USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1190 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 128 THR OG1 : rot -70:sc= 1.37 USER MOD Set 1.2: A 131 SER OG : rot -150:sc= 1.53 USER MOD Set 2.1: A 29 HIS : no HE2:sc= -0.23 K(o=-1.3,f=-6.2!) USER MOD Set 2.2: A 32 TYR OH : rot 32:sc= 1.21 USER MOD Set 2.3: A 88 SER OG : rot -105:sc= -0.623 USER MOD Set 2.4: A 129 HIS : no HD1:sc= -2.11! K(o=-1.3!,f=-2.2) USER MOD Set 2.5: A 137 CYS SG : rot 124:sc= 0.454 USER MOD Set 3.1: A 75 CYS SG : rot -31:sc= -0.0147! USER MOD Set 3.2: A 83 ASN : amide:sc= 1! C(o=0.99!,f=-15!) USER MOD Set 4.1: A 30 ASN : amide:sc= -5.13! C(o=-3.9!,f=-9.7!) USER MOD Set 4.2: A 31 THR OG1 : rot -82:sc= 1.18 USER MOD Set 4.3: A 94 SER OG : rot -90:sc= 0.0572 USER MOD Set 5.1: A 27 THR OG1 : rot -164:sc= 0.278 USER MOD Set 5.2: A 86 SER OG : rot 170:sc= -0.743 USER MOD Set 6.1: A 21 MET CE :methyl -150:sc= 0 (180deg=0) USER MOD Set 6.2: A 85 GLN : amide:sc= -0.522 K(o=-0.52,f=0) USER MOD Single : A 4 GLN : amide:sc= -1.22 K(o=-1.2,f=-0.011) USER MOD Single : A 5 LYS NZ :NH3+ -165:sc= -0.0366 (180deg=-0.246) USER MOD Single : A 6 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0285) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 130:sc= 0.268 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -167:sc= 1.81 (180deg=1.07) USER MOD Single : A 17 CYS SG : rot 170:sc= -0.142 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 36:sc= 0.0781 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 154:sc= 1.28 (180deg=1.17) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 1.19 K(o=1.2,f=-0.0019) USER MOD Single : A 39 ASN : amide:sc= -2.52 X(o=-2.5,f=-2.3!) USER MOD Single : A 42 SER OG : rot 83:sc= 1.23 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl 169:sc= -2.12 (180deg=-2.33!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -4.32! C(o=-4.3!,f=-11!) USER MOD Single : A 48 ASN : amide:sc= -0.279 K(o=-0.28,f=-2.9!) USER MOD Single : A 49 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 52 SER OG : rot 110:sc= -0.21 USER MOD Single : A 54 HIS : no HD1:sc= -2.29! C(o=-2.3!,f=-10!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 1.19 (180deg=1.19) USER MOD Single : A 64 GLN : amide:sc= -0.681 K(o=-0.68,f=-3.8!) USER MOD Single : A 71 ASN : amide:sc= -0.569 X(o=-0.57,f=-0.76) USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 SER OG : rot 3:sc= 0.447 USER MOD Single : A 92 CYS SG : rot 100:sc= -2.88! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -160:sc= -0.108 USER MOD Single : A 101 TYR OH : rot -132:sc= 0.467 USER MOD Single : A 102 TYR OH : rot 15:sc= 0.936 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= 0.696 K(o=0.7,f=-1.1) USER MOD Single : A 114 GLN : amide:sc= -4.32! K(o=-4.3!,f=-0.46) USER MOD Single : A 116 MET CE :methyl -179:sc= -1.98! (180deg=-1.98!) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 164:sc= -0.0724 (180deg=-0.428) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.148 K(o=-0.15,f=-3!) USER MOD Single : A 130 GLN : amide:sc= -3.57! C(o=-3.6!,f=-1.6!) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 TYR OH : rot 80:sc= -1.46! USER MOD Single : A 139 HIS : no HE2:sc= -0.34 X(o=-0.34,f=-0.68) USER MOD Single : A 141 MET CE :methyl -145:sc= -1.29 (180deg=-2.73) USER MOD Single : A 152 GLN : amide:sc= -0.368 X(o=-0.37,f=-0.15) USER MOD Single : A 153 LYS NZ :NH3+ 162:sc= 1.23 (180deg=1.21) USER MOD Single : A 155 LYS NZ :NH3+ 169:sc= -0.0136 (180deg=-0.125) USER MOD Single : A 156 ASN : amide:sc= -3.02! K(o=-3!,f=0) USER MOD ----------------------------------------------------------------- ATOM 35 N ILE A 3 9.724 8.914 0.426 1.00 2.10 N ATOM 36 CA ILE A 3 8.537 8.833 -0.389 1.00 1.35 C ATOM 37 C ILE A 3 8.496 10.041 -1.335 1.00 40.32 C ATOM 38 O ILE A 3 8.522 11.190 -0.887 1.00 42.20 O ATOM 39 CB ILE A 3 7.206 8.769 0.458 1.00 23.12 C ATOM 40 CG1 ILE A 3 7.100 7.494 1.341 1.00 14.43 C ATOM 41 CG2 ILE A 3 5.997 8.860 -0.436 1.00 61.21 C ATOM 42 CD1 ILE A 3 8.056 7.422 2.513 1.00 64.35 C ATOM 0 HA ILE A 3 8.591 7.901 -0.952 1.00 1.35 H new ATOM 0 HB ILE A 3 7.239 9.628 1.129 1.00 23.12 H new ATOM 0 HG12 ILE A 3 6.081 7.423 1.723 1.00 14.43 H new ATOM 0 HG13 ILE A 3 7.265 6.622 0.708 1.00 14.43 H new ATOM 0 HG21 ILE A 3 5.092 8.814 0.170 1.00 61.21 H new ATOM 0 HG22 ILE A 3 6.019 9.802 -0.983 1.00 61.21 H new ATOM 0 HG23 ILE A 3 6.003 8.030 -1.142 1.00 61.21 H new ATOM 0 HD11 ILE A 3 7.894 6.492 3.058 1.00 64.35 H new ATOM 0 HD12 ILE A 3 9.082 7.454 2.148 1.00 64.35 H new ATOM 0 HD13 ILE A 3 7.881 8.268 3.178 1.00 64.35 H new ATOM 54 N GLN A 4 8.433 9.784 -2.622 1.00 33.43 N ATOM 55 CA GLN A 4 8.435 10.839 -3.604 1.00 71.25 C ATOM 56 C GLN A 4 7.007 11.232 -3.848 1.00 62.01 C ATOM 57 O GLN A 4 6.132 10.382 -3.858 1.00 13.32 O ATOM 58 CB GLN A 4 9.061 10.331 -4.881 1.00 44.22 C ATOM 59 CG GLN A 4 9.406 11.412 -5.892 1.00 71.43 C ATOM 60 CD GLN A 4 10.148 10.876 -7.103 1.00 62.33 C ATOM 61 OE1 GLN A 4 10.031 11.410 -8.198 1.00 22.05 O ATOM 62 NE2 GLN A 4 10.926 9.828 -6.918 1.00 71.12 N ATOM 0 H GLN A 4 8.379 8.844 -3.013 1.00 33.43 H new ATOM 0 HA GLN A 4 9.008 11.698 -3.256 1.00 71.25 H new ATOM 0 HB2 GLN A 4 9.969 9.783 -4.631 1.00 44.22 H new ATOM 0 HB3 GLN A 4 8.378 9.621 -5.347 1.00 44.22 H new ATOM 0 HG2 GLN A 4 8.489 11.900 -6.221 1.00 71.43 H new ATOM 0 HG3 GLN A 4 10.016 12.174 -5.407 1.00 71.43 H new ATOM 0 HE21 GLN A 4 11.002 9.406 -5.992 1.00 71.12 H new ATOM 0 HE22 GLN A 4 11.452 9.439 -7.700 1.00 71.12 H new ATOM 71 N LYS A 5 6.758 12.478 -4.035 1.00 44.51 N ATOM 72 CA LYS A 5 5.417 12.931 -4.141 1.00 4.41 C ATOM 73 C LYS A 5 5.034 13.246 -5.570 1.00 41.54 C ATOM 74 O LYS A 5 5.486 14.227 -6.159 1.00 34.22 O ATOM 75 CB LYS A 5 5.190 14.115 -3.205 1.00 52.24 C ATOM 76 CG LYS A 5 5.591 13.819 -1.752 1.00 63.33 C ATOM 77 CD LYS A 5 4.838 12.617 -1.171 1.00 50.11 C ATOM 78 CE LYS A 5 3.379 12.918 -0.854 1.00 20.22 C ATOM 79 NZ LYS A 5 3.243 13.947 0.205 1.00 23.31 N ATOM 0 H LYS A 5 7.468 13.206 -4.118 1.00 44.51 H new ATOM 0 HA LYS A 5 4.757 12.122 -3.829 1.00 4.41 H new ATOM 0 HB2 LYS A 5 5.761 14.971 -3.566 1.00 52.24 H new ATOM 0 HB3 LYS A 5 4.138 14.398 -3.235 1.00 52.24 H new ATOM 0 HG2 LYS A 5 6.663 13.629 -1.705 1.00 63.33 H new ATOM 0 HG3 LYS A 5 5.396 14.698 -1.138 1.00 63.33 H new ATOM 0 HD2 LYS A 5 4.886 11.790 -1.879 1.00 50.11 H new ATOM 0 HD3 LYS A 5 5.340 12.287 -0.261 1.00 50.11 H new ATOM 0 HE2 LYS A 5 2.874 13.259 -1.758 1.00 20.22 H new ATOM 0 HE3 LYS A 5 2.880 12.002 -0.536 1.00 20.22 H new ATOM 0 HZ1 LYS A 5 2.269 13.943 0.570 1.00 23.31 H new ATOM 0 HZ2 LYS A 5 3.904 13.737 0.980 1.00 23.31 H new ATOM 0 HZ3 LYS A 5 3.460 14.884 -0.191 1.00 23.31 H new ATOM 93 N LYS A 6 4.229 12.376 -6.126 1.00 51.03 N ATOM 94 CA LYS A 6 3.681 12.529 -7.470 1.00 53.33 C ATOM 95 C LYS A 6 2.200 12.301 -7.394 1.00 53.21 C ATOM 96 O LYS A 6 1.615 11.576 -8.196 1.00 75.22 O ATOM 97 CB LYS A 6 4.314 11.543 -8.466 1.00 64.32 C ATOM 98 CG LYS A 6 5.803 11.738 -8.672 1.00 5.01 C ATOM 99 CD LYS A 6 6.367 10.810 -9.764 1.00 74.00 C ATOM 100 CE LYS A 6 5.735 11.063 -11.143 1.00 51.33 C ATOM 101 NZ LYS A 6 5.948 12.446 -11.637 1.00 63.23 N ATOM 0 H LYS A 6 3.925 11.523 -5.657 1.00 51.03 H new ATOM 0 HA LYS A 6 3.905 13.533 -7.832 1.00 53.33 H new ATOM 0 HB2 LYS A 6 4.137 10.526 -8.115 1.00 64.32 H new ATOM 0 HB3 LYS A 6 3.810 11.641 -9.427 1.00 64.32 H new ATOM 0 HG2 LYS A 6 5.997 12.776 -8.944 1.00 5.01 H new ATOM 0 HG3 LYS A 6 6.325 11.551 -7.734 1.00 5.01 H new ATOM 0 HD2 LYS A 6 7.446 10.950 -9.832 1.00 74.00 H new ATOM 0 HD3 LYS A 6 6.198 9.772 -9.476 1.00 74.00 H new ATOM 0 HE2 LYS A 6 6.153 10.358 -11.862 1.00 51.33 H new ATOM 0 HE3 LYS A 6 4.665 10.864 -11.087 1.00 51.33 H new ATOM 0 HZ1 LYS A 6 5.574 12.531 -12.604 1.00 63.23 H new ATOM 0 HZ2 LYS A 6 5.454 13.117 -11.015 1.00 63.23 H new ATOM 0 HZ3 LYS A 6 6.966 12.661 -11.639 1.00 63.23 H new ATOM 115 N LEU A 7 1.607 12.953 -6.426 1.00 74.25 N ATOM 116 CA LEU A 7 0.201 12.829 -6.135 1.00 23.05 C ATOM 117 C LEU A 7 -0.667 13.266 -7.315 1.00 22.22 C ATOM 118 O LEU A 7 -0.266 14.105 -8.136 1.00 73.54 O ATOM 119 CB LEU A 7 -0.173 13.614 -4.864 1.00 44.32 C ATOM 120 CG LEU A 7 0.594 13.246 -3.574 1.00 3.44 C ATOM 121 CD1 LEU A 7 0.104 14.076 -2.409 1.00 50.20 C ATOM 122 CD2 LEU A 7 0.468 11.762 -3.253 1.00 63.20 C ATOM 0 H LEU A 7 2.098 13.597 -5.806 1.00 74.25 H new ATOM 0 HA LEU A 7 0.003 11.772 -5.957 1.00 23.05 H new ATOM 0 HB2 LEU A 7 -0.019 14.675 -5.061 1.00 44.32 H new ATOM 0 HB3 LEU A 7 -1.238 13.475 -4.679 1.00 44.32 H new ATOM 0 HG LEU A 7 1.648 13.464 -3.745 1.00 3.44 H new ATOM 0 HD11 LEU A 7 0.656 13.802 -1.510 1.00 50.20 H new ATOM 0 HD12 LEU A 7 0.261 15.133 -2.624 1.00 50.20 H new ATOM 0 HD13 LEU A 7 -0.959 13.892 -2.252 1.00 50.20 H new ATOM 0 HD21 LEU A 7 1.020 11.539 -2.340 1.00 63.20 H new ATOM 0 HD22 LEU A 7 -0.583 11.508 -3.113 1.00 63.20 H new ATOM 0 HD23 LEU A 7 0.877 11.176 -4.076 1.00 63.20 H new ATOM 134 N VAL A 8 -1.833 12.684 -7.391 1.00 24.11 N ATOM 135 CA VAL A 8 -2.780 12.946 -8.445 1.00 62.54 C ATOM 136 C VAL A 8 -3.401 14.351 -8.269 1.00 24.20 C ATOM 137 O VAL A 8 -3.446 14.886 -7.146 1.00 21.31 O ATOM 138 CB VAL A 8 -3.895 11.869 -8.442 1.00 42.02 C ATOM 139 CG1 VAL A 8 -4.811 12.005 -7.235 1.00 35.04 C ATOM 140 CG2 VAL A 8 -4.666 11.866 -9.732 1.00 72.34 C ATOM 0 H VAL A 8 -2.160 12.000 -6.709 1.00 24.11 H new ATOM 0 HA VAL A 8 -2.257 12.910 -9.401 1.00 62.54 H new ATOM 0 HB VAL A 8 -3.404 10.899 -8.359 1.00 42.02 H new ATOM 0 HG11 VAL A 8 -5.578 11.231 -7.271 1.00 35.04 H new ATOM 0 HG12 VAL A 8 -4.227 11.895 -6.321 1.00 35.04 H new ATOM 0 HG13 VAL A 8 -5.285 12.987 -7.247 1.00 35.04 H new ATOM 0 HG21 VAL A 8 -5.439 11.098 -9.692 1.00 72.34 H new ATOM 0 HG22 VAL A 8 -5.131 12.841 -9.881 1.00 72.34 H new ATOM 0 HG23 VAL A 8 -3.989 11.657 -10.560 1.00 72.34 H new ATOM 150 N ASP A 9 -3.841 14.948 -9.362 1.00 63.21 N ATOM 151 CA ASP A 9 -4.406 16.284 -9.331 1.00 4.22 C ATOM 152 C ASP A 9 -5.833 16.216 -8.786 1.00 14.14 C ATOM 153 O ASP A 9 -6.548 15.267 -9.079 1.00 1.24 O ATOM 154 CB ASP A 9 -4.398 16.878 -10.749 1.00 53.21 C ATOM 155 CG ASP A 9 -4.958 18.277 -10.826 1.00 3.41 C ATOM 156 OD1 ASP A 9 -6.189 18.426 -10.985 1.00 11.31 O ATOM 157 OD2 ASP A 9 -4.176 19.253 -10.758 1.00 42.35 O ATOM 0 H ASP A 9 -3.817 14.524 -10.289 1.00 63.21 H new ATOM 0 HA ASP A 9 -3.810 16.925 -8.681 1.00 4.22 H new ATOM 0 HB2 ASP A 9 -3.375 16.885 -11.124 1.00 53.21 H new ATOM 0 HB3 ASP A 9 -4.975 16.229 -11.408 1.00 53.21 H new ATOM 162 N PRO A 10 -6.259 17.204 -7.963 1.00 23.22 N ATOM 163 CA PRO A 10 -7.611 17.247 -7.367 1.00 23.34 C ATOM 164 C PRO A 10 -8.773 17.112 -8.373 1.00 23.42 C ATOM 165 O PRO A 10 -9.884 16.750 -7.987 1.00 10.12 O ATOM 166 CB PRO A 10 -7.669 18.606 -6.660 1.00 61.12 C ATOM 167 CG PRO A 10 -6.487 19.362 -7.160 1.00 64.01 C ATOM 168 CD PRO A 10 -5.453 18.340 -7.507 1.00 1.23 C ATOM 0 HA PRO A 10 -7.749 16.391 -6.706 1.00 23.34 H new ATOM 0 HB2 PRO A 10 -8.597 19.130 -6.891 1.00 61.12 H new ATOM 0 HB3 PRO A 10 -7.630 18.488 -5.577 1.00 61.12 H new ATOM 0 HG2 PRO A 10 -6.749 19.962 -8.032 1.00 64.01 H new ATOM 0 HG3 PRO A 10 -6.115 20.049 -6.400 1.00 64.01 H new ATOM 0 HD2 PRO A 10 -4.778 18.696 -8.286 1.00 1.23 H new ATOM 0 HD3 PRO A 10 -4.837 18.079 -6.646 1.00 1.23 H new ATOM 176 N SER A 11 -8.523 17.366 -9.646 1.00 2.50 N ATOM 177 CA SER A 11 -9.569 17.246 -10.648 1.00 10.14 C ATOM 178 C SER A 11 -9.801 15.761 -10.959 1.00 51.21 C ATOM 179 O SER A 11 -10.864 15.361 -11.426 1.00 10.33 O ATOM 180 CB SER A 11 -9.170 18.024 -11.917 1.00 35.33 C ATOM 181 OG SER A 11 -10.168 17.974 -12.932 1.00 34.44 O ATOM 0 H SER A 11 -7.614 17.654 -10.008 1.00 2.50 H new ATOM 0 HA SER A 11 -10.498 17.673 -10.270 1.00 10.14 H new ATOM 0 HB2 SER A 11 -8.977 19.064 -11.654 1.00 35.33 H new ATOM 0 HB3 SER A 11 -8.238 17.617 -12.310 1.00 35.33 H new ATOM 0 HG SER A 11 -9.866 18.483 -13.713 1.00 34.44 H new ATOM 187 N LYS A 12 -8.811 14.952 -10.632 1.00 33.03 N ATOM 188 CA LYS A 12 -8.833 13.523 -10.906 1.00 12.01 C ATOM 189 C LYS A 12 -9.241 12.796 -9.670 1.00 72.44 C ATOM 190 O LYS A 12 -9.356 11.553 -9.674 1.00 43.42 O ATOM 191 CB LYS A 12 -7.441 13.055 -11.281 1.00 12.05 C ATOM 192 CG LYS A 12 -6.711 13.966 -12.261 1.00 12.23 C ATOM 193 CD LYS A 12 -7.474 14.152 -13.540 1.00 44.10 C ATOM 194 CE LYS A 12 -7.514 12.874 -14.359 1.00 63.31 C ATOM 195 NZ LYS A 12 -8.310 13.018 -15.590 1.00 55.44 N ATOM 0 H LYS A 12 -7.961 15.268 -10.165 1.00 33.03 H new ATOM 0 HA LYS A 12 -9.531 13.327 -11.720 1.00 12.01 H new ATOM 0 HB2 LYS A 12 -6.844 12.966 -10.373 1.00 12.05 H new ATOM 0 HB3 LYS A 12 -7.511 12.058 -11.715 1.00 12.05 H new ATOM 0 HG2 LYS A 12 -6.544 14.937 -11.796 1.00 12.23 H new ATOM 0 HG3 LYS A 12 -5.730 13.546 -12.483 1.00 12.23 H new ATOM 0 HD2 LYS A 12 -8.491 14.472 -13.314 1.00 44.10 H new ATOM 0 HD3 LYS A 12 -7.013 14.946 -14.127 1.00 44.10 H new ATOM 0 HE2 LYS A 12 -6.497 12.581 -14.620 1.00 63.31 H new ATOM 0 HE3 LYS A 12 -7.931 12.070 -13.752 1.00 63.31 H new ATOM 0 HZ1 LYS A 12 -8.306 12.119 -16.113 1.00 55.44 H new ATOM 0 HZ2 LYS A 12 -9.288 13.271 -15.343 1.00 55.44 H new ATOM 0 HZ3 LYS A 12 -7.898 13.766 -16.184 1.00 55.44 H new ATOM 209 N TYR A 13 -9.465 13.555 -8.599 1.00 52.13 N ATOM 210 CA TYR A 13 -9.808 12.973 -7.344 1.00 64.03 C ATOM 211 C TYR A 13 -11.013 12.119 -7.433 1.00 0.40 C ATOM 212 O TYR A 13 -10.978 11.038 -6.988 1.00 41.13 O ATOM 213 CB TYR A 13 -10.047 14.032 -6.269 1.00 3.33 C ATOM 214 CG TYR A 13 -8.837 14.502 -5.489 1.00 22.13 C ATOM 215 CD1 TYR A 13 -7.540 14.117 -5.815 1.00 65.14 C ATOM 216 CD2 TYR A 13 -9.016 15.314 -4.379 1.00 2.43 C ATOM 217 CE1 TYR A 13 -6.465 14.539 -5.057 1.00 74.11 C ATOM 218 CE2 TYR A 13 -7.954 15.731 -3.620 1.00 64.22 C ATOM 219 CZ TYR A 13 -6.684 15.347 -3.955 1.00 61.02 C ATOM 220 OH TYR A 13 -5.626 15.754 -3.173 1.00 52.41 O ATOM 0 H TYR A 13 -9.410 14.574 -8.596 1.00 52.13 H new ATOM 0 HA TYR A 13 -8.952 12.358 -7.066 1.00 64.03 H new ATOM 0 HB2 TYR A 13 -10.503 14.901 -6.744 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -10.775 13.638 -5.560 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -7.372 13.480 -6.671 1.00 65.14 H new ATOM 0 HD2 TYR A 13 -10.014 15.624 -4.107 1.00 2.43 H new ATOM 0 HE1 TYR A 13 -5.461 14.241 -5.322 1.00 74.11 H new ATOM 0 HE2 TYR A 13 -8.119 16.362 -2.759 1.00 64.22 H new ATOM 0 HH TYR A 13 -5.670 16.724 -3.043 1.00 52.41 H new ATOM 230 N GLY A 14 -12.019 12.519 -8.146 1.00 50.13 N ATOM 231 CA GLY A 14 -13.240 11.746 -8.047 1.00 1.33 C ATOM 232 C GLY A 14 -13.321 10.537 -8.936 1.00 41.33 C ATOM 233 O GLY A 14 -14.407 10.066 -9.264 1.00 21.55 O ATOM 0 H GLY A 14 -12.036 13.325 -8.771 1.00 50.13 H new ATOM 0 HA2 GLY A 14 -13.360 11.422 -7.013 1.00 1.33 H new ATOM 0 HA3 GLY A 14 -14.082 12.400 -8.276 1.00 1.33 H new ATOM 237 N THR A 15 -12.185 10.044 -9.317 1.00 73.33 N ATOM 238 CA THR A 15 -12.082 8.807 -10.011 1.00 65.24 C ATOM 239 C THR A 15 -11.178 7.879 -9.188 1.00 30.51 C ATOM 240 O THR A 15 -11.429 6.679 -9.084 1.00 22.30 O ATOM 241 CB THR A 15 -11.503 9.008 -11.430 1.00 22.14 C ATOM 242 OG1 THR A 15 -12.319 9.966 -12.144 1.00 23.02 O ATOM 243 CG2 THR A 15 -11.468 7.691 -12.215 1.00 12.02 C ATOM 0 H THR A 15 -11.289 10.501 -9.150 1.00 73.33 H new ATOM 0 HA THR A 15 -13.073 8.368 -10.129 1.00 65.24 H new ATOM 0 HB THR A 15 -10.480 9.373 -11.332 1.00 22.14 H new ATOM 0 HG1 THR A 15 -11.955 10.099 -13.044 1.00 23.02 H new ATOM 0 HG21 THR A 15 -11.055 7.870 -13.208 1.00 12.02 H new ATOM 0 HG22 THR A 15 -10.844 6.969 -11.687 1.00 12.02 H new ATOM 0 HG23 THR A 15 -12.480 7.296 -12.308 1.00 12.02 H new ATOM 251 N LYS A 16 -10.137 8.463 -8.581 1.00 72.23 N ATOM 252 CA LYS A 16 -9.183 7.689 -7.767 1.00 1.14 C ATOM 253 C LYS A 16 -9.501 7.784 -6.246 1.00 44.22 C ATOM 254 O LYS A 16 -9.321 6.821 -5.493 1.00 61.14 O ATOM 255 CB LYS A 16 -7.762 8.189 -8.076 1.00 24.31 C ATOM 256 CG LYS A 16 -7.426 8.098 -9.562 1.00 73.33 C ATOM 257 CD LYS A 16 -7.307 6.651 -10.027 1.00 72.20 C ATOM 258 CE LYS A 16 -7.441 6.531 -11.493 1.00 41.13 C ATOM 259 NZ LYS A 16 -6.457 7.331 -12.212 1.00 60.30 N ATOM 0 H LYS A 16 -9.932 9.461 -8.635 1.00 72.23 H new ATOM 0 HA LYS A 16 -9.267 6.634 -8.026 1.00 1.14 H new ATOM 0 HB2 LYS A 16 -7.663 9.223 -7.746 1.00 24.31 H new ATOM 0 HB3 LYS A 16 -7.041 7.603 -7.506 1.00 24.31 H new ATOM 0 HG2 LYS A 16 -8.199 8.604 -10.141 1.00 73.33 H new ATOM 0 HG3 LYS A 16 -6.489 8.620 -9.756 1.00 73.33 H new ATOM 0 HD2 LYS A 16 -6.343 6.248 -9.716 1.00 72.20 H new ATOM 0 HD3 LYS A 16 -8.075 6.049 -9.542 1.00 72.20 H new ATOM 0 HE2 LYS A 16 -7.333 5.485 -11.780 1.00 41.13 H new ATOM 0 HE3 LYS A 16 -8.443 6.841 -11.789 1.00 41.13 H new ATOM 0 HZ1 LYS A 16 -6.724 7.390 -13.215 1.00 60.30 H new ATOM 0 HZ2 LYS A 16 -6.423 8.288 -11.805 1.00 60.30 H new ATOM 0 HZ3 LYS A 16 -5.520 6.886 -12.129 1.00 60.30 H new ATOM 273 N CYS A 17 -9.989 8.937 -5.825 1.00 1.00 N ATOM 274 CA CYS A 17 -10.340 9.210 -4.431 1.00 33.43 C ATOM 275 C CYS A 17 -11.317 10.405 -4.301 1.00 71.12 C ATOM 276 O CYS A 17 -10.926 11.502 -3.912 1.00 61.24 O ATOM 277 CB CYS A 17 -9.088 9.450 -3.601 1.00 62.22 C ATOM 278 SG CYS A 17 -7.936 10.680 -4.278 1.00 3.53 S ATOM 0 H CYS A 17 -10.158 9.727 -6.448 1.00 1.00 H new ATOM 0 HA CYS A 17 -10.853 8.328 -4.047 1.00 33.43 H new ATOM 0 HB2 CYS A 17 -9.389 9.768 -2.603 1.00 62.22 H new ATOM 0 HB3 CYS A 17 -8.559 8.504 -3.488 1.00 62.22 H new ATOM 0 HG CYS A 17 -7.025 10.955 -3.392 1.00 3.53 H new ATOM 284 N PRO A 18 -12.602 10.225 -4.707 1.00 23.41 N ATOM 285 CA PRO A 18 -13.594 11.308 -4.678 1.00 41.25 C ATOM 286 C PRO A 18 -13.918 11.743 -3.283 1.00 65.32 C ATOM 287 O PRO A 18 -14.336 12.882 -3.049 1.00 15.53 O ATOM 288 CB PRO A 18 -14.843 10.697 -5.322 1.00 1.14 C ATOM 289 CG PRO A 18 -14.644 9.232 -5.265 1.00 54.03 C ATOM 290 CD PRO A 18 -13.159 8.989 -5.257 1.00 73.54 C ATOM 0 HA PRO A 18 -13.221 12.193 -5.193 1.00 41.25 H new ATOM 0 HB2 PRO A 18 -15.745 10.991 -4.785 1.00 1.14 H new ATOM 0 HB3 PRO A 18 -14.960 11.037 -6.351 1.00 1.14 H new ATOM 0 HG2 PRO A 18 -15.108 8.814 -4.371 1.00 54.03 H new ATOM 0 HG3 PRO A 18 -15.110 8.746 -6.122 1.00 54.03 H new ATOM 0 HD2 PRO A 18 -12.899 8.126 -4.644 1.00 73.54 H new ATOM 0 HD3 PRO A 18 -12.781 8.792 -6.260 1.00 73.54 H new ATOM 298 N TYR A 19 -13.728 10.856 -2.365 1.00 64.21 N ATOM 299 CA TYR A 19 -14.072 11.142 -1.006 1.00 65.42 C ATOM 300 C TYR A 19 -12.848 11.418 -0.166 1.00 30.13 C ATOM 301 O TYR A 19 -11.769 10.861 -0.376 1.00 63.13 O ATOM 302 CB TYR A 19 -14.903 10.026 -0.392 1.00 22.52 C ATOM 303 CG TYR A 19 -16.131 9.686 -1.173 1.00 20.53 C ATOM 304 CD1 TYR A 19 -17.222 10.537 -1.196 1.00 0.33 C ATOM 305 CD2 TYR A 19 -16.187 8.522 -1.920 1.00 4.04 C ATOM 306 CE1 TYR A 19 -18.342 10.235 -1.937 1.00 60.34 C ATOM 307 CE2 TYR A 19 -17.294 8.214 -2.668 1.00 41.42 C ATOM 308 CZ TYR A 19 -18.373 9.073 -2.675 1.00 11.20 C ATOM 309 OH TYR A 19 -19.486 8.769 -3.425 1.00 25.31 O ATOM 0 H TYR A 19 -13.337 9.928 -2.526 1.00 64.21 H new ATOM 0 HA TYR A 19 -14.680 12.047 -1.018 1.00 65.42 H new ATOM 0 HB2 TYR A 19 -14.284 9.134 -0.300 1.00 22.52 H new ATOM 0 HB3 TYR A 19 -15.195 10.317 0.617 1.00 22.52 H new ATOM 0 HD1 TYR A 19 -17.194 11.452 -0.624 1.00 0.33 H new ATOM 0 HD2 TYR A 19 -15.345 7.846 -1.914 1.00 4.04 H new ATOM 0 HE1 TYR A 19 -19.190 10.904 -1.940 1.00 60.34 H new ATOM 0 HE2 TYR A 19 -17.321 7.304 -3.249 1.00 41.42 H new ATOM 0 HH TYR A 19 -19.346 7.916 -3.887 1.00 25.31 H new ATOM 319 N THR A 20 -13.031 12.253 0.771 1.00 51.44 N ATOM 320 CA THR A 20 -12.005 12.648 1.674 1.00 71.55 C ATOM 321 C THR A 20 -12.180 11.906 2.973 1.00 21.30 C ATOM 322 O THR A 20 -13.250 11.964 3.596 1.00 72.41 O ATOM 323 CB THR A 20 -12.027 14.172 1.889 1.00 12.00 C ATOM 324 OG1 THR A 20 -13.381 14.618 2.181 1.00 74.34 O ATOM 325 CG2 THR A 20 -11.504 14.900 0.660 1.00 1.14 C ATOM 0 H THR A 20 -13.928 12.705 0.948 1.00 51.44 H new ATOM 0 HA THR A 20 -11.031 12.397 1.254 1.00 71.55 H new ATOM 0 HB THR A 20 -11.379 14.404 2.734 1.00 12.00 H new ATOM 0 HG1 THR A 20 -13.841 13.939 2.718 1.00 74.34 H new ATOM 0 HG21 THR A 20 -11.529 15.975 0.836 1.00 1.14 H new ATOM 0 HG22 THR A 20 -10.478 14.589 0.462 1.00 1.14 H new ATOM 0 HG23 THR A 20 -12.129 14.658 -0.200 1.00 1.14 H new ATOM 333 N MET A 21 -11.170 11.200 3.381 1.00 42.44 N ATOM 334 CA MET A 21 -11.291 10.349 4.552 1.00 1.54 C ATOM 335 C MET A 21 -9.926 10.074 5.140 1.00 61.30 C ATOM 336 O MET A 21 -8.940 10.044 4.418 1.00 72.10 O ATOM 337 CB MET A 21 -11.969 9.026 4.152 1.00 74.42 C ATOM 338 CG MET A 21 -12.304 8.100 5.307 1.00 52.14 C ATOM 339 SD MET A 21 -13.468 8.845 6.465 1.00 23.03 S ATOM 340 CE MET A 21 -13.717 7.490 7.610 1.00 73.24 C ATOM 0 H MET A 21 -10.254 11.188 2.932 1.00 42.44 H new ATOM 0 HA MET A 21 -11.897 10.855 5.304 1.00 1.54 H new ATOM 0 HB2 MET A 21 -12.888 9.255 3.612 1.00 74.42 H new ATOM 0 HB3 MET A 21 -11.316 8.496 3.459 1.00 74.42 H new ATOM 0 HG2 MET A 21 -12.726 7.174 4.917 1.00 52.14 H new ATOM 0 HG3 MET A 21 -11.388 7.836 5.835 1.00 52.14 H new ATOM 0 HE1 MET A 21 -14.721 7.549 8.030 1.00 73.24 H new ATOM 0 HE2 MET A 21 -13.598 6.543 7.084 1.00 73.24 H new ATOM 0 HE3 MET A 21 -12.983 7.553 8.414 1.00 73.24 H new ATOM 350 N LYS A 22 -9.879 9.888 6.441 1.00 51.10 N ATOM 351 CA LYS A 22 -8.640 9.597 7.123 1.00 1.12 C ATOM 352 C LYS A 22 -8.435 8.083 7.209 1.00 14.33 C ATOM 353 O LYS A 22 -9.368 7.340 7.555 1.00 12.10 O ATOM 354 CB LYS A 22 -8.619 10.237 8.522 1.00 52.43 C ATOM 355 CG LYS A 22 -9.756 9.797 9.445 1.00 62.33 C ATOM 356 CD LYS A 22 -9.651 10.440 10.818 1.00 43.23 C ATOM 357 CE LYS A 22 -9.748 11.957 10.745 1.00 43.23 C ATOM 358 NZ LYS A 22 -9.614 12.581 12.074 1.00 4.22 N ATOM 0 H LYS A 22 -10.695 9.934 7.052 1.00 51.10 H new ATOM 0 HA LYS A 22 -7.817 10.028 6.552 1.00 1.12 H new ATOM 0 HB2 LYS A 22 -7.669 10.000 9.001 1.00 52.43 H new ATOM 0 HB3 LYS A 22 -8.658 11.321 8.411 1.00 52.43 H new ATOM 0 HG2 LYS A 22 -10.713 10.059 8.993 1.00 62.33 H new ATOM 0 HG3 LYS A 22 -9.740 8.712 9.550 1.00 62.33 H new ATOM 0 HD2 LYS A 22 -10.444 10.056 11.460 1.00 43.23 H new ATOM 0 HD3 LYS A 22 -8.704 10.159 11.279 1.00 43.23 H new ATOM 0 HE2 LYS A 22 -8.970 12.339 10.084 1.00 43.23 H new ATOM 0 HE3 LYS A 22 -10.705 12.239 10.306 1.00 43.23 H new ATOM 0 HZ1 LYS A 22 -9.686 13.614 11.981 1.00 4.22 H new ATOM 0 HZ2 LYS A 22 -10.372 12.236 12.697 1.00 4.22 H new ATOM 0 HZ3 LYS A 22 -8.690 12.333 12.482 1.00 4.22 H new ATOM 372 N PRO A 23 -7.230 7.611 6.897 1.00 42.54 N ATOM 373 CA PRO A 23 -6.919 6.185 6.851 1.00 0.04 C ATOM 374 C PRO A 23 -6.855 5.540 8.235 1.00 43.45 C ATOM 375 O PRO A 23 -6.390 6.149 9.210 1.00 60.44 O ATOM 376 CB PRO A 23 -5.549 6.144 6.179 1.00 53.33 C ATOM 377 CG PRO A 23 -4.928 7.453 6.509 1.00 4.23 C ATOM 378 CD PRO A 23 -6.052 8.441 6.569 1.00 70.12 C ATOM 0 HA PRO A 23 -7.691 5.625 6.323 1.00 0.04 H new ATOM 0 HB2 PRO A 23 -4.949 5.315 6.554 1.00 53.33 H new ATOM 0 HB3 PRO A 23 -5.640 6.009 5.101 1.00 53.33 H new ATOM 0 HG2 PRO A 23 -4.400 7.405 7.461 1.00 4.23 H new ATOM 0 HG3 PRO A 23 -4.197 7.739 5.753 1.00 4.23 H new ATOM 0 HD2 PRO A 23 -5.875 9.203 7.328 1.00 70.12 H new ATOM 0 HD3 PRO A 23 -6.180 8.960 5.619 1.00 70.12 H new ATOM 386 N LYS A 24 -7.342 4.322 8.323 1.00 31.02 N ATOM 387 CA LYS A 24 -7.317 3.594 9.550 1.00 61.43 C ATOM 388 C LYS A 24 -6.654 2.233 9.344 1.00 20.40 C ATOM 389 O LYS A 24 -6.124 1.643 10.275 1.00 50.23 O ATOM 390 CB LYS A 24 -8.736 3.422 10.067 1.00 33.25 C ATOM 391 CG LYS A 24 -8.913 2.665 11.387 1.00 14.41 C ATOM 392 CD LYS A 24 -8.496 3.448 12.663 1.00 33.33 C ATOM 393 CE LYS A 24 -6.989 3.696 12.806 1.00 3.21 C ATOM 394 NZ LYS A 24 -6.665 4.360 14.091 1.00 13.22 N ATOM 0 H LYS A 24 -7.763 3.819 7.542 1.00 31.02 H new ATOM 0 HA LYS A 24 -6.736 4.149 10.286 1.00 61.43 H new ATOM 0 HB2 LYS A 24 -9.175 4.413 10.184 1.00 33.25 H new ATOM 0 HB3 LYS A 24 -9.314 2.905 9.301 1.00 33.25 H new ATOM 0 HG2 LYS A 24 -9.960 2.376 11.484 1.00 14.41 H new ATOM 0 HG3 LYS A 24 -8.332 1.744 11.340 1.00 14.41 H new ATOM 0 HD2 LYS A 24 -9.009 4.410 12.665 1.00 33.33 H new ATOM 0 HD3 LYS A 24 -8.844 2.899 13.538 1.00 33.33 H new ATOM 0 HE2 LYS A 24 -6.456 2.748 12.741 1.00 3.21 H new ATOM 0 HE3 LYS A 24 -6.641 4.314 11.978 1.00 3.21 H new ATOM 0 HZ1 LYS A 24 -5.689 4.128 14.365 1.00 13.22 H new ATOM 0 HZ2 LYS A 24 -6.759 5.390 13.983 1.00 13.22 H new ATOM 0 HZ3 LYS A 24 -7.319 4.028 14.828 1.00 13.22 H new ATOM 408 N TYR A 25 -6.697 1.734 8.129 1.00 35.02 N ATOM 409 CA TYR A 25 -6.084 0.457 7.833 1.00 14.34 C ATOM 410 C TYR A 25 -5.008 0.635 6.790 1.00 4.21 C ATOM 411 O TYR A 25 -4.804 1.737 6.287 1.00 5.23 O ATOM 412 CB TYR A 25 -7.108 -0.543 7.300 1.00 23.24 C ATOM 413 CG TYR A 25 -8.318 -0.761 8.177 1.00 43.02 C ATOM 414 CD1 TYR A 25 -8.288 -1.670 9.220 1.00 21.04 C ATOM 415 CD2 TYR A 25 -9.496 -0.059 7.951 1.00 72.15 C ATOM 416 CE1 TYR A 25 -9.395 -1.875 10.018 1.00 10.34 C ATOM 417 CE2 TYR A 25 -10.605 -0.257 8.744 1.00 24.54 C ATOM 418 CZ TYR A 25 -10.549 -1.165 9.775 1.00 74.51 C ATOM 419 OH TYR A 25 -11.657 -1.368 10.566 1.00 4.53 O ATOM 0 H TYR A 25 -7.147 2.189 7.334 1.00 35.02 H new ATOM 0 HA TYR A 25 -5.661 0.073 8.761 1.00 14.34 H new ATOM 0 HB2 TYR A 25 -7.446 -0.204 6.321 1.00 23.24 H new ATOM 0 HB3 TYR A 25 -6.611 -1.502 7.151 1.00 23.24 H new ATOM 0 HD1 TYR A 25 -7.384 -2.228 9.413 1.00 21.04 H new ATOM 0 HD2 TYR A 25 -9.543 0.653 7.141 1.00 72.15 H new ATOM 0 HE1 TYR A 25 -9.356 -2.588 10.828 1.00 10.34 H new ATOM 0 HE2 TYR A 25 -11.513 0.298 8.557 1.00 24.54 H new ATOM 0 HH TYR A 25 -12.386 -0.788 10.262 1.00 4.53 H new ATOM 429 N ILE A 26 -4.335 -0.440 6.458 1.00 3.33 N ATOM 430 CA ILE A 26 -3.322 -0.446 5.426 1.00 74.24 C ATOM 431 C ILE A 26 -3.480 -1.721 4.617 1.00 2.44 C ATOM 432 O ILE A 26 -3.654 -2.788 5.175 1.00 64.12 O ATOM 433 CB ILE A 26 -1.875 -0.351 6.013 1.00 0.50 C ATOM 434 CG1 ILE A 26 -1.706 0.965 6.794 1.00 42.22 C ATOM 435 CG2 ILE A 26 -0.818 -0.465 4.907 1.00 15.33 C ATOM 436 CD1 ILE A 26 -0.354 1.159 7.428 1.00 73.34 C ATOM 0 H ILE A 26 -4.476 -1.348 6.901 1.00 3.33 H new ATOM 0 HA ILE A 26 -3.458 0.433 4.796 1.00 74.24 H new ATOM 0 HB ILE A 26 -1.728 -1.187 6.697 1.00 0.50 H new ATOM 0 HG12 ILE A 26 -1.897 1.798 6.118 1.00 42.22 H new ATOM 0 HG13 ILE A 26 -2.466 1.007 7.574 1.00 42.22 H new ATOM 0 HG21 ILE A 26 0.177 -0.395 5.346 1.00 15.33 H new ATOM 0 HG22 ILE A 26 -0.924 -1.424 4.399 1.00 15.33 H new ATOM 0 HG23 ILE A 26 -0.955 0.343 4.188 1.00 15.33 H new ATOM 0 HD11 ILE A 26 -0.333 2.113 7.955 1.00 73.34 H new ATOM 0 HD12 ILE A 26 -0.164 0.351 8.134 1.00 73.34 H new ATOM 0 HD13 ILE A 26 0.414 1.154 6.655 1.00 73.34 H new ATOM 448 N THR A 27 -3.451 -1.602 3.328 1.00 40.24 N ATOM 449 CA THR A 27 -3.622 -2.736 2.469 1.00 51.45 C ATOM 450 C THR A 27 -2.393 -2.888 1.575 1.00 21.21 C ATOM 451 O THR A 27 -2.026 -1.963 0.843 1.00 75.21 O ATOM 452 CB THR A 27 -4.884 -2.567 1.599 1.00 31.32 C ATOM 453 OG1 THR A 27 -5.989 -2.215 2.438 1.00 22.14 O ATOM 454 CG2 THR A 27 -5.217 -3.865 0.878 1.00 61.31 C ATOM 0 H THR A 27 -3.308 -0.718 2.839 1.00 40.24 H new ATOM 0 HA THR A 27 -3.740 -3.629 3.082 1.00 51.45 H new ATOM 0 HB THR A 27 -4.696 -1.786 0.862 1.00 31.32 H new ATOM 0 HG1 THR A 27 -6.827 -2.353 1.950 1.00 22.14 H new ATOM 0 HG21 THR A 27 -6.111 -3.724 0.270 1.00 61.31 H new ATOM 0 HG22 THR A 27 -4.383 -4.149 0.237 1.00 61.31 H new ATOM 0 HG23 THR A 27 -5.397 -4.652 1.610 1.00 61.31 H new ATOM 462 N VAL A 28 -1.760 -4.029 1.648 1.00 43.14 N ATOM 463 CA VAL A 28 -0.571 -4.302 0.865 1.00 75.24 C ATOM 464 C VAL A 28 -0.950 -5.141 -0.366 1.00 12.14 C ATOM 465 O VAL A 28 -1.793 -6.054 -0.275 1.00 41.23 O ATOM 466 CB VAL A 28 0.459 -5.060 1.717 1.00 35.23 C ATOM 467 CG1 VAL A 28 1.748 -5.294 0.941 1.00 43.51 C ATOM 468 CG2 VAL A 28 0.736 -4.296 2.994 1.00 24.54 C ATOM 0 H VAL A 28 -2.050 -4.799 2.250 1.00 43.14 H new ATOM 0 HA VAL A 28 -0.132 -3.359 0.539 1.00 75.24 H new ATOM 0 HB VAL A 28 0.044 -6.035 1.972 1.00 35.23 H new ATOM 0 HG11 VAL A 28 2.458 -5.832 1.569 1.00 43.51 H new ATOM 0 HG12 VAL A 28 1.534 -5.882 0.049 1.00 43.51 H new ATOM 0 HG13 VAL A 28 2.176 -4.335 0.649 1.00 43.51 H new ATOM 0 HG21 VAL A 28 1.467 -4.840 3.592 1.00 24.54 H new ATOM 0 HG22 VAL A 28 1.129 -3.309 2.750 1.00 24.54 H new ATOM 0 HG23 VAL A 28 -0.189 -4.188 3.561 1.00 24.54 H new ATOM 478 N HIS A 29 -0.386 -4.814 -1.512 1.00 53.01 N ATOM 479 CA HIS A 29 -0.674 -5.537 -2.750 1.00 21.31 C ATOM 480 C HIS A 29 0.677 -5.850 -3.410 1.00 25.02 C ATOM 481 O HIS A 29 1.655 -5.132 -3.180 1.00 65.43 O ATOM 482 CB HIS A 29 -1.545 -4.668 -3.754 1.00 14.40 C ATOM 483 CG HIS A 29 -2.774 -3.970 -3.162 1.00 41.15 C ATOM 484 ND1 HIS A 29 -4.146 -4.140 -3.586 1.00 20.24 N ATOM 485 CD2 HIS A 29 -2.813 -3.038 -2.178 1.00 74.10 C ATOM 486 CE1 HIS A 29 -4.868 -3.301 -2.828 1.00 65.31 C ATOM 487 NE2 HIS A 29 -4.095 -2.655 -1.992 1.00 41.21 N ATOM 0 H HIS A 29 0.279 -4.048 -1.619 1.00 53.01 H new ATOM 0 HA HIS A 29 -1.242 -6.438 -2.518 1.00 21.31 H new ATOM 0 HB2 HIS A 29 -0.900 -3.908 -4.196 1.00 14.40 H new ATOM 0 HB3 HIS A 29 -1.878 -5.315 -4.566 1.00 14.40 H new ATOM 0 HD1 HIS A 29 -4.493 -4.768 -4.311 1.00 20.24 H new ATOM 0 HD2 HIS A 29 -1.959 -2.663 -1.633 1.00 74.10 H new ATOM 0 HE1 HIS A 29 -5.938 -3.176 -2.898 1.00 65.31 H new ATOM 495 N ASN A 30 0.738 -6.907 -4.178 1.00 21.51 N ATOM 496 CA ASN A 30 1.950 -7.257 -4.926 1.00 70.14 C ATOM 497 C ASN A 30 1.686 -7.023 -6.375 1.00 35.31 C ATOM 498 O ASN A 30 0.573 -7.287 -6.851 1.00 2.14 O ATOM 499 CB ASN A 30 2.376 -8.738 -4.760 1.00 74.01 C ATOM 500 CG ASN A 30 2.996 -9.137 -3.425 1.00 52.04 C ATOM 501 OD1 ASN A 30 2.835 -10.280 -2.991 1.00 5.42 O ATOM 502 ND2 ASN A 30 3.756 -8.265 -2.813 1.00 24.53 N ATOM 0 H ASN A 30 -0.038 -7.555 -4.312 1.00 21.51 H new ATOM 0 HA ASN A 30 2.756 -6.637 -4.534 1.00 70.14 H new ATOM 0 HB2 ASN A 30 1.499 -9.363 -4.926 1.00 74.01 H new ATOM 0 HB3 ASN A 30 3.090 -8.975 -5.549 1.00 74.01 H new ATOM 0 HD21 ASN A 30 4.236 -8.523 -1.951 1.00 24.53 H new ATOM 0 HD22 ASN A 30 3.868 -7.327 -3.198 1.00 24.53 H new ATOM 509 N THR A 31 2.677 -6.572 -7.088 1.00 40.52 N ATOM 510 CA THR A 31 2.525 -6.295 -8.481 1.00 2.20 C ATOM 511 C THR A 31 2.658 -7.553 -9.310 1.00 14.05 C ATOM 512 O THR A 31 3.507 -8.414 -9.033 1.00 13.20 O ATOM 513 CB THR A 31 3.531 -5.237 -8.952 1.00 75.04 C ATOM 514 OG1 THR A 31 4.825 -5.530 -8.391 1.00 44.25 O ATOM 515 CG2 THR A 31 3.088 -3.838 -8.561 1.00 10.50 C ATOM 0 H THR A 31 3.610 -6.387 -6.719 1.00 40.52 H new ATOM 0 HA THR A 31 1.520 -5.898 -8.623 1.00 2.20 H new ATOM 0 HB THR A 31 3.587 -5.269 -10.040 1.00 75.04 H new ATOM 0 HG1 THR A 31 4.870 -5.186 -7.474 1.00 44.25 H new ATOM 0 HG21 THR A 31 3.823 -3.113 -8.910 1.00 10.50 H new ATOM 0 HG22 THR A 31 2.121 -3.622 -9.016 1.00 10.50 H new ATOM 0 HG23 THR A 31 3.001 -3.774 -7.476 1.00 10.50 H new ATOM 523 N TYR A 32 1.817 -7.672 -10.317 1.00 13.41 N ATOM 524 CA TYR A 32 1.874 -8.806 -11.219 1.00 73.43 C ATOM 525 C TYR A 32 2.950 -8.560 -12.263 1.00 53.43 C ATOM 526 O TYR A 32 3.289 -9.444 -13.051 1.00 34.14 O ATOM 527 CB TYR A 32 0.532 -9.030 -11.928 1.00 4.42 C ATOM 528 CG TYR A 32 -0.658 -9.258 -11.017 1.00 24.51 C ATOM 529 CD1 TYR A 32 -0.905 -10.501 -10.442 1.00 31.21 C ATOM 530 CD2 TYR A 32 -1.549 -8.233 -10.759 1.00 63.24 C ATOM 531 CE1 TYR A 32 -2.014 -10.702 -9.634 1.00 61.12 C ATOM 532 CE2 TYR A 32 -2.644 -8.420 -9.957 1.00 43.53 C ATOM 533 CZ TYR A 32 -2.878 -9.651 -9.396 1.00 41.40 C ATOM 534 OH TYR A 32 -3.989 -9.832 -8.606 1.00 12.21 O ATOM 0 H TYR A 32 1.084 -6.996 -10.532 1.00 13.41 H new ATOM 0 HA TYR A 32 2.103 -9.695 -10.632 1.00 73.43 H new ATOM 0 HB2 TYR A 32 0.325 -8.165 -12.558 1.00 4.42 H new ATOM 0 HB3 TYR A 32 0.630 -9.890 -12.591 1.00 4.42 H new ATOM 0 HD1 TYR A 32 -0.225 -11.319 -10.627 1.00 31.21 H new ATOM 0 HD2 TYR A 32 -1.378 -7.262 -11.200 1.00 63.24 H new ATOM 0 HE1 TYR A 32 -2.200 -11.671 -9.195 1.00 61.12 H new ATOM 0 HE2 TYR A 32 -3.322 -7.601 -9.767 1.00 43.53 H new ATOM 0 HH TYR A 32 -3.795 -10.502 -7.917 1.00 12.21 H new ATOM 544 N ASN A 33 3.484 -7.356 -12.259 1.00 70.13 N ATOM 545 CA ASN A 33 4.498 -6.967 -13.204 1.00 72.32 C ATOM 546 C ASN A 33 5.643 -6.277 -12.502 1.00 21.50 C ATOM 547 O ASN A 33 5.530 -5.888 -11.344 1.00 0.54 O ATOM 548 CB ASN A 33 3.926 -6.055 -14.312 1.00 24.53 C ATOM 549 CG ASN A 33 3.378 -4.724 -13.775 1.00 11.54 C ATOM 550 OD1 ASN A 33 2.205 -4.631 -13.409 1.00 40.00 O ATOM 551 ND2 ASN A 33 4.207 -3.696 -13.752 1.00 1.22 N ATOM 0 H ASN A 33 3.224 -6.623 -11.599 1.00 70.13 H new ATOM 0 HA ASN A 33 4.868 -7.877 -13.677 1.00 72.32 H new ATOM 0 HB2 ASN A 33 4.707 -5.850 -15.045 1.00 24.53 H new ATOM 0 HB3 ASN A 33 3.129 -6.584 -14.835 1.00 24.53 H new ATOM 0 HD21 ASN A 33 3.883 -2.787 -13.423 1.00 1.22 H new ATOM 0 HD22 ASN A 33 5.172 -3.812 -14.063 1.00 1.22 H new ATOM 558 N ASP A 34 6.746 -6.161 -13.187 1.00 54.53 N ATOM 559 CA ASP A 34 7.886 -5.479 -12.656 1.00 52.32 C ATOM 560 C ASP A 34 7.981 -4.133 -13.316 1.00 44.43 C ATOM 561 O ASP A 34 7.961 -4.024 -14.548 1.00 72.34 O ATOM 562 CB ASP A 34 9.203 -6.276 -12.851 1.00 25.34 C ATOM 563 CG ASP A 34 9.714 -6.335 -14.280 1.00 22.00 C ATOM 564 OD1 ASP A 34 9.298 -7.225 -15.045 1.00 35.02 O ATOM 565 OD2 ASP A 34 10.555 -5.489 -14.656 1.00 23.33 O ATOM 0 H ASP A 34 6.877 -6.536 -14.126 1.00 54.53 H new ATOM 0 HA ASP A 34 7.754 -5.371 -11.580 1.00 52.32 H new ATOM 0 HB2 ASP A 34 9.975 -5.831 -12.223 1.00 25.34 H new ATOM 0 HB3 ASP A 34 9.050 -7.294 -12.494 1.00 25.34 H new ATOM 570 N ALA A 35 8.014 -3.128 -12.519 1.00 23.51 N ATOM 571 CA ALA A 35 8.131 -1.771 -12.961 1.00 14.51 C ATOM 572 C ALA A 35 8.464 -0.947 -11.764 1.00 14.04 C ATOM 573 O ALA A 35 8.072 -1.318 -10.658 1.00 2.52 O ATOM 574 CB ALA A 35 6.820 -1.285 -13.590 1.00 55.01 C ATOM 0 H ALA A 35 7.959 -3.222 -11.505 1.00 23.51 H new ATOM 0 HA ALA A 35 8.906 -1.686 -13.723 1.00 14.51 H new ATOM 0 HB1 ALA A 35 6.935 -0.252 -13.918 1.00 55.01 H new ATOM 0 HB2 ALA A 35 6.573 -1.912 -14.447 1.00 55.01 H new ATOM 0 HB3 ALA A 35 6.019 -1.345 -12.853 1.00 55.01 H new ATOM 580 N PRO A 36 9.229 0.131 -11.933 1.00 55.30 N ATOM 581 CA PRO A 36 9.542 1.030 -10.848 1.00 31.20 C ATOM 582 C PRO A 36 8.279 1.658 -10.315 1.00 34.50 C ATOM 583 O PRO A 36 7.325 1.881 -11.068 1.00 62.10 O ATOM 584 CB PRO A 36 10.460 2.094 -11.454 1.00 12.21 C ATOM 585 CG PRO A 36 10.352 1.934 -12.921 1.00 11.51 C ATOM 586 CD PRO A 36 9.846 0.546 -13.192 1.00 31.00 C ATOM 0 HA PRO A 36 10.020 0.516 -10.014 1.00 31.20 H new ATOM 0 HB2 PRO A 36 10.155 3.094 -11.147 1.00 12.21 H new ATOM 0 HB3 PRO A 36 11.489 1.958 -11.121 1.00 12.21 H new ATOM 0 HG2 PRO A 36 9.672 2.677 -13.338 1.00 11.51 H new ATOM 0 HG3 PRO A 36 11.322 2.087 -13.395 1.00 11.51 H new ATOM 0 HD2 PRO A 36 9.125 0.539 -14.009 1.00 31.00 H new ATOM 0 HD3 PRO A 36 10.657 -0.124 -13.477 1.00 31.00 H new ATOM 594 N ALA A 37 8.270 1.926 -9.043 1.00 43.52 N ATOM 595 CA ALA A 37 7.125 2.485 -8.343 1.00 2.23 C ATOM 596 C ALA A 37 6.652 3.758 -9.013 1.00 43.21 C ATOM 597 O ALA A 37 5.466 4.035 -9.079 1.00 65.23 O ATOM 598 CB ALA A 37 7.506 2.757 -6.909 1.00 42.21 C ATOM 0 H ALA A 37 9.074 1.762 -8.437 1.00 43.52 H new ATOM 0 HA ALA A 37 6.305 1.768 -8.373 1.00 2.23 H new ATOM 0 HB1 ALA A 37 6.651 3.177 -6.379 1.00 42.21 H new ATOM 0 HB2 ALA A 37 7.809 1.826 -6.430 1.00 42.21 H new ATOM 0 HB3 ALA A 37 8.334 3.466 -6.881 1.00 42.21 H new ATOM 604 N GLU A 38 7.602 4.498 -9.546 1.00 74.31 N ATOM 605 CA GLU A 38 7.347 5.736 -10.260 1.00 25.11 C ATOM 606 C GLU A 38 6.448 5.465 -11.462 1.00 60.41 C ATOM 607 O GLU A 38 5.511 6.221 -11.743 1.00 53.02 O ATOM 608 CB GLU A 38 8.671 6.310 -10.710 1.00 21.24 C ATOM 609 CG GLU A 38 8.599 7.649 -11.393 1.00 43.50 C ATOM 610 CD GLU A 38 9.960 8.099 -11.809 1.00 24.44 C ATOM 611 OE1 GLU A 38 10.724 8.569 -10.946 1.00 70.22 O ATOM 612 OE2 GLU A 38 10.303 7.960 -12.996 1.00 44.44 O ATOM 0 H GLU A 38 8.591 4.253 -9.495 1.00 74.31 H new ATOM 0 HA GLU A 38 6.841 6.449 -9.609 1.00 25.11 H new ATOM 0 HB2 GLU A 38 9.322 6.400 -9.841 1.00 21.24 H new ATOM 0 HB3 GLU A 38 9.143 5.600 -11.390 1.00 21.24 H new ATOM 0 HG2 GLU A 38 7.949 7.584 -12.265 1.00 43.50 H new ATOM 0 HG3 GLU A 38 8.157 8.384 -10.720 1.00 43.50 H new ATOM 619 N ASN A 39 6.720 4.372 -12.141 1.00 54.25 N ATOM 620 CA ASN A 39 5.930 3.960 -13.277 1.00 1.12 C ATOM 621 C ASN A 39 4.599 3.425 -12.842 1.00 62.54 C ATOM 622 O ASN A 39 3.582 3.704 -13.477 1.00 22.11 O ATOM 623 CB ASN A 39 6.664 2.948 -14.173 1.00 71.42 C ATOM 624 CG ASN A 39 7.731 3.587 -15.036 1.00 64.10 C ATOM 625 OD1 ASN A 39 7.645 4.758 -15.371 1.00 54.02 O ATOM 626 ND2 ASN A 39 8.700 2.818 -15.462 1.00 35.24 N ATOM 0 H ASN A 39 7.494 3.746 -11.920 1.00 54.25 H new ATOM 0 HA ASN A 39 5.763 4.852 -13.881 1.00 1.12 H new ATOM 0 HB2 ASN A 39 7.121 2.182 -13.547 1.00 71.42 H new ATOM 0 HB3 ASN A 39 5.939 2.446 -14.814 1.00 71.42 H new ATOM 0 HD21 ASN A 39 9.410 3.193 -16.091 1.00 35.24 H new ATOM 0 HD22 ASN A 39 8.746 1.843 -15.165 1.00 35.24 H new ATOM 633 N GLU A 40 4.586 2.703 -11.728 1.00 72.10 N ATOM 634 CA GLU A 40 3.345 2.128 -11.217 1.00 3.31 C ATOM 635 C GLU A 40 2.387 3.209 -10.761 1.00 43.15 C ATOM 636 O GLU A 40 1.168 3.109 -10.983 1.00 22.32 O ATOM 637 CB GLU A 40 3.598 1.111 -10.104 1.00 12.53 C ATOM 638 CG GLU A 40 4.181 -0.208 -10.590 1.00 2.41 C ATOM 639 CD GLU A 40 3.241 -0.909 -11.549 1.00 51.31 C ATOM 640 OE1 GLU A 40 2.076 -1.148 -11.177 1.00 53.44 O ATOM 641 OE2 GLU A 40 3.631 -1.185 -12.707 1.00 55.33 O ATOM 0 H GLU A 40 5.412 2.502 -11.165 1.00 72.10 H new ATOM 0 HA GLU A 40 2.879 1.590 -12.043 1.00 3.31 H new ATOM 0 HB2 GLU A 40 4.278 1.549 -9.373 1.00 12.53 H new ATOM 0 HB3 GLU A 40 2.659 0.913 -9.587 1.00 12.53 H new ATOM 0 HG2 GLU A 40 5.136 -0.026 -11.083 1.00 2.41 H new ATOM 0 HG3 GLU A 40 4.381 -0.855 -9.736 1.00 2.41 H new ATOM 648 N VAL A 41 2.933 4.237 -10.148 1.00 43.00 N ATOM 649 CA VAL A 41 2.152 5.377 -9.697 1.00 11.30 C ATOM 650 C VAL A 41 1.577 6.123 -10.873 1.00 34.15 C ATOM 651 O VAL A 41 0.358 6.297 -10.964 1.00 33.14 O ATOM 652 CB VAL A 41 2.984 6.341 -8.810 1.00 62.53 C ATOM 653 CG1 VAL A 41 2.202 7.604 -8.516 1.00 40.13 C ATOM 654 CG2 VAL A 41 3.344 5.660 -7.509 1.00 71.41 C ATOM 0 H VAL A 41 3.930 4.310 -9.947 1.00 43.00 H new ATOM 0 HA VAL A 41 1.338 4.986 -9.086 1.00 11.30 H new ATOM 0 HB VAL A 41 3.893 6.606 -9.349 1.00 62.53 H new ATOM 0 HG11 VAL A 41 2.802 8.267 -7.893 1.00 40.13 H new ATOM 0 HG12 VAL A 41 1.959 8.107 -9.452 1.00 40.13 H new ATOM 0 HG13 VAL A 41 1.281 7.348 -7.991 1.00 40.13 H new ATOM 0 HG21 VAL A 41 3.928 6.342 -6.891 1.00 71.41 H new ATOM 0 HG22 VAL A 41 2.433 5.381 -6.980 1.00 71.41 H new ATOM 0 HG23 VAL A 41 3.931 4.766 -7.717 1.00 71.41 H new ATOM 664 N SER A 42 2.452 6.537 -11.779 1.00 31.32 N ATOM 665 CA SER A 42 2.052 7.257 -12.968 1.00 42.50 C ATOM 666 C SER A 42 0.974 6.490 -13.744 1.00 13.31 C ATOM 667 O SER A 42 -0.028 7.058 -14.136 1.00 33.54 O ATOM 668 CB SER A 42 3.273 7.506 -13.844 1.00 44.22 C ATOM 669 OG SER A 42 4.275 8.204 -13.107 1.00 5.31 O ATOM 0 H SER A 42 3.457 6.381 -11.706 1.00 31.32 H new ATOM 0 HA SER A 42 1.622 8.213 -12.671 1.00 42.50 H new ATOM 0 HB2 SER A 42 3.671 6.557 -14.204 1.00 44.22 H new ATOM 0 HB3 SER A 42 2.987 8.085 -14.722 1.00 44.22 H new ATOM 0 HG SER A 42 4.799 7.565 -12.580 1.00 5.31 H new ATOM 675 N TYR A 43 1.173 5.190 -13.908 1.00 33.12 N ATOM 676 CA TYR A 43 0.236 4.351 -14.638 1.00 43.45 C ATOM 677 C TYR A 43 -1.142 4.351 -13.963 1.00 13.34 C ATOM 678 O TYR A 43 -2.175 4.489 -14.628 1.00 23.43 O ATOM 679 CB TYR A 43 0.781 2.917 -14.722 1.00 62.53 C ATOM 680 CG TYR A 43 -0.020 1.983 -15.599 1.00 45.05 C ATOM 681 CD1 TYR A 43 -1.094 1.252 -15.093 1.00 44.31 C ATOM 682 CD2 TYR A 43 0.306 1.827 -16.933 1.00 31.34 C ATOM 683 CE1 TYR A 43 -1.813 0.396 -15.904 1.00 63.22 C ATOM 684 CE2 TYR A 43 -0.403 0.978 -17.747 1.00 51.44 C ATOM 685 CZ TYR A 43 -1.460 0.263 -17.233 1.00 13.10 C ATOM 686 OH TYR A 43 -2.175 -0.591 -18.056 1.00 24.13 O ATOM 0 H TYR A 43 1.983 4.691 -13.541 1.00 33.12 H new ATOM 0 HA TYR A 43 0.121 4.755 -15.644 1.00 43.45 H new ATOM 0 HB2 TYR A 43 1.805 2.954 -15.095 1.00 62.53 H new ATOM 0 HB3 TYR A 43 0.823 2.500 -13.716 1.00 62.53 H new ATOM 0 HD1 TYR A 43 -1.367 1.356 -14.053 1.00 44.31 H new ATOM 0 HD2 TYR A 43 1.135 2.384 -17.344 1.00 31.34 H new ATOM 0 HE1 TYR A 43 -2.644 -0.165 -15.503 1.00 63.22 H new ATOM 0 HE2 TYR A 43 -0.132 0.872 -18.787 1.00 51.44 H new ATOM 0 HH TYR A 43 -1.797 -0.566 -18.960 1.00 24.13 H new ATOM 696 N MET A 44 -1.137 4.225 -12.650 1.00 54.14 N ATOM 697 CA MET A 44 -2.347 4.139 -11.864 1.00 71.43 C ATOM 698 C MET A 44 -3.088 5.480 -11.789 1.00 33.12 C ATOM 699 O MET A 44 -4.301 5.535 -11.925 1.00 71.20 O ATOM 700 CB MET A 44 -2.008 3.542 -10.481 1.00 4.14 C ATOM 701 CG MET A 44 -3.163 3.394 -9.499 1.00 53.35 C ATOM 702 SD MET A 44 -3.639 4.938 -8.672 1.00 63.21 S ATOM 703 CE MET A 44 -2.137 5.316 -7.743 1.00 31.33 C ATOM 0 H MET A 44 -0.282 4.179 -12.095 1.00 54.14 H new ATOM 0 HA MET A 44 -3.051 3.468 -12.356 1.00 71.43 H new ATOM 0 HB2 MET A 44 -1.563 2.559 -10.634 1.00 4.14 H new ATOM 0 HB3 MET A 44 -1.245 4.168 -10.018 1.00 4.14 H new ATOM 0 HG2 MET A 44 -4.028 2.998 -10.030 1.00 53.35 H new ATOM 0 HG3 MET A 44 -2.890 2.659 -8.742 1.00 53.35 H new ATOM 0 HE1 MET A 44 -2.202 6.328 -7.342 1.00 31.33 H new ATOM 0 HE2 MET A 44 -2.029 4.607 -6.922 1.00 31.33 H new ATOM 0 HE3 MET A 44 -1.273 5.242 -8.403 1.00 31.33 H new ATOM 713 N ILE A 45 -2.378 6.551 -11.616 1.00 13.10 N ATOM 714 CA ILE A 45 -3.035 7.842 -11.534 1.00 31.32 C ATOM 715 C ILE A 45 -3.447 8.350 -12.914 1.00 52.13 C ATOM 716 O ILE A 45 -4.391 9.118 -13.032 1.00 32.05 O ATOM 717 CB ILE A 45 -2.214 8.930 -10.796 1.00 73.52 C ATOM 718 CG1 ILE A 45 -0.896 9.247 -11.527 1.00 62.11 C ATOM 719 CG2 ILE A 45 -1.964 8.524 -9.346 1.00 64.22 C ATOM 720 CD1 ILE A 45 -0.067 10.342 -10.880 1.00 64.25 C ATOM 0 H ILE A 45 -1.362 6.571 -11.529 1.00 13.10 H new ATOM 0 HA ILE A 45 -3.924 7.661 -10.930 1.00 31.32 H new ATOM 0 HB ILE A 45 -2.803 9.847 -10.795 1.00 73.52 H new ATOM 0 HG12 ILE A 45 -0.297 8.338 -11.580 1.00 62.11 H new ATOM 0 HG13 ILE A 45 -1.124 9.539 -12.552 1.00 62.11 H new ATOM 0 HG21 ILE A 45 -1.386 9.301 -8.845 1.00 64.22 H new ATOM 0 HG22 ILE A 45 -2.918 8.395 -8.835 1.00 64.22 H new ATOM 0 HG23 ILE A 45 -1.409 7.586 -9.321 1.00 64.22 H new ATOM 0 HD11 ILE A 45 0.843 10.500 -11.459 1.00 64.25 H new ATOM 0 HD12 ILE A 45 -0.644 11.266 -10.851 1.00 64.25 H new ATOM 0 HD13 ILE A 45 0.196 10.047 -9.864 1.00 64.25 H new ATOM 732 N SER A 46 -2.767 7.884 -13.947 1.00 4.34 N ATOM 733 CA SER A 46 -3.064 8.320 -15.298 1.00 4.32 C ATOM 734 C SER A 46 -4.227 7.513 -15.881 1.00 74.14 C ATOM 735 O SER A 46 -4.874 7.949 -16.841 1.00 40.24 O ATOM 736 CB SER A 46 -1.814 8.215 -16.200 1.00 22.11 C ATOM 737 OG SER A 46 -2.023 8.804 -17.480 1.00 70.15 O ATOM 0 H SER A 46 -2.008 7.206 -13.876 1.00 4.34 H new ATOM 0 HA SER A 46 -3.361 9.368 -15.259 1.00 4.32 H new ATOM 0 HB2 SER A 46 -0.972 8.704 -15.710 1.00 22.11 H new ATOM 0 HB3 SER A 46 -1.545 7.166 -16.324 1.00 22.11 H new ATOM 0 HG SER A 46 -1.208 8.717 -18.017 1.00 70.15 H new ATOM 743 N ASN A 47 -4.520 6.343 -15.295 1.00 31.24 N ATOM 744 CA ASN A 47 -5.616 5.531 -15.796 1.00 44.33 C ATOM 745 C ASN A 47 -6.958 6.152 -15.348 1.00 63.14 C ATOM 746 O ASN A 47 -6.997 7.294 -14.873 1.00 14.12 O ATOM 747 CB ASN A 47 -5.455 4.019 -15.371 1.00 41.51 C ATOM 748 CG ASN A 47 -5.709 3.691 -13.897 1.00 53.45 C ATOM 749 OD1 ASN A 47 -6.555 4.276 -13.250 1.00 71.31 O ATOM 750 ND2 ASN A 47 -4.964 2.769 -13.360 1.00 24.33 N ATOM 0 H ASN A 47 -4.022 5.953 -14.494 1.00 31.24 H new ATOM 0 HA ASN A 47 -5.601 5.527 -16.886 1.00 44.33 H new ATOM 0 HB2 ASN A 47 -6.137 3.421 -15.976 1.00 41.51 H new ATOM 0 HB3 ASN A 47 -4.443 3.700 -15.622 1.00 41.51 H new ATOM 0 HD21 ASN A 47 -5.084 2.525 -12.377 1.00 24.33 H new ATOM 0 HD22 ASN A 47 -4.260 2.291 -13.922 1.00 24.33 H new ATOM 757 N ASN A 48 -8.010 5.427 -15.467 1.00 22.44 N ATOM 758 CA ASN A 48 -9.338 5.911 -15.154 1.00 73.22 C ATOM 759 C ASN A 48 -10.138 4.789 -14.563 1.00 3.22 C ATOM 760 O ASN A 48 -11.362 4.836 -14.493 1.00 71.12 O ATOM 761 CB ASN A 48 -10.034 6.487 -16.413 1.00 41.04 C ATOM 762 CG ASN A 48 -10.129 5.516 -17.588 1.00 63.02 C ATOM 763 OD1 ASN A 48 -10.200 4.291 -17.429 1.00 45.52 O ATOM 764 ND2 ASN A 48 -10.129 6.049 -18.768 1.00 34.54 N ATOM 0 H ASN A 48 -7.990 4.460 -15.790 1.00 22.44 H new ATOM 0 HA ASN A 48 -9.263 6.722 -14.430 1.00 73.22 H new ATOM 0 HB2 ASN A 48 -11.040 6.807 -16.141 1.00 41.04 H new ATOM 0 HB3 ASN A 48 -9.493 7.376 -16.736 1.00 41.04 H new ATOM 0 HD21 ASN A 48 -10.189 5.456 -19.596 1.00 34.54 H new ATOM 0 HD22 ASN A 48 -10.069 7.062 -18.870 1.00 34.54 H new ATOM 771 N ASN A 49 -9.428 3.791 -14.098 1.00 61.41 N ATOM 772 CA ASN A 49 -10.040 2.619 -13.541 1.00 1.30 C ATOM 773 C ASN A 49 -10.316 2.849 -12.092 1.00 62.01 C ATOM 774 O ASN A 49 -9.785 3.789 -11.498 1.00 20.54 O ATOM 775 CB ASN A 49 -9.151 1.382 -13.732 1.00 23.01 C ATOM 776 CG ASN A 49 -8.962 1.019 -15.190 1.00 32.20 C ATOM 777 OD1 ASN A 49 -8.046 1.503 -15.847 1.00 73.11 O ATOM 778 ND2 ASN A 49 -9.811 0.161 -15.704 1.00 61.33 N ATOM 0 H ASN A 49 -8.408 3.772 -14.097 1.00 61.41 H new ATOM 0 HA ASN A 49 -10.977 2.430 -14.064 1.00 1.30 H new ATOM 0 HB2 ASN A 49 -8.177 1.566 -13.278 1.00 23.01 H new ATOM 0 HB3 ASN A 49 -9.594 0.536 -13.205 1.00 23.01 H new ATOM 0 HD21 ASN A 49 -9.721 -0.124 -16.679 1.00 61.33 H new ATOM 0 HD22 ASN A 49 -10.561 -0.222 -15.128 1.00 61.33 H new ATOM 785 N GLU A 50 -11.136 2.009 -11.527 1.00 45.43 N ATOM 786 CA GLU A 50 -11.520 2.147 -10.153 1.00 34.32 C ATOM 787 C GLU A 50 -10.401 1.867 -9.180 1.00 70.22 C ATOM 788 O GLU A 50 -10.354 2.466 -8.163 1.00 42.13 O ATOM 789 CB GLU A 50 -12.743 1.298 -9.825 1.00 32.24 C ATOM 790 CG GLU A 50 -14.002 1.759 -10.521 1.00 54.23 C ATOM 791 CD GLU A 50 -15.195 0.910 -10.194 1.00 64.40 C ATOM 792 OE1 GLU A 50 -15.739 1.029 -9.077 1.00 4.31 O ATOM 793 OE2 GLU A 50 -15.625 0.121 -11.055 1.00 11.23 O ATOM 0 H GLU A 50 -11.556 1.212 -12.005 1.00 45.43 H new ATOM 0 HA GLU A 50 -11.780 3.198 -10.029 1.00 34.32 H new ATOM 0 HB2 GLU A 50 -12.542 0.263 -10.103 1.00 32.24 H new ATOM 0 HB3 GLU A 50 -12.907 1.313 -8.748 1.00 32.24 H new ATOM 0 HG2 GLU A 50 -14.209 2.791 -10.240 1.00 54.23 H new ATOM 0 HG3 GLU A 50 -13.840 1.749 -11.599 1.00 54.23 H new ATOM 800 N VAL A 51 -9.469 1.011 -9.516 1.00 25.15 N ATOM 801 CA VAL A 51 -8.484 0.627 -8.515 1.00 31.24 C ATOM 802 C VAL A 51 -7.362 1.649 -8.417 1.00 71.53 C ATOM 803 O VAL A 51 -6.788 2.078 -9.421 1.00 61.13 O ATOM 804 CB VAL A 51 -7.907 -0.789 -8.790 1.00 23.44 C ATOM 805 CG1 VAL A 51 -6.856 -1.178 -7.753 1.00 54.14 C ATOM 806 CG2 VAL A 51 -9.029 -1.809 -8.798 1.00 45.00 C ATOM 0 H VAL A 51 -9.365 0.577 -10.433 1.00 25.15 H new ATOM 0 HA VAL A 51 -9.002 0.598 -7.557 1.00 31.24 H new ATOM 0 HB VAL A 51 -7.422 -0.771 -9.766 1.00 23.44 H new ATOM 0 HG11 VAL A 51 -6.475 -2.174 -7.977 1.00 54.14 H new ATOM 0 HG12 VAL A 51 -6.035 -0.461 -7.780 1.00 54.14 H new ATOM 0 HG13 VAL A 51 -7.306 -1.177 -6.760 1.00 54.14 H new ATOM 0 HG21 VAL A 51 -8.618 -2.800 -8.991 1.00 45.00 H new ATOM 0 HG22 VAL A 51 -9.530 -1.806 -7.830 1.00 45.00 H new ATOM 0 HG23 VAL A 51 -9.746 -1.555 -9.578 1.00 45.00 H new ATOM 816 N SER A 52 -7.066 2.022 -7.200 1.00 33.31 N ATOM 817 CA SER A 52 -6.047 2.984 -6.892 1.00 50.14 C ATOM 818 C SER A 52 -5.223 2.494 -5.691 1.00 71.44 C ATOM 819 O SER A 52 -5.532 1.462 -5.094 1.00 4.32 O ATOM 820 CB SER A 52 -6.717 4.314 -6.544 1.00 54.02 C ATOM 821 OG SER A 52 -7.593 4.721 -7.577 1.00 42.51 O ATOM 0 H SER A 52 -7.541 1.654 -6.376 1.00 33.31 H new ATOM 0 HA SER A 52 -5.386 3.113 -7.749 1.00 50.14 H new ATOM 0 HB2 SER A 52 -7.270 4.214 -5.610 1.00 54.02 H new ATOM 0 HB3 SER A 52 -5.957 5.078 -6.384 1.00 54.02 H new ATOM 0 HG SER A 52 -8.520 4.645 -7.269 1.00 42.51 H new ATOM 827 N PHE A 53 -4.177 3.218 -5.362 1.00 14.33 N ATOM 828 CA PHE A 53 -3.357 2.933 -4.211 1.00 14.03 C ATOM 829 C PHE A 53 -2.689 4.219 -3.800 1.00 51.23 C ATOM 830 O PHE A 53 -2.688 5.162 -4.567 1.00 41.33 O ATOM 831 CB PHE A 53 -2.300 1.840 -4.508 1.00 63.24 C ATOM 832 CG PHE A 53 -1.262 2.211 -5.537 1.00 44.22 C ATOM 833 CD1 PHE A 53 -0.188 2.999 -5.182 1.00 24.11 C ATOM 834 CD2 PHE A 53 -1.353 1.766 -6.846 1.00 24.31 C ATOM 835 CE1 PHE A 53 0.765 3.341 -6.084 1.00 73.15 C ATOM 836 CE2 PHE A 53 -0.385 2.111 -7.767 1.00 54.30 C ATOM 837 CZ PHE A 53 0.675 2.900 -7.384 1.00 14.32 C ATOM 0 H PHE A 53 -3.870 4.032 -5.895 1.00 14.33 H new ATOM 0 HA PHE A 53 -3.982 2.545 -3.406 1.00 14.03 H new ATOM 0 HB2 PHE A 53 -1.791 1.587 -3.578 1.00 63.24 H new ATOM 0 HB3 PHE A 53 -2.816 0.941 -4.844 1.00 63.24 H new ATOM 0 HD1 PHE A 53 -0.104 3.351 -4.165 1.00 24.11 H new ATOM 0 HD2 PHE A 53 -2.185 1.147 -7.147 1.00 24.31 H new ATOM 0 HE1 PHE A 53 1.596 3.961 -5.781 1.00 73.15 H new ATOM 0 HE2 PHE A 53 -0.459 1.762 -8.786 1.00 54.30 H new ATOM 0 HZ PHE A 53 1.434 3.172 -8.102 1.00 14.32 H new ATOM 847 N HIS A 54 -2.100 4.259 -2.644 1.00 12.14 N ATOM 848 CA HIS A 54 -1.461 5.474 -2.187 1.00 3.11 C ATOM 849 C HIS A 54 -0.019 5.523 -2.553 1.00 53.44 C ATOM 850 O HIS A 54 0.416 6.418 -3.281 1.00 5.13 O ATOM 851 CB HIS A 54 -1.613 5.671 -0.679 1.00 43.32 C ATOM 852 CG HIS A 54 -3.002 5.938 -0.221 1.00 64.22 C ATOM 853 ND1 HIS A 54 -3.872 4.920 0.063 1.00 11.22 N ATOM 854 CD2 HIS A 54 -3.612 7.124 0.003 1.00 62.22 C ATOM 855 CE1 HIS A 54 -4.991 5.522 0.456 1.00 1.40 C ATOM 856 NE2 HIS A 54 -4.872 6.843 0.432 1.00 33.11 N ATOM 0 H HIS A 54 -2.044 3.473 -1.996 1.00 12.14 H new ATOM 0 HA HIS A 54 -1.975 6.289 -2.698 1.00 3.11 H new ATOM 0 HB2 HIS A 54 -1.243 4.780 -0.171 1.00 43.32 H new ATOM 0 HB3 HIS A 54 -0.978 6.501 -0.370 1.00 43.32 H new ATOM 0 HD2 HIS A 54 -3.182 8.105 -0.133 1.00 62.22 H new ATOM 0 HE1 HIS A 54 -5.887 4.999 0.758 1.00 1.40 H new ATOM 0 HE2 HIS A 54 -5.590 7.521 0.687 1.00 33.11 H new ATOM 864 N ILE A 55 0.715 4.556 -2.098 1.00 30.31 N ATOM 865 CA ILE A 55 2.142 4.595 -2.211 1.00 10.35 C ATOM 866 C ILE A 55 2.640 3.331 -2.852 1.00 42.43 C ATOM 867 O ILE A 55 2.190 2.232 -2.518 1.00 13.11 O ATOM 868 CB ILE A 55 2.804 4.718 -0.806 1.00 52.30 C ATOM 869 CG1 ILE A 55 2.188 5.887 -0.010 1.00 14.13 C ATOM 870 CG2 ILE A 55 4.295 4.986 -0.996 1.00 54.23 C ATOM 871 CD1 ILE A 55 2.460 5.864 1.475 1.00 30.21 C ATOM 0 H ILE A 55 0.347 3.722 -1.641 1.00 30.31 H new ATOM 0 HA ILE A 55 2.405 5.461 -2.818 1.00 10.35 H new ATOM 0 HB ILE A 55 2.639 3.793 -0.254 1.00 52.30 H new ATOM 0 HG12 ILE A 55 2.567 6.824 -0.419 1.00 14.13 H new ATOM 0 HG13 ILE A 55 1.109 5.884 -0.166 1.00 14.13 H new ATOM 0 HG21 ILE A 55 4.776 5.075 -0.022 1.00 54.23 H new ATOM 0 HG22 ILE A 55 4.745 4.161 -1.549 1.00 54.23 H new ATOM 0 HG23 ILE A 55 4.430 5.913 -1.553 1.00 54.23 H new ATOM 0 HD11 ILE A 55 1.986 6.726 1.945 1.00 30.21 H new ATOM 0 HD12 ILE A 55 2.055 4.948 1.905 1.00 30.21 H new ATOM 0 HD13 ILE A 55 3.535 5.902 1.649 1.00 30.21 H new ATOM 883 N ALA A 56 3.535 3.478 -3.763 1.00 11.03 N ATOM 884 CA ALA A 56 4.168 2.350 -4.376 1.00 21.43 C ATOM 885 C ALA A 56 5.627 2.386 -4.049 1.00 11.21 C ATOM 886 O ALA A 56 6.260 3.445 -4.122 1.00 43.52 O ATOM 887 CB ALA A 56 3.971 2.354 -5.878 1.00 72.10 C ATOM 0 H ALA A 56 3.854 4.383 -4.110 1.00 11.03 H new ATOM 0 HA ALA A 56 3.716 1.437 -3.990 1.00 21.43 H new ATOM 0 HB1 ALA A 56 4.464 1.484 -6.312 1.00 72.10 H new ATOM 0 HB2 ALA A 56 2.906 2.318 -6.105 1.00 72.10 H new ATOM 0 HB3 ALA A 56 4.401 3.263 -6.299 1.00 72.10 H new ATOM 893 N VAL A 57 6.159 1.277 -3.639 1.00 54.22 N ATOM 894 CA VAL A 57 7.556 1.182 -3.384 1.00 74.44 C ATOM 895 C VAL A 57 8.184 0.124 -4.290 1.00 72.51 C ATOM 896 O VAL A 57 7.629 -0.980 -4.466 1.00 42.13 O ATOM 897 CB VAL A 57 7.864 0.864 -1.894 1.00 52.33 C ATOM 898 CG1 VAL A 57 7.288 1.914 -0.969 1.00 25.54 C ATOM 899 CG2 VAL A 57 7.376 -0.497 -1.494 1.00 23.21 C ATOM 0 H VAL A 57 5.636 0.417 -3.473 1.00 54.22 H new ATOM 0 HA VAL A 57 7.993 2.156 -3.603 1.00 74.44 H new ATOM 0 HB VAL A 57 8.950 0.875 -1.797 1.00 52.33 H new ATOM 0 HG11 VAL A 57 7.524 1.658 0.064 1.00 25.54 H new ATOM 0 HG12 VAL A 57 7.719 2.886 -1.209 1.00 25.54 H new ATOM 0 HG13 VAL A 57 6.206 1.956 -1.095 1.00 25.54 H new ATOM 0 HG21 VAL A 57 7.613 -0.675 -0.445 1.00 23.21 H new ATOM 0 HG22 VAL A 57 6.297 -0.553 -1.636 1.00 23.21 H new ATOM 0 HG23 VAL A 57 7.863 -1.253 -2.110 1.00 23.21 H new ATOM 909 N ASP A 58 9.286 0.462 -4.891 1.00 21.33 N ATOM 910 CA ASP A 58 10.016 -0.473 -5.699 1.00 22.03 C ATOM 911 C ASP A 58 11.327 -0.794 -5.036 1.00 34.04 C ATOM 912 O ASP A 58 11.595 -0.339 -3.907 1.00 11.43 O ATOM 913 CB ASP A 58 10.217 -0.013 -7.166 1.00 1.40 C ATOM 914 CG ASP A 58 11.039 1.247 -7.353 1.00 34.24 C ATOM 915 OD1 ASP A 58 12.217 1.212 -7.129 1.00 21.44 O ATOM 916 OD2 ASP A 58 10.485 2.275 -7.746 1.00 55.11 O ATOM 0 H ASP A 58 9.705 1.391 -4.836 1.00 21.33 H new ATOM 0 HA ASP A 58 9.410 -1.376 -5.770 1.00 22.03 H new ATOM 0 HB2 ASP A 58 10.695 -0.822 -7.719 1.00 1.40 H new ATOM 0 HB3 ASP A 58 9.237 0.145 -7.616 1.00 1.40 H new ATOM 921 N ASP A 59 12.134 -1.593 -5.702 1.00 53.53 N ATOM 922 CA ASP A 59 13.415 -2.039 -5.151 1.00 23.52 C ATOM 923 C ASP A 59 14.405 -0.875 -5.026 1.00 5.01 C ATOM 924 O ASP A 59 15.454 -1.006 -4.375 1.00 73.32 O ATOM 925 CB ASP A 59 14.041 -3.184 -6.000 1.00 43.25 C ATOM 926 CG ASP A 59 14.705 -2.747 -7.299 1.00 75.22 C ATOM 927 OD1 ASP A 59 14.009 -2.533 -8.291 1.00 12.34 O ATOM 928 OD2 ASP A 59 15.967 -2.677 -7.342 1.00 42.31 O ATOM 0 H ASP A 59 11.931 -1.954 -6.634 1.00 53.53 H new ATOM 0 HA ASP A 59 13.210 -2.429 -4.154 1.00 23.52 H new ATOM 0 HB2 ASP A 59 14.781 -3.702 -5.390 1.00 43.25 H new ATOM 0 HB3 ASP A 59 13.260 -3.907 -6.236 1.00 43.25 H new ATOM 933 N LYS A 60 14.084 0.253 -5.630 1.00 55.41 N ATOM 934 CA LYS A 60 14.960 1.407 -5.596 1.00 51.30 C ATOM 935 C LYS A 60 14.331 2.515 -4.767 1.00 71.23 C ATOM 936 O LYS A 60 14.852 2.914 -3.726 1.00 2.43 O ATOM 937 CB LYS A 60 15.152 2.007 -6.996 1.00 4.12 C ATOM 938 CG LYS A 60 15.398 1.045 -8.126 1.00 4.34 C ATOM 939 CD LYS A 60 15.583 1.827 -9.414 1.00 75.40 C ATOM 940 CE LYS A 60 15.727 0.925 -10.605 1.00 3.41 C ATOM 941 NZ LYS A 60 15.916 1.693 -11.850 1.00 23.13 N ATOM 0 H LYS A 60 13.219 0.394 -6.152 1.00 55.41 H new ATOM 0 HA LYS A 60 15.908 1.064 -5.182 1.00 51.30 H new ATOM 0 HB2 LYS A 60 14.265 2.593 -7.237 1.00 4.12 H new ATOM 0 HB3 LYS A 60 15.991 2.701 -6.954 1.00 4.12 H new ATOM 0 HG2 LYS A 60 16.283 0.443 -7.921 1.00 4.34 H new ATOM 0 HG3 LYS A 60 14.559 0.356 -8.222 1.00 4.34 H new ATOM 0 HD2 LYS A 60 14.730 2.489 -9.562 1.00 75.40 H new ATOM 0 HD3 LYS A 60 16.466 2.460 -9.330 1.00 75.40 H new ATOM 0 HE2 LYS A 60 16.576 0.258 -10.456 1.00 3.41 H new ATOM 0 HE3 LYS A 60 14.841 0.297 -10.696 1.00 3.41 H new ATOM 0 HZ1 LYS A 60 16.012 1.037 -12.651 1.00 23.13 H new ATOM 0 HZ2 LYS A 60 15.094 2.311 -12.005 1.00 23.13 H new ATOM 0 HZ3 LYS A 60 16.776 2.273 -11.773 1.00 23.13 H new ATOM 955 N LYS A 61 13.195 2.985 -5.234 1.00 54.43 N ATOM 956 CA LYS A 61 12.580 4.181 -4.730 1.00 44.11 C ATOM 957 C LYS A 61 11.104 3.991 -4.388 1.00 60.41 C ATOM 958 O LYS A 61 10.471 3.016 -4.775 1.00 14.10 O ATOM 959 CB LYS A 61 12.777 5.312 -5.757 1.00 23.22 C ATOM 960 CG LYS A 61 12.339 4.925 -7.165 1.00 22.14 C ATOM 961 CD LYS A 61 12.608 6.014 -8.188 1.00 63.21 C ATOM 962 CE LYS A 61 12.238 5.530 -9.581 1.00 52.20 C ATOM 963 NZ LYS A 61 12.492 6.547 -10.626 1.00 5.12 N ATOM 0 H LYS A 61 12.670 2.537 -5.985 1.00 54.43 H new ATOM 0 HA LYS A 61 13.066 4.445 -3.791 1.00 44.11 H new ATOM 0 HB2 LYS A 61 12.214 6.188 -5.436 1.00 23.22 H new ATOM 0 HB3 LYS A 61 13.829 5.598 -5.776 1.00 23.22 H new ATOM 0 HG2 LYS A 61 12.859 4.015 -7.465 1.00 22.14 H new ATOM 0 HG3 LYS A 61 11.274 4.695 -7.158 1.00 22.14 H new ATOM 0 HD2 LYS A 61 12.032 6.906 -7.940 1.00 63.21 H new ATOM 0 HD3 LYS A 61 13.660 6.296 -8.161 1.00 63.21 H new ATOM 0 HE2 LYS A 61 12.807 4.629 -9.811 1.00 52.20 H new ATOM 0 HE3 LYS A 61 11.184 5.254 -9.597 1.00 52.20 H new ATOM 0 HZ1 LYS A 61 12.222 6.165 -11.555 1.00 5.12 H new ATOM 0 HZ2 LYS A 61 11.930 7.399 -10.425 1.00 5.12 H new ATOM 0 HZ3 LYS A 61 13.502 6.793 -10.633 1.00 5.12 H new ATOM 977 N ALA A 62 10.594 4.912 -3.619 1.00 1.55 N ATOM 978 CA ALA A 62 9.209 4.915 -3.207 1.00 31.21 C ATOM 979 C ALA A 62 8.539 6.153 -3.733 1.00 14.14 C ATOM 980 O ALA A 62 9.042 7.260 -3.549 1.00 5.02 O ATOM 981 CB ALA A 62 9.109 4.882 -1.692 1.00 0.25 C ATOM 0 H ALA A 62 11.133 5.696 -3.252 1.00 1.55 H new ATOM 0 HA ALA A 62 8.715 4.030 -3.608 1.00 31.21 H new ATOM 0 HB1 ALA A 62 8.060 4.885 -1.396 1.00 0.25 H new ATOM 0 HB2 ALA A 62 9.590 3.979 -1.315 1.00 0.25 H new ATOM 0 HB3 ALA A 62 9.605 5.758 -1.275 1.00 0.25 H new ATOM 987 N ILE A 63 7.424 5.988 -4.387 1.00 4.21 N ATOM 988 CA ILE A 63 6.700 7.106 -4.937 1.00 71.13 C ATOM 989 C ILE A 63 5.267 7.036 -4.480 1.00 74.31 C ATOM 990 O ILE A 63 4.651 5.970 -4.497 1.00 65.02 O ATOM 991 CB ILE A 63 6.729 7.195 -6.522 1.00 31.31 C ATOM 992 CG1 ILE A 63 8.153 7.323 -7.102 1.00 71.50 C ATOM 993 CG2 ILE A 63 5.880 8.351 -7.023 1.00 31.45 C ATOM 994 CD1 ILE A 63 8.968 6.058 -7.076 1.00 23.41 C ATOM 0 H ILE A 63 6.990 5.080 -4.555 1.00 4.21 H new ATOM 0 HA ILE A 63 7.203 8.001 -4.571 1.00 71.13 H new ATOM 0 HB ILE A 63 6.314 6.250 -6.873 1.00 31.31 H new ATOM 0 HG12 ILE A 63 8.079 7.668 -8.133 1.00 71.50 H new ATOM 0 HG13 ILE A 63 8.688 8.093 -6.546 1.00 71.50 H new ATOM 0 HG21 ILE A 63 5.920 8.386 -8.112 1.00 31.45 H new ATOM 0 HG22 ILE A 63 4.848 8.210 -6.702 1.00 31.45 H new ATOM 0 HG23 ILE A 63 6.263 9.287 -6.615 1.00 31.45 H new ATOM 0 HD11 ILE A 63 9.952 6.250 -7.504 1.00 23.41 H new ATOM 0 HD12 ILE A 63 9.081 5.719 -6.046 1.00 23.41 H new ATOM 0 HD13 ILE A 63 8.463 5.288 -7.659 1.00 23.41 H new ATOM 1006 N GLN A 64 4.750 8.133 -4.047 1.00 1.50 N ATOM 1007 CA GLN A 64 3.369 8.183 -3.637 1.00 45.02 C ATOM 1008 C GLN A 64 2.549 8.910 -4.692 1.00 45.12 C ATOM 1009 O GLN A 64 3.016 9.895 -5.276 1.00 15.21 O ATOM 1010 CB GLN A 64 3.226 8.889 -2.316 1.00 34.22 C ATOM 1011 CG GLN A 64 1.846 8.776 -1.737 1.00 4.34 C ATOM 1012 CD GLN A 64 1.672 9.568 -0.474 1.00 75.54 C ATOM 1013 OE1 GLN A 64 2.617 9.792 0.282 1.00 24.02 O ATOM 1014 NE2 GLN A 64 0.473 9.969 -0.221 1.00 73.14 N ATOM 0 H GLN A 64 5.255 9.015 -3.963 1.00 1.50 H new ATOM 0 HA GLN A 64 3.006 7.161 -3.525 1.00 45.02 H new ATOM 0 HB2 GLN A 64 3.945 8.475 -1.609 1.00 34.22 H new ATOM 0 HB3 GLN A 64 3.475 9.942 -2.444 1.00 34.22 H new ATOM 0 HG2 GLN A 64 1.120 9.116 -2.475 1.00 4.34 H new ATOM 0 HG3 GLN A 64 1.628 7.727 -1.534 1.00 4.34 H new ATOM 0 HE21 GLN A 64 -0.282 9.762 -0.874 1.00 73.14 H new ATOM 0 HE22 GLN A 64 0.280 10.493 0.633 1.00 73.14 H new ATOM 1023 N GLY A 65 1.337 8.443 -4.915 1.00 13.41 N ATOM 1024 CA GLY A 65 0.491 9.043 -5.937 1.00 71.03 C ATOM 1025 C GLY A 65 -0.872 9.470 -5.439 1.00 63.01 C ATOM 1026 O GLY A 65 -1.456 10.408 -5.953 1.00 13.11 O ATOM 0 H GLY A 65 0.917 7.661 -4.412 1.00 13.41 H new ATOM 0 HA2 GLY A 65 1.002 9.911 -6.353 1.00 71.03 H new ATOM 0 HA3 GLY A 65 0.361 8.330 -6.751 1.00 71.03 H new ATOM 1030 N ILE A 66 -1.399 8.796 -4.468 1.00 74.30 N ATOM 1031 CA ILE A 66 -2.669 9.215 -3.911 1.00 64.31 C ATOM 1032 C ILE A 66 -2.442 9.734 -2.508 1.00 54.20 C ATOM 1033 O ILE A 66 -1.720 9.112 -1.725 1.00 25.11 O ATOM 1034 CB ILE A 66 -3.748 8.084 -3.953 1.00 11.02 C ATOM 1035 CG1 ILE A 66 -4.070 7.700 -5.413 1.00 21.33 C ATOM 1036 CG2 ILE A 66 -5.020 8.469 -3.200 1.00 63.50 C ATOM 1037 CD1 ILE A 66 -4.696 8.794 -6.239 1.00 75.32 C ATOM 0 H ILE A 66 -0.988 7.965 -4.042 1.00 74.30 H new ATOM 0 HA ILE A 66 -3.072 10.017 -4.529 1.00 64.31 H new ATOM 0 HB ILE A 66 -3.328 7.216 -3.444 1.00 11.02 H new ATOM 0 HG12 ILE A 66 -3.149 7.381 -5.900 1.00 21.33 H new ATOM 0 HG13 ILE A 66 -4.741 6.841 -5.407 1.00 21.33 H new ATOM 0 HG21 ILE A 66 -5.739 7.652 -3.258 1.00 63.50 H new ATOM 0 HG22 ILE A 66 -4.779 8.667 -2.156 1.00 63.50 H new ATOM 0 HG23 ILE A 66 -5.452 9.364 -3.648 1.00 63.50 H new ATOM 0 HD11 ILE A 66 -4.884 8.426 -7.248 1.00 75.32 H new ATOM 0 HD12 ILE A 66 -5.638 9.100 -5.783 1.00 75.32 H new ATOM 0 HD13 ILE A 66 -4.020 9.648 -6.284 1.00 75.32 H new ATOM 1049 N PRO A 67 -2.978 10.930 -2.196 1.00 1.40 N ATOM 1050 CA PRO A 67 -2.840 11.539 -0.875 1.00 11.25 C ATOM 1051 C PRO A 67 -3.443 10.674 0.229 1.00 2.33 C ATOM 1052 O PRO A 67 -4.589 10.243 0.139 1.00 42.44 O ATOM 1053 CB PRO A 67 -3.609 12.862 -1.004 1.00 3.21 C ATOM 1054 CG PRO A 67 -4.490 12.682 -2.182 1.00 64.43 C ATOM 1055 CD PRO A 67 -3.748 11.791 -3.114 1.00 23.44 C ATOM 0 HA PRO A 67 -1.794 11.668 -0.595 1.00 11.25 H new ATOM 0 HB2 PRO A 67 -4.190 13.070 -0.105 1.00 3.21 H new ATOM 0 HB3 PRO A 67 -2.928 13.702 -1.145 1.00 3.21 H new ATOM 0 HG2 PRO A 67 -5.443 12.238 -1.893 1.00 64.43 H new ATOM 0 HG3 PRO A 67 -4.714 13.640 -2.652 1.00 64.43 H new ATOM 0 HD2 PRO A 67 -4.423 11.211 -3.743 1.00 23.44 H new ATOM 0 HD3 PRO A 67 -3.097 12.355 -3.782 1.00 23.44 H new ATOM 1063 N LEU A 68 -2.663 10.466 1.272 1.00 73.54 N ATOM 1064 CA LEU A 68 -3.034 9.636 2.426 1.00 12.22 C ATOM 1065 C LEU A 68 -4.241 10.193 3.174 1.00 65.31 C ATOM 1066 O LEU A 68 -4.880 9.498 3.930 1.00 61.25 O ATOM 1067 CB LEU A 68 -1.842 9.550 3.369 1.00 72.20 C ATOM 1068 CG LEU A 68 -0.614 8.806 2.851 1.00 41.43 C ATOM 1069 CD1 LEU A 68 0.578 9.085 3.746 1.00 22.12 C ATOM 1070 CD2 LEU A 68 -0.888 7.306 2.830 1.00 71.55 C ATOM 0 H LEU A 68 -1.731 10.873 1.353 1.00 73.54 H new ATOM 0 HA LEU A 68 -3.310 8.648 2.059 1.00 12.22 H new ATOM 0 HB2 LEU A 68 -1.541 10.564 3.631 1.00 72.20 H new ATOM 0 HB3 LEU A 68 -2.170 9.067 4.290 1.00 72.20 H new ATOM 0 HG LEU A 68 -0.395 9.151 1.840 1.00 41.43 H new ATOM 0 HD11 LEU A 68 1.449 8.550 3.369 1.00 22.12 H new ATOM 0 HD12 LEU A 68 0.785 10.155 3.754 1.00 22.12 H new ATOM 0 HD13 LEU A 68 0.358 8.751 4.760 1.00 22.12 H new ATOM 0 HD21 LEU A 68 -0.008 6.781 2.459 1.00 71.55 H new ATOM 0 HD22 LEU A 68 -1.117 6.964 3.839 1.00 71.55 H new ATOM 0 HD23 LEU A 68 -1.736 7.100 2.176 1.00 71.55 H new ATOM 1082 N GLU A 69 -4.535 11.451 2.944 1.00 74.53 N ATOM 1083 CA GLU A 69 -5.646 12.112 3.601 1.00 73.10 C ATOM 1084 C GLU A 69 -6.928 11.993 2.767 1.00 31.43 C ATOM 1085 O GLU A 69 -7.935 12.664 3.029 1.00 5.10 O ATOM 1086 CB GLU A 69 -5.287 13.552 3.848 1.00 31.22 C ATOM 1087 CG GLU A 69 -4.075 13.722 4.745 1.00 12.51 C ATOM 1088 CD GLU A 69 -3.647 15.151 4.850 1.00 60.01 C ATOM 1089 OE1 GLU A 69 -4.183 15.880 5.698 1.00 1.42 O ATOM 1090 OE2 GLU A 69 -2.769 15.575 4.065 1.00 0.14 O ATOM 0 H GLU A 69 -4.015 12.046 2.299 1.00 74.53 H new ATOM 0 HA GLU A 69 -5.840 11.625 4.557 1.00 73.10 H new ATOM 0 HB2 GLU A 69 -5.095 14.041 2.893 1.00 31.22 H new ATOM 0 HB3 GLU A 69 -6.139 14.060 4.300 1.00 31.22 H new ATOM 0 HG2 GLU A 69 -4.304 13.339 5.739 1.00 12.51 H new ATOM 0 HG3 GLU A 69 -3.250 13.125 4.356 1.00 12.51 H new ATOM 1097 N ARG A 70 -6.862 11.170 1.760 1.00 32.22 N ATOM 1098 CA ARG A 70 -7.983 10.806 0.931 1.00 23.41 C ATOM 1099 C ARG A 70 -8.042 9.307 0.792 1.00 61.14 C ATOM 1100 O ARG A 70 -7.095 8.605 1.170 1.00 5.22 O ATOM 1101 CB ARG A 70 -7.998 11.452 -0.458 1.00 73.34 C ATOM 1102 CG ARG A 70 -8.652 12.831 -0.576 1.00 2.22 C ATOM 1103 CD ARG A 70 -7.674 14.002 -0.658 1.00 11.13 C ATOM 1104 NE ARG A 70 -7.147 14.462 0.624 1.00 54.30 N ATOM 1105 CZ ARG A 70 -6.273 15.487 0.748 1.00 32.23 C ATOM 1106 NH1 ARG A 70 -5.697 16.026 -0.339 1.00 71.42 N ATOM 1107 NH2 ARG A 70 -5.992 15.975 1.951 1.00 34.12 N ATOM 0 H ARG A 70 -5.993 10.715 1.480 1.00 32.22 H new ATOM 0 HA ARG A 70 -8.864 11.193 1.443 1.00 23.41 H new ATOM 0 HB2 ARG A 70 -6.968 11.535 -0.804 1.00 73.34 H new ATOM 0 HB3 ARG A 70 -8.510 10.775 -1.141 1.00 73.34 H new ATOM 0 HG2 ARG A 70 -9.285 12.842 -1.464 1.00 2.22 H new ATOM 0 HG3 ARG A 70 -9.305 12.982 0.283 1.00 2.22 H new ATOM 0 HD2 ARG A 70 -6.837 13.712 -1.294 1.00 11.13 H new ATOM 0 HD3 ARG A 70 -8.173 14.838 -1.149 1.00 11.13 H new ATOM 0 HE ARG A 70 -7.454 13.985 1.471 1.00 54.30 H new ATOM 0 HH11 ARG A 70 -5.918 15.663 -1.266 1.00 71.42 H new ATOM 0 HH12 ARG A 70 -5.039 16.799 -0.237 1.00 71.42 H new ATOM 0 HH21 ARG A 70 -6.435 15.577 2.779 1.00 34.12 H new ATOM 0 HH22 ARG A 70 -5.333 16.748 2.047 1.00 34.12 H new ATOM 1121 N ASN A 71 -9.141 8.814 0.262 1.00 70.14 N ATOM 1122 CA ASN A 71 -9.333 7.381 0.117 1.00 15.14 C ATOM 1123 C ASN A 71 -8.533 6.851 -1.060 1.00 21.21 C ATOM 1124 O ASN A 71 -7.833 7.581 -1.734 1.00 4.23 O ATOM 1125 CB ASN A 71 -10.833 7.031 -0.110 1.00 51.21 C ATOM 1126 CG ASN A 71 -11.401 7.384 -1.496 1.00 52.21 C ATOM 1127 OD1 ASN A 71 -11.917 8.457 -1.713 1.00 14.23 O ATOM 1128 ND2 ASN A 71 -11.354 6.445 -2.414 1.00 72.23 N ATOM 0 H ASN A 71 -9.917 9.382 -0.077 1.00 70.14 H new ATOM 0 HA ASN A 71 -8.990 6.917 1.042 1.00 15.14 H new ATOM 0 HB2 ASN A 71 -10.966 5.962 0.055 1.00 51.21 H new ATOM 0 HB3 ASN A 71 -11.425 7.546 0.646 1.00 51.21 H new ATOM 0 HD21 ASN A 71 -11.758 6.612 -3.335 1.00 72.23 H new ATOM 0 HD22 ASN A 71 -10.913 5.549 -2.205 1.00 72.23 H new ATOM 1135 N ALA A 72 -8.639 5.580 -1.271 1.00 64.12 N ATOM 1136 CA ALA A 72 -8.118 4.941 -2.432 1.00 34.44 C ATOM 1137 C ALA A 72 -8.961 3.746 -2.646 1.00 70.51 C ATOM 1138 O ALA A 72 -9.319 3.070 -1.674 1.00 70.12 O ATOM 1139 CB ALA A 72 -6.668 4.529 -2.250 1.00 22.23 C ATOM 0 H ALA A 72 -9.102 4.942 -0.624 1.00 64.12 H new ATOM 0 HA ALA A 72 -8.138 5.621 -3.284 1.00 34.44 H new ATOM 0 HB1 ALA A 72 -6.310 4.045 -3.159 1.00 22.23 H new ATOM 0 HB2 ALA A 72 -6.062 5.412 -2.046 1.00 22.23 H new ATOM 0 HB3 ALA A 72 -6.589 3.834 -1.414 1.00 22.23 H new ATOM 1145 N TRP A 73 -9.354 3.494 -3.853 1.00 33.25 N ATOM 1146 CA TRP A 73 -10.113 2.313 -4.094 1.00 34.52 C ATOM 1147 C TRP A 73 -9.128 1.181 -4.137 1.00 2.31 C ATOM 1148 O TRP A 73 -8.395 1.023 -5.092 1.00 64.22 O ATOM 1149 CB TRP A 73 -10.867 2.434 -5.388 1.00 23.13 C ATOM 1150 CG TRP A 73 -11.731 3.667 -5.471 1.00 55.41 C ATOM 1151 CD1 TRP A 73 -11.642 4.677 -6.402 1.00 13.14 C ATOM 1152 CD2 TRP A 73 -12.772 4.054 -4.563 1.00 1.11 C ATOM 1153 NE1 TRP A 73 -12.586 5.636 -6.124 1.00 64.34 N ATOM 1154 CE2 TRP A 73 -13.284 5.277 -5.005 1.00 65.43 C ATOM 1155 CE3 TRP A 73 -13.320 3.476 -3.432 1.00 72.31 C ATOM 1156 CZ2 TRP A 73 -14.320 5.931 -4.340 1.00 50.11 C ATOM 1157 CZ3 TRP A 73 -14.341 4.123 -2.770 1.00 41.40 C ATOM 1158 CH2 TRP A 73 -14.834 5.341 -3.228 1.00 45.24 C ATOM 0 H TRP A 73 -9.167 4.076 -4.670 1.00 33.25 H new ATOM 0 HA TRP A 73 -10.856 2.145 -3.315 1.00 34.52 H new ATOM 0 HB2 TRP A 73 -10.156 2.443 -6.214 1.00 23.13 H new ATOM 0 HB3 TRP A 73 -11.494 1.552 -5.517 1.00 23.13 H new ATOM 0 HD1 TRP A 73 -10.940 4.710 -7.222 1.00 13.14 H new ATOM 0 HE1 TRP A 73 -12.742 6.484 -6.668 1.00 64.34 H new ATOM 0 HE3 TRP A 73 -12.951 2.527 -3.071 1.00 72.31 H new ATOM 0 HZ2 TRP A 73 -14.702 6.876 -4.697 1.00 50.11 H new ATOM 0 HZ3 TRP A 73 -14.765 3.678 -1.882 1.00 41.40 H new ATOM 0 HH2 TRP A 73 -15.637 5.825 -2.692 1.00 45.24 H new ATOM 1169 N ALA A 74 -9.122 0.407 -3.109 1.00 50.41 N ATOM 1170 CA ALA A 74 -8.072 -0.536 -2.908 1.00 23.14 C ATOM 1171 C ALA A 74 -8.562 -1.921 -2.668 1.00 51.22 C ATOM 1172 O ALA A 74 -7.973 -2.890 -3.138 1.00 44.43 O ATOM 1173 CB ALA A 74 -7.282 -0.089 -1.732 1.00 43.21 C ATOM 0 H ALA A 74 -9.840 0.407 -2.385 1.00 50.41 H new ATOM 0 HA ALA A 74 -7.473 -0.572 -3.818 1.00 23.14 H new ATOM 0 HB1 ALA A 74 -6.469 -0.792 -1.552 1.00 43.21 H new ATOM 0 HB2 ALA A 74 -6.870 0.901 -1.926 1.00 43.21 H new ATOM 0 HB3 ALA A 74 -7.927 -0.048 -0.854 1.00 43.21 H new ATOM 1179 N CYS A 75 -9.613 -2.038 -1.918 1.00 22.23 N ATOM 1180 CA CYS A 75 -10.109 -3.323 -1.596 1.00 31.44 C ATOM 1181 C CYS A 75 -11.062 -3.803 -2.665 1.00 14.03 C ATOM 1182 O CYS A 75 -11.367 -4.975 -2.737 1.00 73.21 O ATOM 1183 CB CYS A 75 -10.735 -3.361 -0.193 1.00 24.41 C ATOM 1184 SG CYS A 75 -12.140 -2.258 0.102 1.00 41.33 S ATOM 0 H CYS A 75 -10.137 -1.257 -1.522 1.00 22.23 H new ATOM 0 HA CYS A 75 -9.268 -4.015 -1.569 1.00 31.44 H new ATOM 0 HB2 CYS A 75 -11.057 -4.383 0.008 1.00 24.41 H new ATOM 0 HB3 CYS A 75 -9.957 -3.123 0.533 1.00 24.41 H new ATOM 0 HG CYS A 75 -12.012 -1.188 -0.625 1.00 41.33 H new ATOM 1190 N GLY A 76 -11.526 -2.864 -3.491 1.00 2.44 N ATOM 1191 CA GLY A 76 -12.401 -3.182 -4.617 1.00 62.21 C ATOM 1192 C GLY A 76 -13.707 -3.800 -4.189 1.00 12.42 C ATOM 1193 O GLY A 76 -14.350 -4.505 -4.956 1.00 52.21 O ATOM 0 H GLY A 76 -11.308 -1.872 -3.399 1.00 2.44 H new ATOM 0 HA2 GLY A 76 -12.603 -2.272 -5.182 1.00 62.21 H new ATOM 0 HA3 GLY A 76 -11.884 -3.866 -5.290 1.00 62.21 H new ATOM 1197 N ASP A 77 -14.101 -3.528 -2.971 1.00 11.34 N ATOM 1198 CA ASP A 77 -15.311 -4.120 -2.426 1.00 74.24 C ATOM 1199 C ASP A 77 -16.442 -3.108 -2.454 1.00 64.34 C ATOM 1200 O ASP A 77 -17.589 -3.417 -2.154 1.00 33.34 O ATOM 1201 CB ASP A 77 -15.039 -4.611 -0.990 1.00 2.22 C ATOM 1202 CG ASP A 77 -16.214 -5.330 -0.363 1.00 5.12 C ATOM 1203 OD1 ASP A 77 -16.492 -6.481 -0.748 1.00 44.54 O ATOM 1204 OD2 ASP A 77 -16.853 -4.769 0.535 1.00 65.44 O ATOM 0 H ASP A 77 -13.608 -2.903 -2.334 1.00 11.34 H new ATOM 0 HA ASP A 77 -15.609 -4.974 -3.034 1.00 74.24 H new ATOM 0 HB2 ASP A 77 -14.178 -5.280 -1.000 1.00 2.22 H new ATOM 0 HB3 ASP A 77 -14.772 -3.757 -0.367 1.00 2.22 H new ATOM 1209 N GLY A 78 -16.113 -1.908 -2.876 1.00 35.22 N ATOM 1210 CA GLY A 78 -17.063 -0.852 -2.877 1.00 45.10 C ATOM 1211 C GLY A 78 -16.667 0.134 -1.845 1.00 31.12 C ATOM 1212 O GLY A 78 -16.000 1.127 -2.146 1.00 73.52 O ATOM 0 H GLY A 78 -15.188 -1.652 -3.221 1.00 35.22 H new ATOM 0 HA2 GLY A 78 -17.103 -0.379 -3.858 1.00 45.10 H new ATOM 0 HA3 GLY A 78 -18.060 -1.239 -2.669 1.00 45.10 H new ATOM 1216 N ASN A 79 -17.049 -0.114 -0.628 1.00 32.34 N ATOM 1217 CA ASN A 79 -16.580 0.705 0.461 1.00 31.21 C ATOM 1218 C ASN A 79 -15.633 -0.105 1.358 1.00 15.34 C ATOM 1219 O ASN A 79 -14.642 0.436 1.863 1.00 15.33 O ATOM 1220 CB ASN A 79 -17.750 1.319 1.276 1.00 24.14 C ATOM 1221 CG ASN A 79 -18.627 0.305 1.986 1.00 73.43 C ATOM 1222 OD1 ASN A 79 -18.352 -0.081 3.122 1.00 52.43 O ATOM 1223 ND2 ASN A 79 -19.689 -0.112 1.349 1.00 2.44 N ATOM 0 H ASN A 79 -17.679 -0.870 -0.360 1.00 32.34 H new ATOM 0 HA ASN A 79 -16.027 1.543 0.038 1.00 31.21 H new ATOM 0 HB2 ASN A 79 -17.339 2.005 2.016 1.00 24.14 H new ATOM 0 HB3 ASN A 79 -18.372 1.910 0.604 1.00 24.14 H new ATOM 0 HD21 ASN A 79 -20.321 -0.779 1.793 1.00 2.44 H new ATOM 0 HD22 ASN A 79 -19.886 0.229 0.408 1.00 2.44 H new ATOM 1230 N GLY A 80 -15.906 -1.428 1.450 1.00 2.35 N ATOM 1231 CA GLY A 80 -15.173 -2.378 2.279 1.00 51.33 C ATOM 1232 C GLY A 80 -14.760 -1.819 3.608 1.00 41.11 C ATOM 1233 O GLY A 80 -15.532 -1.755 4.558 1.00 44.11 O ATOM 0 H GLY A 80 -16.667 -1.863 0.929 1.00 2.35 H new ATOM 0 HA2 GLY A 80 -15.793 -3.260 2.442 1.00 51.33 H new ATOM 0 HA3 GLY A 80 -14.284 -2.708 1.741 1.00 51.33 H new ATOM 1237 N SER A 81 -13.534 -1.431 3.644 1.00 63.11 N ATOM 1238 CA SER A 81 -12.899 -0.782 4.752 1.00 41.11 C ATOM 1239 C SER A 81 -11.699 -0.062 4.193 1.00 10.44 C ATOM 1240 O SER A 81 -11.349 1.031 4.628 1.00 32.31 O ATOM 1241 CB SER A 81 -12.468 -1.790 5.830 1.00 42.31 C ATOM 1242 OG SER A 81 -13.584 -2.488 6.367 1.00 32.33 O ATOM 0 H SER A 81 -12.903 -1.564 2.854 1.00 63.11 H new ATOM 0 HA SER A 81 -13.591 -0.093 5.236 1.00 41.11 H new ATOM 0 HB2 SER A 81 -11.763 -2.503 5.402 1.00 42.31 H new ATOM 0 HB3 SER A 81 -11.945 -1.267 6.631 1.00 42.31 H new ATOM 0 HG SER A 81 -14.400 -2.206 5.903 1.00 32.33 H new ATOM 1248 N GLY A 82 -11.086 -0.676 3.169 1.00 52.40 N ATOM 1249 CA GLY A 82 -9.940 -0.066 2.552 1.00 12.43 C ATOM 1250 C GLY A 82 -10.322 1.033 1.598 1.00 53.25 C ATOM 1251 O GLY A 82 -9.690 2.085 1.583 1.00 74.04 O ATOM 0 H GLY A 82 -11.369 -1.572 2.772 1.00 52.40 H new ATOM 0 HA2 GLY A 82 -9.286 0.338 3.325 1.00 12.43 H new ATOM 0 HA3 GLY A 82 -9.370 -0.826 2.018 1.00 12.43 H new ATOM 1255 N ASN A 83 -11.368 0.790 0.807 1.00 53.21 N ATOM 1256 CA ASN A 83 -11.914 1.799 -0.115 1.00 53.31 C ATOM 1257 C ASN A 83 -12.354 3.050 0.617 1.00 13.32 C ATOM 1258 O ASN A 83 -12.377 4.149 0.048 1.00 72.13 O ATOM 1259 CB ASN A 83 -13.082 1.234 -0.915 1.00 33.55 C ATOM 1260 CG ASN A 83 -12.669 0.373 -2.087 1.00 70.05 C ATOM 1261 OD1 ASN A 83 -11.625 -0.245 -2.087 1.00 62.41 O ATOM 1262 ND2 ASN A 83 -13.501 0.327 -3.083 1.00 53.10 N ATOM 0 H ASN A 83 -11.861 -0.103 0.784 1.00 53.21 H new ATOM 0 HA ASN A 83 -11.110 2.069 -0.800 1.00 53.31 H new ATOM 0 HB2 ASN A 83 -13.713 0.645 -0.250 1.00 33.55 H new ATOM 0 HB3 ASN A 83 -13.691 2.060 -1.282 1.00 33.55 H new ATOM 0 HD21 ASN A 83 -13.286 -0.243 -3.901 1.00 53.10 H new ATOM 0 HD22 ASN A 83 -14.370 0.861 -3.047 1.00 53.10 H new ATOM 1269 N ARG A 84 -12.738 2.881 1.858 1.00 4.21 N ATOM 1270 CA ARG A 84 -13.091 4.002 2.676 1.00 53.31 C ATOM 1271 C ARG A 84 -11.914 4.592 3.411 1.00 72.12 C ATOM 1272 O ARG A 84 -11.624 5.767 3.236 1.00 40.43 O ATOM 1273 CB ARG A 84 -14.286 3.721 3.596 1.00 61.21 C ATOM 1274 CG ARG A 84 -15.631 3.613 2.857 1.00 61.42 C ATOM 1275 CD ARG A 84 -16.104 4.970 2.267 1.00 45.11 C ATOM 1276 NE ARG A 84 -15.148 5.560 1.341 1.00 33.43 N ATOM 1277 CZ ARG A 84 -14.720 6.819 1.400 1.00 60.30 C ATOM 1278 NH1 ARG A 84 -15.201 7.662 2.319 1.00 31.30 N ATOM 1279 NH2 ARG A 84 -13.818 7.221 0.549 1.00 1.25 N ATOM 0 H ARG A 84 -12.812 1.974 2.319 1.00 4.21 H new ATOM 0 HA ARG A 84 -13.424 4.774 1.983 1.00 53.31 H new ATOM 0 HB2 ARG A 84 -14.105 2.792 4.137 1.00 61.21 H new ATOM 0 HB3 ARG A 84 -14.354 4.515 4.339 1.00 61.21 H new ATOM 0 HG2 ARG A 84 -15.541 2.884 2.052 1.00 61.42 H new ATOM 0 HG3 ARG A 84 -16.389 3.237 3.544 1.00 61.42 H new ATOM 0 HD2 ARG A 84 -17.054 4.823 1.753 1.00 45.11 H new ATOM 0 HD3 ARG A 84 -16.288 5.669 3.083 1.00 45.11 H new ATOM 0 HE ARG A 84 -14.781 4.968 0.596 1.00 33.43 H new ATOM 0 HH11 ARG A 84 -15.904 7.343 2.985 1.00 31.30 H new ATOM 0 HH12 ARG A 84 -14.865 8.624 2.354 1.00 31.30 H new ATOM 0 HH21 ARG A 84 -13.451 6.574 -0.149 1.00 1.25 H new ATOM 0 HH22 ARG A 84 -13.479 8.183 0.581 1.00 1.25 H new ATOM 1293 N GLN A 85 -11.207 3.799 4.203 1.00 51.32 N ATOM 1294 CA GLN A 85 -10.128 4.362 4.980 1.00 71.31 C ATOM 1295 C GLN A 85 -8.929 3.433 5.190 1.00 61.25 C ATOM 1296 O GLN A 85 -8.766 2.792 6.243 1.00 13.21 O ATOM 1297 CB GLN A 85 -10.644 4.918 6.301 1.00 54.32 C ATOM 1298 CG GLN A 85 -11.366 3.903 7.161 1.00 71.33 C ATOM 1299 CD GLN A 85 -11.896 4.491 8.456 1.00 40.31 C ATOM 1300 OE1 GLN A 85 -12.892 4.036 8.988 1.00 74.32 O ATOM 1301 NE2 GLN A 85 -11.251 5.520 8.961 1.00 3.30 N ATOM 0 H GLN A 85 -11.358 2.797 4.319 1.00 51.32 H new ATOM 0 HA GLN A 85 -9.736 5.180 4.376 1.00 71.31 H new ATOM 0 HB2 GLN A 85 -9.804 5.323 6.865 1.00 54.32 H new ATOM 0 HB3 GLN A 85 -11.319 5.748 6.094 1.00 54.32 H new ATOM 0 HG2 GLN A 85 -12.196 3.480 6.595 1.00 71.33 H new ATOM 0 HG3 GLN A 85 -10.687 3.083 7.392 1.00 71.33 H new ATOM 0 HE21 GLN A 85 -10.419 5.880 8.493 1.00 3.30 H new ATOM 0 HE22 GLN A 85 -11.583 5.958 9.820 1.00 3.30 H new ATOM 1310 N SER A 86 -8.108 3.346 4.211 1.00 31.02 N ATOM 1311 CA SER A 86 -6.895 2.597 4.335 1.00 33.40 C ATOM 1312 C SER A 86 -5.840 3.239 3.509 1.00 42.11 C ATOM 1313 O SER A 86 -6.085 4.244 2.872 1.00 25.34 O ATOM 1314 CB SER A 86 -7.057 1.143 3.882 1.00 21.13 C ATOM 1315 OG SER A 86 -7.282 1.055 2.483 1.00 62.34 O ATOM 0 H SER A 86 -8.248 3.786 3.302 1.00 31.02 H new ATOM 0 HA SER A 86 -6.621 2.590 5.390 1.00 33.40 H new ATOM 0 HB2 SER A 86 -6.163 0.578 4.144 1.00 21.13 H new ATOM 0 HB3 SER A 86 -7.891 0.686 4.415 1.00 21.13 H new ATOM 0 HG SER A 86 -7.221 0.119 2.200 1.00 62.34 H new ATOM 1321 N ILE A 87 -4.693 2.654 3.534 1.00 25.43 N ATOM 1322 CA ILE A 87 -3.578 3.074 2.747 1.00 30.45 C ATOM 1323 C ILE A 87 -3.124 1.899 1.939 1.00 42.01 C ATOM 1324 O ILE A 87 -2.869 0.844 2.490 1.00 74.02 O ATOM 1325 CB ILE A 87 -2.406 3.515 3.634 1.00 71.55 C ATOM 1326 CG1 ILE A 87 -2.845 4.654 4.543 1.00 54.13 C ATOM 1327 CG2 ILE A 87 -1.242 3.941 2.747 1.00 45.44 C ATOM 1328 CD1 ILE A 87 -1.847 5.042 5.605 1.00 12.30 C ATOM 0 H ILE A 87 -4.495 1.843 4.121 1.00 25.43 H new ATOM 0 HA ILE A 87 -3.882 3.914 2.122 1.00 30.45 H new ATOM 0 HB ILE A 87 -2.083 2.686 4.264 1.00 71.55 H new ATOM 0 HG12 ILE A 87 -3.057 5.529 3.928 1.00 54.13 H new ATOM 0 HG13 ILE A 87 -3.779 4.372 5.029 1.00 54.13 H new ATOM 0 HG21 ILE A 87 -0.405 4.256 3.371 1.00 45.44 H new ATOM 0 HG22 ILE A 87 -0.934 3.102 2.123 1.00 45.44 H new ATOM 0 HG23 ILE A 87 -1.553 4.770 2.112 1.00 45.44 H new ATOM 0 HD11 ILE A 87 -2.250 5.861 6.201 1.00 12.30 H new ATOM 0 HD12 ILE A 87 -1.651 4.186 6.250 1.00 12.30 H new ATOM 0 HD13 ILE A 87 -0.918 5.360 5.132 1.00 12.30 H new ATOM 1340 N SER A 88 -3.054 2.046 0.670 1.00 22.21 N ATOM 1341 CA SER A 88 -2.568 0.978 -0.134 1.00 54.44 C ATOM 1342 C SER A 88 -1.157 1.136 -0.538 1.00 12.35 C ATOM 1343 O SER A 88 -0.762 2.144 -1.135 1.00 24.13 O ATOM 1344 CB SER A 88 -3.466 0.652 -1.287 1.00 70.01 C ATOM 1345 OG SER A 88 -4.568 -0.062 -0.813 1.00 70.12 O ATOM 0 H SER A 88 -3.324 2.888 0.162 1.00 22.21 H new ATOM 0 HA SER A 88 -2.588 0.105 0.518 1.00 54.44 H new ATOM 0 HB2 SER A 88 -3.793 1.567 -1.780 1.00 70.01 H new ATOM 0 HB3 SER A 88 -2.927 0.064 -2.030 1.00 70.01 H new ATOM 0 HG SER A 88 -4.474 -1.007 -1.054 1.00 70.12 H new ATOM 1351 N VAL A 89 -0.403 0.139 -0.192 1.00 74.33 N ATOM 1352 CA VAL A 89 0.979 0.066 -0.521 1.00 21.03 C ATOM 1353 C VAL A 89 1.142 -0.992 -1.581 1.00 73.20 C ATOM 1354 O VAL A 89 0.788 -2.163 -1.374 1.00 52.51 O ATOM 1355 CB VAL A 89 1.854 -0.276 0.715 1.00 72.12 C ATOM 1356 CG1 VAL A 89 3.333 -0.330 0.337 1.00 44.24 C ATOM 1357 CG2 VAL A 89 1.627 0.745 1.825 1.00 15.33 C ATOM 0 H VAL A 89 -0.743 -0.663 0.339 1.00 74.33 H new ATOM 0 HA VAL A 89 1.314 1.038 -0.882 1.00 21.03 H new ATOM 0 HB VAL A 89 1.559 -1.260 1.079 1.00 72.12 H new ATOM 0 HG11 VAL A 89 3.926 -0.571 1.220 1.00 44.24 H new ATOM 0 HG12 VAL A 89 3.486 -1.096 -0.424 1.00 44.24 H new ATOM 0 HG13 VAL A 89 3.644 0.638 -0.055 1.00 44.24 H new ATOM 0 HG21 VAL A 89 2.247 0.492 2.685 1.00 15.33 H new ATOM 0 HG22 VAL A 89 1.894 1.739 1.465 1.00 15.33 H new ATOM 0 HG23 VAL A 89 0.578 0.735 2.119 1.00 15.33 H new ATOM 1367 N GLU A 90 1.619 -0.582 -2.700 1.00 34.53 N ATOM 1368 CA GLU A 90 1.796 -1.453 -3.816 1.00 62.13 C ATOM 1369 C GLU A 90 3.276 -1.813 -3.892 1.00 13.23 C ATOM 1370 O GLU A 90 4.135 -0.919 -4.018 1.00 71.31 O ATOM 1371 CB GLU A 90 1.365 -0.702 -5.082 1.00 71.53 C ATOM 1372 CG GLU A 90 1.254 -1.548 -6.335 1.00 52.23 C ATOM 1373 CD GLU A 90 0.151 -2.586 -6.242 1.00 10.50 C ATOM 1374 OE1 GLU A 90 -1.047 -2.213 -6.379 1.00 60.42 O ATOM 1375 OE2 GLU A 90 0.452 -3.762 -6.044 1.00 12.55 O ATOM 0 H GLU A 90 1.903 0.382 -2.874 1.00 34.53 H new ATOM 0 HA GLU A 90 1.202 -2.361 -3.718 1.00 62.13 H new ATOM 0 HB2 GLU A 90 0.399 -0.233 -4.894 1.00 71.53 H new ATOM 0 HB3 GLU A 90 2.079 0.101 -5.268 1.00 71.53 H new ATOM 0 HG2 GLU A 90 1.067 -0.900 -7.191 1.00 52.23 H new ATOM 0 HG3 GLU A 90 2.205 -2.049 -6.516 1.00 52.23 H new ATOM 1382 N ILE A 91 3.589 -3.085 -3.785 1.00 21.10 N ATOM 1383 CA ILE A 91 4.968 -3.509 -3.853 1.00 21.03 C ATOM 1384 C ILE A 91 5.304 -3.764 -5.290 1.00 41.44 C ATOM 1385 O ILE A 91 4.696 -4.612 -5.926 1.00 54.01 O ATOM 1386 CB ILE A 91 5.255 -4.799 -3.022 1.00 30.14 C ATOM 1387 CG1 ILE A 91 4.885 -4.591 -1.542 1.00 15.13 C ATOM 1388 CG2 ILE A 91 6.726 -5.193 -3.154 1.00 51.44 C ATOM 1389 CD1 ILE A 91 5.171 -5.789 -0.653 1.00 44.04 C ATOM 0 H ILE A 91 2.913 -3.838 -3.652 1.00 21.10 H new ATOM 0 HA ILE A 91 5.583 -2.718 -3.425 1.00 21.03 H new ATOM 0 HB ILE A 91 4.637 -5.607 -3.415 1.00 30.14 H new ATOM 0 HG12 ILE A 91 5.434 -3.730 -1.160 1.00 15.13 H new ATOM 0 HG13 ILE A 91 3.824 -4.348 -1.475 1.00 15.13 H new ATOM 0 HG21 ILE A 91 6.915 -6.094 -2.570 1.00 51.44 H new ATOM 0 HG22 ILE A 91 6.959 -5.384 -4.202 1.00 51.44 H new ATOM 0 HG23 ILE A 91 7.354 -4.383 -2.784 1.00 51.44 H new ATOM 0 HD11 ILE A 91 4.882 -5.559 0.372 1.00 44.04 H new ATOM 0 HD12 ILE A 91 4.601 -6.649 -1.006 1.00 44.04 H new ATOM 0 HD13 ILE A 91 6.236 -6.021 -0.686 1.00 44.04 H new ATOM 1401 N CYS A 92 6.239 -3.039 -5.805 1.00 12.41 N ATOM 1402 CA CYS A 92 6.625 -3.188 -7.174 1.00 62.34 C ATOM 1403 C CYS A 92 7.624 -4.318 -7.305 1.00 10.21 C ATOM 1404 O CYS A 92 8.234 -4.717 -6.322 1.00 35.32 O ATOM 1405 CB CYS A 92 7.191 -1.878 -7.676 1.00 62.44 C ATOM 1406 SG CYS A 92 6.039 -0.510 -7.460 1.00 23.33 S ATOM 0 H CYS A 92 6.759 -2.326 -5.293 1.00 12.41 H new ATOM 0 HA CYS A 92 5.759 -3.442 -7.785 1.00 62.34 H new ATOM 0 HB2 CYS A 92 8.117 -1.658 -7.145 1.00 62.44 H new ATOM 0 HB3 CYS A 92 7.444 -1.974 -8.732 1.00 62.44 H new ATOM 0 HG CYS A 92 6.366 0.169 -6.401 1.00 23.33 H new ATOM 1412 N TYR A 93 7.737 -4.875 -8.511 1.00 63.25 N ATOM 1413 CA TYR A 93 8.694 -5.952 -8.796 1.00 61.42 C ATOM 1414 C TYR A 93 8.341 -7.246 -8.085 1.00 32.32 C ATOM 1415 O TYR A 93 9.176 -8.134 -7.964 1.00 73.03 O ATOM 1416 CB TYR A 93 10.134 -5.535 -8.452 1.00 44.42 C ATOM 1417 CG TYR A 93 10.701 -4.470 -9.344 1.00 4.21 C ATOM 1418 CD1 TYR A 93 11.324 -4.812 -10.524 1.00 51.24 C ATOM 1419 CD2 TYR A 93 10.616 -3.133 -9.012 1.00 23.00 C ATOM 1420 CE1 TYR A 93 11.849 -3.858 -11.353 1.00 43.32 C ATOM 1421 CE2 TYR A 93 11.142 -2.167 -9.840 1.00 34.43 C ATOM 1422 CZ TYR A 93 11.755 -2.536 -11.008 1.00 72.21 C ATOM 1423 OH TYR A 93 12.278 -1.575 -11.846 1.00 51.31 O ATOM 0 H TYR A 93 7.174 -4.597 -9.315 1.00 63.25 H new ATOM 0 HA TYR A 93 8.631 -6.136 -9.869 1.00 61.42 H new ATOM 0 HB2 TYR A 93 10.160 -5.181 -7.422 1.00 44.42 H new ATOM 0 HB3 TYR A 93 10.776 -6.414 -8.503 1.00 44.42 H new ATOM 0 HD1 TYR A 93 11.400 -5.853 -10.800 1.00 51.24 H new ATOM 0 HD2 TYR A 93 10.131 -2.841 -8.092 1.00 23.00 H new ATOM 0 HE1 TYR A 93 12.335 -4.146 -12.274 1.00 43.32 H new ATOM 0 HE2 TYR A 93 11.072 -1.124 -9.570 1.00 34.43 H new ATOM 0 HH TYR A 93 12.129 -0.687 -11.459 1.00 51.31 H new ATOM 1433 N SER A 94 7.097 -7.386 -7.664 1.00 62.32 N ATOM 1434 CA SER A 94 6.692 -8.580 -6.958 1.00 12.24 C ATOM 1435 C SER A 94 6.736 -9.797 -7.850 1.00 22.34 C ATOM 1436 O SER A 94 7.077 -10.890 -7.396 1.00 73.02 O ATOM 1437 CB SER A 94 5.329 -8.407 -6.375 1.00 21.41 C ATOM 1438 OG SER A 94 5.293 -7.277 -5.533 1.00 1.33 O ATOM 0 H SER A 94 6.360 -6.694 -7.798 1.00 62.32 H new ATOM 0 HA SER A 94 7.403 -8.740 -6.147 1.00 12.24 H new ATOM 0 HB2 SER A 94 4.596 -8.296 -7.174 1.00 21.41 H new ATOM 0 HB3 SER A 94 5.052 -9.298 -5.811 1.00 21.41 H new ATOM 0 HG SER A 94 5.524 -7.543 -4.618 1.00 1.33 H new ATOM 1444 N LYS A 95 6.407 -9.606 -9.127 1.00 21.41 N ATOM 1445 CA LYS A 95 6.460 -10.713 -10.082 1.00 45.31 C ATOM 1446 C LYS A 95 7.886 -11.269 -10.203 1.00 34.41 C ATOM 1447 O LYS A 95 8.091 -12.458 -10.476 1.00 74.21 O ATOM 1448 CB LYS A 95 6.021 -10.306 -11.478 1.00 73.31 C ATOM 1449 CG LYS A 95 6.996 -9.411 -12.233 1.00 44.03 C ATOM 1450 CD LYS A 95 6.828 -9.574 -13.731 1.00 3.11 C ATOM 1451 CE LYS A 95 7.249 -10.967 -14.168 1.00 32.31 C ATOM 1452 NZ LYS A 95 7.032 -11.179 -15.614 1.00 50.33 N ATOM 0 H LYS A 95 6.106 -8.714 -9.519 1.00 21.41 H new ATOM 0 HA LYS A 95 5.775 -11.465 -9.690 1.00 45.31 H new ATOM 0 HB2 LYS A 95 5.853 -11.209 -12.065 1.00 73.31 H new ATOM 0 HB3 LYS A 95 5.063 -9.791 -11.404 1.00 73.31 H new ATOM 0 HG2 LYS A 95 6.831 -8.370 -11.955 1.00 44.03 H new ATOM 0 HG3 LYS A 95 8.019 -9.658 -11.948 1.00 44.03 H new ATOM 0 HD2 LYS A 95 5.788 -9.399 -14.007 1.00 3.11 H new ATOM 0 HD3 LYS A 95 7.426 -8.827 -14.253 1.00 3.11 H new ATOM 0 HE2 LYS A 95 8.302 -11.119 -13.933 1.00 32.31 H new ATOM 0 HE3 LYS A 95 6.686 -11.710 -13.603 1.00 32.31 H new ATOM 0 HZ1 LYS A 95 7.331 -12.141 -15.873 1.00 50.33 H new ATOM 0 HZ2 LYS A 95 6.023 -11.059 -15.835 1.00 50.33 H new ATOM 0 HZ3 LYS A 95 7.589 -10.486 -16.154 1.00 50.33 H new ATOM 1466 N SER A 96 8.853 -10.385 -10.019 1.00 23.45 N ATOM 1467 CA SER A 96 10.265 -10.710 -10.138 1.00 5.35 C ATOM 1468 C SER A 96 10.705 -11.660 -9.030 1.00 53.22 C ATOM 1469 O SER A 96 11.699 -12.368 -9.173 1.00 25.13 O ATOM 1470 CB SER A 96 11.087 -9.429 -10.089 1.00 22.50 C ATOM 1471 OG SER A 96 10.663 -8.520 -11.092 1.00 45.35 O ATOM 0 H SER A 96 8.677 -9.409 -9.780 1.00 23.45 H new ATOM 0 HA SER A 96 10.427 -11.211 -11.092 1.00 5.35 H new ATOM 0 HB2 SER A 96 10.989 -8.966 -9.107 1.00 22.50 H new ATOM 0 HB3 SER A 96 12.143 -9.663 -10.227 1.00 22.50 H new ATOM 0 HG SER A 96 11.372 -7.865 -11.261 1.00 45.35 H new ATOM 1477 N GLY A 97 9.941 -11.674 -7.947 1.00 34.01 N ATOM 1478 CA GLY A 97 10.161 -12.582 -6.812 1.00 11.42 C ATOM 1479 C GLY A 97 11.445 -12.371 -5.989 1.00 30.33 C ATOM 1480 O GLY A 97 11.395 -12.368 -4.770 1.00 51.53 O ATOM 0 H GLY A 97 9.142 -11.053 -7.823 1.00 34.01 H new ATOM 0 HA2 GLY A 97 9.308 -12.496 -6.138 1.00 11.42 H new ATOM 0 HA3 GLY A 97 10.165 -13.604 -7.191 1.00 11.42 H new ATOM 1484 N GLY A 98 12.556 -12.193 -6.662 1.00 61.02 N ATOM 1485 CA GLY A 98 13.848 -12.118 -6.040 1.00 75.41 C ATOM 1486 C GLY A 98 14.189 -10.771 -5.452 1.00 22.02 C ATOM 1487 O GLY A 98 13.327 -10.087 -4.905 1.00 12.55 O ATOM 0 H GLY A 98 12.584 -12.095 -7.677 1.00 61.02 H new ATOM 0 HA2 GLY A 98 13.900 -12.867 -5.250 1.00 75.41 H new ATOM 0 HA3 GLY A 98 14.607 -12.380 -6.778 1.00 75.41 H new ATOM 1491 N ASP A 99 15.457 -10.392 -5.594 1.00 64.14 N ATOM 1492 CA ASP A 99 16.044 -9.175 -4.985 1.00 52.45 C ATOM 1493 C ASP A 99 15.196 -7.937 -5.184 1.00 70.21 C ATOM 1494 O ASP A 99 15.001 -7.163 -4.240 1.00 61.42 O ATOM 1495 CB ASP A 99 17.459 -8.937 -5.524 1.00 23.31 C ATOM 1496 CG ASP A 99 18.084 -7.637 -5.032 1.00 13.11 C ATOM 1497 OD1 ASP A 99 18.618 -7.606 -3.902 1.00 70.41 O ATOM 1498 OD2 ASP A 99 18.083 -6.648 -5.786 1.00 0.03 O ATOM 0 H ASP A 99 16.129 -10.926 -6.145 1.00 64.14 H new ATOM 0 HA ASP A 99 16.084 -9.358 -3.911 1.00 52.45 H new ATOM 0 HB2 ASP A 99 18.096 -9.771 -5.231 1.00 23.31 H new ATOM 0 HB3 ASP A 99 17.428 -8.927 -6.614 1.00 23.31 H new ATOM 1503 N ARG A 100 14.668 -7.771 -6.387 1.00 75.44 N ATOM 1504 CA ARG A 100 13.832 -6.623 -6.700 1.00 32.02 C ATOM 1505 C ARG A 100 12.593 -6.617 -5.794 1.00 13.31 C ATOM 1506 O ARG A 100 12.253 -5.599 -5.195 1.00 54.04 O ATOM 1507 CB ARG A 100 13.386 -6.658 -8.147 1.00 3.01 C ATOM 1508 CG ARG A 100 14.497 -6.683 -9.188 1.00 64.44 C ATOM 1509 CD ARG A 100 15.327 -5.426 -9.172 1.00 22.14 C ATOM 1510 NE ARG A 100 16.374 -5.449 -10.192 1.00 31.53 N ATOM 1511 CZ ARG A 100 17.265 -4.471 -10.399 1.00 12.42 C ATOM 1512 NH1 ARG A 100 17.245 -3.369 -9.653 1.00 11.52 N ATOM 1513 NH2 ARG A 100 18.178 -4.592 -11.358 1.00 61.22 N ATOM 0 H ARG A 100 14.804 -8.418 -7.164 1.00 75.44 H new ATOM 0 HA ARG A 100 14.420 -5.721 -6.533 1.00 32.02 H new ATOM 0 HB2 ARG A 100 12.760 -7.538 -8.292 1.00 3.01 H new ATOM 0 HB3 ARG A 100 12.759 -5.786 -8.334 1.00 3.01 H new ATOM 0 HG2 ARG A 100 15.142 -7.543 -9.007 1.00 64.44 H new ATOM 0 HG3 ARG A 100 14.061 -6.814 -10.178 1.00 64.44 H new ATOM 0 HD2 ARG A 100 14.681 -4.563 -9.334 1.00 22.14 H new ATOM 0 HD3 ARG A 100 15.781 -5.304 -8.189 1.00 22.14 H new ATOM 0 HE ARG A 100 16.430 -6.272 -10.791 1.00 31.53 H new ATOM 0 HH11 ARG A 100 16.547 -3.264 -8.917 1.00 11.52 H new ATOM 0 HH12 ARG A 100 17.928 -2.629 -9.818 1.00 11.52 H new ATOM 0 HH21 ARG A 100 18.201 -5.431 -11.938 1.00 61.22 H new ATOM 0 HH22 ARG A 100 18.856 -3.846 -11.514 1.00 61.22 H new ATOM 1527 N TYR A 101 11.940 -7.767 -5.684 1.00 13.41 N ATOM 1528 CA TYR A 101 10.789 -7.894 -4.823 1.00 21.32 C ATOM 1529 C TYR A 101 11.162 -7.728 -3.364 1.00 33.21 C ATOM 1530 O TYR A 101 10.517 -6.966 -2.649 1.00 35.43 O ATOM 1531 CB TYR A 101 10.048 -9.224 -5.029 1.00 30.02 C ATOM 1532 CG TYR A 101 9.110 -9.542 -3.882 1.00 13.31 C ATOM 1533 CD1 TYR A 101 7.919 -8.854 -3.700 1.00 2.12 C ATOM 1534 CD2 TYR A 101 9.453 -10.510 -2.954 1.00 31.44 C ATOM 1535 CE1 TYR A 101 7.104 -9.121 -2.627 1.00 13.44 C ATOM 1536 CE2 TYR A 101 8.642 -10.790 -1.884 1.00 14.23 C ATOM 1537 CZ TYR A 101 7.469 -10.089 -1.723 1.00 21.03 C ATOM 1538 OH TYR A 101 6.673 -10.343 -0.649 1.00 63.44 O ATOM 0 H TYR A 101 12.194 -8.620 -6.183 1.00 13.41 H new ATOM 0 HA TYR A 101 10.111 -7.088 -5.103 1.00 21.32 H new ATOM 0 HB2 TYR A 101 9.481 -9.181 -5.959 1.00 30.02 H new ATOM 0 HB3 TYR A 101 10.774 -10.030 -5.136 1.00 30.02 H new ATOM 0 HD1 TYR A 101 7.628 -8.097 -4.413 1.00 2.12 H new ATOM 0 HD2 TYR A 101 10.377 -11.055 -3.075 1.00 31.44 H new ATOM 0 HE1 TYR A 101 6.182 -8.574 -2.495 1.00 13.44 H new ATOM 0 HE2 TYR A 101 8.922 -11.554 -1.174 1.00 14.23 H new ATOM 0 HH TYR A 101 7.219 -10.369 0.164 1.00 63.44 H new ATOM 1548 N TYR A 102 12.193 -8.436 -2.926 1.00 20.23 N ATOM 1549 CA TYR A 102 12.588 -8.393 -1.530 1.00 40.12 C ATOM 1550 C TYR A 102 12.937 -7.006 -1.087 1.00 73.31 C ATOM 1551 O TYR A 102 12.579 -6.606 0.009 1.00 55.32 O ATOM 1552 CB TYR A 102 13.696 -9.381 -1.190 1.00 22.23 C ATOM 1553 CG TYR A 102 13.279 -10.809 -1.367 1.00 33.02 C ATOM 1554 CD1 TYR A 102 12.323 -11.372 -0.545 1.00 75.34 C ATOM 1555 CD2 TYR A 102 13.813 -11.580 -2.363 1.00 22.11 C ATOM 1556 CE1 TYR A 102 11.918 -12.674 -0.714 1.00 51.14 C ATOM 1557 CE2 TYR A 102 13.417 -12.879 -2.553 1.00 22.42 C ATOM 1558 CZ TYR A 102 12.469 -13.427 -1.724 1.00 51.44 C ATOM 1559 OH TYR A 102 12.061 -14.730 -1.906 1.00 53.33 O ATOM 0 H TYR A 102 12.766 -9.042 -3.514 1.00 20.23 H new ATOM 0 HA TYR A 102 11.711 -8.709 -0.966 1.00 40.12 H new ATOM 0 HB2 TYR A 102 14.562 -9.180 -1.821 1.00 22.23 H new ATOM 0 HB3 TYR A 102 14.011 -9.225 -0.158 1.00 22.23 H new ATOM 0 HD1 TYR A 102 11.886 -10.779 0.245 1.00 75.34 H new ATOM 0 HD2 TYR A 102 14.563 -11.156 -3.014 1.00 22.11 H new ATOM 0 HE1 TYR A 102 11.173 -13.102 -0.059 1.00 51.14 H new ATOM 0 HE2 TYR A 102 13.848 -13.467 -3.350 1.00 22.42 H new ATOM 0 HH TYR A 102 11.230 -14.885 -1.410 1.00 53.33 H new ATOM 1569 N LYS A 103 13.610 -6.259 -1.933 1.00 21.44 N ATOM 1570 CA LYS A 103 13.910 -4.885 -1.609 1.00 41.23 C ATOM 1571 C LYS A 103 12.696 -4.026 -1.604 1.00 35.04 C ATOM 1572 O LYS A 103 12.554 -3.193 -0.744 1.00 63.31 O ATOM 1573 CB LYS A 103 15.018 -4.292 -2.451 1.00 72.21 C ATOM 1574 CG LYS A 103 16.383 -4.832 -2.102 1.00 22.53 C ATOM 1575 CD LYS A 103 16.682 -4.599 -0.617 1.00 53.40 C ATOM 1576 CE LYS A 103 18.064 -5.069 -0.223 1.00 5.33 C ATOM 1577 NZ LYS A 103 18.315 -4.863 1.222 1.00 51.21 N ATOM 0 H LYS A 103 13.956 -6.575 -2.839 1.00 21.44 H new ATOM 0 HA LYS A 103 14.293 -4.908 -0.589 1.00 41.23 H new ATOM 0 HB2 LYS A 103 14.813 -4.492 -3.503 1.00 72.21 H new ATOM 0 HB3 LYS A 103 15.020 -3.209 -2.327 1.00 72.21 H new ATOM 0 HG2 LYS A 103 16.429 -5.898 -2.327 1.00 22.53 H new ATOM 0 HG3 LYS A 103 17.142 -4.345 -2.714 1.00 22.53 H new ATOM 0 HD2 LYS A 103 16.586 -3.537 -0.393 1.00 53.40 H new ATOM 0 HD3 LYS A 103 15.939 -5.121 -0.014 1.00 53.40 H new ATOM 0 HE2 LYS A 103 18.173 -6.126 -0.465 1.00 5.33 H new ATOM 0 HE3 LYS A 103 18.812 -4.530 -0.804 1.00 5.33 H new ATOM 0 HZ1 LYS A 103 19.271 -5.196 1.459 1.00 51.21 H new ATOM 0 HZ2 LYS A 103 18.235 -3.851 1.447 1.00 51.21 H new ATOM 0 HZ3 LYS A 103 17.615 -5.397 1.776 1.00 51.21 H new ATOM 1591 N ALA A 104 11.815 -4.244 -2.536 1.00 74.22 N ATOM 1592 CA ALA A 104 10.576 -3.498 -2.582 1.00 63.11 C ATOM 1593 C ALA A 104 9.764 -3.753 -1.301 1.00 64.12 C ATOM 1594 O ALA A 104 9.274 -2.825 -0.667 1.00 61.52 O ATOM 1595 CB ALA A 104 9.792 -3.872 -3.810 1.00 24.23 C ATOM 0 H ALA A 104 11.925 -4.933 -3.280 1.00 74.22 H new ATOM 0 HA ALA A 104 10.797 -2.432 -2.637 1.00 63.11 H new ATOM 0 HB1 ALA A 104 8.862 -3.305 -3.834 1.00 24.23 H new ATOM 0 HB2 ALA A 104 10.379 -3.645 -4.700 1.00 24.23 H new ATOM 0 HB3 ALA A 104 9.566 -4.938 -3.787 1.00 24.23 H new ATOM 1601 N GLU A 105 9.671 -5.019 -0.920 1.00 45.24 N ATOM 1602 CA GLU A 105 9.026 -5.442 0.316 1.00 50.12 C ATOM 1603 C GLU A 105 9.728 -4.794 1.529 1.00 40.24 C ATOM 1604 O GLU A 105 9.087 -4.257 2.436 1.00 2.43 O ATOM 1605 CB GLU A 105 9.139 -6.968 0.417 1.00 31.04 C ATOM 1606 CG GLU A 105 8.623 -7.562 1.709 1.00 72.31 C ATOM 1607 CD GLU A 105 8.954 -9.028 1.845 1.00 12.23 C ATOM 1608 OE1 GLU A 105 10.058 -9.350 2.356 1.00 24.42 O ATOM 1609 OE2 GLU A 105 8.143 -9.870 1.463 1.00 72.51 O ATOM 0 H GLU A 105 10.047 -5.793 -1.468 1.00 45.24 H new ATOM 0 HA GLU A 105 7.980 -5.135 0.313 1.00 50.12 H new ATOM 0 HB2 GLU A 105 8.593 -7.414 -0.414 1.00 31.04 H new ATOM 0 HB3 GLU A 105 10.185 -7.249 0.298 1.00 31.04 H new ATOM 0 HG2 GLU A 105 9.049 -7.017 2.551 1.00 72.31 H new ATOM 0 HG3 GLU A 105 7.542 -7.431 1.759 1.00 72.31 H new ATOM 1616 N ASP A 106 11.043 -4.826 1.501 1.00 25.55 N ATOM 1617 CA ASP A 106 11.892 -4.322 2.584 1.00 0.20 C ATOM 1618 C ASP A 106 11.818 -2.799 2.670 1.00 63.14 C ATOM 1619 O ASP A 106 12.078 -2.205 3.706 1.00 55.31 O ATOM 1620 CB ASP A 106 13.329 -4.782 2.355 1.00 30.45 C ATOM 1621 CG ASP A 106 14.237 -4.536 3.521 1.00 34.02 C ATOM 1622 OD1 ASP A 106 14.167 -5.319 4.499 1.00 21.51 O ATOM 1623 OD2 ASP A 106 15.037 -3.584 3.473 1.00 65.41 O ATOM 0 H ASP A 106 11.571 -5.208 0.716 1.00 25.55 H new ATOM 0 HA ASP A 106 11.535 -4.723 3.533 1.00 0.20 H new ATOM 0 HB2 ASP A 106 13.327 -5.848 2.127 1.00 30.45 H new ATOM 0 HB3 ASP A 106 13.729 -4.269 1.480 1.00 30.45 H new ATOM 1628 N ASN A 107 11.480 -2.181 1.574 1.00 53.34 N ATOM 1629 CA ASN A 107 11.300 -0.745 1.533 1.00 30.02 C ATOM 1630 C ASN A 107 9.916 -0.368 2.020 1.00 2.32 C ATOM 1631 O ASN A 107 9.728 0.692 2.636 1.00 4.44 O ATOM 1632 CB ASN A 107 11.557 -0.179 0.125 1.00 74.25 C ATOM 1633 CG ASN A 107 13.022 -0.253 -0.290 1.00 44.14 C ATOM 1634 OD1 ASN A 107 13.918 -0.183 0.548 1.00 72.01 O ATOM 1635 ND2 ASN A 107 13.285 -0.396 -1.574 1.00 12.53 N ATOM 0 H ASN A 107 11.320 -2.650 0.683 1.00 53.34 H new ATOM 0 HA ASN A 107 12.037 -0.301 2.202 1.00 30.02 H new ATOM 0 HB2 ASN A 107 10.953 -0.728 -0.597 1.00 74.25 H new ATOM 0 HB3 ASN A 107 11.228 0.860 0.092 1.00 74.25 H new ATOM 0 HD21 ASN A 107 14.252 -0.451 -1.893 1.00 12.53 H new ATOM 0 HD22 ASN A 107 12.521 -0.451 -2.248 1.00 12.53 H new ATOM 1642 N ALA A 108 8.945 -1.243 1.767 1.00 25.32 N ATOM 1643 CA ALA A 108 7.579 -1.016 2.187 1.00 50.11 C ATOM 1644 C ALA A 108 7.457 -0.987 3.703 1.00 40.12 C ATOM 1645 O ALA A 108 6.702 -0.194 4.238 1.00 22.24 O ATOM 1646 CB ALA A 108 6.652 -2.064 1.588 1.00 23.23 C ATOM 0 H ALA A 108 9.089 -2.121 1.268 1.00 25.32 H new ATOM 0 HA ALA A 108 7.277 -0.036 1.816 1.00 50.11 H new ATOM 0 HB1 ALA A 108 5.630 -1.876 1.916 1.00 23.23 H new ATOM 0 HB2 ALA A 108 6.699 -2.013 0.500 1.00 23.23 H new ATOM 0 HB3 ALA A 108 6.962 -3.055 1.918 1.00 23.23 H new ATOM 1652 N VAL A 109 8.240 -1.830 4.390 1.00 41.23 N ATOM 1653 CA VAL A 109 8.184 -1.929 5.861 1.00 13.31 C ATOM 1654 C VAL A 109 8.369 -0.567 6.541 1.00 63.23 C ATOM 1655 O VAL A 109 7.691 -0.254 7.524 1.00 4.00 O ATOM 1656 CB VAL A 109 9.220 -2.949 6.438 1.00 73.21 C ATOM 1657 CG1 VAL A 109 9.058 -4.304 5.818 1.00 51.12 C ATOM 1658 CG2 VAL A 109 10.659 -2.477 6.322 1.00 42.43 C ATOM 0 H VAL A 109 8.920 -2.454 3.955 1.00 41.23 H new ATOM 0 HA VAL A 109 7.184 -2.298 6.086 1.00 13.31 H new ATOM 0 HB VAL A 109 9.000 -3.022 7.503 1.00 73.21 H new ATOM 0 HG11 VAL A 109 9.793 -4.988 6.241 1.00 51.12 H new ATOM 0 HG12 VAL A 109 8.055 -4.679 6.020 1.00 51.12 H new ATOM 0 HG13 VAL A 109 9.208 -4.232 4.741 1.00 51.12 H new ATOM 0 HG21 VAL A 109 11.324 -3.232 6.741 1.00 42.43 H new ATOM 0 HG22 VAL A 109 10.906 -2.318 5.272 1.00 42.43 H new ATOM 0 HG23 VAL A 109 10.781 -1.542 6.869 1.00 42.43 H new ATOM 1668 N ASP A 110 9.264 0.231 6.002 1.00 21.34 N ATOM 1669 CA ASP A 110 9.558 1.539 6.560 1.00 43.41 C ATOM 1670 C ASP A 110 8.420 2.485 6.341 1.00 32.54 C ATOM 1671 O ASP A 110 7.993 3.180 7.256 1.00 72.22 O ATOM 1672 CB ASP A 110 10.809 2.112 5.957 1.00 64.43 C ATOM 1673 CG ASP A 110 11.162 3.463 6.557 1.00 53.13 C ATOM 1674 OD1 ASP A 110 11.688 3.497 7.681 1.00 71.34 O ATOM 1675 OD2 ASP A 110 10.944 4.494 5.900 1.00 53.25 O ATOM 0 H ASP A 110 9.807 -0.003 5.171 1.00 21.34 H new ATOM 0 HA ASP A 110 9.708 1.409 7.632 1.00 43.41 H new ATOM 0 HB2 ASP A 110 11.636 1.419 6.111 1.00 64.43 H new ATOM 0 HB3 ASP A 110 10.678 2.217 4.880 1.00 64.43 H new ATOM 1680 N VAL A 111 7.905 2.482 5.137 1.00 42.41 N ATOM 1681 CA VAL A 111 6.806 3.346 4.774 1.00 60.05 C ATOM 1682 C VAL A 111 5.588 2.998 5.620 1.00 71.21 C ATOM 1683 O VAL A 111 4.901 3.880 6.145 1.00 12.30 O ATOM 1684 CB VAL A 111 6.456 3.197 3.269 1.00 12.12 C ATOM 1685 CG1 VAL A 111 5.319 4.125 2.874 1.00 23.14 C ATOM 1686 CG2 VAL A 111 7.683 3.457 2.406 1.00 42.44 C ATOM 0 H VAL A 111 8.234 1.882 4.381 1.00 42.41 H new ATOM 0 HA VAL A 111 7.102 4.379 4.956 1.00 60.05 H new ATOM 0 HB VAL A 111 6.125 2.172 3.102 1.00 12.12 H new ATOM 0 HG11 VAL A 111 5.097 3.998 1.814 1.00 23.14 H new ATOM 0 HG12 VAL A 111 4.433 3.886 3.462 1.00 23.14 H new ATOM 0 HG13 VAL A 111 5.611 5.158 3.062 1.00 23.14 H new ATOM 0 HG21 VAL A 111 7.418 3.348 1.354 1.00 42.44 H new ATOM 0 HG22 VAL A 111 8.046 4.469 2.586 1.00 42.44 H new ATOM 0 HG23 VAL A 111 8.464 2.741 2.659 1.00 42.44 H new ATOM 1696 N VAL A 112 5.375 1.711 5.807 1.00 33.14 N ATOM 1697 CA VAL A 112 4.228 1.240 6.549 1.00 53.33 C ATOM 1698 C VAL A 112 4.350 1.583 8.041 1.00 33.23 C ATOM 1699 O VAL A 112 3.386 2.052 8.644 1.00 31.25 O ATOM 1700 CB VAL A 112 3.957 -0.286 6.348 1.00 3.41 C ATOM 1701 CG1 VAL A 112 2.743 -0.733 7.149 1.00 23.43 C ATOM 1702 CG2 VAL A 112 3.725 -0.605 4.885 1.00 54.51 C ATOM 0 H VAL A 112 5.984 0.973 5.454 1.00 33.14 H new ATOM 0 HA VAL A 112 3.365 1.767 6.143 1.00 53.33 H new ATOM 0 HB VAL A 112 4.839 -0.821 6.700 1.00 3.41 H new ATOM 0 HG11 VAL A 112 2.576 -1.799 6.992 1.00 23.43 H new ATOM 0 HG12 VAL A 112 2.917 -0.545 8.209 1.00 23.43 H new ATOM 0 HG13 VAL A 112 1.865 -0.176 6.821 1.00 23.43 H new ATOM 0 HG21 VAL A 112 3.539 -1.673 4.771 1.00 54.51 H new ATOM 0 HG22 VAL A 112 2.863 -0.045 4.523 1.00 54.51 H new ATOM 0 HG23 VAL A 112 4.607 -0.327 4.308 1.00 54.51 H new ATOM 1712 N ARG A 113 5.544 1.397 8.629 1.00 4.45 N ATOM 1713 CA ARG A 113 5.721 1.688 10.063 1.00 11.24 C ATOM 1714 C ARG A 113 5.480 3.166 10.351 1.00 12.14 C ATOM 1715 O ARG A 113 4.912 3.525 11.384 1.00 1.45 O ATOM 1716 CB ARG A 113 7.104 1.268 10.600 1.00 13.10 C ATOM 1717 CG ARG A 113 8.273 2.058 10.046 1.00 32.10 C ATOM 1718 CD ARG A 113 9.576 1.636 10.674 1.00 75.33 C ATOM 1719 NE ARG A 113 10.718 2.398 10.150 1.00 13.25 N ATOM 1720 CZ ARG A 113 11.928 2.465 10.721 1.00 71.54 C ATOM 1721 NH1 ARG A 113 12.196 1.776 11.825 1.00 51.52 N ATOM 1722 NH2 ARG A 113 12.864 3.207 10.167 1.00 31.31 N ATOM 0 H ARG A 113 6.379 1.057 8.151 1.00 4.45 H new ATOM 0 HA ARG A 113 4.977 1.088 10.587 1.00 11.24 H new ATOM 0 HB2 ARG A 113 7.101 1.366 11.686 1.00 13.10 H new ATOM 0 HB3 ARG A 113 7.259 0.213 10.376 1.00 13.10 H new ATOM 0 HG2 ARG A 113 8.327 1.919 8.966 1.00 32.10 H new ATOM 0 HG3 ARG A 113 8.111 3.121 10.223 1.00 32.10 H new ATOM 0 HD2 ARG A 113 9.517 1.770 11.754 1.00 75.33 H new ATOM 0 HD3 ARG A 113 9.737 0.573 10.493 1.00 75.33 H new ATOM 0 HE ARG A 113 10.578 2.917 9.283 1.00 13.25 H new ATOM 0 HH11 ARG A 113 11.477 1.188 12.247 1.00 51.52 H new ATOM 0 HH12 ARG A 113 13.121 1.835 12.251 1.00 51.52 H new ATOM 0 HH21 ARG A 113 12.665 3.724 9.311 1.00 31.31 H new ATOM 0 HH22 ARG A 113 13.788 3.265 10.594 1.00 31.31 H new ATOM 1736 N GLN A 114 5.893 4.020 9.424 1.00 31.14 N ATOM 1737 CA GLN A 114 5.700 5.442 9.573 1.00 21.34 C ATOM 1738 C GLN A 114 4.222 5.770 9.583 1.00 55.32 C ATOM 1739 O GLN A 114 3.767 6.534 10.411 1.00 53.34 O ATOM 1740 CB GLN A 114 6.428 6.225 8.478 1.00 52.23 C ATOM 1741 CG GLN A 114 7.928 6.032 8.434 1.00 1.13 C ATOM 1742 CD GLN A 114 8.670 6.812 9.479 1.00 12.44 C ATOM 1743 OE1 GLN A 114 9.817 7.185 9.275 1.00 51.01 O ATOM 1744 NE2 GLN A 114 8.032 7.123 10.561 1.00 45.02 N ATOM 0 H GLN A 114 6.364 3.744 8.562 1.00 31.14 H new ATOM 0 HA GLN A 114 6.131 5.744 10.527 1.00 21.34 H new ATOM 0 HB2 GLN A 114 6.013 5.938 7.512 1.00 52.23 H new ATOM 0 HB3 GLN A 114 6.218 7.286 8.613 1.00 52.23 H new ATOM 0 HG2 GLN A 114 8.152 4.972 8.557 1.00 1.13 H new ATOM 0 HG3 GLN A 114 8.294 6.323 7.449 1.00 1.13 H new ATOM 0 HE21 GLN A 114 7.076 6.796 10.701 1.00 45.02 H new ATOM 0 HE22 GLN A 114 8.485 7.695 11.274 1.00 45.02 H new ATOM 1753 N LEU A 115 3.482 5.149 8.687 1.00 12.25 N ATOM 1754 CA LEU A 115 2.052 5.329 8.583 1.00 14.40 C ATOM 1755 C LEU A 115 1.380 4.853 9.851 1.00 34.41 C ATOM 1756 O LEU A 115 0.475 5.507 10.370 1.00 73.20 O ATOM 1757 CB LEU A 115 1.527 4.542 7.392 1.00 62.25 C ATOM 1758 CG LEU A 115 2.069 4.951 6.031 1.00 14.30 C ATOM 1759 CD1 LEU A 115 1.574 4.015 4.959 1.00 51.14 C ATOM 1760 CD2 LEU A 115 1.703 6.390 5.721 1.00 23.03 C ATOM 0 H LEU A 115 3.864 4.497 8.002 1.00 12.25 H new ATOM 0 HA LEU A 115 1.831 6.387 8.442 1.00 14.40 H new ATOM 0 HB2 LEU A 115 1.755 3.488 7.550 1.00 62.25 H new ATOM 0 HB3 LEU A 115 0.441 4.634 7.371 1.00 62.25 H new ATOM 0 HG LEU A 115 3.157 4.882 6.056 1.00 14.30 H new ATOM 0 HD11 LEU A 115 1.973 4.325 3.993 1.00 51.14 H new ATOM 0 HD12 LEU A 115 1.906 3.001 5.180 1.00 51.14 H new ATOM 0 HD13 LEU A 115 0.485 4.042 4.927 1.00 51.14 H new ATOM 0 HD21 LEU A 115 2.100 6.664 4.743 1.00 23.03 H new ATOM 0 HD22 LEU A 115 0.618 6.496 5.715 1.00 23.03 H new ATOM 0 HD23 LEU A 115 2.128 7.045 6.481 1.00 23.03 H new ATOM 1772 N MET A 116 1.852 3.728 10.363 1.00 53.30 N ATOM 1773 CA MET A 116 1.319 3.158 11.586 1.00 62.11 C ATOM 1774 C MET A 116 1.553 4.076 12.766 1.00 22.03 C ATOM 1775 O MET A 116 0.699 4.211 13.634 1.00 61.20 O ATOM 1776 CB MET A 116 1.886 1.761 11.898 1.00 31.03 C ATOM 1777 CG MET A 116 1.615 0.697 10.843 1.00 72.45 C ATOM 1778 SD MET A 116 1.929 -0.988 11.443 1.00 24.23 S ATOM 1779 CE MET A 116 3.604 -0.865 12.072 1.00 33.32 C ATOM 0 H MET A 116 2.610 3.189 9.945 1.00 53.30 H new ATOM 0 HA MET A 116 0.248 3.047 11.418 1.00 62.11 H new ATOM 0 HB2 MET A 116 2.964 1.847 12.035 1.00 31.03 H new ATOM 0 HB3 MET A 116 1.470 1.422 12.847 1.00 31.03 H new ATOM 0 HG2 MET A 116 0.578 0.773 10.515 1.00 72.45 H new ATOM 0 HG3 MET A 116 2.240 0.889 9.971 1.00 72.45 H new ATOM 0 HE1 MET A 116 3.922 -1.836 12.452 1.00 33.32 H new ATOM 0 HE2 MET A 116 4.272 -0.553 11.269 1.00 33.32 H new ATOM 0 HE3 MET A 116 3.637 -0.131 12.878 1.00 33.32 H new ATOM 1789 N SER A 117 2.694 4.715 12.793 1.00 34.52 N ATOM 1790 CA SER A 117 3.024 5.615 13.866 1.00 42.22 C ATOM 1791 C SER A 117 2.284 6.960 13.694 1.00 44.44 C ATOM 1792 O SER A 117 1.672 7.468 14.634 1.00 21.13 O ATOM 1793 CB SER A 117 4.548 5.818 13.925 1.00 4.44 C ATOM 1794 OG SER A 117 4.934 6.607 15.037 1.00 62.10 O ATOM 0 H SER A 117 3.415 4.627 12.077 1.00 34.52 H new ATOM 0 HA SER A 117 2.698 5.180 14.811 1.00 42.22 H new ATOM 0 HB2 SER A 117 5.041 4.848 13.980 1.00 4.44 H new ATOM 0 HB3 SER A 117 4.886 6.296 13.006 1.00 4.44 H new ATOM 0 HG SER A 117 5.908 6.712 15.041 1.00 62.10 H new ATOM 1800 N MET A 118 2.311 7.499 12.485 1.00 2.41 N ATOM 1801 CA MET A 118 1.697 8.793 12.187 1.00 71.42 C ATOM 1802 C MET A 118 0.185 8.754 12.287 1.00 13.53 C ATOM 1803 O MET A 118 -0.413 9.580 12.956 1.00 1.13 O ATOM 1804 CB MET A 118 2.113 9.291 10.796 1.00 64.21 C ATOM 1805 CG MET A 118 3.589 9.641 10.667 1.00 32.34 C ATOM 1806 SD MET A 118 4.076 10.039 8.969 1.00 3.23 S ATOM 1807 CE MET A 118 2.977 11.410 8.600 1.00 31.25 C ATOM 0 H MET A 118 2.757 7.057 11.681 1.00 2.41 H new ATOM 0 HA MET A 118 2.061 9.489 12.943 1.00 71.42 H new ATOM 0 HB2 MET A 118 1.869 8.524 10.061 1.00 64.21 H new ATOM 0 HB3 MET A 118 1.521 10.171 10.547 1.00 64.21 H new ATOM 0 HG2 MET A 118 3.813 10.491 11.312 1.00 32.34 H new ATOM 0 HG3 MET A 118 4.188 8.803 11.024 1.00 32.34 H new ATOM 0 HE1 MET A 118 3.340 11.940 7.719 1.00 31.25 H new ATOM 0 HE2 MET A 118 1.974 11.030 8.407 1.00 31.25 H new ATOM 0 HE3 MET A 118 2.950 12.093 9.449 1.00 31.25 H new ATOM 1817 N TYR A 119 -0.432 7.791 11.643 1.00 61.50 N ATOM 1818 CA TYR A 119 -1.891 7.727 11.639 1.00 44.10 C ATOM 1819 C TYR A 119 -2.438 6.869 12.753 1.00 71.34 C ATOM 1820 O TYR A 119 -3.651 6.819 12.967 1.00 25.13 O ATOM 1821 CB TYR A 119 -2.418 7.278 10.280 1.00 64.12 C ATOM 1822 CG TYR A 119 -2.117 8.272 9.184 1.00 24.24 C ATOM 1823 CD1 TYR A 119 -2.961 9.352 8.957 1.00 62.31 C ATOM 1824 CD2 TYR A 119 -0.986 8.145 8.389 1.00 1.04 C ATOM 1825 CE1 TYR A 119 -2.686 10.276 7.973 1.00 34.02 C ATOM 1826 CE2 TYR A 119 -0.707 9.064 7.400 1.00 52.41 C ATOM 1827 CZ TYR A 119 -1.560 10.130 7.197 1.00 11.42 C ATOM 1828 OH TYR A 119 -1.283 11.054 6.219 1.00 20.22 O ATOM 0 H TYR A 119 0.035 7.049 11.121 1.00 61.50 H new ATOM 0 HA TYR A 119 -2.250 8.739 11.824 1.00 44.10 H new ATOM 0 HB2 TYR A 119 -1.977 6.315 10.023 1.00 64.12 H new ATOM 0 HB3 TYR A 119 -3.496 7.128 10.344 1.00 64.12 H new ATOM 0 HD1 TYR A 119 -3.848 9.469 9.562 1.00 62.31 H new ATOM 0 HD2 TYR A 119 -0.315 7.314 8.548 1.00 1.04 H new ATOM 0 HE1 TYR A 119 -3.352 11.111 7.812 1.00 34.02 H new ATOM 0 HE2 TYR A 119 0.175 8.950 6.787 1.00 52.41 H new ATOM 0 HH TYR A 119 -0.452 10.807 5.762 1.00 20.22 H new ATOM 1838 N ASN A 120 -1.541 6.220 13.477 1.00 60.31 N ATOM 1839 CA ASN A 120 -1.898 5.339 14.581 1.00 64.03 C ATOM 1840 C ASN A 120 -2.723 4.174 14.111 1.00 11.32 C ATOM 1841 O ASN A 120 -3.937 4.090 14.328 1.00 23.24 O ATOM 1842 CB ASN A 120 -2.529 6.065 15.778 1.00 23.51 C ATOM 1843 CG ASN A 120 -1.570 7.019 16.454 1.00 71.11 C ATOM 1844 OD1 ASN A 120 -0.843 6.638 17.361 1.00 5.30 O ATOM 1845 ND2 ASN A 120 -1.563 8.262 16.030 1.00 24.11 N ATOM 0 H ASN A 120 -0.536 6.289 13.315 1.00 60.31 H new ATOM 0 HA ASN A 120 -0.958 4.941 14.964 1.00 64.03 H new ATOM 0 HB2 ASN A 120 -3.407 6.617 15.441 1.00 23.51 H new ATOM 0 HB3 ASN A 120 -2.874 5.328 16.504 1.00 23.51 H new ATOM 0 HD21 ASN A 120 -0.938 8.944 16.460 1.00 24.11 H new ATOM 0 HD22 ASN A 120 -2.183 8.545 15.271 1.00 24.11 H new ATOM 1852 N ILE A 121 -2.063 3.338 13.387 1.00 65.13 N ATOM 1853 CA ILE A 121 -2.623 2.154 12.816 1.00 34.41 C ATOM 1854 C ILE A 121 -1.833 0.968 13.354 1.00 14.31 C ATOM 1855 O ILE A 121 -0.624 0.950 13.243 1.00 62.01 O ATOM 1856 CB ILE A 121 -2.479 2.202 11.261 1.00 31.41 C ATOM 1857 CG1 ILE A 121 -3.186 3.446 10.687 1.00 11.22 C ATOM 1858 CG2 ILE A 121 -3.015 0.932 10.617 1.00 41.43 C ATOM 1859 CD1 ILE A 121 -2.977 3.647 9.196 1.00 0.12 C ATOM 0 H ILE A 121 -1.075 3.463 13.165 1.00 65.13 H new ATOM 0 HA ILE A 121 -3.679 2.069 13.071 1.00 34.41 H new ATOM 0 HB ILE A 121 -1.417 2.271 11.026 1.00 31.41 H new ATOM 0 HG12 ILE A 121 -4.255 3.367 10.885 1.00 11.22 H new ATOM 0 HG13 ILE A 121 -2.828 4.330 11.215 1.00 11.22 H new ATOM 0 HG21 ILE A 121 -2.900 0.996 9.535 1.00 41.43 H new ATOM 0 HG22 ILE A 121 -2.459 0.072 10.990 1.00 41.43 H new ATOM 0 HG23 ILE A 121 -4.070 0.816 10.864 1.00 41.43 H new ATOM 0 HD11 ILE A 121 -3.507 4.543 8.872 1.00 0.12 H new ATOM 0 HD12 ILE A 121 -1.913 3.760 8.990 1.00 0.12 H new ATOM 0 HD13 ILE A 121 -3.361 2.782 8.655 1.00 0.12 H new ATOM 1871 N PRO A 122 -2.479 0.010 13.998 1.00 1.33 N ATOM 1872 CA PRO A 122 -1.794 -1.186 14.468 1.00 64.33 C ATOM 1873 C PRO A 122 -1.449 -2.123 13.308 1.00 62.01 C ATOM 1874 O PRO A 122 -2.122 -2.118 12.272 1.00 65.32 O ATOM 1875 CB PRO A 122 -2.793 -1.836 15.425 1.00 5.11 C ATOM 1876 CG PRO A 122 -4.128 -1.333 14.998 1.00 31.33 C ATOM 1877 CD PRO A 122 -3.907 0.013 14.352 1.00 63.13 C ATOM 0 HA PRO A 122 -0.843 -0.957 14.949 1.00 64.33 H new ATOM 0 HB2 PRO A 122 -2.745 -2.923 15.366 1.00 5.11 H new ATOM 0 HB3 PRO A 122 -2.582 -1.563 16.459 1.00 5.11 H new ATOM 0 HG2 PRO A 122 -4.595 -2.025 14.297 1.00 31.33 H new ATOM 0 HG3 PRO A 122 -4.798 -1.245 15.853 1.00 31.33 H new ATOM 0 HD2 PRO A 122 -4.536 0.141 13.471 1.00 63.13 H new ATOM 0 HD3 PRO A 122 -4.147 0.828 15.035 1.00 63.13 H new ATOM 1885 N ILE A 123 -0.405 -2.923 13.492 1.00 61.43 N ATOM 1886 CA ILE A 123 0.096 -3.860 12.468 1.00 52.31 C ATOM 1887 C ILE A 123 -1.019 -4.847 12.012 1.00 24.42 C ATOM 1888 O ILE A 123 -0.999 -5.357 10.903 1.00 12.33 O ATOM 1889 CB ILE A 123 1.333 -4.654 13.021 1.00 73.33 C ATOM 1890 CG1 ILE A 123 2.006 -5.529 11.947 1.00 11.51 C ATOM 1891 CG2 ILE A 123 0.937 -5.505 14.215 1.00 65.22 C ATOM 1892 CD1 ILE A 123 2.591 -4.755 10.784 1.00 72.15 C ATOM 0 H ILE A 123 0.129 -2.947 14.361 1.00 61.43 H new ATOM 0 HA ILE A 123 0.405 -3.278 11.599 1.00 52.31 H new ATOM 0 HB ILE A 123 2.064 -3.909 13.336 1.00 73.33 H new ATOM 0 HG12 ILE A 123 2.799 -6.111 12.415 1.00 11.51 H new ATOM 0 HG13 ILE A 123 1.273 -6.239 11.563 1.00 11.51 H new ATOM 0 HG21 ILE A 123 1.809 -6.046 14.582 1.00 65.22 H new ATOM 0 HG22 ILE A 123 0.549 -4.864 15.006 1.00 65.22 H new ATOM 0 HG23 ILE A 123 0.168 -6.217 13.915 1.00 65.22 H new ATOM 0 HD11 ILE A 123 3.044 -5.449 10.076 1.00 72.15 H new ATOM 0 HD12 ILE A 123 1.800 -4.194 10.286 1.00 72.15 H new ATOM 0 HD13 ILE A 123 3.350 -4.064 11.152 1.00 72.15 H new ATOM 1904 N GLU A 124 -2.004 -5.057 12.875 1.00 1.34 N ATOM 1905 CA GLU A 124 -3.118 -5.952 12.594 1.00 21.03 C ATOM 1906 C GLU A 124 -4.175 -5.279 11.712 1.00 25.01 C ATOM 1907 O GLU A 124 -5.186 -5.878 11.366 1.00 2.34 O ATOM 1908 CB GLU A 124 -3.718 -6.461 13.894 1.00 54.43 C ATOM 1909 CG GLU A 124 -2.744 -7.304 14.699 1.00 5.22 C ATOM 1910 CD GLU A 124 -3.290 -7.716 16.031 1.00 64.43 C ATOM 1911 OE1 GLU A 124 -4.128 -8.639 16.090 1.00 42.43 O ATOM 1912 OE2 GLU A 124 -2.888 -7.122 17.050 1.00 41.02 O ATOM 0 H GLU A 124 -2.053 -4.611 13.791 1.00 1.34 H new ATOM 0 HA GLU A 124 -2.738 -6.806 12.032 1.00 21.03 H new ATOM 0 HB2 GLU A 124 -4.042 -5.612 14.497 1.00 54.43 H new ATOM 0 HB3 GLU A 124 -4.607 -7.052 13.672 1.00 54.43 H new ATOM 0 HG2 GLU A 124 -2.485 -8.195 14.127 1.00 5.22 H new ATOM 0 HG3 GLU A 124 -1.822 -6.742 14.848 1.00 5.22 H new ATOM 1919 N ASN A 125 -3.939 -4.032 11.371 1.00 75.10 N ATOM 1920 CA ASN A 125 -4.796 -3.310 10.439 1.00 74.40 C ATOM 1921 C ASN A 125 -4.220 -3.365 9.061 1.00 71.41 C ATOM 1922 O ASN A 125 -4.811 -2.855 8.102 1.00 23.31 O ATOM 1923 CB ASN A 125 -5.016 -1.860 10.841 1.00 63.42 C ATOM 1924 CG ASN A 125 -5.997 -1.660 11.965 1.00 1.12 C ATOM 1925 OD1 ASN A 125 -6.170 -2.513 12.832 1.00 74.45 O ATOM 1926 ND2 ASN A 125 -6.635 -0.522 11.967 1.00 71.32 N ATOM 0 H ASN A 125 -3.154 -3.486 11.726 1.00 75.10 H new ATOM 0 HA ASN A 125 -5.767 -3.804 10.460 1.00 74.40 H new ATOM 0 HB2 ASN A 125 -4.058 -1.429 11.132 1.00 63.42 H new ATOM 0 HB3 ASN A 125 -5.364 -1.305 9.970 1.00 63.42 H new ATOM 0 HD21 ASN A 125 -7.306 -0.315 12.707 1.00 71.32 H new ATOM 0 HD22 ASN A 125 -6.463 0.160 11.229 1.00 71.32 H new ATOM 1933 N VAL A 126 -3.055 -3.956 8.955 1.00 34.24 N ATOM 1934 CA VAL A 126 -2.454 -4.165 7.676 1.00 34.53 C ATOM 1935 C VAL A 126 -3.021 -5.467 7.144 1.00 50.15 C ATOM 1936 O VAL A 126 -2.806 -6.531 7.720 1.00 72.03 O ATOM 1937 CB VAL A 126 -0.905 -4.274 7.790 1.00 23.43 C ATOM 1938 CG1 VAL A 126 -0.267 -4.449 6.424 1.00 5.31 C ATOM 1939 CG2 VAL A 126 -0.324 -3.057 8.503 1.00 73.53 C ATOM 0 H VAL A 126 -2.509 -4.299 9.745 1.00 34.24 H new ATOM 0 HA VAL A 126 -2.669 -3.326 7.014 1.00 34.53 H new ATOM 0 HB VAL A 126 -0.677 -5.159 8.385 1.00 23.43 H new ATOM 0 HG11 VAL A 126 0.815 -4.522 6.534 1.00 5.31 H new ATOM 0 HG12 VAL A 126 -0.647 -5.359 5.959 1.00 5.31 H new ATOM 0 HG13 VAL A 126 -0.510 -3.592 5.796 1.00 5.31 H new ATOM 0 HG21 VAL A 126 0.759 -3.157 8.570 1.00 73.53 H new ATOM 0 HG22 VAL A 126 -0.571 -2.155 7.943 1.00 73.53 H new ATOM 0 HG23 VAL A 126 -0.745 -2.988 9.506 1.00 73.53 H new ATOM 1949 N ARG A 127 -3.765 -5.383 6.073 1.00 12.04 N ATOM 1950 CA ARG A 127 -4.426 -6.543 5.516 1.00 33.13 C ATOM 1951 C ARG A 127 -4.196 -6.648 4.031 1.00 45.21 C ATOM 1952 O ARG A 127 -3.665 -5.723 3.399 1.00 60.22 O ATOM 1953 CB ARG A 127 -5.925 -6.526 5.831 1.00 32.03 C ATOM 1954 CG ARG A 127 -6.264 -6.591 7.317 1.00 62.01 C ATOM 1955 CD ARG A 127 -5.728 -7.864 7.958 1.00 71.35 C ATOM 1956 NE ARG A 127 -6.066 -7.948 9.380 1.00 44.43 N ATOM 1957 CZ ARG A 127 -5.602 -8.876 10.229 1.00 32.41 C ATOM 1958 NH1 ARG A 127 -4.707 -9.774 9.823 1.00 75.13 N ATOM 1959 NH2 ARG A 127 -6.015 -8.886 11.491 1.00 13.54 N ATOM 0 H ARG A 127 -3.932 -4.516 5.562 1.00 12.04 H new ATOM 0 HA ARG A 127 -3.988 -7.424 5.985 1.00 33.13 H new ATOM 0 HB2 ARG A 127 -6.360 -5.619 5.412 1.00 32.03 H new ATOM 0 HB3 ARG A 127 -6.398 -7.369 5.327 1.00 32.03 H new ATOM 0 HG2 ARG A 127 -5.845 -5.723 7.825 1.00 62.01 H new ATOM 0 HG3 ARG A 127 -7.345 -6.545 7.447 1.00 62.01 H new ATOM 0 HD2 ARG A 127 -6.135 -8.731 7.437 1.00 71.35 H new ATOM 0 HD3 ARG A 127 -4.645 -7.901 7.840 1.00 71.35 H new ATOM 0 HE ARG A 127 -6.704 -7.246 9.754 1.00 44.43 H new ATOM 0 HH11 ARG A 127 -4.370 -9.759 8.860 1.00 75.13 H new ATOM 0 HH12 ARG A 127 -4.358 -10.477 10.474 1.00 75.13 H new ATOM 0 HH21 ARG A 127 -6.685 -8.188 11.814 1.00 13.54 H new ATOM 0 HH22 ARG A 127 -5.662 -9.592 12.137 1.00 13.54 H new ATOM 1973 N THR A 128 -4.575 -7.769 3.467 1.00 62.22 N ATOM 1974 CA THR A 128 -4.370 -7.999 2.075 1.00 1.14 C ATOM 1975 C THR A 128 -5.626 -7.550 1.323 1.00 72.52 C ATOM 1976 O THR A 128 -6.675 -7.338 1.929 1.00 15.41 O ATOM 1977 CB THR A 128 -4.138 -9.519 1.783 1.00 55.44 C ATOM 1978 OG1 THR A 128 -5.352 -10.237 1.928 1.00 70.15 O ATOM 1979 CG2 THR A 128 -3.124 -10.120 2.746 1.00 2.22 C ATOM 0 H THR A 128 -5.030 -8.536 3.963 1.00 62.22 H new ATOM 0 HA THR A 128 -3.490 -7.442 1.753 1.00 1.14 H new ATOM 0 HB THR A 128 -3.763 -9.596 0.762 1.00 55.44 H new ATOM 0 HG1 THR A 128 -5.602 -10.269 2.875 1.00 70.15 H new ATOM 0 HG21 THR A 128 -2.986 -11.176 2.516 1.00 2.22 H new ATOM 0 HG22 THR A 128 -2.172 -9.599 2.644 1.00 2.22 H new ATOM 0 HG23 THR A 128 -3.487 -10.016 3.768 1.00 2.22 H new ATOM 1987 N HIS A 129 -5.533 -7.425 0.007 1.00 74.04 N ATOM 1988 CA HIS A 129 -6.714 -7.100 -0.821 1.00 72.21 C ATOM 1989 C HIS A 129 -7.718 -8.274 -0.686 1.00 33.40 C ATOM 1990 O HIS A 129 -8.945 -8.110 -0.782 1.00 51.34 O ATOM 1991 CB HIS A 129 -6.268 -6.928 -2.293 1.00 4.24 C ATOM 1992 CG HIS A 129 -7.309 -6.366 -3.259 1.00 14.32 C ATOM 1993 ND1 HIS A 129 -6.972 -5.673 -4.398 1.00 52.21 N ATOM 1994 CD2 HIS A 129 -8.663 -6.434 -3.271 1.00 23.12 C ATOM 1995 CE1 HIS A 129 -8.063 -5.340 -5.065 1.00 23.30 C ATOM 1996 NE2 HIS A 129 -9.099 -5.793 -4.404 1.00 54.01 N ATOM 0 H HIS A 129 -4.666 -7.540 -0.518 1.00 74.04 H new ATOM 0 HA HIS A 129 -7.185 -6.172 -0.495 1.00 72.21 H new ATOM 0 HB2 HIS A 129 -5.397 -6.273 -2.311 1.00 4.24 H new ATOM 0 HB3 HIS A 129 -5.944 -7.899 -2.667 1.00 4.24 H new ATOM 0 HD2 HIS A 129 -9.285 -6.906 -2.525 1.00 23.12 H new ATOM 0 HE1 HIS A 129 -8.095 -4.790 -5.994 1.00 23.30 H new ATOM 0 HE2 HIS A 129 -10.073 -5.687 -4.686 1.00 54.01 H new ATOM 2004 N GLN A 130 -7.168 -9.436 -0.412 1.00 13.20 N ATOM 2005 CA GLN A 130 -7.923 -10.640 -0.235 1.00 31.40 C ATOM 2006 C GLN A 130 -8.626 -10.684 1.117 1.00 4.45 C ATOM 2007 O GLN A 130 -9.653 -11.315 1.266 1.00 32.44 O ATOM 2008 CB GLN A 130 -7.049 -11.872 -0.501 1.00 21.15 C ATOM 2009 CG GLN A 130 -7.658 -13.168 -0.041 1.00 41.41 C ATOM 2010 CD GLN A 130 -6.926 -14.361 -0.496 1.00 72.50 C ATOM 2011 OE1 GLN A 130 -6.841 -15.358 0.199 1.00 12.22 O ATOM 2012 NE2 GLN A 130 -6.532 -14.340 -1.696 1.00 20.42 N ATOM 0 H GLN A 130 -6.162 -9.565 -0.305 1.00 13.20 H new ATOM 0 HA GLN A 130 -8.722 -10.651 -0.976 1.00 31.40 H new ATOM 0 HB2 GLN A 130 -6.847 -11.937 -1.570 1.00 21.15 H new ATOM 0 HB3 GLN A 130 -6.089 -11.737 -0.003 1.00 21.15 H new ATOM 0 HG2 GLN A 130 -7.701 -13.173 1.048 1.00 41.41 H new ATOM 0 HG3 GLN A 130 -8.685 -13.224 -0.401 1.00 41.41 H new ATOM 0 HE21 GLN A 130 -6.620 -13.486 -2.247 1.00 20.42 H new ATOM 0 HE22 GLN A 130 -6.126 -15.177 -2.114 1.00 20.42 H new ATOM 2021 N SER A 131 -8.103 -9.969 2.055 1.00 2.33 N ATOM 2022 CA SER A 131 -8.683 -9.924 3.385 1.00 55.10 C ATOM 2023 C SER A 131 -9.994 -9.145 3.351 1.00 4.31 C ATOM 2024 O SER A 131 -10.888 -9.358 4.172 1.00 63.40 O ATOM 2025 CB SER A 131 -7.715 -9.247 4.344 1.00 62.32 C ATOM 2026 OG SER A 131 -6.437 -9.885 4.331 1.00 1.41 O ATOM 0 H SER A 131 -7.267 -9.397 1.938 1.00 2.33 H new ATOM 0 HA SER A 131 -8.877 -10.942 3.724 1.00 55.10 H new ATOM 0 HB2 SER A 131 -7.603 -8.198 4.070 1.00 62.32 H new ATOM 0 HB3 SER A 131 -8.125 -9.270 5.354 1.00 62.32 H new ATOM 0 HG SER A 131 -6.015 -9.790 5.210 1.00 1.41 H new ATOM 2032 N TRP A 132 -10.105 -8.250 2.386 1.00 0.13 N ATOM 2033 CA TRP A 132 -11.274 -7.404 2.286 1.00 42.25 C ATOM 2034 C TRP A 132 -12.289 -7.939 1.275 1.00 45.22 C ATOM 2035 O TRP A 132 -13.480 -7.981 1.546 1.00 11.25 O ATOM 2036 CB TRP A 132 -10.892 -5.993 1.868 1.00 32.24 C ATOM 2037 CG TRP A 132 -9.861 -5.306 2.719 1.00 43.50 C ATOM 2038 CD1 TRP A 132 -8.649 -4.850 2.296 1.00 21.44 C ATOM 2039 CD2 TRP A 132 -9.937 -5.006 4.120 1.00 40.44 C ATOM 2040 NE1 TRP A 132 -7.980 -4.260 3.333 1.00 32.22 N ATOM 2041 CE2 TRP A 132 -8.740 -4.352 4.467 1.00 42.20 C ATOM 2042 CE3 TRP A 132 -10.897 -5.220 5.110 1.00 34.00 C ATOM 2043 CZ2 TRP A 132 -8.478 -3.911 5.761 1.00 54.40 C ATOM 2044 CZ3 TRP A 132 -10.634 -4.786 6.396 1.00 53.32 C ATOM 2045 CH2 TRP A 132 -9.436 -4.139 6.710 1.00 11.23 C ATOM 0 H TRP A 132 -9.401 -8.093 1.664 1.00 0.13 H new ATOM 0 HA TRP A 132 -11.727 -7.396 3.278 1.00 42.25 H new ATOM 0 HB2 TRP A 132 -10.523 -6.027 0.843 1.00 32.24 H new ATOM 0 HB3 TRP A 132 -11.794 -5.381 1.862 1.00 32.24 H new ATOM 0 HD1 TRP A 132 -8.271 -4.941 1.288 1.00 21.44 H new ATOM 0 HE1 TRP A 132 -7.061 -3.821 3.271 1.00 32.22 H new ATOM 0 HE3 TRP A 132 -11.828 -5.715 4.876 1.00 34.00 H new ATOM 0 HZ2 TRP A 132 -7.554 -3.408 6.006 1.00 54.40 H new ATOM 0 HZ3 TRP A 132 -11.367 -4.950 7.172 1.00 53.32 H new ATOM 0 HH2 TRP A 132 -9.263 -3.812 7.725 1.00 11.23 H new ATOM 2056 N SER A 133 -11.811 -8.314 0.105 1.00 13.14 N ATOM 2057 CA SER A 133 -12.692 -8.717 -0.970 1.00 42.55 C ATOM 2058 C SER A 133 -12.379 -10.136 -1.447 1.00 3.43 C ATOM 2059 O SER A 133 -13.232 -10.815 -2.022 1.00 41.13 O ATOM 2060 CB SER A 133 -12.555 -7.707 -2.113 1.00 54.33 C ATOM 2061 OG SER A 133 -13.393 -8.001 -3.208 1.00 71.51 O ATOM 0 H SER A 133 -10.818 -8.348 -0.124 1.00 13.14 H new ATOM 0 HA SER A 133 -13.721 -8.729 -0.611 1.00 42.55 H new ATOM 0 HB2 SER A 133 -12.789 -6.710 -1.740 1.00 54.33 H new ATOM 0 HB3 SER A 133 -11.519 -7.686 -2.450 1.00 54.33 H new ATOM 0 HG SER A 133 -13.267 -7.326 -3.907 1.00 71.51 H new ATOM 2067 N GLY A 134 -11.167 -10.579 -1.201 1.00 32.42 N ATOM 2068 CA GLY A 134 -10.772 -11.912 -1.614 1.00 0.03 C ATOM 2069 C GLY A 134 -9.823 -11.900 -2.788 1.00 41.04 C ATOM 2070 O GLY A 134 -9.248 -12.933 -3.147 1.00 65.42 O ATOM 0 H GLY A 134 -10.442 -10.044 -0.722 1.00 32.42 H new ATOM 0 HA2 GLY A 134 -10.299 -12.423 -0.775 1.00 0.03 H new ATOM 0 HA3 GLY A 134 -11.661 -12.485 -1.876 1.00 0.03 H new ATOM 2074 N LYS A 135 -9.624 -10.728 -3.358 1.00 54.14 N ATOM 2075 CA LYS A 135 -8.782 -10.598 -4.531 1.00 63.33 C ATOM 2076 C LYS A 135 -7.313 -10.751 -4.178 1.00 60.51 C ATOM 2077 O LYS A 135 -6.773 -10.037 -3.311 1.00 51.21 O ATOM 2078 CB LYS A 135 -9.095 -9.316 -5.297 1.00 53.34 C ATOM 2079 CG LYS A 135 -8.214 -9.076 -6.516 1.00 51.22 C ATOM 2080 CD LYS A 135 -8.796 -8.010 -7.437 1.00 72.54 C ATOM 2081 CE LYS A 135 -10.120 -8.476 -8.051 1.00 20.24 C ATOM 2082 NZ LYS A 135 -10.709 -7.474 -8.947 1.00 32.14 N ATOM 0 H LYS A 135 -10.033 -9.853 -3.029 1.00 54.14 H new ATOM 0 HA LYS A 135 -9.011 -11.418 -5.212 1.00 63.33 H new ATOM 0 HB2 LYS A 135 -10.136 -9.345 -5.617 1.00 53.34 H new ATOM 0 HB3 LYS A 135 -8.993 -8.469 -4.619 1.00 53.34 H new ATOM 0 HG2 LYS A 135 -7.219 -8.771 -6.191 1.00 51.22 H new ATOM 0 HG3 LYS A 135 -8.097 -10.008 -7.068 1.00 51.22 H new ATOM 0 HD2 LYS A 135 -8.955 -7.089 -6.877 1.00 72.54 H new ATOM 0 HD3 LYS A 135 -8.084 -7.782 -8.230 1.00 72.54 H new ATOM 0 HE2 LYS A 135 -9.954 -9.400 -8.604 1.00 20.24 H new ATOM 0 HE3 LYS A 135 -10.826 -8.704 -7.253 1.00 20.24 H new ATOM 0 HZ1 LYS A 135 -11.602 -7.838 -9.336 1.00 32.14 H new ATOM 0 HZ2 LYS A 135 -10.894 -6.599 -8.416 1.00 32.14 H new ATOM 0 HZ3 LYS A 135 -10.049 -7.274 -9.725 1.00 32.14 H new ATOM 2096 N TYR A 136 -6.681 -11.676 -4.845 1.00 31.24 N ATOM 2097 CA TYR A 136 -5.353 -12.092 -4.541 1.00 2.53 C ATOM 2098 C TYR A 136 -4.344 -11.109 -5.107 1.00 64.01 C ATOM 2099 O TYR A 136 -4.017 -11.137 -6.285 1.00 35.44 O ATOM 2100 CB TYR A 136 -5.153 -13.482 -5.160 1.00 72.25 C ATOM 2101 CG TYR A 136 -4.059 -14.340 -4.579 1.00 25.02 C ATOM 2102 CD1 TYR A 136 -4.043 -14.629 -3.238 1.00 10.42 C ATOM 2103 CD2 TYR A 136 -3.078 -14.902 -5.376 1.00 24.22 C ATOM 2104 CE1 TYR A 136 -3.087 -15.442 -2.694 1.00 51.31 C ATOM 2105 CE2 TYR A 136 -2.118 -15.731 -4.834 1.00 2.30 C ATOM 2106 CZ TYR A 136 -2.134 -15.991 -3.488 1.00 52.43 C ATOM 2107 OH TYR A 136 -1.197 -16.808 -2.940 1.00 72.40 O ATOM 0 H TYR A 136 -7.093 -12.171 -5.636 1.00 31.24 H new ATOM 0 HA TYR A 136 -5.203 -12.129 -3.462 1.00 2.53 H new ATOM 0 HB2 TYR A 136 -6.092 -14.028 -5.076 1.00 72.25 H new ATOM 0 HB3 TYR A 136 -4.953 -13.353 -6.224 1.00 72.25 H new ATOM 0 HD1 TYR A 136 -4.802 -14.205 -2.598 1.00 10.42 H new ATOM 0 HD2 TYR A 136 -3.064 -14.689 -6.435 1.00 24.22 H new ATOM 0 HE1 TYR A 136 -3.091 -15.647 -1.634 1.00 51.31 H new ATOM 0 HE2 TYR A 136 -1.360 -16.172 -5.465 1.00 2.30 H new ATOM 0 HH TYR A 136 -1.577 -17.702 -2.813 1.00 72.40 H new ATOM 2117 N CYS A 137 -3.895 -10.228 -4.269 1.00 63.55 N ATOM 2118 CA CYS A 137 -2.819 -9.303 -4.652 1.00 43.02 C ATOM 2119 C CYS A 137 -1.469 -9.688 -4.111 1.00 44.00 C ATOM 2120 O CYS A 137 -0.540 -9.891 -4.893 1.00 40.14 O ATOM 2121 CB CYS A 137 -3.134 -7.816 -4.447 1.00 43.05 C ATOM 2122 SG CYS A 137 -4.120 -7.150 -5.758 1.00 21.43 S ATOM 0 H CYS A 137 -4.239 -10.112 -3.316 1.00 63.55 H new ATOM 0 HA CYS A 137 -2.761 -9.424 -5.734 1.00 43.02 H new ATOM 0 HB2 CYS A 137 -3.657 -7.685 -3.500 1.00 43.05 H new ATOM 0 HB3 CYS A 137 -2.202 -7.256 -4.376 1.00 43.05 H new ATOM 0 HG CYS A 137 -5.198 -6.618 -5.263 1.00 21.43 H new ATOM 2127 N PRO A 138 -1.301 -9.804 -2.775 1.00 53.34 N ATOM 2128 CA PRO A 138 -0.026 -10.219 -2.198 1.00 41.24 C ATOM 2129 C PRO A 138 0.218 -11.732 -2.395 1.00 34.13 C ATOM 2130 O PRO A 138 0.450 -12.455 -1.449 1.00 42.22 O ATOM 2131 CB PRO A 138 -0.186 -9.868 -0.721 1.00 10.55 C ATOM 2132 CG PRO A 138 -1.629 -9.948 -0.464 1.00 33.23 C ATOM 2133 CD PRO A 138 -2.307 -9.519 -1.718 1.00 3.23 C ATOM 0 HA PRO A 138 0.832 -9.733 -2.663 1.00 41.24 H new ATOM 0 HB2 PRO A 138 0.366 -10.563 -0.088 1.00 10.55 H new ATOM 0 HB3 PRO A 138 0.198 -8.870 -0.509 1.00 10.55 H new ATOM 0 HG2 PRO A 138 -1.919 -10.963 -0.194 1.00 33.23 H new ATOM 0 HG3 PRO A 138 -1.911 -9.304 0.369 1.00 33.23 H new ATOM 0 HD2 PRO A 138 -3.231 -10.073 -1.884 1.00 3.23 H new ATOM 0 HD3 PRO A 138 -2.570 -8.462 -1.690 1.00 3.23 H new ATOM 2141 N HIS A 139 0.192 -12.158 -3.652 1.00 12.31 N ATOM 2142 CA HIS A 139 0.373 -13.544 -4.072 1.00 42.13 C ATOM 2143 C HIS A 139 1.668 -14.161 -3.497 1.00 71.42 C ATOM 2144 O HIS A 139 1.648 -15.235 -2.915 1.00 2.11 O ATOM 2145 CB HIS A 139 0.347 -13.634 -5.634 1.00 40.23 C ATOM 2146 CG HIS A 139 1.514 -12.972 -6.353 1.00 41.31 C ATOM 2147 ND1 HIS A 139 1.636 -11.607 -6.574 1.00 3.21 N ATOM 2148 CD2 HIS A 139 2.643 -13.527 -6.861 1.00 60.33 C ATOM 2149 CE1 HIS A 139 2.814 -11.398 -7.189 1.00 54.44 C ATOM 2150 NE2 HIS A 139 3.456 -12.529 -7.384 1.00 22.22 N ATOM 0 H HIS A 139 0.039 -11.525 -4.437 1.00 12.31 H new ATOM 0 HA HIS A 139 -0.455 -14.129 -3.670 1.00 42.13 H new ATOM 0 HB2 HIS A 139 0.318 -14.686 -5.918 1.00 40.23 H new ATOM 0 HB3 HIS A 139 -0.579 -13.182 -5.990 1.00 40.23 H new ATOM 0 HD1 HIS A 139 0.956 -10.892 -6.317 1.00 3.21 H new ATOM 0 HD2 HIS A 139 2.874 -14.582 -6.859 1.00 60.33 H new ATOM 0 HE1 HIS A 139 3.184 -10.427 -7.484 1.00 54.44 H new ATOM 2158 N ARG A 140 2.767 -13.442 -3.637 1.00 32.53 N ATOM 2159 CA ARG A 140 4.071 -13.881 -3.181 1.00 3.14 C ATOM 2160 C ARG A 140 4.055 -14.014 -1.659 1.00 43.13 C ATOM 2161 O ARG A 140 4.616 -14.942 -1.079 1.00 22.21 O ATOM 2162 CB ARG A 140 5.114 -12.826 -3.608 1.00 51.15 C ATOM 2163 CG ARG A 140 6.567 -13.163 -3.271 1.00 50.35 C ATOM 2164 CD ARG A 140 7.075 -14.372 -4.039 1.00 72.01 C ATOM 2165 NE ARG A 140 8.488 -14.661 -3.730 1.00 11.20 N ATOM 2166 CZ ARG A 140 9.360 -15.247 -4.572 1.00 32.10 C ATOM 2167 NH1 ARG A 140 8.956 -15.680 -5.761 1.00 75.43 N ATOM 2168 NH2 ARG A 140 10.631 -15.410 -4.210 1.00 13.34 N ATOM 0 H ARG A 140 2.777 -12.522 -4.078 1.00 32.53 H new ATOM 0 HA ARG A 140 4.323 -14.848 -3.616 1.00 3.14 H new ATOM 0 HB2 ARG A 140 5.034 -12.677 -4.685 1.00 51.15 H new ATOM 0 HB3 ARG A 140 4.860 -11.877 -3.135 1.00 51.15 H new ATOM 0 HG2 ARG A 140 7.198 -12.303 -3.495 1.00 50.35 H new ATOM 0 HG3 ARG A 140 6.654 -13.353 -2.201 1.00 50.35 H new ATOM 0 HD2 ARG A 140 6.464 -15.241 -3.795 1.00 72.01 H new ATOM 0 HD3 ARG A 140 6.965 -14.196 -5.109 1.00 72.01 H new ATOM 0 HE ARG A 140 8.831 -14.396 -2.807 1.00 11.20 H new ATOM 0 HH11 ARG A 140 7.981 -15.569 -6.040 1.00 75.43 H new ATOM 0 HH12 ARG A 140 9.621 -16.123 -6.395 1.00 75.43 H new ATOM 0 HH21 ARG A 140 10.945 -15.091 -3.294 1.00 13.34 H new ATOM 0 HH22 ARG A 140 11.290 -15.854 -4.849 1.00 13.34 H new ATOM 2182 N MET A 141 3.378 -13.096 -1.043 1.00 2.13 N ATOM 2183 CA MET A 141 3.302 -13.009 0.388 1.00 62.54 C ATOM 2184 C MET A 141 2.374 -14.082 0.956 1.00 13.44 C ATOM 2185 O MET A 141 2.687 -14.714 1.960 1.00 1.33 O ATOM 2186 CB MET A 141 2.856 -11.606 0.771 1.00 4.55 C ATOM 2187 CG MET A 141 3.699 -10.539 0.078 1.00 44.02 C ATOM 2188 SD MET A 141 3.117 -8.856 0.294 1.00 11.31 S ATOM 2189 CE MET A 141 3.491 -8.600 1.997 1.00 15.21 C ATOM 0 H MET A 141 2.851 -12.370 -1.528 1.00 2.13 H new ATOM 0 HA MET A 141 4.285 -13.194 0.821 1.00 62.54 H new ATOM 0 HB2 MET A 141 1.808 -11.472 0.505 1.00 4.55 H new ATOM 0 HB3 MET A 141 2.929 -11.483 1.852 1.00 4.55 H new ATOM 0 HG2 MET A 141 4.721 -10.605 0.452 1.00 44.02 H new ATOM 0 HG3 MET A 141 3.735 -10.761 -0.988 1.00 44.02 H new ATOM 0 HE1 MET A 141 2.724 -7.970 2.447 1.00 15.21 H new ATOM 0 HE2 MET A 141 3.520 -9.560 2.512 1.00 15.21 H new ATOM 0 HE3 MET A 141 4.461 -8.111 2.087 1.00 15.21 H new ATOM 2199 N LEU A 142 1.254 -14.294 0.311 1.00 50.12 N ATOM 2200 CA LEU A 142 0.285 -15.280 0.753 1.00 1.51 C ATOM 2201 C LEU A 142 0.710 -16.711 0.438 1.00 21.45 C ATOM 2202 O LEU A 142 0.768 -17.548 1.332 1.00 22.01 O ATOM 2203 CB LEU A 142 -1.105 -14.974 0.190 1.00 24.13 C ATOM 2204 CG LEU A 142 -1.803 -13.721 0.755 1.00 61.21 C ATOM 2205 CD1 LEU A 142 -3.088 -13.422 -0.006 1.00 71.41 C ATOM 2206 CD2 LEU A 142 -2.135 -13.938 2.219 1.00 42.13 C ATOM 0 H LEU A 142 0.984 -13.792 -0.535 1.00 50.12 H new ATOM 0 HA LEU A 142 0.238 -15.207 1.840 1.00 1.51 H new ATOM 0 HB2 LEU A 142 -1.021 -14.862 -0.891 1.00 24.13 H new ATOM 0 HB3 LEU A 142 -1.747 -15.836 0.372 1.00 24.13 H new ATOM 0 HG LEU A 142 -1.124 -12.875 0.645 1.00 61.21 H new ATOM 0 HD11 LEU A 142 -3.560 -12.533 0.413 1.00 71.41 H new ATOM 0 HD12 LEU A 142 -2.857 -13.249 -1.057 1.00 71.41 H new ATOM 0 HD13 LEU A 142 -3.768 -14.270 0.081 1.00 71.41 H new ATOM 0 HD21 LEU A 142 -2.628 -13.051 2.616 1.00 42.13 H new ATOM 0 HD22 LEU A 142 -2.799 -14.797 2.318 1.00 42.13 H new ATOM 0 HD23 LEU A 142 -1.217 -14.123 2.777 1.00 42.13 H new ATOM 2218 N ALA A 143 1.052 -16.981 -0.807 1.00 54.31 N ATOM 2219 CA ALA A 143 1.385 -18.334 -1.218 1.00 31.01 C ATOM 2220 C ALA A 143 2.703 -18.771 -0.649 1.00 43.14 C ATOM 2221 O ALA A 143 2.843 -19.897 -0.157 1.00 13.10 O ATOM 2222 CB ALA A 143 1.423 -18.451 -2.735 1.00 12.34 C ATOM 0 H ALA A 143 1.107 -16.285 -1.550 1.00 54.31 H new ATOM 0 HA ALA A 143 0.603 -18.987 -0.830 1.00 31.01 H new ATOM 0 HB1 ALA A 143 1.675 -19.474 -3.015 1.00 12.34 H new ATOM 0 HB2 ALA A 143 0.446 -18.193 -3.144 1.00 12.34 H new ATOM 0 HB3 ALA A 143 2.175 -17.770 -3.134 1.00 12.34 H new ATOM 2228 N GLU A 144 3.665 -17.889 -0.671 1.00 35.44 N ATOM 2229 CA GLU A 144 4.985 -18.264 -0.273 1.00 71.24 C ATOM 2230 C GLU A 144 5.289 -17.877 1.161 1.00 54.13 C ATOM 2231 O GLU A 144 6.432 -17.962 1.613 1.00 72.35 O ATOM 2232 CB GLU A 144 6.014 -17.765 -1.277 1.00 54.33 C ATOM 2233 CG GLU A 144 5.674 -18.235 -2.686 1.00 74.32 C ATOM 2234 CD GLU A 144 6.819 -18.152 -3.653 1.00 10.42 C ATOM 2235 OE1 GLU A 144 7.809 -18.904 -3.476 1.00 51.13 O ATOM 2236 OE2 GLU A 144 6.744 -17.379 -4.610 1.00 60.12 O ATOM 0 H GLU A 144 3.557 -16.916 -0.958 1.00 35.44 H new ATOM 0 HA GLU A 144 5.046 -19.352 -0.283 1.00 71.24 H new ATOM 0 HB2 GLU A 144 6.053 -16.676 -1.252 1.00 54.33 H new ATOM 0 HB3 GLU A 144 7.004 -18.126 -0.998 1.00 54.33 H new ATOM 0 HG2 GLU A 144 5.326 -19.267 -2.639 1.00 74.32 H new ATOM 0 HG3 GLU A 144 4.846 -17.637 -3.067 1.00 74.32 H new ATOM 2243 N GLY A 145 4.244 -17.478 1.879 1.00 35.04 N ATOM 2244 CA GLY A 145 4.358 -17.221 3.300 1.00 72.00 C ATOM 2245 C GLY A 145 5.282 -16.084 3.645 1.00 25.11 C ATOM 2246 O GLY A 145 6.076 -16.186 4.569 1.00 1.42 O ATOM 0 H GLY A 145 3.311 -17.327 1.495 1.00 35.04 H new ATOM 0 HA2 GLY A 145 3.367 -17.005 3.700 1.00 72.00 H new ATOM 0 HA3 GLY A 145 4.711 -18.126 3.795 1.00 72.00 H new ATOM 2250 N ARG A 146 5.229 -15.025 2.888 1.00 1.45 N ATOM 2251 CA ARG A 146 6.039 -13.864 3.188 1.00 43.13 C ATOM 2252 C ARG A 146 5.208 -12.780 3.846 1.00 32.33 C ATOM 2253 O ARG A 146 5.747 -11.788 4.296 1.00 10.32 O ATOM 2254 CB ARG A 146 6.763 -13.308 1.943 1.00 50.21 C ATOM 2255 CG ARG A 146 7.736 -14.270 1.246 1.00 74.43 C ATOM 2256 CD ARG A 146 8.935 -14.669 2.126 1.00 52.40 C ATOM 2257 NE ARG A 146 8.559 -15.486 3.293 1.00 54.24 N ATOM 2258 CZ ARG A 146 9.410 -15.961 4.208 1.00 21.14 C ATOM 2259 NH1 ARG A 146 10.716 -15.767 4.077 1.00 2.12 N ATOM 2260 NH2 ARG A 146 8.946 -16.653 5.243 1.00 0.41 N ATOM 0 H ARG A 146 4.639 -14.935 2.061 1.00 1.45 H new ATOM 0 HA ARG A 146 6.809 -14.193 3.886 1.00 43.13 H new ATOM 0 HB2 ARG A 146 6.011 -12.995 1.219 1.00 50.21 H new ATOM 0 HB3 ARG A 146 7.314 -12.414 2.236 1.00 50.21 H new ATOM 0 HG2 ARG A 146 7.197 -15.170 0.950 1.00 74.43 H new ATOM 0 HG3 ARG A 146 8.104 -13.804 0.332 1.00 74.43 H new ATOM 0 HD2 ARG A 146 9.652 -15.223 1.520 1.00 52.40 H new ATOM 0 HD3 ARG A 146 9.439 -13.766 2.471 1.00 52.40 H new ATOM 0 HE ARG A 146 7.570 -15.707 3.412 1.00 54.24 H new ATOM 0 HH11 ARG A 146 11.077 -15.252 3.274 1.00 2.12 H new ATOM 0 HH12 ARG A 146 11.359 -16.133 4.779 1.00 2.12 H new ATOM 0 HH21 ARG A 146 7.944 -16.820 5.337 1.00 0.41 H new ATOM 0 HH22 ARG A 146 9.592 -17.017 5.944 1.00 0.41 H new ATOM 2274 N TRP A 147 3.878 -12.981 3.914 1.00 42.13 N ATOM 2275 CA TRP A 147 2.993 -11.972 4.516 1.00 24.13 C ATOM 2276 C TRP A 147 3.311 -11.762 5.986 1.00 24.04 C ATOM 2277 O TRP A 147 3.542 -10.635 6.422 1.00 72.01 O ATOM 2278 CB TRP A 147 1.491 -12.308 4.352 1.00 2.50 C ATOM 2279 CG TRP A 147 0.621 -11.237 4.946 1.00 3.12 C ATOM 2280 CD1 TRP A 147 0.105 -11.208 6.199 1.00 71.12 C ATOM 2281 CD2 TRP A 147 0.203 -10.036 4.318 1.00 14.01 C ATOM 2282 NE1 TRP A 147 -0.581 -10.047 6.408 1.00 71.32 N ATOM 2283 CE2 TRP A 147 -0.553 -9.312 5.261 1.00 72.41 C ATOM 2284 CE3 TRP A 147 0.392 -9.498 3.056 1.00 42.23 C ATOM 2285 CZ2 TRP A 147 -1.109 -8.078 4.972 1.00 41.40 C ATOM 2286 CZ3 TRP A 147 -0.160 -8.281 2.766 1.00 33.31 C ATOM 2287 CH2 TRP A 147 -0.905 -7.577 3.721 1.00 41.04 C ATOM 0 H TRP A 147 3.403 -13.814 3.567 1.00 42.13 H new ATOM 0 HA TRP A 147 3.185 -11.049 3.969 1.00 24.13 H new ATOM 0 HB2 TRP A 147 1.256 -12.424 3.294 1.00 2.50 H new ATOM 0 HB3 TRP A 147 1.276 -13.262 4.833 1.00 2.50 H new ATOM 0 HD1 TRP A 147 0.221 -11.994 6.930 1.00 71.12 H new ATOM 0 HE1 TRP A 147 -1.039 -9.775 7.278 1.00 71.32 H new ATOM 0 HE3 TRP A 147 0.966 -10.031 2.313 1.00 42.23 H new ATOM 0 HZ2 TRP A 147 -1.682 -7.534 5.708 1.00 41.40 H new ATOM 0 HZ3 TRP A 147 -0.019 -7.855 1.784 1.00 33.31 H new ATOM 0 HH2 TRP A 147 -1.326 -6.617 3.461 1.00 41.04 H new ATOM 2298 N GLY A 148 3.327 -12.847 6.742 1.00 71.32 N ATOM 2299 CA GLY A 148 3.613 -12.758 8.146 1.00 54.13 C ATOM 2300 C GLY A 148 4.985 -12.212 8.377 1.00 14.45 C ATOM 2301 O GLY A 148 5.168 -11.335 9.198 1.00 52.35 O ATOM 0 H GLY A 148 3.145 -13.791 6.400 1.00 71.32 H new ATOM 0 HA2 GLY A 148 2.876 -12.118 8.632 1.00 54.13 H new ATOM 0 HA3 GLY A 148 3.528 -13.745 8.602 1.00 54.13 H new ATOM 2305 N ALA A 149 5.943 -12.709 7.609 1.00 71.32 N ATOM 2306 CA ALA A 149 7.317 -12.255 7.701 1.00 65.42 C ATOM 2307 C ALA A 149 7.406 -10.748 7.429 1.00 2.25 C ATOM 2308 O ALA A 149 8.133 -10.029 8.122 1.00 44.23 O ATOM 2309 CB ALA A 149 8.200 -13.042 6.749 1.00 3.53 C ATOM 0 H ALA A 149 5.788 -13.434 6.909 1.00 71.32 H new ATOM 0 HA ALA A 149 7.677 -12.431 8.715 1.00 65.42 H new ATOM 0 HB1 ALA A 149 9.228 -12.689 6.830 1.00 3.53 H new ATOM 0 HB2 ALA A 149 8.159 -14.101 7.005 1.00 3.53 H new ATOM 0 HB3 ALA A 149 7.848 -12.902 5.727 1.00 3.53 H new ATOM 2315 N PHE A 150 6.644 -10.272 6.433 1.00 14.40 N ATOM 2316 CA PHE A 150 6.561 -8.850 6.139 1.00 15.23 C ATOM 2317 C PHE A 150 6.034 -8.107 7.350 1.00 24.40 C ATOM 2318 O PHE A 150 6.622 -7.126 7.778 1.00 1.05 O ATOM 2319 CB PHE A 150 5.667 -8.597 4.916 1.00 74.43 C ATOM 2320 CG PHE A 150 5.490 -7.140 4.547 1.00 51.52 C ATOM 2321 CD1 PHE A 150 6.578 -6.358 4.247 1.00 13.41 C ATOM 2322 CD2 PHE A 150 4.223 -6.560 4.497 1.00 41.24 C ATOM 2323 CE1 PHE A 150 6.420 -5.034 3.906 1.00 64.31 C ATOM 2324 CE2 PHE A 150 4.064 -5.228 4.149 1.00 60.14 C ATOM 2325 CZ PHE A 150 5.166 -4.469 3.855 1.00 54.33 C ATOM 0 H PHE A 150 6.078 -10.860 5.821 1.00 14.40 H new ATOM 0 HA PHE A 150 7.559 -8.481 5.904 1.00 15.23 H new ATOM 0 HB2 PHE A 150 6.089 -9.125 4.061 1.00 74.43 H new ATOM 0 HB3 PHE A 150 4.685 -9.031 5.106 1.00 74.43 H new ATOM 0 HD1 PHE A 150 7.569 -6.787 4.279 1.00 13.41 H new ATOM 0 HD2 PHE A 150 3.354 -7.157 4.733 1.00 41.24 H new ATOM 0 HE1 PHE A 150 7.288 -4.433 3.676 1.00 64.31 H new ATOM 0 HE2 PHE A 150 3.077 -4.791 4.110 1.00 60.14 H new ATOM 0 HZ PHE A 150 5.051 -3.430 3.584 1.00 54.33 H new ATOM 2335 N ILE A 151 4.945 -8.606 7.911 1.00 73.31 N ATOM 2336 CA ILE A 151 4.345 -8.052 9.093 1.00 5.31 C ATOM 2337 C ILE A 151 5.326 -8.029 10.289 1.00 13.11 C ATOM 2338 O ILE A 151 5.347 -7.060 11.065 1.00 71.42 O ATOM 2339 CB ILE A 151 2.966 -8.744 9.383 1.00 42.40 C ATOM 2340 CG1 ILE A 151 1.805 -7.999 8.690 1.00 42.12 C ATOM 2341 CG2 ILE A 151 2.689 -8.974 10.838 1.00 23.13 C ATOM 2342 CD1 ILE A 151 1.945 -7.851 7.193 1.00 44.31 C ATOM 0 H ILE A 151 4.452 -9.421 7.545 1.00 73.31 H new ATOM 0 HA ILE A 151 4.120 -7.000 8.918 1.00 5.31 H new ATOM 0 HB ILE A 151 3.042 -9.740 8.947 1.00 42.40 H new ATOM 0 HG12 ILE A 151 0.876 -8.528 8.902 1.00 42.12 H new ATOM 0 HG13 ILE A 151 1.715 -7.006 9.131 1.00 42.12 H new ATOM 0 HG21 ILE A 151 1.718 -9.455 10.952 1.00 23.13 H new ATOM 0 HG22 ILE A 151 3.463 -9.615 11.259 1.00 23.13 H new ATOM 0 HG23 ILE A 151 2.684 -8.019 11.363 1.00 23.13 H new ATOM 0 HD11 ILE A 151 1.082 -7.315 6.798 1.00 44.31 H new ATOM 0 HD12 ILE A 151 2.853 -7.293 6.966 1.00 44.31 H new ATOM 0 HD13 ILE A 151 2.001 -8.838 6.733 1.00 44.31 H new ATOM 2354 N GLN A 152 6.163 -9.064 10.416 1.00 75.32 N ATOM 2355 CA GLN A 152 7.227 -9.024 11.410 1.00 41.21 C ATOM 2356 C GLN A 152 8.207 -7.901 11.125 1.00 53.34 C ATOM 2357 O GLN A 152 8.583 -7.182 12.034 1.00 13.01 O ATOM 2358 CB GLN A 152 7.986 -10.358 11.609 1.00 71.34 C ATOM 2359 CG GLN A 152 7.326 -11.377 12.546 1.00 32.40 C ATOM 2360 CD GLN A 152 6.022 -11.944 12.059 1.00 1.54 C ATOM 2361 OE1 GLN A 152 5.998 -12.973 11.376 1.00 62.23 O ATOM 2362 NE2 GLN A 152 4.940 -11.314 12.416 1.00 2.43 N ATOM 0 H GLN A 152 6.124 -9.916 9.857 1.00 75.32 H new ATOM 0 HA GLN A 152 6.712 -8.834 12.352 1.00 41.21 H new ATOM 0 HB2 GLN A 152 8.120 -10.825 10.633 1.00 71.34 H new ATOM 0 HB3 GLN A 152 8.981 -10.133 11.993 1.00 71.34 H new ATOM 0 HG2 GLN A 152 8.022 -12.199 12.711 1.00 32.40 H new ATOM 0 HG3 GLN A 152 7.159 -10.902 13.513 1.00 32.40 H new ATOM 0 HE21 GLN A 152 5.006 -10.467 12.981 1.00 2.43 H new ATOM 0 HE22 GLN A 152 4.027 -11.667 12.131 1.00 2.43 H new ATOM 2371 N LYS A 153 8.609 -7.739 9.864 1.00 71.31 N ATOM 2372 CA LYS A 153 9.536 -6.682 9.485 1.00 63.52 C ATOM 2373 C LYS A 153 8.927 -5.294 9.713 1.00 13.20 C ATOM 2374 O LYS A 153 9.603 -4.414 10.244 1.00 34.32 O ATOM 2375 CB LYS A 153 9.949 -6.846 8.032 1.00 14.23 C ATOM 2376 CG LYS A 153 10.676 -8.145 7.728 1.00 2.41 C ATOM 2377 CD LYS A 153 10.722 -8.403 6.231 1.00 63.24 C ATOM 2378 CE LYS A 153 11.533 -7.360 5.444 1.00 75.43 C ATOM 2379 NZ LYS A 153 12.983 -7.366 5.787 1.00 43.31 N ATOM 0 H LYS A 153 8.305 -8.329 9.090 1.00 71.31 H new ATOM 0 HA LYS A 153 10.419 -6.765 10.119 1.00 63.52 H new ATOM 0 HB2 LYS A 153 9.059 -6.787 7.405 1.00 14.23 H new ATOM 0 HB3 LYS A 153 10.591 -6.011 7.753 1.00 14.23 H new ATOM 0 HG2 LYS A 153 11.690 -8.100 8.125 1.00 2.41 H new ATOM 0 HG3 LYS A 153 10.174 -8.973 8.229 1.00 2.41 H new ATOM 0 HD2 LYS A 153 11.150 -9.390 6.055 1.00 63.24 H new ATOM 0 HD3 LYS A 153 9.703 -8.424 5.844 1.00 63.24 H new ATOM 0 HE2 LYS A 153 11.418 -7.549 4.377 1.00 75.43 H new ATOM 0 HE3 LYS A 153 11.124 -6.369 5.638 1.00 75.43 H new ATOM 0 HZ1 LYS A 153 13.519 -6.882 5.038 1.00 43.31 H new ATOM 0 HZ2 LYS A 153 13.128 -6.872 6.691 1.00 43.31 H new ATOM 0 HZ3 LYS A 153 13.316 -8.348 5.872 1.00 43.31 H new ATOM 2393 N VAL A 154 7.664 -5.105 9.318 1.00 2.12 N ATOM 2394 CA VAL A 154 6.966 -3.828 9.483 1.00 73.31 C ATOM 2395 C VAL A 154 6.862 -3.430 10.957 1.00 52.31 C ATOM 2396 O VAL A 154 6.903 -2.243 11.283 1.00 72.34 O ATOM 2397 CB VAL A 154 5.548 -3.866 8.874 1.00 0.50 C ATOM 2398 CG1 VAL A 154 4.873 -2.538 9.016 1.00 53.41 C ATOM 2399 CG2 VAL A 154 5.578 -4.284 7.436 1.00 12.55 C ATOM 0 H VAL A 154 7.099 -5.831 8.877 1.00 2.12 H new ATOM 0 HA VAL A 154 7.561 -3.086 8.951 1.00 73.31 H new ATOM 0 HB VAL A 154 4.975 -4.610 9.427 1.00 0.50 H new ATOM 0 HG11 VAL A 154 3.875 -2.588 8.580 1.00 53.41 H new ATOM 0 HG12 VAL A 154 4.795 -2.281 10.072 1.00 53.41 H new ATOM 0 HG13 VAL A 154 5.457 -1.776 8.499 1.00 53.41 H new ATOM 0 HG21 VAL A 154 4.562 -4.300 7.040 1.00 12.55 H new ATOM 0 HG22 VAL A 154 6.179 -3.577 6.864 1.00 12.55 H new ATOM 0 HG23 VAL A 154 6.014 -5.280 7.356 1.00 12.55 H new ATOM 2409 N LYS A 155 6.772 -4.439 11.837 1.00 1.31 N ATOM 2410 CA LYS A 155 6.632 -4.231 13.281 1.00 3.23 C ATOM 2411 C LYS A 155 7.696 -3.234 13.793 1.00 62.21 C ATOM 2412 O LYS A 155 7.386 -2.332 14.558 1.00 11.43 O ATOM 2413 CB LYS A 155 6.779 -5.596 14.012 1.00 24.45 C ATOM 2414 CG LYS A 155 6.614 -5.559 15.539 1.00 61.12 C ATOM 2415 CD LYS A 155 5.190 -5.201 15.974 1.00 74.52 C ATOM 2416 CE LYS A 155 4.169 -6.283 15.613 1.00 20.32 C ATOM 2417 NZ LYS A 155 4.436 -7.575 16.291 1.00 20.41 N ATOM 0 H LYS A 155 6.795 -5.422 11.564 1.00 1.31 H new ATOM 0 HA LYS A 155 5.647 -3.811 13.487 1.00 3.23 H new ATOM 0 HB2 LYS A 155 6.042 -6.287 13.603 1.00 24.45 H new ATOM 0 HB3 LYS A 155 7.762 -6.006 13.782 1.00 24.45 H new ATOM 0 HG2 LYS A 155 6.882 -6.531 15.952 1.00 61.12 H new ATOM 0 HG3 LYS A 155 7.310 -4.832 15.958 1.00 61.12 H new ATOM 0 HD2 LYS A 155 5.174 -5.038 17.052 1.00 74.52 H new ATOM 0 HD3 LYS A 155 4.897 -4.261 15.506 1.00 74.52 H new ATOM 0 HE2 LYS A 155 3.170 -5.937 15.880 1.00 20.32 H new ATOM 0 HE3 LYS A 155 4.175 -6.436 14.534 1.00 20.32 H new ATOM 0 HZ1 LYS A 155 3.622 -8.209 16.162 1.00 20.41 H new ATOM 0 HZ2 LYS A 155 5.285 -8.013 15.881 1.00 20.41 H new ATOM 0 HZ3 LYS A 155 4.588 -7.409 17.306 1.00 20.41 H new ATOM 2431 N ASN A 156 8.946 -3.402 13.378 1.00 71.00 N ATOM 2432 CA ASN A 156 10.002 -2.430 13.788 1.00 50.23 C ATOM 2433 C ASN A 156 10.477 -1.587 12.636 1.00 11.30 C ATOM 2434 O ASN A 156 10.751 -0.409 12.789 1.00 63.41 O ATOM 2435 CB ASN A 156 11.229 -3.085 14.443 1.00 53.41 C ATOM 2436 CG ASN A 156 10.993 -3.691 15.829 1.00 52.24 C ATOM 2437 OD1 ASN A 156 11.912 -3.756 16.644 1.00 70.34 O ATOM 2438 ND2 ASN A 156 9.794 -4.113 16.112 1.00 55.24 N ATOM 0 H ASN A 156 9.265 -4.165 12.781 1.00 71.00 H new ATOM 0 HA ASN A 156 9.510 -1.804 14.532 1.00 50.23 H new ATOM 0 HB2 ASN A 156 11.597 -3.869 13.781 1.00 53.41 H new ATOM 0 HB3 ASN A 156 12.019 -2.338 14.522 1.00 53.41 H new ATOM 0 HD21 ASN A 156 9.597 -4.511 17.030 1.00 55.24 H new ATOM 0 HD22 ASN A 156 9.052 -4.046 15.415 1.00 55.24 H new ATOM 2445 N GLY A 157 10.556 -2.189 11.483 1.00 51.41 N ATOM 2446 CA GLY A 157 11.164 -1.543 10.355 1.00 21.23 C ATOM 2447 C GLY A 157 12.400 -2.302 9.930 1.00 14.04 C ATOM 2448 O GLY A 157 13.512 -1.809 10.055 1.00 24.04 O ATOM 0 H GLY A 157 10.206 -3.129 11.300 1.00 51.41 H new ATOM 0 HA2 GLY A 157 10.455 -1.493 9.528 1.00 21.23 H new ATOM 0 HA3 GLY A 157 11.427 -0.517 10.611 1.00 21.23 H new