.963 20.161 1.00 1.23 H new ATOM 0 HD2 PRO A 64 -2.881 -0.655 18.503 1.00 1.34 H new ATOM 0 HD3 PRO A 64 -4.608 -0.401 18.349 1.00 1.34 H new ATOM 1046 N GLN A 65 -2.086 1.794 21.851 1.00 70.23 N ATOM 1047 CA GLN A 65 -1.140 2.337 22.869 1.00 32.34 C ATOM 1048 C GLN A 65 0.075 3.061 22.191 1.00 4.32 C ATOM 1049 O GLN A 65 1.084 3.347 22.844 1.00 63.53 O ATOM 1050 CB GLN A 65 -0.664 1.164 23.790 1.00 22.52 C ATOM 1051 CG GLN A 65 0.029 1.587 25.110 1.00 75.41 C ATOM 1052 CD GLN A 65 0.653 0.408 25.860 1.00 32.13 C ATOM 1053 OE1 GLN A 65 1.812 0.073 25.657 1.00 64.42 O ATOM 1054 NE2 GLN A 65 -0.108 -0.232 26.724 1.00 3.42 N ATOM 0 H GLN A 65 -1.627 1.290 21.092 1.00 70.23 H new ATOM 0 HA GLN A 65 -1.651 3.086 23.474 1.00 32.34 H new ATOM 0 HB2 GLN A 65 -1.527 0.546 24.036 1.00 22.52 H new ATOM 0 HB3 GLN A 65 0.025 0.538 23.223 1.00 22.52 H new ATOM 0 HG2 GLN A 65 0.804 2.321 24.889 1.00 75.41 H new ATOM 0 HG3 GLN A 65 -0.699 2.077 25.756 1.00 75.41 H new ATOM 0 HE21 GLN A 65 -1.071 0.067 26.875 1.00 3.42 H new ATOM 0 HE22 GLN A 65 0.266 -1.027 27.242 1.00 3.42 H new ATOM 1063 N MET A 66 -0.048 3.402 20.889 1.00 11.33 N ATOM 1064 CA MET A 66 1.075 3.991 20.100 1.00 23.22 C ATOM 1065 C MET A 66 0.551 4.757 18.858 1.00 0.32 C ATOM 1066 O MET A 66 -0.485 4.421 18.322 1.00 64.41 O ATOM 1067 CB MET A 66 2.048 2.849 19.653 1.00 73.14 C ATOM 1068 CG MET A 66 3.278 3.295 18.840 1.00 15.43 C ATOM 1069 SD MET A 66 4.302 1.902 18.292 1.00 21.51 S ATOM 1070 CE MET A 66 3.180 0.998 17.219 1.00 14.54 C ATOM 0 H MET A 66 -0.910 3.283 20.356 1.00 11.33 H new ATOM 0 HA MET A 66 1.605 4.704 20.732 1.00 23.22 H new ATOM 0 HB2 MET A 66 2.395 2.324 20.543 1.00 73.14 H new ATOM 0 HB3 MET A 66 1.485 2.130 19.059 1.00 73.14 H new ATOM 0 HG2 MET A 66 2.946 3.861 17.969 1.00 15.43 H new ATOM 0 HG3 MET A 66 3.884 3.969 19.446 1.00 15.43 H new ATOM 0 HE1 MET A 66 3.751 0.325 16.579 1.00 14.54 H new ATOM 0 HE2 MET A 66 2.484 0.418 17.826 1.00 14.54 H new ATOM 0 HE3 MET A 66 2.623 1.701 16.600 1.00 14.54 H new ATOM 1080 N ILE A 67 1.264 5.816 18.428 1.00 54.21 N ATOM 1081 CA ILE A 67 1.047 6.463 17.107 1.00 24.55 C ATOM 1082 C ILE A 67 2.416 6.609 16.405 1.00 0.12 C ATOM 1083 O ILE A 67 3.251 7.417 16.823 1.00 3.40 O ATOM 1084 CB ILE A 67 0.332 7.874 17.222 1.00 50.32 C ATOM 1085 CG1 ILE A 67 -1.062 7.736 17.922 1.00 2.52 C ATOM 1086 CG2 ILE A 67 0.185 8.549 15.827 1.00 4.23 C ATOM 1087 CD1 ILE A 67 -1.849 9.029 18.078 1.00 73.05 C ATOM 0 H ILE A 67 2.005 6.250 18.979 1.00 54.21 H new ATOM 0 HA ILE A 67 0.378 5.831 16.523 1.00 24.55 H new ATOM 0 HB ILE A 67 0.962 8.516 17.838 1.00 50.32 H new ATOM 0 HG12 ILE A 67 -1.666 7.030 17.353 1.00 2.52 H new ATOM 0 HG13 ILE A 67 -0.911 7.302 18.910 1.00 2.52 H new ATOM 0 HG21 ILE A 67 -0.309 9.514 15.940 1.00 4.23 H new ATOM 0 HG22 ILE A 67 1.172 8.695 15.388 1.00 4.23 H new ATOM 0 HG23 ILE A 67 -0.411 7.911 15.175 1.00 4.23 H new ATOM 0 HD11 ILE A 67 -2.797 8.820 18.574 1.00 73.05 H new ATOM 0 HD12 ILE A 67 -1.274 9.735 18.677 1.00 73.05 H new ATOM 0 HD13 ILE A 67 -2.041 9.459 17.095 1.00 73.05 H new ATOM 1099 N SER A 68 2.639 5.798 15.353 1.00 25.24 N ATOM 1100 CA SER A 68 3.932 5.734 14.616 1.00 63.33 C ATOM 1101 C SER A 68 3.783 6.324 13.200 1.00 72.01 C ATOM 1102 O SER A 68 2.934 5.884 12.438 1.00 63.05 O ATOM 1103 CB SER A 68 4.408 4.267 14.525 1.00 24.02 C ATOM 1104 OG SER A 68 5.568 4.146 13.719 1.00 51.22 O ATOM 0 H SER A 68 1.931 5.164 14.983 1.00 25.24 H new ATOM 0 HA SER A 68 4.671 6.323 15.159 1.00 63.33 H new ATOM 0 HB2 SER A 68 4.618 3.889 15.526 1.00 24.02 H new ATOM 0 HB3 SER A 68 3.610 3.650 14.112 1.00 24.02 H new ATOM 0 HG SER A 68 5.845 3.207 13.683 1.00 51.22 H new ATOM 1110 N TYR A 69 4.652 7.281 12.842 1.00 53.44 N ATOM 1111 CA TYR A 69 4.505 8.107 11.614 1.00 33.31 C ATOM 1112 C TYR A 69 5.244 7.481 10.409 1.00 75.22 C ATOM 1113 O TYR A 69 6.309 6.879 10.567 1.00 64.22 O ATOM 1114 CB TYR A 69 5.018 9.548 11.904 1.00 31.55 C ATOM 1115 CG TYR A 69 4.335 10.185 13.122 1.00 12.31 C ATOM 1116 CD1 TYR A 69 4.780 9.904 14.417 1.00 32.34 C ATOM 1117 CD2 TYR A 69 3.214 11.011 12.988 1.00 3.42 C ATOM 1118 CE1 TYR A 69 4.146 10.421 15.521 1.00 42.30 C ATOM 1119 CE2 TYR A 69 2.569 11.524 14.097 1.00 14.12 C ATOM 1120 CZ TYR A 69 3.038 11.226 15.358 1.00 73.42 C ATOM 1121 OH TYR A 69 2.381 11.718 16.466 1.00 21.25 O ATOM 0 H TYR A 69 5.481 7.511 13.390 1.00 53.44 H new ATOM 0 HA TYR A 69 3.450 8.147 11.343 1.00 33.31 H new ATOM 0 HB2 TYR A 69 6.095 9.520 12.070 1.00 31.55 H new ATOM 0 HB3 TYR A 69 4.847 10.174 11.028 1.00 31.55 H new ATOM 0 HD1 TYR A 69 5.641 9.266 14.553 1.00 32.34 H new ATOM 0 HD2 TYR A 69 2.847 11.252 12.001 1.00 3.42 H new ATOM 0 HE1 TYR A 69 4.514 10.198 16.512 1.00 42.30 H new ATOM 0 HE2 TYR A 69 1.701 12.156 13.976 1.00 14.12 H new ATOM 0 HH TYR A 69 1.623 12.268 16.179 1.00 21.25 H new ATOM 1131 N THR A 70 4.668 7.643 9.196 1.00 21.32 N ATOM 1132 CA THR A 70 5.197 7.051 7.939 1.00 42.13 C ATOM 1133 C THR A 70 4.739 7.894 6.709 1.00 60.13 C ATOM 1134 O THR A 70 3.666 8.493 6.726 1.00 50.20 O ATOM 1135 CB THR A 70 4.746 5.549 7.766 1.00 73.42 C ATOM 1136 OG1 THR A 70 5.006 4.788 8.962 1.00 3.43 O ATOM 1137 CG2 THR A 70 5.470 4.861 6.598 1.00 63.04 C ATOM 0 H THR A 70 3.819 8.190 9.058 1.00 21.32 H new ATOM 0 HA THR A 70 6.285 7.067 8.000 1.00 42.13 H new ATOM 0 HB THR A 70 3.676 5.576 7.561 1.00 73.42 H new ATOM 0 HG1 THR A 70 4.716 3.861 8.830 1.00 3.43 H new ATOM 0 HG21 THR A 70 5.129 3.829 6.516 1.00 63.04 H new ATOM 0 HG22 THR A 70 5.250 5.391 5.671 1.00 63.04 H new ATOM 0 HG23 THR A 70 6.545 4.875 6.778 1.00 63.04 H new ATOM 1145 N ILE A 71 5.563 7.926 5.641 1.00 43.25 N ATOM 1146 CA ILE A 71 5.369 8.799 4.449 1.00 72.44 C ATOM 1147 C ILE A 71 5.345 7.954 3.154 1.00 63.42 C ATOM 1148 O ILE A 71 6.057 6.967 3.059 1.00 44.11 O ATOM 1149 CB ILE A 71 6.553 9.847 4.331 1.00 1.35 C ATOM 1150 CG1 ILE A 71 6.681 10.687 5.636 1.00 4.31 C ATOM 1151 CG2 ILE A 71 6.393 10.772 3.092 1.00 32.54 C ATOM 1152 CD1 ILE A 71 7.885 11.612 5.695 1.00 2.21 C ATOM 0 H ILE A 71 6.396 7.340 5.575 1.00 43.25 H new ATOM 0 HA ILE A 71 4.419 9.319 4.572 1.00 72.44 H new ATOM 0 HB ILE A 71 7.473 9.279 4.193 1.00 1.35 H new ATOM 0 HG12 ILE A 71 5.777 11.285 5.754 1.00 4.31 H new ATOM 0 HG13 ILE A 71 6.725 10.005 6.485 1.00 4.31 H new ATOM 0 HG21 ILE A 71 7.226 11.473 3.052 1.00 32.54 H new ATOM 0 HG22 ILE A 71 6.383 10.167 2.185 1.00 32.54 H new ATOM 0 HG23 ILE A 71 5.457 11.325 3.169 1.00 32.54 H new ATOM 0 HD11 ILE A 71 7.883 12.152 6.642 1.00 2.21 H new ATOM 0 HD12 ILE A 71 8.800 11.024 5.614 1.00 2.21 H new ATOM 0 HD13 ILE A 71 7.837 12.324 4.871 1.00 2.21 H new ATOM 1164 N ALA A 72 4.527 8.362 2.165 1.00 63.43 N ATOM 1165 CA ALA A 72 4.585 7.834 0.786 1.00 32.24 C ATOM 1166 C ALA A 72 4.721 9.005 -0.226 1.00 0.33 C ATOM 1167 O ALA A 72 3.815 9.835 -0.353 1.00 73.24 O ATOM 1168 CB ALA A 72 3.326 6.998 0.497 1.00 24.24 C ATOM 0 H ALA A 72 3.805 9.069 2.299 1.00 63.43 H new ATOM 0 HA ALA A 72 5.458 7.190 0.679 1.00 32.24 H new ATOM 0 HB1 ALA A 72 3.372 6.610 -0.521 1.00 24.24 H new ATOM 0 HB2 ALA A 72 3.272 6.167 1.200 1.00 24.24 H new ATOM 0 HB3 ALA A 72 2.440 7.624 0.607 1.00 24.24 H new ATOM 1174 N GLU A 73 5.856 9.063 -0.945 1.00 55.41 N ATOM 1175 CA GLU A 73 6.086 10.044 -2.025 1.00 54.22 C ATOM 1176 C GLU A 73 5.825 9.379 -3.389 1.00 3.02 C ATOM 1177 O GLU A 73 6.614 8.547 -3.838 1.00 71.34 O ATOM 1178 CB GLU A 73 7.552 10.566 -1.953 1.00 14.41 C ATOM 1179 CG GLU A 73 7.899 11.365 -0.680 1.00 15.23 C ATOM 1180 CD GLU A 73 7.129 12.695 -0.568 1.00 72.34 C ATOM 1181 OE1 GLU A 73 7.465 13.651 -1.304 1.00 40.54 O ATOM 1182 OE2 GLU A 73 6.191 12.800 0.254 1.00 34.03 O ATOM 0 H GLU A 73 6.642 8.431 -0.795 1.00 55.41 H new ATOM 0 HA GLU A 73 5.404 10.886 -1.905 1.00 54.22 H new ATOM 0 HB2 GLU A 73 8.229 9.714 -2.025 1.00 14.41 H new ATOM 0 HB3 GLU A 73 7.740 11.197 -2.822 1.00 14.41 H new ATOM 0 HG2 GLU A 73 7.683 10.753 0.195 1.00 15.23 H new ATOM 0 HG3 GLU A 73 8.969 11.570 -0.669 1.00 15.23 H new ATOM 1189 N TYR A 74 4.746 9.792 -4.062 1.00 33.41 N ATOM 1190 CA TYR A 74 4.308 9.184 -5.334 1.00 53.25 C ATOM 1191 C TYR A 74 5.157 9.711 -6.508 1.00 3.40 C ATOM 1192 O TYR A 74 5.042 10.871 -6.898 1.00 11.13 O ATOM 1193 CB TYR A 74 2.794 9.434 -5.549 1.00 20.03 C ATOM 1194 CG TYR A 74 1.905 8.737 -4.501 1.00 51.54 C ATOM 1195 CD1 TYR A 74 1.649 9.327 -3.259 1.00 21.30 C ATOM 1196 CD2 TYR A 74 1.338 7.480 -4.749 1.00 31.24 C ATOM 1197 CE1 TYR A 74 0.866 8.693 -2.312 1.00 1.34 C ATOM 1198 CE2 TYR A 74 0.552 6.846 -3.801 1.00 62.31 C ATOM 1199 CZ TYR A 74 0.319 7.457 -2.586 1.00 73.53 C ATOM 1200 OH TYR A 74 -0.460 6.829 -1.636 1.00 11.23 O ATOM 0 H TYR A 74 4.149 10.556 -3.745 1.00 33.41 H new ATOM 0 HA TYR A 74 4.461 8.106 -5.288 1.00 53.25 H new ATOM 0 HB2 TYR A 74 2.603 10.507 -5.521 1.00 20.03 H new ATOM 0 HB3 TYR A 74 2.513 9.085 -6.543 1.00 20.03 H new ATOM 0 HD1 TYR A 74 2.071 10.296 -3.035 1.00 21.30 H new ATOM 0 HD2 TYR A 74 1.517 6.996 -5.698 1.00 31.24 H new ATOM 0 HE1 TYR A 74 0.683 9.165 -1.358 1.00 1.34 H new ATOM 0 HE2 TYR A 74 0.123 5.877 -4.012 1.00 62.31 H new ATOM 0 HH TYR A 74 -1.304 7.316 -1.530 1.00 11.23 H new ATOM 1210 N LEU A 75 6.030 8.842 -7.044 1.00 41.31 N ATOM 1211 CA LEU A 75 7.001 9.211 -8.091 1.00 33.24 C ATOM 1212 C LEU A 75 6.337 9.189 -9.492 1.00 71.13 C ATOM 1213 O LEU A 75 6.428 10.170 -10.238 1.00 1.35 O ATOM 1214 CB LEU A 75 8.233 8.266 -8.014 1.00 61.51 C ATOM 1215 CG LEU A 75 9.474 8.643 -8.890 1.00 43.40 C ATOM 1216 CD1 LEU A 75 9.946 10.093 -8.627 1.00 54.43 C ATOM 1217 CD2 LEU A 75 10.630 7.637 -8.659 1.00 54.21 C ATOM 0 H LEU A 75 6.083 7.863 -6.764 1.00 41.31 H new ATOM 0 HA LEU A 75 7.345 10.231 -7.922 1.00 33.24 H new ATOM 0 HB2 LEU A 75 8.556 8.214 -6.974 1.00 61.51 H new ATOM 0 HB3 LEU A 75 7.910 7.264 -8.298 1.00 61.51 H new ATOM 0 HG LEU A 75 9.167 8.587 -9.934 1.00 43.40 H new ATOM 0 HD11 LEU A 75 10.809 10.314 -9.255 1.00 54.43 H new ATOM 0 HD12 LEU A 75 9.139 10.787 -8.862 1.00 54.43 H new ATOM 0 HD13 LEU A 75 10.223 10.201 -7.578 1.00 54.43 H new ATOM 0 HD21 LEU A 75 11.484 7.916 -9.277 1.00 54.21 H new ATOM 0 HD22 LEU A 75 10.921 7.653 -7.609 1.00 54.21 H new ATOM 0 HD23 LEU A 75 10.299 6.634 -8.929 1.00 54.21 H new ATOM 1229 N GLN A 76 5.668 8.065 -9.837 1.00 62.53 N ATOM 1230 CA GLN A 76 4.888 7.931 -11.104 1.00 3.44 C ATOM 1231 C GLN A 76 3.552 7.182 -10.864 1.00 3.44 C ATOM 1232 O GLN A 76 3.548 6.008 -10.517 1.00 40.50 O ATOM 1233 CB GLN A 76 5.711 7.165 -12.185 1.00 2.15 C ATOM 1234 CG GLN A 76 6.934 7.921 -12.746 1.00 1.52 C ATOM 1235 CD GLN A 76 7.693 7.134 -13.823 1.00 31.52 C ATOM 1236 OE1 GLN A 76 7.718 5.908 -13.821 1.00 63.30 O ATOM 1237 NE2 GLN A 76 8.319 7.832 -14.753 1.00 63.11 N ATOM 0 H GLN A 76 5.649 7.228 -9.255 1.00 62.53 H new ATOM 0 HA GLN A 76 4.674 8.940 -11.457 1.00 3.44 H new ATOM 0 HB2 GLN A 76 6.053 6.223 -11.757 1.00 2.15 H new ATOM 0 HB3 GLN A 76 5.048 6.916 -13.013 1.00 2.15 H new ATOM 0 HG2 GLN A 76 6.604 8.871 -13.165 1.00 1.52 H new ATOM 0 HG3 GLN A 76 7.616 8.153 -11.928 1.00 1.52 H new ATOM 0 HE21 GLN A 76 8.285 8.851 -14.735 1.00 63.11 H new ATOM 0 HE22 GLN A 76 8.837 7.352 -15.489 1.00 63.11 H new ATOM 1246 N VAL A 77 2.416 7.862 -11.078 1.00 33.24 N ATOM 1247 CA VAL A 77 1.077 7.218 -11.084 1.00 62.25 C ATOM 1248 C VAL A 77 0.429 7.441 -12.470 1.00 51.23 C ATOM 1249 O VAL A 77 0.069 8.572 -12.823 1.00 50.32 O ATOM 1250 CB VAL A 77 0.156 7.777 -9.928 1.00 51.33 C ATOM 1251 CG1 VAL A 77 -1.226 7.075 -9.918 1.00 61.11 C ATOM 1252 CG2 VAL A 77 0.852 7.647 -8.545 1.00 22.41 C ATOM 0 H VAL A 77 2.390 8.867 -11.251 1.00 33.24 H new ATOM 0 HA VAL A 77 1.193 6.150 -10.900 1.00 62.25 H new ATOM 0 HB VAL A 77 -0.010 8.836 -10.124 1.00 51.33 H new ATOM 0 HG11 VAL A 77 -1.835 7.482 -9.111 1.00 61.11 H new ATOM 0 HG12 VAL A 77 -1.727 7.244 -10.871 1.00 61.11 H new ATOM 0 HG13 VAL A 77 -1.089 6.005 -9.764 1.00 61.11 H new ATOM 0 HG21 VAL A 77 0.195 8.039 -7.769 1.00 22.41 H new ATOM 0 HG22 VAL A 77 1.066 6.598 -8.343 1.00 22.41 H new ATOM 0 HG23 VAL A 77 1.784 8.213 -8.552 1.00 22.41 H new ATOM 1262 N ASP A 78 0.291 6.357 -13.253 1.00 63.40 N ATOM 1263 CA ASP A 78 -0.092 6.432 -14.679 1.00 23.22 C ATOM 1264 C ASP A 78 -1.024 5.256 -15.053 1.00 0.41 C ATOM 1265 O ASP A 78 -0.598 4.094 -14.997 1.00 10.45 O ATOM 1266 CB ASP A 78 1.193 6.416 -15.555 1.00 53.12 C ATOM 1267 CG ASP A 78 0.910 6.579 -17.059 1.00 3.41 C ATOM 1268 OD1 ASP A 78 0.790 7.732 -17.526 1.00 23.04 O ATOM 1269 OD2 ASP A 78 0.805 5.560 -17.779 1.00 14.44 O ATOM 0 H ASP A 78 0.441 5.405 -12.919 1.00 63.40 H new ATOM 0 HA ASP A 78 -0.637 7.359 -14.859 1.00 23.22 H new ATOM 0 HB2 ASP A 78 1.856 7.217 -15.229 1.00 53.12 H new ATOM 0 HB3 ASP A 78 1.723 5.478 -15.392 1.00 53.12 H new ATOM 1274 N ALA A 79 -2.291 5.587 -15.428 1.00 21.03 N ATOM 1275 CA ALA A 79 -3.344 4.602 -15.805 1.00 30.31 C ATOM 1276 C ALA A 79 -3.807 3.731 -14.590 1.00 74.43 C ATOM 1277 O ALA A 79 -3.073 3.592 -13.607 1.00 34.10 O ATOM 1278 CB ALA A 79 -2.882 3.732 -17.004 1.00 44.04 C ATOM 0 H ALA A 79 -2.613 6.554 -15.477 1.00 21.03 H new ATOM 0 HA ALA A 79 -4.221 5.167 -16.123 1.00 30.31 H new ATOM 0 HB1 ALA A 79 -3.667 3.021 -17.261 1.00 44.04 H new ATOM 0 HB2 ALA A 79 -2.678 4.373 -17.862 1.00 44.04 H new ATOM 0 HB3 ALA A 79 -1.976 3.190 -16.733 1.00 44.04 H new ATOM 1284 N PRO A 80 -5.040 3.102 -14.635 1.00 22.24 N ATOM 1285 CA PRO A 80 -5.514 2.168 -13.562 1.00 14.40 C ATOM 1286 C PRO A 80 -4.658 0.872 -13.363 1.00 3.03 C ATOM 1287 O PRO A 80 -5.019 0.010 -12.555 1.00 72.43 O ATOM 1288 CB PRO A 80 -6.965 1.819 -14.006 1.00 51.43 C ATOM 1289 CG PRO A 80 -7.359 2.921 -14.941 1.00 41.45 C ATOM 1290 CD PRO A 80 -6.091 3.299 -15.672 1.00 45.32 C ATOM 0 HA PRO A 80 -5.437 2.647 -12.586 1.00 14.40 H new ATOM 0 HB2 PRO A 80 -7.004 0.849 -14.501 1.00 51.43 H new ATOM 0 HB3 PRO A 80 -7.638 1.768 -13.150 1.00 51.43 H new ATOM 0 HG2 PRO A 80 -8.130 2.589 -15.637 1.00 41.45 H new ATOM 0 HG3 PRO A 80 -7.767 3.772 -14.396 1.00 41.45 H new ATOM 0 HD2 PRO A 80 -5.923 2.666 -16.543 1.00 45.32 H new ATOM 0 HD3 PRO A 80 -6.121 4.329 -16.027 1.00 45.32 H new ATOM 1298 N TYR A 81 -3.531 0.751 -14.098 1.00 30.23 N ATOM 1299 CA TYR A 81 -2.689 -0.465 -14.126 1.00 65.04 C ATOM 1300 C TYR A 81 -1.250 -0.215 -13.592 1.00 54.42 C ATOM 1301 O TYR A 81 -0.441 -1.155 -13.561 1.00 24.53 O ATOM 1302 CB TYR A 81 -2.638 -1.002 -15.584 1.00 12.04 C ATOM 1303 CG TYR A 81 -4.034 -1.243 -16.210 1.00 72.32 C ATOM 1304 CD1 TYR A 81 -4.683 -2.475 -16.077 1.00 24.35 C ATOM 1305 CD2 TYR A 81 -4.699 -0.232 -16.919 1.00 43.24 C ATOM 1306 CE1 TYR A 81 -5.929 -2.692 -16.631 1.00 52.21 C ATOM 1307 CE2 TYR A 81 -5.948 -0.448 -17.470 1.00 10.20 C ATOM 1308 CZ TYR A 81 -6.556 -1.678 -17.326 1.00 10.12 C ATOM 1309 OH TYR A 81 -7.795 -1.900 -17.886 1.00 32.25 O ATOM 0 H TYR A 81 -3.177 1.500 -14.693 1.00 30.23 H new ATOM 0 HA TYR A 81 -3.139 -1.202 -13.461 1.00 65.04 H new ATOM 0 HB2 TYR A 81 -2.090 -0.292 -16.204 1.00 12.04 H new ATOM 0 HB3 TYR A 81 -2.078 -1.937 -15.598 1.00 12.04 H new ATOM 0 HD1 TYR A 81 -4.200 -3.272 -15.531 1.00 24.35 H new ATOM 0 HD2 TYR A 81 -4.227 0.732 -17.036 1.00 43.24 H new ATOM 0 HE1 TYR A 81 -6.411 -3.652 -16.521 1.00 52.21 H new ATOM 0 HE2 TYR A 81 -6.446 0.343 -18.011 1.00 10.20 H new ATOM 0 HH TYR A 81 -8.100 -1.086 -18.340 1.00 32.25 H new ATOM 1319 N TYR A 82 -0.930 1.040 -13.173 1.00 63.32 N ATOM 1320 CA TYR A 82 0.414 1.379 -12.626 1.00 22.40 C ATOM 1321 C TYR A 82 0.361 2.503 -11.564 1.00 41.12 C ATOM 1322 O TYR A 82 -0.104 3.617 -11.833 1.00 62.24 O ATOM 1323 CB TYR A 82 1.394 1.786 -13.759 1.00 65.11 C ATOM 1324 CG TYR A 82 2.841 2.067 -13.290 1.00 12.04 C ATOM 1325 CD1 TYR A 82 3.587 1.070 -12.664 1.00 42.20 C ATOM 1326 CD2 TYR A 82 3.464 3.308 -13.493 1.00 64.45 C ATOM 1327 CE1 TYR A 82 4.887 1.283 -12.261 1.00 3.22 C ATOM 1328 CE2 TYR A 82 4.770 3.527 -13.082 1.00 32.35 C ATOM 1329 CZ TYR A 82 5.476 2.511 -12.473 1.00 31.10 C ATOM 1330 OH TYR A 82 6.783 2.715 -12.087 1.00 1.15 O ATOM 0 H TYR A 82 -1.578 1.827 -13.203 1.00 63.32 H new ATOM 0 HA TYR A 82 0.776 0.474 -12.138 1.00 22.40 H new ATOM 0 HB2 TYR A 82 1.416 0.992 -14.505 1.00 65.11 H new ATOM 0 HB3 TYR A 82 1.007 2.677 -14.253 1.00 65.11 H new ATOM 0 HD1 TYR A 82 3.134 0.105 -12.490 1.00 42.20 H new ATOM 0 HD2 TYR A 82 2.918 4.104 -13.977 1.00 64.45 H new ATOM 0 HE1 TYR A 82 5.442 0.491 -11.781 1.00 3.22 H new ATOM 0 HE2 TYR A 82 5.233 4.490 -13.238 1.00 32.35 H new ATOM 0 HH TYR A 82 7.050 3.632 -12.307 1.00 1.15 H new ATOM 1340 N ILE A 83 0.857 2.179 -10.353 1.00 1.45 N ATOM 1341 CA ILE A 83 1.122 3.154 -9.271 1.00 42.10 C ATOM 1342 C ILE A 83 2.595 2.978 -8.809 1.00 52.21 C ATOM 1343 O ILE A 83 3.093 1.852 -8.764 1.00 42.32 O ATOM 1344 CB ILE A 83 0.173 2.969 -8.009 1.00 40.44 C ATOM 1345 CG1 ILE A 83 -1.354 2.909 -8.385 1.00 74.24 C ATOM 1346 CG2 ILE A 83 0.440 4.070 -6.945 1.00 73.40 C ATOM 1347 CD1 ILE A 83 -1.851 1.543 -8.858 1.00 31.44 C ATOM 0 H ILE A 83 1.089 1.220 -10.094 1.00 1.45 H new ATOM 0 HA ILE A 83 0.929 4.148 -9.674 1.00 42.10 H new ATOM 0 HB ILE A 83 0.422 1.999 -7.580 1.00 40.44 H new ATOM 0 HG12 ILE A 83 -1.939 3.210 -7.516 1.00 74.24 H new ATOM 0 HG13 ILE A 83 -1.548 3.641 -9.169 1.00 74.24 H new ATOM 0 HG21 ILE A 83 -0.222 3.920 -6.092 1.00 73.40 H new ATOM 0 HG22 ILE A 83 1.477 4.012 -6.614 1.00 73.40 H new ATOM 0 HG23 ILE A 83 0.253 5.051 -7.382 1.00 73.40 H new ATOM 0 HD11 ILE A 83 -2.914 1.604 -9.093 1.00 31.44 H new ATOM 0 HD12 ILE A 83 -1.299 1.243 -9.749 1.00 31.44 H new ATOM 0 HD13 ILE A 83 -1.695 0.806 -8.070 1.00 31.44 H new ATOM 1359 N GLU A 84 3.282 4.082 -8.468 1.00 12.13 N ATOM 1360 CA GLU A 84 4.664 4.048 -7.923 1.00 43.11 C ATOM 1361 C GLU A 84 4.828 5.093 -6.805 1.00 12.32 C ATOM 1362 O GLU A 84 4.497 6.268 -7.000 1.00 63.41 O ATOM 1363 CB GLU A 84 5.701 4.302 -9.055 1.00 61.40 C ATOM 1364 CG GLU A 84 7.164 4.469 -8.595 1.00 11.12 C ATOM 1365 CD GLU A 84 8.137 4.637 -9.775 1.00 55.53 C ATOM 1366 OE1 GLU A 84 8.210 5.735 -10.348 1.00 14.23 O ATOM 1367 OE2 GLU A 84 8.805 3.657 -10.156 1.00 3.05 O ATOM 0 H GLU A 84 2.902 5.024 -8.559 1.00 12.13 H new ATOM 0 HA GLU A 84 4.844 3.059 -7.502 1.00 43.11 H new ATOM 0 HB2 GLU A 84 5.653 3.472 -9.760 1.00 61.40 H new ATOM 0 HB3 GLU A 84 5.406 5.199 -9.599 1.00 61.40 H new ATOM 0 HG2 GLU A 84 7.239 5.337 -7.940 1.00 11.12 H new ATOM 0 HG3 GLU A 84 7.458 3.600 -8.007 1.00 11.12 H new ATOM 1374 N TYR A 85 5.344 4.656 -5.638 1.00 44.43 N ATOM 1375 CA TYR A 85 5.656 5.551 -4.504 1.00 70.25 C ATOM 1376 C TYR A 85 6.863 5.049 -3.682 1.00 13.20 C ATOM 1377 O TYR A 85 7.269 3.882 -3.772 1.00 24.11 O ATOM 1378 CB TYR A 85 4.415 5.776 -3.590 1.00 62.31 C ATOM 1379 CG TYR A 85 3.774 4.508 -2.996 1.00 65.24 C ATOM 1380 CD1 TYR A 85 2.795 3.797 -3.701 1.00 32.05 C ATOM 1381 CD2 TYR A 85 4.126 4.034 -1.727 1.00 40.11 C ATOM 1382 CE1 TYR A 85 2.202 2.670 -3.166 1.00 23.12 C ATOM 1383 CE2 TYR A 85 3.532 2.905 -1.190 1.00 62.02 C ATOM 1384 CZ TYR A 85 2.570 2.228 -1.913 1.00 3.20 C ATOM 1385 OH TYR A 85 1.975 1.099 -1.386 1.00 53.03 O ATOM 0 H TYR A 85 5.556 3.675 -5.455 1.00 44.43 H new ATOM 0 HA TYR A 85 5.933 6.513 -4.935 1.00 70.25 H new ATOM 0 HB2 TYR A 85 4.708 6.430 -2.768 1.00 62.31 H new ATOM 0 HB3 TYR A 85 3.657 6.307 -4.165 1.00 62.31 H new ATOM 0 HD1 TYR A 85 2.498 4.136 -4.682 1.00 32.05 H new ATOM 0 HD2 TYR A 85 4.876 4.560 -1.155 1.00 40.11 H new ATOM 0 HE1 TYR A 85 1.451 2.136 -3.729 1.00 23.12 H new ATOM 0 HE2 TYR A 85 3.820 2.555 -0.210 1.00 62.02 H new ATOM 0 HH TYR A 85 2.345 0.919 -0.496 1.00 53.03 H new ATOM 1395 N LEU A 86 7.420 5.967 -2.876 1.00 4.41 N ATOM 1396 CA LEU A 86 8.589 5.730 -2.014 1.00 43.45 C ATOM 1397 C LEU A 86 8.158 5.877 -0.544 1.00 72.51 C ATOM 1398 O LEU A 86 7.706 6.948 -0.141 1.00 51.11 O ATOM 1399 CB LEU A 86 9.680 6.783 -2.363 1.00 5.54 C ATOM 1400 CG LEU A 86 10.124 6.832 -3.862 1.00 51.22 C ATOM 1401 CD1 LEU A 86 11.015 8.057 -4.155 1.00 5.33 C ATOM 1402 CD2 LEU A 86 10.831 5.525 -4.265 1.00 34.44 C ATOM 0 H LEU A 86 7.061 6.919 -2.804 1.00 4.41 H new ATOM 0 HA LEU A 86 8.990 4.728 -2.170 1.00 43.45 H new ATOM 0 HB2 LEU A 86 9.310 7.769 -2.081 1.00 5.54 H new ATOM 0 HB3 LEU A 86 10.559 6.585 -1.750 1.00 5.54 H new ATOM 0 HG LEU A 86 9.224 6.935 -4.468 1.00 51.22 H new ATOM 0 HD11 LEU A 86 11.302 8.055 -5.206 1.00 5.33 H new ATOM 0 HD12 LEU A 86 10.463 8.970 -3.931 1.00 5.33 H new ATOM 0 HD13 LEU A 86 11.910 8.013 -3.534 1.00 5.33 H new ATOM 0 HD21 LEU A 86 11.131 5.581 -5.311 1.00 34.44 H new ATOM 0 HD22 LEU A 86 11.714 5.382 -3.642 1.00 34.44 H new ATOM 0 HD23 LEU A 86 10.150 4.685 -4.128 1.00 34.44 H new ATOM 1414 N ASP A 87 8.329 4.829 0.258 1.00 3.41 N ATOM 1415 CA ASP A 87 7.834 4.801 1.642 1.00 12.21 C ATOM 1416 C ASP A 87 8.986 5.094 2.632 1.00 75.22 C ATOM 1417 O ASP A 87 9.897 4.280 2.817 1.00 72.04 O ATOM 1418 CB ASP A 87 7.153 3.439 1.921 1.00 11.14 C ATOM 1419 CG ASP A 87 6.422 3.398 3.266 1.00 50.41 C ATOM 1420 OD1 ASP A 87 5.332 3.991 3.362 1.00 33.11 O ATOM 1421 OD2 ASP A 87 6.933 2.776 4.230 1.00 12.35 O ATOM 0 H ASP A 87 8.812 3.977 -0.026 1.00 3.41 H new ATOM 0 HA ASP A 87 7.087 5.582 1.783 1.00 12.21 H new ATOM 0 HB2 ASP A 87 6.444 3.224 1.122 1.00 11.14 H new ATOM 0 HB3 ASP A 87 7.906 2.652 1.899 1.00 11.14 H new ATOM 1426 N TYR A 88 8.956 6.288 3.234 1.00 72.00 N ATOM 1427 CA TYR A 88 9.932 6.704 4.255 1.00 44.25 C ATOM 1428 C TYR A 88 9.270 6.633 5.641 1.00 40.34 C ATOM 1429 O TYR A 88 8.289 7.337 5.884 1.00 31.52 O ATOM 1430 CB TYR A 88 10.412 8.161 3.985 1.00 32.30 C ATOM 1431 CG TYR A 88 11.052 8.383 2.604 1.00 20.35 C ATOM 1432 CD1 TYR A 88 12.419 8.165 2.394 1.00 74.22 C ATOM 1433 CD2 TYR A 88 10.287 8.814 1.513 1.00 35.22 C ATOM 1434 CE1 TYR A 88 12.994 8.364 1.150 1.00 72.14 C ATOM 1435 CE2 TYR A 88 10.862 9.014 0.272 1.00 21.42 C ATOM 1436 CZ TYR A 88 12.212 8.789 0.095 1.00 13.34 C ATOM 1437 OH TYR A 88 12.782 8.982 -1.148 1.00 53.54 O ATOM 0 H TYR A 88 8.253 6.998 3.028 1.00 72.00 H new ATOM 0 HA TYR A 88 10.794 6.038 4.217 1.00 44.25 H new ATOM 0 HB2 TYR A 88 9.561 8.834 4.088 1.00 32.30 H new ATOM 0 HB3 TYR A 88 11.133 8.439 4.753 1.00 32.30 H new ATOM 0 HD1 TYR A 88 13.036 7.836 3.217 1.00 74.22 H new ATOM 0 HD2 TYR A 88 9.230 8.993 1.643 1.00 35.22 H new ATOM 0 HE1 TYR A 88 14.050 8.187 1.006 1.00 72.14 H new ATOM 0 HE2 TYR A 88 10.256 9.346 -0.558 1.00 21.42 H new ATOM 0 HH TYR A 88 12.095 9.280 -1.780 1.00 53.54 H new ATOM 1447 N PHE A 89 9.795 5.788 6.548 1.00 55.30 N ATOM 1448 CA PHE A 89 9.388 5.811 7.972 1.00 15.55 C ATOM 1449 C PHE A 89 9.684 7.209 8.555 1.00 32.21 C ATOM 1450 O PHE A 89 10.826 7.645 8.531 1.00 35.52 O ATOM 1451 CB PHE A 89 10.134 4.715 8.783 1.00 22.43 C ATOM 1452 CG PHE A 89 9.822 4.726 10.285 1.00 62.44 C ATOM 1453 CD1 PHE A 89 8.589 4.283 10.761 1.00 61.12 C ATOM 1454 CD2 PHE A 89 10.752 5.207 11.213 1.00 62.34 C ATOM 1455 CE1 PHE A 89 8.299 4.314 12.113 1.00 24.10 C ATOM 1456 CE2 PHE A 89 10.456 5.242 12.564 1.00 22.44 C ATOM 1457 CZ PHE A 89 9.231 4.793 13.014 1.00 3.14 C ATOM 0 H PHE A 89 10.498 5.083 6.325 1.00 55.30 H new ATOM 0 HA PHE A 89 8.320 5.602 8.042 1.00 15.55 H new ATOM 0 HB2 PHE A 89 9.875 3.738 8.376 1.00 22.43 H new ATOM 0 HB3 PHE A 89 11.208 4.843 8.645 1.00 22.43 H new ATOM 0 HD1 PHE A 89 7.851 3.911 10.066 1.00 61.12 H new ATOM 0 HD2 PHE A 89 11.715 5.556 10.870 1.00 62.34 H new ATOM 0 HE1 PHE A 89 7.341 3.963 12.466 1.00 24.10 H new ATOM 0 HE2 PHE A 89 11.184 5.621 13.267 1.00 22.44 H new ATOM 0 HZ PHE A 89 9.001 4.816 14.069 1.00 3.14 H new ATOM 1467 N ALA A 90 8.647 7.895 9.044 1.00 4.24 N ATOM 1468 CA ALA A 90 8.764 9.278 9.545 1.00 63.01 C ATOM 1469 C ALA A 90 9.009 9.313 11.064 1.00 34.42 C ATOM 1470 O ALA A 90 8.520 8.453 11.804 1.00 3.22 O ATOM 1471 CB ALA A 90 7.505 10.074 9.184 1.00 70.35 C ATOM 0 H ALA A 90 7.703 7.514 9.106 1.00 4.24 H new ATOM 0 HA ALA A 90 9.628 9.738 9.065 1.00 63.01 H new ATOM 0 HB1 ALA A 90 7.600 11.094 9.557 1.00 70.35 H new ATOM 0 HB2 ALA A 90 7.385 10.094 8.101 1.00 70.35 H new ATOM 0 HB3 ALA A 90 6.633 9.601 9.637 1.00 70.35 H new ATOM 1477 N THR A 91 9.770 10.326 11.523 1.00 44.53 N ATOM 1478 CA THR A 91 10.029 10.540 12.964 1.00 72.42 C ATOM 1479 C THR A 91 8.794 11.189 13.665 1.00 73.35 C ATOM 1480 O THR A 91 8.191 10.563 14.547 1.00 44.21 O ATOM 1481 CB THR A 91 11.342 11.376 13.215 1.00 1.31 C ATOM 1482 OG1 THR A 91 11.471 11.696 14.611 1.00 12.43 O ATOM 1483 CG2 THR A 91 11.418 12.668 12.373 1.00 34.01 C ATOM 0 H THR A 91 10.218 11.012 10.916 1.00 44.53 H new ATOM 0 HA THR A 91 10.192 9.560 13.411 1.00 72.42 H new ATOM 0 HB THR A 91 12.171 10.744 12.897 1.00 1.31 H new ATOM 0 HG1 THR A 91 12.291 12.214 14.754 1.00 12.43 H new ATOM 0 HG21 THR A 91 12.347 13.193 12.596 1.00 34.01 H new ATOM 0 HG22 THR A 91 11.390 12.414 11.313 1.00 34.01 H new ATOM 0 HG23 THR A 91 10.571 13.310 12.615 1.00 34.01 H new ATOM 1491 N SER A 92 8.409 12.410 13.220 1.00 15.44 N ATOM 1492 CA SER A 92 7.265 13.202 13.771 1.00 4.23 C ATOM 1493 C SER A 92 7.239 14.622 13.152 1.00 45.15 C ATOM 1494 O SER A 92 6.170 15.194 12.922 1.00 13.10 O ATOM 1495 CB SER A 92 7.323 13.343 15.326 1.00 74.11 C ATOM 1496 OG SER A 92 6.213 14.076 15.835 1.00 63.34 O ATOM 0 H SER A 92 8.888 12.886 12.456 1.00 15.44 H new ATOM 0 HA SER A 92 6.361 12.652 13.509 1.00 4.23 H new ATOM 0 HB2 SER A 92 7.342 12.352 15.780 1.00 74.11 H new ATOM 0 HB3 SER A 92 8.249 13.842 15.611 1.00 74.11 H new ATOM 0 HG SER A 92 6.284 14.142 16.810 1.00 63.34 H new ATOM 1502 N LYS A 93 8.442 15.165 12.853 1.00 72.22 N ATOM 1503 CA LYS A 93 8.642 16.577 12.408 1.00 20.45 C ATOM 1504 C LYS A 93 8.262 16.842 10.918 1.00 43.34 C ATOM 1505 O LYS A 93 8.775 17.793 10.309 1.00 73.40 O ATOM 1506 CB LYS A 93 10.133 16.972 12.634 1.00 52.40 C ATOM 1507 CG LYS A 93 10.639 16.849 14.091 1.00 74.44 C ATOM 1508 CD LYS A 93 9.855 17.740 15.081 1.00 44.05 C ATOM 1509 CE LYS A 93 10.397 17.670 16.519 1.00 12.43 C ATOM 1510 NZ LYS A 93 9.567 18.468 17.459 1.00 15.34 N ATOM 0 H LYS A 93 9.312 14.637 12.912 1.00 72.22 H new ATOM 0 HA LYS A 93 7.965 17.187 13.006 1.00 20.45 H new ATOM 0 HB2 LYS A 93 10.758 16.346 11.996 1.00 52.40 H new ATOM 0 HB3 LYS A 93 10.272 18.002 12.305 1.00 52.40 H new ATOM 0 HG2 LYS A 93 10.564 15.809 14.409 1.00 74.44 H new ATOM 0 HG3 LYS A 93 11.695 17.118 14.127 1.00 74.44 H new ATOM 0 HD2 LYS A 93 9.890 18.773 14.736 1.00 44.05 H new ATOM 0 HD3 LYS A 93 8.807 17.439 15.079 1.00 44.05 H new ATOM 0 HE2 LYS A 93 10.423 16.631 16.848 1.00 12.43 H new ATOM 0 HE3 LYS A 93 11.423 18.036 16.539 1.00 12.43 H new ATOM 0 HZ1 LYS A 93 9.963 18.397 18.418 1.00 15.34 H new ATOM 0 HZ2 LYS A 93 9.563 19.464 17.159 1.00 15.34 H new ATOM 0 HZ3 LYS A 93 8.593 18.103 17.458 1.00 15.34 H new ATOM 1524 N GLY A 94 7.357 16.030 10.337 1.00 13.23 N ATOM 1525 CA GLY A 94 6.935 16.209 8.935 1.00 21.25 C ATOM 1526 C GLY A 94 7.912 15.634 7.902 1.00 24.02 C ATOM 1527 O GLY A 94 7.718 15.813 6.699 1.00 53.43 O ATOM 0 H GLY A 94 6.907 15.249 10.814 1.00 13.23 H new ATOM 0 HA2 GLY A 94 5.962 15.738 8.798 1.00 21.25 H new ATOM 0 HA3 GLY A 94 6.804 17.274 8.741 1.00 21.25 H new ATOM 1531 N GLU A 95 8.960 14.937 8.373 1.00 41.13 N ATOM 1532 CA GLU A 95 9.992 14.320 7.503 1.00 71.52 C ATOM 1533 C GLU A 95 10.329 12.892 7.992 1.00 25.42 C ATOM 1534 O GLU A 95 9.786 12.435 9.009 1.00 14.40 O ATOM 1535 CB GLU A 95 11.275 15.198 7.473 1.00 3.03 C ATOM 1536 CG GLU A 95 12.011 15.314 8.828 1.00 43.41 C ATOM 1537 CD GLU A 95 13.356 16.051 8.714 1.00 12.23 C ATOM 1538 OE1 GLU A 95 14.316 15.468 8.156 1.00 53.10 O ATOM 1539 OE2 GLU A 95 13.464 17.210 9.167 1.00 31.20 O ATOM 0 H GLU A 95 9.121 14.782 9.368 1.00 41.13 H new ATOM 0 HA GLU A 95 9.593 14.255 6.491 1.00 71.52 H new ATOM 0 HB2 GLU A 95 11.964 14.786 6.735 1.00 3.03 H new ATOM 0 HB3 GLU A 95 11.006 16.199 7.134 1.00 3.03 H new ATOM 0 HG2 GLU A 95 11.373 15.839 9.539 1.00 43.41 H new ATOM 0 HG3 GLU A 95 12.182 14.315 9.230 1.00 43.41 H new ATOM 1546 N LYS A 96 11.235 12.207 7.254 1.00 43.13 N ATOM 1547 CA LYS A 96 11.677 10.817 7.553 1.00 34.51 C ATOM 1548 C LYS A 96 12.355 10.690 8.950 1.00 61.11 C ATOM 1549 O LYS A 96 12.586 11.691 9.626 1.00 11.22 O ATOM 1550 CB LYS A 96 12.632 10.290 6.419 1.00 54.21 C ATOM 1551 CG LYS A 96 14.159 10.603 6.575 1.00 13.42 C ATOM 1552 CD LYS A 96 14.500 12.116 6.651 1.00 73.11 C ATOM 1553 CE LYS A 96 14.205 12.883 5.347 1.00 31.02 C ATOM 1554 NZ LYS A 96 14.545 14.325 5.465 1.00 53.03 N ATOM 0 H LYS A 96 11.685 12.603 6.428 1.00 43.13 H new ATOM 0 HA LYS A 96 10.782 10.196 7.583 1.00 34.51 H new ATOM 0 HB2 LYS A 96 12.513 9.209 6.351 1.00 54.21 H new ATOM 0 HB3 LYS A 96 12.295 10.708 5.470 1.00 54.21 H new ATOM 0 HG2 LYS A 96 14.527 10.114 7.477 1.00 13.42 H new ATOM 0 HG3 LYS A 96 14.695 10.164 5.733 1.00 13.42 H new ATOM 0 HD2 LYS A 96 13.932 12.567 7.464 1.00 73.11 H new ATOM 0 HD3 LYS A 96 15.555 12.230 6.898 1.00 73.11 H new ATOM 0 HE2 LYS A 96 14.774 12.441 4.529 1.00 31.02 H new ATOM 0 HE3 LYS A 96 13.150 12.778 5.094 1.00 31.02 H new ATOM 0 HZ1 LYS A 96 13.917 14.881 4.850 1.00 53.03 H new ATOM 0 HZ2 LYS A 96 14.423 14.631 6.452 1.00 53.03 H new ATOM 0 HZ3 LYS A 96 15.533 14.473 5.176 1.00 53.03 H new ATOM 1568 N ASP A 97 12.687 9.444 9.333 1.00 31.32 N ATOM 1569 CA ASP A 97 13.292 9.092 10.634 1.00 1.35 C ATOM 1570 C ASP A 97 14.550 9.951 10.944 1.00 33.03 C ATOM 1571 O ASP A 97 14.501 10.871 11.764 1.00 14.55 O ATOM 1572 CB ASP A 97 13.621 7.574 10.597 1.00 15.22 C ATOM 1573 CG ASP A 97 14.287 7.036 11.874 1.00 72.03 C ATOM 1574 OD1 ASP A 97 13.581 6.767 12.866 1.00 73.42 O ATOM 1575 OD2 ASP A 97 15.529 6.872 11.889 1.00 53.03 O ATOM 0 H ASP A 97 12.539 8.633 8.733 1.00 31.32 H new ATOM 0 HA ASP A 97 12.592 9.305 11.442 1.00 1.35 H new ATOM 0 HB2 ASP A 97 12.699 7.019 10.421 1.00 15.22 H new ATOM 0 HB3 ASP A 97 14.278 7.378 9.749 1.00 15.22 H new ATOM 1580 N THR A 98 15.660 9.632 10.261 1.00 20.02 N ATOM 1581 CA THR A 98 16.926 10.405 10.299 1.00 63.23 C ATOM 1582 C THR A 98 17.657 10.199 8.958 1.00 74.25 C ATOM 1583 O THR A 98 17.988 11.158 8.257 1.00 63.32 O ATOM 1584 CB THR A 98 17.892 9.974 11.471 1.00 63.43 C ATOM 1585 OG1 THR A 98 18.018 8.543 11.506 1.00 24.14 O ATOM 1586 CG2 THR A 98 17.446 10.482 12.856 1.00 73.41 C ATOM 0 H THR A 98 15.711 8.815 9.653 1.00 20.02 H new ATOM 0 HA THR A 98 16.664 11.449 10.472 1.00 63.23 H new ATOM 0 HB THR A 98 18.854 10.439 11.257 1.00 63.43 H new ATOM 0 HG1 THR A 98 17.142 8.142 11.684 1.00 24.14 H new ATOM 0 HG21 THR A 98 18.156 10.148 13.612 1.00 73.41 H new ATOM 0 HG22 THR A 98 17.409 11.571 12.849 1.00 73.41 H new ATOM 0 HG23 THR A 98 16.457 10.086 13.087 1.00 73.41 H new ATOM 1594 N SER A 99 17.872 8.913 8.610 1.00 43.23 N ATOM 1595 CA SER A 99 18.559 8.503 7.368 1.00 34.51 C ATOM 1596 C SER A 99 18.209 7.034 7.025 1.00 74.22 C ATOM 1597 O SER A 99 18.791 6.103 7.589 1.00 13.02 O ATOM 1598 CB SER A 99 20.098 8.680 7.508 1.00 55.31 C ATOM 1599 OG SER A 99 20.789 8.274 6.332 1.00 21.53 O ATOM 0 H SER A 99 17.572 8.126 9.186 1.00 43.23 H new ATOM 0 HA SER A 99 18.217 9.142 6.554 1.00 34.51 H new ATOM 0 HB2 SER A 99 20.325 9.725 7.720 1.00 55.31 H new ATOM 0 HB3 SER A 99 20.454 8.098 8.358 1.00 55.31 H new ATOM 0 HG SER A 99 21.752 8.402 6.458 1.00 21.53 H new ATOM 1605 N MET A 100 17.221 6.833 6.130 1.00 24.35 N ATOM 1606 CA MET A 100 16.806 5.482 5.661 1.00 52.55 C ATOM 1607 C MET A 100 16.528 5.483 4.128 1.00 41.51 C ATOM 1608 O MET A 100 16.068 6.503 3.586 1.00 21.55 O ATOM 1609 CB MET A 100 15.542 4.989 6.432 1.00 2.41 C ATOM 1610 CG MET A 100 14.276 5.837 6.230 1.00 22.04 C ATOM 1611 SD MET A 100 12.804 5.031 6.893 1.00 2.51 S ATOM 1612 CE MET A 100 12.682 3.551 5.876 1.00 41.51 C ATOM 0 H MET A 100 16.687 7.594 5.710 1.00 24.35 H new ATOM 0 HA MET A 100 17.628 4.796 5.864 1.00 52.55 H new ATOM 0 HB2 MET A 100 15.326 3.965 6.126 1.00 2.41 H new ATOM 0 HB3 MET A 100 15.774 4.961 7.497 1.00 2.41 H new ATOM 0 HG2 MET A 100 14.408 6.805 6.714 1.00 22.04 H new ATOM 0 HG3 MET A 100 14.135 6.029 5.166 1.00 22.04 H new ATOM 0 HE1 MET A 100 11.653 3.190 5.881 1.00 41.51 H new ATOM 0 HE2 MET A 100 12.980 3.786 4.854 1.00 41.51 H new ATOM 0 HE3 MET A 100 13.339 2.779 6.277 1.00 41.51 H new ATOM 1622 N PRO A 101 16.828 4.352 3.397 1.00 21.42 N ATOM 1623 CA PRO A 101 16.430 4.185 1.966 1.00 53.21 C ATOM 1624 C PRO A 101 14.884 4.133 1.761 1.00 53.41 C ATOM 1625 O PRO A 101 14.154 3.585 2.601 1.00 23.33 O ATOM 1626 CB PRO A 101 17.100 2.838 1.552 1.00 23.01 C ATOM 1627 CG PRO A 101 18.164 2.600 2.586 1.00 31.21 C ATOM 1628 CD PRO A 101 17.620 3.183 3.872 1.00 70.25 C ATOM 0 HA PRO A 101 16.749 5.033 1.360 1.00 53.21 H new ATOM 0 HB2 PRO A 101 16.375 2.024 1.537 1.00 23.01 H new ATOM 0 HB3 PRO A 101 17.529 2.901 0.552 1.00 23.01 H new ATOM 0 HG2 PRO A 101 18.373 1.536 2.696 1.00 31.21 H new ATOM 0 HG3 PRO A 101 19.100 3.081 2.303 1.00 31.21 H new ATOM 0 HD2 PRO A 101 17.000 2.466 4.410 1.00 70.25 H new ATOM 0 HD3 PRO A 101 18.419 3.484 4.549 1.00 70.25 H new ATOM 1636 N GLY A 102 14.412 4.702 0.630 1.00 41.43 N ATOM 1637 CA GLY A 102 12.981 4.748 0.298 1.00 14.31 C ATOM 1638 C GLY A 102 12.404 3.391 -0.134 1.00 63.12 C ATOM 1639 O GLY A 102 12.788 2.847 -1.176 1.00 53.41 O ATOM 0 H GLY A 102 15.012 5.138 -0.070 1.00 41.43 H new ATOM 0 HA2 GLY A 102 12.427 5.109 1.165 1.00 14.31 H new ATOM 0 HA3 GLY A 102 12.826 5.471 -0.503 1.00 14.31 H new ATOM 1643 N MET A 103 11.498 2.854 0.694 1.00 31.33 N ATOM 1644 CA MET A 103 10.769 1.589 0.442 1.00 12.23 C ATOM 1645 C MET A 103 9.870 1.716 -0.838 1.00 24.24 C ATOM 1646 O MET A 103 8.753 2.228 -0.797 1.00 71.44 O ATOM 1647 CB MET A 103 9.961 1.247 1.735 1.00 45.34 C ATOM 1648 CG MET A 103 8.955 0.103 1.635 1.00 13.45 C ATOM 1649 SD MET A 103 9.714 -1.497 1.354 1.00 4.13 S ATOM 1650 CE MET A 103 8.251 -2.512 1.243 1.00 75.31 C ATOM 0 H MET A 103 11.241 3.291 1.579 1.00 31.33 H new ATOM 0 HA MET A 103 11.455 0.768 0.233 1.00 12.23 H new ATOM 0 HB2 MET A 103 10.671 1.007 2.526 1.00 45.34 H new ATOM 0 HB3 MET A 103 9.426 2.143 2.049 1.00 45.34 H new ATOM 0 HG2 MET A 103 8.371 0.062 2.554 1.00 13.45 H new ATOM 0 HG3 MET A 103 8.258 0.313 0.824 1.00 13.45 H new ATOM 0 HE1 MET A 103 8.538 -3.563 1.229 1.00 75.31 H new ATOM 0 HE2 MET A 103 7.610 -2.322 2.104 1.00 75.31 H new ATOM 0 HE3 MET A 103 7.710 -2.271 0.328 1.00 75.31 H new ATOM 1660 N HIS A 104 10.402 1.258 -1.979 1.00 23.23 N ATOM 1661 CA HIS A 104 9.844 1.543 -3.325 1.00 41.12 C ATOM 1662 C HIS A 104 8.806 0.477 -3.786 1.00 2.14 C ATOM 1663 O HIS A 104 9.180 -0.597 -4.256 1.00 1.21 O ATOM 1664 CB HIS A 104 11.040 1.642 -4.317 1.00 14.23 C ATOM 1665 CG HIS A 104 10.686 1.797 -5.773 1.00 53.42 C ATOM 1666 ND1 HIS A 104 11.102 0.904 -6.734 1.00 24.20 N ATOM 1667 CD2 HIS A 104 10.015 2.766 -6.435 1.00 4.25 C ATOM 1668 CE1 HIS A 104 10.705 1.312 -7.913 1.00 0.41 C ATOM 1669 NE2 HIS A 104 10.045 2.438 -7.763 1.00 14.45 N ATOM 0 H HIS A 104 11.238 0.674 -2.003 1.00 23.23 H new ATOM 0 HA HIS A 104 9.292 2.482 -3.294 1.00 41.12 H new ATOM 0 HB2 HIS A 104 11.660 2.489 -4.023 1.00 14.23 H new ATOM 0 HB3 HIS A 104 11.652 0.746 -4.207 1.00 14.23 H new ATOM 0 HD2 HIS A 104 9.544 3.635 -5.998 1.00 4.25 H new ATOM 0 HE1 HIS A 104 10.889 0.808 -8.850 1.00 0.41 H new ATOM 0 HE2 HIS A 104 9.623 2.981 -8.516 1.00 14.45 H new ATOM 1678 N ILE A 105 7.500 0.790 -3.653 1.00 1.00 N ATOM 1679 CA ILE A 105 6.409 -0.087 -4.154 1.00 21.01 C ATOM 1680 C ILE A 105 5.967 0.375 -5.568 1.00 15.11 C ATOM 1681 O ILE A 105 5.646 1.553 -5.769 1.00 62.22 O ATOM 1682 CB ILE A 105 5.125 -0.132 -3.212 1.00 43.02 C ATOM 1683 CG1 ILE A 105 5.403 -0.742 -1.803 1.00 21.34 C ATOM 1684 CG2 ILE A 105 3.991 -0.952 -3.873 1.00 34.23 C ATOM 1685 CD1 ILE A 105 6.325 0.051 -0.903 1.00 63.33 C ATOM 0 H ILE A 105 7.170 1.644 -3.203 1.00 1.00 H new ATOM 0 HA ILE A 105 6.827 -1.093 -4.174 1.00 21.01 H new ATOM 0 HB ILE A 105 4.832 0.909 -3.077 1.00 43.02 H new ATOM 0 HG12 ILE A 105 4.450 -0.869 -1.290 1.00 21.34 H new ATOM 0 HG13 ILE A 105 5.828 -1.737 -1.938 1.00 21.34 H new ATOM 0 HG21 ILE A 105 3.123 -0.970 -3.213 1.00 34.23 H new ATOM 0 HG22 ILE A 105 3.716 -0.493 -4.822 1.00 34.23 H new ATOM 0 HG23 ILE A 105 4.334 -1.971 -4.049 1.00 34.23 H new ATOM 0 HD11 ILE A 105 6.443 -0.470 0.047 1.00 63.33 H new ATOM 0 HD12 ILE A 105 7.298 0.157 -1.382 1.00 63.33 H new ATOM 0 HD13 ILE A 105 5.899 1.038 -0.725 1.00 63.33 H new ATOM 1697 N THR A 106 5.976 -0.560 -6.538 1.00 3.43 N ATOM 1698 CA THR A 106 5.349 -0.374 -7.869 1.00 14.32 C ATOM 1699 C THR A 106 4.291 -1.463 -8.097 1.00 62.43 C ATOM 1700 O THR A 106 4.618 -2.650 -8.159 1.00 65.33 O ATOM 1701 CB THR A 106 6.400 -0.420 -9.027 1.00 4.25 C ATOM 1702 OG1 THR A 106 7.200 -1.613 -8.932 1.00 65.30 O ATOM 1703 CG2 THR A 106 7.306 0.806 -8.998 1.00 61.11 C ATOM 0 H THR A 106 6.420 -1.471 -6.423 1.00 3.43 H new ATOM 0 HA THR A 106 4.886 0.613 -7.879 1.00 14.32 H new ATOM 0 HB THR A 106 5.854 -0.425 -9.970 1.00 4.25 H new ATOM 0 HG1 THR A 106 7.852 -1.629 -9.664 1.00 65.30 H new ATOM 0 HG21 THR A 106 8.026 0.746 -9.814 1.00 61.11 H new ATOM 0 HG22 THR A 106 6.703 1.707 -9.112 1.00 61.11 H new ATOM 0 HG23 THR A 106 7.838 0.843 -8.047 1.00 61.11 H new ATOM 1711 N LEU A 107 3.019 -1.056 -8.238 1.00 44.41 N ATOM 1712 CA LEU A 107 1.895 -1.995 -8.374 1.00 4.23 C ATOM 1713 C LEU A 107 1.452 -2.072 -9.856 1.00 54.20 C ATOM 1714 O LEU A 107 0.951 -1.089 -10.410 1.00 72.23 O ATOM 1715 CB LEU A 107 0.698 -1.578 -7.456 1.00 54.44 C ATOM 1716 CG LEU A 107 1.030 -1.143 -5.975 1.00 20.40 C ATOM 1717 CD1 LEU A 107 1.402 0.350 -5.890 1.00 45.21 C ATOM 1718 CD2 LEU A 107 -0.141 -1.473 -5.021 1.00 34.13 C ATOM 0 H LEU A 107 2.743 -0.074 -8.261 1.00 44.41 H new ATOM 0 HA LEU A 107 2.226 -2.983 -8.053 1.00 4.23 H new ATOM 0 HB2 LEU A 107 0.175 -0.753 -7.939 1.00 54.44 H new ATOM 0 HB3 LEU A 107 0.001 -2.415 -7.412 1.00 54.44 H new ATOM 0 HG LEU A 107 1.900 -1.718 -5.657 1.00 20.40 H new ATOM 0 HD11 LEU A 107 1.624 0.611 -4.855 1.00 45.21 H new ATOM 0 HD12 LEU A 107 2.279 0.542 -6.509 1.00 45.21 H new ATOM 0 HD13 LEU A 107 0.567 0.954 -6.246 1.00 45.21 H new ATOM 0 HD21 LEU A 107 0.116 -1.162 -4.008 1.00 34.13 H new ATOM 0 HD22 LEU A 107 -1.036 -0.943 -5.347 1.00 34.13 H new ATOM 0 HD23 LEU A 107 -0.330 -2.546 -5.034 1.00 34.13 H new ATOM 1730 N ASN A 108 1.658 -3.248 -10.479 1.00 50.01 N ATOM 1731 CA ASN A 108 1.311 -3.516 -11.898 1.00 50.51 C ATOM 1732 C ASN A 108 0.394 -4.752 -12.037 1.00 51.54 C ATOM 1733 O ASN A 108 0.448 -5.676 -11.220 1.00 11.11 O ATOM 1734 CB ASN A 108 2.604 -3.748 -12.732 1.00 21.31 C ATOM 1735 CG ASN A 108 3.397 -2.472 -12.990 1.00 11.14 C ATOM 1736 OD1 ASN A 108 4.275 -2.100 -12.223 1.00 71.40 O ATOM 1737 ND2 ASN A 108 3.087 -1.786 -14.073 1.00 55.01 N ATOM 0 H ASN A 108 2.075 -4.052 -10.010 1.00 50.01 H new ATOM 0 HA ASN A 108 0.776 -2.643 -12.272 1.00 50.51 H new ATOM 0 HB2 ASN A 108 3.240 -4.463 -12.210 1.00 21.31 H new ATOM 0 HB3 ASN A 108 2.335 -4.199 -13.687 1.00 21.31 H new ATOM 0 HD21 ASN A 108 3.584 -0.922 -14.289 1.00 55.01 H new ATOM 0 HD22 ASN A 108 2.351 -2.120 -14.695 1.00 55.01 H new ATOM 1744 N PHE A 109 -0.443 -4.754 -13.088 1.00 1.21 N ATOM 1745 CA PHE A 109 -1.212 -5.946 -13.504 1.00 62.01 C ATOM 1746 C PHE A 109 -0.359 -6.841 -14.432 1.00 20.33 C ATOM 1747 O PHE A 109 -0.131 -6.499 -15.596 1.00 73.45 O ATOM 1748 CB PHE A 109 -2.544 -5.538 -14.207 1.00 53.53 C ATOM 1749 CG PHE A 109 -3.625 -5.071 -13.238 1.00 52.31 C ATOM 1750 CD1 PHE A 109 -3.561 -3.814 -12.645 1.00 75.11 C ATOM 1751 CD2 PHE A 109 -4.698 -5.903 -12.905 1.00 45.44 C ATOM 1752 CE1 PHE A 109 -4.528 -3.404 -11.751 1.00 13.34 C ATOM 1753 CE2 PHE A 109 -5.661 -5.492 -12.006 1.00 13.30 C ATOM 1754 CZ PHE A 109 -5.577 -4.242 -11.432 1.00 32.44 C ATOM 0 H PHE A 109 -0.607 -3.935 -13.673 1.00 1.21 H new ATOM 0 HA PHE A 109 -1.466 -6.514 -12.609 1.00 62.01 H new ATOM 0 HB2 PHE A 109 -2.339 -4.741 -14.922 1.00 53.53 H new ATOM 0 HB3 PHE A 109 -2.920 -6.388 -14.776 1.00 53.53 H new ATOM 0 HD1 PHE A 109 -2.744 -3.151 -12.888 1.00 75.11 H new ATOM 0 HD2 PHE A 109 -4.774 -6.881 -13.357 1.00 45.44 H new ATOM 0 HE1 PHE A 109 -4.464 -2.425 -11.300 1.00 13.34 H new ATOM 0 HE2 PHE A 109 -6.480 -6.149 -11.753 1.00 13.30 H new ATOM 0 HZ PHE A 109 -6.333 -3.918 -10.732 1.00 32.44 H new ATOM 1764 N GLU A 110 0.134 -7.972 -13.884 1.00 40.20 N ATOM 1765 CA GLU A 110 0.801 -9.038 -14.677 1.00 52.35 C ATOM 1766 C GLU A 110 -0.223 -9.723 -15.620 1.00 75.25 C ATOM 1767 O GLU A 110 0.116 -10.155 -16.728 1.00 41.11 O ATOM 1768 CB GLU A 110 1.436 -10.101 -13.729 1.00 43.25 C ATOM 1769 CG GLU A 110 2.418 -9.534 -12.682 1.00 13.31 C ATOM 1770 CD GLU A 110 2.966 -10.613 -11.724 1.00 71.43 C ATOM 1771 OE1 GLU A 110 2.183 -11.137 -10.896 1.00 2.51 O ATOM 1772 OE2 GLU A 110 4.165 -10.955 -11.798 1.00 45.44 O ATOM 0 H GLU A 110 0.084 -8.176 -12.886 1.00 40.20 H new ATOM 0 HA GLU A 110 1.589 -8.582 -15.276 1.00 52.35 H new ATOM 0 HB2 GLU A 110 0.636 -10.626 -13.208 1.00 43.25 H new ATOM 0 HB3 GLU A 110 1.960 -10.840 -14.335 1.00 43.25 H new ATOM 0 HG2 GLU A 110 3.251 -9.055 -13.196 1.00 13.31 H new ATOM 0 HG3 GLU A 110 1.915 -8.761 -12.101 1.00 13.31 H new ATOM 1832 N GLY A 114 -11.012 -10.391 -14.485 1.00 52.30 N ATOM 1833 CA GLY A 114 -12.299 -9.757 -14.143 1.00 1.13 C ATOM 1834 C GLY A 114 -12.361 -9.411 -12.649 1.00 61.53 C ATOM 1835 O GLY A 114 -12.931 -8.391 -12.244 1.00 21.23 O ATOM 0 HA2 GLY A 114 -12.431 -8.852 -14.736 1.00 1.13 H new ATOM 0 HA3 GLY A 114 -13.119 -10.428 -14.399 1.00 1.13 H new ATOM 1839 N LYS A 115 -11.776 -10.300 -11.836 1.00 62.54 N ATOM 1840 CA LYS A 115 -11.524 -10.067 -10.404 1.00 23.24 C ATOM 1841 C LYS A 115 -10.157 -9.363 -10.239 1.00 3.43 C ATOM 1842 O LYS A 115 -9.103 -9.978 -10.439 1.00 31.21 O ATOM 1843 CB LYS A 115 -11.546 -11.417 -9.652 1.00 33.51 C ATOM 1844 CG LYS A 115 -12.892 -12.174 -9.733 1.00 54.34 C ATOM 1845 CD LYS A 115 -12.789 -13.629 -9.221 1.00 74.31 C ATOM 1846 CE LYS A 115 -12.363 -13.733 -7.746 1.00 63.33 C ATOM 1847 NZ LYS A 115 -12.133 -15.140 -7.343 1.00 32.25 N ATOM 0 H LYS A 115 -11.459 -11.215 -12.157 1.00 62.54 H new ATOM 0 HA LYS A 115 -12.299 -9.427 -9.983 1.00 23.24 H new ATOM 0 HB2 LYS A 115 -10.760 -12.056 -10.054 1.00 33.51 H new ATOM 0 HB3 LYS A 115 -11.306 -11.239 -8.604 1.00 33.51 H new ATOM 0 HG2 LYS A 115 -13.641 -11.639 -9.148 1.00 54.34 H new ATOM 0 HG3 LYS A 115 -13.239 -12.180 -10.766 1.00 54.34 H new ATOM 0 HD2 LYS A 115 -13.754 -14.119 -9.347 1.00 74.31 H new ATOM 0 HD3 LYS A 115 -12.072 -14.172 -9.837 1.00 74.31 H new ATOM 0 HE2 LYS A 115 -11.452 -13.155 -7.588 1.00 63.33 H new ATOM 0 HE3 LYS A 115 -13.133 -13.294 -7.112 1.00 63.33 H new ATOM 0 HZ1 LYS A 115 -11.847 -15.173 -6.343 1.00 32.25 H new ATOM 0 HZ2 LYS A 115 -13.009 -15.685 -7.471 1.00 32.25 H new ATOM 0 HZ3 LYS A 115 -11.381 -15.551 -7.932 1.00 32.25 H new ATOM 1861 N THR A 116 -10.197 -8.079 -9.863 1.00 64.31 N ATOM 1862 CA THR A 116 -9.026 -7.176 -9.902 1.00 60.23 C ATOM 1863 C THR A 116 -7.860 -7.649 -9.006 1.00 10.10 C ATOM 1864 O THR A 116 -7.977 -7.695 -7.783 1.00 14.23 O ATOM 1865 CB THR A 116 -9.439 -5.734 -9.484 1.00 51.41 C ATOM 1866 OG1 THR A 116 -10.163 -5.770 -8.237 1.00 71.44 O ATOM 1867 CG2 THR A 116 -10.307 -5.067 -10.557 1.00 30.52 C ATOM 0 H THR A 116 -11.045 -7.628 -9.520 1.00 64.31 H new ATOM 0 HA THR A 116 -8.670 -7.187 -10.932 1.00 60.23 H new ATOM 0 HB THR A 116 -8.527 -5.148 -9.366 1.00 51.41 H new ATOM 0 HG1 THR A 116 -11.104 -5.550 -8.399 1.00 71.44 H new ATOM 0 HG21 THR A 116 -10.578 -4.062 -10.233 1.00 30.52 H new ATOM 0 HG22 THR A 116 -9.750 -5.009 -11.492 1.00 30.52 H new ATOM 0 HG23 THR A 116 -11.212 -5.655 -10.710 1.00 30.52 H new ATOM 1875 N THR A 117 -6.733 -7.989 -9.649 1.00 72.00 N ATOM 1876 CA THR A 117 -5.513 -8.447 -8.960 1.00 51.44 C ATOM 1877 C THR A 117 -4.335 -7.535 -9.343 1.00 42.13 C ATOM 1878 O THR A 117 -3.754 -7.684 -10.424 1.00 3.34 O ATOM 1879 CB THR A 117 -5.179 -9.933 -9.349 1.00 50.32 C ATOM 1880 OG1 THR A 117 -6.326 -10.771 -9.132 1.00 1.44 O ATOM 1881 CG2 THR A 117 -3.982 -10.490 -8.555 1.00 71.00 C ATOM 0 H THR A 117 -6.640 -7.955 -10.664 1.00 72.00 H new ATOM 0 HA THR A 117 -5.681 -8.400 -7.884 1.00 51.44 H new ATOM 0 HB THR A 117 -4.909 -9.934 -10.405 1.00 50.32 H new ATOM 0 HG1 THR A 117 -7.066 -10.465 -9.697 1.00 1.44 H new ATOM 0 HG21 THR A 117 -3.791 -11.519 -8.859 1.00 71.00 H new ATOM 0 HG22 THR A 117 -3.099 -9.883 -8.754 1.00 71.00 H new ATOM 0 HG23 THR A 117 -4.208 -10.463 -7.489 1.00 71.00 H new ATOM 1889 N VAL A 118 -4.001 -6.573 -8.467 1.00 4.24 N ATOM 1890 CA VAL A 118 -2.851 -5.677 -8.689 1.00 64.35 C ATOM 1891 C VAL A 118 -1.643 -6.172 -7.858 1.00 54.14 C ATOM 1892 O VAL A 118 -1.707 -6.304 -6.626 1.00 24.41 O ATOM 1893 CB VAL A 118 -3.206 -4.162 -8.401 1.00 43.43 C ATOM 1894 CG1 VAL A 118 -3.481 -3.867 -6.913 1.00 0.44 C ATOM 1895 CG2 VAL A 118 -2.120 -3.214 -8.976 1.00 33.32 C ATOM 0 H VAL A 118 -4.509 -6.395 -7.600 1.00 4.24 H new ATOM 0 HA VAL A 118 -2.580 -5.713 -9.744 1.00 64.35 H new ATOM 0 HB VAL A 118 -4.144 -3.967 -8.920 1.00 43.43 H new ATOM 0 HG11 VAL A 118 -3.718 -2.810 -6.789 1.00 0.44 H new ATOM 0 HG12 VAL A 118 -4.323 -4.470 -6.572 1.00 0.44 H new ATOM 0 HG13 VAL A 118 -2.597 -4.112 -6.324 1.00 0.44 H new ATOM 0 HG21 VAL A 118 -2.390 -2.180 -8.763 1.00 33.32 H new ATOM 0 HG22 VAL A 118 -1.159 -3.440 -8.515 1.00 33.32 H new ATOM 0 HG23 VAL A 118 -2.047 -3.356 -10.054 1.00 33.32 H new ATOM 1905 N THR A 119 -0.582 -6.526 -8.569 1.00 71.24 N ATOM 1906 CA THR A 119 0.632 -7.112 -7.990 1.00 45.22 C ATOM 1907 C THR A 119 1.644 -6.013 -7.567 1.00 21.41 C ATOM 1908 O THR A 119 2.224 -5.335 -8.421 1.00 21.14 O ATOM 1909 CB THR A 119 1.283 -8.076 -9.025 1.00 10.01 C ATOM 1910 OG1 THR A 119 0.339 -9.087 -9.427 1.00 61.22 O ATOM 1911 CG2 THR A 119 2.542 -8.754 -8.478 1.00 40.10 C ATOM 0 H THR A 119 -0.534 -6.415 -9.582 1.00 71.24 H new ATOM 0 HA THR A 119 0.356 -7.668 -7.094 1.00 45.22 H new ATOM 0 HB THR A 119 1.573 -7.469 -9.883 1.00 10.01 H new ATOM 0 HG1 THR A 119 0.806 -9.792 -9.923 1.00 61.22 H new ATOM 0 HG21 THR A 119 2.958 -9.416 -9.238 1.00 40.10 H new ATOM 0 HG22 THR A 119 3.279 -7.995 -8.215 1.00 40.10 H new ATOM 0 HG23 THR A 119 2.287 -9.335 -7.591 1.00 40.10 H new ATOM 1919 N SER A 120 1.855 -5.853 -6.244 1.00 20.24 N ATOM 1920 CA SER A 120 2.753 -4.818 -5.683 1.00 70.31 C ATOM 1921 C SER A 120 4.202 -5.345 -5.501 1.00 63.14 C ATOM 1922 O SER A 120 4.482 -6.148 -4.612 1.00 31.23 O ATOM 1923 CB SER A 120 2.185 -4.323 -4.324 1.00 30.23 C ATOM 1924 OG SER A 120 2.221 -5.322 -3.320 1.00 61.43 O ATOM 0 H SER A 120 1.410 -6.435 -5.535 1.00 20.24 H new ATOM 0 HA SER A 120 2.798 -3.989 -6.389 1.00 70.31 H new ATOM 0 HB2 SER A 120 2.756 -3.457 -3.990 1.00 30.23 H new ATOM 0 HB3 SER A 120 1.156 -3.991 -4.464 1.00 30.23 H new ATOM 0 HG SER A 120 2.971 -5.929 -3.489 1.00 61.43 H new ATOM 1930 N THR A 121 5.125 -4.868 -6.348 1.00 12.21 N ATOM 1931 CA THR A 121 6.569 -5.148 -6.199 1.00 73.01 C ATOM 1932 C THR A 121 7.155 -4.218 -5.117 1.00 64.15 C ATOM 1933 O THR A 121 7.395 -3.030 -5.358 1.00 74.23 O ATOM 1934 CB THR A 121 7.345 -4.973 -7.546 1.00 4.20 C ATOM 1935 OG1 THR A 121 6.730 -5.786 -8.560 1.00 43.24 O ATOM 1936 CG2 THR A 121 8.839 -5.354 -7.418 1.00 31.14 C ATOM 0 H THR A 121 4.899 -4.281 -7.151 1.00 12.21 H new ATOM 0 HA THR A 121 6.685 -6.189 -5.899 1.00 73.01 H new ATOM 0 HB THR A 121 7.297 -3.919 -7.818 1.00 4.20 H new ATOM 0 HG1 THR A 121 7.214 -5.676 -9.405 1.00 43.24 H new ATOM 0 HG21 THR A 121 9.334 -5.215 -8.379 1.00 31.14 H new ATOM 0 HG22 THR A 121 9.314 -4.718 -6.671 1.00 31.14 H new ATOM 0 HG23 THR A 121 8.924 -6.397 -7.114 1.00 31.14 H new ATOM 1944 N SER A 122 7.349 -4.779 -3.921 1.00 4.00 N ATOM 1945 CA SER A 122 7.709 -4.022 -2.708 1.00 73.32 C ATOM 1946 C SER A 122 9.233 -4.079 -2.476 1.00 63.44 C ATOM 1947 O SER A 122 9.761 -5.114 -2.064 1.00 61.54 O ATOM 1948 CB SER A 122 6.938 -4.613 -1.498 1.00 31.35 C ATOM 1949 OG SER A 122 5.533 -4.571 -1.717 1.00 63.43 O ATOM 0 H SER A 122 7.261 -5.782 -3.760 1.00 4.00 H new ATOM 0 HA SER A 122 7.431 -2.975 -2.829 1.00 73.32 H new ATOM 0 HB2 SER A 122 7.253 -5.643 -1.330 1.00 31.35 H new ATOM 0 HB3 SER A 122 7.186 -4.053 -0.596 1.00 31.35 H new ATOM 0 HG SER A 122 5.070 -4.950 -0.941 1.00 63.43 H new ATOM 1955 N THR A 123 9.934 -2.965 -2.757 1.00 45.24 N ATOM 1956 CA THR A 123 11.409 -2.891 -2.626 1.00 44.52 C ATOM 1957 C THR A 123 11.800 -2.434 -1.212 1.00 43.13 C ATOM 1958 O THR A 123 11.770 -1.240 -0.892 1.00 5.20 O ATOM 1959 CB THR A 123 12.049 -1.931 -3.693 1.00 63.34 C ATOM 1960 OG1 THR A 123 11.608 -2.301 -5.012 1.00 62.31 O ATOM 1961 CG2 THR A 123 13.595 -1.945 -3.655 1.00 44.45 C ATOM 0 H THR A 123 9.504 -2.098 -3.078 1.00 45.24 H new ATOM 0 HA THR A 123 11.798 -3.893 -2.805 1.00 44.52 H new ATOM 0 HB THR A 123 11.720 -0.921 -3.448 1.00 63.34 H new ATOM 0 HG1 THR A 123 10.732 -1.898 -5.189 1.00 62.31 H new ATOM 0 HG21 THR A 123 13.984 -1.264 -4.412 1.00 44.45 H new ATOM 0 HG22 THR A 123 13.938 -1.626 -2.671 1.00 44.45 H new ATOM 0 HG23 THR A 123 13.955 -2.954 -3.855 1.00 44.45 H new ATOM 1969 N PHE A 124 12.164 -3.414 -0.381 1.00 22.53 N ATOM 1970 CA PHE A 124 12.641 -3.201 0.995 1.00 75.21 C ATOM 1971 C PHE A 124 14.062 -2.556 1.022 1.00 13.22 C ATOM 1972 O PHE A 124 14.840 -2.724 0.069 1.00 12.52 O ATOM 1973 CB PHE A 124 12.614 -4.553 1.767 1.00 14.12 C ATOM 1974 CG PHE A 124 11.206 -5.059 2.109 1.00 23.21 C ATOM 1975 CD1 PHE A 124 10.377 -5.607 1.128 1.00 52.20 C ATOM 1976 CD2 PHE A 124 10.726 -5.007 3.421 1.00 54.10 C ATOM 1977 CE1 PHE A 124 9.120 -6.083 1.449 1.00 0.22 C ATOM 1978 CE2 PHE A 124 9.465 -5.482 3.738 1.00 50.34 C ATOM 1979 CZ PHE A 124 8.664 -6.021 2.752 1.00 72.04 C ATOM 0 H PHE A 124 12.136 -4.398 -0.647 1.00 22.53 H new ATOM 0 HA PHE A 124 11.973 -2.497 1.490 1.00 75.21 H new ATOM 0 HB2 PHE A 124 13.124 -5.309 1.169 1.00 14.12 H new ATOM 0 HB3 PHE A 124 13.181 -4.441 2.691 1.00 14.12 H new ATOM 0 HD1 PHE A 124 10.722 -5.659 0.106 1.00 52.20 H new ATOM 0 HD2 PHE A 124 11.348 -4.590 4.199 1.00 54.10 H new ATOM 0 HE1 PHE A 124 8.492 -6.505 0.679 1.00 0.22 H new ATOM 0 HE2 PHE A 124 9.108 -5.431 4.756 1.00 50.34 H new ATOM 0 HZ PHE A 124 7.681 -6.394 2.999 1.00 72.04 H new ATOM 1989 N PRO A 125 14.414 -1.820 2.134 1.00 4.40 N ATOM 1990 CA PRO A 125 15.662 -1.018 2.238 1.00 32.23 C ATOM 1991 C PRO A 125 16.937 -1.868 2.542 1.00 10.41 C ATOM 1992 O PRO A 125 17.484 -1.816 3.653 1.00 2.31 O ATOM 1993 CB PRO A 125 15.320 -0.044 3.399 1.00 34.52 C ATOM 1994 CG PRO A 125 14.441 -0.852 4.307 1.00 54.54 C ATOM 1995 CD PRO A 125 13.615 -1.741 3.392 1.00 11.41 C ATOM 0 HA PRO A 125 15.923 -0.527 1.301 1.00 32.23 H new ATOM 0 HB2 PRO A 125 16.219 0.295 3.913 1.00 34.52 H new ATOM 0 HB3 PRO A 125 14.806 0.846 3.035 1.00 34.52 H new ATOM 0 HG2 PRO A 125 15.035 -1.447 5.000 1.00 54.54 H new ATOM 0 HG3 PRO A 125 13.801 -0.207 4.909 1.00 54.54 H new ATOM 0 HD2 PRO A 125 13.462 -2.728 3.829 1.00 11.41 H new ATOM 0 HD3 PRO A 125 12.628 -1.316 3.210 1.00 11.41 H new ATOM 2003 N THR A 126 17.378 -2.657 1.521 1.00 51.04 N ATOM 2004 CA THR A 126 18.654 -3.456 1.499 1.00 61.32 C ATOM 2005 C THR A 126 18.881 -4.351 2.767 1.00 11.14 C ATOM 2006 O THR A 126 17.950 -4.559 3.552 1.00 5.14 O ATOM 2007 CB THR A 126 19.916 -2.544 1.171 1.00 2.41 C ATOM 2008 OG1 THR A 126 21.056 -3.371 0.852 1.00 63.11 O ATOM 2009 CG2 THR A 126 20.310 -1.579 2.310 1.00 3.10 C ATOM 0 H THR A 126 16.843 -2.763 0.659 1.00 51.04 H new ATOM 0 HA THR A 126 18.534 -4.164 0.679 1.00 61.32 H new ATOM 0 HB THR A 126 19.620 -1.931 0.320 1.00 2.41 H new ATOM 0 HG1 THR A 126 21.827 -2.801 0.650 1.00 63.11 H new ATOM 0 HG21 THR A 126 21.178 -0.994 2.007 1.00 3.10 H new ATOM 0 HG22 THR A 126 19.477 -0.909 2.523 1.00 3.10 H new ATOM 0 HG23 THR A 126 20.553 -2.152 3.205 1.00 3.10 H new ATOM 2017 N GLU A 127 20.094 -4.972 2.893 1.00 32.03 N ATOM 2018 CA GLU A 127 20.502 -5.807 4.076 1.00 64.52 C ATOM 2019 C GLU A 127 19.603 -7.087 4.231 1.00 75.41 C ATOM 2020 O GLU A 127 19.585 -7.738 5.287 1.00 51.23 O ATOM 2021 CB GLU A 127 20.509 -4.928 5.374 1.00 70.12 C ATOM 2022 CG GLU A 127 21.163 -5.575 6.617 1.00 44.44 C ATOM 2023 CD GLU A 127 21.049 -4.706 7.882 1.00 13.12 C ATOM 2024 OE1 GLU A 127 20.018 -4.791 8.588 1.00 32.11 O ATOM 2025 OE2 GLU A 127 21.979 -3.919 8.170 1.00 41.34 O ATOM 0 H GLU A 127 20.819 -4.909 2.178 1.00 32.03 H new ATOM 0 HA GLU A 127 21.515 -6.171 3.907 1.00 64.52 H new ATOM 0 HB2 GLU A 127 21.029 -3.995 5.156 1.00 70.12 H new ATOM 0 HB3 GLU A 127 19.479 -4.669 5.621 1.00 70.12 H new ATOM 0 HG2 GLU A 127 20.695 -6.542 6.804 1.00 44.44 H new ATOM 0 HG3 GLU A 127 22.216 -5.766 6.408 1.00 44.44 H new ATOM 2032 N SER A 128 18.888 -7.450 3.137 1.00 33.10 N ATOM 2033 CA SER A 128 17.886 -8.550 3.127 1.00 55.14 C ATOM 2034 C SER A 128 16.754 -8.305 4.159 1.00 45.32 C ATOM 2035 O SER A 128 16.229 -9.244 4.754 1.00 13.42 O ATOM 2036 CB SER A 128 18.566 -9.926 3.353 1.00 22.52 C ATOM 2037 OG SER A 128 19.590 -10.159 2.401 1.00 11.32 O ATOM 0 H SER A 128 18.989 -6.988 2.233 1.00 33.10 H new ATOM 0 HA SER A 128 17.425 -8.562 2.140 1.00 55.14 H new ATOM 0 HB2 SER A 128 18.986 -9.965 4.358 1.00 22.52 H new ATOM 0 HB3 SER A 128 17.820 -10.718 3.288 1.00 22.52 H new ATOM 0 HG SER A 128 20.001 -11.032 2.570 1.00 11.32 H new ATOM 2043 N ALA A 129 16.372 -7.018 4.324 1.00 32.14 N ATOM 2044 CA ALA A 129 15.232 -6.590 5.179 1.00 13.43 C ATOM 2045 C ALA A 129 13.910 -7.266 4.738 1.00 61.25 C ATOM 2046 O ALA A 129 13.029 -7.542 5.562 1.00 52.01 O ATOM 2047 CB ALA A 129 15.096 -5.052 5.128 1.00 75.32 C ATOM 0 H ALA A 129 16.847 -6.240 3.866 1.00 32.14 H new ATOM 0 HA ALA A 129 15.433 -6.902 6.204 1.00 13.43 H new ATOM 0 HB1 ALA A 129 14.261 -4.740 5.755 1.00 75.32 H new ATOM 0 HB2 ALA A 129 16.015 -4.593 5.493 1.00 75.32 H new ATOM 0 HB3 ALA A 129 14.916 -4.736 4.100 1.00 75.32 H new ATOM 2053 N ALA A 130 13.804 -7.527 3.420 1.00 72.35 N ATOM 2054 CA ALA A 130 12.686 -8.290 2.828 1.00 73.35 C ATOM 2055 C ALA A 130 12.683 -9.756 3.287 1.00 62.12 C ATOM 2056 O ALA A 130 11.663 -10.255 3.752 1.00 32.22 O ATOM 2057 CB ALA A 130 12.763 -8.209 1.308 1.00 64.03 C ATOM 0 H ALA A 130 14.492 -7.214 2.735 1.00 72.35 H new ATOM 0 HA ALA A 130 11.753 -7.844 3.173 1.00 73.35 H new ATOM 0 HB1 ALA A 130 11.938 -8.772 0.871 1.00 64.03 H new ATOM 0 HB2 ALA A 130 12.697 -7.167 0.995 1.00 64.03 H new ATOM 0 HB3 ALA A 130 13.709 -8.630 0.969 1.00 64.03 H new ATOM 2063 N GLN A 131 13.851 -10.423 3.153 1.00 15.12 N ATOM 2064 CA GLN A 131 14.045 -11.822 3.608 1.00 3.04 C ATOM 2065 C GLN A 131 13.718 -11.985 5.109 1.00 61.32 C ATOM 2066 O GLN A 131 13.018 -12.921 5.505 1.00 22.24 O ATOM 2067 CB GLN A 131 15.492 -12.307 3.331 1.00 55.45 C ATOM 2068 CG GLN A 131 15.793 -13.727 3.873 1.00 21.52 C ATOM 2069 CD GLN A 131 15.003 -14.848 3.177 1.00 70.21 C ATOM 2070 OE1 GLN A 131 14.706 -14.787 1.986 1.00 34.42 O ATOM 2071 NE2 GLN A 131 14.631 -15.867 3.926 1.00 14.23 N ATOM 0 H GLN A 131 14.683 -10.011 2.729 1.00 15.12 H new ATOM 0 HA GLN A 131 13.351 -12.438 3.036 1.00 3.04 H new ATOM 0 HB2 GLN A 131 15.669 -12.294 2.256 1.00 55.45 H new ATOM 0 HB3 GLN A 131 16.193 -11.602 3.778 1.00 55.45 H new ATOM 0 HG2 GLN A 131 16.859 -13.927 3.764 1.00 21.52 H new ATOM 0 HG3 GLN A 131 15.572 -13.751 4.940 1.00 21.52 H new ATOM 0 HE21 GLN A 131 14.889 -15.896 4.912 1.00 14.23 H new ATOM 0 HE22 GLN A 131 14.085 -16.626 3.519 1.00 14.23 H new ATOM 2080 N GLN A 132 14.227 -11.048 5.915 1.00 63.43 N ATOM 2081 CA GLN A 132 13.981 -11.000 7.366 1.00 4.03 C ATOM 2082 C GLN A 132 12.458 -10.911 7.677 1.00 61.12 C ATOM 2083 O GLN A 132 11.958 -11.554 8.608 1.00 21.13 O ATOM 2084 CB GLN A 132 14.738 -9.785 7.974 1.00 75.33 C ATOM 2085 CG GLN A 132 14.493 -9.542 9.481 1.00 12.42 C ATOM 2086 CD GLN A 132 15.289 -8.358 10.038 1.00 34.11 C ATOM 2087 OE1 GLN A 132 16.415 -8.512 10.502 1.00 41.45 O ATOM 2088 NE2 GLN A 132 14.717 -7.168 9.990 1.00 32.05 N ATOM 0 H GLN A 132 14.826 -10.294 5.579 1.00 63.43 H new ATOM 0 HA GLN A 132 14.352 -11.921 7.817 1.00 4.03 H new ATOM 0 HB2 GLN A 132 15.807 -9.927 7.815 1.00 75.33 H new ATOM 0 HB3 GLN A 132 14.450 -8.887 7.426 1.00 75.33 H new ATOM 0 HG2 GLN A 132 13.430 -9.367 9.646 1.00 12.42 H new ATOM 0 HG3 GLN A 132 14.757 -10.442 10.035 1.00 12.42 H new ATOM 0 HE21 GLN A 132 13.780 -7.068 9.599 1.00 32.05 H new ATOM 0 HE22 GLN A 132 15.212 -6.349 10.344 1.00 32.05 H new ATOM 2097 N ALA A 133 11.739 -10.123 6.850 1.00 63.32 N ATOM 2098 CA ALA A 133 10.271 -9.966 6.945 1.00 72.13 C ATOM 2099 C ALA A 133 9.517 -11.268 6.551 1.00 15.01 C ATOM 2100 O ALA A 133 8.432 -11.542 7.074 1.00 10.33 O ATOM 2101 CB ALA A 133 9.818 -8.781 6.077 1.00 55.23 C ATOM 0 H ALA A 133 12.159 -9.578 6.098 1.00 63.32 H new ATOM 0 HA ALA A 133 10.020 -9.763 7.986 1.00 72.13 H new ATOM 0 HB1 ALA A 133 8.736 -8.669 6.150 1.00 55.23 H new ATOM 0 HB2 ALA A 133 10.302 -7.869 6.426 1.00 55.23 H new ATOM 0 HB3 ALA A 133 10.095 -8.964 5.039 1.00 55.23 H new ATOM 2107 N ILE A 134 10.099 -12.064 5.629 1.00 42.41 N ATOM 2108 CA ILE A 134 9.546 -13.394 5.245 1.00 52.33 C ATOM 2109 C ILE A 134 9.574 -14.359 6.461 1.00 43.32 C ATOM 2110 O ILE A 134 8.584 -15.048 6.751 1.00 54.43 O ATOM 2111 CB ILE A 134 10.355 -14.047 4.060 1.00 11.35 C ATOM 2112 CG1 ILE A 134 10.477 -13.074 2.851 1.00 33.13 C ATOM 2113 CG2 ILE A 134 9.715 -15.382 3.604 1.00 34.43 C ATOM 2114 CD1 ILE A 134 11.450 -13.532 1.779 1.00 41.32 C ATOM 0 H ILE A 134 10.954 -11.814 5.132 1.00 42.41 H new ATOM 0 HA ILE A 134 8.520 -13.231 4.916 1.00 52.33 H new ATOM 0 HB ILE A 134 11.356 -14.257 4.437 1.00 11.35 H new ATOM 0 HG12 ILE A 134 9.492 -12.946 2.401 1.00 33.13 H new ATOM 0 HG13 ILE A 134 10.790 -12.096 3.216 1.00 33.13 H new ATOM 0 HG21 ILE A 134 10.298 -15.804 2.786 1.00 34.43 H new ATOM 0 HG22 ILE A 134 9.701 -16.083 4.439 1.00 34.43 H new ATOM 0 HG23 ILE A 134 8.695 -15.200 3.266 1.00 34.43 H new ATOM 0 HD11 ILE A 134 11.475 -12.798 0.973 1.00 41.32 H new ATOM 0 HD12 ILE A 134 12.446 -13.632 2.210 1.00 41.32 H new ATOM 0 HD13 ILE A 134 11.128 -14.495 1.383 1.00 41.32 H new ATOM 2126 N ASP A 135 10.723 -14.365 7.176 1.00 15.12 N ATOM 2127 CA ASP A 135 10.903 -15.137 8.428 1.00 74.54 C ATOM 2128 C ASP A 135 9.999 -14.600 9.573 1.00 4.31 C ATOM 2129 O ASP A 135 9.684 -15.329 10.517 1.00 51.21 O ATOM 2130 CB ASP A 135 12.392 -15.114 8.861 1.00 24.51 C ATOM 2131 CG ASP A 135 13.327 -15.764 7.824 1.00 53.45 C ATOM 2132 OD1 ASP A 135 13.291 -17.004 7.675 1.00 35.03 O ATOM 2133 OD2 ASP A 135 14.097 -15.048 7.149 1.00 74.54 O ATOM 0 H ASP A 135 11.551 -13.835 6.902 1.00 15.12 H new ATOM 0 HA ASP A 135 10.603 -16.166 8.229 1.00 74.54 H new ATOM 0 HB2 ASP A 135 12.702 -14.082 9.026 1.00 24.51 H new ATOM 0 HB3 ASP A 135 12.496 -15.634 9.813 1.00 24.51 H new ATOM 2138 N MET A 136 9.608 -13.316 9.488 1.00 64.20 N ATOM 2139 CA MET A 136 8.645 -12.689 10.429 1.00 10.11 C ATOM 2140 C MET A 136 7.180 -13.136 10.129 1.00 64.25 C ATOM 2141 O MET A 136 6.331 -13.165 11.027 1.00 10.42 O ATOM 2142 CB MET A 136 8.770 -11.142 10.337 1.00 61.21 C ATOM 2143 CG MET A 136 7.958 -10.346 11.375 1.00 22.31 C ATOM 2144 SD MET A 136 8.059 -8.556 11.124 1.00 10.31 S ATOM 2145 CE MET A 136 9.825 -8.245 11.253 1.00 43.11 C ATOM 0 H MET A 136 9.947 -12.679 8.767 1.00 64.20 H new ATOM 0 HA MET A 136 8.885 -13.016 11.441 1.00 10.11 H new ATOM 0 HB2 MET A 136 9.821 -10.874 10.441 1.00 61.21 H new ATOM 0 HB3 MET A 136 8.458 -10.829 9.341 1.00 61.21 H new ATOM 0 HG2 MET A 136 6.914 -10.656 11.328 1.00 22.31 H new ATOM 0 HG3 MET A 136 8.318 -10.589 12.375 1.00 22.31 H new ATOM 0 HE1 MET A 136 9.999 -7.175 11.367 1.00 43.11 H new ATOM 0 HE2 MET A 136 10.225 -8.772 12.120 1.00 43.11 H new ATOM 0 HE3 MET A 136 10.324 -8.600 10.351 1.00 43.11 H new ATOM 2155 N GLY A 137 6.909 -13.502 8.856 1.00 23.21 N ATOM 2156 CA GLY A 137 5.553 -13.885 8.407 1.00 1.33 C ATOM 2157 C GLY A 137 4.731 -12.691 7.908 1.00 63.15 C ATOM 2158 O GLY A 137 3.517 -12.611 8.138 1.00 22.24 O ATOM 0 H GLY A 137 7.614 -13.540 8.120 1.00 23.21 H new ATOM 0 HA2 GLY A 137 5.635 -14.623 7.609 1.00 1.33 H new ATOM 0 HA3 GLY A 137 5.025 -14.365 9.231 1.00 1.33 H new ATOM 2162 N VAL A 138 5.404 -11.777 7.182 1.00 40.23 N ATOM 2163 CA VAL A 138 4.808 -10.506 6.690 1.00 52.34 C ATOM 2164 C VAL A 138 3.717 -10.736 5.598 1.00 64.02 C ATOM 2165 O VAL A 138 2.865 -9.873 5.379 1.00 73.21 O ATOM 2166 CB VAL A 138 5.945 -9.559 6.138 1.00 32.23 C ATOM 2167 CG1 VAL A 138 6.520 -10.071 4.789 1.00 2.03 C ATOM 2168 CG2 VAL A 138 5.483 -8.087 6.038 1.00 22.15 C ATOM 0 H VAL A 138 6.382 -11.894 6.916 1.00 40.23 H new ATOM 0 HA VAL A 138 4.311 -10.032 7.537 1.00 52.34 H new ATOM 0 HB VAL A 138 6.755 -9.588 6.867 1.00 32.23 H new ATOM 0 HG11 VAL A 138 7.299 -9.391 4.444 1.00 2.03 H new ATOM 0 HG12 VAL A 138 6.942 -11.066 4.928 1.00 2.03 H new ATOM 0 HG13 VAL A 138 5.723 -10.115 4.047 1.00 2.03 H new ATOM 0 HG21 VAL A 138 6.299 -7.475 5.654 1.00 22.15 H new ATOM 0 HG22 VAL A 138 4.629 -8.019 5.364 1.00 22.15 H new ATOM 0 HG23 VAL A 138 5.195 -7.728 7.026 1.00 22.15 H new ATOM 2178 N GLU A 139 3.760 -11.921 4.942 1.00 21.13 N ATOM 2179 CA GLU A 139 2.817 -12.322 3.859 1.00 0.40 C ATOM 2180 C GLU A 139 1.348 -12.210 4.343 1.00 64.52 C ATOM 2181 O GLU A 139 0.526 -11.517 3.737 1.00 74.32 O ATOM 2182 CB GLU A 139 3.136 -13.800 3.434 1.00 60.01 C ATOM 2183 CG GLU A 139 2.730 -14.221 1.993 1.00 24.50 C ATOM 2184 CD GLU A 139 1.241 -14.082 1.629 1.00 62.15 C ATOM 2185 OE1 GLU A 139 0.393 -14.738 2.278 1.00 15.51 O ATOM 2186 OE2 GLU A 139 0.907 -13.342 0.673 1.00 33.24 O ATOM 0 H GLU A 139 4.457 -12.636 5.149 1.00 21.13 H new ATOM 0 HA GLU A 139 2.941 -11.655 3.006 1.00 0.40 H new ATOM 0 HB2 GLU A 139 4.208 -13.961 3.545 1.00 60.01 H new ATOM 0 HB3 GLU A 139 2.639 -14.470 4.136 1.00 60.01 H new ATOM 0 HG2 GLU A 139 3.310 -13.626 1.288 1.00 24.50 H new ATOM 0 HG3 GLU A 139 3.021 -15.261 1.847 1.00 24.50 H new ATOM 2193 N THR A 140 1.069 -12.864 5.480 1.00 42.40 N ATOM 2194 CA THR A 140 -0.289 -12.969 6.058 1.00 15.35 C ATOM 2195 C THR A 140 -0.757 -11.629 6.654 1.00 43.54 C ATOM 2196 O THR A 140 -1.945 -11.299 6.612 1.00 40.43 O ATOM 2197 CB THR A 140 -0.338 -14.059 7.177 1.00 64.32 C ATOM 2198 OG1 THR A 140 0.432 -13.640 8.319 1.00 43.32 O ATOM 2199 CG2 THR A 140 0.211 -15.405 6.685 1.00 74.41 C ATOM 0 H THR A 140 1.782 -13.341 6.033 1.00 42.40 H new ATOM 0 HA THR A 140 -0.956 -13.248 5.242 1.00 15.35 H new ATOM 0 HB THR A 140 -1.385 -14.185 7.453 1.00 64.32 H new ATOM 0 HG1 THR A 140 1.335 -13.390 8.031 1.00 43.32 H new ATOM 0 HG21 THR A 140 0.160 -16.136 7.492 1.00 74.41 H new ATOM 0 HG22 THR A 140 -0.384 -15.754 5.841 1.00 74.41 H new ATOM 0 HG23 THR A 140 1.248 -15.282 6.372 1.00 74.41 H new ATOM 2207 N GLY A 141 0.207 -10.885 7.217 1.00 4.00 N ATOM 2208 CA GLY A 141 -0.043 -9.572 7.805 1.00 54.12 C ATOM 2209 C GLY A 141 -0.480 -8.514 6.778 1.00 51.14 C ATOM 2210 O GLY A 141 -1.512 -7.854 6.953 1.00 3.41 O ATOM 0 H GLY A 141 1.181 -11.182 7.275 1.00 4.00 H new ATOM 0 HA2 GLY A 141 -0.815 -9.666 8.569 1.00 54.12 H new ATOM 0 HA3 GLY A 141 0.862 -9.229 8.306 1.00 54.12 H new ATOM 2214 N MET A 142 0.292 -8.384 5.685 1.00 4.41 N ATOM 2215 CA MET A 142 -0.042 -7.471 4.563 1.00 42.21 C ATOM 2216 C MET A 142 -1.323 -7.932 3.820 1.00 62.40 C ATOM 2217 O MET A 142 -2.090 -7.104 3.322 1.00 61.25 O ATOM 2218 CB MET A 142 1.159 -7.346 3.583 1.00 61.54 C ATOM 2219 CG MET A 142 2.419 -6.706 4.200 1.00 5.31 C ATOM 2220 SD MET A 142 3.759 -6.453 3.007 1.00 74.10 S ATOM 2221 CE MET A 142 4.139 -8.128 2.486 1.00 63.13 C ATOM 0 H MET A 142 1.160 -8.902 5.549 1.00 4.41 H new ATOM 0 HA MET A 142 -0.245 -6.485 4.982 1.00 42.21 H new ATOM 0 HB2 MET A 142 1.415 -8.339 3.212 1.00 61.54 H new ATOM 0 HB3 MET A 142 0.850 -6.754 2.722 1.00 61.54 H new ATOM 0 HG2 MET A 142 2.150 -5.746 4.642 1.00 5.31 H new ATOM 0 HG3 MET A 142 2.779 -7.340 5.010 1.00 5.31 H new ATOM 0 HE1 MET A 142 5.178 -8.356 2.723 1.00 63.13 H new ATOM 0 HE2 MET A 142 3.486 -8.828 3.007 1.00 63.13 H new ATOM 0 HE3 MET A 142 3.984 -8.219 1.411 1.00 63.13 H new ATOM 2231 N ASN A 143 -1.547 -9.264 3.772 1.00 42.04 N ATOM 2232 CA ASN A 143 -2.781 -9.856 3.205 1.00 23.20 C ATOM 2233 C ASN A 143 -4.016 -9.496 4.061 1.00 44.21 C ATOM 2234 O ASN A 143 -5.091 -9.261 3.519 1.00 42.42 O ATOM 2235 CB ASN A 143 -2.637 -11.396 3.087 1.00 60.01 C ATOM 2236 CG ASN A 143 -3.839 -12.059 2.410 1.00 53.42 C ATOM 2237 OD1 ASN A 143 -3.883 -12.200 1.196 1.00 23.24 O ATOM 2238 ND2 ASN A 143 -4.821 -12.465 3.184 1.00 24.01 N ATOM 0 H ASN A 143 -0.884 -9.955 4.122 1.00 42.04 H new ATOM 0 HA ASN A 143 -2.927 -9.439 2.209 1.00 23.20 H new ATOM 0 HB2 ASN A 143 -1.735 -11.629 2.522 1.00 60.01 H new ATOM 0 HB3 ASN A 143 -2.508 -11.821 4.083 1.00 60.01 H new ATOM 0 HD21 ASN A 143 -5.643 -12.909 2.774 1.00 24.01 H new ATOM 0 HD22 ASN A 143 -4.761 -12.336 4.194 1.00 24.01 H new ATOM 2245 N SER A 144 -3.840 -9.458 5.399 1.00 41.13 N ATOM 2246 CA SER A 144 -4.923 -9.090 6.353 1.00 22.52 C ATOM 2247 C SER A 144 -5.386 -7.635 6.130 1.00 11.34 C ATOM 2248 O SER A 144 -6.583 -7.335 6.196 1.00 10.50 O ATOM 2249 CB SER A 144 -4.456 -9.284 7.817 1.00 41.44 C ATOM 2250 OG SER A 144 -5.486 -8.968 8.748 1.00 60.10 O ATOM 0 H SER A 144 -2.953 -9.679 5.852 1.00 41.13 H new ATOM 0 HA SER A 144 -5.769 -9.752 6.167 1.00 22.52 H new ATOM 0 HB2 SER A 144 -4.138 -10.316 7.963 1.00 41.44 H new ATOM 0 HB3 SER A 144 -3.588 -8.653 8.008 1.00 41.44 H new ATOM 0 HG SER A 144 -5.155 -9.104 9.660 1.00 60.10 H new ATOM 2256 N THR A 145 -4.414 -6.751 5.847 1.00 71.31 N ATOM 2257 CA THR A 145 -4.668 -5.342 5.462 1.00 12.01 C ATOM 2258 C THR A 145 -5.439 -5.258 4.104 1.00 54.43 C ATOM 2259 O THR A 145 -6.323 -4.410 3.928 1.00 23.33 O ATOM 2260 CB THR A 145 -3.312 -4.554 5.372 1.00 73.55 C ATOM 2261 OG1 THR A 145 -2.606 -4.645 6.628 1.00 54.13 O ATOM 2262 CG2 THR A 145 -3.503 -3.072 5.011 1.00 24.24 C ATOM 0 H THR A 145 -3.423 -6.990 5.878 1.00 71.31 H new ATOM 0 HA THR A 145 -5.293 -4.886 6.230 1.00 12.01 H new ATOM 0 HB THR A 145 -2.735 -5.016 4.571 1.00 73.55 H new ATOM 0 HG1 THR A 145 -3.058 -4.091 7.298 1.00 54.13 H new ATOM 0 HG21 THR A 145 -2.531 -2.581 4.964 1.00 24.24 H new ATOM 0 HG22 THR A 145 -3.996 -2.994 4.042 1.00 24.24 H new ATOM 0 HG23 THR A 145 -4.117 -2.589 5.771 1.00 24.24 H new ATOM 2270 N LEU A 146 -5.106 -6.164 3.160 1.00 25.42 N ATOM 2271 CA LEU A 146 -5.802 -6.269 1.850 1.00 23.55 C ATOM 2272 C LEU A 146 -7.202 -6.927 1.970 1.00 34.53 C ATOM 2273 O LEU A 146 -8.064 -6.721 1.106 1.00 73.52 O ATOM 2274 CB LEU A 146 -4.932 -7.026 0.815 1.00 33.12 C ATOM 2275 CG LEU A 146 -3.560 -6.367 0.444 1.00 1.43 C ATOM 2276 CD1 LEU A 146 -2.912 -7.065 -0.759 1.00 32.41 C ATOM 2277 CD2 LEU A 146 -3.698 -4.861 0.169 1.00 72.21 C ATOM 0 H LEU A 146 -4.353 -6.841 3.279 1.00 25.42 H new ATOM 0 HA LEU A 146 -5.956 -5.249 1.498 1.00 23.55 H new ATOM 0 HB2 LEU A 146 -4.737 -8.027 1.199 1.00 33.12 H new ATOM 0 HB3 LEU A 146 -5.513 -7.143 -0.100 1.00 33.12 H new ATOM 0 HG LEU A 146 -2.911 -6.491 1.311 1.00 1.43 H new ATOM 0 HD11 LEU A 146 -1.962 -6.584 -0.991 1.00 32.41 H new ATOM 0 HD12 LEU A 146 -2.739 -8.114 -0.521 1.00 32.41 H new ATOM 0 HD13 LEU A 146 -3.575 -6.993 -1.622 1.00 32.41 H new ATOM 0 HD21 LEU A 146 -2.722 -4.446 -0.084 1.00 72.21 H new ATOM 0 HD22 LEU A 146 -4.385 -4.704 -0.662 1.00 72.21 H new ATOM 0 HD23 LEU A 146 -4.084 -4.363 1.058 1.00 72.21 H new ATOM 2289 N ASN A 147 -7.419 -7.737 3.026 1.00 1.23 N ATOM 2290 CA ASN A 147 -8.763 -8.273 3.352 1.00 5.01 C ATOM 2291 C ASN A 147 -9.706 -7.124 3.782 1.00 43.05 C ATOM 2292 O ASN A 147 -10.905 -7.159 3.497 1.00 11.53 O ATOM 2293 CB ASN A 147 -8.687 -9.352 4.465 1.00 72.14 C ATOM 2294 CG ASN A 147 -7.864 -10.585 4.074 1.00 53.50 C ATOM 2295 OD1 ASN A 147 -7.749 -10.938 2.906 1.00 52.35 O ATOM 2296 ND2 ASN A 147 -7.291 -11.260 5.051 1.00 61.02 N ATOM 0 H ASN A 147 -6.685 -8.036 3.668 1.00 1.23 H new ATOM 0 HA ASN A 147 -9.163 -8.746 2.455 1.00 5.01 H new ATOM 0 HB2 ASN A 147 -8.255 -8.907 5.361 1.00 72.14 H new ATOM 0 HB3 ASN A 147 -9.698 -9.668 4.722 1.00 72.14 H new ATOM 0 HD21 ASN A 147 -6.740 -12.092 4.841 1.00 61.02 H new ATOM 0 HD22 ASN A 147 -7.399 -10.950 6.017 1.00 61.02 H new ATOM 2303 N GLN A 148 -9.130 -6.099 4.454 1.00 60.23 N ATOM 2304 CA GLN A 148 -9.860 -4.865 4.836 1.00 42.13 C ATOM 2305 C GLN A 148 -10.185 -4.017 3.576 1.00 3.03 C ATOM 2306 O GLN A 148 -11.204 -3.325 3.528 1.00 13.24 O ATOM 2307 CB GLN A 148 -9.045 -4.005 5.856 1.00 50.43 C ATOM 2308 CG GLN A 148 -8.370 -4.790 7.006 1.00 73.13 C ATOM 2309 CD GLN A 148 -9.306 -5.689 7.834 1.00 12.31 C ATOM 2310 OE1 GLN A 148 -10.482 -5.395 8.037 1.00 74.32 O ATOM 2311 NE2 GLN A 148 -8.788 -6.814 8.304 1.00 3.24 N ATOM 0 H GLN A 148 -8.153 -6.103 4.745 1.00 60.23 H new ATOM 0 HA GLN A 148 -10.789 -5.171 5.317 1.00 42.13 H new ATOM 0 HB2 GLN A 148 -8.274 -3.461 5.310 1.00 50.43 H new ATOM 0 HB3 GLN A 148 -9.712 -3.261 6.291 1.00 50.43 H new ATOM 0 HG2 GLN A 148 -7.579 -5.410 6.584 1.00 73.13 H new ATOM 0 HG3 GLN A 148 -7.892 -4.077 7.678 1.00 73.13 H new ATOM 0 HE21 GLN A 148 -7.810 -7.039 8.124 1.00 3.24 H new ATOM 0 HE22 GLN A 148 -9.368 -7.455 8.846 1.00 3.24 H new ATOM 2320 N LEU A 149 -9.289 -4.088 2.561 1.00 12.24 N ATOM 2321 CA LEU A 149 -9.488 -3.441 1.246 1.00 74.52 C ATOM 2322 C LEU A 149 -10.655 -4.089 0.477 1.00 51.24 C ATOM 2323 O LEU A 149 -11.448 -3.392 -0.153 1.00 2.14 O ATOM 2324 CB LEU A 149 -8.162 -3.476 0.422 1.00 42.35 C ATOM 2325 CG LEU A 149 -8.194 -2.847 -1.015 1.00 33.13 C ATOM 2326 CD1 LEU A 149 -8.787 -1.425 -1.002 1.00 35.24 C ATOM 2327 CD2 LEU A 149 -6.787 -2.837 -1.658 1.00 1.02 C ATOM 0 H LEU A 149 -8.408 -4.597 2.634 1.00 12.24 H new ATOM 0 HA LEU A 149 -9.756 -2.397 1.409 1.00 74.52 H new ATOM 0 HB2 LEU A 149 -7.392 -2.963 0.998 1.00 42.35 H new ATOM 0 HB3 LEU A 149 -7.850 -4.516 0.329 1.00 42.35 H new ATOM 0 HG LEU A 149 -8.844 -3.477 -1.622 1.00 33.13 H new ATOM 0 HD11 LEU A 149 -8.792 -1.024 -2.015 1.00 35.24 H new ATOM 0 HD12 LEU A 149 -9.807 -1.460 -0.620 1.00 35.24 H new ATOM 0 HD13 LEU A 149 -8.182 -0.784 -0.361 1.00 35.24 H new ATOM 0 HD21 LEU A 149 -6.845 -2.395 -2.653 1.00 1.02 H new ATOM 0 HD22 LEU A 149 -6.108 -2.250 -1.039 1.00 1.02 H new ATOM 0 HD23 LEU A 149 -6.415 -3.859 -1.736 1.00 1.02 H new ATOM 2339 N GLU A 150 -10.775 -5.421 0.557 1.00 14.31 N ATOM 2340 CA GLU A 150 -11.908 -6.141 -0.056 1.00 34.21 C ATOM 2341 C GLU A 150 -13.243 -5.802 0.672 1.00 31.33 C ATOM 2342 O GLU A 150 -14.272 -5.630 0.023 1.00 61.04 O ATOM 2343 CB GLU A 150 -11.644 -7.667 -0.070 1.00 23.34 C ATOM 2344 CG GLU A 150 -12.707 -8.481 -0.844 1.00 54.02 C ATOM 2345 CD GLU A 150 -12.396 -9.982 -0.922 1.00 74.14 C ATOM 2346 OE1 GLU A 150 -12.395 -10.650 0.133 1.00 4.52 O ATOM 2347 OE2 GLU A 150 -12.108 -10.493 -2.032 1.00 73.55 O ATOM 0 H GLU A 150 -10.106 -6.023 1.037 1.00 14.31 H new ATOM 0 HA GLU A 150 -12.004 -5.810 -1.090 1.00 34.21 H new ATOM 0 HB2 GLU A 150 -10.666 -7.852 -0.513 1.00 23.34 H new ATOM 0 HB3 GLU A 150 -11.602 -8.028 0.958 1.00 23.34 H new ATOM 0 HG2 GLU A 150 -13.677 -8.344 -0.365 1.00 54.02 H new ATOM 0 HG3 GLU A 150 -12.792 -8.083 -1.855 1.00 54.02 H new ATOM 2354 N LYS A 151 -13.201 -5.671 2.017 1.00 34.34 N ATOM 2355 CA LYS A 151 -14.371 -5.210 2.823 1.00 62.43 C ATOM 2356 C LYS A 151 -14.851 -3.804 2.372 1.00 71.40 C ATOM 2357 O LYS A 151 -16.052 -3.560 2.226 1.00 2.20 O ATOM 2358 CB LYS A 151 -14.031 -5.181 4.336 1.00 45.33 C ATOM 2359 CG LYS A 151 -13.733 -6.556 4.967 1.00 15.44 C ATOM 2360 CD LYS A 151 -13.395 -6.439 6.472 1.00 12.25 C ATOM 2361 CE LYS A 151 -13.026 -7.785 7.117 1.00 14.10 C ATOM 2362 NZ LYS A 151 -12.643 -7.625 8.547 1.00 5.15 N ATOM 0 H LYS A 151 -12.372 -5.877 2.574 1.00 34.34 H new ATOM 0 HA LYS A 151 -15.176 -5.925 2.654 1.00 62.43 H new ATOM 0 HB2 LYS A 151 -13.166 -4.535 4.486 1.00 45.33 H new ATOM 0 HB3 LYS A 151 -14.865 -4.726 4.871 1.00 45.33 H new ATOM 0 HG2 LYS A 151 -14.596 -7.209 4.838 1.00 15.44 H new ATOM 0 HG3 LYS A 151 -12.899 -7.023 4.443 1.00 15.44 H new ATOM 0 HD2 LYS A 151 -12.565 -5.744 6.598 1.00 12.25 H new ATOM 0 HD3 LYS A 151 -14.250 -6.014 6.998 1.00 12.25 H new ATOM 0 HE2 LYS A 151 -13.872 -8.469 7.041 1.00 14.10 H new ATOM 0 HE3 LYS A 151 -12.200 -8.237 6.568 1.00 14.10 H new ATOM 0 HZ1 LYS A 151 -12.288 -8.531 8.915 1.00 5.15 H new ATOM 0 HZ2 LYS A 151 -11.899 -6.903 8.628 1.00 5.15 H new ATOM 0 HZ3 LYS A 151 -13.474 -7.329 9.098 1.00 5.15 H new ATOM 2376 N LEU A 152 -13.875 -2.910 2.157 1.00 53.32 N ATOM 2377 CA LEU A 152 -14.087 -1.531 1.662 1.00 30.33 C ATOM 2378 C LEU A 152 -14.791 -1.492 0.273 1.00 35.42 C ATOM 2379 O LEU A 152 -15.849 -0.866 0.110 1.00 52.31 O ATOM 2380 CB LEU A 152 -12.699 -0.820 1.597 1.00 35.41 C ATOM 2381 CG LEU A 152 -12.622 0.530 0.815 1.00 61.31 C ATOM 2382 CD1 LEU A 152 -13.568 1.588 1.413 1.00 14.21 C ATOM 2383 CD2 LEU A 152 -11.170 1.045 0.748 1.00 2.02 C ATOM 0 H LEU A 152 -12.892 -3.125 2.324 1.00 53.32 H new ATOM 0 HA LEU A 152 -14.754 -1.013 2.351 1.00 30.33 H new ATOM 0 HB2 LEU A 152 -12.365 -0.638 2.618 1.00 35.41 H new ATOM 0 HB3 LEU A 152 -11.986 -1.511 1.147 1.00 35.41 H new ATOM 0 HG LEU A 152 -12.957 0.341 -0.205 1.00 61.31 H new ATOM 0 HD11 LEU A 152 -13.486 2.513 0.842 1.00 14.21 H new ATOM 0 HD12 LEU A 152 -14.595 1.224 1.370 1.00 14.21 H new ATOM 0 HD13 LEU A 152 -13.293 1.776 2.451 1.00 14.21 H new ATOM 0 HD21 LEU A 152 -11.143 1.986 0.199 1.00 2.02 H new ATOM 0 HD22 LEU A 152 -10.793 1.204 1.758 1.00 2.02 H new ATOM 0 HD23 LEU A 152 -10.546 0.310 0.240 1.00 2.02 H new ATOM 2395 N LEU A 153 -14.189 -2.171 -0.710 1.00 74.22 N ATOM 2396 CA LEU A 153 -14.620 -2.109 -2.125 1.00 3.30 C ATOM 2397 C LEU A 153 -15.952 -2.854 -2.372 1.00 52.11 C ATOM 2398 O LEU A 153 -16.728 -2.472 -3.249 1.00 73.43 O ATOM 2399 CB LEU A 153 -13.489 -2.662 -3.019 1.00 31.35 C ATOM 2400 CG LEU A 153 -12.123 -1.915 -2.877 1.00 13.43 C ATOM 2401 CD1 LEU A 153 -11.006 -2.639 -3.641 1.00 2.41 C ATOM 2402 CD2 LEU A 153 -12.231 -0.428 -3.299 1.00 74.00 C ATOM 0 H LEU A 153 -13.387 -2.782 -0.554 1.00 74.22 H new ATOM 0 HA LEU A 153 -14.811 -1.067 -2.381 1.00 3.30 H new ATOM 0 HB2 LEU A 153 -13.339 -3.715 -2.782 1.00 31.35 H new ATOM 0 HB3 LEU A 153 -13.809 -2.612 -4.060 1.00 31.35 H new ATOM 0 HG LEU A 153 -11.858 -1.927 -1.820 1.00 13.43 H new ATOM 0 HD11 LEU A 153 -10.070 -2.093 -3.521 1.00 2.41 H new ATOM 0 HD12 LEU A 153 -10.890 -3.648 -3.246 1.00 2.41 H new ATOM 0 HD13 LEU A 153 -11.263 -2.690 -4.699 1.00 2.41 H new ATOM 0 HD21 LEU A 153 -11.260 0.054 -3.185 1.00 74.00 H new ATOM 0 HD22 LEU A 153 -12.546 -0.367 -4.341 1.00 74.00 H new ATOM 0 HD23 LEU A 153 -12.963 0.077 -2.669 1.00 74.00 H new ATOM 2414 N ASN A 154 -16.199 -3.917 -1.590 1.00 15.32 N ATOM 2415 CA ASN A 154 -17.491 -4.646 -1.591 1.00 31.21 C ATOM 2416 C ASN A 154 -18.566 -3.897 -0.760 1.00 44.42 C ATOM 2417 O ASN A 154 -19.762 -4.075 -1.004 1.00 33.45 O ATOM 2418 CB ASN A 154 -17.284 -6.088 -1.066 1.00 51.30 C ATOM 2419 CG ASN A 154 -16.620 -6.983 -2.116 1.00 13.21 C ATOM 2420 OD1 ASN A 154 -17.271 -7.769 -2.787 1.00 44.40 O ATOM 2421 ND2 ASN A 154 -15.333 -6.825 -2.315 1.00 4.33 N ATOM 0 H ASN A 154 -15.514 -4.300 -0.938 1.00 15.32 H new ATOM 0 HA ASN A 154 -17.856 -4.696 -2.617 1.00 31.21 H new ATOM 0 HB2 ASN A 154 -16.668 -6.063 -0.167 1.00 51.30 H new ATOM 0 HB3 ASN A 154 -18.246 -6.513 -0.781 1.00 51.30 H new ATOM 0 HD21 ASN A 154 -14.859 -7.363 -3.040 1.00 4.33 H new ATOM 0 HD22 ASN A 154 -14.806 -6.164 -1.744 1.00 4.33 H new ATOM 2428 N GLN A 155 -18.105 -3.046 0.203 1.00 31.14 N ATOM 2429 CA GLN A 155 -18.958 -2.248 1.134 1.00 23.41 C ATOM 2430 C GLN A 155 -19.746 -3.161 2.110 1.00 43.02 C ATOM 2431 O GLN A 155 -19.510 -3.152 3.323 1.00 14.32 O ATOM 2432 CB GLN A 155 -19.923 -1.288 0.376 1.00 1.21 C ATOM 2433 CG GLN A 155 -19.234 -0.320 -0.606 1.00 64.33 C ATOM 2434 CD GLN A 155 -20.214 0.650 -1.260 1.00 2.32 C ATOM 2435 OE1 GLN A 155 -20.445 1.742 -0.759 1.00 50.23 O ATOM 2436 NE2 GLN A 155 -20.832 0.252 -2.355 1.00 52.21 N ATOM 0 H GLN A 155 -17.108 -2.893 0.356 1.00 31.14 H new ATOM 0 HA GLN A 155 -18.279 -1.630 1.721 1.00 23.41 H new ATOM 0 HB2 GLN A 155 -20.649 -1.886 -0.175 1.00 1.21 H new ATOM 0 HB3 GLN A 155 -20.481 -0.704 1.108 1.00 1.21 H new ATOM 0 HG2 GLN A 155 -18.468 0.246 -0.075 1.00 64.33 H new ATOM 0 HG3 GLN A 155 -18.726 -0.895 -1.381 1.00 64.33 H new ATOM 0 HE21 GLN A 155 -20.623 -0.663 -2.755 1.00 52.21 H new ATOM 0 HE22 GLN A 155 -21.519 0.859 -2.802 1.00 52.21 H new