USER MOD reduce.3.24.130724 H: found=0, std=0, add=1194, rem=0, adj=45 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 95 LYS NZ :NH3+ 174:sc= 1.7 (180deg=1.09) USER MOD Set 1.2: A 96 SER OG : rot 180:sc= 0.453 USER MOD Set 2.1: A 29 HIS : no HD1:sc= -1.02 K(o=-15,f=-14) USER MOD Set 2.2: A 75 CYS SG : rot -19:sc= -6.1! USER MOD Set 2.3: A 129 HIS : no HD1:sc= -7.94! C(o=-15!,f=-14!) USER MOD Set 2.4: A 137 CYS SG : rot 119:sc= 0.413 USER MOD Set 3.1: A 30 ASN : amide:sc= -5.3! C(o=-2.1!,f=-7.1!) USER MOD Set 3.2: A 31 THR OG1 : rot -83:sc= 0.765 USER MOD Set 3.3: A 94 SER OG : rot -43:sc= 1.14 USER MOD Set 3.4: A 101 TYR OH : rot -143:sc= 1.28 USER MOD Set 4.1: A 27 THR OG1 : rot 102:sc= 1.49 USER MOD Set 4.2: A 86 SER OG : rot -37:sc= 1.43 USER MOD Set 5.1: A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 85 GLN : amide:sc= -1.11 K(o=-1.1,f=0) USER MOD Set 6.1: A 16 LYS NZ :NH3+ -149:sc= -1.57! (180deg=-5.25!) USER MOD Set 6.2: A 52 SER OG : rot 120:sc= 0.724 USER MOD Set 7.1: A 12 LYS NZ :NH3+ -164:sc= 1.24 (180deg=0) USER MOD Set 7.2: A 48 ASN : amide:sc= 0.758 K(o=2,f=-4.6) USER MOD Single : A 4 GLN : amide:sc= -3.28! K(o=-3.3!,f=-0.019) USER MOD Single : A 5 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0239) USER MOD Single : A 6 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00688) USER MOD Single : A 11 SER OG : rot 84:sc= 0.901 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 CYS SG : rot 51:sc= -0.599 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 26:sc= 0.0404 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.09) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.37 X(o=-0.37,f=-0.04) USER MOD Single : A 39 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.4!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl -178:sc= -1.46 (180deg=-1.49) USER MOD Single : A 46 SER OG : rot -30:sc= 0.468 USER MOD Single : A 47 ASN : amide:sc= -2.45 K(o=-2.4,f=-13!) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 HIS : no HD1:sc= -1.74 K(o=-1.7,f=-11!) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 173:sc= 1.28 (180deg=1.15) USER MOD Single : A 64 GLN : amide:sc= 0.179 K(o=0.18,f=-1.7) USER MOD Single : A 71 ASN : amide:sc= -0.0346 K(o=-0.035,f=-1.7!) USER MOD Single : A 79 ASN : amide:sc= -0.0193 X(o=-0.019,f=0) USER MOD Single : A 81 SER OG : rot 180:sc= -0.0155 USER MOD Single : A 83 ASN : amide:sc= -0.621 K(o=-0.62,f=-8.6!) USER MOD Single : A 88 SER OG : rot 130:sc= -0.0166 USER MOD Single : A 92 CYS SG : rot -40:sc= -3.39! USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 TYR OH : rot 165:sc= 0.0902 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 ASN : amide:sc= 0.437 K(o=0.44,f=-0.67) USER MOD Single : A 114 GLN : amide:sc= -1.36 K(o=-1.4,f=-0.4) USER MOD Single : A 116 MET CE :methyl -177:sc= -2.25! (180deg=-2.27!) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 170:sc= -0.0295 (180deg=-0.291) USER MOD Single : A 119 TYR OH : rot 180:sc= -0.0286 USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 125 ASN : amide:sc= 0.398 K(o=0.4,f=-2.1) USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.472 USER MOD Single : A 130 GLN : amide:sc= -1.31! K(o=-1.3!,f=-0.029) USER MOD Single : A 131 SER OG : rot 150:sc= 0 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 110:sc= 0 USER MOD Single : A 139 HIS : no HE2:sc= -0.202 K(o=-0.2,f=-2.2) USER MOD Single : A 141 MET CE :methyl -124:sc= -0.141 (180deg=-3.47!) USER MOD Single : A 152 GLN : amide:sc= -0.0612 X(o=-0.061,f=-0.077) USER MOD Single : A 153 LYS NZ :NH3+ 162:sc= 1.09 (180deg=1.04) USER MOD Single : A 155 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.19) USER MOD Single : A 156 ASN : amide:sc= -0.0323 K(o=-0.032,f=-2.4!) USER MOD ----------------------------------------------------------------- ATOM 35 N ILE A 3 9.964 9.218 -0.183 1.00 74.32 N ATOM 36 CA ILE A 3 8.758 9.033 -0.944 1.00 63.33 C ATOM 37 C ILE A 3 8.628 10.223 -1.908 1.00 43.12 C ATOM 38 O ILE A 3 8.797 11.377 -1.493 1.00 21.04 O ATOM 39 CB ILE A 3 7.468 8.921 -0.033 1.00 64.22 C ATOM 40 CG1 ILE A 3 7.460 7.639 0.858 1.00 51.22 C ATOM 41 CG2 ILE A 3 6.199 8.975 -0.862 1.00 40.42 C ATOM 42 CD1 ILE A 3 8.511 7.583 1.952 1.00 4.55 C ATOM 0 HA ILE A 3 8.827 8.089 -1.485 1.00 63.33 H new ATOM 0 HB ILE A 3 7.501 9.784 0.632 1.00 64.22 H new ATOM 0 HG12 ILE A 3 6.477 7.548 1.321 1.00 51.22 H new ATOM 0 HG13 ILE A 3 7.590 6.771 0.212 1.00 51.22 H new ATOM 0 HG21 ILE A 3 5.332 8.896 -0.206 1.00 40.42 H new ATOM 0 HG22 ILE A 3 6.158 9.920 -1.404 1.00 40.42 H new ATOM 0 HG23 ILE A 3 6.193 8.148 -1.573 1.00 40.42 H new ATOM 0 HD11 ILE A 3 8.410 6.650 2.506 1.00 4.55 H new ATOM 0 HD12 ILE A 3 9.504 7.635 1.506 1.00 4.55 H new ATOM 0 HD13 ILE A 3 8.374 8.424 2.631 1.00 4.55 H new ATOM 54 N GLN A 4 8.358 9.946 -3.161 1.00 13.31 N ATOM 55 CA GLN A 4 8.267 10.971 -4.163 1.00 23.32 C ATOM 56 C GLN A 4 6.833 11.381 -4.291 1.00 72.14 C ATOM 57 O GLN A 4 5.939 10.543 -4.228 1.00 1.44 O ATOM 58 CB GLN A 4 8.765 10.440 -5.501 1.00 72.04 C ATOM 59 CG GLN A 4 8.961 11.516 -6.573 1.00 32.21 C ATOM 60 CD GLN A 4 9.634 11.021 -7.854 1.00 2.50 C ATOM 61 OE1 GLN A 4 10.317 11.781 -8.530 1.00 63.31 O ATOM 62 NE2 GLN A 4 9.470 9.767 -8.186 1.00 43.33 N ATOM 0 H GLN A 4 8.196 9.002 -3.511 1.00 13.31 H new ATOM 0 HA GLN A 4 8.881 11.824 -3.875 1.00 23.32 H new ATOM 0 HB2 GLN A 4 9.712 9.924 -5.344 1.00 72.04 H new ATOM 0 HB3 GLN A 4 8.056 9.700 -5.871 1.00 72.04 H new ATOM 0 HG2 GLN A 4 7.989 11.938 -6.828 1.00 32.21 H new ATOM 0 HG3 GLN A 4 9.559 12.325 -6.153 1.00 32.21 H new ATOM 0 HE21 GLN A 4 8.896 9.156 -7.605 1.00 43.33 H new ATOM 0 HE22 GLN A 4 9.916 9.399 -9.026 1.00 43.33 H new ATOM 71 N LYS A 5 6.604 12.626 -4.460 1.00 62.33 N ATOM 72 CA LYS A 5 5.281 13.117 -4.573 1.00 20.40 C ATOM 73 C LYS A 5 4.884 13.314 -6.012 1.00 62.11 C ATOM 74 O LYS A 5 5.340 14.233 -6.689 1.00 63.54 O ATOM 75 CB LYS A 5 5.105 14.377 -3.732 1.00 73.22 C ATOM 76 CG LYS A 5 5.136 14.106 -2.236 1.00 31.51 C ATOM 77 CD LYS A 5 3.921 13.284 -1.820 1.00 13.24 C ATOM 78 CE LYS A 5 3.974 12.869 -0.366 1.00 41.23 C ATOM 79 NZ LYS A 5 4.055 14.012 0.571 1.00 44.13 N ATOM 0 H LYS A 5 7.330 13.339 -4.525 1.00 62.33 H new ATOM 0 HA LYS A 5 4.598 12.367 -4.174 1.00 20.40 H new ATOM 0 HB2 LYS A 5 5.893 15.087 -3.983 1.00 73.22 H new ATOM 0 HB3 LYS A 5 4.157 14.849 -3.990 1.00 73.22 H new ATOM 0 HG2 LYS A 5 6.050 13.573 -1.975 1.00 31.51 H new ATOM 0 HG3 LYS A 5 5.150 15.049 -1.689 1.00 31.51 H new ATOM 0 HD2 LYS A 5 3.016 13.865 -1.996 1.00 13.24 H new ATOM 0 HD3 LYS A 5 3.856 12.394 -2.447 1.00 13.24 H new ATOM 0 HE2 LYS A 5 3.088 12.280 -0.132 1.00 41.23 H new ATOM 0 HE3 LYS A 5 4.837 12.221 -0.212 1.00 41.23 H new ATOM 0 HZ1 LYS A 5 4.003 13.663 1.549 1.00 44.13 H new ATOM 0 HZ2 LYS A 5 4.955 14.514 0.430 1.00 44.13 H new ATOM 0 HZ3 LYS A 5 3.264 14.663 0.393 1.00 44.13 H new ATOM 93 N LYS A 6 4.053 12.419 -6.476 1.00 5.21 N ATOM 94 CA LYS A 6 3.511 12.453 -7.811 1.00 15.53 C ATOM 95 C LYS A 6 2.042 12.259 -7.721 1.00 74.15 C ATOM 96 O LYS A 6 1.424 11.647 -8.600 1.00 61.41 O ATOM 97 CB LYS A 6 4.125 11.374 -8.698 1.00 65.12 C ATOM 98 CG LYS A 6 5.591 11.581 -8.993 1.00 71.43 C ATOM 99 CD LYS A 6 6.104 10.610 -10.064 1.00 4.03 C ATOM 100 CE LYS A 6 5.316 10.729 -11.385 1.00 30.25 C ATOM 101 NZ LYS A 6 5.326 12.107 -11.961 1.00 62.34 N ATOM 0 H LYS A 6 3.725 11.626 -5.924 1.00 5.21 H new ATOM 0 HA LYS A 6 3.747 13.416 -8.264 1.00 15.53 H new ATOM 0 HB2 LYS A 6 3.995 10.405 -8.216 1.00 65.12 H new ATOM 0 HB3 LYS A 6 3.577 11.337 -9.640 1.00 65.12 H new ATOM 0 HG2 LYS A 6 5.753 12.606 -9.326 1.00 71.43 H new ATOM 0 HG3 LYS A 6 6.167 11.448 -8.077 1.00 71.43 H new ATOM 0 HD2 LYS A 6 7.159 10.806 -10.254 1.00 4.03 H new ATOM 0 HD3 LYS A 6 6.031 9.589 -9.691 1.00 4.03 H new ATOM 0 HE2 LYS A 6 5.736 10.036 -12.114 1.00 30.25 H new ATOM 0 HE3 LYS A 6 4.284 10.423 -11.212 1.00 30.25 H new ATOM 0 HZ1 LYS A 6 4.808 12.110 -12.863 1.00 62.34 H new ATOM 0 HZ2 LYS A 6 4.869 12.764 -11.297 1.00 62.34 H new ATOM 0 HZ3 LYS A 6 6.308 12.408 -12.124 1.00 62.34 H new ATOM 115 N LEU A 7 1.486 12.816 -6.658 1.00 21.11 N ATOM 116 CA LEU A 7 0.072 12.747 -6.366 1.00 55.42 C ATOM 117 C LEU A 7 -0.776 13.146 -7.582 1.00 1.20 C ATOM 118 O LEU A 7 -0.362 13.969 -8.417 1.00 24.14 O ATOM 119 CB LEU A 7 -0.276 13.616 -5.142 1.00 64.33 C ATOM 120 CG LEU A 7 0.467 13.285 -3.825 1.00 24.24 C ATOM 121 CD1 LEU A 7 0.047 14.235 -2.722 1.00 52.21 C ATOM 122 CD2 LEU A 7 0.224 11.846 -3.392 1.00 10.23 C ATOM 0 H LEU A 7 2.019 13.338 -5.963 1.00 21.11 H new ATOM 0 HA LEU A 7 -0.166 11.710 -6.128 1.00 55.42 H new ATOM 0 HB2 LEU A 7 -0.075 14.657 -5.395 1.00 64.33 H new ATOM 0 HB3 LEU A 7 -1.347 13.534 -4.959 1.00 64.33 H new ATOM 0 HG LEU A 7 1.534 13.407 -4.013 1.00 24.24 H new ATOM 0 HD11 LEU A 7 0.580 13.986 -1.805 1.00 52.21 H new ATOM 0 HD12 LEU A 7 0.284 15.258 -3.013 1.00 52.21 H new ATOM 0 HD13 LEU A 7 -1.026 14.145 -2.554 1.00 52.21 H new ATOM 0 HD21 LEU A 7 0.761 11.650 -2.464 1.00 10.23 H new ATOM 0 HD22 LEU A 7 -0.843 11.689 -3.234 1.00 10.23 H new ATOM 0 HD23 LEU A 7 0.580 11.168 -4.168 1.00 10.23 H new ATOM 134 N VAL A 8 -1.946 12.584 -7.649 1.00 21.24 N ATOM 135 CA VAL A 8 -2.848 12.743 -8.770 1.00 52.32 C ATOM 136 C VAL A 8 -3.407 14.180 -8.824 1.00 75.24 C ATOM 137 O VAL A 8 -3.444 14.877 -7.798 1.00 72.44 O ATOM 138 CB VAL A 8 -4.011 11.722 -8.653 1.00 60.15 C ATOM 139 CG1 VAL A 8 -4.875 12.000 -7.439 1.00 65.13 C ATOM 140 CG2 VAL A 8 -4.833 11.682 -9.901 1.00 3.13 C ATOM 0 H VAL A 8 -2.317 11.985 -6.911 1.00 21.24 H new ATOM 0 HA VAL A 8 -2.296 12.558 -9.691 1.00 52.32 H new ATOM 0 HB VAL A 8 -3.563 10.737 -8.521 1.00 60.15 H new ATOM 0 HG11 VAL A 8 -5.679 11.266 -7.389 1.00 65.13 H new ATOM 0 HG12 VAL A 8 -4.267 11.934 -6.537 1.00 65.13 H new ATOM 0 HG13 VAL A 8 -5.301 13.000 -7.517 1.00 65.13 H new ATOM 0 HG21 VAL A 8 -5.638 10.957 -9.783 1.00 3.13 H new ATOM 0 HG22 VAL A 8 -5.258 12.668 -10.089 1.00 3.13 H new ATOM 0 HG23 VAL A 8 -4.203 11.392 -10.742 1.00 3.13 H new ATOM 150 N ASP A 9 -3.799 14.630 -10.025 1.00 52.21 N ATOM 151 CA ASP A 9 -4.259 15.986 -10.216 1.00 12.12 C ATOM 152 C ASP A 9 -5.576 16.165 -9.497 1.00 31.11 C ATOM 153 O ASP A 9 -6.399 15.248 -9.487 1.00 4.12 O ATOM 154 CB ASP A 9 -4.422 16.288 -11.721 1.00 63.30 C ATOM 155 CG ASP A 9 -4.880 17.704 -12.009 1.00 52.52 C ATOM 156 OD1 ASP A 9 -6.096 17.969 -11.992 1.00 75.30 O ATOM 157 OD2 ASP A 9 -4.025 18.570 -12.270 1.00 1.11 O ATOM 0 H ASP A 9 -3.801 14.062 -10.872 1.00 52.21 H new ATOM 0 HA ASP A 9 -3.526 16.681 -9.807 1.00 12.12 H new ATOM 0 HB2 ASP A 9 -3.471 16.113 -12.223 1.00 63.30 H new ATOM 0 HB3 ASP A 9 -5.141 15.589 -12.148 1.00 63.30 H new ATOM 162 N PRO A 10 -5.794 17.321 -8.850 1.00 25.10 N ATOM 163 CA PRO A 10 -7.036 17.614 -8.132 1.00 42.33 C ATOM 164 C PRO A 10 -8.315 17.373 -8.948 1.00 44.54 C ATOM 165 O PRO A 10 -9.374 17.098 -8.381 1.00 23.40 O ATOM 166 CB PRO A 10 -6.899 19.087 -7.768 1.00 53.44 C ATOM 167 CG PRO A 10 -5.435 19.286 -7.643 1.00 61.13 C ATOM 168 CD PRO A 10 -4.820 18.428 -8.709 1.00 15.12 C ATOM 0 HA PRO A 10 -7.151 16.948 -7.277 1.00 42.33 H new ATOM 0 HB2 PRO A 10 -7.326 19.730 -8.537 1.00 53.44 H new ATOM 0 HB3 PRO A 10 -7.415 19.318 -6.836 1.00 53.44 H new ATOM 0 HG2 PRO A 10 -5.168 20.334 -7.781 1.00 61.13 H new ATOM 0 HG3 PRO A 10 -5.083 18.995 -6.653 1.00 61.13 H new ATOM 0 HD2 PRO A 10 -4.693 18.975 -9.643 1.00 15.12 H new ATOM 0 HD3 PRO A 10 -3.835 18.064 -8.416 1.00 15.12 H new ATOM 176 N SER A 11 -8.212 17.425 -10.259 1.00 62.15 N ATOM 177 CA SER A 11 -9.372 17.252 -11.108 1.00 33.54 C ATOM 178 C SER A 11 -9.725 15.768 -11.200 1.00 31.52 C ATOM 179 O SER A 11 -10.835 15.395 -11.563 1.00 43.13 O ATOM 180 CB SER A 11 -9.075 17.804 -12.488 1.00 30.22 C ATOM 181 OG SER A 11 -8.553 19.129 -12.393 1.00 53.21 O ATOM 0 H SER A 11 -7.338 17.585 -10.760 1.00 62.15 H new ATOM 0 HA SER A 11 -10.219 17.791 -10.683 1.00 33.54 H new ATOM 0 HB2 SER A 11 -8.358 17.160 -12.998 1.00 30.22 H new ATOM 0 HB3 SER A 11 -9.984 17.807 -13.089 1.00 30.22 H new ATOM 0 HG SER A 11 -7.587 19.089 -12.231 1.00 53.21 H new ATOM 187 N LYS A 12 -8.768 14.934 -10.842 1.00 62.32 N ATOM 188 CA LYS A 12 -8.918 13.502 -10.939 1.00 22.33 C ATOM 189 C LYS A 12 -9.256 12.925 -9.603 1.00 13.20 C ATOM 190 O LYS A 12 -9.444 11.692 -9.484 1.00 1.15 O ATOM 191 CB LYS A 12 -7.618 12.863 -11.393 1.00 4.33 C ATOM 192 CG LYS A 12 -6.977 13.507 -12.596 1.00 23.35 C ATOM 193 CD LYS A 12 -7.909 13.562 -13.758 1.00 61.30 C ATOM 194 CE LYS A 12 -8.306 12.167 -14.247 1.00 12.43 C ATOM 195 NZ LYS A 12 -9.254 12.219 -15.377 1.00 21.33 N ATOM 0 H LYS A 12 -7.865 15.234 -10.476 1.00 62.32 H new ATOM 0 HA LYS A 12 -9.713 13.301 -11.657 1.00 22.33 H new ATOM 0 HB2 LYS A 12 -6.909 12.889 -10.565 1.00 4.33 H new ATOM 0 HB3 LYS A 12 -7.806 11.813 -11.619 1.00 4.33 H new ATOM 0 HG2 LYS A 12 -6.656 14.517 -12.340 1.00 23.35 H new ATOM 0 HG3 LYS A 12 -6.083 12.949 -12.874 1.00 23.35 H new ATOM 0 HD2 LYS A 12 -8.805 14.115 -13.477 1.00 61.30 H new ATOM 0 HD3 LYS A 12 -7.438 14.111 -14.574 1.00 61.30 H new ATOM 0 HE2 LYS A 12 -7.412 11.623 -14.550 1.00 12.43 H new ATOM 0 HE3 LYS A 12 -8.755 11.610 -13.424 1.00 12.43 H new ATOM 0 HZ1 LYS A 12 -9.700 11.288 -15.499 1.00 21.33 H new ATOM 0 HZ2 LYS A 12 -9.987 12.931 -15.183 1.00 21.33 H new ATOM 0 HZ3 LYS A 12 -8.744 12.475 -16.246 1.00 21.33 H new ATOM 209 N TYR A 13 -9.333 13.781 -8.574 1.00 42.12 N ATOM 210 CA TYR A 13 -9.567 13.302 -7.253 1.00 33.05 C ATOM 211 C TYR A 13 -10.801 12.488 -7.145 1.00 21.13 C ATOM 212 O TYR A 13 -10.760 11.471 -6.559 1.00 53.04 O ATOM 213 CB TYR A 13 -9.575 14.395 -6.186 1.00 24.31 C ATOM 214 CG TYR A 13 -8.225 14.932 -5.756 1.00 42.03 C ATOM 215 CD1 TYR A 13 -7.088 14.133 -5.770 1.00 11.40 C ATOM 216 CD2 TYR A 13 -8.093 16.237 -5.314 1.00 2.02 C ATOM 217 CE1 TYR A 13 -5.868 14.624 -5.363 1.00 11.30 C ATOM 218 CE2 TYR A 13 -6.873 16.734 -4.902 1.00 4.33 C ATOM 219 CZ TYR A 13 -5.764 15.921 -4.931 1.00 32.14 C ATOM 220 OH TYR A 13 -4.548 16.408 -4.520 1.00 14.23 O ATOM 0 H TYR A 13 -9.235 14.793 -8.654 1.00 42.12 H new ATOM 0 HA TYR A 13 -8.708 12.661 -7.054 1.00 33.05 H new ATOM 0 HB2 TYR A 13 -10.171 15.229 -6.557 1.00 24.31 H new ATOM 0 HB3 TYR A 13 -10.084 14.007 -5.304 1.00 24.31 H new ATOM 0 HD1 TYR A 13 -7.163 13.109 -6.106 1.00 11.40 H new ATOM 0 HD2 TYR A 13 -8.961 16.879 -5.291 1.00 2.02 H new ATOM 0 HE1 TYR A 13 -4.995 13.989 -5.384 1.00 11.30 H new ATOM 0 HE2 TYR A 13 -6.790 17.755 -4.559 1.00 4.33 H new ATOM 0 HH TYR A 13 -4.646 17.344 -4.246 1.00 14.23 H new ATOM 230 N GLY A 14 -11.859 12.858 -7.809 1.00 71.24 N ATOM 231 CA GLY A 14 -13.089 12.118 -7.587 1.00 4.42 C ATOM 232 C GLY A 14 -13.262 10.931 -8.483 1.00 53.15 C ATOM 233 O GLY A 14 -14.358 10.404 -8.629 1.00 2.12 O ATOM 0 H GLY A 14 -11.908 13.626 -8.478 1.00 71.24 H new ATOM 0 HA2 GLY A 14 -13.116 11.783 -6.550 1.00 4.42 H new ATOM 0 HA3 GLY A 14 -13.935 12.791 -7.727 1.00 4.42 H new ATOM 237 N THR A 15 -12.188 10.518 -9.082 1.00 25.35 N ATOM 238 CA THR A 15 -12.159 9.321 -9.862 1.00 24.24 C ATOM 239 C THR A 15 -11.253 8.311 -9.138 1.00 35.54 C ATOM 240 O THR A 15 -11.433 7.107 -9.209 1.00 33.34 O ATOM 241 CB THR A 15 -11.604 9.621 -11.268 1.00 74.13 C ATOM 242 OG1 THR A 15 -12.351 10.702 -11.836 1.00 14.34 O ATOM 243 CG2 THR A 15 -11.728 8.407 -12.177 1.00 72.14 C ATOM 0 H THR A 15 -11.295 11.010 -9.042 1.00 25.35 H new ATOM 0 HA THR A 15 -13.164 8.915 -9.975 1.00 24.24 H new ATOM 0 HB THR A 15 -10.549 9.881 -11.178 1.00 74.13 H new ATOM 0 HG1 THR A 15 -12.006 10.904 -12.731 1.00 14.34 H new ATOM 0 HG21 THR A 15 -11.329 8.648 -13.162 1.00 72.14 H new ATOM 0 HG22 THR A 15 -11.167 7.575 -11.751 1.00 72.14 H new ATOM 0 HG23 THR A 15 -12.777 8.127 -12.269 1.00 72.14 H new ATOM 251 N LYS A 16 -10.281 8.826 -8.430 1.00 53.44 N ATOM 252 CA LYS A 16 -9.367 7.997 -7.679 1.00 32.42 C ATOM 253 C LYS A 16 -9.781 7.928 -6.207 1.00 43.02 C ATOM 254 O LYS A 16 -9.775 6.851 -5.600 1.00 63.45 O ATOM 255 CB LYS A 16 -7.959 8.548 -7.794 1.00 22.14 C ATOM 256 CG LYS A 16 -7.309 8.573 -9.204 1.00 2.51 C ATOM 257 CD LYS A 16 -6.794 7.197 -9.742 1.00 24.13 C ATOM 258 CE LYS A 16 -7.806 6.310 -10.521 1.00 34.42 C ATOM 259 NZ LYS A 16 -8.925 5.752 -9.725 1.00 64.33 N ATOM 0 H LYS A 16 -10.099 9.827 -8.356 1.00 53.44 H new ATOM 0 HA LYS A 16 -9.396 6.989 -8.092 1.00 32.42 H new ATOM 0 HB2 LYS A 16 -7.965 9.568 -7.409 1.00 22.14 H new ATOM 0 HB3 LYS A 16 -7.315 7.963 -7.138 1.00 22.14 H new ATOM 0 HG2 LYS A 16 -8.037 8.969 -9.912 1.00 2.51 H new ATOM 0 HG3 LYS A 16 -6.472 9.270 -9.185 1.00 2.51 H new ATOM 0 HD2 LYS A 16 -5.942 7.388 -10.394 1.00 24.13 H new ATOM 0 HD3 LYS A 16 -6.424 6.621 -8.894 1.00 24.13 H new ATOM 0 HE2 LYS A 16 -8.225 6.900 -11.336 1.00 34.42 H new ATOM 0 HE3 LYS A 16 -7.260 5.483 -10.974 1.00 34.42 H new ATOM 0 HZ1 LYS A 16 -9.209 4.834 -10.122 1.00 64.33 H new ATOM 0 HZ2 LYS A 16 -8.620 5.624 -8.739 1.00 64.33 H new ATOM 0 HZ3 LYS A 16 -9.733 6.407 -9.755 1.00 64.33 H new ATOM 273 N CYS A 17 -10.158 9.070 -5.671 1.00 43.55 N ATOM 274 CA CYS A 17 -10.536 9.228 -4.277 1.00 62.44 C ATOM 275 C CYS A 17 -11.513 10.421 -4.096 1.00 4.15 C ATOM 276 O CYS A 17 -11.110 11.520 -3.672 1.00 53.35 O ATOM 277 CB CYS A 17 -9.285 9.443 -3.451 1.00 23.13 C ATOM 278 SG CYS A 17 -8.219 10.776 -4.067 1.00 55.12 S ATOM 0 H CYS A 17 -10.212 9.938 -6.204 1.00 43.55 H new ATOM 0 HA CYS A 17 -11.050 8.327 -3.943 1.00 62.44 H new ATOM 0 HB2 CYS A 17 -9.573 9.667 -2.424 1.00 23.13 H new ATOM 0 HB3 CYS A 17 -8.713 8.515 -3.427 1.00 23.13 H new ATOM 0 HG CYS A 17 -8.930 11.848 -4.255 1.00 55.12 H new ATOM 284 N PRO A 18 -12.789 10.255 -4.520 1.00 3.51 N ATOM 285 CA PRO A 18 -13.806 11.321 -4.428 1.00 75.13 C ATOM 286 C PRO A 18 -14.129 11.691 -3.008 1.00 30.14 C ATOM 287 O PRO A 18 -14.574 12.806 -2.725 1.00 65.55 O ATOM 288 CB PRO A 18 -15.043 10.718 -5.110 1.00 72.50 C ATOM 289 CG PRO A 18 -14.804 9.243 -5.141 1.00 62.01 C ATOM 290 CD PRO A 18 -13.322 9.041 -5.162 1.00 54.23 C ATOM 0 HA PRO A 18 -13.455 12.242 -4.893 1.00 75.13 H new ATOM 0 HB2 PRO A 18 -15.951 10.957 -4.557 1.00 72.50 H new ATOM 0 HB3 PRO A 18 -15.169 11.116 -6.117 1.00 72.50 H new ATOM 0 HG2 PRO A 18 -15.247 8.762 -4.269 1.00 62.01 H new ATOM 0 HG3 PRO A 18 -15.267 8.796 -6.021 1.00 62.01 H new ATOM 0 HD2 PRO A 18 -13.034 8.142 -4.617 1.00 54.23 H new ATOM 0 HD3 PRO A 18 -12.948 8.931 -6.180 1.00 54.23 H new ATOM 298 N TYR A 19 -13.883 10.783 -2.130 1.00 35.31 N ATOM 299 CA TYR A 19 -14.208 10.979 -0.750 1.00 60.54 C ATOM 300 C TYR A 19 -12.976 11.304 0.068 1.00 5.41 C ATOM 301 O TYR A 19 -11.849 10.968 -0.299 1.00 44.01 O ATOM 302 CB TYR A 19 -14.911 9.751 -0.177 1.00 51.13 C ATOM 303 CG TYR A 19 -16.147 9.358 -0.939 1.00 42.25 C ATOM 304 CD1 TYR A 19 -17.343 10.043 -0.779 1.00 43.23 C ATOM 305 CD2 TYR A 19 -16.114 8.296 -1.819 1.00 55.32 C ATOM 306 CE1 TYR A 19 -18.474 9.674 -1.483 1.00 31.32 C ATOM 307 CE2 TYR A 19 -17.228 7.921 -2.527 1.00 25.14 C ATOM 308 CZ TYR A 19 -18.409 8.609 -2.358 1.00 1.34 C ATOM 309 OH TYR A 19 -19.535 8.222 -3.061 1.00 25.34 O ATOM 0 H TYR A 19 -13.452 9.883 -2.341 1.00 35.31 H new ATOM 0 HA TYR A 19 -14.887 11.830 -0.693 1.00 60.54 H new ATOM 0 HB2 TYR A 19 -14.215 8.913 -0.172 1.00 51.13 H new ATOM 0 HB3 TYR A 19 -15.180 9.947 0.861 1.00 51.13 H new ATOM 0 HD1 TYR A 19 -17.391 10.877 -0.094 1.00 43.23 H new ATOM 0 HD2 TYR A 19 -15.193 7.749 -1.953 1.00 55.32 H new ATOM 0 HE1 TYR A 19 -19.400 10.214 -1.349 1.00 31.32 H new ATOM 0 HE2 TYR A 19 -17.179 7.089 -3.214 1.00 25.14 H new ATOM 0 HH TYR A 19 -19.316 7.457 -3.633 1.00 25.34 H new ATOM 319 N THR A 20 -13.201 11.952 1.161 1.00 73.03 N ATOM 320 CA THR A 20 -12.167 12.309 2.078 1.00 52.42 C ATOM 321 C THR A 20 -12.321 11.477 3.335 1.00 75.32 C ATOM 322 O THR A 20 -13.422 11.399 3.910 1.00 51.23 O ATOM 323 CB THR A 20 -12.203 13.826 2.404 1.00 3.33 C ATOM 324 OG1 THR A 20 -13.533 14.224 2.795 1.00 33.15 O ATOM 325 CG2 THR A 20 -11.769 14.649 1.206 1.00 61.23 C ATOM 0 H THR A 20 -14.131 12.256 1.450 1.00 73.03 H new ATOM 0 HA THR A 20 -11.197 12.105 1.624 1.00 52.42 H new ATOM 0 HB THR A 20 -11.511 14.005 3.227 1.00 3.33 H new ATOM 0 HG1 THR A 20 -14.011 13.451 3.161 1.00 33.15 H new ATOM 0 HG21 THR A 20 -11.803 15.708 1.461 1.00 61.23 H new ATOM 0 HG22 THR A 20 -10.752 14.376 0.926 1.00 61.23 H new ATOM 0 HG23 THR A 20 -12.440 14.455 0.369 1.00 61.23 H new ATOM 333 N MET A 21 -11.262 10.846 3.763 1.00 74.20 N ATOM 334 CA MET A 21 -11.358 9.962 4.907 1.00 71.10 C ATOM 335 C MET A 21 -10.006 9.727 5.534 1.00 11.43 C ATOM 336 O MET A 21 -8.999 9.738 4.857 1.00 40.04 O ATOM 337 CB MET A 21 -12.016 8.629 4.502 1.00 62.03 C ATOM 338 CG MET A 21 -12.222 7.659 5.653 1.00 50.55 C ATOM 339 SD MET A 21 -13.190 8.385 6.990 1.00 73.42 S ATOM 340 CE MET A 21 -13.265 7.005 8.133 1.00 72.41 C ATOM 0 H MET A 21 -10.333 10.921 3.349 1.00 74.20 H new ATOM 0 HA MET A 21 -11.987 10.445 5.655 1.00 71.10 H new ATOM 0 HB2 MET A 21 -12.982 8.839 4.042 1.00 62.03 H new ATOM 0 HB3 MET A 21 -11.399 8.148 3.743 1.00 62.03 H new ATOM 0 HG2 MET A 21 -12.725 6.764 5.286 1.00 50.55 H new ATOM 0 HG3 MET A 21 -11.252 7.344 6.038 1.00 50.55 H new ATOM 0 HE1 MET A 21 -13.833 7.295 9.017 1.00 72.41 H new ATOM 0 HE2 MET A 21 -13.752 6.158 7.650 1.00 72.41 H new ATOM 0 HE3 MET A 21 -12.255 6.722 8.428 1.00 72.41 H new ATOM 350 N LYS A 22 -10.001 9.512 6.821 1.00 53.23 N ATOM 351 CA LYS A 22 -8.781 9.272 7.540 1.00 43.34 C ATOM 352 C LYS A 22 -8.524 7.774 7.564 1.00 63.52 C ATOM 353 O LYS A 22 -9.432 6.985 7.896 1.00 50.11 O ATOM 354 CB LYS A 22 -8.839 9.832 8.992 1.00 10.32 C ATOM 355 CG LYS A 22 -9.008 11.363 9.124 1.00 51.45 C ATOM 356 CD LYS A 22 -10.380 11.862 8.663 1.00 5.12 C ATOM 357 CE LYS A 22 -10.489 13.376 8.768 1.00 13.11 C ATOM 358 NZ LYS A 22 -11.819 13.866 8.336 1.00 35.12 N ATOM 0 H LYS A 22 -10.841 9.498 7.400 1.00 53.23 H new ATOM 0 HA LYS A 22 -7.968 9.792 7.033 1.00 43.34 H new ATOM 0 HB2 LYS A 22 -9.666 9.349 9.513 1.00 10.32 H new ATOM 0 HB3 LYS A 22 -7.924 9.542 9.508 1.00 10.32 H new ATOM 0 HG2 LYS A 22 -8.855 11.650 10.164 1.00 51.45 H new ATOM 0 HG3 LYS A 22 -8.233 11.859 8.539 1.00 51.45 H new ATOM 0 HD2 LYS A 22 -10.552 11.555 7.631 1.00 5.12 H new ATOM 0 HD3 LYS A 22 -11.159 11.398 9.268 1.00 5.12 H new ATOM 0 HE2 LYS A 22 -10.306 13.682 9.798 1.00 13.11 H new ATOM 0 HE3 LYS A 22 -9.715 13.839 8.156 1.00 13.11 H new ATOM 0 HZ1 LYS A 22 -11.852 14.902 8.423 1.00 35.12 H new ATOM 0 HZ2 LYS A 22 -11.983 13.596 7.345 1.00 35.12 H new ATOM 0 HZ3 LYS A 22 -12.556 13.445 8.937 1.00 35.12 H new ATOM 372 N PRO A 23 -7.308 7.354 7.210 1.00 51.45 N ATOM 373 CA PRO A 23 -6.962 5.946 7.112 1.00 75.25 C ATOM 374 C PRO A 23 -6.822 5.297 8.485 1.00 63.24 C ATOM 375 O PRO A 23 -6.199 5.854 9.402 1.00 21.03 O ATOM 376 CB PRO A 23 -5.612 5.963 6.393 1.00 52.13 C ATOM 377 CG PRO A 23 -5.007 7.278 6.745 1.00 62.41 C ATOM 378 CD PRO A 23 -6.152 8.234 6.912 1.00 35.01 C ATOM 0 HA PRO A 23 -7.728 5.369 6.594 1.00 75.25 H new ATOM 0 HB2 PRO A 23 -4.980 5.137 6.720 1.00 52.13 H new ATOM 0 HB3 PRO A 23 -5.737 5.862 5.315 1.00 52.13 H new ATOM 0 HG2 PRO A 23 -4.424 7.205 7.663 1.00 62.41 H new ATOM 0 HG3 PRO A 23 -4.328 7.616 5.962 1.00 62.41 H new ATOM 0 HD2 PRO A 23 -5.968 8.941 7.721 1.00 35.01 H new ATOM 0 HD3 PRO A 23 -6.318 8.821 6.008 1.00 35.01 H new ATOM 386 N LYS A 24 -7.429 4.158 8.645 1.00 51.11 N ATOM 387 CA LYS A 24 -7.340 3.437 9.876 1.00 34.22 C ATOM 388 C LYS A 24 -6.690 2.079 9.630 1.00 73.42 C ATOM 389 O LYS A 24 -6.254 1.404 10.561 1.00 23.54 O ATOM 390 CB LYS A 24 -8.735 3.265 10.466 1.00 21.12 C ATOM 391 CG LYS A 24 -8.819 2.542 11.812 1.00 4.40 C ATOM 392 CD LYS A 24 -8.438 3.406 13.043 1.00 41.30 C ATOM 393 CE LYS A 24 -6.979 3.851 13.065 1.00 62.41 C ATOM 394 NZ LYS A 24 -6.636 4.541 14.322 1.00 10.12 N ATOM 0 H LYS A 24 -7.997 3.706 7.928 1.00 51.11 H new ATOM 0 HA LYS A 24 -6.726 3.993 10.584 1.00 34.22 H new ATOM 0 HB2 LYS A 24 -9.182 4.253 10.580 1.00 21.12 H new ATOM 0 HB3 LYS A 24 -9.346 2.720 9.746 1.00 21.12 H new ATOM 0 HG2 LYS A 24 -9.836 2.172 11.947 1.00 4.40 H new ATOM 0 HG3 LYS A 24 -8.165 1.671 11.781 1.00 4.40 H new ATOM 0 HD2 LYS A 24 -9.076 4.289 13.065 1.00 41.30 H new ATOM 0 HD3 LYS A 24 -8.647 2.839 13.950 1.00 41.30 H new ATOM 0 HE2 LYS A 24 -6.332 2.983 12.939 1.00 62.41 H new ATOM 0 HE3 LYS A 24 -6.789 4.515 12.222 1.00 62.41 H new ATOM 0 HZ1 LYS A 24 -5.615 4.738 14.343 1.00 10.12 H new ATOM 0 HZ2 LYS A 24 -7.162 5.436 14.381 1.00 10.12 H new ATOM 0 HZ3 LYS A 24 -6.888 3.937 15.130 1.00 10.12 H new ATOM 408 N TYR A 25 -6.634 1.684 8.383 1.00 2.14 N ATOM 409 CA TYR A 25 -6.069 0.407 8.019 1.00 31.33 C ATOM 410 C TYR A 25 -5.046 0.596 6.916 1.00 72.40 C ATOM 411 O TYR A 25 -4.877 1.704 6.407 1.00 23.13 O ATOM 412 CB TYR A 25 -7.153 -0.559 7.524 1.00 35.33 C ATOM 413 CG TYR A 25 -8.287 -0.836 8.495 1.00 11.12 C ATOM 414 CD1 TYR A 25 -9.408 -0.011 8.553 1.00 40.45 C ATOM 415 CD2 TYR A 25 -8.235 -1.925 9.349 1.00 12.00 C ATOM 416 CE1 TYR A 25 -10.439 -0.271 9.437 1.00 51.25 C ATOM 417 CE2 TYR A 25 -9.260 -2.193 10.233 1.00 53.25 C ATOM 418 CZ TYR A 25 -10.357 -1.364 10.274 1.00 62.43 C ATOM 419 OH TYR A 25 -11.379 -1.630 11.164 1.00 21.04 O ATOM 0 H TYR A 25 -6.976 2.234 7.595 1.00 2.14 H new ATOM 0 HA TYR A 25 -5.598 -0.016 8.907 1.00 31.33 H new ATOM 0 HB2 TYR A 25 -7.578 -0.157 6.604 1.00 35.33 H new ATOM 0 HB3 TYR A 25 -6.679 -1.507 7.269 1.00 35.33 H new ATOM 0 HD1 TYR A 25 -9.473 0.845 7.897 1.00 40.45 H new ATOM 0 HD2 TYR A 25 -7.375 -2.578 9.323 1.00 12.00 H new ATOM 0 HE1 TYR A 25 -11.302 0.377 9.472 1.00 51.25 H new ATOM 0 HE2 TYR A 25 -9.201 -3.049 10.889 1.00 53.25 H new ATOM 0 HH TYR A 25 -11.164 -2.436 11.678 1.00 21.04 H new ATOM 429 N ILE A 26 -4.386 -0.474 6.540 1.00 13.44 N ATOM 430 CA ILE A 26 -3.416 -0.460 5.455 1.00 14.24 C ATOM 431 C ILE A 26 -3.629 -1.708 4.610 1.00 72.13 C ATOM 432 O ILE A 26 -3.851 -2.777 5.149 1.00 62.04 O ATOM 433 CB ILE A 26 -1.937 -0.421 5.989 1.00 23.13 C ATOM 434 CG1 ILE A 26 -1.708 0.839 6.840 1.00 23.11 C ATOM 435 CG2 ILE A 26 -0.933 -0.469 4.831 1.00 11.41 C ATOM 436 CD1 ILE A 26 -0.322 0.956 7.441 1.00 20.20 C ATOM 0 H ILE A 26 -4.503 -1.388 6.977 1.00 13.44 H new ATOM 0 HA ILE A 26 -3.566 0.442 4.861 1.00 14.24 H new ATOM 0 HB ILE A 26 -1.780 -1.301 6.613 1.00 23.13 H new ATOM 0 HG12 ILE A 26 -1.896 1.717 6.222 1.00 23.11 H new ATOM 0 HG13 ILE A 26 -2.441 0.854 7.647 1.00 23.11 H new ATOM 0 HG21 ILE A 26 0.082 -0.441 5.228 1.00 11.41 H new ATOM 0 HG22 ILE A 26 -1.075 -1.389 4.264 1.00 11.41 H new ATOM 0 HG23 ILE A 26 -1.091 0.389 4.177 1.00 11.41 H new ATOM 0 HD11 ILE A 26 -0.254 1.875 8.024 1.00 20.20 H new ATOM 0 HD12 ILE A 26 -0.133 0.100 8.089 1.00 20.20 H new ATOM 0 HD13 ILE A 26 0.420 0.977 6.643 1.00 20.20 H new ATOM 448 N THR A 27 -3.599 -1.564 3.314 1.00 75.23 N ATOM 449 CA THR A 27 -3.773 -2.680 2.420 1.00 54.12 C ATOM 450 C THR A 27 -2.518 -2.852 1.555 1.00 11.24 C ATOM 451 O THR A 27 -2.183 -1.972 0.751 1.00 71.45 O ATOM 452 CB THR A 27 -4.994 -2.466 1.496 1.00 73.54 C ATOM 453 OG1 THR A 27 -6.145 -2.147 2.287 1.00 72.14 O ATOM 454 CG2 THR A 27 -5.281 -3.738 0.714 1.00 54.31 C ATOM 0 H THR A 27 -3.453 -0.670 2.845 1.00 75.23 H new ATOM 0 HA THR A 27 -3.939 -3.573 3.023 1.00 54.12 H new ATOM 0 HB THR A 27 -4.774 -1.650 0.807 1.00 73.54 H new ATOM 0 HG1 THR A 27 -6.310 -1.182 2.250 1.00 72.14 H new ATOM 0 HG21 THR A 27 -6.142 -3.580 0.065 1.00 54.31 H new ATOM 0 HG22 THR A 27 -4.413 -3.996 0.108 1.00 54.31 H new ATOM 0 HG23 THR A 27 -5.494 -4.551 1.408 1.00 54.31 H new ATOM 462 N VAL A 28 -1.845 -3.969 1.708 1.00 14.34 N ATOM 463 CA VAL A 28 -0.630 -4.250 0.953 1.00 13.42 C ATOM 464 C VAL A 28 -0.948 -5.148 -0.250 1.00 2.53 C ATOM 465 O VAL A 28 -1.822 -6.039 -0.173 1.00 34.45 O ATOM 466 CB VAL A 28 0.435 -4.917 1.855 1.00 10.02 C ATOM 467 CG1 VAL A 28 1.724 -5.187 1.089 1.00 65.03 C ATOM 468 CG2 VAL A 28 0.716 -4.029 3.044 1.00 23.51 C ATOM 0 H VAL A 28 -2.117 -4.710 2.354 1.00 14.34 H new ATOM 0 HA VAL A 28 -0.226 -3.305 0.589 1.00 13.42 H new ATOM 0 HB VAL A 28 0.044 -5.876 2.195 1.00 10.02 H new ATOM 0 HG11 VAL A 28 2.450 -5.656 1.753 1.00 65.03 H new ATOM 0 HG12 VAL A 28 1.517 -5.852 0.251 1.00 65.03 H new ATOM 0 HG13 VAL A 28 2.129 -4.247 0.715 1.00 65.03 H new ATOM 0 HG21 VAL A 28 1.466 -4.499 3.680 1.00 23.51 H new ATOM 0 HG22 VAL A 28 1.086 -3.064 2.698 1.00 23.51 H new ATOM 0 HG23 VAL A 28 -0.202 -3.882 3.614 1.00 23.51 H new ATOM 478 N HIS A 29 -0.294 -4.889 -1.364 1.00 64.51 N ATOM 479 CA HIS A 29 -0.492 -5.659 -2.581 1.00 61.44 C ATOM 480 C HIS A 29 0.894 -6.009 -3.111 1.00 40.32 C ATOM 481 O HIS A 29 1.872 -5.322 -2.792 1.00 11.45 O ATOM 482 CB HIS A 29 -1.220 -4.816 -3.693 1.00 60.04 C ATOM 483 CG HIS A 29 -2.439 -4.031 -3.265 1.00 53.40 C ATOM 484 ND1 HIS A 29 -3.761 -4.168 -3.803 1.00 11.01 N ATOM 485 CD2 HIS A 29 -2.518 -3.032 -2.353 1.00 62.00 C ATOM 486 CE1 HIS A 29 -4.504 -3.249 -3.178 1.00 44.12 C ATOM 487 NE2 HIS A 29 -3.788 -2.579 -2.318 1.00 74.02 N ATOM 0 H HIS A 29 0.391 -4.139 -1.454 1.00 64.51 H new ATOM 0 HA HIS A 29 -1.102 -6.533 -2.354 1.00 61.44 H new ATOM 0 HB2 HIS A 29 -0.498 -4.118 -4.117 1.00 60.04 H new ATOM 0 HB3 HIS A 29 -1.516 -5.494 -4.494 1.00 60.04 H new ATOM 0 HD2 HIS A 29 -1.700 -2.660 -1.754 1.00 62.00 H new ATOM 0 HE1 HIS A 29 -5.556 -3.084 -3.361 1.00 44.12 H new ATOM 0 HE2 HIS A 29 -4.133 -1.832 -1.715 1.00 74.02 H new ATOM 495 N ASN A 30 0.986 -7.064 -3.862 1.00 42.11 N ATOM 496 CA ASN A 30 2.212 -7.396 -4.556 1.00 54.22 C ATOM 497 C ASN A 30 1.947 -7.194 -6.022 1.00 62.51 C ATOM 498 O ASN A 30 0.847 -7.503 -6.498 1.00 71.40 O ATOM 499 CB ASN A 30 2.668 -8.864 -4.321 1.00 2.21 C ATOM 500 CG ASN A 30 3.263 -9.203 -2.933 1.00 65.10 C ATOM 501 OD1 ASN A 30 3.101 -10.327 -2.443 1.00 53.34 O ATOM 502 ND2 ASN A 30 3.988 -8.298 -2.331 1.00 22.44 N ATOM 0 H ASN A 30 0.222 -7.722 -4.016 1.00 42.11 H new ATOM 0 HA ASN A 30 3.012 -6.760 -4.178 1.00 54.22 H new ATOM 0 HB2 ASN A 30 1.811 -9.516 -4.490 1.00 2.21 H new ATOM 0 HB3 ASN A 30 3.412 -9.113 -5.078 1.00 2.21 H new ATOM 0 HD21 ASN A 30 4.434 -8.512 -1.439 1.00 22.44 H new ATOM 0 HD22 ASN A 30 4.108 -7.377 -2.753 1.00 22.44 H new ATOM 509 N THR A 31 2.917 -6.713 -6.738 1.00 0.10 N ATOM 510 CA THR A 31 2.743 -6.433 -8.132 1.00 53.54 C ATOM 511 C THR A 31 2.810 -7.680 -8.994 1.00 72.20 C ATOM 512 O THR A 31 3.678 -8.540 -8.818 1.00 12.42 O ATOM 513 CB THR A 31 3.760 -5.398 -8.625 1.00 12.04 C ATOM 514 OG1 THR A 31 5.049 -5.713 -8.078 1.00 42.41 O ATOM 515 CG2 THR A 31 3.353 -3.984 -8.244 1.00 1.25 C ATOM 0 H THR A 31 3.847 -6.504 -6.376 1.00 0.10 H new ATOM 0 HA THR A 31 1.740 -6.019 -8.233 1.00 53.54 H new ATOM 0 HB THR A 31 3.798 -5.438 -9.714 1.00 12.04 H new ATOM 0 HG1 THR A 31 5.117 -5.350 -7.170 1.00 42.41 H new ATOM 0 HG21 THR A 31 4.099 -3.279 -8.611 1.00 1.25 H new ATOM 0 HG22 THR A 31 2.385 -3.752 -8.688 1.00 1.25 H new ATOM 0 HG23 THR A 31 3.283 -3.905 -7.159 1.00 1.25 H new ATOM 523 N TYR A 32 1.887 -7.765 -9.920 1.00 50.25 N ATOM 524 CA TYR A 32 1.841 -8.838 -10.896 1.00 53.55 C ATOM 525 C TYR A 32 2.798 -8.528 -12.041 1.00 65.21 C ATOM 526 O TYR A 32 3.017 -9.344 -12.938 1.00 3.12 O ATOM 527 CB TYR A 32 0.398 -9.041 -11.420 1.00 60.24 C ATOM 528 CG TYR A 32 -0.247 -7.790 -12.010 1.00 31.12 C ATOM 529 CD1 TYR A 32 -0.077 -7.453 -13.350 1.00 3.22 C ATOM 530 CD2 TYR A 32 -1.026 -6.950 -11.223 1.00 11.21 C ATOM 531 CE1 TYR A 32 -0.661 -6.319 -13.880 1.00 64.23 C ATOM 532 CE2 TYR A 32 -1.613 -5.817 -11.747 1.00 23.12 C ATOM 533 CZ TYR A 32 -1.426 -5.506 -13.075 1.00 52.04 C ATOM 534 OH TYR A 32 -2.009 -4.375 -13.601 1.00 0.12 O ATOM 0 H TYR A 32 1.134 -7.084 -10.023 1.00 50.25 H new ATOM 0 HA TYR A 32 2.153 -9.767 -10.419 1.00 53.55 H new ATOM 0 HB2 TYR A 32 0.409 -9.821 -12.181 1.00 60.24 H new ATOM 0 HB3 TYR A 32 -0.224 -9.403 -10.601 1.00 60.24 H new ATOM 0 HD1 TYR A 32 0.521 -8.089 -13.986 1.00 3.22 H new ATOM 0 HD2 TYR A 32 -1.175 -7.189 -10.180 1.00 11.21 H new ATOM 0 HE1 TYR A 32 -0.518 -6.071 -14.921 1.00 64.23 H new ATOM 0 HE2 TYR A 32 -2.216 -5.178 -11.119 1.00 23.12 H new ATOM 0 HH TYR A 32 -2.516 -3.913 -12.901 1.00 0.12 H new ATOM 544 N ASN A 33 3.348 -7.336 -12.002 1.00 23.41 N ATOM 545 CA ASN A 33 4.253 -6.844 -13.022 1.00 5.11 C ATOM 546 C ASN A 33 5.461 -6.194 -12.379 1.00 55.50 C ATOM 547 O ASN A 33 5.370 -5.672 -11.273 1.00 33.12 O ATOM 548 CB ASN A 33 3.492 -5.861 -13.934 1.00 45.02 C ATOM 549 CG ASN A 33 4.353 -5.108 -14.932 1.00 4.14 C ATOM 550 OD1 ASN A 33 4.592 -5.575 -16.038 1.00 13.13 O ATOM 551 ND2 ASN A 33 4.769 -3.916 -14.573 1.00 31.22 N ATOM 0 H ASN A 33 3.178 -6.668 -11.250 1.00 23.41 H new ATOM 0 HA ASN A 33 4.617 -7.671 -13.632 1.00 5.11 H new ATOM 0 HB2 ASN A 33 2.729 -6.414 -14.481 1.00 45.02 H new ATOM 0 HB3 ASN A 33 2.972 -5.136 -13.307 1.00 45.02 H new ATOM 0 HD21 ASN A 33 5.310 -3.347 -15.224 1.00 31.22 H new ATOM 0 HD22 ASN A 33 4.551 -3.559 -13.643 1.00 31.22 H new ATOM 558 N ASP A 34 6.599 -6.258 -13.039 1.00 44.25 N ATOM 559 CA ASP A 34 7.773 -5.633 -12.505 1.00 75.52 C ATOM 560 C ASP A 34 7.974 -4.307 -13.185 1.00 12.01 C ATOM 561 O ASP A 34 8.079 -4.219 -14.413 1.00 42.34 O ATOM 562 CB ASP A 34 9.041 -6.511 -12.618 1.00 3.00 C ATOM 563 CG ASP A 34 9.636 -6.639 -14.013 1.00 10.52 C ATOM 564 OD1 ASP A 34 9.179 -7.485 -14.799 1.00 74.22 O ATOM 565 OD2 ASP A 34 10.609 -5.916 -14.315 1.00 24.35 O ATOM 0 H ASP A 34 6.728 -6.731 -13.933 1.00 44.25 H new ATOM 0 HA ASP A 34 7.613 -5.488 -11.437 1.00 75.52 H new ATOM 0 HB2 ASP A 34 9.803 -6.102 -11.955 1.00 3.00 H new ATOM 0 HB3 ASP A 34 8.802 -7.510 -12.252 1.00 3.00 H new ATOM 570 N ALA A 35 7.974 -3.286 -12.411 1.00 24.35 N ATOM 571 CA ALA A 35 8.157 -1.957 -12.886 1.00 53.33 C ATOM 572 C ALA A 35 8.577 -1.115 -11.721 1.00 42.45 C ATOM 573 O ALA A 35 8.314 -1.493 -10.576 1.00 4.14 O ATOM 574 CB ALA A 35 6.851 -1.424 -13.480 1.00 45.34 C ATOM 0 H ALA A 35 7.844 -3.348 -11.401 1.00 24.35 H new ATOM 0 HA ALA A 35 8.915 -1.932 -13.668 1.00 53.33 H new ATOM 0 HB1 ALA A 35 7.004 -0.407 -13.840 1.00 45.34 H new ATOM 0 HB2 ALA A 35 6.542 -2.060 -14.310 1.00 45.34 H new ATOM 0 HB3 ALA A 35 6.076 -1.425 -12.714 1.00 45.34 H new ATOM 580 N PRO A 36 9.272 -0.008 -11.972 1.00 4.22 N ATOM 581 CA PRO A 36 9.646 0.933 -10.937 1.00 33.54 C ATOM 582 C PRO A 36 8.409 1.526 -10.327 1.00 51.22 C ATOM 583 O PRO A 36 7.397 1.707 -11.038 1.00 1.24 O ATOM 584 CB PRO A 36 10.429 2.013 -11.669 1.00 11.45 C ATOM 585 CG PRO A 36 10.113 1.841 -13.090 1.00 21.51 C ATOM 586 CD PRO A 36 9.757 0.410 -13.285 1.00 75.51 C ATOM 0 HA PRO A 36 10.222 0.471 -10.135 1.00 33.54 H new ATOM 0 HB2 PRO A 36 10.143 3.006 -11.322 1.00 11.45 H new ATOM 0 HB3 PRO A 36 11.499 1.909 -11.491 1.00 11.45 H new ATOM 0 HG2 PRO A 36 9.286 2.488 -13.382 1.00 21.51 H new ATOM 0 HG3 PRO A 36 10.966 2.114 -13.711 1.00 21.51 H new ATOM 0 HD2 PRO A 36 8.992 0.289 -14.052 1.00 75.51 H new ATOM 0 HD3 PRO A 36 10.619 -0.178 -13.599 1.00 75.51 H new ATOM 594 N ALA A 37 8.462 1.844 -9.046 1.00 33.23 N ATOM 595 CA ALA A 37 7.265 2.336 -8.337 1.00 72.44 C ATOM 596 C ALA A 37 6.687 3.568 -9.018 1.00 4.22 C ATOM 597 O ALA A 37 5.482 3.792 -9.022 1.00 73.30 O ATOM 598 CB ALA A 37 7.588 2.633 -6.896 1.00 74.41 C ATOM 0 H ALA A 37 9.302 1.777 -8.471 1.00 33.23 H new ATOM 0 HA ALA A 37 6.511 1.550 -8.370 1.00 72.44 H new ATOM 0 HB1 ALA A 37 6.693 2.995 -6.390 1.00 74.41 H new ATOM 0 HB2 ALA A 37 7.939 1.724 -6.407 1.00 74.41 H new ATOM 0 HB3 ALA A 37 8.366 3.395 -6.847 1.00 74.41 H new ATOM 604 N GLU A 38 7.564 4.331 -9.630 1.00 33.04 N ATOM 605 CA GLU A 38 7.202 5.547 -10.317 1.00 74.41 C ATOM 606 C GLU A 38 6.302 5.246 -11.505 1.00 55.24 C ATOM 607 O GLU A 38 5.296 5.926 -11.726 1.00 51.33 O ATOM 608 CB GLU A 38 8.464 6.252 -10.761 1.00 53.11 C ATOM 609 CG GLU A 38 8.250 7.595 -11.394 1.00 55.40 C ATOM 610 CD GLU A 38 9.550 8.224 -11.737 1.00 40.21 C ATOM 611 OE1 GLU A 38 10.184 8.827 -10.832 1.00 64.10 O ATOM 612 OE2 GLU A 38 9.991 8.099 -12.887 1.00 14.54 O ATOM 0 H GLU A 38 8.561 4.120 -9.664 1.00 33.04 H new ATOM 0 HA GLU A 38 6.645 6.196 -9.641 1.00 74.41 H new ATOM 0 HB2 GLU A 38 9.117 6.374 -9.897 1.00 53.11 H new ATOM 0 HB3 GLU A 38 8.989 5.612 -11.470 1.00 53.11 H new ATOM 0 HG2 GLU A 38 7.644 7.487 -12.293 1.00 55.40 H new ATOM 0 HG3 GLU A 38 7.696 8.240 -10.712 1.00 55.40 H new ATOM 619 N ASN A 39 6.642 4.206 -12.236 1.00 74.41 N ATOM 620 CA ASN A 39 5.865 3.805 -13.387 1.00 72.02 C ATOM 621 C ASN A 39 4.537 3.234 -12.986 1.00 21.35 C ATOM 622 O ASN A 39 3.538 3.411 -13.691 1.00 43.13 O ATOM 623 CB ASN A 39 6.622 2.855 -14.328 1.00 63.14 C ATOM 624 CG ASN A 39 7.675 3.559 -15.172 1.00 24.31 C ATOM 625 OD1 ASN A 39 7.572 4.755 -15.440 1.00 32.12 O ATOM 626 ND2 ASN A 39 8.643 2.821 -15.655 1.00 3.41 N ATOM 0 H ASN A 39 7.456 3.620 -12.051 1.00 74.41 H new ATOM 0 HA ASN A 39 5.682 4.716 -13.957 1.00 72.02 H new ATOM 0 HB2 ASN A 39 7.102 2.075 -13.737 1.00 63.14 H new ATOM 0 HB3 ASN A 39 5.908 2.362 -14.987 1.00 63.14 H new ATOM 0 HD21 ASN A 39 9.340 3.235 -16.273 1.00 3.41 H new ATOM 0 HD22 ASN A 39 8.700 1.832 -15.413 1.00 3.41 H new ATOM 633 N GLU A 40 4.503 2.563 -11.853 1.00 61.20 N ATOM 634 CA GLU A 40 3.262 1.978 -11.373 1.00 41.41 C ATOM 635 C GLU A 40 2.310 3.087 -10.920 1.00 14.41 C ATOM 636 O GLU A 40 1.095 3.020 -11.149 1.00 10.20 O ATOM 637 CB GLU A 40 3.531 0.964 -10.253 1.00 54.42 C ATOM 638 CG GLU A 40 4.406 -0.219 -10.691 1.00 5.31 C ATOM 639 CD GLU A 40 3.753 -1.109 -11.752 1.00 60.42 C ATOM 640 OE1 GLU A 40 3.574 -0.665 -12.907 1.00 40.45 O ATOM 641 OE2 GLU A 40 3.408 -2.263 -11.441 1.00 33.50 O ATOM 0 H GLU A 40 5.311 2.408 -11.250 1.00 61.20 H new ATOM 0 HA GLU A 40 2.786 1.432 -12.187 1.00 41.41 H new ATOM 0 HB2 GLU A 40 4.015 1.475 -9.421 1.00 54.42 H new ATOM 0 HB3 GLU A 40 2.579 0.583 -9.883 1.00 54.42 H new ATOM 0 HG2 GLU A 40 5.349 0.163 -11.081 1.00 5.31 H new ATOM 0 HG3 GLU A 40 4.645 -0.826 -9.818 1.00 5.31 H new ATOM 648 N VAL A 41 2.874 4.129 -10.318 1.00 24.25 N ATOM 649 CA VAL A 41 2.085 5.287 -9.885 1.00 24.24 C ATOM 650 C VAL A 41 1.588 6.064 -11.087 1.00 14.52 C ATOM 651 O VAL A 41 0.403 6.394 -11.168 1.00 32.35 O ATOM 652 CB VAL A 41 2.872 6.231 -8.936 1.00 62.51 C ATOM 653 CG1 VAL A 41 2.061 7.481 -8.615 1.00 61.24 C ATOM 654 CG2 VAL A 41 3.208 5.511 -7.656 1.00 31.32 C ATOM 0 H VAL A 41 3.872 4.200 -10.117 1.00 24.25 H new ATOM 0 HA VAL A 41 1.238 4.896 -9.321 1.00 24.24 H new ATOM 0 HB VAL A 41 3.790 6.530 -9.441 1.00 62.51 H new ATOM 0 HG11 VAL A 41 2.634 8.126 -7.949 1.00 61.24 H new ATOM 0 HG12 VAL A 41 1.839 8.018 -9.537 1.00 61.24 H new ATOM 0 HG13 VAL A 41 1.128 7.195 -8.129 1.00 61.24 H new ATOM 0 HG21 VAL A 41 3.760 6.180 -6.996 1.00 31.32 H new ATOM 0 HG22 VAL A 41 2.288 5.194 -7.165 1.00 31.32 H new ATOM 0 HG23 VAL A 41 3.819 4.637 -7.880 1.00 31.32 H new ATOM 664 N SER A 42 2.497 6.328 -12.025 1.00 11.32 N ATOM 665 CA SER A 42 2.185 7.027 -13.268 1.00 1.14 C ATOM 666 C SER A 42 0.995 6.352 -13.970 1.00 74.23 C ATOM 667 O SER A 42 0.120 7.022 -14.529 1.00 35.20 O ATOM 668 CB SER A 42 3.432 7.025 -14.177 1.00 1.00 C ATOM 669 OG SER A 42 3.218 7.714 -15.405 1.00 62.44 O ATOM 0 H SER A 42 3.478 6.060 -11.942 1.00 11.32 H new ATOM 0 HA SER A 42 1.907 8.058 -13.050 1.00 1.14 H new ATOM 0 HB2 SER A 42 4.264 7.487 -13.646 1.00 1.00 H new ATOM 0 HB3 SER A 42 3.721 5.995 -14.388 1.00 1.00 H new ATOM 0 HG SER A 42 4.037 7.685 -15.943 1.00 62.44 H new ATOM 675 N TYR A 43 0.964 5.038 -13.906 1.00 61.54 N ATOM 676 CA TYR A 43 -0.106 4.261 -14.474 1.00 13.13 C ATOM 677 C TYR A 43 -1.412 4.452 -13.690 1.00 24.54 C ATOM 678 O TYR A 43 -2.437 4.780 -14.262 1.00 33.35 O ATOM 679 CB TYR A 43 0.292 2.780 -14.500 1.00 65.35 C ATOM 680 CG TYR A 43 -0.794 1.854 -14.978 1.00 23.45 C ATOM 681 CD1 TYR A 43 -1.122 1.788 -16.314 1.00 43.20 C ATOM 682 CD2 TYR A 43 -1.497 1.054 -14.085 1.00 71.00 C ATOM 683 CE1 TYR A 43 -2.114 0.953 -16.759 1.00 35.14 C ATOM 684 CE2 TYR A 43 -2.495 0.210 -14.525 1.00 53.13 C ATOM 685 CZ TYR A 43 -2.797 0.166 -15.866 1.00 74.42 C ATOM 686 OH TYR A 43 -3.796 -0.670 -16.316 1.00 23.22 O ATOM 0 H TYR A 43 1.688 4.479 -13.454 1.00 61.54 H new ATOM 0 HA TYR A 43 -0.281 4.607 -15.493 1.00 13.13 H new ATOM 0 HB2 TYR A 43 1.163 2.662 -15.144 1.00 65.35 H new ATOM 0 HB3 TYR A 43 0.594 2.479 -13.497 1.00 65.35 H new ATOM 0 HD1 TYR A 43 -0.589 2.404 -17.023 1.00 43.20 H new ATOM 0 HD2 TYR A 43 -1.259 1.094 -13.032 1.00 71.00 H new ATOM 0 HE1 TYR A 43 -2.358 0.915 -17.810 1.00 35.14 H new ATOM 0 HE2 TYR A 43 -3.034 -0.410 -13.824 1.00 53.13 H new ATOM 0 HH TYR A 43 -4.179 -1.159 -15.558 1.00 23.22 H new ATOM 696 N MET A 44 -1.347 4.261 -12.388 1.00 41.15 N ATOM 697 CA MET A 44 -2.513 4.324 -11.519 1.00 71.12 C ATOM 698 C MET A 44 -3.209 5.691 -11.534 1.00 44.25 C ATOM 699 O MET A 44 -4.431 5.764 -11.635 1.00 30.30 O ATOM 700 CB MET A 44 -2.125 3.853 -10.104 1.00 13.50 C ATOM 701 CG MET A 44 -3.219 3.908 -9.039 1.00 21.05 C ATOM 702 SD MET A 44 -3.514 5.558 -8.347 1.00 10.54 S ATOM 703 CE MET A 44 -1.905 5.916 -7.617 1.00 2.15 C ATOM 0 H MET A 44 -0.478 4.056 -11.895 1.00 41.15 H new ATOM 0 HA MET A 44 -3.267 3.642 -11.911 1.00 71.12 H new ATOM 0 HB2 MET A 44 -1.769 2.825 -10.173 1.00 13.50 H new ATOM 0 HB3 MET A 44 -1.286 4.459 -9.762 1.00 13.50 H new ATOM 0 HG2 MET A 44 -4.148 3.538 -9.472 1.00 21.05 H new ATOM 0 HG3 MET A 44 -2.953 3.230 -8.228 1.00 21.05 H new ATOM 0 HE1 MET A 44 -1.939 6.886 -7.120 1.00 2.15 H new ATOM 0 HE2 MET A 44 -1.656 5.144 -6.889 1.00 2.15 H new ATOM 0 HE3 MET A 44 -1.147 5.935 -8.400 1.00 2.15 H new ATOM 713 N ILE A 45 -2.442 6.753 -11.483 1.00 41.21 N ATOM 714 CA ILE A 45 -3.022 8.101 -11.469 1.00 33.43 C ATOM 715 C ILE A 45 -3.603 8.478 -12.836 1.00 52.31 C ATOM 716 O ILE A 45 -4.476 9.337 -12.940 1.00 44.32 O ATOM 717 CB ILE A 45 -1.997 9.187 -11.029 1.00 13.35 C ATOM 718 CG1 ILE A 45 -0.788 9.233 -11.985 1.00 71.41 C ATOM 719 CG2 ILE A 45 -1.549 8.947 -9.592 1.00 74.54 C ATOM 720 CD1 ILE A 45 0.249 10.282 -11.632 1.00 11.45 C ATOM 0 H ILE A 45 -1.423 6.726 -11.450 1.00 41.21 H new ATOM 0 HA ILE A 45 -3.825 8.071 -10.732 1.00 33.43 H new ATOM 0 HB ILE A 45 -2.491 10.158 -11.076 1.00 13.35 H new ATOM 0 HG12 ILE A 45 -0.309 8.254 -11.993 1.00 71.41 H new ATOM 0 HG13 ILE A 45 -1.147 9.420 -12.997 1.00 71.41 H new ATOM 0 HG21 ILE A 45 -0.833 9.715 -9.301 1.00 74.54 H new ATOM 0 HG22 ILE A 45 -2.414 8.988 -8.930 1.00 74.54 H new ATOM 0 HG23 ILE A 45 -1.080 7.966 -9.516 1.00 74.54 H new ATOM 0 HD11 ILE A 45 1.064 10.246 -12.355 1.00 11.45 H new ATOM 0 HD12 ILE A 45 -0.211 11.270 -11.653 1.00 11.45 H new ATOM 0 HD13 ILE A 45 0.640 10.085 -10.634 1.00 11.45 H new ATOM 732 N SER A 46 -3.139 7.814 -13.867 1.00 54.41 N ATOM 733 CA SER A 46 -3.545 8.138 -15.205 1.00 73.15 C ATOM 734 C SER A 46 -4.527 7.108 -15.770 1.00 44.05 C ATOM 735 O SER A 46 -5.020 7.283 -16.881 1.00 34.22 O ATOM 736 CB SER A 46 -2.299 8.258 -16.102 1.00 34.55 C ATOM 737 OG SER A 46 -2.614 8.650 -17.435 1.00 60.34 O ATOM 0 H SER A 46 -2.476 7.042 -13.800 1.00 54.41 H new ATOM 0 HA SER A 46 -4.070 9.093 -15.183 1.00 73.15 H new ATOM 0 HB2 SER A 46 -1.613 8.984 -15.667 1.00 34.55 H new ATOM 0 HB3 SER A 46 -1.779 7.301 -16.123 1.00 34.55 H new ATOM 0 HG SER A 46 -3.506 8.320 -17.671 1.00 60.34 H new ATOM 743 N ASN A 47 -4.831 6.049 -15.017 1.00 1.42 N ATOM 744 CA ASN A 47 -5.699 5.003 -15.556 1.00 31.14 C ATOM 745 C ASN A 47 -7.125 5.485 -15.711 1.00 45.14 C ATOM 746 O ASN A 47 -7.776 5.192 -16.708 1.00 44.43 O ATOM 747 CB ASN A 47 -5.609 3.657 -14.767 1.00 62.21 C ATOM 748 CG ASN A 47 -6.074 3.687 -13.297 1.00 13.23 C ATOM 749 OD1 ASN A 47 -6.981 4.411 -12.908 1.00 31.24 O ATOM 750 ND2 ASN A 47 -5.450 2.901 -12.486 1.00 74.32 N ATOM 0 H ASN A 47 -4.502 5.895 -14.064 1.00 1.42 H new ATOM 0 HA ASN A 47 -5.322 4.780 -16.554 1.00 31.14 H new ATOM 0 HB2 ASN A 47 -6.202 2.911 -15.297 1.00 62.21 H new ATOM 0 HB3 ASN A 47 -4.574 3.317 -14.790 1.00 62.21 H new ATOM 0 HD21 ASN A 47 -5.710 2.875 -11.500 1.00 74.32 H new ATOM 0 HD22 ASN A 47 -4.697 2.306 -12.831 1.00 74.32 H new ATOM 757 N ASN A 48 -7.605 6.220 -14.698 1.00 31.25 N ATOM 758 CA ASN A 48 -8.959 6.830 -14.675 1.00 32.14 C ATOM 759 C ASN A 48 -10.043 5.729 -14.662 1.00 62.41 C ATOM 760 O ASN A 48 -11.229 5.998 -14.721 1.00 41.43 O ATOM 761 CB ASN A 48 -9.127 7.773 -15.907 1.00 63.31 C ATOM 762 CG ASN A 48 -10.407 8.607 -15.919 1.00 32.21 C ATOM 763 OD1 ASN A 48 -10.435 9.715 -15.382 1.00 73.23 O ATOM 764 ND2 ASN A 48 -11.447 8.112 -16.550 1.00 74.33 N ATOM 0 H ASN A 48 -7.063 6.415 -13.856 1.00 31.25 H new ATOM 0 HA ASN A 48 -9.076 7.422 -13.767 1.00 32.14 H new ATOM 0 HB2 ASN A 48 -8.272 8.448 -15.947 1.00 63.31 H new ATOM 0 HB3 ASN A 48 -9.098 7.168 -16.814 1.00 63.31 H new ATOM 0 HD21 ASN A 48 -12.312 8.649 -16.606 1.00 74.33 H new ATOM 0 HD22 ASN A 48 -11.389 7.191 -16.984 1.00 74.33 H new ATOM 771 N ASN A 49 -9.615 4.497 -14.515 1.00 55.32 N ATOM 772 CA ASN A 49 -10.510 3.373 -14.646 1.00 25.15 C ATOM 773 C ASN A 49 -11.102 2.944 -13.311 1.00 61.33 C ATOM 774 O ASN A 49 -12.251 3.265 -13.016 1.00 32.32 O ATOM 775 CB ASN A 49 -9.820 2.213 -15.394 1.00 21.41 C ATOM 776 CG ASN A 49 -10.732 1.019 -15.661 1.00 11.31 C ATOM 777 OD1 ASN A 49 -11.442 0.985 -16.664 1.00 73.42 O ATOM 778 ND2 ASN A 49 -10.677 0.016 -14.815 1.00 11.43 N ATOM 0 H ASN A 49 -8.649 4.248 -14.304 1.00 55.32 H new ATOM 0 HA ASN A 49 -11.359 3.692 -15.251 1.00 25.15 H new ATOM 0 HB2 ASN A 49 -9.436 2.584 -16.344 1.00 21.41 H new ATOM 0 HB3 ASN A 49 -8.961 1.879 -14.812 1.00 21.41 H new ATOM 0 HD21 ASN A 49 -11.234 -0.822 -14.981 1.00 11.43 H new ATOM 0 HD22 ASN A 49 -10.078 0.075 -13.992 1.00 11.43 H new ATOM 785 N GLU A 50 -10.321 2.278 -12.470 1.00 24.42 N ATOM 786 CA GLU A 50 -10.870 1.780 -11.209 1.00 11.21 C ATOM 787 C GLU A 50 -9.894 1.874 -10.049 1.00 34.51 C ATOM 788 O GLU A 50 -10.180 2.523 -9.047 1.00 13.45 O ATOM 789 CB GLU A 50 -11.351 0.324 -11.376 1.00 62.44 C ATOM 790 CG GLU A 50 -11.883 -0.317 -10.095 1.00 24.41 C ATOM 791 CD GLU A 50 -12.333 -1.745 -10.295 1.00 1.14 C ATOM 792 OE1 GLU A 50 -11.491 -2.663 -10.267 1.00 23.25 O ATOM 793 OE2 GLU A 50 -13.549 -1.980 -10.462 1.00 1.32 O ATOM 0 H GLU A 50 -9.334 2.073 -12.627 1.00 24.42 H new ATOM 0 HA GLU A 50 -11.712 2.426 -10.962 1.00 11.21 H new ATOM 0 HB2 GLU A 50 -12.135 0.298 -12.133 1.00 62.44 H new ATOM 0 HB3 GLU A 50 -10.524 -0.278 -11.752 1.00 62.44 H new ATOM 0 HG2 GLU A 50 -11.106 -0.290 -9.331 1.00 24.41 H new ATOM 0 HG3 GLU A 50 -12.719 0.273 -9.720 1.00 24.41 H new ATOM 800 N VAL A 51 -8.730 1.298 -10.211 1.00 71.15 N ATOM 801 CA VAL A 51 -7.841 1.096 -9.090 1.00 12.34 C ATOM 802 C VAL A 51 -7.013 2.326 -8.767 1.00 62.41 C ATOM 803 O VAL A 51 -6.437 2.977 -9.658 1.00 42.24 O ATOM 804 CB VAL A 51 -6.887 -0.113 -9.350 1.00 12.03 C ATOM 805 CG1 VAL A 51 -5.970 -0.381 -8.157 1.00 0.14 C ATOM 806 CG2 VAL A 51 -7.686 -1.360 -9.695 1.00 21.32 C ATOM 0 H VAL A 51 -8.374 0.960 -11.105 1.00 71.15 H new ATOM 0 HA VAL A 51 -8.479 0.888 -8.231 1.00 12.34 H new ATOM 0 HB VAL A 51 -6.255 0.148 -10.199 1.00 12.03 H new ATOM 0 HG11 VAL A 51 -5.323 -1.229 -8.379 1.00 0.14 H new ATOM 0 HG12 VAL A 51 -5.359 0.500 -7.963 1.00 0.14 H new ATOM 0 HG13 VAL A 51 -6.573 -0.605 -7.277 1.00 0.14 H new ATOM 0 HG21 VAL A 51 -7.004 -2.192 -9.873 1.00 21.32 H new ATOM 0 HG22 VAL A 51 -8.351 -1.607 -8.867 1.00 21.32 H new ATOM 0 HG23 VAL A 51 -8.277 -1.177 -10.593 1.00 21.32 H new ATOM 816 N SER A 52 -6.996 2.635 -7.499 1.00 70.42 N ATOM 817 CA SER A 52 -6.200 3.669 -6.923 1.00 33.45 C ATOM 818 C SER A 52 -5.411 3.054 -5.766 1.00 22.34 C ATOM 819 O SER A 52 -5.848 2.082 -5.162 1.00 23.52 O ATOM 820 CB SER A 52 -7.104 4.751 -6.333 1.00 65.34 C ATOM 821 OG SER A 52 -8.098 5.190 -7.247 1.00 71.33 O ATOM 0 H SER A 52 -7.567 2.145 -6.811 1.00 70.42 H new ATOM 0 HA SER A 52 -5.548 4.100 -7.683 1.00 33.45 H new ATOM 0 HB2 SER A 52 -7.586 4.366 -5.435 1.00 65.34 H new ATOM 0 HB3 SER A 52 -6.495 5.602 -6.028 1.00 65.34 H new ATOM 0 HG SER A 52 -8.987 5.020 -6.870 1.00 71.33 H new ATOM 827 N PHE A 53 -4.280 3.603 -5.471 1.00 41.32 N ATOM 828 CA PHE A 53 -3.525 3.206 -4.321 1.00 62.24 C ATOM 829 C PHE A 53 -2.778 4.418 -3.852 1.00 43.23 C ATOM 830 O PHE A 53 -2.669 5.380 -4.592 1.00 34.12 O ATOM 831 CB PHE A 53 -2.562 2.018 -4.601 1.00 5.14 C ATOM 832 CG PHE A 53 -1.468 2.293 -5.590 1.00 74.42 C ATOM 833 CD1 PHE A 53 -0.394 3.077 -5.233 1.00 64.23 C ATOM 834 CD2 PHE A 53 -1.510 1.765 -6.860 1.00 71.13 C ATOM 835 CE1 PHE A 53 0.607 3.344 -6.102 1.00 73.33 C ATOM 836 CE2 PHE A 53 -0.490 2.023 -7.758 1.00 20.23 C ATOM 837 CZ PHE A 53 0.572 2.818 -7.377 1.00 3.51 C ATOM 0 H PHE A 53 -3.848 4.345 -6.022 1.00 41.32 H new ATOM 0 HA PHE A 53 -4.203 2.837 -3.551 1.00 62.24 H new ATOM 0 HB2 PHE A 53 -2.108 1.711 -3.659 1.00 5.14 H new ATOM 0 HB3 PHE A 53 -3.150 1.174 -4.961 1.00 5.14 H new ATOM 0 HD1 PHE A 53 -0.350 3.488 -4.235 1.00 64.23 H new ATOM 0 HD2 PHE A 53 -2.344 1.146 -7.157 1.00 71.13 H new ATOM 0 HE1 PHE A 53 1.434 3.969 -5.798 1.00 73.33 H new ATOM 0 HE2 PHE A 53 -0.524 1.604 -8.753 1.00 20.23 H new ATOM 0 HZ PHE A 53 1.371 3.027 -8.073 1.00 3.51 H new ATOM 847 N HIS A 54 -2.246 4.384 -2.680 1.00 73.41 N ATOM 848 CA HIS A 54 -1.576 5.549 -2.166 1.00 35.42 C ATOM 849 C HIS A 54 -0.132 5.584 -2.532 1.00 2.45 C ATOM 850 O HIS A 54 0.307 6.480 -3.247 1.00 22.54 O ATOM 851 CB HIS A 54 -1.739 5.679 -0.657 1.00 54.31 C ATOM 852 CG HIS A 54 -3.140 5.901 -0.204 1.00 11.32 C ATOM 853 ND1 HIS A 54 -3.982 4.853 0.053 1.00 2.31 N ATOM 854 CD2 HIS A 54 -3.782 7.062 0.042 1.00 31.44 C ATOM 855 CE1 HIS A 54 -5.119 5.412 0.452 1.00 62.23 C ATOM 856 NE2 HIS A 54 -5.039 6.730 0.456 1.00 10.54 N ATOM 0 H HIS A 54 -2.256 3.576 -2.057 1.00 73.41 H new ATOM 0 HA HIS A 54 -2.060 6.404 -2.639 1.00 35.42 H new ATOM 0 HB2 HIS A 54 -1.357 4.775 -0.184 1.00 54.31 H new ATOM 0 HB3 HIS A 54 -1.122 6.507 -0.308 1.00 54.31 H new ATOM 0 HD2 HIS A 54 -3.380 8.058 -0.067 1.00 31.44 H new ATOM 0 HE1 HIS A 54 -6.000 4.857 0.738 1.00 62.23 H new ATOM 0 HE2 HIS A 54 -5.780 7.380 0.720 1.00 10.54 H new ATOM 864 N ILE A 55 0.600 4.614 -2.082 1.00 62.43 N ATOM 865 CA ILE A 55 2.023 4.654 -2.224 1.00 64.11 C ATOM 866 C ILE A 55 2.526 3.387 -2.862 1.00 20.33 C ATOM 867 O ILE A 55 2.129 2.280 -2.479 1.00 20.43 O ATOM 868 CB ILE A 55 2.706 4.810 -0.835 1.00 12.23 C ATOM 869 CG1 ILE A 55 2.119 6.009 -0.071 1.00 71.32 C ATOM 870 CG2 ILE A 55 4.200 5.053 -1.049 1.00 73.22 C ATOM 871 CD1 ILE A 55 2.387 6.003 1.414 1.00 71.43 C ATOM 0 H ILE A 55 0.237 3.784 -1.613 1.00 62.43 H new ATOM 0 HA ILE A 55 2.269 5.508 -2.855 1.00 64.11 H new ATOM 0 HB ILE A 55 2.536 3.903 -0.255 1.00 12.23 H new ATOM 0 HG12 ILE A 55 2.525 6.927 -0.496 1.00 71.32 H new ATOM 0 HG13 ILE A 55 1.041 6.032 -0.232 1.00 71.32 H new ATOM 0 HG21 ILE A 55 4.693 5.164 -0.083 1.00 73.22 H new ATOM 0 HG22 ILE A 55 4.634 4.207 -1.582 1.00 73.22 H new ATOM 0 HG23 ILE A 55 4.341 5.961 -1.635 1.00 73.22 H new ATOM 0 HD11 ILE A 55 1.936 6.885 1.869 1.00 71.43 H new ATOM 0 HD12 ILE A 55 1.956 5.106 1.858 1.00 71.43 H new ATOM 0 HD13 ILE A 55 3.463 6.014 1.590 1.00 71.43 H new ATOM 883 N ALA A 56 3.374 3.546 -3.824 1.00 70.23 N ATOM 884 CA ALA A 56 4.026 2.420 -4.446 1.00 63.20 C ATOM 885 C ALA A 56 5.473 2.451 -4.065 1.00 31.40 C ATOM 886 O ALA A 56 6.127 3.493 -4.170 1.00 3.13 O ATOM 887 CB ALA A 56 3.886 2.455 -5.952 1.00 43.50 C ATOM 0 H ALA A 56 3.640 4.453 -4.207 1.00 70.23 H new ATOM 0 HA ALA A 56 3.555 1.500 -4.101 1.00 63.20 H new ATOM 0 HB1 ALA A 56 4.390 1.591 -6.384 1.00 43.50 H new ATOM 0 HB2 ALA A 56 2.830 2.431 -6.220 1.00 43.50 H new ATOM 0 HB3 ALA A 56 4.337 3.369 -6.338 1.00 43.50 H new ATOM 893 N VAL A 57 5.970 1.352 -3.595 1.00 2.34 N ATOM 894 CA VAL A 57 7.352 1.265 -3.189 1.00 31.21 C ATOM 895 C VAL A 57 8.062 0.175 -3.977 1.00 3.31 C ATOM 896 O VAL A 57 7.590 -0.974 -4.031 1.00 61.12 O ATOM 897 CB VAL A 57 7.483 0.968 -1.670 1.00 44.32 C ATOM 898 CG1 VAL A 57 8.937 0.954 -1.249 1.00 60.41 C ATOM 899 CG2 VAL A 57 6.705 1.984 -0.847 1.00 14.03 C ATOM 0 H VAL A 57 5.439 0.489 -3.479 1.00 2.34 H new ATOM 0 HA VAL A 57 7.815 2.231 -3.392 1.00 31.21 H new ATOM 0 HB VAL A 57 7.059 -0.019 -1.485 1.00 44.32 H new ATOM 0 HG11 VAL A 57 9.005 0.744 -0.182 1.00 60.41 H new ATOM 0 HG12 VAL A 57 9.469 0.182 -1.805 1.00 60.41 H new ATOM 0 HG13 VAL A 57 9.385 1.926 -1.457 1.00 60.41 H new ATOM 0 HG21 VAL A 57 6.813 1.753 0.213 1.00 14.03 H new ATOM 0 HG22 VAL A 57 7.093 2.984 -1.042 1.00 14.03 H new ATOM 0 HG23 VAL A 57 5.651 1.944 -1.121 1.00 14.03 H new ATOM 909 N ASP A 58 9.167 0.519 -4.598 1.00 10.44 N ATOM 910 CA ASP A 58 9.931 -0.466 -5.321 1.00 61.55 C ATOM 911 C ASP A 58 11.316 -0.586 -4.723 1.00 73.10 C ATOM 912 O ASP A 58 11.629 0.045 -3.700 1.00 4.15 O ATOM 913 CB ASP A 58 10.016 -0.196 -6.861 1.00 23.43 C ATOM 914 CG ASP A 58 11.046 0.838 -7.329 1.00 64.13 C ATOM 915 OD1 ASP A 58 12.194 0.453 -7.592 1.00 55.50 O ATOM 916 OD2 ASP A 58 10.710 2.018 -7.504 1.00 63.42 O ATOM 0 H ASP A 58 9.552 1.463 -4.616 1.00 10.44 H new ATOM 0 HA ASP A 58 9.397 -1.410 -5.216 1.00 61.55 H new ATOM 0 HB2 ASP A 58 10.234 -1.141 -7.359 1.00 23.43 H new ATOM 0 HB3 ASP A 58 9.033 0.126 -7.204 1.00 23.43 H new ATOM 921 N ASP A 59 12.119 -1.415 -5.344 1.00 62.11 N ATOM 922 CA ASP A 59 13.511 -1.661 -4.949 1.00 10.22 C ATOM 923 C ASP A 59 14.322 -0.376 -4.865 1.00 33.32 C ATOM 924 O ASP A 59 15.172 -0.209 -3.982 1.00 71.15 O ATOM 925 CB ASP A 59 14.150 -2.663 -5.936 1.00 14.25 C ATOM 926 CG ASP A 59 15.621 -2.430 -6.196 1.00 71.13 C ATOM 927 OD1 ASP A 59 16.459 -2.797 -5.374 1.00 24.35 O ATOM 928 OD2 ASP A 59 15.944 -1.886 -7.271 1.00 64.32 O ATOM 0 H ASP A 59 11.830 -1.957 -6.158 1.00 62.11 H new ATOM 0 HA ASP A 59 13.513 -2.088 -3.946 1.00 10.22 H new ATOM 0 HB2 ASP A 59 14.018 -3.673 -5.547 1.00 14.25 H new ATOM 0 HB3 ASP A 59 13.614 -2.614 -6.884 1.00 14.25 H new ATOM 933 N LYS A 60 14.023 0.526 -5.734 1.00 24.32 N ATOM 934 CA LYS A 60 14.728 1.754 -5.836 1.00 20.50 C ATOM 935 C LYS A 60 14.028 2.925 -5.148 1.00 32.45 C ATOM 936 O LYS A 60 14.580 3.509 -4.207 1.00 55.14 O ATOM 937 CB LYS A 60 15.060 2.046 -7.299 1.00 44.24 C ATOM 938 CG LYS A 60 15.492 3.454 -7.579 1.00 50.54 C ATOM 939 CD LYS A 60 16.049 3.596 -8.976 1.00 14.31 C ATOM 940 CE LYS A 60 16.535 5.009 -9.236 1.00 13.45 C ATOM 941 NZ LYS A 60 17.166 5.138 -10.566 1.00 50.43 N ATOM 0 H LYS A 60 13.264 0.427 -6.408 1.00 24.32 H new ATOM 0 HA LYS A 60 15.661 1.637 -5.285 1.00 20.50 H new ATOM 0 HB2 LYS A 60 15.851 1.368 -7.619 1.00 44.24 H new ATOM 0 HB3 LYS A 60 14.183 1.823 -7.907 1.00 44.24 H new ATOM 0 HG2 LYS A 60 14.644 4.127 -7.454 1.00 50.54 H new ATOM 0 HG3 LYS A 60 16.247 3.755 -6.853 1.00 50.54 H new ATOM 0 HD2 LYS A 60 16.872 2.895 -9.114 1.00 14.31 H new ATOM 0 HD3 LYS A 60 15.281 3.334 -9.704 1.00 14.31 H new ATOM 0 HE2 LYS A 60 15.696 5.701 -9.164 1.00 13.45 H new ATOM 0 HE3 LYS A 60 17.251 5.294 -8.465 1.00 13.45 H new ATOM 0 HZ1 LYS A 60 17.485 6.118 -10.705 1.00 50.43 H new ATOM 0 HZ2 LYS A 60 17.982 4.496 -10.627 1.00 50.43 H new ATOM 0 HZ3 LYS A 60 16.476 4.890 -11.303 1.00 50.43 H new ATOM 955 N LYS A 61 12.835 3.262 -5.575 1.00 62.41 N ATOM 956 CA LYS A 61 12.175 4.433 -5.060 1.00 54.01 C ATOM 957 C LYS A 61 10.754 4.186 -4.631 1.00 15.02 C ATOM 958 O LYS A 61 10.160 3.166 -4.953 1.00 45.35 O ATOM 959 CB LYS A 61 12.327 5.650 -6.017 1.00 22.41 C ATOM 960 CG LYS A 61 12.079 5.370 -7.493 1.00 12.20 C ATOM 961 CD LYS A 61 12.317 6.625 -8.330 1.00 72.42 C ATOM 962 CE LYS A 61 12.290 6.331 -9.824 1.00 2.33 C ATOM 963 NZ LYS A 61 12.531 7.552 -10.644 1.00 71.23 N ATOM 0 H LYS A 61 12.305 2.743 -6.275 1.00 62.41 H new ATOM 0 HA LYS A 61 12.695 4.695 -4.138 1.00 54.01 H new ATOM 0 HB2 LYS A 61 11.637 6.430 -5.694 1.00 22.41 H new ATOM 0 HB3 LYS A 61 13.335 6.050 -5.907 1.00 22.41 H new ATOM 0 HG2 LYS A 61 12.738 4.571 -7.832 1.00 12.20 H new ATOM 0 HG3 LYS A 61 11.056 5.021 -7.635 1.00 12.20 H new ATOM 0 HD2 LYS A 61 11.555 7.368 -8.093 1.00 72.42 H new ATOM 0 HD3 LYS A 61 13.280 7.060 -8.064 1.00 72.42 H new ATOM 0 HE2 LYS A 61 13.047 5.583 -10.059 1.00 2.33 H new ATOM 0 HE3 LYS A 61 11.324 5.902 -10.090 1.00 2.33 H new ATOM 0 HZ1 LYS A 61 12.622 7.285 -11.645 1.00 71.23 H new ATOM 0 HZ2 LYS A 61 11.733 8.209 -10.531 1.00 71.23 H new ATOM 0 HZ3 LYS A 61 13.407 8.015 -10.328 1.00 71.23 H new ATOM 977 N ALA A 62 10.251 5.090 -3.857 1.00 14.02 N ATOM 978 CA ALA A 62 8.906 5.032 -3.371 1.00 24.41 C ATOM 979 C ALA A 62 8.213 6.250 -3.864 1.00 60.54 C ATOM 980 O ALA A 62 8.716 7.351 -3.708 1.00 20.14 O ATOM 981 CB ALA A 62 8.878 4.993 -1.850 1.00 51.32 C ATOM 0 H ALA A 62 10.771 5.907 -3.537 1.00 14.02 H new ATOM 0 HA ALA A 62 8.413 4.127 -3.727 1.00 24.41 H new ATOM 0 HB1 ALA A 62 7.845 4.949 -1.506 1.00 51.32 H new ATOM 0 HB2 ALA A 62 9.415 4.112 -1.499 1.00 51.32 H new ATOM 0 HB3 ALA A 62 9.354 5.890 -1.454 1.00 51.32 H new ATOM 987 N ILE A 63 7.099 6.074 -4.474 1.00 41.34 N ATOM 988 CA ILE A 63 6.379 7.169 -5.037 1.00 44.40 C ATOM 989 C ILE A 63 4.978 7.149 -4.530 1.00 60.40 C ATOM 990 O ILE A 63 4.336 6.094 -4.487 1.00 51.10 O ATOM 991 CB ILE A 63 6.364 7.176 -6.616 1.00 34.21 C ATOM 992 CG1 ILE A 63 7.768 7.282 -7.217 1.00 24.32 C ATOM 993 CG2 ILE A 63 5.509 8.314 -7.152 1.00 42.13 C ATOM 994 CD1 ILE A 63 8.605 6.040 -7.145 1.00 61.15 C ATOM 0 H ILE A 63 6.654 5.165 -4.601 1.00 41.34 H new ATOM 0 HA ILE A 63 6.899 8.076 -4.728 1.00 44.40 H new ATOM 0 HB ILE A 63 5.935 6.220 -6.916 1.00 34.21 H new ATOM 0 HG12 ILE A 63 7.674 7.574 -8.263 1.00 24.32 H new ATOM 0 HG13 ILE A 63 8.300 8.086 -6.709 1.00 24.32 H new ATOM 0 HG21 ILE A 63 5.518 8.293 -8.242 1.00 42.13 H new ATOM 0 HG22 ILE A 63 4.486 8.199 -6.795 1.00 42.13 H new ATOM 0 HG23 ILE A 63 5.910 9.266 -6.804 1.00 42.13 H new ATOM 0 HD11 ILE A 63 9.577 6.230 -7.600 1.00 61.15 H new ATOM 0 HD12 ILE A 63 8.742 5.753 -6.102 1.00 61.15 H new ATOM 0 HD13 ILE A 63 8.105 5.233 -7.681 1.00 61.15 H new ATOM 1006 N GLN A 64 4.502 8.275 -4.131 1.00 54.34 N ATOM 1007 CA GLN A 64 3.147 8.346 -3.665 1.00 53.42 C ATOM 1008 C GLN A 64 2.282 9.013 -4.726 1.00 44.13 C ATOM 1009 O GLN A 64 2.706 9.995 -5.356 1.00 42.42 O ATOM 1010 CB GLN A 64 3.034 9.093 -2.348 1.00 64.40 C ATOM 1011 CG GLN A 64 1.661 8.969 -1.736 1.00 52.24 C ATOM 1012 CD GLN A 64 1.463 9.816 -0.498 1.00 1.41 C ATOM 1013 OE1 GLN A 64 2.403 10.089 0.256 1.00 12.21 O ATOM 1014 NE2 GLN A 64 0.250 10.213 -0.267 1.00 71.14 N ATOM 0 H GLN A 64 5.017 9.155 -4.114 1.00 54.34 H new ATOM 0 HA GLN A 64 2.798 7.329 -3.487 1.00 53.42 H new ATOM 0 HB2 GLN A 64 3.777 8.708 -1.649 1.00 64.40 H new ATOM 0 HB3 GLN A 64 3.264 10.146 -2.509 1.00 64.40 H new ATOM 0 HG2 GLN A 64 0.916 9.250 -2.480 1.00 52.24 H new ATOM 0 HG3 GLN A 64 1.480 7.924 -1.482 1.00 52.24 H new ATOM 0 HE21 GLN A 64 -0.499 9.967 -0.914 1.00 71.14 H new ATOM 0 HE22 GLN A 64 0.045 10.771 0.562 1.00 71.14 H new ATOM 1023 N GLY A 65 1.091 8.480 -4.918 1.00 75.11 N ATOM 1024 CA GLY A 65 0.201 8.981 -5.955 1.00 34.13 C ATOM 1025 C GLY A 65 -1.140 9.478 -5.435 1.00 53.11 C ATOM 1026 O GLY A 65 -1.711 10.407 -5.980 1.00 10.44 O ATOM 0 H GLY A 65 0.716 7.703 -4.374 1.00 75.11 H new ATOM 0 HA2 GLY A 65 0.698 9.795 -6.484 1.00 34.13 H new ATOM 0 HA3 GLY A 65 0.026 8.188 -6.682 1.00 34.13 H new ATOM 1030 N ILE A 66 -1.650 8.870 -4.408 1.00 63.23 N ATOM 1031 CA ILE A 66 -2.912 9.319 -3.833 1.00 75.14 C ATOM 1032 C ILE A 66 -2.667 9.809 -2.413 1.00 1.41 C ATOM 1033 O ILE A 66 -1.910 9.180 -1.669 1.00 34.33 O ATOM 1034 CB ILE A 66 -4.002 8.190 -3.870 1.00 61.33 C ATOM 1035 CG1 ILE A 66 -4.333 7.808 -5.324 1.00 43.14 C ATOM 1036 CG2 ILE A 66 -5.274 8.563 -3.104 1.00 34.12 C ATOM 1037 CD1 ILE A 66 -4.925 8.917 -6.149 1.00 50.22 C ATOM 0 H ILE A 66 -1.227 8.066 -3.943 1.00 63.23 H new ATOM 0 HA ILE A 66 -3.300 10.142 -4.434 1.00 75.14 H new ATOM 0 HB ILE A 66 -3.577 7.325 -3.361 1.00 61.33 H new ATOM 0 HG12 ILE A 66 -3.421 7.460 -5.810 1.00 43.14 H new ATOM 0 HG13 ILE A 66 -5.029 6.970 -5.315 1.00 43.14 H new ATOM 0 HG21 ILE A 66 -5.990 7.743 -3.166 1.00 34.12 H new ATOM 0 HG22 ILE A 66 -5.027 8.751 -2.059 1.00 34.12 H new ATOM 0 HG23 ILE A 66 -5.712 9.461 -3.541 1.00 34.12 H new ATOM 0 HD11 ILE A 66 -5.125 8.554 -7.157 1.00 50.22 H new ATOM 0 HD12 ILE A 66 -5.857 9.252 -5.693 1.00 50.22 H new ATOM 0 HD13 ILE A 66 -4.224 9.750 -6.196 1.00 50.22 H new ATOM 1049 N PRO A 67 -3.236 10.982 -2.040 1.00 24.04 N ATOM 1050 CA PRO A 67 -3.079 11.544 -0.698 1.00 31.45 C ATOM 1051 C PRO A 67 -3.646 10.619 0.386 1.00 23.32 C ATOM 1052 O PRO A 67 -4.764 10.124 0.275 1.00 51.34 O ATOM 1053 CB PRO A 67 -3.858 12.868 -0.749 1.00 12.05 C ATOM 1054 CG PRO A 67 -4.758 12.748 -1.929 1.00 54.20 C ATOM 1055 CD PRO A 67 -4.060 11.853 -2.904 1.00 51.44 C ATOM 0 HA PRO A 67 -2.029 11.678 -0.438 1.00 31.45 H new ATOM 0 HB2 PRO A 67 -4.428 13.024 0.167 1.00 12.05 H new ATOM 0 HB3 PRO A 67 -3.183 13.718 -0.853 1.00 12.05 H new ATOM 0 HG2 PRO A 67 -5.723 12.331 -1.641 1.00 54.20 H new ATOM 0 HG3 PRO A 67 -4.953 13.726 -2.370 1.00 54.20 H new ATOM 0 HD2 PRO A 67 -4.769 11.275 -3.498 1.00 51.44 H new ATOM 0 HD3 PRO A 67 -3.447 12.421 -3.603 1.00 51.44 H new ATOM 1063 N LEU A 68 -2.873 10.436 1.440 1.00 22.13 N ATOM 1064 CA LEU A 68 -3.197 9.534 2.551 1.00 44.13 C ATOM 1065 C LEU A 68 -4.398 9.999 3.368 1.00 20.25 C ATOM 1066 O LEU A 68 -4.897 9.275 4.203 1.00 14.01 O ATOM 1067 CB LEU A 68 -1.974 9.368 3.444 1.00 33.10 C ATOM 1068 CG LEU A 68 -0.773 8.664 2.812 1.00 63.43 C ATOM 1069 CD1 LEU A 68 0.429 8.729 3.734 1.00 65.24 C ATOM 1070 CD2 LEU A 68 -1.115 7.220 2.535 1.00 21.31 C ATOM 0 H LEU A 68 -1.981 10.916 1.559 1.00 22.13 H new ATOM 0 HA LEU A 68 -3.477 8.573 2.119 1.00 44.13 H new ATOM 0 HB2 LEU A 68 -1.656 10.356 3.779 1.00 33.10 H new ATOM 0 HB3 LEU A 68 -2.271 8.811 4.333 1.00 33.10 H new ATOM 0 HG LEU A 68 -0.528 9.169 1.878 1.00 63.43 H new ATOM 0 HD11 LEU A 68 1.274 8.223 3.267 1.00 65.24 H new ATOM 0 HD12 LEU A 68 0.689 9.771 3.920 1.00 65.24 H new ATOM 0 HD13 LEU A 68 0.190 8.240 4.678 1.00 65.24 H new ATOM 0 HD21 LEU A 68 -0.256 6.723 2.085 1.00 21.31 H new ATOM 0 HD22 LEU A 68 -1.374 6.722 3.469 1.00 21.31 H new ATOM 0 HD23 LEU A 68 -1.962 7.172 1.851 1.00 21.31 H new ATOM 1082 N GLU A 69 -4.843 11.206 3.123 1.00 14.04 N ATOM 1083 CA GLU A 69 -6.015 11.738 3.798 1.00 11.31 C ATOM 1084 C GLU A 69 -7.271 11.454 2.991 1.00 71.03 C ATOM 1085 O GLU A 69 -8.363 11.986 3.279 1.00 53.51 O ATOM 1086 CB GLU A 69 -5.861 13.220 4.027 1.00 2.13 C ATOM 1087 CG GLU A 69 -4.712 13.571 4.937 1.00 62.03 C ATOM 1088 CD GLU A 69 -4.602 15.042 5.142 1.00 65.44 C ATOM 1089 OE1 GLU A 69 -5.300 15.585 6.020 1.00 43.44 O ATOM 1090 OE2 GLU A 69 -3.826 15.698 4.418 1.00 43.55 O ATOM 0 H GLU A 69 -4.412 11.848 2.457 1.00 14.04 H new ATOM 0 HA GLU A 69 -6.109 11.245 4.765 1.00 11.31 H new ATOM 0 HB2 GLU A 69 -5.718 13.715 3.067 1.00 2.13 H new ATOM 0 HB3 GLU A 69 -6.785 13.612 4.453 1.00 2.13 H new ATOM 0 HG2 GLU A 69 -4.847 13.078 5.900 1.00 62.03 H new ATOM 0 HG3 GLU A 69 -3.782 13.192 4.512 1.00 62.03 H new ATOM 1097 N ARG A 70 -7.118 10.623 1.995 1.00 42.01 N ATOM 1098 CA ARG A 70 -8.195 10.203 1.161 1.00 4.41 C ATOM 1099 C ARG A 70 -8.269 8.760 0.993 1.00 44.43 C ATOM 1100 O ARG A 70 -7.354 8.011 1.350 1.00 23.13 O ATOM 1101 CB ARG A 70 -8.220 10.890 -0.171 1.00 53.25 C ATOM 1102 CG ARG A 70 -8.852 12.210 -0.083 1.00 32.22 C ATOM 1103 CD ARG A 70 -8.720 12.998 -1.339 1.00 3.32 C ATOM 1104 NE ARG A 70 -9.224 14.351 -1.176 1.00 0.22 N ATOM 1105 CZ ARG A 70 -10.075 14.955 -2.012 1.00 72.42 C ATOM 1106 NH1 ARG A 70 -10.741 14.239 -2.927 1.00 52.42 N ATOM 1107 NH2 ARG A 70 -10.302 16.259 -1.901 1.00 53.12 N ATOM 0 H ARG A 70 -6.219 10.214 1.741 1.00 42.01 H new ATOM 0 HA ARG A 70 -9.087 10.513 1.705 1.00 4.41 H new ATOM 0 HB2 ARG A 70 -7.202 10.997 -0.545 1.00 53.25 H new ATOM 0 HB3 ARG A 70 -8.761 10.274 -0.889 1.00 53.25 H new ATOM 0 HG2 ARG A 70 -9.909 12.087 0.154 1.00 32.22 H new ATOM 0 HG3 ARG A 70 -8.404 12.768 0.739 1.00 32.22 H new ATOM 0 HD2 ARG A 70 -7.673 13.033 -1.639 1.00 3.32 H new ATOM 0 HD3 ARG A 70 -9.265 12.500 -2.141 1.00 3.32 H new ATOM 0 HE ARG A 70 -8.905 14.879 -0.364 1.00 0.22 H new ATOM 0 HH11 ARG A 70 -10.600 13.231 -2.987 1.00 52.42 H new ATOM 0 HH12 ARG A 70 -11.390 14.702 -3.564 1.00 52.42 H new ATOM 0 HH21 ARG A 70 -9.827 16.800 -1.178 1.00 53.12 H new ATOM 0 HH22 ARG A 70 -10.951 16.720 -2.539 1.00 53.12 H new ATOM 1121 N ASN A 71 -9.361 8.382 0.448 1.00 11.12 N ATOM 1122 CA ASN A 71 -9.673 6.988 0.207 1.00 50.52 C ATOM 1123 C ASN A 71 -8.904 6.499 -1.022 1.00 32.54 C ATOM 1124 O ASN A 71 -8.271 7.281 -1.716 1.00 75.54 O ATOM 1125 CB ASN A 71 -11.200 6.800 -0.027 1.00 70.31 C ATOM 1126 CG ASN A 71 -11.697 7.272 -1.391 1.00 11.12 C ATOM 1127 OD1 ASN A 71 -12.077 8.413 -1.574 1.00 54.23 O ATOM 1128 ND2 ASN A 71 -11.725 6.369 -2.344 1.00 63.24 N ATOM 0 H ASN A 71 -10.090 9.027 0.144 1.00 11.12 H new ATOM 0 HA ASN A 71 -9.380 6.408 1.082 1.00 50.52 H new ATOM 0 HB2 ASN A 71 -11.445 5.744 0.089 1.00 70.31 H new ATOM 0 HB3 ASN A 71 -11.742 7.340 0.749 1.00 70.31 H new ATOM 0 HD21 ASN A 71 -12.073 6.616 -3.271 1.00 63.24 H new ATOM 0 HD22 ASN A 71 -11.399 5.421 -2.158 1.00 63.24 H new ATOM 1135 N ALA A 72 -8.964 5.223 -1.286 1.00 21.15 N ATOM 1136 CA ALA A 72 -8.354 4.669 -2.463 1.00 73.45 C ATOM 1137 C ALA A 72 -9.113 3.451 -2.876 1.00 73.13 C ATOM 1138 O ALA A 72 -9.318 2.547 -2.060 1.00 54.14 O ATOM 1139 CB ALA A 72 -6.898 4.305 -2.213 1.00 12.25 C ATOM 0 H ALA A 72 -9.436 4.540 -0.693 1.00 21.15 H new ATOM 0 HA ALA A 72 -8.381 5.418 -3.254 1.00 73.45 H new ATOM 0 HB1 ALA A 72 -6.466 3.889 -3.123 1.00 12.25 H new ATOM 0 HB2 ALA A 72 -6.344 5.198 -1.924 1.00 12.25 H new ATOM 0 HB3 ALA A 72 -6.840 3.567 -1.413 1.00 12.25 H new ATOM 1145 N TRP A 73 -9.575 3.412 -4.109 1.00 74.44 N ATOM 1146 CA TRP A 73 -10.241 2.222 -4.561 1.00 70.22 C ATOM 1147 C TRP A 73 -9.172 1.219 -4.842 1.00 54.04 C ATOM 1148 O TRP A 73 -8.512 1.300 -5.842 1.00 0.31 O ATOM 1149 CB TRP A 73 -10.999 2.482 -5.864 1.00 23.13 C ATOM 1150 CG TRP A 73 -11.975 3.625 -5.836 1.00 24.13 C ATOM 1151 CD1 TRP A 73 -12.143 4.553 -6.815 1.00 35.22 C ATOM 1152 CD2 TRP A 73 -12.886 3.991 -4.777 1.00 74.22 C ATOM 1153 NE1 TRP A 73 -13.104 5.461 -6.443 1.00 30.42 N ATOM 1154 CE2 TRP A 73 -13.574 5.137 -5.202 1.00 40.22 C ATOM 1155 CE3 TRP A 73 -13.191 3.459 -3.527 1.00 5.34 C ATOM 1156 CZ2 TRP A 73 -14.540 5.762 -4.417 1.00 44.33 C ATOM 1157 CZ3 TRP A 73 -14.147 4.077 -2.746 1.00 74.44 C ATOM 1158 CH2 TRP A 73 -14.813 5.219 -3.195 1.00 33.35 C ATOM 0 H TRP A 73 -9.503 4.166 -4.792 1.00 74.44 H new ATOM 0 HA TRP A 73 -10.952 1.883 -3.807 1.00 70.22 H new ATOM 0 HB2 TRP A 73 -10.272 2.669 -6.654 1.00 23.13 H new ATOM 0 HB3 TRP A 73 -11.539 1.575 -6.136 1.00 23.13 H new ATOM 0 HD1 TRP A 73 -11.600 4.573 -7.749 1.00 35.22 H new ATOM 0 HE1 TRP A 73 -13.417 6.253 -7.005 1.00 30.42 H new ATOM 0 HE3 TRP A 73 -12.685 2.573 -3.172 1.00 5.34 H new ATOM 0 HZ2 TRP A 73 -15.055 6.646 -4.763 1.00 44.33 H new ATOM 0 HZ3 TRP A 73 -14.383 3.671 -1.773 1.00 74.44 H new ATOM 0 HH2 TRP A 73 -15.558 5.681 -2.564 1.00 33.35 H new ATOM 1169 N ALA A 74 -9.010 0.284 -3.988 1.00 34.45 N ATOM 1170 CA ALA A 74 -7.941 -0.642 -4.166 1.00 3.33 C ATOM 1171 C ALA A 74 -8.411 -2.029 -4.090 1.00 60.40 C ATOM 1172 O ALA A 74 -8.012 -2.861 -4.866 1.00 22.10 O ATOM 1173 CB ALA A 74 -6.863 -0.401 -3.145 1.00 64.54 C ATOM 0 H ALA A 74 -9.592 0.132 -3.164 1.00 34.45 H new ATOM 0 HA ALA A 74 -7.529 -0.484 -5.163 1.00 3.33 H new ATOM 0 HB1 ALA A 74 -6.054 -1.116 -3.294 1.00 64.54 H new ATOM 0 HB2 ALA A 74 -6.477 0.612 -3.256 1.00 64.54 H new ATOM 0 HB3 ALA A 74 -7.276 -0.524 -2.144 1.00 64.54 H new ATOM 1179 N CYS A 75 -9.251 -2.293 -3.138 1.00 30.32 N ATOM 1180 CA CYS A 75 -9.705 -3.615 -2.928 1.00 42.45 C ATOM 1181 C CYS A 75 -10.938 -3.946 -3.764 1.00 42.54 C ATOM 1182 O CYS A 75 -11.254 -5.119 -3.978 1.00 64.42 O ATOM 1183 CB CYS A 75 -10.004 -3.866 -1.457 1.00 21.41 C ATOM 1184 SG CYS A 75 -10.478 -5.564 -1.154 1.00 22.34 S ATOM 0 H CYS A 75 -9.633 -1.599 -2.495 1.00 30.32 H new ATOM 0 HA CYS A 75 -8.895 -4.271 -3.248 1.00 42.45 H new ATOM 0 HB2 CYS A 75 -9.124 -3.623 -0.861 1.00 21.41 H new ATOM 0 HB3 CYS A 75 -10.804 -3.202 -1.131 1.00 21.41 H new ATOM 0 HG CYS A 75 -10.845 -6.118 -2.271 1.00 22.34 H new ATOM 1190 N GLY A 76 -11.621 -2.935 -4.235 1.00 21.31 N ATOM 1191 CA GLY A 76 -12.900 -3.180 -4.872 1.00 13.45 C ATOM 1192 C GLY A 76 -13.920 -3.448 -3.785 1.00 52.31 C ATOM 1193 O GLY A 76 -14.949 -4.061 -3.995 1.00 13.31 O ATOM 0 H GLY A 76 -11.329 -1.959 -4.195 1.00 21.31 H new ATOM 0 HA2 GLY A 76 -13.198 -2.320 -5.471 1.00 13.45 H new ATOM 0 HA3 GLY A 76 -12.832 -4.032 -5.549 1.00 13.45 H new ATOM 1197 N ASP A 77 -13.582 -2.952 -2.616 1.00 1.25 N ATOM 1198 CA ASP A 77 -14.294 -3.119 -1.381 1.00 43.13 C ATOM 1199 C ASP A 77 -15.389 -2.053 -1.212 1.00 51.45 C ATOM 1200 O ASP A 77 -16.182 -2.102 -0.282 1.00 30.04 O ATOM 1201 CB ASP A 77 -13.203 -3.045 -0.308 1.00 32.42 C ATOM 1202 CG ASP A 77 -13.639 -2.701 1.052 1.00 25.03 C ATOM 1203 OD1 ASP A 77 -14.155 -3.571 1.785 1.00 65.23 O ATOM 1204 OD2 ASP A 77 -13.414 -1.544 1.425 1.00 33.30 O ATOM 0 H ASP A 77 -12.743 -2.383 -2.502 1.00 1.25 H new ATOM 0 HA ASP A 77 -14.839 -4.061 -1.326 1.00 43.13 H new ATOM 0 HB2 ASP A 77 -12.697 -4.010 -0.270 1.00 32.42 H new ATOM 0 HB3 ASP A 77 -12.463 -2.310 -0.625 1.00 32.42 H new ATOM 1209 N GLY A 78 -15.440 -1.130 -2.163 1.00 11.13 N ATOM 1210 CA GLY A 78 -16.438 -0.082 -2.201 1.00 23.13 C ATOM 1211 C GLY A 78 -16.497 0.760 -0.951 1.00 72.54 C ATOM 1212 O GLY A 78 -15.673 1.649 -0.739 1.00 1.41 O ATOM 0 H GLY A 78 -14.778 -1.092 -2.938 1.00 11.13 H new ATOM 0 HA2 GLY A 78 -16.236 0.567 -3.053 1.00 23.13 H new ATOM 0 HA3 GLY A 78 -17.416 -0.533 -2.369 1.00 23.13 H new ATOM 1216 N ASN A 79 -17.465 0.474 -0.134 1.00 43.21 N ATOM 1217 CA ASN A 79 -17.686 1.218 1.102 1.00 51.21 C ATOM 1218 C ASN A 79 -17.371 0.364 2.317 1.00 32.33 C ATOM 1219 O ASN A 79 -17.674 0.752 3.449 1.00 40.43 O ATOM 1220 CB ASN A 79 -19.135 1.760 1.202 1.00 64.41 C ATOM 1221 CG ASN A 79 -20.210 0.673 1.244 1.00 33.13 C ATOM 1222 OD1 ASN A 79 -20.728 0.258 0.213 1.00 62.31 O ATOM 1223 ND2 ASN A 79 -20.550 0.213 2.430 1.00 74.33 N ATOM 0 H ASN A 79 -18.133 -0.280 -0.292 1.00 43.21 H new ATOM 0 HA ASN A 79 -17.007 2.070 1.081 1.00 51.21 H new ATOM 0 HB2 ASN A 79 -19.220 2.374 2.099 1.00 64.41 H new ATOM 0 HB3 ASN A 79 -19.327 2.412 0.350 1.00 64.41 H new ATOM 0 HD21 ASN A 79 -21.264 -0.511 2.511 1.00 74.33 H new ATOM 0 HD22 ASN A 79 -20.099 0.580 3.268 1.00 74.33 H new ATOM 1230 N GLY A 80 -16.757 -0.775 2.084 1.00 3.31 N ATOM 1231 CA GLY A 80 -16.454 -1.707 3.144 1.00 21.32 C ATOM 1232 C GLY A 80 -15.459 -1.188 4.169 1.00 53.20 C ATOM 1233 O GLY A 80 -15.839 -0.821 5.280 1.00 5.25 O ATOM 0 H GLY A 80 -16.455 -1.079 1.158 1.00 3.31 H new ATOM 0 HA2 GLY A 80 -17.380 -1.971 3.655 1.00 21.32 H new ATOM 0 HA3 GLY A 80 -16.060 -2.623 2.704 1.00 21.32 H new ATOM 1237 N SER A 81 -14.201 -1.166 3.820 1.00 73.42 N ATOM 1238 CA SER A 81 -13.161 -0.763 4.744 1.00 45.41 C ATOM 1239 C SER A 81 -11.960 -0.129 4.049 1.00 34.24 C ATOM 1240 O SER A 81 -11.740 1.077 4.177 1.00 21.50 O ATOM 1241 CB SER A 81 -12.704 -1.957 5.586 1.00 31.10 C ATOM 1242 OG SER A 81 -13.773 -2.470 6.380 1.00 35.23 O ATOM 0 H SER A 81 -13.863 -1.425 2.893 1.00 73.42 H new ATOM 0 HA SER A 81 -13.597 -0.000 5.389 1.00 45.41 H new ATOM 0 HB2 SER A 81 -12.325 -2.742 4.932 1.00 31.10 H new ATOM 0 HB3 SER A 81 -11.880 -1.655 6.233 1.00 31.10 H new ATOM 0 HG SER A 81 -13.453 -3.233 6.906 1.00 35.23 H new ATOM 1248 N GLY A 82 -11.198 -0.918 3.296 1.00 74.54 N ATOM 1249 CA GLY A 82 -9.963 -0.399 2.743 1.00 51.54 C ATOM 1250 C GLY A 82 -10.164 0.630 1.672 1.00 23.43 C ATOM 1251 O GLY A 82 -9.411 1.606 1.611 1.00 3.14 O ATOM 0 H GLY A 82 -11.409 -1.888 3.063 1.00 74.54 H new ATOM 0 HA2 GLY A 82 -9.371 0.038 3.547 1.00 51.54 H new ATOM 0 HA3 GLY A 82 -9.383 -1.226 2.334 1.00 51.54 H new ATOM 1255 N ASN A 83 -11.176 0.450 0.843 1.00 13.13 N ATOM 1256 CA ASN A 83 -11.496 1.443 -0.178 1.00 1.02 C ATOM 1257 C ASN A 83 -11.833 2.792 0.418 1.00 73.21 C ATOM 1258 O ASN A 83 -11.690 3.819 -0.237 1.00 73.10 O ATOM 1259 CB ASN A 83 -12.644 0.999 -1.053 1.00 24.51 C ATOM 1260 CG ASN A 83 -12.257 0.117 -2.211 1.00 52.45 C ATOM 1261 OD1 ASN A 83 -11.300 -0.655 -2.167 1.00 73.22 O ATOM 1262 ND2 ASN A 83 -13.005 0.243 -3.267 1.00 63.02 N ATOM 0 H ASN A 83 -11.788 -0.366 0.852 1.00 13.13 H new ATOM 0 HA ASN A 83 -10.595 1.540 -0.784 1.00 1.02 H new ATOM 0 HB2 ASN A 83 -13.367 0.466 -0.435 1.00 24.51 H new ATOM 0 HB3 ASN A 83 -13.148 1.884 -1.442 1.00 24.51 H new ATOM 0 HD21 ASN A 83 -12.807 -0.310 -4.101 1.00 63.02 H new ATOM 0 HD22 ASN A 83 -13.789 0.895 -3.262 1.00 63.02 H new ATOM 1269 N ARG A 84 -12.286 2.784 1.648 1.00 61.15 N ATOM 1270 CA ARG A 84 -12.673 4.002 2.317 1.00 1.03 C ATOM 1271 C ARG A 84 -11.592 4.537 3.246 1.00 63.11 C ATOM 1272 O ARG A 84 -11.270 5.711 3.191 1.00 62.01 O ATOM 1273 CB ARG A 84 -13.975 3.817 3.100 1.00 62.21 C ATOM 1274 CG ARG A 84 -15.197 3.523 2.244 1.00 13.12 C ATOM 1275 CD ARG A 84 -15.521 4.672 1.284 1.00 12.12 C ATOM 1276 NE ARG A 84 -15.744 5.952 1.997 1.00 73.35 N ATOM 1277 CZ ARG A 84 -16.749 6.814 1.748 1.00 72.31 C ATOM 1278 NH1 ARG A 84 -17.681 6.519 0.849 1.00 51.33 N ATOM 1279 NH2 ARG A 84 -16.828 7.955 2.421 1.00 4.42 N ATOM 0 H ARG A 84 -12.396 1.940 2.210 1.00 61.15 H new ATOM 0 HA ARG A 84 -12.826 4.738 1.528 1.00 1.03 H new ATOM 0 HB2 ARG A 84 -13.842 3.002 3.811 1.00 62.21 H new ATOM 0 HB3 ARG A 84 -14.164 4.719 3.681 1.00 62.21 H new ATOM 0 HG2 ARG A 84 -15.027 2.611 1.672 1.00 13.12 H new ATOM 0 HG3 ARG A 84 -16.055 3.339 2.890 1.00 13.12 H new ATOM 0 HD2 ARG A 84 -14.703 4.792 0.574 1.00 12.12 H new ATOM 0 HD3 ARG A 84 -16.410 4.420 0.706 1.00 12.12 H new ATOM 0 HE ARG A 84 -15.084 6.200 2.735 1.00 73.35 H new ATOM 0 HH11 ARG A 84 -17.639 5.635 0.342 1.00 51.33 H new ATOM 0 HH12 ARG A 84 -18.439 7.176 0.666 1.00 51.33 H new ATOM 0 HH21 ARG A 84 -16.127 8.180 3.127 1.00 4.42 H new ATOM 0 HH22 ARG A 84 -17.589 8.607 2.232 1.00 4.42 H new ATOM 1293 N GLN A 85 -11.035 3.690 4.097 1.00 24.33 N ATOM 1294 CA GLN A 85 -10.106 4.180 5.104 1.00 13.32 C ATOM 1295 C GLN A 85 -8.843 3.325 5.263 1.00 41.11 C ATOM 1296 O GLN A 85 -8.430 3.011 6.392 1.00 63.50 O ATOM 1297 CB GLN A 85 -10.834 4.301 6.441 1.00 33.05 C ATOM 1298 CG GLN A 85 -11.462 3.006 6.922 1.00 63.14 C ATOM 1299 CD GLN A 85 -12.200 3.156 8.226 1.00 55.31 C ATOM 1300 OE1 GLN A 85 -13.174 2.462 8.479 1.00 5.33 O ATOM 1301 NE2 GLN A 85 -11.749 4.048 9.057 1.00 41.22 N ATOM 0 H GLN A 85 -11.204 2.684 4.113 1.00 24.33 H new ATOM 0 HA GLN A 85 -9.758 5.154 4.761 1.00 13.32 H new ATOM 0 HB2 GLN A 85 -10.131 4.654 7.195 1.00 33.05 H new ATOM 0 HB3 GLN A 85 -11.612 5.059 6.352 1.00 33.05 H new ATOM 0 HG2 GLN A 85 -12.151 2.639 6.161 1.00 63.14 H new ATOM 0 HG3 GLN A 85 -10.683 2.252 7.037 1.00 63.14 H new ATOM 0 HE21 GLN A 85 -10.933 4.608 8.810 1.00 41.22 H new ATOM 0 HE22 GLN A 85 -12.211 4.188 9.956 1.00 41.22 H new ATOM 1310 N SER A 86 -8.204 2.984 4.191 1.00 75.31 N ATOM 1311 CA SER A 86 -6.960 2.288 4.323 1.00 62.51 C ATOM 1312 C SER A 86 -5.956 2.923 3.441 1.00 4.53 C ATOM 1313 O SER A 86 -6.294 3.729 2.594 1.00 2.12 O ATOM 1314 CB SER A 86 -7.042 0.788 3.995 1.00 54.44 C ATOM 1315 OG SER A 86 -7.189 0.554 2.606 1.00 53.21 O ATOM 0 H SER A 86 -8.510 3.169 3.236 1.00 75.31 H new ATOM 0 HA SER A 86 -6.676 2.358 5.373 1.00 62.51 H new ATOM 0 HB2 SER A 86 -6.141 0.289 4.353 1.00 54.44 H new ATOM 0 HB3 SER A 86 -7.884 0.346 4.528 1.00 54.44 H new ATOM 0 HG SER A 86 -7.771 1.241 2.218 1.00 53.21 H new ATOM 1321 N ILE A 87 -4.755 2.545 3.633 1.00 0.21 N ATOM 1322 CA ILE A 87 -3.665 3.008 2.840 1.00 1.53 C ATOM 1323 C ILE A 87 -3.241 1.890 1.951 1.00 1.25 C ATOM 1324 O ILE A 87 -2.899 0.824 2.426 1.00 54.05 O ATOM 1325 CB ILE A 87 -2.471 3.443 3.702 1.00 54.42 C ATOM 1326 CG1 ILE A 87 -2.879 4.610 4.599 1.00 54.41 C ATOM 1327 CG2 ILE A 87 -1.314 3.838 2.794 1.00 75.44 C ATOM 1328 CD1 ILE A 87 -1.838 5.030 5.609 1.00 75.50 C ATOM 0 H ILE A 87 -4.484 1.887 4.364 1.00 0.21 H new ATOM 0 HA ILE A 87 -3.991 3.877 2.268 1.00 1.53 H new ATOM 0 HB ILE A 87 -2.153 2.617 4.338 1.00 54.42 H new ATOM 0 HG12 ILE A 87 -3.119 5.467 3.969 1.00 54.41 H new ATOM 0 HG13 ILE A 87 -3.791 4.339 5.130 1.00 54.41 H new ATOM 0 HG21 ILE A 87 -0.464 4.148 3.402 1.00 75.44 H new ATOM 0 HG22 ILE A 87 -1.028 2.986 2.177 1.00 75.44 H new ATOM 0 HG23 ILE A 87 -1.621 4.664 2.152 1.00 75.44 H new ATOM 0 HD11 ILE A 87 -2.219 5.864 6.199 1.00 75.50 H new ATOM 0 HD12 ILE A 87 -1.612 4.192 6.269 1.00 75.50 H new ATOM 0 HD13 ILE A 87 -0.930 5.337 5.090 1.00 75.50 H new ATOM 1340 N SER A 88 -3.274 2.105 0.696 1.00 54.14 N ATOM 1341 CA SER A 88 -2.909 1.088 -0.207 1.00 33.13 C ATOM 1342 C SER A 88 -1.444 1.201 -0.570 1.00 61.50 C ATOM 1343 O SER A 88 -1.001 2.218 -1.119 1.00 52.20 O ATOM 1344 CB SER A 88 -3.796 1.162 -1.416 1.00 15.25 C ATOM 1345 OG SER A 88 -5.142 0.998 -1.030 1.00 3.13 O ATOM 0 H SER A 88 -3.553 2.986 0.265 1.00 54.14 H new ATOM 0 HA SER A 88 -3.045 0.112 0.259 1.00 33.13 H new ATOM 0 HB2 SER A 88 -3.666 2.122 -1.916 1.00 15.25 H new ATOM 0 HB3 SER A 88 -3.516 0.389 -2.132 1.00 15.25 H new ATOM 0 HG SER A 88 -5.684 1.717 -1.418 1.00 3.13 H new ATOM 1351 N VAL A 89 -0.710 0.165 -0.249 1.00 11.13 N ATOM 1352 CA VAL A 89 0.706 0.096 -0.511 1.00 64.41 C ATOM 1353 C VAL A 89 0.943 -0.962 -1.559 1.00 63.12 C ATOM 1354 O VAL A 89 0.492 -2.110 -1.413 1.00 61.21 O ATOM 1355 CB VAL A 89 1.516 -0.242 0.778 1.00 34.14 C ATOM 1356 CG1 VAL A 89 3.015 -0.308 0.489 1.00 35.11 C ATOM 1357 CG2 VAL A 89 1.230 0.782 1.872 1.00 40.20 C ATOM 0 H VAL A 89 -1.085 -0.666 0.208 1.00 11.13 H new ATOM 0 HA VAL A 89 1.048 1.070 -0.862 1.00 64.41 H new ATOM 0 HB VAL A 89 1.197 -1.225 1.125 1.00 34.14 H new ATOM 0 HG11 VAL A 89 3.552 -0.545 1.407 1.00 35.11 H new ATOM 0 HG12 VAL A 89 3.208 -1.081 -0.255 1.00 35.11 H new ATOM 0 HG13 VAL A 89 3.355 0.655 0.108 1.00 35.11 H new ATOM 0 HG21 VAL A 89 1.803 0.531 2.764 1.00 40.20 H new ATOM 0 HG22 VAL A 89 1.516 1.775 1.525 1.00 40.20 H new ATOM 0 HG23 VAL A 89 0.166 0.773 2.110 1.00 40.20 H new ATOM 1367 N GLU A 90 1.604 -0.583 -2.600 1.00 62.44 N ATOM 1368 CA GLU A 90 1.862 -1.469 -3.697 1.00 14.14 C ATOM 1369 C GLU A 90 3.358 -1.777 -3.731 1.00 72.34 C ATOM 1370 O GLU A 90 4.183 -0.854 -3.797 1.00 41.15 O ATOM 1371 CB GLU A 90 1.423 -0.772 -4.993 1.00 34.21 C ATOM 1372 CG GLU A 90 1.374 -1.666 -6.210 1.00 12.44 C ATOM 1373 CD GLU A 90 0.393 -2.799 -6.026 1.00 54.12 C ATOM 1374 OE1 GLU A 90 -0.834 -2.535 -6.010 1.00 73.51 O ATOM 1375 OE2 GLU A 90 0.830 -3.943 -5.858 1.00 75.20 O ATOM 0 H GLU A 90 1.985 0.355 -2.720 1.00 62.44 H new ATOM 0 HA GLU A 90 1.311 -2.403 -3.589 1.00 14.14 H new ATOM 0 HB2 GLU A 90 0.435 -0.338 -4.839 1.00 34.21 H new ATOM 0 HB3 GLU A 90 2.106 0.054 -5.194 1.00 34.21 H new ATOM 0 HG2 GLU A 90 1.092 -1.078 -7.083 1.00 12.44 H new ATOM 0 HG3 GLU A 90 2.367 -2.071 -6.405 1.00 12.44 H new ATOM 1382 N ILE A 91 3.714 -3.047 -3.646 1.00 13.44 N ATOM 1383 CA ILE A 91 5.114 -3.434 -3.673 1.00 40.21 C ATOM 1384 C ILE A 91 5.477 -3.812 -5.083 1.00 13.54 C ATOM 1385 O ILE A 91 4.941 -4.768 -5.625 1.00 34.31 O ATOM 1386 CB ILE A 91 5.417 -4.642 -2.743 1.00 25.11 C ATOM 1387 CG1 ILE A 91 4.981 -4.342 -1.307 1.00 64.33 C ATOM 1388 CG2 ILE A 91 6.905 -4.972 -2.782 1.00 3.24 C ATOM 1389 CD1 ILE A 91 5.196 -5.494 -0.339 1.00 21.31 C ATOM 0 H ILE A 91 3.058 -3.823 -3.558 1.00 13.44 H new ATOM 0 HA ILE A 91 5.700 -2.587 -3.317 1.00 40.21 H new ATOM 0 HB ILE A 91 4.852 -5.503 -3.101 1.00 25.11 H new ATOM 0 HG12 ILE A 91 5.529 -3.472 -0.947 1.00 64.33 H new ATOM 0 HG13 ILE A 91 3.924 -4.075 -1.308 1.00 64.33 H new ATOM 0 HG21 ILE A 91 7.107 -5.820 -2.127 1.00 3.24 H new ATOM 0 HG22 ILE A 91 7.195 -5.224 -3.802 1.00 3.24 H new ATOM 0 HG23 ILE A 91 7.478 -4.108 -2.445 1.00 3.24 H new ATOM 0 HD11 ILE A 91 4.862 -5.200 0.656 1.00 21.31 H new ATOM 0 HD12 ILE A 91 4.625 -6.361 -0.672 1.00 21.31 H new ATOM 0 HD13 ILE A 91 6.255 -5.748 -0.305 1.00 21.31 H new ATOM 1401 N CYS A 92 6.365 -3.080 -5.672 1.00 14.15 N ATOM 1402 CA CYS A 92 6.751 -3.320 -7.038 1.00 53.13 C ATOM 1403 C CYS A 92 7.772 -4.457 -7.154 1.00 23.13 C ATOM 1404 O CYS A 92 8.401 -4.838 -6.170 1.00 12.44 O ATOM 1405 CB CYS A 92 7.277 -2.042 -7.640 1.00 61.25 C ATOM 1406 SG CYS A 92 6.102 -0.679 -7.534 1.00 71.55 S ATOM 0 H CYS A 92 6.847 -2.299 -5.227 1.00 14.15 H new ATOM 0 HA CYS A 92 5.871 -3.641 -7.596 1.00 53.13 H new ATOM 0 HB2 CYS A 92 8.199 -1.760 -7.132 1.00 61.25 H new ATOM 0 HB3 CYS A 92 7.530 -2.216 -8.686 1.00 61.25 H new ATOM 0 HG CYS A 92 4.904 -1.119 -7.779 1.00 71.55 H new ATOM 1412 N TYR A 93 7.880 -5.029 -8.366 1.00 2.12 N ATOM 1413 CA TYR A 93 8.841 -6.106 -8.678 1.00 23.22 C ATOM 1414 C TYR A 93 8.489 -7.430 -8.007 1.00 55.35 C ATOM 1415 O TYR A 93 9.292 -8.366 -8.035 1.00 31.13 O ATOM 1416 CB TYR A 93 10.295 -5.705 -8.344 1.00 65.45 C ATOM 1417 CG TYR A 93 10.844 -4.543 -9.147 1.00 44.43 C ATOM 1418 CD1 TYR A 93 11.305 -4.727 -10.441 1.00 53.34 C ATOM 1419 CD2 TYR A 93 10.911 -3.275 -8.609 1.00 2.43 C ATOM 1420 CE1 TYR A 93 11.818 -3.674 -11.174 1.00 0.33 C ATOM 1421 CE2 TYR A 93 11.423 -2.220 -9.335 1.00 23.14 C ATOM 1422 CZ TYR A 93 11.872 -2.423 -10.611 1.00 65.15 C ATOM 1423 OH TYR A 93 12.385 -1.368 -11.326 1.00 4.22 O ATOM 0 H TYR A 93 7.302 -4.757 -9.161 1.00 2.12 H new ATOM 0 HA TYR A 93 8.767 -6.256 -9.755 1.00 23.22 H new ATOM 0 HB2 TYR A 93 10.351 -5.453 -7.285 1.00 65.45 H new ATOM 0 HB3 TYR A 93 10.939 -6.570 -8.500 1.00 65.45 H new ATOM 0 HD1 TYR A 93 11.263 -5.711 -10.884 1.00 53.34 H new ATOM 0 HD2 TYR A 93 10.557 -3.105 -7.603 1.00 2.43 H new ATOM 0 HE1 TYR A 93 12.173 -3.834 -12.181 1.00 0.33 H new ATOM 0 HE2 TYR A 93 11.469 -1.234 -8.896 1.00 23.14 H new ATOM 0 HH TYR A 93 12.348 -0.555 -10.781 1.00 4.22 H new ATOM 1433 N SER A 94 7.279 -7.535 -7.454 1.00 52.42 N ATOM 1434 CA SER A 94 6.846 -8.764 -6.807 1.00 44.15 C ATOM 1435 C SER A 94 6.797 -9.893 -7.808 1.00 70.24 C ATOM 1436 O SER A 94 7.071 -11.046 -7.473 1.00 1.21 O ATOM 1437 CB SER A 94 5.497 -8.576 -6.193 1.00 33.44 C ATOM 1438 OG SER A 94 5.496 -7.471 -5.315 1.00 34.22 O ATOM 0 H SER A 94 6.588 -6.785 -7.444 1.00 52.42 H new ATOM 0 HA SER A 94 7.562 -9.014 -6.024 1.00 44.15 H new ATOM 0 HB2 SER A 94 4.754 -8.425 -6.976 1.00 33.44 H new ATOM 0 HB3 SER A 94 5.210 -9.477 -5.651 1.00 33.44 H new ATOM 0 HG SER A 94 6.313 -7.482 -4.774 1.00 34.22 H new ATOM 1444 N LYS A 95 6.446 -9.550 -9.040 1.00 11.41 N ATOM 1445 CA LYS A 95 6.463 -10.466 -10.123 1.00 41.42 C ATOM 1446 C LYS A 95 7.850 -11.098 -10.315 1.00 15.45 C ATOM 1447 O LYS A 95 7.965 -12.319 -10.457 1.00 50.43 O ATOM 1448 CB LYS A 95 5.905 -9.774 -11.394 1.00 62.32 C ATOM 1449 CG LYS A 95 6.301 -10.397 -12.715 1.00 12.14 C ATOM 1450 CD LYS A 95 7.650 -9.858 -13.140 1.00 32.13 C ATOM 1451 CE LYS A 95 8.300 -10.709 -14.157 1.00 55.02 C ATOM 1452 NZ LYS A 95 9.579 -10.120 -14.603 1.00 62.14 N ATOM 0 H LYS A 95 6.141 -8.611 -9.297 1.00 11.41 H new ATOM 0 HA LYS A 95 5.807 -11.307 -9.899 1.00 41.42 H new ATOM 0 HB2 LYS A 95 4.817 -9.765 -11.331 1.00 62.32 H new ATOM 0 HB3 LYS A 95 6.233 -8.735 -11.392 1.00 62.32 H new ATOM 0 HG2 LYS A 95 6.344 -11.482 -12.620 1.00 12.14 H new ATOM 0 HG3 LYS A 95 5.552 -10.173 -13.474 1.00 12.14 H new ATOM 0 HD2 LYS A 95 7.527 -8.851 -13.538 1.00 32.13 H new ATOM 0 HD3 LYS A 95 8.298 -9.779 -12.267 1.00 32.13 H new ATOM 0 HE2 LYS A 95 8.477 -11.702 -13.745 1.00 55.02 H new ATOM 0 HE3 LYS A 95 7.635 -10.832 -15.012 1.00 55.02 H new ATOM 0 HZ1 LYS A 95 10.064 -10.784 -15.240 1.00 62.14 H new ATOM 0 HZ2 LYS A 95 9.394 -9.229 -15.107 1.00 62.14 H new ATOM 0 HZ3 LYS A 95 10.181 -9.931 -13.776 1.00 62.14 H new ATOM 1466 N SER A 96 8.893 -10.271 -10.315 1.00 42.14 N ATOM 1467 CA SER A 96 10.243 -10.794 -10.484 1.00 41.22 C ATOM 1468 C SER A 96 10.707 -11.556 -9.233 1.00 64.43 C ATOM 1469 O SER A 96 11.561 -12.425 -9.310 1.00 23.03 O ATOM 1470 CB SER A 96 11.227 -9.675 -10.851 1.00 3.33 C ATOM 1471 OG SER A 96 10.869 -9.070 -12.093 1.00 5.23 O ATOM 0 H SER A 96 8.832 -9.259 -10.203 1.00 42.14 H new ATOM 0 HA SER A 96 10.223 -11.503 -11.312 1.00 41.22 H new ATOM 0 HB2 SER A 96 11.237 -8.921 -10.064 1.00 3.33 H new ATOM 0 HB3 SER A 96 12.237 -10.080 -10.917 1.00 3.33 H new ATOM 0 HG SER A 96 11.508 -8.359 -12.307 1.00 5.23 H new ATOM 1477 N GLY A 97 10.100 -11.226 -8.096 1.00 41.40 N ATOM 1478 CA GLY A 97 10.307 -11.942 -6.810 1.00 5.31 C ATOM 1479 C GLY A 97 11.725 -11.937 -6.209 1.00 2.34 C ATOM 1480 O GLY A 97 11.889 -12.208 -5.030 1.00 61.24 O ATOM 0 H GLY A 97 9.442 -10.450 -8.026 1.00 41.40 H new ATOM 0 HA2 GLY A 97 9.629 -11.511 -6.073 1.00 5.31 H new ATOM 0 HA3 GLY A 97 10.006 -12.980 -6.952 1.00 5.31 H new ATOM 1484 N GLY A 98 12.702 -11.652 -7.014 1.00 22.53 N ATOM 1485 CA GLY A 98 14.086 -11.693 -6.623 1.00 45.43 C ATOM 1486 C GLY A 98 14.539 -10.455 -5.907 1.00 61.05 C ATOM 1487 O GLY A 98 13.744 -9.802 -5.242 1.00 62.33 O ATOM 0 H GLY A 98 12.560 -11.377 -7.986 1.00 22.53 H new ATOM 0 HA2 GLY A 98 14.248 -12.557 -5.978 1.00 45.43 H new ATOM 0 HA3 GLY A 98 14.703 -11.837 -7.510 1.00 45.43 H new ATOM 1491 N ASP A 99 15.805 -10.109 -6.077 1.00 23.03 N ATOM 1492 CA ASP A 99 16.452 -8.994 -5.342 1.00 14.54 C ATOM 1493 C ASP A 99 15.661 -7.694 -5.416 1.00 12.23 C ATOM 1494 O ASP A 99 15.535 -6.982 -4.417 1.00 52.34 O ATOM 1495 CB ASP A 99 17.874 -8.775 -5.836 1.00 31.14 C ATOM 1496 CG ASP A 99 18.597 -7.694 -5.073 1.00 12.22 C ATOM 1497 OD1 ASP A 99 18.997 -7.941 -3.916 1.00 72.05 O ATOM 1498 OD2 ASP A 99 18.819 -6.611 -5.626 1.00 2.14 O ATOM 0 H ASP A 99 16.429 -10.585 -6.728 1.00 23.03 H new ATOM 0 HA ASP A 99 16.477 -9.291 -4.293 1.00 14.54 H new ATOM 0 HB2 ASP A 99 18.431 -9.708 -5.751 1.00 31.14 H new ATOM 0 HB3 ASP A 99 17.850 -8.513 -6.894 1.00 31.14 H new ATOM 1503 N ARG A 100 15.101 -7.413 -6.589 1.00 3.12 N ATOM 1504 CA ARG A 100 14.279 -6.230 -6.785 1.00 74.24 C ATOM 1505 C ARG A 100 13.077 -6.251 -5.836 1.00 63.24 C ATOM 1506 O ARG A 100 12.699 -5.236 -5.277 1.00 62.03 O ATOM 1507 CB ARG A 100 13.791 -6.148 -8.227 1.00 54.13 C ATOM 1508 CG ARG A 100 14.880 -6.004 -9.272 1.00 50.22 C ATOM 1509 CD ARG A 100 15.662 -4.716 -9.101 1.00 50.30 C ATOM 1510 NE ARG A 100 16.689 -4.563 -10.131 1.00 42.44 N ATOM 1511 CZ ARG A 100 17.466 -3.485 -10.283 1.00 44.35 C ATOM 1512 NH1 ARG A 100 17.362 -2.465 -9.449 1.00 74.22 N ATOM 1513 NH2 ARG A 100 18.352 -3.435 -11.266 1.00 13.12 N ATOM 0 H ARG A 100 15.204 -7.994 -7.421 1.00 3.12 H new ATOM 0 HA ARG A 100 14.890 -5.354 -6.568 1.00 74.24 H new ATOM 0 HB2 ARG A 100 13.213 -7.045 -8.449 1.00 54.13 H new ATOM 0 HB3 ARG A 100 13.111 -5.301 -8.316 1.00 54.13 H new ATOM 0 HG2 ARG A 100 15.560 -6.853 -9.206 1.00 50.22 H new ATOM 0 HG3 ARG A 100 14.434 -6.029 -10.266 1.00 50.22 H new ATOM 0 HD2 ARG A 100 14.978 -3.868 -9.141 1.00 50.30 H new ATOM 0 HD3 ARG A 100 16.130 -4.703 -8.117 1.00 50.30 H new ATOM 0 HE ARG A 100 16.823 -5.336 -10.782 1.00 42.44 H new ATOM 0 HH11 ARG A 100 16.687 -2.498 -8.685 1.00 74.22 H new ATOM 0 HH12 ARG A 100 17.957 -1.645 -9.569 1.00 74.22 H new ATOM 0 HH21 ARG A 100 18.444 -4.220 -11.910 1.00 13.12 H new ATOM 0 HH22 ARG A 100 18.943 -2.611 -11.379 1.00 13.12 H new ATOM 1527 N TYR A 101 12.497 -7.417 -5.648 1.00 64.35 N ATOM 1528 CA TYR A 101 11.384 -7.548 -4.759 1.00 1.34 C ATOM 1529 C TYR A 101 11.830 -7.506 -3.306 1.00 14.11 C ATOM 1530 O TYR A 101 11.184 -6.866 -2.480 1.00 71.02 O ATOM 1531 CB TYR A 101 10.582 -8.809 -5.042 1.00 31.30 C ATOM 1532 CG TYR A 101 9.521 -9.040 -4.020 1.00 31.14 C ATOM 1533 CD1 TYR A 101 8.416 -8.219 -3.951 1.00 31.10 C ATOM 1534 CD2 TYR A 101 9.653 -10.042 -3.087 1.00 52.11 C ATOM 1535 CE1 TYR A 101 7.459 -8.397 -2.989 1.00 12.53 C ATOM 1536 CE2 TYR A 101 8.705 -10.222 -2.114 1.00 4.32 C ATOM 1537 CZ TYR A 101 7.605 -9.391 -2.072 1.00 70.31 C ATOM 1538 OH TYR A 101 6.653 -9.562 -1.105 1.00 75.33 O ATOM 0 H TYR A 101 12.785 -8.283 -6.103 1.00 64.35 H new ATOM 0 HA TYR A 101 10.730 -6.695 -4.937 1.00 1.34 H new ATOM 0 HB2 TYR A 101 10.124 -8.733 -6.028 1.00 31.30 H new ATOM 0 HB3 TYR A 101 11.254 -9.667 -5.067 1.00 31.30 H new ATOM 0 HD1 TYR A 101 8.303 -7.420 -4.669 1.00 31.10 H new ATOM 0 HD2 TYR A 101 10.513 -10.694 -3.122 1.00 52.11 H new ATOM 0 HE1 TYR A 101 6.593 -7.752 -2.958 1.00 12.53 H new ATOM 0 HE2 TYR A 101 8.819 -11.010 -1.384 1.00 4.32 H new ATOM 0 HH TYR A 101 7.083 -9.830 -0.266 1.00 75.33 H new ATOM 1548 N TYR A 102 12.932 -8.183 -2.997 1.00 11.42 N ATOM 1549 CA TYR A 102 13.456 -8.192 -1.634 1.00 51.13 C ATOM 1550 C TYR A 102 13.731 -6.801 -1.130 1.00 52.20 C ATOM 1551 O TYR A 102 13.488 -6.508 0.037 1.00 71.50 O ATOM 1552 CB TYR A 102 14.678 -9.090 -1.483 1.00 23.20 C ATOM 1553 CG TYR A 102 14.327 -10.547 -1.549 1.00 40.23 C ATOM 1554 CD1 TYR A 102 14.291 -11.214 -2.742 1.00 73.33 C ATOM 1555 CD2 TYR A 102 14.010 -11.242 -0.401 1.00 5.12 C ATOM 1556 CE1 TYR A 102 13.952 -12.540 -2.818 1.00 30.42 C ATOM 1557 CE2 TYR A 102 13.668 -12.571 -0.450 1.00 60.22 C ATOM 1558 CZ TYR A 102 13.638 -13.222 -1.664 1.00 12.24 C ATOM 1559 OH TYR A 102 13.292 -14.558 -1.718 1.00 61.52 O ATOM 0 H TYR A 102 13.476 -8.729 -3.665 1.00 11.42 H new ATOM 0 HA TYR A 102 12.672 -8.619 -1.009 1.00 51.13 H new ATOM 0 HB2 TYR A 102 15.397 -8.856 -2.268 1.00 23.20 H new ATOM 0 HB3 TYR A 102 15.166 -8.879 -0.531 1.00 23.20 H new ATOM 0 HD1 TYR A 102 14.536 -10.682 -3.649 1.00 73.33 H new ATOM 0 HD2 TYR A 102 14.031 -10.733 0.551 1.00 5.12 H new ATOM 0 HE1 TYR A 102 13.931 -13.044 -3.773 1.00 30.42 H new ATOM 0 HE2 TYR A 102 13.424 -13.103 0.458 1.00 60.22 H new ATOM 0 HH TYR A 102 13.335 -14.944 -0.818 1.00 61.52 H new ATOM 1569 N LYS A 103 14.219 -5.941 -2.010 1.00 4.05 N ATOM 1570 CA LYS A 103 14.427 -4.553 -1.658 1.00 42.24 C ATOM 1571 C LYS A 103 13.124 -3.794 -1.607 1.00 61.20 C ATOM 1572 O LYS A 103 12.911 -3.009 -0.711 1.00 72.40 O ATOM 1573 CB LYS A 103 15.401 -3.863 -2.592 1.00 52.22 C ATOM 1574 CG LYS A 103 16.804 -4.409 -2.540 1.00 23.24 C ATOM 1575 CD LYS A 103 17.346 -4.358 -1.128 1.00 50.21 C ATOM 1576 CE LYS A 103 18.785 -4.810 -1.072 1.00 21.45 C ATOM 1577 NZ LYS A 103 19.314 -4.796 0.306 1.00 4.32 N ATOM 0 H LYS A 103 14.476 -6.182 -2.967 1.00 4.05 H new ATOM 0 HA LYS A 103 14.867 -4.552 -0.661 1.00 42.24 H new ATOM 0 HB2 LYS A 103 15.029 -3.947 -3.613 1.00 52.22 H new ATOM 0 HB3 LYS A 103 15.428 -2.801 -2.349 1.00 52.22 H new ATOM 0 HG2 LYS A 103 16.813 -5.437 -2.901 1.00 23.24 H new ATOM 0 HG3 LYS A 103 17.449 -3.832 -3.203 1.00 23.24 H new ATOM 0 HD2 LYS A 103 17.268 -3.341 -0.743 1.00 50.21 H new ATOM 0 HD3 LYS A 103 16.739 -4.991 -0.481 1.00 50.21 H new ATOM 0 HE2 LYS A 103 18.865 -5.817 -1.481 1.00 21.45 H new ATOM 0 HE3 LYS A 103 19.394 -4.161 -1.701 1.00 21.45 H new ATOM 0 HZ1 LYS A 103 20.305 -5.113 0.301 1.00 4.32 H new ATOM 0 HZ2 LYS A 103 19.261 -3.830 0.688 1.00 4.32 H new ATOM 0 HZ3 LYS A 103 18.749 -5.435 0.901 1.00 4.32 H new ATOM 1591 N ALA A 104 12.253 -4.044 -2.567 1.00 24.41 N ATOM 1592 CA ALA A 104 10.948 -3.386 -2.621 1.00 11.00 C ATOM 1593 C ALA A 104 10.163 -3.619 -1.332 1.00 74.41 C ATOM 1594 O ALA A 104 9.626 -2.685 -0.734 1.00 70.32 O ATOM 1595 CB ALA A 104 10.160 -3.893 -3.805 1.00 44.14 C ATOM 0 H ALA A 104 12.422 -4.702 -3.328 1.00 24.41 H new ATOM 0 HA ALA A 104 11.112 -2.314 -2.732 1.00 11.00 H new ATOM 0 HB1 ALA A 104 9.190 -3.397 -3.836 1.00 44.14 H new ATOM 0 HB2 ALA A 104 10.706 -3.680 -4.724 1.00 44.14 H new ATOM 0 HB3 ALA A 104 10.014 -4.969 -3.711 1.00 44.14 H new ATOM 1601 N GLU A 105 10.134 -4.864 -0.901 1.00 73.54 N ATOM 1602 CA GLU A 105 9.446 -5.252 0.314 1.00 50.25 C ATOM 1603 C GLU A 105 10.180 -4.657 1.527 1.00 24.23 C ATOM 1604 O GLU A 105 9.561 -4.185 2.476 1.00 61.05 O ATOM 1605 CB GLU A 105 9.429 -6.777 0.423 1.00 22.11 C ATOM 1606 CG GLU A 105 8.608 -7.315 1.574 1.00 12.31 C ATOM 1607 CD GLU A 105 8.791 -8.794 1.765 1.00 74.03 C ATOM 1608 OE1 GLU A 105 8.214 -9.582 1.008 1.00 41.34 O ATOM 1609 OE2 GLU A 105 9.545 -9.185 2.680 1.00 64.41 O ATOM 0 H GLU A 105 10.589 -5.638 -1.385 1.00 73.54 H new ATOM 0 HA GLU A 105 8.422 -4.879 0.290 1.00 50.25 H new ATOM 0 HB2 GLU A 105 9.041 -7.191 -0.508 1.00 22.11 H new ATOM 0 HB3 GLU A 105 10.454 -7.133 0.527 1.00 22.11 H new ATOM 0 HG2 GLU A 105 8.888 -6.796 2.491 1.00 12.31 H new ATOM 0 HG3 GLU A 105 7.554 -7.102 1.396 1.00 12.31 H new ATOM 1616 N ASP A 106 11.510 -4.659 1.449 1.00 63.10 N ATOM 1617 CA ASP A 106 12.399 -4.155 2.523 1.00 61.41 C ATOM 1618 C ASP A 106 12.180 -2.668 2.721 1.00 72.02 C ATOM 1619 O ASP A 106 12.314 -2.144 3.813 1.00 72.13 O ATOM 1620 CB ASP A 106 13.859 -4.401 2.125 1.00 63.13 C ATOM 1621 CG ASP A 106 14.859 -4.155 3.222 1.00 44.12 C ATOM 1622 OD1 ASP A 106 15.012 -5.040 4.089 1.00 73.24 O ATOM 1623 OD2 ASP A 106 15.543 -3.107 3.203 1.00 52.15 O ATOM 0 H ASP A 106 12.016 -5.011 0.636 1.00 63.10 H new ATOM 0 HA ASP A 106 12.172 -4.678 3.452 1.00 61.41 H new ATOM 0 HB2 ASP A 106 13.960 -5.431 1.784 1.00 63.13 H new ATOM 0 HB3 ASP A 106 14.104 -3.760 1.278 1.00 63.13 H new ATOM 1628 N ASN A 107 11.849 -2.005 1.661 1.00 12.32 N ATOM 1629 CA ASN A 107 11.578 -0.592 1.702 1.00 50.32 C ATOM 1630 C ASN A 107 10.156 -0.333 2.167 1.00 30.25 C ATOM 1631 O ASN A 107 9.894 0.640 2.897 1.00 63.15 O ATOM 1632 CB ASN A 107 11.846 0.053 0.339 1.00 53.44 C ATOM 1633 CG ASN A 107 13.309 -0.002 -0.078 1.00 73.01 C ATOM 1634 OD1 ASN A 107 14.208 0.041 0.766 1.00 2.24 O ATOM 1635 ND2 ASN A 107 13.565 -0.122 -1.372 1.00 71.24 N ATOM 0 H ASN A 107 11.757 -2.423 0.735 1.00 12.32 H new ATOM 0 HA ASN A 107 12.254 -0.132 2.423 1.00 50.32 H new ATOM 0 HB2 ASN A 107 11.241 -0.448 -0.417 1.00 53.44 H new ATOM 0 HB3 ASN A 107 11.523 1.094 0.368 1.00 53.44 H new ATOM 0 HD21 ASN A 107 14.530 -0.182 -1.698 1.00 71.24 H new ATOM 0 HD22 ASN A 107 12.797 -0.154 -2.043 1.00 71.24 H new ATOM 1642 N ALA A 108 9.236 -1.211 1.767 1.00 35.34 N ATOM 1643 CA ALA A 108 7.849 -1.100 2.156 1.00 43.32 C ATOM 1644 C ALA A 108 7.670 -1.260 3.659 1.00 10.33 C ATOM 1645 O ALA A 108 6.831 -0.592 4.239 1.00 72.34 O ATOM 1646 CB ALA A 108 6.989 -2.100 1.396 1.00 53.42 C ATOM 0 H ALA A 108 9.439 -2.011 1.168 1.00 35.34 H new ATOM 0 HA ALA A 108 7.517 -0.096 1.894 1.00 43.32 H new ATOM 0 HB1 ALA A 108 5.949 -1.996 1.707 1.00 53.42 H new ATOM 0 HB2 ALA A 108 7.068 -1.909 0.326 1.00 53.42 H new ATOM 0 HB3 ALA A 108 7.332 -3.112 1.610 1.00 53.42 H new ATOM 1652 N VAL A 109 8.484 -2.130 4.296 1.00 61.31 N ATOM 1653 CA VAL A 109 8.373 -2.362 5.745 1.00 73.32 C ATOM 1654 C VAL A 109 8.439 -1.045 6.544 1.00 60.51 C ATOM 1655 O VAL A 109 7.651 -0.823 7.458 1.00 42.42 O ATOM 1656 CB VAL A 109 9.438 -3.380 6.299 1.00 32.44 C ATOM 1657 CG1 VAL A 109 9.378 -4.701 5.582 1.00 61.11 C ATOM 1658 CG2 VAL A 109 10.849 -2.836 6.304 1.00 73.43 C ATOM 0 H VAL A 109 9.213 -2.674 3.834 1.00 61.31 H new ATOM 0 HA VAL A 109 7.391 -2.813 5.886 1.00 73.32 H new ATOM 0 HB VAL A 109 9.164 -3.542 7.342 1.00 32.44 H new ATOM 0 HG11 VAL A 109 10.129 -5.374 5.995 1.00 61.11 H new ATOM 0 HG12 VAL A 109 8.388 -5.140 5.710 1.00 61.11 H new ATOM 0 HG13 VAL A 109 9.573 -4.548 4.521 1.00 61.11 H new ATOM 0 HG21 VAL A 109 11.529 -3.591 6.698 1.00 73.43 H new ATOM 0 HG22 VAL A 109 11.143 -2.579 5.287 1.00 73.43 H new ATOM 0 HG23 VAL A 109 10.893 -1.945 6.931 1.00 73.43 H new ATOM 1668 N ASP A 110 9.362 -0.181 6.165 1.00 20.32 N ATOM 1669 CA ASP A 110 9.558 1.097 6.816 1.00 60.31 C ATOM 1670 C ASP A 110 8.424 2.041 6.522 1.00 52.23 C ATOM 1671 O ASP A 110 7.937 2.739 7.414 1.00 55.42 O ATOM 1672 CB ASP A 110 10.852 1.716 6.361 1.00 64.45 C ATOM 1673 CG ASP A 110 11.149 3.007 7.087 1.00 34.55 C ATOM 1674 OD1 ASP A 110 11.772 2.963 8.160 1.00 1.33 O ATOM 1675 OD2 ASP A 110 10.753 4.078 6.611 1.00 44.31 O ATOM 0 H ASP A 110 10.002 -0.350 5.389 1.00 20.32 H new ATOM 0 HA ASP A 110 9.591 0.920 7.891 1.00 60.31 H new ATOM 0 HB2 ASP A 110 11.668 1.012 6.525 1.00 64.45 H new ATOM 0 HB3 ASP A 110 10.806 1.906 5.289 1.00 64.45 H new ATOM 1680 N VAL A 111 8.002 2.066 5.269 1.00 53.24 N ATOM 1681 CA VAL A 111 6.922 2.944 4.853 1.00 41.42 C ATOM 1682 C VAL A 111 5.631 2.558 5.560 1.00 1.10 C ATOM 1683 O VAL A 111 4.860 3.407 5.968 1.00 54.42 O ATOM 1684 CB VAL A 111 6.719 2.947 3.313 1.00 72.22 C ATOM 1685 CG1 VAL A 111 5.593 3.898 2.919 1.00 33.31 C ATOM 1686 CG2 VAL A 111 8.004 3.346 2.612 1.00 5.34 C ATOM 0 H VAL A 111 8.390 1.489 4.523 1.00 53.24 H new ATOM 0 HA VAL A 111 7.201 3.958 5.138 1.00 41.42 H new ATOM 0 HB VAL A 111 6.446 1.938 3.004 1.00 72.22 H new ATOM 0 HG11 VAL A 111 5.468 3.885 1.836 1.00 33.31 H new ATOM 0 HG12 VAL A 111 4.665 3.581 3.396 1.00 33.31 H new ATOM 0 HG13 VAL A 111 5.840 4.909 3.243 1.00 33.31 H new ATOM 0 HG21 VAL A 111 7.846 3.344 1.534 1.00 5.34 H new ATOM 0 HG22 VAL A 111 8.299 4.345 2.933 1.00 5.34 H new ATOM 0 HG23 VAL A 111 8.792 2.636 2.865 1.00 5.34 H new ATOM 1696 N VAL A 112 5.433 1.282 5.754 1.00 51.10 N ATOM 1697 CA VAL A 112 4.239 0.836 6.438 1.00 74.31 C ATOM 1698 C VAL A 112 4.361 1.159 7.940 1.00 23.41 C ATOM 1699 O VAL A 112 3.417 1.650 8.559 1.00 74.01 O ATOM 1700 CB VAL A 112 3.936 -0.674 6.193 1.00 51.00 C ATOM 1701 CG1 VAL A 112 2.671 -1.100 6.927 1.00 35.12 C ATOM 1702 CG2 VAL A 112 3.766 -0.945 4.705 1.00 43.14 C ATOM 0 H VAL A 112 6.067 0.541 5.456 1.00 51.10 H new ATOM 0 HA VAL A 112 3.387 1.376 6.025 1.00 74.31 H new ATOM 0 HB VAL A 112 4.779 -1.250 6.575 1.00 51.00 H new ATOM 0 HG11 VAL A 112 2.481 -2.157 6.741 1.00 35.12 H new ATOM 0 HG12 VAL A 112 2.799 -0.938 7.997 1.00 35.12 H new ATOM 0 HG13 VAL A 112 1.827 -0.511 6.569 1.00 35.12 H new ATOM 0 HG21 VAL A 112 3.555 -2.003 4.550 1.00 43.14 H new ATOM 0 HG22 VAL A 112 2.939 -0.350 4.319 1.00 43.14 H new ATOM 0 HG23 VAL A 112 4.682 -0.677 4.179 1.00 43.14 H new ATOM 1712 N ARG A 113 5.558 0.930 8.491 1.00 71.52 N ATOM 1713 CA ARG A 113 5.871 1.215 9.876 1.00 11.01 C ATOM 1714 C ARG A 113 5.605 2.691 10.223 1.00 74.04 C ATOM 1715 O ARG A 113 4.958 2.998 11.233 1.00 2.44 O ATOM 1716 CB ARG A 113 7.332 0.915 10.095 1.00 50.41 C ATOM 1717 CG ARG A 113 7.844 1.257 11.434 1.00 14.24 C ATOM 1718 CD ARG A 113 9.336 1.242 11.410 1.00 43.24 C ATOM 1719 NE ARG A 113 9.903 2.307 10.551 1.00 60.33 N ATOM 1720 CZ ARG A 113 10.001 3.609 10.885 1.00 72.12 C ATOM 1721 NH1 ARG A 113 9.460 4.065 12.009 1.00 13.05 N ATOM 1722 NH2 ARG A 113 10.634 4.440 10.081 1.00 0.14 N ATOM 0 H ARG A 113 6.341 0.535 7.971 1.00 71.52 H new ATOM 0 HA ARG A 113 5.237 0.600 10.515 1.00 11.01 H new ATOM 0 HB2 ARG A 113 7.500 -0.148 9.919 1.00 50.41 H new ATOM 0 HB3 ARG A 113 7.914 1.457 9.350 1.00 50.41 H new ATOM 0 HG2 ARG A 113 7.484 2.241 11.733 1.00 14.24 H new ATOM 0 HG3 ARG A 113 7.473 0.544 12.171 1.00 14.24 H new ATOM 0 HD2 ARG A 113 9.713 1.361 12.426 1.00 43.24 H new ATOM 0 HD3 ARG A 113 9.680 0.271 11.053 1.00 43.24 H new ATOM 0 HE ARG A 113 10.248 2.033 9.631 1.00 60.33 H new ATOM 0 HH11 ARG A 113 8.963 3.427 12.631 1.00 13.05 H new ATOM 0 HH12 ARG A 113 9.541 5.053 12.250 1.00 13.05 H new ATOM 0 HH21 ARG A 113 11.045 4.096 9.213 1.00 0.14 H new ATOM 0 HH22 ARG A 113 10.712 5.427 10.327 1.00 0.14 H new ATOM 1736 N GLN A 114 6.112 3.594 9.386 1.00 22.55 N ATOM 1737 CA GLN A 114 5.975 5.022 9.632 1.00 10.33 C ATOM 1738 C GLN A 114 4.517 5.432 9.649 1.00 32.33 C ATOM 1739 O GLN A 114 4.089 6.141 10.534 1.00 41.31 O ATOM 1740 CB GLN A 114 6.805 5.848 8.635 1.00 52.11 C ATOM 1741 CG GLN A 114 6.407 5.735 7.190 1.00 35.23 C ATOM 1742 CD GLN A 114 7.320 6.516 6.278 1.00 32.31 C ATOM 1743 OE1 GLN A 114 7.088 7.694 5.990 1.00 42.44 O ATOM 1744 NE2 GLN A 114 8.371 5.886 5.838 1.00 74.00 N ATOM 0 H GLN A 114 6.620 3.359 8.533 1.00 22.55 H new ATOM 0 HA GLN A 114 6.379 5.235 10.622 1.00 10.33 H new ATOM 0 HB2 GLN A 114 6.746 6.897 8.926 1.00 52.11 H new ATOM 0 HB3 GLN A 114 7.849 5.549 8.728 1.00 52.11 H new ATOM 0 HG2 GLN A 114 6.415 4.686 6.895 1.00 35.23 H new ATOM 0 HG3 GLN A 114 5.385 6.093 7.069 1.00 35.23 H new ATOM 0 HE21 GLN A 114 8.528 4.912 6.098 1.00 74.00 H new ATOM 0 HE22 GLN A 114 9.037 6.366 5.233 1.00 74.00 H new ATOM 1753 N LEU A 115 3.766 4.932 8.700 1.00 73.32 N ATOM 1754 CA LEU A 115 2.330 5.171 8.602 1.00 62.35 C ATOM 1755 C LEU A 115 1.604 4.683 9.845 1.00 52.25 C ATOM 1756 O LEU A 115 0.685 5.342 10.327 1.00 33.20 O ATOM 1757 CB LEU A 115 1.764 4.511 7.339 1.00 63.24 C ATOM 1758 CG LEU A 115 1.841 5.303 6.005 1.00 60.02 C ATOM 1759 CD1 LEU A 115 3.188 5.965 5.789 1.00 32.53 C ATOM 1760 CD2 LEU A 115 1.572 4.357 4.861 1.00 52.25 C ATOM 0 H LEU A 115 4.132 4.337 7.957 1.00 73.32 H new ATOM 0 HA LEU A 115 2.169 6.247 8.530 1.00 62.35 H new ATOM 0 HB2 LEU A 115 2.284 3.564 7.195 1.00 63.24 H new ATOM 0 HB3 LEU A 115 0.717 4.274 7.527 1.00 63.24 H new ATOM 0 HG LEU A 115 1.094 6.095 6.052 1.00 60.02 H new ATOM 0 HD11 LEU A 115 3.181 6.503 4.841 1.00 32.53 H new ATOM 0 HD12 LEU A 115 3.384 6.664 6.602 1.00 32.53 H new ATOM 0 HD13 LEU A 115 3.968 5.204 5.769 1.00 32.53 H new ATOM 0 HD21 LEU A 115 1.623 4.902 3.918 1.00 52.25 H new ATOM 0 HD22 LEU A 115 2.319 3.563 4.862 1.00 52.25 H new ATOM 0 HD23 LEU A 115 0.579 3.922 4.975 1.00 52.25 H new ATOM 1772 N MET A 116 2.047 3.553 10.382 1.00 25.20 N ATOM 1773 CA MET A 116 1.457 3.007 11.596 1.00 20.33 C ATOM 1774 C MET A 116 1.652 3.961 12.765 1.00 52.20 C ATOM 1775 O MET A 116 0.757 4.151 13.578 1.00 11.13 O ATOM 1776 CB MET A 116 2.014 1.618 11.976 1.00 34.35 C ATOM 1777 CG MET A 116 1.800 0.509 10.958 1.00 53.52 C ATOM 1778 SD MET A 116 2.095 -1.149 11.652 1.00 64.42 S ATOM 1779 CE MET A 116 3.745 -1.001 12.356 1.00 45.35 C ATOM 0 H MET A 116 2.811 2.998 9.996 1.00 25.20 H new ATOM 0 HA MET A 116 0.395 2.885 11.381 1.00 20.33 H new ATOM 0 HB2 MET A 116 3.084 1.716 12.157 1.00 34.35 H new ATOM 0 HB3 MET A 116 1.558 1.312 12.918 1.00 34.35 H new ATOM 0 HG2 MET A 116 0.780 0.563 10.577 1.00 53.52 H new ATOM 0 HG3 MET A 116 2.466 0.667 10.109 1.00 53.52 H new ATOM 0 HE1 MET A 116 4.056 -1.964 12.761 1.00 45.35 H new ATOM 0 HE2 MET A 116 4.445 -0.691 11.580 1.00 45.35 H new ATOM 0 HE3 MET A 116 3.735 -0.258 13.154 1.00 45.35 H new ATOM 1789 N SER A 117 2.813 4.566 12.834 1.00 23.40 N ATOM 1790 CA SER A 117 3.116 5.494 13.898 1.00 11.34 C ATOM 1791 C SER A 117 2.486 6.878 13.623 1.00 14.44 C ATOM 1792 O SER A 117 1.915 7.498 14.518 1.00 22.33 O ATOM 1793 CB SER A 117 4.641 5.593 14.090 1.00 42.21 C ATOM 1794 OG SER A 117 4.982 6.418 15.199 1.00 1.10 O ATOM 0 H SER A 117 3.568 4.432 12.162 1.00 23.40 H new ATOM 0 HA SER A 117 2.679 5.122 14.825 1.00 11.34 H new ATOM 0 HB2 SER A 117 5.054 4.595 14.239 1.00 42.21 H new ATOM 0 HB3 SER A 117 5.096 5.995 13.185 1.00 42.21 H new ATOM 0 HG SER A 117 5.957 6.456 15.291 1.00 1.10 H new ATOM 1800 N MET A 118 2.581 7.327 12.384 1.00 21.24 N ATOM 1801 CA MET A 118 2.078 8.641 11.965 1.00 52.14 C ATOM 1802 C MET A 118 0.560 8.723 12.012 1.00 4.32 C ATOM 1803 O MET A 118 -0.006 9.673 12.548 1.00 44.10 O ATOM 1804 CB MET A 118 2.565 8.981 10.544 1.00 11.55 C ATOM 1805 CG MET A 118 4.066 9.187 10.417 1.00 22.24 C ATOM 1806 SD MET A 118 4.618 9.324 8.696 1.00 0.44 S ATOM 1807 CE MET A 118 3.659 10.728 8.119 1.00 45.54 C ATOM 0 H MET A 118 3.011 6.793 11.629 1.00 21.24 H new ATOM 0 HA MET A 118 2.475 9.367 12.675 1.00 52.14 H new ATOM 0 HB2 MET A 118 2.264 8.179 9.870 1.00 11.55 H new ATOM 0 HB3 MET A 118 2.058 9.886 10.208 1.00 11.55 H new ATOM 0 HG2 MET A 118 4.350 10.090 10.957 1.00 22.24 H new ATOM 0 HG3 MET A 118 4.583 8.354 10.894 1.00 22.24 H new ATOM 0 HE1 MET A 118 4.021 11.038 7.139 1.00 45.54 H new ATOM 0 HE2 MET A 118 2.609 10.446 8.045 1.00 45.54 H new ATOM 0 HE3 MET A 118 3.764 11.554 8.822 1.00 45.54 H new ATOM 1817 N TYR A 119 -0.098 7.739 11.452 1.00 61.20 N ATOM 1818 CA TYR A 119 -1.556 7.759 11.376 1.00 24.41 C ATOM 1819 C TYR A 119 -2.201 6.966 12.486 1.00 42.31 C ATOM 1820 O TYR A 119 -3.429 6.949 12.613 1.00 13.23 O ATOM 1821 CB TYR A 119 -2.034 7.294 10.001 1.00 44.15 C ATOM 1822 CG TYR A 119 -1.639 8.256 8.894 1.00 70.15 C ATOM 1823 CD1 TYR A 119 -0.387 8.185 8.294 1.00 13.34 C ATOM 1824 CD2 TYR A 119 -2.510 9.251 8.471 1.00 24.21 C ATOM 1825 CE1 TYR A 119 -0.017 9.075 7.308 1.00 12.30 C ATOM 1826 CE2 TYR A 119 -2.147 10.152 7.487 1.00 53.44 C ATOM 1827 CZ TYR A 119 -0.896 10.057 6.906 1.00 20.12 C ATOM 1828 OH TYR A 119 -0.515 10.962 5.932 1.00 31.12 O ATOM 0 H TYR A 119 0.340 6.914 11.041 1.00 61.20 H new ATOM 0 HA TYR A 119 -1.873 8.793 11.513 1.00 24.41 H new ATOM 0 HB2 TYR A 119 -1.617 6.309 9.789 1.00 44.15 H new ATOM 0 HB3 TYR A 119 -3.118 7.185 10.014 1.00 44.15 H new ATOM 0 HD1 TYR A 119 0.308 7.419 8.606 1.00 13.34 H new ATOM 0 HD2 TYR A 119 -3.490 9.323 8.919 1.00 24.21 H new ATOM 0 HE1 TYR A 119 0.959 9.003 6.852 1.00 12.30 H new ATOM 0 HE2 TYR A 119 -2.835 10.924 7.175 1.00 53.44 H new ATOM 0 HH TYR A 119 -1.249 11.588 5.762 1.00 31.12 H new ATOM 1838 N ASN A 120 -1.369 6.322 13.287 1.00 1.55 N ATOM 1839 CA ASN A 120 -1.816 5.520 14.428 1.00 1.34 C ATOM 1840 C ASN A 120 -2.664 4.347 13.960 1.00 74.42 C ATOM 1841 O ASN A 120 -3.895 4.322 14.103 1.00 71.24 O ATOM 1842 CB ASN A 120 -2.514 6.365 15.528 1.00 20.50 C ATOM 1843 CG ASN A 120 -2.948 5.552 16.745 1.00 44.33 C ATOM 1844 OD1 ASN A 120 -2.335 4.533 17.088 1.00 54.43 O ATOM 1845 ND2 ASN A 120 -3.989 5.997 17.407 1.00 5.10 N ATOM 0 H ASN A 120 -0.356 6.337 13.168 1.00 1.55 H new ATOM 0 HA ASN A 120 -0.926 5.113 14.908 1.00 1.34 H new ATOM 0 HB2 ASN A 120 -1.836 7.154 15.853 1.00 20.50 H new ATOM 0 HB3 ASN A 120 -3.388 6.853 15.098 1.00 20.50 H new ATOM 0 HD21 ASN A 120 -4.318 5.499 18.234 1.00 5.10 H new ATOM 0 HD22 ASN A 120 -4.469 6.841 17.095 1.00 5.10 H new ATOM 1852 N ILE A 121 -1.997 3.442 13.308 1.00 43.31 N ATOM 1853 CA ILE A 121 -2.577 2.242 12.774 1.00 21.21 C ATOM 1854 C ILE A 121 -1.817 1.054 13.362 1.00 74.40 C ATOM 1855 O ILE A 121 -0.602 1.019 13.293 1.00 62.05 O ATOM 1856 CB ILE A 121 -2.409 2.221 11.227 1.00 13.45 C ATOM 1857 CG1 ILE A 121 -3.064 3.455 10.592 1.00 54.14 C ATOM 1858 CG2 ILE A 121 -2.994 0.946 10.641 1.00 5.11 C ATOM 1859 CD1 ILE A 121 -2.772 3.612 9.108 1.00 32.11 C ATOM 0 H ILE A 121 -0.997 3.521 13.126 1.00 43.31 H new ATOM 0 HA ILE A 121 -3.637 2.195 13.023 1.00 21.21 H new ATOM 0 HB ILE A 121 -1.343 2.245 11.001 1.00 13.45 H new ATOM 0 HG12 ILE A 121 -4.143 3.396 10.736 1.00 54.14 H new ATOM 0 HG13 ILE A 121 -2.721 4.347 11.116 1.00 54.14 H new ATOM 0 HG21 ILE A 121 -2.866 0.951 9.559 1.00 5.11 H new ATOM 0 HG22 ILE A 121 -2.480 0.082 11.063 1.00 5.11 H new ATOM 0 HG23 ILE A 121 -4.056 0.889 10.881 1.00 5.11 H new ATOM 0 HD11 ILE A 121 -3.269 4.506 8.732 1.00 32.11 H new ATOM 0 HD12 ILE A 121 -1.696 3.704 8.957 1.00 32.11 H new ATOM 0 HD13 ILE A 121 -3.141 2.739 8.570 1.00 32.11 H new ATOM 1871 N PRO A 122 -2.500 0.103 13.986 1.00 32.14 N ATOM 1872 CA PRO A 122 -1.852 -1.082 14.522 1.00 42.14 C ATOM 1873 C PRO A 122 -1.489 -2.089 13.425 1.00 54.35 C ATOM 1874 O PRO A 122 -2.119 -2.134 12.366 1.00 25.14 O ATOM 1875 CB PRO A 122 -2.872 -1.660 15.500 1.00 32.53 C ATOM 1876 CG PRO A 122 -4.198 -1.149 15.043 1.00 64.10 C ATOM 1877 CD PRO A 122 -3.948 0.114 14.244 1.00 31.41 C ATOM 0 HA PRO A 122 -0.903 -0.844 15.002 1.00 42.14 H new ATOM 0 HB2 PRO A 122 -2.848 -2.750 15.493 1.00 32.53 H new ATOM 0 HB3 PRO A 122 -2.660 -1.343 16.521 1.00 32.53 H new ATOM 0 HG2 PRO A 122 -4.707 -1.895 14.432 1.00 64.10 H new ATOM 0 HG3 PRO A 122 -4.844 -0.942 15.896 1.00 64.10 H new ATOM 0 HD2 PRO A 122 -4.517 0.115 13.314 1.00 31.41 H new ATOM 0 HD3 PRO A 122 -4.246 1.002 14.801 1.00 31.41 H new ATOM 1885 N ILE A 123 -0.476 -2.894 13.702 1.00 24.31 N ATOM 1886 CA ILE A 123 0.084 -3.876 12.764 1.00 61.43 C ATOM 1887 C ILE A 123 -0.966 -4.930 12.323 1.00 22.20 C ATOM 1888 O ILE A 123 -0.806 -5.601 11.330 1.00 1.41 O ATOM 1889 CB ILE A 123 1.334 -4.580 13.395 1.00 22.43 C ATOM 1890 CG1 ILE A 123 2.049 -5.497 12.389 1.00 23.22 C ATOM 1891 CG2 ILE A 123 0.950 -5.363 14.650 1.00 74.20 C ATOM 1892 CD1 ILE A 123 2.643 -4.767 11.199 1.00 25.15 C ATOM 0 H ILE A 123 -0.003 -2.889 14.606 1.00 24.31 H new ATOM 0 HA ILE A 123 0.391 -3.333 11.870 1.00 61.43 H new ATOM 0 HB ILE A 123 2.032 -3.792 13.677 1.00 22.43 H new ATOM 0 HG12 ILE A 123 2.844 -6.035 12.905 1.00 23.22 H new ATOM 0 HG13 ILE A 123 1.342 -6.243 12.028 1.00 23.22 H new ATOM 0 HG21 ILE A 123 1.837 -5.841 15.066 1.00 74.20 H new ATOM 0 HG22 ILE A 123 0.525 -4.682 15.387 1.00 74.20 H new ATOM 0 HG23 ILE A 123 0.214 -6.125 14.393 1.00 74.20 H new ATOM 0 HD11 ILE A 123 3.129 -5.484 10.538 1.00 25.15 H new ATOM 0 HD12 ILE A 123 1.851 -4.252 10.656 1.00 25.15 H new ATOM 0 HD13 ILE A 123 3.377 -4.040 11.547 1.00 25.15 H new ATOM 1904 N GLU A 124 -2.035 -5.055 13.061 1.00 60.32 N ATOM 1905 CA GLU A 124 -3.067 -6.000 12.691 1.00 63.12 C ATOM 1906 C GLU A 124 -4.148 -5.352 11.834 1.00 72.14 C ATOM 1907 O GLU A 124 -5.141 -5.988 11.456 1.00 43.55 O ATOM 1908 CB GLU A 124 -3.626 -6.698 13.909 1.00 61.13 C ATOM 1909 CG GLU A 124 -2.584 -7.558 14.597 1.00 15.51 C ATOM 1910 CD GLU A 124 -3.109 -8.258 15.798 1.00 52.00 C ATOM 1911 OE1 GLU A 124 -3.788 -9.287 15.642 1.00 22.12 O ATOM 1912 OE2 GLU A 124 -2.850 -7.791 16.927 1.00 72.33 O ATOM 0 H GLU A 124 -2.219 -4.524 13.913 1.00 60.32 H new ATOM 0 HA GLU A 124 -2.610 -6.769 12.068 1.00 63.12 H new ATOM 0 HB2 GLU A 124 -4.004 -5.955 14.611 1.00 61.13 H new ATOM 0 HB3 GLU A 124 -4.472 -7.319 13.615 1.00 61.13 H new ATOM 0 HG2 GLU A 124 -2.206 -8.296 13.890 1.00 15.51 H new ATOM 0 HG3 GLU A 124 -1.740 -6.933 14.888 1.00 15.51 H new ATOM 1919 N ASN A 125 -3.940 -4.092 11.517 1.00 14.25 N ATOM 1920 CA ASN A 125 -4.819 -3.366 10.622 1.00 11.44 C ATOM 1921 C ASN A 125 -4.291 -3.365 9.227 1.00 1.54 C ATOM 1922 O ASN A 125 -4.942 -2.869 8.307 1.00 73.32 O ATOM 1923 CB ASN A 125 -5.092 -1.945 11.083 1.00 32.41 C ATOM 1924 CG ASN A 125 -6.128 -1.858 12.168 1.00 34.10 C ATOM 1925 OD1 ASN A 125 -6.302 -2.771 12.972 1.00 11.43 O ATOM 1926 ND2 ASN A 125 -6.825 -0.757 12.201 1.00 20.21 N ATOM 0 H ASN A 125 -3.158 -3.541 11.871 1.00 14.25 H new ATOM 0 HA ASN A 125 -5.771 -3.897 10.639 1.00 11.44 H new ATOM 0 HB2 ASN A 125 -4.163 -1.503 11.442 1.00 32.41 H new ATOM 0 HB3 ASN A 125 -5.419 -1.351 10.230 1.00 32.41 H new ATOM 0 HD21 ASN A 125 -7.545 -0.630 12.912 1.00 20.21 H new ATOM 0 HD22 ASN A 125 -6.650 -0.022 11.516 1.00 20.21 H new ATOM 1933 N VAL A 126 -3.107 -3.893 9.050 1.00 13.42 N ATOM 1934 CA VAL A 126 -2.598 -4.049 7.725 1.00 24.01 C ATOM 1935 C VAL A 126 -3.122 -5.375 7.170 1.00 1.42 C ATOM 1936 O VAL A 126 -2.870 -6.450 7.721 1.00 73.01 O ATOM 1937 CB VAL A 126 -1.037 -3.932 7.633 1.00 73.23 C ATOM 1938 CG1 VAL A 126 -0.331 -4.956 8.468 1.00 33.22 C ATOM 1939 CG2 VAL A 126 -0.574 -4.008 6.202 1.00 41.54 C ATOM 0 H VAL A 126 -2.491 -4.215 9.797 1.00 13.42 H new ATOM 0 HA VAL A 126 -2.957 -3.222 7.112 1.00 24.01 H new ATOM 0 HB VAL A 126 -0.775 -2.954 8.037 1.00 73.23 H new ATOM 0 HG11 VAL A 126 0.747 -4.828 8.366 1.00 33.22 H new ATOM 0 HG12 VAL A 126 -0.614 -4.831 9.513 1.00 33.22 H new ATOM 0 HG13 VAL A 126 -0.611 -5.955 8.133 1.00 33.22 H new ATOM 0 HG21 VAL A 126 0.512 -3.924 6.166 1.00 41.54 H new ATOM 0 HG22 VAL A 126 -0.879 -4.962 5.771 1.00 41.54 H new ATOM 0 HG23 VAL A 126 -1.020 -3.193 5.632 1.00 41.54 H new ATOM 1949 N ARG A 127 -3.898 -5.279 6.133 1.00 12.43 N ATOM 1950 CA ARG A 127 -4.558 -6.420 5.552 1.00 42.34 C ATOM 1951 C ARG A 127 -4.222 -6.521 4.082 1.00 13.42 C ATOM 1952 O ARG A 127 -3.642 -5.594 3.494 1.00 42.21 O ATOM 1953 CB ARG A 127 -6.077 -6.289 5.737 1.00 75.30 C ATOM 1954 CG ARG A 127 -6.522 -6.194 7.192 1.00 13.34 C ATOM 1955 CD ARG A 127 -6.260 -7.482 7.950 1.00 0.11 C ATOM 1956 NE ARG A 127 -6.562 -7.344 9.384 1.00 75.22 N ATOM 1957 CZ ARG A 127 -7.602 -7.896 10.012 1.00 24.21 C ATOM 1958 NH1 ARG A 127 -8.543 -8.533 9.328 1.00 65.35 N ATOM 1959 NH2 ARG A 127 -7.713 -7.771 11.333 1.00 70.34 N ATOM 0 H ARG A 127 -4.096 -4.399 5.658 1.00 12.43 H new ATOM 0 HA ARG A 127 -4.214 -7.325 6.053 1.00 42.34 H new ATOM 0 HB2 ARG A 127 -6.422 -5.403 5.204 1.00 75.30 H new ATOM 0 HB3 ARG A 127 -6.564 -7.148 5.275 1.00 75.30 H new ATOM 0 HG2 ARG A 127 -5.996 -5.373 7.679 1.00 13.34 H new ATOM 0 HG3 ARG A 127 -7.586 -5.960 7.232 1.00 13.34 H new ATOM 0 HD2 ARG A 127 -6.866 -8.283 7.526 1.00 0.11 H new ATOM 0 HD3 ARG A 127 -5.217 -7.772 7.825 1.00 0.11 H new ATOM 0 HE ARG A 127 -5.923 -6.780 9.944 1.00 75.22 H new ATOM 0 HH11 ARG A 127 -8.476 -8.604 8.313 1.00 65.35 H new ATOM 0 HH12 ARG A 127 -9.334 -8.952 9.817 1.00 65.35 H new ATOM 0 HH21 ARG A 127 -7.006 -7.256 11.858 1.00 70.34 H new ATOM 0 HH22 ARG A 127 -8.505 -8.190 11.820 1.00 70.34 H new ATOM 1973 N THR A 128 -4.550 -7.633 3.491 1.00 33.33 N ATOM 1974 CA THR A 128 -4.303 -7.819 2.101 1.00 22.02 C ATOM 1975 C THR A 128 -5.544 -7.408 1.307 1.00 53.45 C ATOM 1976 O THR A 128 -6.644 -7.304 1.855 1.00 51.23 O ATOM 1977 CB THR A 128 -3.994 -9.309 1.767 1.00 42.32 C ATOM 1978 OG1 THR A 128 -5.140 -10.101 1.984 1.00 3.20 O ATOM 1979 CG2 THR A 128 -2.884 -9.852 2.628 1.00 0.34 C ATOM 0 H THR A 128 -4.991 -8.425 3.958 1.00 33.33 H new ATOM 0 HA THR A 128 -3.440 -7.208 1.835 1.00 22.02 H new ATOM 0 HB THR A 128 -3.689 -9.347 0.721 1.00 42.32 H new ATOM 0 HG1 THR A 128 -4.937 -11.036 1.770 1.00 3.20 H new ATOM 0 HG21 THR A 128 -2.697 -10.893 2.366 1.00 0.34 H new ATOM 0 HG22 THR A 128 -1.978 -9.268 2.465 1.00 0.34 H new ATOM 0 HG23 THR A 128 -3.173 -9.788 3.677 1.00 0.34 H new ATOM 1987 N HIS A 129 -5.366 -7.193 0.011 1.00 62.20 N ATOM 1988 CA HIS A 129 -6.488 -6.922 -0.911 1.00 73.12 C ATOM 1989 C HIS A 129 -7.435 -8.147 -0.891 1.00 73.53 C ATOM 1990 O HIS A 129 -8.651 -8.051 -1.061 1.00 74.35 O ATOM 1991 CB HIS A 129 -5.895 -6.721 -2.343 1.00 4.24 C ATOM 1992 CG HIS A 129 -6.878 -6.364 -3.452 1.00 2.11 C ATOM 1993 ND1 HIS A 129 -6.498 -5.812 -4.651 1.00 42.23 N ATOM 1994 CD2 HIS A 129 -8.211 -6.521 -3.549 1.00 35.14 C ATOM 1995 CE1 HIS A 129 -7.541 -5.646 -5.426 1.00 22.21 C ATOM 1996 NE2 HIS A 129 -8.592 -6.070 -4.783 1.00 71.53 N ATOM 0 H HIS A 129 -4.451 -7.199 -0.440 1.00 62.20 H new ATOM 0 HA HIS A 129 -7.043 -6.031 -0.617 1.00 73.12 H new ATOM 0 HB2 HIS A 129 -5.142 -5.935 -2.291 1.00 4.24 H new ATOM 0 HB3 HIS A 129 -5.380 -7.638 -2.629 1.00 4.24 H new ATOM 0 HD2 HIS A 129 -8.862 -6.929 -2.790 1.00 35.14 H new ATOM 0 HE1 HIS A 129 -7.531 -5.231 -6.423 1.00 22.21 H new ATOM 0 HE2 HIS A 129 -9.547 -6.066 -5.142 1.00 71.53 H new ATOM 2004 N GLN A 130 -6.843 -9.267 -0.655 1.00 60.01 N ATOM 2005 CA GLN A 130 -7.502 -10.528 -0.672 1.00 23.32 C ATOM 2006 C GLN A 130 -8.286 -10.720 0.639 1.00 42.31 C ATOM 2007 O GLN A 130 -9.257 -11.449 0.697 1.00 61.34 O ATOM 2008 CB GLN A 130 -6.417 -11.569 -0.859 1.00 60.43 C ATOM 2009 CG GLN A 130 -6.789 -12.782 -1.693 1.00 64.12 C ATOM 2010 CD GLN A 130 -7.686 -13.791 -1.046 1.00 15.25 C ATOM 2011 OE1 GLN A 130 -8.461 -14.465 -1.709 1.00 33.33 O ATOM 2012 NE2 GLN A 130 -7.576 -13.920 0.213 1.00 42.41 N ATOM 0 H GLN A 130 -5.849 -9.332 -0.437 1.00 60.01 H new ATOM 0 HA GLN A 130 -8.231 -10.609 -1.478 1.00 23.32 H new ATOM 0 HB2 GLN A 130 -5.555 -11.087 -1.321 1.00 60.43 H new ATOM 0 HB3 GLN A 130 -6.100 -11.914 0.125 1.00 60.43 H new ATOM 0 HG2 GLN A 130 -7.272 -12.433 -2.606 1.00 64.12 H new ATOM 0 HG3 GLN A 130 -5.869 -13.285 -1.991 1.00 64.12 H new ATOM 0 HE21 GLN A 130 -6.917 -13.338 0.730 1.00 42.41 H new ATOM 0 HE22 GLN A 130 -8.147 -14.606 0.707 1.00 42.41 H new ATOM 2021 N SER A 131 -7.856 -10.039 1.656 1.00 13.32 N ATOM 2022 CA SER A 131 -8.443 -10.143 2.969 1.00 62.14 C ATOM 2023 C SER A 131 -9.770 -9.399 3.031 1.00 12.33 C ATOM 2024 O SER A 131 -10.693 -9.832 3.721 1.00 51.11 O ATOM 2025 CB SER A 131 -7.467 -9.599 4.028 1.00 31.44 C ATOM 2026 OG SER A 131 -7.947 -9.777 5.352 1.00 70.13 O ATOM 0 H SER A 131 -7.076 -9.384 1.603 1.00 13.32 H new ATOM 0 HA SER A 131 -8.638 -11.195 3.178 1.00 62.14 H new ATOM 0 HB2 SER A 131 -6.505 -10.101 3.923 1.00 31.44 H new ATOM 0 HB3 SER A 131 -7.294 -8.538 3.847 1.00 31.44 H new ATOM 0 HG SER A 131 -7.189 -9.884 5.963 1.00 70.13 H new ATOM 2032 N TRP A 132 -9.877 -8.288 2.301 1.00 1.40 N ATOM 2033 CA TRP A 132 -11.108 -7.496 2.347 1.00 51.30 C ATOM 2034 C TRP A 132 -12.194 -8.124 1.494 1.00 60.05 C ATOM 2035 O TRP A 132 -13.327 -8.309 1.939 1.00 31.21 O ATOM 2036 CB TRP A 132 -10.906 -6.060 1.891 1.00 32.01 C ATOM 2037 CG TRP A 132 -9.894 -5.250 2.631 1.00 43.54 C ATOM 2038 CD1 TRP A 132 -8.757 -4.714 2.108 1.00 24.32 C ATOM 2039 CD2 TRP A 132 -9.914 -4.882 4.014 1.00 52.30 C ATOM 2040 NE1 TRP A 132 -8.085 -4.007 3.069 1.00 63.33 N ATOM 2041 CE2 TRP A 132 -8.765 -4.102 4.250 1.00 72.44 C ATOM 2042 CE3 TRP A 132 -10.791 -5.128 5.074 1.00 71.34 C ATOM 2043 CZ2 TRP A 132 -8.474 -3.565 5.499 1.00 61.20 C ATOM 2044 CZ3 TRP A 132 -10.496 -4.597 6.314 1.00 33.55 C ATOM 2045 CH2 TRP A 132 -9.348 -3.824 6.515 1.00 61.42 C ATOM 0 H TRP A 132 -9.149 -7.923 1.687 1.00 1.40 H new ATOM 0 HA TRP A 132 -11.410 -7.484 3.394 1.00 51.30 H new ATOM 0 HB2 TRP A 132 -10.624 -6.075 0.838 1.00 32.01 H new ATOM 0 HB3 TRP A 132 -11.865 -5.546 1.956 1.00 32.01 H new ATOM 0 HD1 TRP A 132 -8.432 -4.830 1.084 1.00 24.32 H new ATOM 0 HE1 TRP A 132 -7.216 -3.492 2.926 1.00 63.33 H new ATOM 0 HE3 TRP A 132 -11.681 -5.721 4.926 1.00 71.34 H new ATOM 0 HZ2 TRP A 132 -7.590 -2.966 5.659 1.00 61.20 H new ATOM 0 HZ3 TRP A 132 -11.163 -4.782 7.143 1.00 33.55 H new ATOM 0 HH2 TRP A 132 -9.148 -3.422 7.497 1.00 61.42 H new ATOM 2056 N SER A 133 -11.848 -8.437 0.272 1.00 22.23 N ATOM 2057 CA SER A 133 -12.774 -9.024 -0.652 1.00 11.43 C ATOM 2058 C SER A 133 -12.219 -10.358 -1.126 1.00 52.24 C ATOM 2059 O SER A 133 -12.870 -11.405 -0.978 1.00 4.04 O ATOM 2060 CB SER A 133 -13.034 -8.062 -1.824 1.00 51.32 C ATOM 2061 OG SER A 133 -13.933 -8.605 -2.774 1.00 75.22 O ATOM 0 H SER A 133 -10.913 -8.290 -0.108 1.00 22.23 H new ATOM 0 HA SER A 133 -13.732 -9.203 -0.164 1.00 11.43 H new ATOM 0 HB2 SER A 133 -13.437 -7.125 -1.440 1.00 51.32 H new ATOM 0 HB3 SER A 133 -12.089 -7.826 -2.314 1.00 51.32 H new ATOM 0 HG SER A 133 -14.071 -7.961 -3.499 1.00 75.22 H new ATOM 2067 N GLY A 134 -11.008 -10.335 -1.658 1.00 72.01 N ATOM 2068 CA GLY A 134 -10.401 -11.576 -2.065 1.00 41.30 C ATOM 2069 C GLY A 134 -9.634 -11.550 -3.371 1.00 73.25 C ATOM 2070 O GLY A 134 -9.373 -12.608 -3.935 1.00 70.55 O ATOM 0 H GLY A 134 -10.447 -9.497 -1.812 1.00 72.01 H new ATOM 0 HA2 GLY A 134 -9.723 -11.900 -1.276 1.00 41.30 H new ATOM 0 HA3 GLY A 134 -11.184 -12.331 -2.143 1.00 41.30 H new ATOM 2074 N LYS A 135 -9.258 -10.376 -3.876 1.00 51.12 N ATOM 2075 CA LYS A 135 -8.371 -10.386 -5.032 1.00 42.42 C ATOM 2076 C LYS A 135 -6.973 -10.632 -4.558 1.00 13.21 C ATOM 2077 O LYS A 135 -6.408 -9.838 -3.768 1.00 60.32 O ATOM 2078 CB LYS A 135 -8.442 -9.145 -5.919 1.00 23.30 C ATOM 2079 CG LYS A 135 -7.401 -9.173 -7.045 1.00 71.32 C ATOM 2080 CD LYS A 135 -7.536 -8.011 -8.011 1.00 25.54 C ATOM 2081 CE LYS A 135 -8.832 -8.070 -8.799 1.00 1.23 C ATOM 2082 NZ LYS A 135 -8.933 -6.960 -9.762 1.00 54.12 N ATOM 0 H LYS A 135 -9.534 -9.458 -3.527 1.00 51.12 H new ATOM 0 HA LYS A 135 -8.714 -11.191 -5.682 1.00 42.42 H new ATOM 0 HB2 LYS A 135 -9.439 -9.067 -6.351 1.00 23.30 H new ATOM 0 HB3 LYS A 135 -8.289 -8.255 -5.308 1.00 23.30 H new ATOM 0 HG2 LYS A 135 -6.402 -9.160 -6.608 1.00 71.32 H new ATOM 0 HG3 LYS A 135 -7.496 -10.109 -7.596 1.00 71.32 H new ATOM 0 HD2 LYS A 135 -7.491 -7.073 -7.457 1.00 25.54 H new ATOM 0 HD3 LYS A 135 -6.692 -8.014 -8.701 1.00 25.54 H new ATOM 0 HE2 LYS A 135 -8.892 -9.020 -9.330 1.00 1.23 H new ATOM 0 HE3 LYS A 135 -9.678 -8.035 -8.112 1.00 1.23 H new ATOM 0 HZ1 LYS A 135 -9.831 -7.032 -10.282 1.00 54.12 H new ATOM 0 HZ2 LYS A 135 -8.900 -6.054 -9.252 1.00 54.12 H new ATOM 0 HZ3 LYS A 135 -8.139 -7.009 -10.432 1.00 54.12 H new ATOM 2096 N TYR A 136 -6.418 -11.714 -5.011 1.00 52.04 N ATOM 2097 CA TYR A 136 -5.158 -12.171 -4.541 1.00 51.23 C ATOM 2098 C TYR A 136 -4.036 -11.317 -5.190 1.00 62.35 C ATOM 2099 O TYR A 136 -3.662 -11.531 -6.334 1.00 52.44 O ATOM 2100 CB TYR A 136 -5.047 -13.660 -4.951 1.00 52.22 C ATOM 2101 CG TYR A 136 -4.170 -14.566 -4.096 1.00 42.35 C ATOM 2102 CD1 TYR A 136 -4.678 -15.161 -2.930 1.00 3.54 C ATOM 2103 CD2 TYR A 136 -2.870 -14.867 -4.459 1.00 72.52 C ATOM 2104 CE1 TYR A 136 -3.912 -16.008 -2.169 1.00 13.01 C ATOM 2105 CE2 TYR A 136 -2.101 -15.728 -3.690 1.00 23.23 C ATOM 2106 CZ TYR A 136 -2.629 -16.289 -2.552 1.00 72.41 C ATOM 2107 OH TYR A 136 -1.865 -17.132 -1.796 1.00 4.45 O ATOM 0 H TYR A 136 -6.837 -12.308 -5.726 1.00 52.04 H new ATOM 0 HA TYR A 136 -5.059 -12.075 -3.460 1.00 51.23 H new ATOM 0 HB2 TYR A 136 -6.053 -14.081 -4.963 1.00 52.22 H new ATOM 0 HB3 TYR A 136 -4.673 -13.699 -5.974 1.00 52.22 H new ATOM 0 HD1 TYR A 136 -5.692 -14.948 -2.626 1.00 3.54 H new ATOM 0 HD2 TYR A 136 -2.449 -14.427 -5.351 1.00 72.52 H new ATOM 0 HE1 TYR A 136 -4.320 -16.451 -1.272 1.00 13.01 H new ATOM 0 HE2 TYR A 136 -1.088 -15.957 -3.985 1.00 23.23 H new ATOM 0 HH TYR A 136 -1.729 -17.973 -2.280 1.00 4.45 H new ATOM 2117 N CYS A 137 -3.576 -10.314 -4.458 1.00 43.30 N ATOM 2118 CA CYS A 137 -2.437 -9.466 -4.880 1.00 43.11 C ATOM 2119 C CYS A 137 -1.133 -9.889 -4.260 1.00 64.31 C ATOM 2120 O CYS A 137 -0.174 -10.174 -4.987 1.00 73.12 O ATOM 2121 CB CYS A 137 -2.670 -7.946 -4.697 1.00 72.41 C ATOM 2122 SG CYS A 137 -3.589 -7.209 -6.019 1.00 61.53 S ATOM 0 H CYS A 137 -3.971 -10.053 -3.554 1.00 43.30 H new ATOM 0 HA CYS A 137 -2.368 -9.635 -5.955 1.00 43.11 H new ATOM 0 HB2 CYS A 137 -3.199 -7.778 -3.759 1.00 72.41 H new ATOM 0 HB3 CYS A 137 -1.705 -7.446 -4.613 1.00 72.41 H new ATOM 0 HG CYS A 137 -4.690 -6.700 -5.551 1.00 61.53 H new ATOM 2127 N PRO A 138 -1.032 -9.946 -2.897 1.00 31.41 N ATOM 2128 CA PRO A 138 0.188 -10.382 -2.245 1.00 15.12 C ATOM 2129 C PRO A 138 0.389 -11.894 -2.378 1.00 24.21 C ATOM 2130 O PRO A 138 0.554 -12.584 -1.400 1.00 74.42 O ATOM 2131 CB PRO A 138 -0.013 -9.979 -0.782 1.00 2.12 C ATOM 2132 CG PRO A 138 -1.475 -9.957 -0.591 1.00 75.22 C ATOM 2133 CD PRO A 138 -2.074 -9.579 -1.906 1.00 65.43 C ATOM 0 HA PRO A 138 1.077 -9.934 -2.688 1.00 15.12 H new ATOM 0 HB2 PRO A 138 0.463 -10.691 -0.107 1.00 2.12 H new ATOM 0 HB3 PRO A 138 0.427 -9.003 -0.577 1.00 2.12 H new ATOM 0 HG2 PRO A 138 -1.838 -10.932 -0.267 1.00 75.22 H new ATOM 0 HG3 PRO A 138 -1.754 -9.240 0.182 1.00 75.22 H new ATOM 0 HD2 PRO A 138 -3.005 -10.116 -2.089 1.00 65.43 H new ATOM 0 HD3 PRO A 138 -2.306 -8.515 -1.947 1.00 65.43 H new ATOM 2141 N HIS A 139 0.398 -12.363 -3.617 1.00 0.01 N ATOM 2142 CA HIS A 139 0.572 -13.761 -3.969 1.00 64.33 C ATOM 2143 C HIS A 139 1.829 -14.332 -3.318 1.00 40.34 C ATOM 2144 O HIS A 139 1.786 -15.364 -2.680 1.00 5.13 O ATOM 2145 CB HIS A 139 0.605 -13.925 -5.520 1.00 24.13 C ATOM 2146 CG HIS A 139 1.771 -13.242 -6.222 1.00 22.30 C ATOM 2147 ND1 HIS A 139 1.898 -11.869 -6.396 1.00 52.54 N ATOM 2148 CD2 HIS A 139 2.896 -13.784 -6.744 1.00 55.14 C ATOM 2149 CE1 HIS A 139 3.080 -11.644 -6.994 1.00 64.52 C ATOM 2150 NE2 HIS A 139 3.720 -12.773 -7.227 1.00 14.12 N ATOM 0 H HIS A 139 0.280 -11.759 -4.431 1.00 0.01 H new ATOM 0 HA HIS A 139 -0.277 -14.328 -3.588 1.00 64.33 H new ATOM 0 HB2 HIS A 139 0.633 -14.989 -5.756 1.00 24.13 H new ATOM 0 HB3 HIS A 139 -0.325 -13.532 -5.930 1.00 24.13 H new ATOM 0 HD1 HIS A 139 1.218 -11.161 -6.120 1.00 52.54 H new ATOM 0 HD2 HIS A 139 3.120 -14.840 -6.780 1.00 55.14 H new ATOM 0 HE1 HIS A 139 3.457 -10.665 -7.251 1.00 64.52 H new ATOM 2158 N ARG A 140 2.916 -13.604 -3.465 1.00 33.32 N ATOM 2159 CA ARG A 140 4.187 -13.913 -2.873 1.00 30.33 C ATOM 2160 C ARG A 140 4.037 -14.119 -1.376 1.00 11.22 C ATOM 2161 O ARG A 140 4.443 -15.140 -0.823 1.00 71.23 O ATOM 2162 CB ARG A 140 5.128 -12.721 -3.147 1.00 45.13 C ATOM 2163 CG ARG A 140 6.404 -12.661 -2.302 1.00 32.02 C ATOM 2164 CD ARG A 140 7.317 -13.860 -2.427 1.00 3.52 C ATOM 2165 NE ARG A 140 8.499 -13.682 -1.564 1.00 31.13 N ATOM 2166 CZ ARG A 140 9.527 -14.525 -1.458 1.00 33.34 C ATOM 2167 NH1 ARG A 140 9.481 -15.722 -2.014 1.00 2.32 N ATOM 2168 NH2 ARG A 140 10.570 -14.184 -0.723 1.00 20.34 N ATOM 0 H ARG A 140 2.932 -12.750 -4.022 1.00 33.32 H new ATOM 0 HA ARG A 140 4.590 -14.831 -3.300 1.00 30.33 H new ATOM 0 HB2 ARG A 140 5.414 -12.744 -4.199 1.00 45.13 H new ATOM 0 HB3 ARG A 140 4.568 -11.799 -2.989 1.00 45.13 H new ATOM 0 HG2 ARG A 140 6.963 -11.768 -2.581 1.00 32.02 H new ATOM 0 HG3 ARG A 140 6.122 -12.547 -1.255 1.00 32.02 H new ATOM 0 HD2 ARG A 140 6.782 -14.767 -2.144 1.00 3.52 H new ATOM 0 HD3 ARG A 140 7.628 -13.985 -3.464 1.00 3.52 H new ATOM 0 HE ARG A 140 8.534 -12.836 -0.995 1.00 31.13 H new ATOM 0 HH11 ARG A 140 8.652 -16.012 -2.533 1.00 2.32 H new ATOM 0 HH12 ARG A 140 10.275 -16.357 -1.925 1.00 2.32 H new ATOM 0 HH21 ARG A 140 10.584 -13.284 -0.244 1.00 20.34 H new ATOM 0 HH22 ARG A 140 11.362 -14.821 -0.635 1.00 20.34 H new ATOM 2182 N MET A 141 3.450 -13.163 -0.734 1.00 31.54 N ATOM 2183 CA MET A 141 3.347 -13.210 0.674 1.00 62.34 C ATOM 2184 C MET A 141 2.284 -14.180 1.201 1.00 71.33 C ATOM 2185 O MET A 141 2.501 -14.842 2.203 1.00 44.20 O ATOM 2186 CB MET A 141 3.306 -11.819 1.285 1.00 73.45 C ATOM 2187 CG MET A 141 4.523 -10.987 0.846 1.00 73.31 C ATOM 2188 SD MET A 141 4.901 -9.577 1.885 1.00 73.04 S ATOM 2189 CE MET A 141 3.470 -8.560 1.701 1.00 74.13 C ATOM 0 H MET A 141 3.035 -12.340 -1.171 1.00 31.54 H new ATOM 0 HA MET A 141 4.272 -13.661 1.032 1.00 62.34 H new ATOM 0 HB2 MET A 141 2.388 -11.313 0.985 1.00 73.45 H new ATOM 0 HB3 MET A 141 3.287 -11.896 2.372 1.00 73.45 H new ATOM 0 HG2 MET A 141 5.396 -11.639 0.815 1.00 73.31 H new ATOM 0 HG3 MET A 141 4.353 -10.633 -0.171 1.00 73.31 H new ATOM 0 HE1 MET A 141 3.769 -7.571 1.355 1.00 74.13 H new ATOM 0 HE2 MET A 141 2.795 -9.010 0.974 1.00 74.13 H new ATOM 0 HE3 MET A 141 2.962 -8.470 2.661 1.00 74.13 H new ATOM 2199 N LEU A 142 1.171 -14.293 0.521 1.00 0.53 N ATOM 2200 CA LEU A 142 0.106 -15.183 0.956 1.00 31.50 C ATOM 2201 C LEU A 142 0.414 -16.640 0.664 1.00 30.13 C ATOM 2202 O LEU A 142 0.230 -17.497 1.522 1.00 5.20 O ATOM 2203 CB LEU A 142 -1.237 -14.788 0.339 1.00 42.41 C ATOM 2204 CG LEU A 142 -1.870 -13.493 0.844 1.00 33.35 C ATOM 2205 CD1 LEU A 142 -3.095 -13.156 0.013 1.00 71.33 C ATOM 2206 CD2 LEU A 142 -2.280 -13.656 2.300 1.00 35.32 C ATOM 0 H LEU A 142 0.972 -13.782 -0.339 1.00 0.53 H new ATOM 0 HA LEU A 142 0.037 -15.074 2.038 1.00 31.50 H new ATOM 0 HB2 LEU A 142 -1.104 -14.704 -0.740 1.00 42.41 H new ATOM 0 HB3 LEU A 142 -1.942 -15.601 0.511 1.00 42.41 H new ATOM 0 HG LEU A 142 -1.142 -12.687 0.757 1.00 33.35 H new ATOM 0 HD11 LEU A 142 -3.540 -12.231 0.380 1.00 71.33 H new ATOM 0 HD12 LEU A 142 -2.804 -13.030 -1.030 1.00 71.33 H new ATOM 0 HD13 LEU A 142 -3.822 -13.965 0.092 1.00 71.33 H new ATOM 0 HD21 LEU A 142 -2.731 -12.730 2.657 1.00 35.32 H new ATOM 0 HD22 LEU A 142 -3.002 -14.468 2.386 1.00 35.32 H new ATOM 0 HD23 LEU A 142 -1.401 -13.887 2.902 1.00 35.32 H new ATOM 2218 N ALA A 143 0.893 -16.920 -0.529 1.00 15.13 N ATOM 2219 CA ALA A 143 1.123 -18.295 -0.949 1.00 0.35 C ATOM 2220 C ALA A 143 2.306 -18.897 -0.248 1.00 31.44 C ATOM 2221 O ALA A 143 2.326 -20.086 0.050 1.00 51.23 O ATOM 2222 CB ALA A 143 1.285 -18.391 -2.457 1.00 41.32 C ATOM 0 H ALA A 143 1.132 -16.217 -1.229 1.00 15.13 H new ATOM 0 HA ALA A 143 0.241 -18.870 -0.666 1.00 0.35 H new ATOM 0 HB1 ALA A 143 1.455 -19.430 -2.739 1.00 41.32 H new ATOM 0 HB2 ALA A 143 0.381 -18.026 -2.944 1.00 41.32 H new ATOM 0 HB3 ALA A 143 2.135 -17.786 -2.771 1.00 41.32 H new ATOM 2228 N GLU A 144 3.290 -18.087 0.034 1.00 24.53 N ATOM 2229 CA GLU A 144 4.484 -18.602 0.632 1.00 3.22 C ATOM 2230 C GLU A 144 4.508 -18.420 2.140 1.00 21.42 C ATOM 2231 O GLU A 144 5.414 -18.909 2.806 1.00 12.10 O ATOM 2232 CB GLU A 144 5.711 -17.993 -0.008 1.00 60.34 C ATOM 2233 CG GLU A 144 5.743 -18.170 -1.512 1.00 21.33 C ATOM 2234 CD GLU A 144 7.095 -17.889 -2.077 1.00 25.03 C ATOM 2235 OE1 GLU A 144 8.026 -18.677 -1.799 1.00 74.13 O ATOM 2236 OE2 GLU A 144 7.255 -16.907 -2.819 1.00 51.22 O ATOM 0 H GLU A 144 3.287 -17.082 -0.139 1.00 24.53 H new ATOM 0 HA GLU A 144 4.492 -19.676 0.447 1.00 3.22 H new ATOM 0 HB2 GLU A 144 5.747 -16.929 0.228 1.00 60.34 H new ATOM 0 HB3 GLU A 144 6.603 -18.446 0.425 1.00 60.34 H new ATOM 0 HG2 GLU A 144 5.449 -19.189 -1.764 1.00 21.33 H new ATOM 0 HG3 GLU A 144 5.012 -17.505 -1.971 1.00 21.33 H new ATOM 2243 N GLY A 145 3.517 -17.738 2.680 1.00 72.25 N ATOM 2244 CA GLY A 145 3.484 -17.510 4.112 1.00 2.21 C ATOM 2245 C GLY A 145 4.442 -16.408 4.531 1.00 5.12 C ATOM 2246 O GLY A 145 4.927 -16.378 5.645 1.00 23.04 O ATOM 0 H GLY A 145 2.736 -17.338 2.160 1.00 72.25 H new ATOM 0 HA2 GLY A 145 2.471 -17.245 4.414 1.00 2.21 H new ATOM 0 HA3 GLY A 145 3.741 -18.432 4.633 1.00 2.21 H new ATOM 2250 N ARG A 146 4.721 -15.518 3.616 1.00 12.12 N ATOM 2251 CA ARG A 146 5.593 -14.390 3.854 1.00 73.11 C ATOM 2252 C ARG A 146 4.822 -13.157 4.317 1.00 61.43 C ATOM 2253 O ARG A 146 5.422 -12.127 4.588 1.00 53.02 O ATOM 2254 CB ARG A 146 6.433 -14.067 2.608 1.00 3.34 C ATOM 2255 CG ARG A 146 7.816 -14.748 2.478 1.00 4.44 C ATOM 2256 CD ARG A 146 7.814 -16.279 2.559 1.00 35.34 C ATOM 2257 NE ARG A 146 7.598 -16.791 3.925 1.00 11.11 N ATOM 2258 CZ ARG A 146 7.986 -18.003 4.352 1.00 64.35 C ATOM 2259 NH1 ARG A 146 8.600 -18.849 3.522 1.00 12.51 N ATOM 2260 NH2 ARG A 146 7.759 -18.362 5.605 1.00 33.15 N ATOM 0 H ARG A 146 4.345 -15.554 2.669 1.00 12.12 H new ATOM 0 HA ARG A 146 6.268 -14.675 4.661 1.00 73.11 H new ATOM 0 HB2 ARG A 146 5.845 -14.331 1.729 1.00 3.34 H new ATOM 0 HB3 ARG A 146 6.586 -12.988 2.577 1.00 3.34 H new ATOM 0 HG2 ARG A 146 8.257 -14.454 1.526 1.00 4.44 H new ATOM 0 HG3 ARG A 146 8.466 -14.362 3.263 1.00 4.44 H new ATOM 0 HD2 ARG A 146 7.035 -16.669 1.905 1.00 35.34 H new ATOM 0 HD3 ARG A 146 8.765 -16.657 2.183 1.00 35.34 H new ATOM 0 HE ARG A 146 7.121 -16.183 4.591 1.00 11.11 H new ATOM 0 HH11 ARG A 146 8.778 -18.576 2.555 1.00 12.51 H new ATOM 0 HH12 ARG A 146 8.892 -19.768 3.854 1.00 12.51 H new ATOM 0 HH21 ARG A 146 7.291 -17.719 6.243 1.00 33.15 H new ATOM 0 HH22 ARG A 146 8.052 -19.282 5.933 1.00 33.15 H new ATOM 2274 N TRP A 147 3.496 -13.264 4.423 1.00 11.32 N ATOM 2275 CA TRP A 147 2.697 -12.135 4.893 1.00 34.14 C ATOM 2276 C TRP A 147 3.001 -11.861 6.347 1.00 30.20 C ATOM 2277 O TRP A 147 3.268 -10.717 6.732 1.00 52.24 O ATOM 2278 CB TRP A 147 1.185 -12.357 4.686 1.00 51.24 C ATOM 2279 CG TRP A 147 0.360 -11.232 5.245 1.00 54.10 C ATOM 2280 CD1 TRP A 147 -0.247 -11.201 6.458 1.00 60.10 C ATOM 2281 CD2 TRP A 147 0.078 -9.972 4.626 1.00 51.22 C ATOM 2282 NE1 TRP A 147 -0.871 -10.004 6.649 1.00 75.04 N ATOM 2283 CE2 TRP A 147 -0.702 -9.232 5.534 1.00 23.34 C ATOM 2284 CE3 TRP A 147 0.405 -9.396 3.401 1.00 33.52 C ATOM 2285 CZ2 TRP A 147 -1.153 -7.946 5.253 1.00 73.11 C ATOM 2286 CZ3 TRP A 147 -0.045 -8.132 3.123 1.00 1.41 C ATOM 2287 CH2 TRP A 147 -0.818 -7.413 4.044 1.00 32.25 C ATOM 0 H TRP A 147 2.963 -14.103 4.195 1.00 11.32 H new ATOM 0 HA TRP A 147 2.971 -11.266 4.295 1.00 34.14 H new ATOM 0 HB2 TRP A 147 0.978 -12.461 3.621 1.00 51.24 H new ATOM 0 HB3 TRP A 147 0.889 -13.292 5.161 1.00 51.24 H new ATOM 0 HD1 TRP A 147 -0.237 -12.011 7.172 1.00 60.10 H new ATOM 0 HE1 TRP A 147 -1.381 -9.729 7.488 1.00 75.04 H new ATOM 0 HE3 TRP A 147 1.003 -9.936 2.682 1.00 33.52 H new ATOM 0 HZ2 TRP A 147 -1.746 -7.391 5.965 1.00 73.11 H new ATOM 0 HZ3 TRP A 147 0.202 -7.680 2.173 1.00 1.41 H new ATOM 0 HH2 TRP A 147 -1.155 -6.418 3.791 1.00 32.25 H new ATOM 2298 N GLY A 148 2.983 -12.918 7.148 1.00 34.01 N ATOM 2299 CA GLY A 148 3.303 -12.791 8.549 1.00 52.13 C ATOM 2300 C GLY A 148 4.721 -12.321 8.733 1.00 62.03 C ATOM 2301 O GLY A 148 5.025 -11.609 9.681 1.00 71.04 O ATOM 0 H GLY A 148 2.751 -13.864 6.847 1.00 34.01 H new ATOM 0 HA2 GLY A 148 2.618 -12.087 9.021 1.00 52.13 H new ATOM 0 HA3 GLY A 148 3.166 -13.751 9.046 1.00 52.13 H new ATOM 2305 N ALA A 149 5.586 -12.716 7.811 1.00 52.24 N ATOM 2306 CA ALA A 149 6.962 -12.286 7.827 1.00 14.20 C ATOM 2307 C ALA A 149 7.040 -10.784 7.577 1.00 43.32 C ATOM 2308 O ALA A 149 7.698 -10.075 8.317 1.00 64.02 O ATOM 2309 CB ALA A 149 7.783 -13.048 6.796 1.00 74.41 C ATOM 0 H ALA A 149 5.349 -13.339 7.039 1.00 52.24 H new ATOM 0 HA ALA A 149 7.382 -12.501 8.810 1.00 14.20 H new ATOM 0 HB1 ALA A 149 8.817 -12.705 6.828 1.00 74.41 H new ATOM 0 HB2 ALA A 149 7.747 -14.114 7.019 1.00 74.41 H new ATOM 0 HB3 ALA A 149 7.373 -12.871 5.802 1.00 74.41 H new ATOM 2315 N PHE A 150 6.334 -10.311 6.544 1.00 33.42 N ATOM 2316 CA PHE A 150 6.297 -8.888 6.209 1.00 5.21 C ATOM 2317 C PHE A 150 5.771 -8.083 7.370 1.00 21.44 C ATOM 2318 O PHE A 150 6.375 -7.095 7.765 1.00 15.11 O ATOM 2319 CB PHE A 150 5.449 -8.637 4.973 1.00 10.22 C ATOM 2320 CG PHE A 150 5.378 -7.183 4.562 1.00 2.53 C ATOM 2321 CD1 PHE A 150 6.536 -6.461 4.313 1.00 4.24 C ATOM 2322 CD2 PHE A 150 4.154 -6.547 4.409 1.00 54.14 C ATOM 2323 CE1 PHE A 150 6.468 -5.142 3.924 1.00 73.15 C ATOM 2324 CE2 PHE A 150 4.093 -5.221 4.019 1.00 62.30 C ATOM 2325 CZ PHE A 150 5.249 -4.522 3.775 1.00 61.51 C ATOM 0 H PHE A 150 5.778 -10.899 5.924 1.00 33.42 H new ATOM 0 HA PHE A 150 7.317 -8.571 5.994 1.00 5.21 H new ATOM 0 HB2 PHE A 150 5.852 -9.219 4.144 1.00 10.22 H new ATOM 0 HB3 PHE A 150 4.439 -9.002 5.158 1.00 10.22 H new ATOM 0 HD1 PHE A 150 7.499 -6.937 4.425 1.00 4.24 H new ATOM 0 HD2 PHE A 150 3.241 -7.092 4.596 1.00 54.14 H new ATOM 0 HE1 PHE A 150 7.377 -4.591 3.735 1.00 73.15 H new ATOM 0 HE2 PHE A 150 3.135 -4.735 3.906 1.00 62.30 H new ATOM 0 HZ PHE A 150 5.202 -3.488 3.467 1.00 61.51 H new ATOM 2335 N ILE A 151 4.657 -8.525 7.915 1.00 24.45 N ATOM 2336 CA ILE A 151 4.056 -7.918 9.073 1.00 11.22 C ATOM 2337 C ILE A 151 5.023 -7.868 10.258 1.00 1.04 C ATOM 2338 O ILE A 151 5.103 -6.856 10.960 1.00 41.22 O ATOM 2339 CB ILE A 151 2.697 -8.618 9.389 1.00 21.23 C ATOM 2340 CG1 ILE A 151 1.539 -7.864 8.734 1.00 12.34 C ATOM 2341 CG2 ILE A 151 2.454 -8.848 10.859 1.00 4.14 C ATOM 2342 CD1 ILE A 151 1.700 -7.631 7.249 1.00 64.32 C ATOM 0 H ILE A 151 4.140 -9.328 7.557 1.00 24.45 H new ATOM 0 HA ILE A 151 3.833 -6.873 8.858 1.00 11.22 H new ATOM 0 HB ILE A 151 2.757 -9.615 8.954 1.00 21.23 H new ATOM 0 HG12 ILE A 151 0.618 -8.421 8.903 1.00 12.34 H new ATOM 0 HG13 ILE A 151 1.424 -6.900 9.229 1.00 12.34 H new ATOM 0 HG21 ILE A 151 1.490 -9.338 10.996 1.00 4.14 H new ATOM 0 HG22 ILE A 151 3.244 -9.481 11.264 1.00 4.14 H new ATOM 0 HG23 ILE A 151 2.452 -7.891 11.382 1.00 4.14 H new ATOM 0 HD11 ILE A 151 0.833 -7.090 6.869 1.00 64.32 H new ATOM 0 HD12 ILE A 151 2.601 -7.045 7.068 1.00 64.32 H new ATOM 0 HD13 ILE A 151 1.782 -8.590 6.737 1.00 64.32 H new ATOM 2354 N GLN A 152 5.781 -8.924 10.439 1.00 43.34 N ATOM 2355 CA GLN A 152 6.786 -8.955 11.476 1.00 23.11 C ATOM 2356 C GLN A 152 7.869 -7.904 11.186 1.00 31.54 C ATOM 2357 O GLN A 152 8.273 -7.166 12.069 1.00 50.12 O ATOM 2358 CB GLN A 152 7.402 -10.353 11.577 1.00 40.21 C ATOM 2359 CG GLN A 152 8.422 -10.519 12.691 1.00 74.21 C ATOM 2360 CD GLN A 152 7.834 -10.268 14.068 1.00 22.11 C ATOM 2361 OE1 GLN A 152 7.849 -9.148 14.575 1.00 10.55 O ATOM 2362 NE2 GLN A 152 7.300 -11.296 14.670 1.00 60.40 N ATOM 0 H GLN A 152 5.721 -9.775 9.880 1.00 43.34 H new ATOM 0 HA GLN A 152 6.318 -8.719 12.432 1.00 23.11 H new ATOM 0 HB2 GLN A 152 6.602 -11.078 11.725 1.00 40.21 H new ATOM 0 HB3 GLN A 152 7.879 -10.594 10.627 1.00 40.21 H new ATOM 0 HG2 GLN A 152 8.832 -11.528 12.654 1.00 74.21 H new ATOM 0 HG3 GLN A 152 9.251 -9.831 12.524 1.00 74.21 H new ATOM 0 HE21 GLN A 152 7.306 -12.211 14.219 1.00 60.40 H new ATOM 0 HE22 GLN A 152 6.877 -11.184 15.591 1.00 60.40 H new ATOM 2371 N LYS A 153 8.305 -7.828 9.932 1.00 63.24 N ATOM 2372 CA LYS A 153 9.330 -6.879 9.516 1.00 62.23 C ATOM 2373 C LYS A 153 8.851 -5.426 9.674 1.00 43.04 C ATOM 2374 O LYS A 153 9.626 -4.558 10.097 1.00 5.42 O ATOM 2375 CB LYS A 153 9.726 -7.180 8.084 1.00 21.54 C ATOM 2376 CG LYS A 153 10.266 -8.590 7.912 1.00 31.13 C ATOM 2377 CD LYS A 153 10.341 -8.996 6.456 1.00 61.11 C ATOM 2378 CE LYS A 153 11.338 -8.176 5.672 1.00 62.43 C ATOM 2379 NZ LYS A 153 11.491 -8.663 4.288 1.00 35.04 N ATOM 0 H LYS A 153 7.958 -8.421 9.178 1.00 63.24 H new ATOM 0 HA LYS A 153 10.202 -6.989 10.160 1.00 62.23 H new ATOM 0 HB2 LYS A 153 8.861 -7.045 7.435 1.00 21.54 H new ATOM 0 HB3 LYS A 153 10.481 -6.464 7.761 1.00 21.54 H new ATOM 0 HG2 LYS A 153 11.259 -8.655 8.358 1.00 31.13 H new ATOM 0 HG3 LYS A 153 9.628 -9.291 8.451 1.00 31.13 H new ATOM 0 HD2 LYS A 153 10.612 -10.050 6.391 1.00 61.11 H new ATOM 0 HD3 LYS A 153 9.355 -8.892 6.003 1.00 61.11 H new ATOM 0 HE2 LYS A 153 11.017 -7.134 5.656 1.00 62.43 H new ATOM 0 HE3 LYS A 153 12.305 -8.204 6.175 1.00 62.43 H new ATOM 0 HZ1 LYS A 153 11.929 -7.921 3.705 1.00 35.04 H new ATOM 0 HZ2 LYS A 153 12.095 -9.510 4.283 1.00 35.04 H new ATOM 0 HZ3 LYS A 153 10.557 -8.902 3.899 1.00 35.04 H new ATOM 2393 N VAL A 154 7.586 -5.169 9.331 1.00 43.55 N ATOM 2394 CA VAL A 154 6.960 -3.854 9.492 1.00 15.42 C ATOM 2395 C VAL A 154 6.870 -3.461 10.973 1.00 12.52 C ATOM 2396 O VAL A 154 7.084 -2.299 11.330 1.00 13.15 O ATOM 2397 CB VAL A 154 5.530 -3.849 8.895 1.00 33.23 C ATOM 2398 CG1 VAL A 154 4.836 -2.546 9.178 1.00 4.43 C ATOM 2399 CG2 VAL A 154 5.564 -4.084 7.411 1.00 23.01 C ATOM 0 H VAL A 154 6.964 -5.872 8.931 1.00 43.55 H new ATOM 0 HA VAL A 154 7.585 -3.135 8.962 1.00 15.42 H new ATOM 0 HB VAL A 154 4.976 -4.659 9.369 1.00 33.23 H new ATOM 0 HG11 VAL A 154 3.834 -2.567 8.749 1.00 4.43 H new ATOM 0 HG12 VAL A 154 4.766 -2.397 10.256 1.00 4.43 H new ATOM 0 HG13 VAL A 154 5.404 -1.728 8.735 1.00 4.43 H new ATOM 0 HG21 VAL A 154 4.547 -4.076 7.018 1.00 23.01 H new ATOM 0 HG22 VAL A 154 6.145 -3.297 6.931 1.00 23.01 H new ATOM 0 HG23 VAL A 154 6.024 -5.051 7.206 1.00 23.01 H new ATOM 2409 N LYS A 155 6.579 -4.454 11.816 1.00 34.21 N ATOM 2410 CA LYS A 155 6.394 -4.302 13.230 1.00 42.24 C ATOM 2411 C LYS A 155 7.549 -3.535 13.889 1.00 34.00 C ATOM 2412 O LYS A 155 7.324 -2.711 14.793 1.00 12.13 O ATOM 2413 CB LYS A 155 6.272 -5.706 13.801 1.00 5.45 C ATOM 2414 CG LYS A 155 5.987 -5.808 15.255 1.00 12.12 C ATOM 2415 CD LYS A 155 4.734 -5.073 15.601 1.00 51.32 C ATOM 2416 CE LYS A 155 4.283 -5.437 16.968 1.00 33.51 C ATOM 2417 NZ LYS A 155 5.321 -5.199 18.002 1.00 2.10 N ATOM 0 H LYS A 155 6.465 -5.418 11.503 1.00 34.21 H new ATOM 0 HA LYS A 155 5.501 -3.711 13.432 1.00 42.24 H new ATOM 0 HB2 LYS A 155 5.481 -6.226 13.261 1.00 5.45 H new ATOM 0 HB3 LYS A 155 7.201 -6.239 13.597 1.00 5.45 H new ATOM 0 HG2 LYS A 155 5.890 -6.856 15.539 1.00 12.12 H new ATOM 0 HG3 LYS A 155 6.823 -5.400 15.824 1.00 12.12 H new ATOM 0 HD2 LYS A 155 4.907 -3.998 15.542 1.00 51.32 H new ATOM 0 HD3 LYS A 155 3.954 -5.311 14.878 1.00 51.32 H new ATOM 0 HE2 LYS A 155 3.392 -4.861 17.216 1.00 33.51 H new ATOM 0 HE3 LYS A 155 3.997 -6.489 16.983 1.00 33.51 H new ATOM 0 HZ1 LYS A 155 4.897 -5.291 18.947 1.00 2.10 H new ATOM 0 HZ2 LYS A 155 6.084 -5.898 17.895 1.00 2.10 H new ATOM 0 HZ3 LYS A 155 5.710 -4.241 17.889 1.00 2.10 H new ATOM 2431 N ASN A 156 8.765 -3.796 13.458 1.00 45.32 N ATOM 2432 CA ASN A 156 9.905 -3.069 13.986 1.00 33.01 C ATOM 2433 C ASN A 156 10.426 -2.085 12.993 1.00 44.11 C ATOM 2434 O ASN A 156 10.705 -0.939 13.333 1.00 53.21 O ATOM 2435 CB ASN A 156 11.028 -4.001 14.367 1.00 74.41 C ATOM 2436 CG ASN A 156 10.716 -4.943 15.519 1.00 3.53 C ATOM 2437 OD1 ASN A 156 9.573 -5.329 15.765 1.00 14.50 O ATOM 2438 ND2 ASN A 156 11.734 -5.345 16.197 1.00 23.25 N ATOM 0 H ASN A 156 8.991 -4.497 12.752 1.00 45.32 H new ATOM 0 HA ASN A 156 9.552 -2.544 14.874 1.00 33.01 H new ATOM 0 HB2 ASN A 156 11.299 -4.595 13.494 1.00 74.41 H new ATOM 0 HB3 ASN A 156 11.902 -3.405 14.631 1.00 74.41 H new ATOM 0 HD21 ASN A 156 11.607 -6.004 16.965 1.00 23.25 H new ATOM 0 HD22 ASN A 156 12.667 -5.005 15.966 1.00 23.25 H new ATOM 2445 N GLY A 157 10.568 -2.522 11.775 1.00 53.14 N ATOM 2446 CA GLY A 157 11.088 -1.660 10.764 1.00 35.34 C ATOM 2447 C GLY A 157 12.370 -2.187 10.241 1.00 24.24 C ATOM 2448 O GLY A 157 13.441 -1.674 10.572 1.00 10.13 O ATOM 0 H GLY A 157 10.332 -3.464 11.463 1.00 53.14 H new ATOM 0 HA2 GLY A 157 10.368 -1.567 9.951 1.00 35.34 H new ATOM 0 HA3 GLY A 157 11.238 -0.661 11.172 1.00 35.34 H new