USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1121 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 156 GLN : amide:sc= -0.255 K(o=-2.7,f=-2) USER MOD Set 1.2: A 160 GLN : amide:sc= -2.46 K(o=-2.7,f=-2) USER MOD Set 2.1: A 47 GLN : amide:sc= -2.97 K(o=-4.1,f=-5.2) USER MOD Set 2.2: A 154 SER OG : rot -120:sc= -1.17 USER MOD Set 3.1: A 134 GLN : amide:sc= -1.51! C(o=-0.27!,f=-1.9!) USER MOD Set 3.2: A 135 SER OG : rot 32:sc= 1.23 USER MOD Set 4.1: A 87 SER OG : rot 78:sc= 0.0286 USER MOD Set 4.2: A 110 ASN : amide:sc= -2.35 K(o=-2.3,f=-1.5) USER MOD Set 5.1: A 45 THR OG1 : rot 66:sc= -0.236 USER MOD Set 5.2: A 100 GLN : amide:sc= -1.68 K(o=-1.9,f=-0.36) USER MOD Set 6.1: A 29 HIS : no HD1:sc= -3.96! K(o=-4!,f=-3.2) USER MOD Set 6.2: A 102 ASN : amide:sc= -0.0185 K(o=-4,f=-5.6!) USER MOD Set 6.3: A 105 GLN : amide:sc= -0.0714 K(o=-4,f=-4.6) USER MOD Single : A 9 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.018) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 19 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-3.2!) USER MOD Single : A 20 THR OG1 : rot 110:sc= -0.832 USER MOD Single : A 23 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.2!) USER MOD Single : A 26 HIS : no HD1:sc= -0.871 K(o=-0.87,f=-0.0043) USER MOD Single : A 31 THR OG1 : rot 110:sc= -0.189 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc=-0.00241 X(o=-0.0024,f=0.16) USER MOD Single : A 49 ASN : amide:sc= -5.56! C(o=-5.6!,f=-8.8!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -179:sc= 0.00845 USER MOD Single : A 60 THR OG1 : rot 81:sc= 1.12 USER MOD Single : A 61 SER OG : rot -76:sc= 1.31 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= -0.74 K(o=-0.74,f=-0.0045) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 HIS : no HD1:sc= -2.28 K(o=-2.3,f=-1.8) USER MOD Single : A 70 GLN : amide:sc= -3.25 K(o=-3.3,f=-2.3) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.136 X(o=-0.14,f=0) USER MOD Single : A 78 ASN : amide:sc= -0.58 K(o=-0.58,f=0) USER MOD Single : A 83 ASN : amide:sc= -3.43 X(o=-3.4,f=-3.5) USER MOD Single : A 85 ASN : amide:sc= -0.668 K(o=-0.67,f=-0.03) USER MOD Single : A 86 ASN : amide:sc= -0.154 X(o=-0.15,f=-0.00043) USER MOD Single : A 89 HIS : no HD1:sc= -0.0224 X(o=-0.022,f=-0.14) USER MOD Single : A 93 THR OG1 : rot 170:sc= -0.0469 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0.0872 K(o=0.087,f=-16!) USER MOD Single : A 98 GLN : amide:sc=-0.00104 X(o=-0.001,f=-0.001) USER MOD Single : A 103 SER OG : rot 164:sc= -1.12 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 THR OG1 : rot 110:sc= 1.21 USER MOD Single : A 113 HIS : no HD1:sc= -0.303 X(o=-0.3,f=0.046) USER MOD Single : A 114 GLN : amide:sc= -1.74 K(o=-1.7,f=-1.1) USER MOD Single : A 116 GLN : amide:sc= -1.34 K(o=-1.3,f=-0.33) USER MOD Single : A 120 THR OG1 : rot 79:sc= 0.75 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0708 X(o=-0.071,f=0) USER MOD Single : A 125 SER OG : rot 160:sc= -0.133 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 138 GLN : amide:sc= -1.97 X(o=-2,f=-1.8) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.0615 USER MOD Single : A 145 LYS NZ :NH3+ -115:sc= -3.68! (180deg=-5.1!) USER MOD Single : A 150 ASN : amide:sc=-0.00324 X(o=-0.0032,f=-0.21) USER MOD Single : A 152 GLN : amide:sc= -0.111 X(o=-0.11,f=0) USER MOD Single : A 153 ASN : amide:sc= -0.94 K(o=-0.94,f=-3.4!) USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 111 N ASN A 9 -4.828 16.519 -5.770 1.00 0.82 N ATOM 112 CA ASN A 9 -5.918 16.078 -6.689 1.00 0.86 C ATOM 113 C ASN A 9 -5.450 14.862 -7.491 1.00 0.71 C ATOM 114 O ASN A 9 -6.173 13.897 -7.646 1.00 0.72 O ATOM 115 CB ASN A 9 -6.268 17.218 -7.648 1.00 0.97 C ATOM 116 CG ASN A 9 -7.245 18.177 -6.966 1.00 1.40 C ATOM 117 OD1 ASN A 9 -6.990 19.362 -6.879 1.00 2.12 O ATOM 118 ND2 ASN A 9 -8.361 17.713 -6.476 1.00 1.57 N ATOM 0 HA ASN A 9 -6.799 15.810 -6.105 1.00 0.86 H new ATOM 0 HB2 ASN A 9 -5.364 17.751 -7.941 1.00 0.97 H new ATOM 0 HB3 ASN A 9 -6.712 16.817 -8.559 1.00 0.97 H new ATOM 0 HD21 ASN A 9 -9.019 18.345 -6.020 1.00 1.57 H new ATOM 0 HD22 ASN A 9 -8.575 16.718 -6.549 1.00 1.57 H new ATOM 125 N ILE A 10 -4.245 14.905 -7.999 1.00 0.60 N ATOM 126 CA ILE A 10 -3.720 13.755 -8.794 1.00 0.52 C ATOM 127 C ILE A 10 -3.353 12.633 -7.816 1.00 0.47 C ATOM 128 O ILE A 10 -3.725 11.490 -8.008 1.00 0.51 O ATOM 129 CB ILE A 10 -2.493 14.206 -9.620 1.00 0.52 C ATOM 130 CG1 ILE A 10 -2.957 15.099 -10.780 1.00 0.53 C ATOM 131 CG2 ILE A 10 -1.758 12.995 -10.213 1.00 0.58 C ATOM 132 CD1 ILE A 10 -3.544 16.404 -10.240 1.00 1.49 C ATOM 0 H ILE A 10 -3.601 15.689 -7.897 1.00 0.60 H new ATOM 0 HA ILE A 10 -4.471 13.391 -9.495 1.00 0.52 H new ATOM 0 HB ILE A 10 -1.820 14.750 -8.957 1.00 0.52 H new ATOM 0 HG12 ILE A 10 -2.117 15.315 -11.440 1.00 0.53 H new ATOM 0 HG13 ILE A 10 -3.704 14.575 -11.376 1.00 0.53 H new ATOM 0 HG21 ILE A 10 -0.899 13.337 -10.790 1.00 0.58 H new ATOM 0 HG22 ILE A 10 -1.418 12.345 -9.407 1.00 0.58 H new ATOM 0 HG23 ILE A 10 -2.435 12.442 -10.864 1.00 0.58 H new ATOM 0 HD11 ILE A 10 -3.869 17.028 -11.072 1.00 1.49 H new ATOM 0 HD12 ILE A 10 -4.397 16.181 -9.598 1.00 1.49 H new ATOM 0 HD13 ILE A 10 -2.785 16.934 -9.664 1.00 1.49 H new ATOM 144 N ALA A 11 -2.644 12.954 -6.758 1.00 0.46 N ATOM 145 CA ALA A 11 -2.275 11.910 -5.756 1.00 0.54 C ATOM 146 C ALA A 11 -3.562 11.325 -5.169 1.00 0.59 C ATOM 147 O ALA A 11 -3.671 10.136 -4.938 1.00 0.67 O ATOM 148 CB ALA A 11 -1.440 12.541 -4.639 1.00 0.61 C ATOM 0 H ALA A 11 -2.307 13.894 -6.548 1.00 0.46 H new ATOM 0 HA ALA A 11 -1.690 11.124 -6.233 1.00 0.54 H new ATOM 0 HB1 ALA A 11 -1.172 11.777 -3.909 1.00 0.61 H new ATOM 0 HB2 ALA A 11 -0.533 12.973 -5.062 1.00 0.61 H new ATOM 0 HB3 ALA A 11 -2.020 13.323 -4.149 1.00 0.61 H new ATOM 154 N GLU A 12 -4.542 12.164 -4.949 1.00 0.66 N ATOM 155 CA GLU A 12 -5.839 11.682 -4.402 1.00 0.77 C ATOM 156 C GLU A 12 -6.619 10.985 -5.517 1.00 0.71 C ATOM 157 O GLU A 12 -7.285 9.991 -5.295 1.00 0.71 O ATOM 158 CB GLU A 12 -6.648 12.871 -3.878 1.00 0.98 C ATOM 159 CG GLU A 12 -7.868 12.361 -3.108 1.00 1.35 C ATOM 160 CD GLU A 12 -9.029 13.340 -3.284 1.00 1.44 C ATOM 161 OE1 GLU A 12 -8.806 14.529 -3.127 1.00 1.89 O ATOM 162 OE2 GLU A 12 -10.124 12.884 -3.574 1.00 1.65 O ATOM 0 H GLU A 12 -4.496 13.167 -5.127 1.00 0.66 H new ATOM 0 HA GLU A 12 -5.658 10.984 -3.585 1.00 0.77 H new ATOM 0 HB2 GLU A 12 -6.027 13.488 -3.229 1.00 0.98 H new ATOM 0 HB3 GLU A 12 -6.967 13.501 -4.708 1.00 0.98 H new ATOM 0 HG2 GLU A 12 -8.153 11.373 -3.471 1.00 1.35 H new ATOM 0 HG3 GLU A 12 -7.625 12.255 -2.051 1.00 1.35 H new ATOM 169 N ALA A 13 -6.541 11.503 -6.721 1.00 0.73 N ATOM 170 CA ALA A 13 -7.273 10.876 -7.861 1.00 0.81 C ATOM 171 C ALA A 13 -6.652 9.514 -8.179 1.00 0.76 C ATOM 172 O ALA A 13 -7.338 8.512 -8.252 1.00 0.87 O ATOM 173 CB ALA A 13 -7.174 11.781 -9.090 1.00 0.96 C ATOM 0 H ALA A 13 -6.000 12.334 -6.960 1.00 0.73 H new ATOM 0 HA ALA A 13 -8.321 10.743 -7.591 1.00 0.81 H new ATOM 0 HB1 ALA A 13 -7.708 11.324 -9.923 1.00 0.96 H new ATOM 0 HB2 ALA A 13 -7.616 12.751 -8.864 1.00 0.96 H new ATOM 0 HB3 ALA A 13 -6.126 11.914 -9.360 1.00 0.96 H new ATOM 179 N VAL A 14 -5.357 9.473 -8.364 1.00 0.72 N ATOM 180 CA VAL A 14 -4.676 8.180 -8.676 1.00 0.79 C ATOM 181 C VAL A 14 -4.871 7.208 -7.505 1.00 0.73 C ATOM 182 O VAL A 14 -4.929 6.007 -7.685 1.00 0.84 O ATOM 183 CB VAL A 14 -3.180 8.436 -8.916 1.00 0.86 C ATOM 184 CG1 VAL A 14 -2.541 9.037 -7.660 1.00 1.51 C ATOM 185 CG2 VAL A 14 -2.480 7.118 -9.266 1.00 1.98 C ATOM 0 H VAL A 14 -4.739 10.283 -8.312 1.00 0.72 H new ATOM 0 HA VAL A 14 -5.107 7.741 -9.576 1.00 0.79 H new ATOM 0 HB VAL A 14 -3.070 9.137 -9.743 1.00 0.86 H new ATOM 0 HG11 VAL A 14 -1.481 9.215 -7.841 1.00 1.51 H new ATOM 0 HG12 VAL A 14 -3.031 9.980 -7.418 1.00 1.51 H new ATOM 0 HG13 VAL A 14 -2.656 8.344 -6.826 1.00 1.51 H new ATOM 0 HG21 VAL A 14 -1.419 7.303 -9.436 1.00 1.98 H new ATOM 0 HG22 VAL A 14 -2.598 6.413 -8.443 1.00 1.98 H new ATOM 0 HG23 VAL A 14 -2.924 6.699 -10.169 1.00 1.98 H new ATOM 195 N GLN A 15 -4.970 7.726 -6.304 1.00 0.63 N ATOM 196 CA GLN A 15 -5.159 6.852 -5.101 1.00 0.64 C ATOM 197 C GLN A 15 -6.328 5.884 -5.323 1.00 0.56 C ATOM 198 O GLN A 15 -6.331 4.778 -4.814 1.00 0.57 O ATOM 199 CB GLN A 15 -5.450 7.727 -3.881 1.00 0.72 C ATOM 200 CG GLN A 15 -5.459 6.859 -2.621 1.00 0.95 C ATOM 201 CD GLN A 15 -5.708 7.741 -1.396 1.00 1.46 C ATOM 202 OE1 GLN A 15 -4.901 7.781 -0.488 1.00 1.81 O ATOM 203 NE2 GLN A 15 -6.798 8.454 -1.330 1.00 2.32 N ATOM 0 H GLN A 15 -4.928 8.725 -6.103 1.00 0.63 H new ATOM 0 HA GLN A 15 -4.249 6.275 -4.936 1.00 0.64 H new ATOM 0 HB2 GLN A 15 -4.695 8.508 -3.792 1.00 0.72 H new ATOM 0 HB3 GLN A 15 -6.412 8.226 -3.999 1.00 0.72 H new ATOM 0 HG2 GLN A 15 -6.234 6.097 -2.697 1.00 0.95 H new ATOM 0 HG3 GLN A 15 -4.508 6.337 -2.519 1.00 0.95 H new ATOM 0 HE21 GLN A 15 -7.476 8.421 -2.092 1.00 2.32 H new ATOM 0 HE22 GLN A 15 -6.973 9.045 -0.517 1.00 2.32 H new ATOM 212 N GLN A 16 -7.317 6.292 -6.079 1.00 0.51 N ATOM 213 CA GLN A 16 -8.486 5.400 -6.338 1.00 0.45 C ATOM 214 C GLN A 16 -8.010 4.146 -7.077 1.00 0.40 C ATOM 215 O GLN A 16 -8.530 3.064 -6.882 1.00 0.43 O ATOM 216 CB GLN A 16 -9.513 6.140 -7.198 1.00 0.50 C ATOM 217 CG GLN A 16 -10.422 6.981 -6.298 1.00 0.95 C ATOM 218 CD GLN A 16 -11.749 7.240 -7.012 1.00 1.32 C ATOM 219 OE1 GLN A 16 -12.730 6.568 -6.761 1.00 2.24 O ATOM 220 NE2 GLN A 16 -11.823 8.195 -7.900 1.00 1.47 N ATOM 0 H GLN A 16 -7.364 7.207 -6.528 1.00 0.51 H new ATOM 0 HA GLN A 16 -8.945 5.115 -5.391 1.00 0.45 H new ATOM 0 HB2 GLN A 16 -9.005 6.780 -7.920 1.00 0.50 H new ATOM 0 HB3 GLN A 16 -10.108 5.426 -7.768 1.00 0.50 H new ATOM 0 HG2 GLN A 16 -10.599 6.462 -5.356 1.00 0.95 H new ATOM 0 HG3 GLN A 16 -9.937 7.926 -6.055 1.00 0.95 H new ATOM 0 HE21 GLN A 16 -11.000 8.760 -8.111 1.00 1.47 H new ATOM 0 HE22 GLN A 16 -12.704 8.376 -8.382 1.00 1.47 H new ATOM 229 N LEU A 17 -7.020 4.292 -7.919 1.00 0.38 N ATOM 230 CA LEU A 17 -6.492 3.122 -8.676 1.00 0.37 C ATOM 231 C LEU A 17 -5.648 2.253 -7.742 1.00 0.40 C ATOM 232 O LEU A 17 -5.585 1.047 -7.890 1.00 0.45 O ATOM 233 CB LEU A 17 -5.622 3.617 -9.832 1.00 0.39 C ATOM 234 CG LEU A 17 -5.556 2.542 -10.917 1.00 0.89 C ATOM 235 CD1 LEU A 17 -5.450 3.211 -12.287 1.00 1.94 C ATOM 236 CD2 LEU A 17 -4.330 1.658 -10.686 1.00 1.45 C ATOM 0 H LEU A 17 -6.553 5.177 -8.115 1.00 0.38 H new ATOM 0 HA LEU A 17 -7.323 2.536 -9.069 1.00 0.37 H new ATOM 0 HB2 LEU A 17 -6.034 4.539 -10.243 1.00 0.39 H new ATOM 0 HB3 LEU A 17 -4.619 3.849 -9.473 1.00 0.39 H new ATOM 0 HG LEU A 17 -6.457 1.930 -10.878 1.00 0.89 H new ATOM 0 HD11 LEU A 17 -5.403 2.447 -13.063 1.00 1.94 H new ATOM 0 HD12 LEU A 17 -6.323 3.842 -12.452 1.00 1.94 H new ATOM 0 HD13 LEU A 17 -4.548 3.822 -12.325 1.00 1.94 H new ATOM 0 HD21 LEU A 17 -4.283 0.892 -11.460 1.00 1.45 H new ATOM 0 HD22 LEU A 17 -3.428 2.269 -10.725 1.00 1.45 H new ATOM 0 HD23 LEU A 17 -4.403 1.182 -9.708 1.00 1.45 H new ATOM 248 N ASN A 18 -4.998 2.862 -6.780 1.00 0.52 N ATOM 249 CA ASN A 18 -4.150 2.085 -5.827 1.00 0.60 C ATOM 250 C ASN A 18 -5.010 1.054 -5.092 1.00 0.57 C ATOM 251 O ASN A 18 -4.580 -0.053 -4.838 1.00 0.65 O ATOM 252 CB ASN A 18 -3.523 3.041 -4.810 1.00 0.73 C ATOM 253 CG ASN A 18 -2.211 3.595 -5.371 1.00 1.18 C ATOM 254 OD1 ASN A 18 -2.051 3.710 -6.570 1.00 1.93 O ATOM 255 ND2 ASN A 18 -1.260 3.945 -4.549 1.00 1.72 N ATOM 0 H ASN A 18 -5.020 3.868 -6.615 1.00 0.52 H new ATOM 0 HA ASN A 18 -3.364 1.570 -6.380 1.00 0.60 H new ATOM 0 HB2 ASN A 18 -4.211 3.858 -4.591 1.00 0.73 H new ATOM 0 HB3 ASN A 18 -3.338 2.520 -3.871 1.00 0.73 H new ATOM 0 HD21 ASN A 18 -0.382 4.315 -4.913 1.00 1.72 H new ATOM 0 HD22 ASN A 18 -1.395 3.848 -3.543 1.00 1.72 H new ATOM 262 N HIS A 19 -6.224 1.410 -4.757 1.00 0.51 N ATOM 263 CA HIS A 19 -7.124 0.456 -4.042 1.00 0.52 C ATOM 264 C HIS A 19 -7.365 -0.777 -4.918 1.00 0.45 C ATOM 265 O HIS A 19 -7.567 -1.871 -4.424 1.00 0.45 O ATOM 266 CB HIS A 19 -8.461 1.143 -3.748 1.00 0.63 C ATOM 267 CG HIS A 19 -9.304 0.250 -2.881 1.00 1.13 C ATOM 268 ND1 HIS A 19 -9.826 -0.949 -3.342 1.00 1.83 N ATOM 269 CD2 HIS A 19 -9.726 0.367 -1.579 1.00 1.89 C ATOM 270 CE1 HIS A 19 -10.525 -1.501 -2.333 1.00 2.43 C ATOM 271 NE2 HIS A 19 -10.497 -0.741 -1.235 1.00 2.42 N ATOM 0 H HIS A 19 -6.632 2.325 -4.949 1.00 0.51 H new ATOM 0 HA HIS A 19 -6.658 0.148 -3.106 1.00 0.52 H new ATOM 0 HB2 HIS A 19 -8.290 2.096 -3.248 1.00 0.63 H new ATOM 0 HB3 HIS A 19 -8.983 1.361 -4.680 1.00 0.63 H new ATOM 0 HD2 HIS A 19 -9.495 1.192 -0.922 1.00 1.89 H new ATOM 0 HE1 HIS A 19 -11.046 -2.445 -2.403 1.00 2.43 H new ATOM 0 HE2 HIS A 19 -10.944 -0.931 -0.338 1.00 2.42 H new ATOM 279 N THR A 20 -7.353 -0.602 -6.212 1.00 0.45 N ATOM 280 CA THR A 20 -7.587 -1.751 -7.136 1.00 0.42 C ATOM 281 C THR A 20 -6.338 -2.638 -7.197 1.00 0.40 C ATOM 282 O THR A 20 -6.382 -3.808 -6.869 1.00 0.45 O ATOM 283 CB THR A 20 -7.901 -1.213 -8.537 1.00 0.46 C ATOM 284 OG1 THR A 20 -9.002 -0.318 -8.461 1.00 0.60 O ATOM 285 CG2 THR A 20 -8.249 -2.371 -9.475 1.00 0.43 C ATOM 0 H THR A 20 -7.190 0.293 -6.672 1.00 0.45 H new ATOM 0 HA THR A 20 -8.425 -2.344 -6.770 1.00 0.42 H new ATOM 0 HB THR A 20 -7.027 -0.690 -8.925 1.00 0.46 H new ATOM 0 HG1 THR A 20 -8.691 0.597 -8.622 1.00 0.60 H new ATOM 0 HG21 THR A 20 -8.471 -1.981 -10.468 1.00 0.43 H new ATOM 0 HG22 THR A 20 -7.404 -3.057 -9.535 1.00 0.43 H new ATOM 0 HG23 THR A 20 -9.120 -2.901 -9.091 1.00 0.43 H new ATOM 293 N ILE A 21 -5.232 -2.092 -7.638 1.00 0.39 N ATOM 294 CA ILE A 21 -3.976 -2.899 -7.752 1.00 0.43 C ATOM 295 C ILE A 21 -3.616 -3.559 -6.412 1.00 0.44 C ATOM 296 O ILE A 21 -3.215 -4.708 -6.377 1.00 0.53 O ATOM 297 CB ILE A 21 -2.821 -2.003 -8.215 1.00 0.49 C ATOM 298 CG1 ILE A 21 -2.731 -0.753 -7.326 1.00 0.98 C ATOM 299 CG2 ILE A 21 -3.063 -1.581 -9.666 1.00 1.20 C ATOM 300 CD1 ILE A 21 -1.586 -0.919 -6.323 1.00 2.25 C ATOM 0 H ILE A 21 -5.144 -1.117 -7.926 1.00 0.39 H new ATOM 0 HA ILE A 21 -4.145 -3.687 -8.486 1.00 0.43 H new ATOM 0 HB ILE A 21 -1.885 -2.557 -8.141 1.00 0.49 H new ATOM 0 HG12 ILE A 21 -2.564 0.132 -7.941 1.00 0.98 H new ATOM 0 HG13 ILE A 21 -3.672 -0.601 -6.797 1.00 0.98 H new ATOM 0 HG21 ILE A 21 -2.245 -0.943 -10.001 1.00 1.20 H new ATOM 0 HG22 ILE A 21 -3.115 -2.467 -10.299 1.00 1.20 H new ATOM 0 HG23 ILE A 21 -4.002 -1.031 -9.733 1.00 1.20 H new ATOM 0 HD11 ILE A 21 -1.523 -0.032 -5.693 1.00 2.25 H new ATOM 0 HD12 ILE A 21 -1.772 -1.794 -5.700 1.00 2.25 H new ATOM 0 HD13 ILE A 21 -0.647 -1.049 -6.861 1.00 2.25 H new ATOM 312 N VAL A 22 -3.748 -2.854 -5.312 1.00 0.45 N ATOM 313 CA VAL A 22 -3.404 -3.464 -3.987 1.00 0.55 C ATOM 314 C VAL A 22 -4.311 -4.670 -3.726 1.00 0.56 C ATOM 315 O VAL A 22 -3.918 -5.625 -3.084 1.00 0.63 O ATOM 316 CB VAL A 22 -3.586 -2.435 -2.865 1.00 0.63 C ATOM 317 CG1 VAL A 22 -2.610 -1.276 -3.065 1.00 1.41 C ATOM 318 CG2 VAL A 22 -5.021 -1.901 -2.880 1.00 1.29 C ATOM 0 H VAL A 22 -4.077 -1.889 -5.274 1.00 0.45 H new ATOM 0 HA VAL A 22 -2.363 -3.786 -4.007 1.00 0.55 H new ATOM 0 HB VAL A 22 -3.388 -2.914 -1.906 1.00 0.63 H new ATOM 0 HG11 VAL A 22 -2.742 -0.547 -2.266 1.00 1.41 H new ATOM 0 HG12 VAL A 22 -1.588 -1.654 -3.046 1.00 1.41 H new ATOM 0 HG13 VAL A 22 -2.803 -0.800 -4.026 1.00 1.41 H new ATOM 0 HG21 VAL A 22 -5.146 -1.170 -2.081 1.00 1.29 H new ATOM 0 HG22 VAL A 22 -5.223 -1.427 -3.840 1.00 1.29 H new ATOM 0 HG23 VAL A 22 -5.718 -2.726 -2.729 1.00 1.29 H new ATOM 328 N ASN A 23 -5.522 -4.625 -4.217 1.00 0.54 N ATOM 329 CA ASN A 23 -6.468 -5.759 -4.000 1.00 0.58 C ATOM 330 C ASN A 23 -6.003 -6.975 -4.805 1.00 0.56 C ATOM 331 O ASN A 23 -5.824 -8.052 -4.269 1.00 0.59 O ATOM 332 CB ASN A 23 -7.869 -5.350 -4.458 1.00 0.59 C ATOM 333 CG ASN A 23 -8.907 -6.275 -3.820 1.00 1.14 C ATOM 334 OD1 ASN A 23 -8.745 -7.479 -3.820 1.00 1.86 O ATOM 335 ND2 ASN A 23 -9.972 -5.759 -3.270 1.00 1.46 N ATOM 0 H ASN A 23 -5.898 -3.848 -4.761 1.00 0.54 H new ATOM 0 HA ASN A 23 -6.492 -6.013 -2.940 1.00 0.58 H new ATOM 0 HB2 ASN A 23 -8.067 -4.316 -4.177 1.00 0.59 H new ATOM 0 HB3 ASN A 23 -7.938 -5.404 -5.544 1.00 0.59 H new ATOM 0 HD21 ASN A 23 -10.669 -6.367 -2.840 1.00 1.46 H new ATOM 0 HD22 ASN A 23 -10.107 -4.748 -3.270 1.00 1.46 H new ATOM 342 N ALA A 24 -5.809 -6.807 -6.089 1.00 0.56 N ATOM 343 CA ALA A 24 -5.358 -7.947 -6.939 1.00 0.56 C ATOM 344 C ALA A 24 -3.976 -8.416 -6.479 1.00 0.55 C ATOM 345 O ALA A 24 -3.692 -9.599 -6.450 1.00 0.56 O ATOM 346 CB ALA A 24 -5.281 -7.495 -8.399 1.00 0.62 C ATOM 0 H ALA A 24 -5.944 -5.926 -6.585 1.00 0.56 H new ATOM 0 HA ALA A 24 -6.068 -8.769 -6.848 1.00 0.56 H new ATOM 0 HB1 ALA A 24 -4.951 -8.327 -9.021 1.00 0.62 H new ATOM 0 HB2 ALA A 24 -6.265 -7.163 -8.729 1.00 0.62 H new ATOM 0 HB3 ALA A 24 -4.571 -6.672 -8.488 1.00 0.62 H new ATOM 352 N ALA A 25 -3.114 -7.496 -6.122 1.00 0.61 N ATOM 353 CA ALA A 25 -1.742 -7.876 -5.665 1.00 0.68 C ATOM 354 C ALA A 25 -1.834 -8.804 -4.448 1.00 0.67 C ATOM 355 O ALA A 25 -1.115 -9.780 -4.348 1.00 0.70 O ATOM 356 CB ALA A 25 -0.967 -6.614 -5.282 1.00 0.83 C ATOM 0 H ALA A 25 -3.303 -6.494 -6.128 1.00 0.61 H new ATOM 0 HA ALA A 25 -1.227 -8.395 -6.473 1.00 0.68 H new ATOM 0 HB1 ALA A 25 0.034 -6.889 -4.948 1.00 0.83 H new ATOM 0 HB2 ALA A 25 -0.893 -5.956 -6.148 1.00 0.83 H new ATOM 0 HB3 ALA A 25 -1.489 -6.097 -4.477 1.00 0.83 H new ATOM 362 N HIS A 26 -2.714 -8.504 -3.528 1.00 0.68 N ATOM 363 CA HIS A 26 -2.861 -9.362 -2.316 1.00 0.78 C ATOM 364 C HIS A 26 -3.601 -10.648 -2.689 1.00 0.76 C ATOM 365 O HIS A 26 -3.368 -11.697 -2.118 1.00 0.87 O ATOM 366 CB HIS A 26 -3.657 -8.608 -1.249 1.00 0.88 C ATOM 367 CG HIS A 26 -3.502 -9.301 0.077 1.00 1.24 C ATOM 368 ND1 HIS A 26 -2.919 -8.682 1.171 1.00 1.69 N ATOM 369 CD2 HIS A 26 -3.851 -10.561 0.499 1.00 2.08 C ATOM 370 CE1 HIS A 26 -2.933 -9.562 2.189 1.00 2.14 C ATOM 371 NE2 HIS A 26 -3.491 -10.723 1.834 1.00 2.36 N ATOM 0 H HIS A 26 -3.339 -7.699 -3.565 1.00 0.68 H new ATOM 0 HA HIS A 26 -1.874 -9.610 -1.925 1.00 0.78 H new ATOM 0 HB2 HIS A 26 -3.305 -7.579 -1.177 1.00 0.88 H new ATOM 0 HB3 HIS A 26 -4.710 -8.565 -1.528 1.00 0.88 H new ATOM 0 HD2 HIS A 26 -4.331 -11.311 -0.112 1.00 2.08 H new ATOM 0 HE1 HIS A 26 -2.541 -9.355 3.174 1.00 2.14 H new ATOM 0 HE2 HIS A 26 -3.624 -11.550 2.416 1.00 2.36 H new ATOM 379 N GLU A 27 -4.491 -10.570 -3.644 1.00 0.70 N ATOM 380 CA GLU A 27 -5.258 -11.778 -4.066 1.00 0.74 C ATOM 381 C GLU A 27 -4.319 -12.772 -4.754 1.00 0.68 C ATOM 382 O GLU A 27 -4.512 -13.970 -4.683 1.00 0.68 O ATOM 383 CB GLU A 27 -6.366 -11.365 -5.037 1.00 0.75 C ATOM 384 CG GLU A 27 -7.343 -10.425 -4.328 1.00 0.83 C ATOM 385 CD GLU A 27 -8.509 -11.235 -3.758 1.00 1.19 C ATOM 386 OE1 GLU A 27 -8.251 -12.162 -3.009 1.00 1.92 O ATOM 387 OE2 GLU A 27 -9.641 -10.914 -4.083 1.00 1.44 O ATOM 0 H GLU A 27 -4.720 -9.716 -4.152 1.00 0.70 H new ATOM 0 HA GLU A 27 -5.700 -12.249 -3.188 1.00 0.74 H new ATOM 0 HB2 GLU A 27 -5.935 -10.870 -5.907 1.00 0.75 H new ATOM 0 HB3 GLU A 27 -6.893 -12.247 -5.401 1.00 0.75 H new ATOM 0 HG2 GLU A 27 -6.833 -9.890 -3.527 1.00 0.83 H new ATOM 0 HG3 GLU A 27 -7.714 -9.675 -5.027 1.00 0.83 H new ATOM 394 N LEU A 28 -3.302 -12.281 -5.424 1.00 0.70 N ATOM 395 CA LEU A 28 -2.343 -13.190 -6.130 1.00 0.69 C ATOM 396 C LEU A 28 -1.764 -14.215 -5.145 1.00 0.70 C ATOM 397 O LEU A 28 -1.653 -15.387 -5.451 1.00 0.73 O ATOM 398 CB LEU A 28 -1.202 -12.360 -6.729 1.00 0.86 C ATOM 399 CG LEU A 28 -1.499 -12.060 -8.204 1.00 0.95 C ATOM 400 CD1 LEU A 28 -1.998 -10.619 -8.347 1.00 1.75 C ATOM 401 CD2 LEU A 28 -0.222 -12.239 -9.032 1.00 1.63 C ATOM 0 H LEU A 28 -3.095 -11.286 -5.512 1.00 0.70 H new ATOM 0 HA LEU A 28 -2.872 -13.718 -6.923 1.00 0.69 H new ATOM 0 HB2 LEU A 28 -1.087 -11.429 -6.175 1.00 0.86 H new ATOM 0 HB3 LEU A 28 -0.260 -12.902 -6.641 1.00 0.86 H new ATOM 0 HG LEU A 28 -2.266 -12.747 -8.562 1.00 0.95 H new ATOM 0 HD11 LEU A 28 -2.208 -10.409 -9.396 1.00 1.75 H new ATOM 0 HD12 LEU A 28 -2.908 -10.489 -7.762 1.00 1.75 H new ATOM 0 HD13 LEU A 28 -1.233 -9.932 -7.985 1.00 1.75 H new ATOM 0 HD21 LEU A 28 -0.435 -12.026 -10.080 1.00 1.63 H new ATOM 0 HD22 LEU A 28 0.545 -11.554 -8.671 1.00 1.63 H new ATOM 0 HD23 LEU A 28 0.133 -13.265 -8.936 1.00 1.63 H new ATOM 413 N HIS A 29 -1.400 -13.779 -3.968 1.00 0.79 N ATOM 414 CA HIS A 29 -0.833 -14.719 -2.957 1.00 0.93 C ATOM 415 C HIS A 29 -1.950 -15.611 -2.414 1.00 0.92 C ATOM 416 O HIS A 29 -1.727 -16.750 -2.051 1.00 0.98 O ATOM 417 CB HIS A 29 -0.212 -13.921 -1.809 1.00 1.07 C ATOM 418 CG HIS A 29 1.240 -13.661 -2.106 1.00 1.20 C ATOM 419 ND1 HIS A 29 1.824 -12.420 -1.908 1.00 1.95 N ATOM 420 CD2 HIS A 29 2.237 -14.473 -2.586 1.00 1.74 C ATOM 421 CE1 HIS A 29 3.117 -12.520 -2.265 1.00 2.27 C ATOM 422 NE2 HIS A 29 3.422 -13.750 -2.685 1.00 2.28 N ATOM 0 H HIS A 29 -1.471 -12.809 -3.662 1.00 0.79 H new ATOM 0 HA HIS A 29 -0.066 -15.338 -3.423 1.00 0.93 H new ATOM 0 HB2 HIS A 29 -0.742 -12.978 -1.679 1.00 1.07 H new ATOM 0 HB3 HIS A 29 -0.310 -14.473 -0.874 1.00 1.07 H new ATOM 0 HD2 HIS A 29 2.120 -15.514 -2.847 1.00 1.74 H new ATOM 0 HE1 HIS A 29 3.823 -11.704 -2.218 1.00 2.27 H new ATOM 0 HE2 HIS A 29 4.329 -14.087 -3.009 1.00 2.28 H new ATOM 430 N GLU A 30 -3.151 -15.094 -2.351 1.00 0.93 N ATOM 431 CA GLU A 30 -4.296 -15.897 -1.828 1.00 1.03 C ATOM 432 C GLU A 30 -4.677 -16.981 -2.841 1.00 0.97 C ATOM 433 O GLU A 30 -5.064 -18.075 -2.473 1.00 1.09 O ATOM 434 CB GLU A 30 -5.496 -14.978 -1.592 1.00 1.14 C ATOM 435 CG GLU A 30 -6.562 -15.724 -0.787 1.00 1.49 C ATOM 436 CD GLU A 30 -7.563 -14.721 -0.211 1.00 2.03 C ATOM 437 OE1 GLU A 30 -7.135 -13.655 0.198 1.00 2.36 O ATOM 438 OE2 GLU A 30 -8.741 -15.037 -0.190 1.00 2.70 O ATOM 0 H GLU A 30 -3.388 -14.145 -2.641 1.00 0.93 H new ATOM 0 HA GLU A 30 -4.005 -16.369 -0.890 1.00 1.03 H new ATOM 0 HB2 GLU A 30 -5.181 -14.082 -1.056 1.00 1.14 H new ATOM 0 HB3 GLU A 30 -5.909 -14.650 -2.546 1.00 1.14 H new ATOM 0 HG2 GLU A 30 -7.077 -16.443 -1.424 1.00 1.49 H new ATOM 0 HG3 GLU A 30 -6.094 -16.290 0.018 1.00 1.49 H new ATOM 445 N THR A 31 -4.564 -16.687 -4.111 1.00 0.88 N ATOM 446 CA THR A 31 -4.912 -17.698 -5.154 1.00 0.88 C ATOM 447 C THR A 31 -3.792 -18.733 -5.234 1.00 0.82 C ATOM 448 O THR A 31 -4.017 -19.884 -5.539 1.00 0.81 O ATOM 449 CB THR A 31 -5.095 -17.016 -6.514 1.00 1.01 C ATOM 450 OG1 THR A 31 -5.351 -18.005 -7.503 1.00 1.38 O ATOM 451 CG2 THR A 31 -3.832 -16.239 -6.889 1.00 1.50 C ATOM 0 H THR A 31 -4.245 -15.788 -4.471 1.00 0.88 H new ATOM 0 HA THR A 31 -5.848 -18.189 -4.887 1.00 0.88 H new ATOM 0 HB THR A 31 -5.934 -16.322 -6.456 1.00 1.01 H new ATOM 0 HG1 THR A 31 -6.283 -17.937 -7.800 1.00 1.38 H new ATOM 0 HG21 THR A 31 -3.974 -15.759 -7.857 1.00 1.50 H new ATOM 0 HG22 THR A 31 -3.634 -15.479 -6.133 1.00 1.50 H new ATOM 0 HG23 THR A 31 -2.986 -16.924 -6.945 1.00 1.50 H new ATOM 459 N LEU A 32 -2.580 -18.324 -4.956 1.00 0.91 N ATOM 460 CA LEU A 32 -1.415 -19.262 -4.999 1.00 1.06 C ATOM 461 C LEU A 32 -1.726 -20.519 -4.155 1.00 1.07 C ATOM 462 O LEU A 32 -1.359 -21.623 -4.511 1.00 1.20 O ATOM 463 CB LEU A 32 -0.179 -18.480 -4.465 1.00 1.26 C ATOM 464 CG LEU A 32 0.937 -19.375 -3.867 1.00 0.99 C ATOM 465 CD1 LEU A 32 0.552 -19.803 -2.446 1.00 1.53 C ATOM 466 CD2 LEU A 32 1.183 -20.611 -4.745 1.00 1.37 C ATOM 0 H LEU A 32 -2.344 -17.366 -4.697 1.00 0.91 H new ATOM 0 HA LEU A 32 -1.210 -19.610 -6.011 1.00 1.06 H new ATOM 0 HB2 LEU A 32 0.242 -17.891 -5.280 1.00 1.26 H new ATOM 0 HB3 LEU A 32 -0.512 -17.777 -3.702 1.00 1.26 H new ATOM 0 HG LEU A 32 1.861 -18.798 -3.832 1.00 0.99 H new ATOM 0 HD11 LEU A 32 1.339 -20.432 -2.030 1.00 1.53 H new ATOM 0 HD12 LEU A 32 0.425 -18.919 -1.821 1.00 1.53 H new ATOM 0 HD13 LEU A 32 -0.383 -20.363 -2.475 1.00 1.53 H new ATOM 0 HD21 LEU A 32 1.970 -21.221 -4.302 1.00 1.37 H new ATOM 0 HD22 LEU A 32 0.266 -21.196 -4.814 1.00 1.37 H new ATOM 0 HD23 LEU A 32 1.487 -20.294 -5.743 1.00 1.37 H new ATOM 478 N GLY A 33 -2.390 -20.347 -3.043 1.00 1.02 N ATOM 479 CA GLY A 33 -2.719 -21.509 -2.162 1.00 1.20 C ATOM 480 C GLY A 33 -3.870 -22.341 -2.745 1.00 1.06 C ATOM 481 O GLY A 33 -3.960 -23.531 -2.506 1.00 1.12 O ATOM 0 H GLY A 33 -2.722 -19.444 -2.703 1.00 1.02 H new ATOM 0 HA2 GLY A 33 -1.837 -22.138 -2.041 1.00 1.20 H new ATOM 0 HA3 GLY A 33 -2.993 -21.150 -1.170 1.00 1.20 H new ATOM 485 N LEU A 34 -4.772 -21.722 -3.470 1.00 1.04 N ATOM 486 CA LEU A 34 -5.951 -22.461 -4.037 1.00 1.13 C ATOM 487 C LEU A 34 -5.517 -23.791 -4.725 1.00 1.02 C ATOM 488 O LEU A 34 -5.933 -24.845 -4.285 1.00 1.12 O ATOM 489 CB LEU A 34 -6.725 -21.503 -4.987 1.00 1.33 C ATOM 490 CG LEU A 34 -7.411 -22.239 -6.152 1.00 0.77 C ATOM 491 CD1 LEU A 34 -8.517 -23.142 -5.609 1.00 1.36 C ATOM 492 CD2 LEU A 34 -8.014 -21.212 -7.114 1.00 1.41 C ATOM 0 H LEU A 34 -4.743 -20.728 -3.696 1.00 1.04 H new ATOM 0 HA LEU A 34 -6.624 -22.764 -3.234 1.00 1.13 H new ATOM 0 HB2 LEU A 34 -7.477 -20.960 -4.414 1.00 1.33 H new ATOM 0 HB3 LEU A 34 -6.034 -20.762 -5.389 1.00 1.33 H new ATOM 0 HG LEU A 34 -6.677 -22.848 -6.680 1.00 0.77 H new ATOM 0 HD11 LEU A 34 -9.001 -23.662 -6.436 1.00 1.36 H new ATOM 0 HD12 LEU A 34 -8.087 -23.872 -4.923 1.00 1.36 H new ATOM 0 HD13 LEU A 34 -9.253 -22.537 -5.080 1.00 1.36 H new ATOM 0 HD21 LEU A 34 -8.501 -21.730 -7.941 1.00 1.41 H new ATOM 0 HD22 LEU A 34 -8.747 -20.604 -6.584 1.00 1.41 H new ATOM 0 HD23 LEU A 34 -7.224 -20.570 -7.503 1.00 1.41 H new ATOM 504 N PRO A 35 -4.718 -23.733 -5.777 1.00 0.93 N ATOM 505 CA PRO A 35 -4.286 -24.959 -6.476 1.00 1.02 C ATOM 506 C PRO A 35 -3.140 -25.647 -5.721 1.00 0.98 C ATOM 507 O PRO A 35 -3.323 -26.680 -5.107 1.00 1.75 O ATOM 508 CB PRO A 35 -3.811 -24.452 -7.840 1.00 1.04 C ATOM 509 CG PRO A 35 -3.457 -22.959 -7.652 1.00 0.89 C ATOM 510 CD PRO A 35 -4.173 -22.489 -6.372 1.00 0.89 C ATOM 0 HA PRO A 35 -5.081 -25.701 -6.553 1.00 1.02 H new ATOM 0 HB2 PRO A 35 -2.944 -25.016 -8.184 1.00 1.04 H new ATOM 0 HB3 PRO A 35 -4.590 -24.575 -8.593 1.00 1.04 H new ATOM 0 HG2 PRO A 35 -2.379 -22.826 -7.563 1.00 0.89 H new ATOM 0 HG3 PRO A 35 -3.780 -22.374 -8.513 1.00 0.89 H new ATOM 0 HD2 PRO A 35 -3.483 -21.992 -5.690 1.00 0.89 H new ATOM 0 HD3 PRO A 35 -4.966 -21.776 -6.599 1.00 0.89 H new ATOM 518 N THR A 36 -1.961 -25.085 -5.780 1.00 0.70 N ATOM 519 CA THR A 36 -0.790 -25.696 -5.090 1.00 0.76 C ATOM 520 C THR A 36 0.319 -24.643 -4.951 1.00 0.75 C ATOM 521 O THR A 36 0.239 -23.601 -5.568 1.00 0.70 O ATOM 522 CB THR A 36 -0.266 -26.863 -5.928 1.00 1.12 C ATOM 523 OG1 THR A 36 -0.566 -26.635 -7.299 1.00 2.05 O ATOM 524 CG2 THR A 36 -0.931 -28.154 -5.469 1.00 1.61 C ATOM 0 H THR A 36 -1.759 -24.220 -6.282 1.00 0.70 H new ATOM 0 HA THR A 36 -1.089 -26.052 -4.104 1.00 0.76 H new ATOM 0 HB THR A 36 0.814 -26.946 -5.803 1.00 1.12 H new ATOM 0 HG1 THR A 36 -0.229 -27.382 -7.836 1.00 2.05 H new ATOM 0 HG21 THR A 36 -0.559 -28.987 -6.065 1.00 1.61 H new ATOM 0 HG22 THR A 36 -0.700 -28.328 -4.418 1.00 1.61 H new ATOM 0 HG23 THR A 36 -2.011 -28.072 -5.595 1.00 1.61 H new ATOM 532 N PRO A 37 1.339 -24.935 -4.161 1.00 0.91 N ATOM 533 CA PRO A 37 2.465 -24.001 -3.971 1.00 1.12 C ATOM 534 C PRO A 37 3.470 -24.110 -5.132 1.00 1.36 C ATOM 535 O PRO A 37 4.663 -24.200 -4.912 1.00 1.72 O ATOM 536 CB PRO A 37 3.106 -24.472 -2.664 1.00 1.27 C ATOM 537 CG PRO A 37 2.698 -25.954 -2.481 1.00 1.22 C ATOM 538 CD PRO A 37 1.466 -26.189 -3.376 1.00 1.00 C ATOM 0 HA PRO A 37 2.147 -22.959 -3.941 1.00 1.12 H new ATOM 0 HB2 PRO A 37 4.190 -24.371 -2.706 1.00 1.27 H new ATOM 0 HB3 PRO A 37 2.762 -23.869 -1.824 1.00 1.27 H new ATOM 0 HG2 PRO A 37 3.515 -26.618 -2.765 1.00 1.22 H new ATOM 0 HG3 PRO A 37 2.464 -26.165 -1.438 1.00 1.22 H new ATOM 0 HD2 PRO A 37 1.605 -27.053 -4.026 1.00 1.00 H new ATOM 0 HD3 PRO A 37 0.572 -26.378 -2.781 1.00 1.00 H new ATOM 546 N ASP A 38 3.002 -24.100 -6.360 1.00 1.30 N ATOM 547 CA ASP A 38 3.935 -24.202 -7.520 1.00 1.57 C ATOM 548 C ASP A 38 3.154 -24.032 -8.828 1.00 1.41 C ATOM 549 O ASP A 38 3.388 -23.110 -9.586 1.00 1.43 O ATOM 550 CB ASP A 38 4.613 -25.574 -7.508 1.00 1.93 C ATOM 551 CG ASP A 38 5.750 -25.593 -8.531 1.00 2.46 C ATOM 552 OD1 ASP A 38 5.531 -25.135 -9.641 1.00 3.32 O ATOM 553 OD2 ASP A 38 6.821 -26.067 -8.189 1.00 2.48 O ATOM 0 H ASP A 38 2.014 -24.026 -6.604 1.00 1.30 H new ATOM 0 HA ASP A 38 4.690 -23.419 -7.446 1.00 1.57 H new ATOM 0 HB2 ASP A 38 5.002 -25.790 -6.513 1.00 1.93 H new ATOM 0 HB3 ASP A 38 3.886 -26.352 -7.742 1.00 1.93 H new ATOM 558 N GLU A 39 2.232 -24.919 -9.095 1.00 1.35 N ATOM 559 CA GLU A 39 1.428 -24.831 -10.353 1.00 1.34 C ATOM 560 C GLU A 39 0.650 -23.512 -10.392 1.00 1.00 C ATOM 561 O GLU A 39 0.377 -22.976 -11.448 1.00 0.98 O ATOM 562 CB GLU A 39 0.443 -26.001 -10.408 1.00 1.56 C ATOM 563 CG GLU A 39 -0.033 -26.202 -11.849 1.00 1.51 C ATOM 564 CD GLU A 39 1.072 -26.876 -12.663 1.00 1.79 C ATOM 565 OE1 GLU A 39 1.910 -26.163 -13.191 1.00 2.38 O ATOM 566 OE2 GLU A 39 1.062 -28.093 -12.744 1.00 2.12 O ATOM 0 H GLU A 39 1.999 -25.707 -8.492 1.00 1.35 H new ATOM 0 HA GLU A 39 2.102 -24.872 -11.209 1.00 1.34 H new ATOM 0 HB2 GLU A 39 0.921 -26.910 -10.042 1.00 1.56 H new ATOM 0 HB3 GLU A 39 -0.409 -25.804 -9.757 1.00 1.56 H new ATOM 0 HG2 GLU A 39 -0.935 -26.814 -11.863 1.00 1.51 H new ATOM 0 HG3 GLU A 39 -0.293 -25.242 -12.294 1.00 1.51 H new ATOM 573 N ALA A 40 0.277 -22.998 -9.246 1.00 0.78 N ATOM 574 CA ALA A 40 -0.505 -21.717 -9.184 1.00 0.60 C ATOM 575 C ALA A 40 0.117 -20.633 -10.078 1.00 0.55 C ATOM 576 O ALA A 40 -0.578 -19.783 -10.601 1.00 0.54 O ATOM 577 CB ALA A 40 -0.536 -21.217 -7.740 1.00 0.59 C ATOM 0 H ALA A 40 0.482 -23.414 -8.338 1.00 0.78 H new ATOM 0 HA ALA A 40 -1.515 -21.918 -9.543 1.00 0.60 H new ATOM 0 HB1 ALA A 40 -1.102 -20.287 -7.689 1.00 0.59 H new ATOM 0 HB2 ALA A 40 -1.010 -21.966 -7.106 1.00 0.59 H new ATOM 0 HB3 ALA A 40 0.483 -21.041 -7.394 1.00 0.59 H new ATOM 583 N LEU A 41 1.418 -20.650 -10.248 1.00 0.62 N ATOM 584 CA LEU A 41 2.090 -19.615 -11.102 1.00 0.67 C ATOM 585 C LEU A 41 1.402 -19.521 -12.471 1.00 0.57 C ATOM 586 O LEU A 41 1.368 -18.473 -13.085 1.00 0.59 O ATOM 587 CB LEU A 41 3.566 -19.980 -11.294 1.00 0.85 C ATOM 588 CG LEU A 41 3.684 -21.380 -11.907 1.00 1.02 C ATOM 589 CD1 LEU A 41 3.617 -21.287 -13.440 1.00 2.07 C ATOM 590 CD2 LEU A 41 5.021 -22.000 -11.485 1.00 1.52 C ATOM 0 H LEU A 41 2.046 -21.337 -9.832 1.00 0.62 H new ATOM 0 HA LEU A 41 2.015 -18.649 -10.603 1.00 0.67 H new ATOM 0 HB2 LEU A 41 4.049 -19.248 -11.942 1.00 0.85 H new ATOM 0 HB3 LEU A 41 4.085 -19.949 -10.336 1.00 0.85 H new ATOM 0 HG LEU A 41 2.862 -22.003 -11.555 1.00 1.02 H new ATOM 0 HD11 LEU A 41 3.701 -22.285 -13.869 1.00 2.07 H new ATOM 0 HD12 LEU A 41 2.666 -20.844 -13.736 1.00 2.07 H new ATOM 0 HD13 LEU A 41 4.436 -20.666 -13.803 1.00 2.07 H new ATOM 0 HD21 LEU A 41 5.113 -22.996 -11.917 1.00 1.52 H new ATOM 0 HD22 LEU A 41 5.840 -21.374 -11.839 1.00 1.52 H new ATOM 0 HD23 LEU A 41 5.062 -22.071 -10.398 1.00 1.52 H new ATOM 602 N ASN A 42 0.856 -20.611 -12.947 1.00 0.55 N ATOM 603 CA ASN A 42 0.170 -20.597 -14.274 1.00 0.54 C ATOM 604 C ASN A 42 -1.004 -19.610 -14.247 1.00 0.46 C ATOM 605 O ASN A 42 -1.159 -18.798 -15.141 1.00 0.48 O ATOM 606 CB ASN A 42 -0.353 -22.000 -14.590 1.00 0.66 C ATOM 607 CG ASN A 42 0.811 -22.895 -15.018 1.00 1.02 C ATOM 608 OD1 ASN A 42 1.349 -23.636 -14.219 1.00 1.88 O ATOM 609 ND2 ASN A 42 1.227 -22.857 -16.254 1.00 1.40 N ATOM 0 H ASN A 42 0.856 -21.513 -12.472 1.00 0.55 H new ATOM 0 HA ASN A 42 0.880 -20.287 -15.041 1.00 0.54 H new ATOM 0 HB2 ASN A 42 -0.846 -22.421 -13.714 1.00 0.66 H new ATOM 0 HB3 ASN A 42 -1.099 -21.951 -15.383 1.00 0.66 H new ATOM 0 HD21 ASN A 42 2.003 -23.449 -16.549 1.00 1.40 H new ATOM 0 HD22 ASN A 42 0.776 -22.235 -16.925 1.00 1.40 H new ATOM 616 N LEU A 43 -1.836 -19.681 -13.236 1.00 0.45 N ATOM 617 CA LEU A 43 -3.005 -18.756 -13.155 1.00 0.46 C ATOM 618 C LEU A 43 -2.523 -17.303 -13.070 1.00 0.48 C ATOM 619 O LEU A 43 -3.079 -16.421 -13.697 1.00 0.59 O ATOM 620 CB LEU A 43 -3.830 -19.090 -11.910 1.00 0.54 C ATOM 621 CG LEU A 43 -5.117 -18.265 -11.912 1.00 0.95 C ATOM 622 CD1 LEU A 43 -6.239 -19.068 -12.573 1.00 1.30 C ATOM 623 CD2 LEU A 43 -5.511 -17.933 -10.470 1.00 1.31 C ATOM 0 H LEU A 43 -1.754 -20.342 -12.463 1.00 0.45 H new ATOM 0 HA LEU A 43 -3.617 -18.876 -14.049 1.00 0.46 H new ATOM 0 HB2 LEU A 43 -4.068 -20.154 -11.893 1.00 0.54 H new ATOM 0 HB3 LEU A 43 -3.252 -18.879 -11.011 1.00 0.54 H new ATOM 0 HG LEU A 43 -4.955 -17.342 -12.468 1.00 0.95 H new ATOM 0 HD11 LEU A 43 -7.156 -18.479 -12.574 1.00 1.30 H new ATOM 0 HD12 LEU A 43 -5.960 -19.306 -13.599 1.00 1.30 H new ATOM 0 HD13 LEU A 43 -6.402 -19.992 -12.017 1.00 1.30 H new ATOM 0 HD21 LEU A 43 -6.429 -17.345 -10.470 1.00 1.31 H new ATOM 0 HD22 LEU A 43 -5.672 -18.857 -9.915 1.00 1.31 H new ATOM 0 HD23 LEU A 43 -4.713 -17.361 -9.997 1.00 1.31 H new ATOM 635 N LEU A 44 -1.503 -17.048 -12.290 1.00 0.57 N ATOM 636 CA LEU A 44 -0.990 -15.651 -12.151 1.00 0.68 C ATOM 637 C LEU A 44 -0.203 -15.252 -13.401 1.00 0.61 C ATOM 638 O LEU A 44 -0.365 -14.167 -13.924 1.00 0.70 O ATOM 639 CB LEU A 44 -0.078 -15.566 -10.924 1.00 0.83 C ATOM 640 CG LEU A 44 -0.822 -16.091 -9.694 1.00 0.84 C ATOM 641 CD1 LEU A 44 0.126 -16.107 -8.493 1.00 1.63 C ATOM 642 CD2 LEU A 44 -2.018 -15.181 -9.389 1.00 1.48 C ATOM 0 H LEU A 44 -1.003 -17.748 -11.743 1.00 0.57 H new ATOM 0 HA LEU A 44 -1.833 -14.971 -12.032 1.00 0.68 H new ATOM 0 HB2 LEU A 44 0.828 -16.150 -11.090 1.00 0.83 H new ATOM 0 HB3 LEU A 44 0.233 -14.534 -10.760 1.00 0.83 H new ATOM 0 HG LEU A 44 -1.178 -17.102 -9.891 1.00 0.84 H new ATOM 0 HD11 LEU A 44 -0.403 -16.481 -7.617 1.00 1.63 H new ATOM 0 HD12 LEU A 44 0.975 -16.756 -8.708 1.00 1.63 H new ATOM 0 HD13 LEU A 44 0.483 -15.096 -8.297 1.00 1.63 H new ATOM 0 HD21 LEU A 44 -2.547 -15.556 -8.513 1.00 1.48 H new ATOM 0 HD22 LEU A 44 -1.664 -14.169 -9.193 1.00 1.48 H new ATOM 0 HD23 LEU A 44 -2.694 -15.170 -10.244 1.00 1.48 H new ATOM 654 N THR A 45 0.650 -16.122 -13.882 1.00 0.53 N ATOM 655 CA THR A 45 1.459 -15.803 -15.099 1.00 0.53 C ATOM 656 C THR A 45 0.525 -15.495 -16.275 1.00 0.50 C ATOM 657 O THR A 45 0.661 -14.487 -16.941 1.00 0.55 O ATOM 658 CB THR A 45 2.341 -17.009 -15.445 1.00 0.56 C ATOM 659 OG1 THR A 45 3.177 -17.312 -14.337 1.00 0.92 O ATOM 660 CG2 THR A 45 3.207 -16.691 -16.665 1.00 0.87 C ATOM 0 H THR A 45 0.822 -17.044 -13.482 1.00 0.53 H new ATOM 0 HA THR A 45 2.086 -14.933 -14.904 1.00 0.53 H new ATOM 0 HB THR A 45 1.706 -17.865 -15.673 1.00 0.56 H new ATOM 0 HG1 THR A 45 2.626 -17.610 -13.583 1.00 0.92 H new ATOM 0 HG21 THR A 45 3.830 -17.553 -16.904 1.00 0.87 H new ATOM 0 HG22 THR A 45 2.566 -16.460 -17.516 1.00 0.87 H new ATOM 0 HG23 THR A 45 3.843 -15.833 -16.446 1.00 0.87 H new ATOM 668 N GLU A 46 -0.416 -16.365 -16.534 1.00 0.48 N ATOM 669 CA GLU A 46 -1.368 -16.150 -17.668 1.00 0.52 C ATOM 670 C GLU A 46 -2.040 -14.773 -17.552 1.00 0.48 C ATOM 671 O GLU A 46 -2.176 -14.054 -18.522 1.00 0.48 O ATOM 672 CB GLU A 46 -2.444 -17.239 -17.635 1.00 0.60 C ATOM 673 CG GLU A 46 -3.174 -17.276 -18.979 1.00 0.98 C ATOM 674 CD GLU A 46 -4.118 -18.480 -19.014 1.00 1.47 C ATOM 675 OE1 GLU A 46 -4.689 -18.790 -17.981 1.00 2.05 O ATOM 676 OE2 GLU A 46 -4.253 -19.071 -20.072 1.00 2.16 O ATOM 0 H GLU A 46 -0.568 -17.223 -16.004 1.00 0.48 H new ATOM 0 HA GLU A 46 -0.815 -16.195 -18.606 1.00 0.52 H new ATOM 0 HB2 GLU A 46 -1.989 -18.208 -17.429 1.00 0.60 H new ATOM 0 HB3 GLU A 46 -3.152 -17.041 -16.830 1.00 0.60 H new ATOM 0 HG2 GLU A 46 -3.737 -16.354 -19.124 1.00 0.98 H new ATOM 0 HG3 GLU A 46 -2.454 -17.341 -19.794 1.00 0.98 H new ATOM 683 N GLN A 47 -2.464 -14.414 -16.371 1.00 0.48 N ATOM 684 CA GLN A 47 -3.133 -13.093 -16.173 1.00 0.49 C ATOM 685 C GLN A 47 -2.094 -11.970 -16.149 1.00 0.52 C ATOM 686 O GLN A 47 -2.301 -10.908 -16.708 1.00 0.55 O ATOM 687 CB GLN A 47 -3.897 -13.106 -14.847 1.00 0.55 C ATOM 688 CG GLN A 47 -5.063 -14.091 -14.938 1.00 0.97 C ATOM 689 CD GLN A 47 -6.085 -13.580 -15.955 1.00 1.66 C ATOM 690 OE1 GLN A 47 -6.710 -12.560 -15.745 1.00 2.11 O ATOM 691 NE2 GLN A 47 -6.284 -14.252 -17.057 1.00 2.45 N ATOM 0 H GLN A 47 -2.376 -14.982 -15.528 1.00 0.48 H new ATOM 0 HA GLN A 47 -3.824 -12.918 -16.998 1.00 0.49 H new ATOM 0 HB2 GLN A 47 -3.230 -13.391 -14.034 1.00 0.55 H new ATOM 0 HB3 GLN A 47 -4.268 -12.107 -14.620 1.00 0.55 H new ATOM 0 HG2 GLN A 47 -4.699 -15.075 -15.235 1.00 0.97 H new ATOM 0 HG3 GLN A 47 -5.533 -14.206 -13.961 1.00 0.97 H new ATOM 0 HE21 GLN A 47 -5.759 -15.109 -17.234 1.00 2.45 H new ATOM 0 HE22 GLN A 47 -6.964 -13.920 -17.741 1.00 2.45 H new ATOM 700 N ALA A 48 -0.989 -12.189 -15.483 1.00 0.60 N ATOM 701 CA ALA A 48 0.063 -11.133 -15.387 1.00 0.66 C ATOM 702 C ALA A 48 0.633 -10.803 -16.771 1.00 0.66 C ATOM 703 O ALA A 48 1.032 -9.681 -17.023 1.00 0.73 O ATOM 704 CB ALA A 48 1.192 -11.623 -14.480 1.00 0.73 C ATOM 0 H ALA A 48 -0.769 -13.059 -14.999 1.00 0.60 H new ATOM 0 HA ALA A 48 -0.388 -10.232 -14.972 1.00 0.66 H new ATOM 0 HB1 ALA A 48 1.961 -10.854 -14.408 1.00 0.73 H new ATOM 0 HB2 ALA A 48 0.795 -11.833 -13.487 1.00 0.73 H new ATOM 0 HB3 ALA A 48 1.626 -12.532 -14.897 1.00 0.73 H new ATOM 710 N ASN A 49 0.690 -11.762 -17.664 1.00 0.62 N ATOM 711 CA ASN A 49 1.255 -11.480 -19.018 1.00 0.65 C ATOM 712 C ASN A 49 0.387 -10.442 -19.741 1.00 0.62 C ATOM 713 O ASN A 49 0.875 -9.661 -20.535 1.00 0.65 O ATOM 714 CB ASN A 49 1.377 -12.789 -19.831 1.00 0.67 C ATOM 715 CG ASN A 49 0.011 -13.321 -20.299 1.00 1.53 C ATOM 716 OD1 ASN A 49 -0.807 -12.596 -20.826 1.00 2.33 O ATOM 717 ND2 ASN A 49 -0.253 -14.588 -20.151 1.00 2.11 N ATOM 0 H ASN A 49 0.372 -12.720 -17.514 1.00 0.62 H new ATOM 0 HA ASN A 49 2.257 -11.064 -18.913 1.00 0.65 H new ATOM 0 HB2 ASN A 49 2.013 -12.616 -20.699 1.00 0.67 H new ATOM 0 HB3 ASN A 49 1.869 -13.547 -19.222 1.00 0.67 H new ATOM 0 HD21 ASN A 49 -1.143 -14.965 -20.477 1.00 2.11 H new ATOM 0 HD22 ASN A 49 0.430 -15.203 -19.709 1.00 2.11 H new ATOM 724 N ALA A 50 -0.894 -10.432 -19.468 1.00 0.59 N ATOM 725 CA ALA A 50 -1.798 -9.449 -20.133 1.00 0.60 C ATOM 726 C ALA A 50 -1.592 -8.068 -19.511 1.00 0.49 C ATOM 727 O ALA A 50 -1.545 -7.067 -20.201 1.00 0.51 O ATOM 728 CB ALA A 50 -3.252 -9.883 -19.943 1.00 0.69 C ATOM 0 H ALA A 50 -1.352 -11.064 -18.812 1.00 0.59 H new ATOM 0 HA ALA A 50 -1.569 -9.406 -21.198 1.00 0.60 H new ATOM 0 HB1 ALA A 50 -3.913 -9.165 -20.429 1.00 0.69 H new ATOM 0 HB2 ALA A 50 -3.399 -10.868 -20.386 1.00 0.69 H new ATOM 0 HB3 ALA A 50 -3.483 -9.926 -18.879 1.00 0.69 H new ATOM 734 N PHE A 51 -1.468 -8.011 -18.210 1.00 0.46 N ATOM 735 CA PHE A 51 -1.267 -6.703 -17.525 1.00 0.41 C ATOM 736 C PHE A 51 0.141 -6.179 -17.821 1.00 0.30 C ATOM 737 O PHE A 51 0.364 -4.985 -17.895 1.00 0.28 O ATOM 738 CB PHE A 51 -1.432 -6.896 -16.017 1.00 0.47 C ATOM 739 CG PHE A 51 -1.542 -5.551 -15.348 1.00 0.43 C ATOM 740 CD1 PHE A 51 -0.407 -4.745 -15.210 1.00 1.29 C ATOM 741 CD2 PHE A 51 -2.779 -5.109 -14.866 1.00 1.14 C ATOM 742 CE1 PHE A 51 -0.508 -3.495 -14.588 1.00 1.40 C ATOM 743 CE2 PHE A 51 -2.882 -3.860 -14.244 1.00 1.24 C ATOM 744 CZ PHE A 51 -1.746 -3.052 -14.105 1.00 0.85 C ATOM 0 H PHE A 51 -1.498 -8.821 -17.591 1.00 0.46 H new ATOM 0 HA PHE A 51 -2.002 -5.984 -17.887 1.00 0.41 H new ATOM 0 HB2 PHE A 51 -2.322 -7.491 -15.811 1.00 0.47 H new ATOM 0 HB3 PHE A 51 -0.581 -7.446 -15.615 1.00 0.47 H new ATOM 0 HD1 PHE A 51 0.547 -5.087 -15.583 1.00 1.29 H new ATOM 0 HD2 PHE A 51 -3.654 -5.732 -14.974 1.00 1.14 H new ATOM 0 HE1 PHE A 51 0.368 -2.873 -14.481 1.00 1.40 H new ATOM 0 HE2 PHE A 51 -3.837 -3.519 -13.871 1.00 1.24 H new ATOM 0 HZ PHE A 51 -1.825 -2.088 -13.625 1.00 0.85 H new ATOM 754 N LYS A 52 1.089 -7.064 -17.986 1.00 0.34 N ATOM 755 CA LYS A 52 2.489 -6.631 -18.273 1.00 0.30 C ATOM 756 C LYS A 52 2.530 -5.861 -19.598 1.00 0.31 C ATOM 757 O LYS A 52 3.079 -4.779 -19.678 1.00 0.40 O ATOM 758 CB LYS A 52 3.390 -7.863 -18.371 1.00 0.36 C ATOM 759 CG LYS A 52 4.849 -7.424 -18.525 1.00 0.85 C ATOM 760 CD LYS A 52 5.649 -8.539 -19.202 1.00 0.74 C ATOM 761 CE LYS A 52 5.156 -8.722 -20.638 1.00 0.88 C ATOM 762 NZ LYS A 52 6.232 -9.351 -21.456 1.00 1.12 N ATOM 0 H LYS A 52 0.953 -8.074 -17.934 1.00 0.34 H new ATOM 0 HA LYS A 52 2.840 -5.984 -17.470 1.00 0.30 H new ATOM 0 HB2 LYS A 52 3.278 -8.479 -17.479 1.00 0.36 H new ATOM 0 HB3 LYS A 52 3.093 -8.476 -19.222 1.00 0.36 H new ATOM 0 HG2 LYS A 52 4.904 -6.511 -19.118 1.00 0.85 H new ATOM 0 HG3 LYS A 52 5.276 -7.197 -17.548 1.00 0.85 H new ATOM 0 HD2 LYS A 52 6.711 -8.292 -19.200 1.00 0.74 H new ATOM 0 HD3 LYS A 52 5.537 -9.470 -18.646 1.00 0.74 H new ATOM 0 HE2 LYS A 52 4.263 -9.347 -20.650 1.00 0.88 H new ATOM 0 HE3 LYS A 52 4.877 -7.758 -21.064 1.00 0.88 H new ATOM 0 HZ1 LYS A 52 5.897 -9.476 -22.433 1.00 1.12 H new ATOM 0 HZ2 LYS A 52 7.073 -8.739 -21.454 1.00 1.12 H new ATOM 0 HZ3 LYS A 52 6.477 -10.278 -21.053 1.00 1.12 H new ATOM 776 N THR A 53 1.959 -6.418 -20.634 1.00 0.39 N ATOM 777 CA THR A 53 1.964 -5.731 -21.960 1.00 0.49 C ATOM 778 C THR A 53 0.956 -4.580 -21.953 1.00 0.38 C ATOM 779 O THR A 53 1.143 -3.577 -22.616 1.00 0.40 O ATOM 780 CB THR A 53 1.585 -6.733 -23.054 1.00 0.68 C ATOM 781 OG1 THR A 53 2.441 -7.864 -22.974 1.00 1.11 O ATOM 782 CG2 THR A 53 1.733 -6.074 -24.425 1.00 1.15 C ATOM 0 H THR A 53 1.488 -7.322 -20.619 1.00 0.39 H new ATOM 0 HA THR A 53 2.960 -5.334 -22.155 1.00 0.49 H new ATOM 0 HB THR A 53 0.551 -7.049 -22.916 1.00 0.68 H new ATOM 0 HG1 THR A 53 2.199 -8.507 -23.672 1.00 1.11 H new ATOM 0 HG21 THR A 53 1.463 -6.788 -25.203 1.00 1.15 H new ATOM 0 HG22 THR A 53 1.076 -5.207 -24.485 1.00 1.15 H new ATOM 0 HG23 THR A 53 2.766 -5.757 -24.567 1.00 1.15 H new ATOM 790 N LYS A 54 -0.116 -4.718 -21.213 1.00 0.33 N ATOM 791 CA LYS A 54 -1.151 -3.638 -21.164 1.00 0.29 C ATOM 792 C LYS A 54 -0.516 -2.323 -20.698 1.00 0.31 C ATOM 793 O LYS A 54 -0.801 -1.268 -21.231 1.00 0.42 O ATOM 794 CB LYS A 54 -2.259 -4.039 -20.189 1.00 0.34 C ATOM 795 CG LYS A 54 -3.471 -3.127 -20.393 1.00 0.87 C ATOM 796 CD LYS A 54 -4.436 -3.774 -21.388 1.00 0.47 C ATOM 797 CE LYS A 54 -5.021 -5.049 -20.778 1.00 0.57 C ATOM 798 NZ LYS A 54 -6.282 -5.406 -21.487 1.00 1.19 N ATOM 0 H LYS A 54 -0.320 -5.535 -20.638 1.00 0.33 H new ATOM 0 HA LYS A 54 -1.569 -3.500 -22.161 1.00 0.29 H new ATOM 0 HB2 LYS A 54 -2.542 -5.079 -20.351 1.00 0.34 H new ATOM 0 HB3 LYS A 54 -1.901 -3.962 -19.162 1.00 0.34 H new ATOM 0 HG2 LYS A 54 -3.974 -2.955 -19.442 1.00 0.87 H new ATOM 0 HG3 LYS A 54 -3.149 -2.154 -20.763 1.00 0.87 H new ATOM 0 HD2 LYS A 54 -5.237 -3.078 -21.639 1.00 0.47 H new ATOM 0 HD3 LYS A 54 -3.915 -4.008 -22.316 1.00 0.47 H new ATOM 0 HE2 LYS A 54 -4.303 -5.865 -20.857 1.00 0.57 H new ATOM 0 HE3 LYS A 54 -5.218 -4.900 -19.716 1.00 0.57 H new ATOM 0 HZ1 LYS A 54 -6.680 -6.273 -21.072 1.00 1.19 H new ATOM 0 HZ2 LYS A 54 -6.967 -4.630 -21.389 1.00 1.19 H new ATOM 0 HZ3 LYS A 54 -6.081 -5.565 -22.495 1.00 1.19 H new ATOM 812 N ILE A 55 0.344 -2.384 -19.712 1.00 0.28 N ATOM 813 CA ILE A 55 1.002 -1.140 -19.213 1.00 0.35 C ATOM 814 C ILE A 55 1.888 -0.569 -20.317 1.00 0.37 C ATOM 815 O ILE A 55 2.022 0.631 -20.448 1.00 0.37 O ATOM 816 CB ILE A 55 1.843 -1.469 -17.973 1.00 0.48 C ATOM 817 CG1 ILE A 55 0.917 -1.983 -16.861 1.00 0.50 C ATOM 818 CG2 ILE A 55 2.595 -0.221 -17.484 1.00 0.62 C ATOM 819 CD1 ILE A 55 -0.096 -0.900 -16.462 1.00 0.59 C ATOM 0 H ILE A 55 0.618 -3.241 -19.232 1.00 0.28 H new ATOM 0 HA ILE A 55 0.248 -0.402 -18.940 1.00 0.35 H new ATOM 0 HB ILE A 55 2.575 -2.234 -18.232 1.00 0.48 H new ATOM 0 HG12 ILE A 55 0.390 -2.874 -17.201 1.00 0.50 H new ATOM 0 HG13 ILE A 55 1.508 -2.274 -15.993 1.00 0.50 H new ATOM 0 HG21 ILE A 55 3.186 -0.474 -16.604 1.00 0.62 H new ATOM 0 HG22 ILE A 55 3.255 0.139 -18.273 1.00 0.62 H new ATOM 0 HG23 ILE A 55 1.878 0.559 -17.228 1.00 0.62 H new ATOM 0 HD11 ILE A 55 -0.744 -1.281 -15.673 1.00 0.59 H new ATOM 0 HD12 ILE A 55 0.436 -0.020 -16.101 1.00 0.59 H new ATOM 0 HD13 ILE A 55 -0.700 -0.629 -17.328 1.00 0.59 H new ATOM 831 N ALA A 56 2.482 -1.415 -21.123 1.00 0.45 N ATOM 832 CA ALA A 56 3.350 -0.918 -22.235 1.00 0.54 C ATOM 833 C ALA A 56 2.519 0.006 -23.128 1.00 0.49 C ATOM 834 O ALA A 56 3.003 0.991 -23.652 1.00 0.52 O ATOM 835 CB ALA A 56 3.860 -2.105 -23.055 1.00 0.67 C ATOM 0 H ALA A 56 2.403 -2.430 -21.058 1.00 0.45 H new ATOM 0 HA ALA A 56 4.203 -0.374 -21.829 1.00 0.54 H new ATOM 0 HB1 ALA A 56 4.493 -1.742 -23.865 1.00 0.67 H new ATOM 0 HB2 ALA A 56 4.438 -2.769 -22.413 1.00 0.67 H new ATOM 0 HB3 ALA A 56 3.013 -2.650 -23.472 1.00 0.67 H new ATOM 841 N GLU A 57 1.262 -0.312 -23.284 1.00 0.45 N ATOM 842 CA GLU A 57 0.362 0.532 -24.116 1.00 0.50 C ATOM 843 C GLU A 57 -0.042 1.782 -23.323 1.00 0.45 C ATOM 844 O GLU A 57 -0.182 2.858 -23.874 1.00 0.54 O ATOM 845 CB GLU A 57 -0.889 -0.273 -24.483 1.00 0.57 C ATOM 846 CG GLU A 57 -1.809 0.576 -25.363 1.00 0.69 C ATOM 847 CD GLU A 57 -3.118 -0.174 -25.613 1.00 1.00 C ATOM 848 OE1 GLU A 57 -3.059 -1.260 -26.166 1.00 1.88 O ATOM 849 OE2 GLU A 57 -4.157 0.349 -25.247 1.00 1.30 O ATOM 0 H GLU A 57 0.818 -1.129 -22.865 1.00 0.45 H new ATOM 0 HA GLU A 57 0.879 0.835 -25.027 1.00 0.50 H new ATOM 0 HB2 GLU A 57 -0.605 -1.184 -25.010 1.00 0.57 H new ATOM 0 HB3 GLU A 57 -1.415 -0.578 -23.578 1.00 0.57 H new ATOM 0 HG2 GLU A 57 -2.012 1.531 -24.878 1.00 0.69 H new ATOM 0 HG3 GLU A 57 -1.319 0.798 -26.311 1.00 0.69 H new ATOM 856 N VAL A 58 -0.247 1.640 -22.036 1.00 0.37 N ATOM 857 CA VAL A 58 -0.664 2.808 -21.203 1.00 0.43 C ATOM 858 C VAL A 58 0.529 3.733 -20.967 1.00 0.42 C ATOM 859 O VAL A 58 0.415 4.941 -21.064 1.00 0.42 O ATOM 860 CB VAL A 58 -1.196 2.311 -19.856 1.00 0.51 C ATOM 861 CG1 VAL A 58 -1.755 3.491 -19.057 1.00 0.61 C ATOM 862 CG2 VAL A 58 -2.306 1.282 -20.094 1.00 0.58 C ATOM 0 H VAL A 58 -0.143 0.763 -21.527 1.00 0.37 H new ATOM 0 HA VAL A 58 -1.446 3.358 -21.726 1.00 0.43 H new ATOM 0 HB VAL A 58 -0.384 1.848 -19.295 1.00 0.51 H new ATOM 0 HG11 VAL A 58 -2.133 3.135 -18.099 1.00 0.61 H new ATOM 0 HG12 VAL A 58 -0.965 4.222 -18.886 1.00 0.61 H new ATOM 0 HG13 VAL A 58 -2.566 3.958 -19.616 1.00 0.61 H new ATOM 0 HG21 VAL A 58 -2.685 0.928 -19.136 1.00 0.58 H new ATOM 0 HG22 VAL A 58 -3.117 1.745 -20.656 1.00 0.58 H new ATOM 0 HG23 VAL A 58 -1.907 0.440 -20.660 1.00 0.58 H new ATOM 872 N THR A 59 1.670 3.177 -20.653 1.00 0.47 N ATOM 873 CA THR A 59 2.877 4.023 -20.402 1.00 0.54 C ATOM 874 C THR A 59 3.208 4.835 -21.659 1.00 0.50 C ATOM 875 O THR A 59 3.618 5.978 -21.577 1.00 0.54 O ATOM 876 CB THR A 59 4.066 3.128 -20.033 1.00 0.68 C ATOM 877 OG1 THR A 59 5.224 3.933 -19.846 1.00 1.38 O ATOM 878 CG2 THR A 59 4.318 2.117 -21.153 1.00 1.46 C ATOM 0 H THR A 59 1.819 2.172 -20.559 1.00 0.47 H new ATOM 0 HA THR A 59 2.674 4.707 -19.578 1.00 0.54 H new ATOM 0 HB THR A 59 3.843 2.592 -19.110 1.00 0.68 H new ATOM 0 HG1 THR A 59 5.988 3.361 -19.624 1.00 1.38 H new ATOM 0 HG21 THR A 59 5.164 1.483 -20.887 1.00 1.46 H new ATOM 0 HG22 THR A 59 3.431 1.499 -21.292 1.00 1.46 H new ATOM 0 HG23 THR A 59 4.539 2.648 -22.079 1.00 1.46 H new ATOM 886 N THR A 60 3.026 4.253 -22.818 1.00 0.55 N ATOM 887 CA THR A 60 3.321 4.987 -24.083 1.00 0.62 C ATOM 888 C THR A 60 2.391 6.195 -24.190 1.00 0.49 C ATOM 889 O THR A 60 2.749 7.220 -24.738 1.00 0.50 O ATOM 890 CB THR A 60 3.096 4.061 -25.281 1.00 0.79 C ATOM 891 OG1 THR A 60 3.858 2.874 -25.109 1.00 0.99 O ATOM 892 CG2 THR A 60 3.534 4.769 -26.564 1.00 0.93 C ATOM 0 H THR A 60 2.685 3.300 -22.941 1.00 0.55 H new ATOM 0 HA THR A 60 4.359 5.321 -24.078 1.00 0.62 H new ATOM 0 HB THR A 60 2.038 3.807 -25.352 1.00 0.79 H new ATOM 0 HG1 THR A 60 3.377 2.260 -24.516 1.00 0.99 H new ATOM 0 HG21 THR A 60 3.374 4.109 -27.417 1.00 0.93 H new ATOM 0 HG22 THR A 60 2.949 5.680 -26.695 1.00 0.93 H new ATOM 0 HG23 THR A 60 4.592 5.024 -26.496 1.00 0.93 H new ATOM 900 N SER A 61 1.198 6.082 -23.659 1.00 0.41 N ATOM 901 CA SER A 61 0.234 7.219 -23.712 1.00 0.42 C ATOM 902 C SER A 61 0.832 8.426 -22.985 1.00 0.35 C ATOM 903 O SER A 61 0.580 9.561 -23.339 1.00 0.41 O ATOM 904 CB SER A 61 -1.074 6.810 -23.034 1.00 0.48 C ATOM 905 OG SER A 61 -2.165 7.425 -23.707 1.00 1.29 O ATOM 0 H SER A 61 0.851 5.246 -23.189 1.00 0.41 H new ATOM 0 HA SER A 61 0.036 7.482 -24.751 1.00 0.42 H new ATOM 0 HB2 SER A 61 -1.184 5.726 -23.054 1.00 0.48 H new ATOM 0 HB3 SER A 61 -1.063 7.110 -21.986 1.00 0.48 H new ATOM 0 HG SER A 61 -2.217 8.370 -23.451 1.00 1.29 H new ATOM 911 N LEU A 62 1.630 8.181 -21.975 1.00 0.33 N ATOM 912 CA LEU A 62 2.257 9.305 -21.223 1.00 0.46 C ATOM 913 C LEU A 62 3.335 9.947 -22.097 1.00 0.53 C ATOM 914 O LEU A 62 3.298 11.129 -22.380 1.00 0.63 O ATOM 915 CB LEU A 62 2.889 8.769 -19.933 1.00 0.54 C ATOM 916 CG LEU A 62 1.991 9.112 -18.747 1.00 0.97 C ATOM 917 CD1 LEU A 62 1.029 7.952 -18.481 1.00 1.43 C ATOM 918 CD2 LEU A 62 2.852 9.356 -17.505 1.00 1.38 C ATOM 0 H LEU A 62 1.873 7.249 -21.640 1.00 0.33 H new ATOM 0 HA LEU A 62 1.501 10.047 -20.968 1.00 0.46 H new ATOM 0 HB2 LEU A 62 3.022 7.689 -20.002 1.00 0.54 H new ATOM 0 HB3 LEU A 62 3.878 9.204 -19.792 1.00 0.54 H new ATOM 0 HG LEU A 62 1.420 10.012 -18.975 1.00 0.97 H new ATOM 0 HD11 LEU A 62 0.388 8.198 -17.634 1.00 1.43 H new ATOM 0 HD12 LEU A 62 0.413 7.780 -19.364 1.00 1.43 H new ATOM 0 HD13 LEU A 62 1.599 7.051 -18.255 1.00 1.43 H new ATOM 0 HD21 LEU A 62 2.209 9.601 -16.659 1.00 1.38 H new ATOM 0 HD22 LEU A 62 3.425 8.457 -17.277 1.00 1.38 H new ATOM 0 HD23 LEU A 62 3.535 10.184 -17.693 1.00 1.38 H new ATOM 930 N LYS A 63 4.288 9.165 -22.530 1.00 0.57 N ATOM 931 CA LYS A 63 5.374 9.706 -23.397 1.00 0.73 C ATOM 932 C LYS A 63 4.771 10.228 -24.700 1.00 0.66 C ATOM 933 O LYS A 63 5.273 11.161 -25.298 1.00 0.74 O ATOM 934 CB LYS A 63 6.380 8.598 -23.707 1.00 1.00 C ATOM 935 CG LYS A 63 7.520 8.659 -22.692 1.00 0.76 C ATOM 936 CD LYS A 63 8.085 7.255 -22.469 1.00 0.92 C ATOM 937 CE LYS A 63 9.256 7.018 -23.423 1.00 1.06 C ATOM 938 NZ LYS A 63 9.567 5.561 -23.475 1.00 1.41 N ATOM 0 H LYS A 63 4.361 8.170 -22.319 1.00 0.57 H new ATOM 0 HA LYS A 63 5.881 10.520 -22.879 1.00 0.73 H new ATOM 0 HB2 LYS A 63 5.892 7.624 -23.666 1.00 1.00 H new ATOM 0 HB3 LYS A 63 6.770 8.716 -24.718 1.00 1.00 H new ATOM 0 HG2 LYS A 63 8.305 9.325 -23.051 1.00 0.76 H new ATOM 0 HG3 LYS A 63 7.159 9.071 -21.749 1.00 0.76 H new ATOM 0 HD2 LYS A 63 8.416 7.145 -21.436 1.00 0.92 H new ATOM 0 HD3 LYS A 63 7.309 6.508 -22.637 1.00 0.92 H new ATOM 0 HE2 LYS A 63 9.007 7.383 -24.419 1.00 1.06 H new ATOM 0 HE3 LYS A 63 10.131 7.576 -23.088 1.00 1.06 H new ATOM 0 HZ1 LYS A 63 10.364 5.399 -24.124 1.00 1.41 H new ATOM 0 HZ2 LYS A 63 9.822 5.226 -22.524 1.00 1.41 H new ATOM 0 HZ3 LYS A 63 8.733 5.040 -23.814 1.00 1.41 H new ATOM 952 N GLN A 64 3.691 9.632 -25.140 1.00 0.65 N ATOM 953 CA GLN A 64 3.034 10.085 -26.405 1.00 0.79 C ATOM 954 C GLN A 64 2.671 11.569 -26.290 1.00 0.75 C ATOM 955 O GLN A 64 2.653 12.290 -27.270 1.00 0.88 O ATOM 956 CB GLN A 64 1.763 9.267 -26.642 1.00 1.05 C ATOM 957 CG GLN A 64 1.174 9.626 -28.008 1.00 1.23 C ATOM 958 CD GLN A 64 1.846 8.780 -29.092 1.00 1.42 C ATOM 959 OE1 GLN A 64 1.305 7.779 -29.519 1.00 2.27 O ATOM 960 NE2 GLN A 64 3.009 9.144 -29.558 1.00 1.79 N ATOM 0 H GLN A 64 3.234 8.847 -24.675 1.00 0.65 H new ATOM 0 HA GLN A 64 3.719 9.942 -27.240 1.00 0.79 H new ATOM 0 HB2 GLN A 64 1.990 8.202 -26.600 1.00 1.05 H new ATOM 0 HB3 GLN A 64 1.036 9.469 -25.856 1.00 1.05 H new ATOM 0 HG2 GLN A 64 0.098 9.450 -28.010 1.00 1.23 H new ATOM 0 HG3 GLN A 64 1.324 10.686 -28.214 1.00 1.23 H new ATOM 0 HE21 GLN A 64 3.462 9.984 -29.199 1.00 1.79 H new ATOM 0 HE22 GLN A 64 3.465 8.588 -30.282 1.00 1.79 H new ATOM 969 N GLU A 65 2.384 12.022 -25.096 1.00 0.79 N ATOM 970 CA GLU A 65 2.022 13.456 -24.902 1.00 1.09 C ATOM 971 C GLU A 65 3.267 14.324 -25.097 1.00 1.13 C ATOM 972 O GLU A 65 3.185 15.456 -25.535 1.00 1.34 O ATOM 973 CB GLU A 65 1.474 13.659 -23.488 1.00 1.34 C ATOM 974 CG GLU A 65 0.129 12.932 -23.345 1.00 1.54 C ATOM 975 CD GLU A 65 -0.868 13.826 -22.603 1.00 2.07 C ATOM 976 OE1 GLU A 65 -0.436 14.591 -21.756 1.00 2.95 O ATOM 977 OE2 GLU A 65 -2.049 13.731 -22.895 1.00 1.96 O ATOM 0 H GLU A 65 2.385 11.458 -24.246 1.00 0.79 H new ATOM 0 HA GLU A 65 1.261 13.741 -25.629 1.00 1.09 H new ATOM 0 HB2 GLU A 65 2.184 13.278 -22.754 1.00 1.34 H new ATOM 0 HB3 GLU A 65 1.347 14.723 -23.286 1.00 1.34 H new ATOM 0 HG2 GLU A 65 -0.262 12.675 -24.329 1.00 1.54 H new ATOM 0 HG3 GLU A 65 0.267 11.997 -22.802 1.00 1.54 H new ATOM 984 N ALA A 66 4.419 13.799 -24.767 1.00 1.03 N ATOM 985 CA ALA A 66 5.681 14.582 -24.921 1.00 1.29 C ATOM 986 C ALA A 66 6.069 14.716 -26.403 1.00 1.21 C ATOM 987 O ALA A 66 7.018 15.403 -26.733 1.00 1.42 O ATOM 988 CB ALA A 66 6.808 13.871 -24.168 1.00 1.47 C ATOM 0 H ALA A 66 4.540 12.857 -24.396 1.00 1.03 H new ATOM 0 HA ALA A 66 5.522 15.580 -24.513 1.00 1.29 H new ATOM 0 HB1 ALA A 66 7.733 14.438 -24.277 1.00 1.47 H new ATOM 0 HB2 ALA A 66 6.550 13.797 -23.112 1.00 1.47 H new ATOM 0 HB3 ALA A 66 6.945 12.871 -24.579 1.00 1.47 H new ATOM 994 N GLU A 67 5.360 14.064 -27.299 1.00 1.00 N ATOM 995 CA GLU A 67 5.712 14.160 -28.750 1.00 1.10 C ATOM 996 C GLU A 67 4.896 15.267 -29.428 1.00 1.21 C ATOM 997 O GLU A 67 4.681 15.237 -30.626 1.00 1.53 O ATOM 998 CB GLU A 67 5.404 12.826 -29.428 1.00 1.24 C ATOM 999 CG GLU A 67 6.382 11.762 -28.928 1.00 2.10 C ATOM 1000 CD GLU A 67 6.487 10.638 -29.961 1.00 2.89 C ATOM 1001 OE1 GLU A 67 5.450 10.173 -30.408 1.00 3.61 O ATOM 1002 OE2 GLU A 67 7.600 10.262 -30.287 1.00 3.06 O ATOM 0 H GLU A 67 4.557 13.473 -27.086 1.00 1.00 H new ATOM 0 HA GLU A 67 6.772 14.396 -28.842 1.00 1.10 H new ATOM 0 HB2 GLU A 67 4.379 12.524 -29.211 1.00 1.24 H new ATOM 0 HB3 GLU A 67 5.484 12.929 -30.510 1.00 1.24 H new ATOM 0 HG2 GLU A 67 7.363 12.206 -28.757 1.00 2.10 H new ATOM 0 HG3 GLU A 67 6.043 11.362 -27.973 1.00 2.10 H new ATOM 1009 N LYS A 68 4.440 16.241 -28.679 1.00 1.24 N ATOM 1010 CA LYS A 68 3.640 17.346 -29.288 1.00 1.41 C ATOM 1011 C LYS A 68 4.121 18.693 -28.739 1.00 1.35 C ATOM 1012 O LYS A 68 4.284 19.650 -29.472 1.00 1.83 O ATOM 1013 CB LYS A 68 2.162 17.155 -28.943 1.00 1.60 C ATOM 1014 CG LYS A 68 1.541 16.137 -29.901 1.00 1.73 C ATOM 1015 CD LYS A 68 0.462 15.338 -29.169 1.00 2.11 C ATOM 1016 CE LYS A 68 -0.774 16.217 -28.965 1.00 2.69 C ATOM 1017 NZ LYS A 68 -1.713 16.027 -30.107 1.00 3.26 N ATOM 0 H LYS A 68 4.588 16.318 -27.673 1.00 1.24 H new ATOM 0 HA LYS A 68 3.767 17.330 -30.370 1.00 1.41 H new ATOM 0 HB2 LYS A 68 2.060 16.811 -27.914 1.00 1.60 H new ATOM 0 HB3 LYS A 68 1.635 18.106 -29.015 1.00 1.60 H new ATOM 0 HG2 LYS A 68 1.109 16.648 -30.761 1.00 1.73 H new ATOM 0 HG3 LYS A 68 2.310 15.465 -30.283 1.00 1.73 H new ATOM 0 HD2 LYS A 68 0.199 14.450 -29.744 1.00 2.11 H new ATOM 0 HD3 LYS A 68 0.840 14.994 -28.206 1.00 2.11 H new ATOM 0 HE2 LYS A 68 -1.267 15.958 -28.028 1.00 2.69 H new ATOM 0 HE3 LYS A 68 -0.481 17.264 -28.892 1.00 2.69 H new ATOM 0 HZ1 LYS A 68 -2.553 16.624 -29.969 1.00 3.26 H new ATOM 0 HZ2 LYS A 68 -1.240 16.295 -30.994 1.00 3.26 H new ATOM 0 HZ3 LYS A 68 -2.002 15.029 -30.157 1.00 3.26 H new ATOM 1031 N HIS A 69 4.347 18.768 -27.454 1.00 1.00 N ATOM 1032 CA HIS A 69 4.817 20.045 -26.835 1.00 1.06 C ATOM 1033 C HIS A 69 5.248 19.768 -25.394 1.00 1.10 C ATOM 1034 O HIS A 69 6.266 20.249 -24.933 1.00 1.07 O ATOM 1035 CB HIS A 69 3.677 21.068 -26.840 1.00 1.46 C ATOM 1036 CG HIS A 69 3.795 21.948 -28.055 1.00 1.58 C ATOM 1037 ND1 HIS A 69 4.827 22.860 -28.210 1.00 2.13 N ATOM 1038 CD2 HIS A 69 3.016 22.067 -29.180 1.00 2.13 C ATOM 1039 CE1 HIS A 69 4.644 23.483 -29.389 1.00 2.82 C ATOM 1040 NE2 HIS A 69 3.554 23.037 -30.021 1.00 2.84 N ATOM 0 H HIS A 69 4.226 17.994 -26.801 1.00 1.00 H new ATOM 0 HA HIS A 69 5.658 20.443 -27.403 1.00 1.06 H new ATOM 0 HB2 HIS A 69 2.715 20.556 -26.841 1.00 1.46 H new ATOM 0 HB3 HIS A 69 3.714 21.674 -25.935 1.00 1.46 H new ATOM 0 HD2 HIS A 69 2.122 21.495 -29.381 1.00 2.13 H new ATOM 0 HE1 HIS A 69 5.298 24.250 -29.777 1.00 2.82 H new ATOM 0 HE2 HIS A 69 3.194 23.342 -30.925 1.00 2.84 H new ATOM 1048 N GLN A 70 4.480 18.980 -24.687 1.00 1.51 N ATOM 1049 CA GLN A 70 4.817 18.632 -23.271 1.00 1.88 C ATOM 1050 C GLN A 70 6.258 18.113 -23.178 1.00 1.57 C ATOM 1051 O GLN A 70 6.894 18.218 -22.149 1.00 1.48 O ATOM 1052 CB GLN A 70 3.855 17.551 -22.773 1.00 2.55 C ATOM 1053 CG GLN A 70 2.475 18.165 -22.538 1.00 2.84 C ATOM 1054 CD GLN A 70 1.431 17.052 -22.431 1.00 3.40 C ATOM 1055 OE1 GLN A 70 1.430 16.293 -21.482 1.00 4.09 O ATOM 1056 NE2 GLN A 70 0.535 16.923 -23.371 1.00 3.46 N ATOM 0 H GLN A 70 3.620 18.556 -25.035 1.00 1.51 H new ATOM 0 HA GLN A 70 4.723 19.526 -22.654 1.00 1.88 H new ATOM 0 HB2 GLN A 70 3.787 16.745 -23.504 1.00 2.55 H new ATOM 0 HB3 GLN A 70 4.231 17.112 -21.849 1.00 2.55 H new ATOM 0 HG2 GLN A 70 2.481 18.761 -21.625 1.00 2.84 H new ATOM 0 HG3 GLN A 70 2.221 18.839 -23.357 1.00 2.84 H new ATOM 0 HE21 GLN A 70 0.536 17.560 -24.167 1.00 3.46 H new ATOM 0 HE22 GLN A 70 -0.166 16.185 -23.309 1.00 3.46 H new ATOM 1065 N GLY A 71 6.758 17.531 -24.245 1.00 1.59 N ATOM 1066 CA GLY A 71 8.149 16.960 -24.258 1.00 1.63 C ATOM 1067 C GLY A 71 9.158 17.893 -23.571 1.00 1.20 C ATOM 1068 O GLY A 71 10.127 17.438 -22.991 1.00 1.22 O ATOM 0 H GLY A 71 6.252 17.425 -25.124 1.00 1.59 H new ATOM 0 HA2 GLY A 71 8.149 15.993 -23.756 1.00 1.63 H new ATOM 0 HA3 GLY A 71 8.460 16.785 -25.288 1.00 1.63 H new ATOM 1072 N SER A 72 8.939 19.186 -23.620 1.00 0.95 N ATOM 1073 CA SER A 72 9.892 20.131 -22.955 1.00 0.97 C ATOM 1074 C SER A 72 9.966 19.805 -21.457 1.00 0.92 C ATOM 1075 O SER A 72 10.997 19.400 -20.955 1.00 1.08 O ATOM 1076 CB SER A 72 9.399 21.567 -23.141 1.00 1.07 C ATOM 1077 OG SER A 72 9.273 21.844 -24.529 1.00 1.40 O ATOM 0 H SER A 72 8.147 19.625 -24.089 1.00 0.95 H new ATOM 0 HA SER A 72 10.881 20.027 -23.401 1.00 0.97 H new ATOM 0 HB2 SER A 72 8.439 21.701 -22.643 1.00 1.07 H new ATOM 0 HB3 SER A 72 10.097 22.266 -22.681 1.00 1.07 H new ATOM 0 HG SER A 72 8.956 22.763 -24.652 1.00 1.40 H new ATOM 1083 N VAL A 73 8.873 19.956 -20.751 1.00 0.99 N ATOM 1084 CA VAL A 73 8.865 19.632 -19.292 1.00 1.29 C ATOM 1085 C VAL A 73 8.796 18.113 -19.130 1.00 1.15 C ATOM 1086 O VAL A 73 9.462 17.531 -18.299 1.00 1.20 O ATOM 1087 CB VAL A 73 7.643 20.260 -18.615 1.00 1.71 C ATOM 1088 CG1 VAL A 73 7.813 20.193 -17.096 1.00 2.18 C ATOM 1089 CG2 VAL A 73 7.501 21.725 -19.042 1.00 2.09 C ATOM 0 H VAL A 73 7.984 20.290 -21.124 1.00 0.99 H new ATOM 0 HA VAL A 73 9.769 20.028 -18.830 1.00 1.29 H new ATOM 0 HB VAL A 73 6.750 19.711 -18.913 1.00 1.71 H new ATOM 0 HG11 VAL A 73 6.944 20.640 -16.613 1.00 2.18 H new ATOM 0 HG12 VAL A 73 7.906 19.152 -16.786 1.00 2.18 H new ATOM 0 HG13 VAL A 73 8.710 20.739 -16.806 1.00 2.18 H new ATOM 0 HG21 VAL A 73 6.629 22.163 -18.556 1.00 2.09 H new ATOM 0 HG22 VAL A 73 8.395 22.277 -18.751 1.00 2.09 H new ATOM 0 HG23 VAL A 73 7.378 21.778 -20.124 1.00 2.09 H new ATOM 1099 N ALA A 74 7.983 17.475 -19.933 1.00 1.09 N ATOM 1100 CA ALA A 74 7.825 15.988 -19.872 1.00 1.18 C ATOM 1101 C ALA A 74 9.190 15.295 -19.869 1.00 0.95 C ATOM 1102 O ALA A 74 9.329 14.202 -19.363 1.00 0.96 O ATOM 1103 CB ALA A 74 7.019 15.511 -21.080 1.00 1.35 C ATOM 0 H ALA A 74 7.410 17.931 -20.643 1.00 1.09 H new ATOM 0 HA ALA A 74 7.302 15.734 -18.950 1.00 1.18 H new ATOM 0 HB1 ALA A 74 6.904 14.428 -21.036 1.00 1.35 H new ATOM 0 HB2 ALA A 74 6.036 15.981 -21.070 1.00 1.35 H new ATOM 0 HB3 ALA A 74 7.542 15.783 -21.997 1.00 1.35 H new ATOM 1109 N GLU A 75 10.190 15.916 -20.456 1.00 0.81 N ATOM 1110 CA GLU A 75 11.562 15.302 -20.521 1.00 0.79 C ATOM 1111 C GLU A 75 11.961 14.683 -19.170 1.00 0.73 C ATOM 1112 O GLU A 75 12.559 13.625 -19.123 1.00 0.76 O ATOM 1113 CB GLU A 75 12.576 16.383 -20.896 1.00 0.89 C ATOM 1114 CG GLU A 75 13.922 15.730 -21.211 1.00 1.32 C ATOM 1115 CD GLU A 75 15.033 16.777 -21.119 1.00 1.86 C ATOM 1116 OE1 GLU A 75 14.893 17.816 -21.744 1.00 2.22 O ATOM 1117 OE2 GLU A 75 16.004 16.524 -20.425 1.00 2.46 O ATOM 0 H GLU A 75 10.114 16.832 -20.898 1.00 0.81 H new ATOM 0 HA GLU A 75 11.550 14.511 -21.271 1.00 0.79 H new ATOM 0 HB2 GLU A 75 12.221 16.946 -21.760 1.00 0.89 H new ATOM 0 HB3 GLU A 75 12.687 17.093 -20.076 1.00 0.89 H new ATOM 0 HG2 GLU A 75 14.116 14.917 -20.512 1.00 1.32 H new ATOM 0 HG3 GLU A 75 13.901 15.294 -22.210 1.00 1.32 H new ATOM 1124 N GLN A 76 11.614 15.322 -18.078 1.00 0.76 N ATOM 1125 CA GLN A 76 11.955 14.750 -16.742 1.00 0.84 C ATOM 1126 C GLN A 76 10.998 13.586 -16.453 1.00 0.77 C ATOM 1127 O GLN A 76 11.376 12.582 -15.881 1.00 0.79 O ATOM 1128 CB GLN A 76 11.826 15.831 -15.656 1.00 1.01 C ATOM 1129 CG GLN A 76 10.369 16.293 -15.527 1.00 1.31 C ATOM 1130 CD GLN A 76 10.326 17.696 -14.920 1.00 1.68 C ATOM 1131 OE1 GLN A 76 9.763 17.896 -13.863 1.00 2.05 O ATOM 1132 NE2 GLN A 76 10.904 18.684 -15.549 1.00 1.67 N ATOM 0 H GLN A 76 11.112 16.210 -18.056 1.00 0.76 H new ATOM 0 HA GLN A 76 12.984 14.390 -16.742 1.00 0.84 H new ATOM 0 HB2 GLN A 76 12.175 15.439 -14.701 1.00 1.01 H new ATOM 0 HB3 GLN A 76 12.462 16.681 -15.903 1.00 1.01 H new ATOM 0 HG2 GLN A 76 9.890 16.295 -16.506 1.00 1.31 H new ATOM 0 HG3 GLN A 76 9.811 15.598 -14.900 1.00 1.31 H new ATOM 0 HE21 GLN A 76 11.377 18.516 -16.437 1.00 1.67 H new ATOM 0 HE22 GLN A 76 10.882 19.623 -15.152 1.00 1.67 H new ATOM 1141 N LEU A 77 9.760 13.727 -16.857 1.00 0.77 N ATOM 1142 CA LEU A 77 8.758 12.646 -16.626 1.00 0.79 C ATOM 1143 C LEU A 77 9.074 11.462 -17.542 1.00 0.63 C ATOM 1144 O LEU A 77 8.824 10.321 -17.204 1.00 0.58 O ATOM 1145 CB LEU A 77 7.355 13.177 -16.939 1.00 0.99 C ATOM 1146 CG LEU A 77 6.313 12.109 -16.599 1.00 1.11 C ATOM 1147 CD1 LEU A 77 5.018 12.786 -16.149 1.00 1.44 C ATOM 1148 CD2 LEU A 77 6.038 11.254 -17.838 1.00 0.98 C ATOM 0 H LEU A 77 9.400 14.550 -17.340 1.00 0.77 H new ATOM 0 HA LEU A 77 8.799 12.323 -15.586 1.00 0.79 H new ATOM 0 HB2 LEU A 77 7.162 14.083 -16.365 1.00 0.99 H new ATOM 0 HB3 LEU A 77 7.284 13.446 -17.993 1.00 0.99 H new ATOM 0 HG LEU A 77 6.689 11.475 -15.796 1.00 1.11 H new ATOM 0 HD11 LEU A 77 4.275 12.026 -15.907 1.00 1.44 H new ATOM 0 HD12 LEU A 77 5.214 13.396 -15.267 1.00 1.44 H new ATOM 0 HD13 LEU A 77 4.640 13.419 -16.952 1.00 1.44 H new ATOM 0 HD21 LEU A 77 5.296 10.493 -17.597 1.00 0.98 H new ATOM 0 HD22 LEU A 77 5.661 11.887 -18.641 1.00 0.98 H new ATOM 0 HD23 LEU A 77 6.961 10.772 -18.160 1.00 0.98 H new ATOM 1160 N ASN A 78 9.624 11.727 -18.705 1.00 0.67 N ATOM 1161 CA ASN A 78 9.964 10.627 -19.662 1.00 0.75 C ATOM 1162 C ASN A 78 10.797 9.556 -18.950 1.00 0.66 C ATOM 1163 O ASN A 78 10.710 8.384 -19.258 1.00 0.70 O ATOM 1164 CB ASN A 78 10.768 11.201 -20.830 1.00 1.02 C ATOM 1165 CG ASN A 78 9.813 11.648 -21.938 1.00 1.29 C ATOM 1166 OD1 ASN A 78 10.061 11.411 -23.103 1.00 2.11 O ATOM 1167 ND2 ASN A 78 8.720 12.289 -21.621 1.00 1.49 N ATOM 0 H ASN A 78 9.853 12.665 -19.033 1.00 0.67 H new ATOM 0 HA ASN A 78 9.043 10.178 -20.034 1.00 0.75 H new ATOM 0 HB2 ASN A 78 11.369 12.045 -20.491 1.00 1.02 H new ATOM 0 HB3 ASN A 78 11.460 10.450 -21.213 1.00 1.02 H new ATOM 0 HD21 ASN A 78 8.075 12.590 -22.352 1.00 1.49 H new ATOM 0 HD22 ASN A 78 8.511 12.488 -20.643 1.00 1.49 H new ATOM 1174 N ALA A 79 11.589 9.959 -17.989 1.00 0.72 N ATOM 1175 CA ALA A 79 12.419 8.976 -17.238 1.00 0.88 C ATOM 1176 C ALA A 79 11.501 8.144 -16.341 1.00 0.77 C ATOM 1177 O ALA A 79 11.752 6.981 -16.093 1.00 0.86 O ATOM 1178 CB ALA A 79 13.441 9.721 -16.376 1.00 1.08 C ATOM 0 H ALA A 79 11.695 10.929 -17.693 1.00 0.72 H new ATOM 0 HA ALA A 79 12.948 8.325 -17.935 1.00 0.88 H new ATOM 0 HB1 ALA A 79 14.048 9.001 -15.827 1.00 1.08 H new ATOM 0 HB2 ALA A 79 14.085 10.325 -17.015 1.00 1.08 H new ATOM 0 HB3 ALA A 79 12.919 10.368 -15.671 1.00 1.08 H new ATOM 1184 N PHE A 80 10.437 8.736 -15.859 1.00 0.66 N ATOM 1185 CA PHE A 80 9.490 7.987 -14.980 1.00 0.67 C ATOM 1186 C PHE A 80 8.646 7.031 -15.828 1.00 0.54 C ATOM 1187 O PHE A 80 8.352 5.923 -15.419 1.00 0.59 O ATOM 1188 CB PHE A 80 8.572 8.977 -14.262 1.00 0.77 C ATOM 1189 CG PHE A 80 9.297 9.570 -13.077 1.00 0.91 C ATOM 1190 CD1 PHE A 80 9.359 8.864 -11.870 1.00 1.83 C ATOM 1191 CD2 PHE A 80 9.908 10.825 -13.188 1.00 1.58 C ATOM 1192 CE1 PHE A 80 10.032 9.414 -10.772 1.00 2.41 C ATOM 1193 CE2 PHE A 80 10.580 11.374 -12.089 1.00 2.24 C ATOM 1194 CZ PHE A 80 10.642 10.669 -10.882 1.00 2.41 C ATOM 0 H PHE A 80 10.184 9.708 -16.037 1.00 0.66 H new ATOM 0 HA PHE A 80 10.055 7.414 -14.245 1.00 0.67 H new ATOM 0 HB2 PHE A 80 8.266 9.768 -14.947 1.00 0.77 H new ATOM 0 HB3 PHE A 80 7.664 8.473 -13.931 1.00 0.77 H new ATOM 0 HD1 PHE A 80 8.888 7.896 -11.786 1.00 1.83 H new ATOM 0 HD2 PHE A 80 9.861 11.369 -14.120 1.00 1.58 H new ATOM 0 HE1 PHE A 80 10.080 8.870 -9.840 1.00 2.41 H new ATOM 0 HE2 PHE A 80 11.051 12.342 -12.173 1.00 2.24 H new ATOM 0 HZ PHE A 80 11.161 11.093 -10.035 1.00 2.41 H new ATOM 1204 N ALA A 81 8.249 7.455 -17.002 1.00 0.44 N ATOM 1205 CA ALA A 81 7.415 6.579 -17.881 1.00 0.43 C ATOM 1206 C ALA A 81 8.240 5.378 -18.356 1.00 0.42 C ATOM 1207 O ALA A 81 7.763 4.258 -18.371 1.00 0.41 O ATOM 1208 CB ALA A 81 6.940 7.382 -19.095 1.00 0.54 C ATOM 0 H ALA A 81 8.467 8.373 -17.390 1.00 0.44 H new ATOM 0 HA ALA A 81 6.554 6.221 -17.317 1.00 0.43 H new ATOM 0 HB1 ALA A 81 6.332 6.745 -19.737 1.00 0.54 H new ATOM 0 HB2 ALA A 81 6.346 8.232 -18.759 1.00 0.54 H new ATOM 0 HB3 ALA A 81 7.804 7.742 -19.654 1.00 0.54 H new ATOM 1214 N ARG A 82 9.468 5.603 -18.749 1.00 0.58 N ATOM 1215 CA ARG A 82 10.326 4.480 -19.233 1.00 0.72 C ATOM 1216 C ARG A 82 10.546 3.466 -18.105 1.00 0.72 C ATOM 1217 O ARG A 82 10.695 2.283 -18.345 1.00 0.77 O ATOM 1218 CB ARG A 82 11.678 5.025 -19.704 1.00 0.91 C ATOM 1219 CG ARG A 82 12.358 5.787 -18.565 1.00 1.69 C ATOM 1220 CD ARG A 82 13.755 6.227 -19.006 1.00 1.79 C ATOM 1221 NE ARG A 82 14.520 5.042 -19.486 1.00 2.50 N ATOM 1222 CZ ARG A 82 15.499 5.198 -20.335 1.00 3.07 C ATOM 1223 NH1 ARG A 82 16.673 5.582 -19.914 1.00 3.20 N ATOM 1224 NH2 ARG A 82 15.305 4.969 -21.605 1.00 3.92 N ATOM 0 H ARG A 82 9.915 6.520 -18.755 1.00 0.58 H new ATOM 0 HA ARG A 82 9.826 3.986 -20.066 1.00 0.72 H new ATOM 0 HB2 ARG A 82 12.315 4.205 -20.036 1.00 0.91 H new ATOM 0 HB3 ARG A 82 11.536 5.684 -20.560 1.00 0.91 H new ATOM 0 HG2 ARG A 82 11.762 6.657 -18.289 1.00 1.69 H new ATOM 0 HG3 ARG A 82 12.427 5.154 -17.680 1.00 1.69 H new ATOM 0 HD2 ARG A 82 13.680 6.971 -19.799 1.00 1.79 H new ATOM 0 HD3 ARG A 82 14.279 6.699 -18.175 1.00 1.79 H new ATOM 0 HE ARG A 82 14.279 4.109 -19.151 1.00 2.50 H new ATOM 0 HH11 ARG A 82 16.826 5.760 -18.921 1.00 3.20 H new ATOM 0 HH12 ARG A 82 17.438 5.704 -20.578 1.00 3.20 H new ATOM 0 HH21 ARG A 82 14.388 4.668 -21.935 1.00 3.92 H new ATOM 0 HH22 ARG A 82 16.070 5.091 -22.268 1.00 3.92 H new ATOM 1238 N ASN A 83 10.572 3.921 -16.875 1.00 0.73 N ATOM 1239 CA ASN A 83 10.787 2.990 -15.725 1.00 0.83 C ATOM 1240 C ASN A 83 9.688 1.925 -15.708 1.00 0.77 C ATOM 1241 O ASN A 83 9.907 0.802 -15.297 1.00 0.84 O ATOM 1242 CB ASN A 83 10.750 3.779 -14.415 1.00 0.91 C ATOM 1243 CG ASN A 83 11.868 4.821 -14.413 1.00 0.96 C ATOM 1244 OD1 ASN A 83 12.869 4.658 -15.085 1.00 1.28 O ATOM 1245 ND2 ASN A 83 11.742 5.894 -13.682 1.00 1.64 N ATOM 0 H ASN A 83 10.453 4.901 -16.619 1.00 0.73 H new ATOM 0 HA ASN A 83 11.757 2.505 -15.833 1.00 0.83 H new ATOM 0 HB2 ASN A 83 9.783 4.268 -14.301 1.00 0.91 H new ATOM 0 HB3 ASN A 83 10.867 3.103 -13.568 1.00 0.91 H new ATOM 0 HD21 ASN A 83 12.482 6.596 -13.674 1.00 1.64 H new ATOM 0 HD22 ASN A 83 10.903 6.031 -13.118 1.00 1.64 H new ATOM 1252 N LEU A 84 8.509 2.275 -16.154 1.00 0.74 N ATOM 1253 CA LEU A 84 7.388 1.292 -16.169 1.00 0.75 C ATOM 1254 C LEU A 84 7.690 0.198 -17.191 1.00 0.68 C ATOM 1255 O LEU A 84 7.498 -0.975 -16.930 1.00 0.65 O ATOM 1256 CB LEU A 84 6.085 2.005 -16.540 1.00 0.90 C ATOM 1257 CG LEU A 84 5.861 3.195 -15.600 1.00 0.61 C ATOM 1258 CD1 LEU A 84 4.582 3.929 -16.002 1.00 1.35 C ATOM 1259 CD2 LEU A 84 5.730 2.697 -14.158 1.00 0.97 C ATOM 0 H LEU A 84 8.275 3.202 -16.509 1.00 0.74 H new ATOM 0 HA LEU A 84 7.280 0.844 -15.181 1.00 0.75 H new ATOM 0 HB2 LEU A 84 6.129 2.349 -17.573 1.00 0.90 H new ATOM 0 HB3 LEU A 84 5.247 1.311 -16.470 1.00 0.90 H new ATOM 0 HG LEU A 84 6.710 3.875 -15.672 1.00 0.61 H new ATOM 0 HD11 LEU A 84 4.423 4.775 -15.334 1.00 1.35 H new ATOM 0 HD12 LEU A 84 4.676 4.289 -17.027 1.00 1.35 H new ATOM 0 HD13 LEU A 84 3.734 3.247 -15.933 1.00 1.35 H new ATOM 0 HD21 LEU A 84 5.571 3.546 -13.493 1.00 0.97 H new ATOM 0 HD22 LEU A 84 4.883 2.015 -14.084 1.00 0.97 H new ATOM 0 HD23 LEU A 84 6.642 2.176 -13.869 1.00 0.97 H new ATOM 1271 N ASN A 85 8.179 0.570 -18.348 1.00 0.71 N ATOM 1272 CA ASN A 85 8.514 -0.447 -19.388 1.00 0.75 C ATOM 1273 C ASN A 85 9.600 -1.378 -18.842 1.00 0.67 C ATOM 1274 O ASN A 85 9.657 -2.547 -19.172 1.00 0.74 O ATOM 1275 CB ASN A 85 9.029 0.256 -20.646 1.00 0.86 C ATOM 1276 CG ASN A 85 9.008 -0.720 -21.824 1.00 1.11 C ATOM 1277 OD1 ASN A 85 8.198 -0.592 -22.719 1.00 1.64 O ATOM 1278 ND2 ASN A 85 9.870 -1.699 -21.859 1.00 1.19 N ATOM 0 H ASN A 85 8.361 1.537 -18.616 1.00 0.71 H new ATOM 0 HA ASN A 85 7.624 -1.024 -19.639 1.00 0.75 H new ATOM 0 HB2 ASN A 85 8.409 1.124 -20.869 1.00 0.86 H new ATOM 0 HB3 ASN A 85 10.043 0.622 -20.481 1.00 0.86 H new ATOM 0 HD21 ASN A 85 9.863 -2.357 -22.638 1.00 1.19 H new ATOM 0 HD22 ASN A 85 10.551 -1.806 -21.107 1.00 1.19 H new ATOM 1285 N ASN A 86 10.458 -0.860 -18.002 1.00 0.62 N ATOM 1286 CA ASN A 86 11.542 -1.694 -17.413 1.00 0.66 C ATOM 1287 C ASN A 86 10.952 -2.580 -16.316 1.00 0.55 C ATOM 1288 O ASN A 86 11.335 -3.723 -16.156 1.00 0.53 O ATOM 1289 CB ASN A 86 12.618 -0.787 -16.813 1.00 0.84 C ATOM 1290 CG ASN A 86 13.468 -0.190 -17.937 1.00 1.13 C ATOM 1291 OD1 ASN A 86 14.662 -0.408 -17.992 1.00 2.04 O ATOM 1292 ND2 ASN A 86 12.899 0.558 -18.842 1.00 1.61 N ATOM 0 H ASN A 86 10.452 0.114 -17.698 1.00 0.62 H new ATOM 0 HA ASN A 86 11.988 -2.317 -18.189 1.00 0.66 H new ATOM 0 HB2 ASN A 86 12.154 0.010 -16.231 1.00 0.84 H new ATOM 0 HB3 ASN A 86 13.248 -1.356 -16.129 1.00 0.84 H new ATOM 0 HD21 ASN A 86 13.457 0.960 -19.596 1.00 1.61 H new ATOM 0 HD22 ASN A 86 11.897 0.741 -18.796 1.00 1.61 H new ATOM 1299 N SER A 87 10.021 -2.055 -15.557 1.00 0.58 N ATOM 1300 CA SER A 87 9.401 -2.854 -14.463 1.00 0.64 C ATOM 1301 C SER A 87 8.533 -3.960 -15.065 1.00 0.64 C ATOM 1302 O SER A 87 8.519 -5.077 -14.581 1.00 0.70 O ATOM 1303 CB SER A 87 8.534 -1.942 -13.595 1.00 0.77 C ATOM 1304 OG SER A 87 9.372 -1.088 -12.827 1.00 1.61 O ATOM 0 H SER A 87 9.665 -1.104 -15.651 1.00 0.58 H new ATOM 0 HA SER A 87 10.185 -3.301 -13.852 1.00 0.64 H new ATOM 0 HB2 SER A 87 7.868 -1.349 -14.222 1.00 0.77 H new ATOM 0 HB3 SER A 87 7.903 -2.539 -12.937 1.00 0.77 H new ATOM 0 HG SER A 87 9.703 -0.359 -13.393 1.00 1.61 H new ATOM 1310 N ILE A 88 7.808 -3.659 -16.113 1.00 0.67 N ATOM 1311 CA ILE A 88 6.937 -4.700 -16.744 1.00 0.81 C ATOM 1312 C ILE A 88 7.796 -5.671 -17.555 1.00 0.77 C ATOM 1313 O ILE A 88 7.477 -6.838 -17.674 1.00 0.87 O ATOM 1314 CB ILE A 88 5.891 -4.047 -17.657 1.00 0.95 C ATOM 1315 CG1 ILE A 88 6.564 -3.028 -18.596 1.00 0.91 C ATOM 1316 CG2 ILE A 88 4.841 -3.342 -16.795 1.00 1.08 C ATOM 1317 CD1 ILE A 88 6.275 -3.398 -20.055 1.00 1.04 C ATOM 0 H ILE A 88 7.781 -2.742 -16.558 1.00 0.67 H new ATOM 0 HA ILE A 88 6.419 -5.245 -15.955 1.00 0.81 H new ATOM 0 HB ILE A 88 5.413 -4.817 -18.263 1.00 0.95 H new ATOM 0 HG12 ILE A 88 6.193 -2.025 -18.385 1.00 0.91 H new ATOM 0 HG13 ILE A 88 7.640 -3.013 -18.421 1.00 0.91 H new ATOM 0 HG21 ILE A 88 4.095 -2.876 -17.439 1.00 1.08 H new ATOM 0 HG22 ILE A 88 4.356 -4.070 -16.145 1.00 1.08 H new ATOM 0 HG23 ILE A 88 5.324 -2.577 -16.187 1.00 1.08 H new ATOM 0 HD11 ILE A 88 6.753 -2.674 -20.715 1.00 1.04 H new ATOM 0 HD12 ILE A 88 6.668 -4.393 -20.263 1.00 1.04 H new ATOM 0 HD13 ILE A 88 5.199 -3.390 -20.226 1.00 1.04 H new ATOM 1329 N HIS A 89 8.887 -5.200 -18.109 1.00 0.69 N ATOM 1330 CA HIS A 89 9.777 -6.095 -18.913 1.00 0.75 C ATOM 1331 C HIS A 89 10.246 -7.265 -18.043 1.00 0.70 C ATOM 1332 O HIS A 89 10.471 -8.358 -18.526 1.00 0.82 O ATOM 1333 CB HIS A 89 10.991 -5.303 -19.402 1.00 0.75 C ATOM 1334 CG HIS A 89 11.794 -6.148 -20.352 1.00 1.03 C ATOM 1335 ND1 HIS A 89 11.232 -6.733 -21.477 1.00 1.51 N ATOM 1336 CD2 HIS A 89 13.116 -6.517 -20.361 1.00 1.48 C ATOM 1337 CE1 HIS A 89 12.206 -7.416 -22.108 1.00 1.63 C ATOM 1338 NE2 HIS A 89 13.374 -7.317 -21.469 1.00 1.62 N ATOM 0 H HIS A 89 9.200 -4.232 -18.039 1.00 0.69 H new ATOM 0 HA HIS A 89 9.225 -6.479 -19.771 1.00 0.75 H new ATOM 0 HB2 HIS A 89 10.666 -4.389 -19.898 1.00 0.75 H new ATOM 0 HB3 HIS A 89 11.608 -5.004 -18.555 1.00 0.75 H new ATOM 0 HD2 HIS A 89 13.846 -6.229 -19.619 1.00 1.48 H new ATOM 0 HE1 HIS A 89 12.060 -7.976 -23.020 1.00 1.63 H new ATOM 0 HE2 HIS A 89 14.264 -7.738 -21.736 1.00 1.62 H new ATOM 1346 N ASP A 90 10.390 -7.035 -16.764 1.00 0.61 N ATOM 1347 CA ASP A 90 10.841 -8.123 -15.847 1.00 0.65 C ATOM 1348 C ASP A 90 9.820 -8.288 -14.719 1.00 0.63 C ATOM 1349 O ASP A 90 10.174 -8.508 -13.575 1.00 0.65 O ATOM 1350 CB ASP A 90 12.204 -7.759 -15.255 1.00 0.74 C ATOM 1351 CG ASP A 90 13.185 -7.445 -16.385 1.00 1.46 C ATOM 1352 OD1 ASP A 90 13.054 -6.389 -16.982 1.00 2.46 O ATOM 1353 OD2 ASP A 90 14.053 -8.266 -16.635 1.00 1.71 O ATOM 0 H ASP A 90 10.214 -6.137 -16.314 1.00 0.61 H new ATOM 0 HA ASP A 90 10.926 -9.058 -16.401 1.00 0.65 H new ATOM 0 HB2 ASP A 90 12.107 -6.898 -14.594 1.00 0.74 H new ATOM 0 HB3 ASP A 90 12.581 -8.584 -14.650 1.00 0.74 H new ATOM 1358 N ALA A 91 8.554 -8.183 -15.036 1.00 0.63 N ATOM 1359 CA ALA A 91 7.499 -8.331 -13.990 1.00 0.65 C ATOM 1360 C ALA A 91 7.015 -9.781 -13.957 1.00 0.61 C ATOM 1361 O ALA A 91 6.837 -10.362 -12.903 1.00 0.63 O ATOM 1362 CB ALA A 91 6.323 -7.408 -14.317 1.00 0.72 C ATOM 0 H ALA A 91 8.206 -8.001 -15.977 1.00 0.63 H new ATOM 0 HA ALA A 91 7.911 -8.063 -13.017 1.00 0.65 H new ATOM 0 HB1 ALA A 91 5.553 -7.516 -13.554 1.00 0.72 H new ATOM 0 HB2 ALA A 91 6.668 -6.374 -14.341 1.00 0.72 H new ATOM 0 HB3 ALA A 91 5.910 -7.676 -15.290 1.00 0.72 H new ATOM 1368 N ALA A 92 6.804 -10.368 -15.108 1.00 0.62 N ATOM 1369 CA ALA A 92 6.334 -11.783 -15.158 1.00 0.69 C ATOM 1370 C ALA A 92 7.343 -12.621 -15.943 1.00 0.73 C ATOM 1371 O ALA A 92 6.982 -13.538 -16.656 1.00 0.86 O ATOM 1372 CB ALA A 92 4.971 -11.843 -15.853 1.00 0.76 C ATOM 0 H ALA A 92 6.938 -9.925 -16.017 1.00 0.62 H new ATOM 0 HA ALA A 92 6.242 -12.175 -14.145 1.00 0.69 H new ATOM 0 HB1 ALA A 92 4.627 -12.877 -15.890 1.00 0.76 H new ATOM 0 HB2 ALA A 92 4.252 -11.241 -15.297 1.00 0.76 H new ATOM 0 HB3 ALA A 92 5.062 -11.454 -16.867 1.00 0.76 H new ATOM 1378 N THR A 93 8.607 -12.308 -15.816 1.00 0.72 N ATOM 1379 CA THR A 93 9.654 -13.075 -16.551 1.00 0.84 C ATOM 1380 C THR A 93 10.338 -14.051 -15.592 1.00 1.03 C ATOM 1381 O THR A 93 10.718 -15.143 -15.973 1.00 1.09 O ATOM 1382 CB THR A 93 10.692 -12.103 -17.118 1.00 0.88 C ATOM 1383 OG1 THR A 93 11.401 -11.493 -16.048 1.00 1.18 O ATOM 1384 CG2 THR A 93 9.988 -11.024 -17.944 1.00 1.05 C ATOM 0 H THR A 93 8.959 -11.550 -15.231 1.00 0.72 H new ATOM 0 HA THR A 93 9.193 -13.632 -17.367 1.00 0.84 H new ATOM 0 HB THR A 93 11.389 -12.648 -17.755 1.00 0.88 H new ATOM 0 HG1 THR A 93 12.168 -10.997 -16.404 1.00 1.18 H new ATOM 0 HG21 THR A 93 10.729 -10.333 -18.347 1.00 1.05 H new ATOM 0 HG22 THR A 93 9.444 -11.491 -18.765 1.00 1.05 H new ATOM 0 HG23 THR A 93 9.290 -10.478 -17.310 1.00 1.05 H new ATOM 1392 N SER A 94 10.496 -13.664 -14.352 1.00 1.18 N ATOM 1393 CA SER A 94 11.155 -14.563 -13.358 1.00 1.42 C ATOM 1394 C SER A 94 10.149 -15.602 -12.865 1.00 1.06 C ATOM 1395 O SER A 94 9.232 -15.292 -12.127 1.00 1.93 O ATOM 1396 CB SER A 94 11.658 -13.735 -12.176 1.00 2.15 C ATOM 1397 OG SER A 94 12.850 -13.057 -12.552 1.00 2.81 O ATOM 0 H SER A 94 10.196 -12.761 -13.984 1.00 1.18 H new ATOM 0 HA SER A 94 11.997 -15.070 -13.829 1.00 1.42 H new ATOM 0 HB2 SER A 94 10.898 -13.016 -11.871 1.00 2.15 H new ATOM 0 HB3 SER A 94 11.848 -14.381 -11.319 1.00 2.15 H new ATOM 0 HG SER A 94 13.175 -12.524 -11.797 1.00 2.81 H new ATOM 1403 N LEU A 95 10.320 -16.833 -13.271 1.00 0.85 N ATOM 1404 CA LEU A 95 9.386 -17.908 -12.836 1.00 1.27 C ATOM 1405 C LEU A 95 10.135 -18.892 -11.933 1.00 1.17 C ATOM 1406 O LEU A 95 10.232 -20.072 -12.222 1.00 1.76 O ATOM 1407 CB LEU A 95 8.840 -18.641 -14.067 1.00 1.92 C ATOM 1408 CG LEU A 95 10.003 -19.117 -14.943 1.00 2.71 C ATOM 1409 CD1 LEU A 95 9.680 -20.498 -15.520 1.00 3.49 C ATOM 1410 CD2 LEU A 95 10.219 -18.126 -16.092 1.00 3.36 C ATOM 0 H LEU A 95 11.072 -17.139 -13.889 1.00 0.85 H new ATOM 0 HA LEU A 95 8.554 -17.472 -12.283 1.00 1.27 H new ATOM 0 HB2 LEU A 95 8.234 -19.492 -13.756 1.00 1.92 H new ATOM 0 HB3 LEU A 95 8.190 -17.978 -14.638 1.00 1.92 H new ATOM 0 HG LEU A 95 10.908 -19.177 -14.338 1.00 2.71 H new ATOM 0 HD11 LEU A 95 10.509 -20.835 -16.143 1.00 3.49 H new ATOM 0 HD12 LEU A 95 9.527 -21.206 -14.705 1.00 3.49 H new ATOM 0 HD13 LEU A 95 8.774 -20.438 -16.123 1.00 3.49 H new ATOM 0 HD21 LEU A 95 11.047 -18.466 -16.715 1.00 3.36 H new ATOM 0 HD22 LEU A 95 9.313 -18.065 -16.695 1.00 3.36 H new ATOM 0 HD23 LEU A 95 10.451 -17.142 -15.685 1.00 3.36 H new ATOM 1422 N ASN A 96 10.661 -18.413 -10.832 1.00 0.90 N ATOM 1423 CA ASN A 96 11.400 -19.312 -9.897 1.00 1.15 C ATOM 1424 C ASN A 96 10.460 -19.773 -8.777 1.00 1.20 C ATOM 1425 O ASN A 96 10.897 -20.123 -7.697 1.00 1.69 O ATOM 1426 CB ASN A 96 12.591 -18.558 -9.293 1.00 1.37 C ATOM 1427 CG ASN A 96 12.106 -17.293 -8.572 1.00 1.52 C ATOM 1428 OD1 ASN A 96 10.920 -17.074 -8.427 1.00 2.00 O ATOM 1429 ND2 ASN A 96 12.986 -16.448 -8.108 1.00 1.82 N ATOM 0 H ASN A 96 10.609 -17.437 -10.542 1.00 0.90 H new ATOM 0 HA ASN A 96 11.764 -20.182 -10.443 1.00 1.15 H new ATOM 0 HB2 ASN A 96 13.122 -19.203 -8.593 1.00 1.37 H new ATOM 0 HB3 ASN A 96 13.297 -18.290 -10.079 1.00 1.37 H new ATOM 0 HD21 ASN A 96 12.678 -15.605 -7.624 1.00 1.82 H new ATOM 0 HD22 ASN A 96 13.982 -16.631 -8.229 1.00 1.82 H new ATOM 1436 N LEU A 97 9.173 -19.779 -9.029 1.00 0.95 N ATOM 1437 CA LEU A 97 8.193 -20.220 -7.989 1.00 1.12 C ATOM 1438 C LEU A 97 8.258 -19.274 -6.788 1.00 1.13 C ATOM 1439 O LEU A 97 8.393 -19.692 -5.653 1.00 1.69 O ATOM 1440 CB LEU A 97 8.516 -21.656 -7.549 1.00 1.25 C ATOM 1441 CG LEU A 97 7.230 -22.478 -7.530 1.00 2.11 C ATOM 1442 CD1 LEU A 97 6.826 -22.809 -8.968 1.00 2.61 C ATOM 1443 CD2 LEU A 97 7.462 -23.773 -6.751 1.00 2.59 C ATOM 0 H LEU A 97 8.758 -19.495 -9.916 1.00 0.95 H new ATOM 0 HA LEU A 97 7.186 -20.196 -8.406 1.00 1.12 H new ATOM 0 HB2 LEU A 97 9.238 -22.104 -8.232 1.00 1.25 H new ATOM 0 HB3 LEU A 97 8.973 -21.651 -6.560 1.00 1.25 H new ATOM 0 HG LEU A 97 6.436 -21.907 -7.048 1.00 2.11 H new ATOM 0 HD11 LEU A 97 5.908 -23.396 -8.962 1.00 2.61 H new ATOM 0 HD12 LEU A 97 6.662 -21.885 -9.522 1.00 2.61 H new ATOM 0 HD13 LEU A 97 7.620 -23.382 -9.446 1.00 2.61 H new ATOM 0 HD21 LEU A 97 6.543 -24.359 -6.738 1.00 2.59 H new ATOM 0 HD22 LEU A 97 8.253 -24.349 -7.230 1.00 2.59 H new ATOM 0 HD23 LEU A 97 7.755 -23.535 -5.728 1.00 2.59 H new ATOM 1455 N GLN A 98 8.154 -17.994 -7.037 1.00 0.82 N ATOM 1456 CA GLN A 98 8.199 -16.980 -5.935 1.00 0.84 C ATOM 1457 C GLN A 98 8.313 -15.591 -6.562 1.00 0.76 C ATOM 1458 O GLN A 98 7.788 -14.620 -6.051 1.00 0.82 O ATOM 1459 CB GLN A 98 9.417 -17.226 -5.025 1.00 0.90 C ATOM 1460 CG GLN A 98 8.958 -17.851 -3.705 1.00 1.29 C ATOM 1461 CD GLN A 98 10.027 -18.822 -3.199 1.00 1.86 C ATOM 1462 OE1 GLN A 98 9.778 -20.003 -3.069 1.00 2.44 O ATOM 1463 NE2 GLN A 98 11.216 -18.369 -2.906 1.00 2.59 N ATOM 0 H GLN A 98 8.038 -17.600 -7.971 1.00 0.82 H new ATOM 0 HA GLN A 98 7.293 -17.058 -5.333 1.00 0.84 H new ATOM 0 HB2 GLN A 98 10.128 -17.886 -5.523 1.00 0.90 H new ATOM 0 HB3 GLN A 98 9.935 -16.286 -4.833 1.00 0.90 H new ATOM 0 HG2 GLN A 98 8.780 -17.072 -2.964 1.00 1.29 H new ATOM 0 HG3 GLN A 98 8.014 -18.376 -3.848 1.00 1.29 H new ATOM 0 HE21 GLN A 98 11.425 -17.377 -3.015 1.00 2.59 H new ATOM 0 HE22 GLN A 98 11.936 -19.007 -2.568 1.00 2.59 H new ATOM 1472 N ASP A 99 9.001 -15.498 -7.670 1.00 0.70 N ATOM 1473 CA ASP A 99 9.165 -14.182 -8.352 1.00 0.72 C ATOM 1474 C ASP A 99 7.840 -13.777 -8.999 1.00 0.66 C ATOM 1475 O ASP A 99 7.535 -12.608 -9.122 1.00 0.71 O ATOM 1476 CB ASP A 99 10.248 -14.295 -9.429 1.00 0.82 C ATOM 1477 CG ASP A 99 11.577 -13.773 -8.877 1.00 1.47 C ATOM 1478 OD1 ASP A 99 11.904 -14.117 -7.753 1.00 2.35 O ATOM 1479 OD2 ASP A 99 12.244 -13.040 -9.586 1.00 1.47 O ATOM 0 H ASP A 99 9.459 -16.283 -8.134 1.00 0.70 H new ATOM 0 HA ASP A 99 9.459 -13.428 -7.622 1.00 0.72 H new ATOM 0 HB2 ASP A 99 10.356 -15.333 -9.743 1.00 0.82 H new ATOM 0 HB3 ASP A 99 9.959 -13.723 -10.311 1.00 0.82 H new ATOM 1484 N GLN A 100 7.055 -14.736 -9.421 1.00 0.63 N ATOM 1485 CA GLN A 100 5.746 -14.416 -10.071 1.00 0.63 C ATOM 1486 C GLN A 100 4.882 -13.557 -9.136 1.00 0.57 C ATOM 1487 O GLN A 100 4.401 -12.508 -9.519 1.00 0.56 O ATOM 1488 CB GLN A 100 5.008 -15.718 -10.387 1.00 0.77 C ATOM 1489 CG GLN A 100 3.749 -15.407 -11.200 1.00 1.16 C ATOM 1490 CD GLN A 100 4.147 -14.982 -12.614 1.00 1.09 C ATOM 1491 OE1 GLN A 100 3.714 -13.954 -13.096 1.00 1.81 O ATOM 1492 NE2 GLN A 100 4.960 -15.734 -13.304 1.00 1.00 N ATOM 0 H GLN A 100 7.265 -15.731 -9.343 1.00 0.63 H new ATOM 0 HA GLN A 100 5.933 -13.860 -10.990 1.00 0.63 H new ATOM 0 HB2 GLN A 100 5.658 -16.390 -10.947 1.00 0.77 H new ATOM 0 HB3 GLN A 100 4.740 -16.230 -9.463 1.00 0.77 H new ATOM 0 HG2 GLN A 100 3.104 -16.284 -11.241 1.00 1.16 H new ATOM 0 HG3 GLN A 100 3.178 -14.614 -10.717 1.00 1.16 H new ATOM 0 HE21 GLN A 100 5.324 -16.597 -12.900 1.00 1.00 H new ATOM 0 HE22 GLN A 100 5.232 -15.459 -14.248 1.00 1.00 H new ATOM 1501 N LEU A 101 4.680 -13.998 -7.919 1.00 0.60 N ATOM 1502 CA LEU A 101 3.840 -13.213 -6.963 1.00 0.65 C ATOM 1503 C LEU A 101 4.627 -12.006 -6.447 1.00 0.63 C ATOM 1504 O LEU A 101 4.105 -10.910 -6.352 1.00 0.70 O ATOM 1505 CB LEU A 101 3.437 -14.099 -5.778 1.00 0.80 C ATOM 1506 CG LEU A 101 2.831 -15.413 -6.290 1.00 0.83 C ATOM 1507 CD1 LEU A 101 3.861 -16.542 -6.170 1.00 1.68 C ATOM 1508 CD2 LEU A 101 1.590 -15.764 -5.461 1.00 1.44 C ATOM 0 H LEU A 101 5.061 -14.868 -7.546 1.00 0.60 H new ATOM 0 HA LEU A 101 2.945 -12.867 -7.481 1.00 0.65 H new ATOM 0 HB2 LEU A 101 4.308 -14.308 -5.156 1.00 0.80 H new ATOM 0 HB3 LEU A 101 2.715 -13.576 -5.150 1.00 0.80 H new ATOM 0 HG LEU A 101 2.549 -15.293 -7.336 1.00 0.83 H new ATOM 0 HD11 LEU A 101 3.425 -17.472 -6.535 1.00 1.68 H new ATOM 0 HD12 LEU A 101 4.741 -16.296 -6.764 1.00 1.68 H new ATOM 0 HD13 LEU A 101 4.150 -16.662 -5.126 1.00 1.68 H new ATOM 0 HD21 LEU A 101 1.161 -16.697 -5.826 1.00 1.44 H new ATOM 0 HD22 LEU A 101 1.872 -15.879 -4.414 1.00 1.44 H new ATOM 0 HD23 LEU A 101 0.854 -14.966 -5.553 1.00 1.44 H new ATOM 1520 N ASN A 102 5.875 -12.200 -6.107 1.00 0.64 N ATOM 1521 CA ASN A 102 6.703 -11.071 -5.586 1.00 0.71 C ATOM 1522 C ASN A 102 6.858 -9.995 -6.666 1.00 0.67 C ATOM 1523 O ASN A 102 6.748 -8.814 -6.396 1.00 0.76 O ATOM 1524 CB ASN A 102 8.084 -11.597 -5.191 1.00 0.78 C ATOM 1525 CG ASN A 102 8.880 -10.484 -4.506 1.00 0.83 C ATOM 1526 OD1 ASN A 102 8.309 -9.575 -3.936 1.00 0.91 O ATOM 1527 ND2 ASN A 102 10.184 -10.516 -4.539 1.00 0.89 N ATOM 0 H ASN A 102 6.359 -13.096 -6.168 1.00 0.64 H new ATOM 0 HA ASN A 102 6.211 -10.636 -4.716 1.00 0.71 H new ATOM 0 HB2 ASN A 102 7.981 -12.450 -4.520 1.00 0.78 H new ATOM 0 HB3 ASN A 102 8.617 -11.948 -6.075 1.00 0.78 H new ATOM 0 HD21 ASN A 102 10.724 -9.778 -4.086 1.00 0.89 H new ATOM 0 HD22 ASN A 102 10.663 -11.279 -5.017 1.00 0.89 H new ATOM 1534 N SER A 103 7.119 -10.398 -7.882 1.00 0.59 N ATOM 1535 CA SER A 103 7.292 -9.410 -8.987 1.00 0.59 C ATOM 1536 C SER A 103 5.940 -8.789 -9.343 1.00 0.50 C ATOM 1537 O SER A 103 5.862 -7.635 -9.720 1.00 0.55 O ATOM 1538 CB SER A 103 7.868 -10.114 -10.214 1.00 0.60 C ATOM 1539 OG SER A 103 8.384 -9.142 -11.115 1.00 1.50 O ATOM 0 H SER A 103 7.220 -11.375 -8.158 1.00 0.59 H new ATOM 0 HA SER A 103 7.974 -8.624 -8.663 1.00 0.59 H new ATOM 0 HB2 SER A 103 8.657 -10.804 -9.915 1.00 0.60 H new ATOM 0 HB3 SER A 103 7.095 -10.706 -10.704 1.00 0.60 H new ATOM 0 HG SER A 103 8.973 -9.579 -11.765 1.00 1.50 H new ATOM 1545 N LEU A 104 4.877 -9.544 -9.228 1.00 0.44 N ATOM 1546 CA LEU A 104 3.528 -8.999 -9.563 1.00 0.42 C ATOM 1547 C LEU A 104 3.176 -7.880 -8.580 1.00 0.46 C ATOM 1548 O LEU A 104 2.811 -6.788 -8.975 1.00 0.55 O ATOM 1549 CB LEU A 104 2.482 -10.123 -9.471 1.00 0.46 C ATOM 1550 CG LEU A 104 2.073 -10.594 -10.876 1.00 0.52 C ATOM 1551 CD1 LEU A 104 1.465 -9.426 -11.660 1.00 0.63 C ATOM 1552 CD2 LEU A 104 3.299 -11.138 -11.624 1.00 0.59 C ATOM 0 H LEU A 104 4.886 -10.515 -8.916 1.00 0.44 H new ATOM 0 HA LEU A 104 3.535 -8.600 -10.577 1.00 0.42 H new ATOM 0 HB2 LEU A 104 2.889 -10.961 -8.904 1.00 0.46 H new ATOM 0 HB3 LEU A 104 1.605 -9.768 -8.930 1.00 0.46 H new ATOM 0 HG LEU A 104 1.331 -11.387 -10.782 1.00 0.52 H new ATOM 0 HD11 LEU A 104 1.177 -9.766 -12.655 1.00 0.63 H new ATOM 0 HD12 LEU A 104 0.585 -9.054 -11.135 1.00 0.63 H new ATOM 0 HD13 LEU A 104 2.200 -8.626 -11.749 1.00 0.63 H new ATOM 0 HD21 LEU A 104 3.001 -11.470 -12.619 1.00 0.59 H new ATOM 0 HD22 LEU A 104 4.049 -10.352 -11.713 1.00 0.59 H new ATOM 0 HD23 LEU A 104 3.719 -11.979 -11.072 1.00 0.59 H new ATOM 1564 N GLN A 105 3.284 -8.145 -7.302 1.00 0.48 N ATOM 1565 CA GLN A 105 2.957 -7.101 -6.286 1.00 0.57 C ATOM 1566 C GLN A 105 3.910 -5.912 -6.449 1.00 0.57 C ATOM 1567 O GLN A 105 3.518 -4.771 -6.306 1.00 0.61 O ATOM 1568 CB GLN A 105 3.098 -7.690 -4.875 1.00 0.67 C ATOM 1569 CG GLN A 105 4.520 -8.222 -4.666 1.00 1.11 C ATOM 1570 CD GLN A 105 4.634 -8.837 -3.270 1.00 1.53 C ATOM 1571 OE1 GLN A 105 3.688 -9.414 -2.770 1.00 1.96 O ATOM 1572 NE2 GLN A 105 5.759 -8.738 -2.617 1.00 2.03 N ATOM 0 H GLN A 105 3.585 -9.041 -6.919 1.00 0.48 H new ATOM 0 HA GLN A 105 1.931 -6.763 -6.431 1.00 0.57 H new ATOM 0 HB2 GLN A 105 2.874 -6.927 -4.130 1.00 0.67 H new ATOM 0 HB3 GLN A 105 2.376 -8.494 -4.735 1.00 0.67 H new ATOM 0 HG2 GLN A 105 4.756 -8.969 -5.424 1.00 1.11 H new ATOM 0 HG3 GLN A 105 5.243 -7.414 -4.779 1.00 1.11 H new ATOM 0 HE21 GLN A 105 6.552 -8.254 -3.038 1.00 2.03 H new ATOM 0 HE22 GLN A 105 5.846 -9.145 -1.686 1.00 2.03 H new ATOM 1581 N SER A 106 5.157 -6.176 -6.748 1.00 0.56 N ATOM 1582 CA SER A 106 6.141 -5.067 -6.925 1.00 0.60 C ATOM 1583 C SER A 106 5.898 -4.381 -8.271 1.00 0.55 C ATOM 1584 O SER A 106 6.116 -3.194 -8.422 1.00 0.63 O ATOM 1585 CB SER A 106 7.560 -5.635 -6.890 1.00 0.64 C ATOM 1586 OG SER A 106 8.442 -4.661 -6.345 1.00 1.27 O ATOM 0 H SER A 106 5.536 -7.114 -6.877 1.00 0.56 H new ATOM 0 HA SER A 106 6.021 -4.341 -6.121 1.00 0.60 H new ATOM 0 HB2 SER A 106 7.586 -6.543 -6.288 1.00 0.64 H new ATOM 0 HB3 SER A 106 7.879 -5.910 -7.895 1.00 0.64 H new ATOM 0 HG SER A 106 9.353 -5.022 -6.319 1.00 1.27 H new ATOM 1592 N ALA A 107 5.449 -5.127 -9.246 1.00 0.45 N ATOM 1593 CA ALA A 107 5.185 -4.538 -10.591 1.00 0.42 C ATOM 1594 C ALA A 107 3.895 -3.721 -10.541 1.00 0.42 C ATOM 1595 O ALA A 107 3.875 -2.554 -10.885 1.00 0.45 O ATOM 1596 CB ALA A 107 5.038 -5.661 -11.621 1.00 0.40 C ATOM 0 H ALA A 107 5.253 -6.125 -9.167 1.00 0.45 H new ATOM 0 HA ALA A 107 6.016 -3.892 -10.876 1.00 0.42 H new ATOM 0 HB1 ALA A 107 4.845 -5.230 -12.604 1.00 0.40 H new ATOM 0 HB2 ALA A 107 5.957 -6.246 -11.655 1.00 0.40 H new ATOM 0 HB3 ALA A 107 4.207 -6.307 -11.339 1.00 0.40 H new ATOM 1602 N LEU A 108 2.816 -4.326 -10.108 1.00 0.41 N ATOM 1603 CA LEU A 108 1.516 -3.592 -10.023 1.00 0.45 C ATOM 1604 C LEU A 108 1.673 -2.388 -9.092 1.00 0.50 C ATOM 1605 O LEU A 108 1.100 -1.340 -9.313 1.00 0.53 O ATOM 1606 CB LEU A 108 0.441 -4.529 -9.469 1.00 0.45 C ATOM 1607 CG LEU A 108 -0.913 -4.171 -10.081 1.00 0.51 C ATOM 1608 CD1 LEU A 108 -0.890 -4.468 -11.581 1.00 0.87 C ATOM 1609 CD2 LEU A 108 -2.008 -5.005 -9.413 1.00 0.67 C ATOM 0 H LEU A 108 2.780 -5.300 -9.809 1.00 0.41 H new ATOM 0 HA LEU A 108 1.224 -3.248 -11.015 1.00 0.45 H new ATOM 0 HB2 LEU A 108 0.693 -5.564 -9.698 1.00 0.45 H new ATOM 0 HB3 LEU A 108 0.395 -4.445 -8.383 1.00 0.45 H new ATOM 0 HG LEU A 108 -1.115 -3.111 -9.924 1.00 0.51 H new ATOM 0 HD11 LEU A 108 -1.856 -4.213 -12.017 1.00 0.87 H new ATOM 0 HD12 LEU A 108 -0.109 -3.876 -12.057 1.00 0.87 H new ATOM 0 HD13 LEU A 108 -0.689 -5.528 -11.739 1.00 0.87 H new ATOM 0 HD21 LEU A 108 -2.975 -4.751 -9.848 1.00 0.67 H new ATOM 0 HD22 LEU A 108 -1.806 -6.064 -9.571 1.00 0.67 H new ATOM 0 HD23 LEU A 108 -2.025 -4.794 -8.344 1.00 0.67 H new ATOM 1621 N THR A 109 2.453 -2.538 -8.053 1.00 0.54 N ATOM 1622 CA THR A 109 2.670 -1.412 -7.101 1.00 0.62 C ATOM 1623 C THR A 109 3.625 -0.392 -7.732 1.00 0.61 C ATOM 1624 O THR A 109 3.541 0.793 -7.469 1.00 0.66 O ATOM 1625 CB THR A 109 3.269 -1.962 -5.800 1.00 0.70 C ATOM 1626 OG1 THR A 109 2.354 -2.876 -5.211 1.00 0.89 O ATOM 1627 CG2 THR A 109 3.539 -0.817 -4.821 1.00 0.95 C ATOM 0 H THR A 109 2.951 -3.398 -7.823 1.00 0.54 H new ATOM 0 HA THR A 109 1.722 -0.922 -6.880 1.00 0.62 H new ATOM 0 HB THR A 109 4.207 -2.469 -6.025 1.00 0.70 H new ATOM 0 HG1 THR A 109 2.709 -3.787 -5.284 1.00 0.89 H new ATOM 0 HG21 THR A 109 3.964 -1.218 -3.901 1.00 0.95 H new ATOM 0 HG22 THR A 109 4.241 -0.113 -5.269 1.00 0.95 H new ATOM 0 HG23 THR A 109 2.605 -0.303 -4.595 1.00 0.95 H new ATOM 1635 N ASN A 110 4.538 -0.847 -8.556 1.00 0.60 N ATOM 1636 CA ASN A 110 5.515 0.080 -9.204 1.00 0.63 C ATOM 1637 C ASN A 110 4.772 1.221 -9.917 1.00 0.62 C ATOM 1638 O ASN A 110 5.128 2.377 -9.785 1.00 0.67 O ATOM 1639 CB ASN A 110 6.350 -0.712 -10.218 1.00 0.66 C ATOM 1640 CG ASN A 110 7.377 0.210 -10.875 1.00 0.69 C ATOM 1641 OD1 ASN A 110 8.546 0.170 -10.551 1.00 0.97 O ATOM 1642 ND2 ASN A 110 6.979 1.045 -11.793 1.00 1.13 N ATOM 0 H ASN A 110 4.648 -1.829 -8.808 1.00 0.60 H new ATOM 0 HA ASN A 110 6.166 0.513 -8.445 1.00 0.63 H new ATOM 0 HB2 ASN A 110 6.856 -1.539 -9.720 1.00 0.66 H new ATOM 0 HB3 ASN A 110 5.700 -1.147 -10.977 1.00 0.66 H new ATOM 0 HD21 ASN A 110 7.651 1.668 -12.242 1.00 1.13 H new ATOM 0 HD22 ASN A 110 5.996 1.076 -12.063 1.00 1.13 H new ATOM 1649 N VAL A 111 3.749 0.900 -10.663 1.00 0.60 N ATOM 1650 CA VAL A 111 2.983 1.961 -11.382 1.00 0.63 C ATOM 1651 C VAL A 111 2.307 2.874 -10.358 1.00 0.63 C ATOM 1652 O VAL A 111 2.112 4.051 -10.597 1.00 0.67 O ATOM 1653 CB VAL A 111 1.925 1.323 -12.287 1.00 0.66 C ATOM 1654 CG1 VAL A 111 2.614 0.598 -13.444 1.00 1.36 C ATOM 1655 CG2 VAL A 111 1.092 0.319 -11.487 1.00 1.63 C ATOM 0 H VAL A 111 3.410 -0.051 -10.806 1.00 0.60 H new ATOM 0 HA VAL A 111 3.666 2.545 -11.999 1.00 0.63 H new ATOM 0 HB VAL A 111 1.272 2.103 -12.678 1.00 0.66 H new ATOM 0 HG11 VAL A 111 1.861 0.144 -14.088 1.00 1.36 H new ATOM 0 HG12 VAL A 111 3.203 1.311 -14.021 1.00 1.36 H new ATOM 0 HG13 VAL A 111 3.269 -0.178 -13.048 1.00 1.36 H new ATOM 0 HG21 VAL A 111 0.342 -0.131 -12.137 1.00 1.63 H new ATOM 0 HG22 VAL A 111 1.743 -0.460 -11.091 1.00 1.63 H new ATOM 0 HG23 VAL A 111 0.597 0.832 -10.662 1.00 1.63 H new ATOM 1665 N GLY A 112 1.950 2.338 -9.218 1.00 0.61 N ATOM 1666 CA GLY A 112 1.284 3.166 -8.171 1.00 0.67 C ATOM 1667 C GLY A 112 2.323 4.063 -7.492 1.00 0.68 C ATOM 1668 O GLY A 112 2.051 5.205 -7.169 1.00 0.70 O ATOM 0 H GLY A 112 2.092 1.359 -8.968 1.00 0.61 H new ATOM 0 HA2 GLY A 112 0.499 3.775 -8.619 1.00 0.67 H new ATOM 0 HA3 GLY A 112 0.806 2.522 -7.433 1.00 0.67 H new ATOM 1672 N HIS A 113 3.507 3.552 -7.273 1.00 0.70 N ATOM 1673 CA HIS A 113 4.571 4.367 -6.615 1.00 0.78 C ATOM 1674 C HIS A 113 5.125 5.387 -7.612 1.00 0.74 C ATOM 1675 O HIS A 113 5.409 6.517 -7.261 1.00 0.81 O ATOM 1676 CB HIS A 113 5.700 3.446 -6.146 1.00 0.86 C ATOM 1677 CG HIS A 113 6.451 4.107 -5.023 1.00 0.95 C ATOM 1678 ND1 HIS A 113 6.755 3.442 -3.846 1.00 1.08 N ATOM 1679 CD2 HIS A 113 6.967 5.372 -4.883 1.00 1.31 C ATOM 1680 CE1 HIS A 113 7.425 4.302 -3.056 1.00 1.33 C ATOM 1681 NE2 HIS A 113 7.582 5.493 -3.641 1.00 1.48 N ATOM 0 H HIS A 113 3.783 2.602 -7.522 1.00 0.70 H new ATOM 0 HA HIS A 113 4.149 4.892 -5.758 1.00 0.78 H new ATOM 0 HB2 HIS A 113 5.291 2.492 -5.813 1.00 0.86 H new ATOM 0 HB3 HIS A 113 6.376 3.231 -6.973 1.00 0.86 H new ATOM 0 HD2 HIS A 113 6.905 6.154 -5.625 1.00 1.31 H new ATOM 0 HE1 HIS A 113 7.791 4.059 -2.069 1.00 1.33 H new ATOM 0 HE2 HIS A 113 8.052 6.314 -3.259 1.00 1.48 H new ATOM 1689 N GLN A 114 5.280 4.994 -8.851 1.00 0.65 N ATOM 1690 CA GLN A 114 5.815 5.934 -9.879 1.00 0.65 C ATOM 1691 C GLN A 114 4.823 7.079 -10.090 1.00 0.58 C ATOM 1692 O GLN A 114 5.204 8.228 -10.208 1.00 0.66 O ATOM 1693 CB GLN A 114 6.019 5.186 -11.198 1.00 0.66 C ATOM 1694 CG GLN A 114 7.121 5.870 -12.009 1.00 1.04 C ATOM 1695 CD GLN A 114 8.480 5.282 -11.623 1.00 0.84 C ATOM 1696 OE1 GLN A 114 9.215 5.874 -10.859 1.00 1.33 O ATOM 1697 NE2 GLN A 114 8.846 4.134 -12.124 1.00 1.29 N ATOM 0 H GLN A 114 5.058 4.060 -9.195 1.00 0.65 H new ATOM 0 HA GLN A 114 6.769 6.338 -9.539 1.00 0.65 H new ATOM 0 HB2 GLN A 114 6.289 4.148 -11.002 1.00 0.66 H new ATOM 0 HB3 GLN A 114 5.090 5.172 -11.767 1.00 0.66 H new ATOM 0 HG2 GLN A 114 6.942 5.730 -13.075 1.00 1.04 H new ATOM 0 HG3 GLN A 114 7.111 6.944 -11.822 1.00 1.04 H new ATOM 0 HE21 GLN A 114 8.228 3.637 -12.766 1.00 1.29 H new ATOM 0 HE22 GLN A 114 9.750 3.733 -11.874 1.00 1.29 H new ATOM 1706 N TRP A 115 3.553 6.771 -10.138 1.00 0.52 N ATOM 1707 CA TRP A 115 2.523 7.833 -10.342 1.00 0.52 C ATOM 1708 C TRP A 115 2.552 8.796 -9.150 1.00 0.50 C ATOM 1709 O TRP A 115 2.280 9.973 -9.285 1.00 0.53 O ATOM 1710 CB TRP A 115 1.138 7.184 -10.443 1.00 0.60 C ATOM 1711 CG TRP A 115 0.719 7.084 -11.879 1.00 0.65 C ATOM 1712 CD1 TRP A 115 -0.564 7.063 -12.307 1.00 1.00 C ATOM 1713 CD2 TRP A 115 1.550 6.988 -13.076 1.00 0.63 C ATOM 1714 NE1 TRP A 115 -0.576 6.960 -13.686 1.00 1.19 N ATOM 1715 CE2 TRP A 115 0.701 6.911 -14.206 1.00 0.91 C ATOM 1716 CE3 TRP A 115 2.941 6.961 -13.290 1.00 0.70 C ATOM 1717 CZ2 TRP A 115 1.213 6.810 -15.500 1.00 0.98 C ATOM 1718 CZ3 TRP A 115 3.458 6.859 -14.592 1.00 0.76 C ATOM 1719 CH2 TRP A 115 2.596 6.783 -15.694 1.00 0.78 C ATOM 0 H TRP A 115 3.183 5.825 -10.044 1.00 0.52 H new ATOM 0 HA TRP A 115 2.734 8.381 -11.260 1.00 0.52 H new ATOM 0 HB2 TRP A 115 1.159 6.192 -9.992 1.00 0.60 H new ATOM 0 HB3 TRP A 115 0.410 7.772 -9.884 1.00 0.60 H new ATOM 0 HD1 TRP A 115 -1.438 7.118 -11.674 1.00 1.00 H new ATOM 0 HE1 TRP A 115 -1.425 6.925 -14.250 1.00 1.19 H new ATOM 0 HE3 TRP A 115 3.615 7.019 -12.448 1.00 0.70 H new ATOM 0 HZ2 TRP A 115 0.544 6.753 -16.346 1.00 0.98 H new ATOM 0 HZ3 TRP A 115 4.527 6.839 -14.745 1.00 0.76 H new ATOM 0 HH2 TRP A 115 3.000 6.704 -16.692 1.00 0.78 H new ATOM 1730 N GLN A 116 2.877 8.296 -7.985 1.00 0.49 N ATOM 1731 CA GLN A 116 2.926 9.164 -6.771 1.00 0.51 C ATOM 1732 C GLN A 116 3.956 10.280 -6.971 1.00 0.49 C ATOM 1733 O GLN A 116 3.808 11.370 -6.451 1.00 0.53 O ATOM 1734 CB GLN A 116 3.320 8.320 -5.558 1.00 0.60 C ATOM 1735 CG GLN A 116 2.058 7.825 -4.848 1.00 1.11 C ATOM 1736 CD GLN A 116 1.332 9.011 -4.210 1.00 1.24 C ATOM 1737 OE1 GLN A 116 1.768 9.534 -3.203 1.00 1.91 O ATOM 1738 NE2 GLN A 116 0.236 9.461 -4.756 1.00 1.74 N ATOM 0 H GLN A 116 3.112 7.317 -7.822 1.00 0.49 H new ATOM 0 HA GLN A 116 1.944 9.607 -6.606 1.00 0.51 H new ATOM 0 HB2 GLN A 116 3.928 7.473 -5.874 1.00 0.60 H new ATOM 0 HB3 GLN A 116 3.928 8.911 -4.873 1.00 0.60 H new ATOM 0 HG2 GLN A 116 1.402 7.323 -5.559 1.00 1.11 H new ATOM 0 HG3 GLN A 116 2.321 7.093 -4.085 1.00 1.11 H new ATOM 0 HE21 GLN A 116 -0.130 9.022 -5.601 1.00 1.74 H new ATOM 0 HE22 GLN A 116 -0.255 10.251 -4.338 1.00 1.74 H new ATOM 1747 N ASP A 117 4.999 10.013 -7.717 1.00 0.50 N ATOM 1748 CA ASP A 117 6.047 11.052 -7.951 1.00 0.54 C ATOM 1749 C ASP A 117 5.423 12.269 -8.641 1.00 0.54 C ATOM 1750 O ASP A 117 5.414 13.359 -8.100 1.00 0.61 O ATOM 1751 CB ASP A 117 7.149 10.472 -8.841 1.00 0.57 C ATOM 1752 CG ASP A 117 7.762 9.247 -8.162 1.00 1.27 C ATOM 1753 OD1 ASP A 117 7.172 8.183 -8.257 1.00 2.00 O ATOM 1754 OD2 ASP A 117 8.811 9.392 -7.557 1.00 1.90 O ATOM 0 H ASP A 117 5.170 9.118 -8.175 1.00 0.50 H new ATOM 0 HA ASP A 117 6.472 11.358 -6.995 1.00 0.54 H new ATOM 0 HB2 ASP A 117 6.739 10.195 -9.812 1.00 0.57 H new ATOM 0 HB3 ASP A 117 7.918 11.223 -9.022 1.00 0.57 H new ATOM 1759 N ILE A 118 4.904 12.088 -9.829 1.00 0.51 N ATOM 1760 CA ILE A 118 4.281 13.228 -10.558 1.00 0.56 C ATOM 1761 C ILE A 118 3.067 13.740 -9.773 1.00 0.55 C ATOM 1762 O ILE A 118 2.807 14.923 -9.726 1.00 0.73 O ATOM 1763 CB ILE A 118 3.838 12.766 -11.952 1.00 0.58 C ATOM 1764 CG1 ILE A 118 3.199 13.956 -12.689 1.00 0.63 C ATOM 1765 CG2 ILE A 118 2.828 11.616 -11.822 1.00 0.58 C ATOM 1766 CD1 ILE A 118 2.693 13.528 -14.064 1.00 0.99 C ATOM 0 H ILE A 118 4.886 11.197 -10.325 1.00 0.51 H new ATOM 0 HA ILE A 118 5.009 14.033 -10.660 1.00 0.56 H new ATOM 0 HB ILE A 118 4.699 12.408 -12.517 1.00 0.58 H new ATOM 0 HG12 ILE A 118 2.373 14.355 -12.100 1.00 0.63 H new ATOM 0 HG13 ILE A 118 3.929 14.758 -12.798 1.00 0.63 H new ATOM 0 HG21 ILE A 118 2.516 11.291 -12.815 1.00 0.58 H new ATOM 0 HG22 ILE A 118 3.292 10.782 -11.297 1.00 0.58 H new ATOM 0 HG23 ILE A 118 1.957 11.958 -11.262 1.00 0.58 H new ATOM 0 HD11 ILE A 118 2.245 14.383 -14.569 1.00 0.99 H new ATOM 0 HD12 ILE A 118 3.526 13.152 -14.657 1.00 0.99 H new ATOM 0 HD13 ILE A 118 1.946 12.743 -13.949 1.00 0.99 H new ATOM 1778 N ALA A 119 2.320 12.860 -9.157 1.00 0.39 N ATOM 1779 CA ALA A 119 1.121 13.299 -8.374 1.00 0.39 C ATOM 1780 C ALA A 119 1.534 14.388 -7.378 1.00 0.40 C ATOM 1781 O ALA A 119 0.763 15.258 -7.031 1.00 0.40 O ATOM 1782 CB ALA A 119 0.545 12.104 -7.613 1.00 0.43 C ATOM 0 H ALA A 119 2.487 11.854 -9.161 1.00 0.39 H new ATOM 0 HA ALA A 119 0.367 13.695 -9.054 1.00 0.39 H new ATOM 0 HB1 ALA A 119 -0.328 12.422 -7.043 1.00 0.43 H new ATOM 0 HB2 ALA A 119 0.253 11.328 -8.321 1.00 0.43 H new ATOM 0 HB3 ALA A 119 1.299 11.709 -6.932 1.00 0.43 H new ATOM 1788 N THR A 120 2.755 14.323 -6.919 1.00 0.41 N ATOM 1789 CA THR A 120 3.258 15.329 -5.942 1.00 0.43 C ATOM 1790 C THR A 120 3.645 16.646 -6.635 1.00 0.43 C ATOM 1791 O THR A 120 3.472 17.713 -6.077 1.00 0.45 O ATOM 1792 CB THR A 120 4.485 14.763 -5.232 1.00 0.45 C ATOM 1793 OG1 THR A 120 4.319 13.363 -5.046 1.00 0.49 O ATOM 1794 CG2 THR A 120 4.644 15.447 -3.874 1.00 0.52 C ATOM 0 H THR A 120 3.432 13.607 -7.183 1.00 0.41 H new ATOM 0 HA THR A 120 2.460 15.540 -5.230 1.00 0.43 H new ATOM 0 HB THR A 120 5.374 14.944 -5.835 1.00 0.45 H new ATOM 0 HG1 THR A 120 4.513 12.896 -5.886 1.00 0.49 H new ATOM 0 HG21 THR A 120 5.520 15.045 -3.364 1.00 0.52 H new ATOM 0 HG22 THR A 120 4.770 16.520 -4.020 1.00 0.52 H new ATOM 0 HG23 THR A 120 3.756 15.265 -3.269 1.00 0.52 H new ATOM 1802 N LYS A 121 4.205 16.583 -7.824 1.00 0.43 N ATOM 1803 CA LYS A 121 4.644 17.840 -8.520 1.00 0.46 C ATOM 1804 C LYS A 121 3.493 18.853 -8.617 1.00 0.45 C ATOM 1805 O LYS A 121 3.718 20.049 -8.590 1.00 0.51 O ATOM 1806 CB LYS A 121 5.205 17.519 -9.917 1.00 0.48 C ATOM 1807 CG LYS A 121 4.105 16.983 -10.844 1.00 1.05 C ATOM 1808 CD LYS A 121 4.054 17.808 -12.134 1.00 1.38 C ATOM 1809 CE LYS A 121 4.755 17.046 -13.266 1.00 1.60 C ATOM 1810 NZ LYS A 121 5.711 17.956 -13.958 1.00 2.10 N ATOM 0 H LYS A 121 4.376 15.720 -8.340 1.00 0.43 H new ATOM 0 HA LYS A 121 5.438 18.292 -7.925 1.00 0.46 H new ATOM 0 HB2 LYS A 121 5.645 18.417 -10.351 1.00 0.48 H new ATOM 0 HB3 LYS A 121 6.004 16.782 -9.831 1.00 0.48 H new ATOM 0 HG2 LYS A 121 4.296 15.936 -11.080 1.00 1.05 H new ATOM 0 HG3 LYS A 121 3.140 17.025 -10.338 1.00 1.05 H new ATOM 0 HD2 LYS A 121 3.018 18.010 -12.406 1.00 1.38 H new ATOM 0 HD3 LYS A 121 4.537 18.773 -11.979 1.00 1.38 H new ATOM 0 HE2 LYS A 121 5.284 16.182 -12.864 1.00 1.60 H new ATOM 0 HE3 LYS A 121 4.019 16.667 -13.975 1.00 1.60 H new ATOM 0 HZ1 LYS A 121 6.187 17.441 -14.726 1.00 2.10 H new ATOM 0 HZ2 LYS A 121 5.194 18.767 -14.354 1.00 2.10 H new ATOM 0 HZ3 LYS A 121 6.420 18.297 -13.278 1.00 2.10 H new ATOM 1824 N THR A 122 2.266 18.395 -8.714 1.00 0.43 N ATOM 1825 CA THR A 122 1.112 19.345 -8.796 1.00 0.50 C ATOM 1826 C THR A 122 1.126 20.273 -7.575 1.00 0.59 C ATOM 1827 O THR A 122 0.692 21.402 -7.636 1.00 0.67 O ATOM 1828 CB THR A 122 -0.205 18.559 -8.837 1.00 0.53 C ATOM 1829 OG1 THR A 122 -1.294 19.471 -8.898 1.00 1.14 O ATOM 1830 CG2 THR A 122 -0.338 17.690 -7.585 1.00 1.38 C ATOM 0 H THR A 122 2.015 17.407 -8.740 1.00 0.43 H new ATOM 0 HA THR A 122 1.198 19.942 -9.704 1.00 0.50 H new ATOM 0 HB THR A 122 -0.211 17.916 -9.717 1.00 0.53 H new ATOM 0 HG1 THR A 122 -2.137 18.972 -8.926 1.00 1.14 H new ATOM 0 HG21 THR A 122 -1.276 17.136 -7.624 1.00 1.38 H new ATOM 0 HG22 THR A 122 0.495 16.989 -7.539 1.00 1.38 H new ATOM 0 HG23 THR A 122 -0.328 18.325 -6.699 1.00 1.38 H new ATOM 1838 N GLN A 123 1.627 19.793 -6.470 1.00 0.60 N ATOM 1839 CA GLN A 123 1.675 20.632 -5.237 1.00 0.71 C ATOM 1840 C GLN A 123 2.602 21.826 -5.470 1.00 0.71 C ATOM 1841 O GLN A 123 2.379 22.904 -4.952 1.00 0.80 O ATOM 1842 CB GLN A 123 2.207 19.794 -4.071 1.00 0.78 C ATOM 1843 CG GLN A 123 1.973 20.541 -2.757 1.00 0.83 C ATOM 1844 CD GLN A 123 3.071 20.173 -1.758 1.00 1.29 C ATOM 1845 OE1 GLN A 123 3.584 21.025 -1.059 1.00 1.94 O ATOM 1846 NE2 GLN A 123 3.457 18.929 -1.659 1.00 1.88 N ATOM 0 H GLN A 123 2.007 18.852 -6.367 1.00 0.60 H new ATOM 0 HA GLN A 123 0.673 20.990 -5.001 1.00 0.71 H new ATOM 0 HB2 GLN A 123 1.705 18.827 -4.046 1.00 0.78 H new ATOM 0 HB3 GLN A 123 3.271 19.598 -4.206 1.00 0.78 H new ATOM 0 HG2 GLN A 123 1.973 21.617 -2.933 1.00 0.83 H new ATOM 0 HG3 GLN A 123 0.995 20.284 -2.350 1.00 0.83 H new ATOM 0 HE21 GLN A 123 3.027 18.213 -2.245 1.00 1.88 H new ATOM 0 HE22 GLN A 123 4.188 18.673 -0.996 1.00 1.88 H new ATOM 1855 N ALA A 124 3.643 21.637 -6.239 1.00 0.64 N ATOM 1856 CA ALA A 124 4.597 22.754 -6.504 1.00 0.67 C ATOM 1857 C ALA A 124 3.984 23.751 -7.497 1.00 0.65 C ATOM 1858 O ALA A 124 3.782 24.908 -7.176 1.00 0.70 O ATOM 1859 CB ALA A 124 5.891 22.187 -7.090 1.00 0.66 C ATOM 0 H ALA A 124 3.874 20.755 -6.696 1.00 0.64 H new ATOM 0 HA ALA A 124 4.808 23.270 -5.567 1.00 0.67 H new ATOM 0 HB1 ALA A 124 6.590 23.001 -7.285 1.00 0.66 H new ATOM 0 HB2 ALA A 124 6.336 21.488 -6.381 1.00 0.66 H new ATOM 0 HB3 ALA A 124 5.671 21.667 -8.022 1.00 0.66 H new ATOM 1865 N SER A 125 3.700 23.315 -8.699 1.00 0.59 N ATOM 1866 CA SER A 125 3.112 24.240 -9.720 1.00 0.58 C ATOM 1867 C SER A 125 1.626 24.471 -9.421 1.00 0.60 C ATOM 1868 O SER A 125 1.170 25.594 -9.341 1.00 0.66 O ATOM 1869 CB SER A 125 3.280 23.633 -11.112 1.00 0.52 C ATOM 1870 OG SER A 125 3.810 24.617 -11.991 1.00 0.66 O ATOM 0 H SER A 125 3.850 22.358 -9.019 1.00 0.59 H new ATOM 0 HA SER A 125 3.630 25.198 -9.682 1.00 0.58 H new ATOM 0 HB2 SER A 125 3.946 22.771 -11.068 1.00 0.52 H new ATOM 0 HB3 SER A 125 2.320 23.275 -11.484 1.00 0.52 H new ATOM 0 HG SER A 125 4.215 24.178 -12.768 1.00 0.66 H new ATOM 1876 N ALA A 126 0.878 23.405 -9.247 1.00 0.57 N ATOM 1877 CA ALA A 126 -0.591 23.505 -8.930 1.00 0.62 C ATOM 1878 C ALA A 126 -1.425 23.812 -10.178 1.00 0.61 C ATOM 1879 O ALA A 126 -2.291 23.043 -10.537 1.00 0.61 O ATOM 1880 CB ALA A 126 -0.852 24.585 -7.868 1.00 0.71 C ATOM 0 H ALA A 126 1.229 22.449 -9.312 1.00 0.57 H new ATOM 0 HA ALA A 126 -0.895 22.533 -8.542 1.00 0.62 H new ATOM 0 HB1 ALA A 126 -1.920 24.637 -7.657 1.00 0.71 H new ATOM 0 HB2 ALA A 126 -0.313 24.334 -6.954 1.00 0.71 H new ATOM 0 HB3 ALA A 126 -0.508 25.551 -8.239 1.00 0.71 H new ATOM 1886 N GLN A 127 -1.218 24.937 -10.814 1.00 0.63 N ATOM 1887 CA GLN A 127 -2.060 25.282 -12.006 1.00 0.65 C ATOM 1888 C GLN A 127 -1.628 24.522 -13.271 1.00 0.59 C ATOM 1889 O GLN A 127 -2.374 23.730 -13.814 1.00 0.58 O ATOM 1890 CB GLN A 127 -1.950 26.785 -12.274 1.00 0.72 C ATOM 1891 CG GLN A 127 -2.351 27.562 -11.017 1.00 0.89 C ATOM 1892 CD GLN A 127 -3.829 27.948 -11.104 1.00 1.07 C ATOM 1893 OE1 GLN A 127 -4.695 27.148 -10.807 1.00 1.87 O ATOM 1894 NE2 GLN A 127 -4.157 29.146 -11.500 1.00 1.50 N ATOM 0 H GLN A 127 -0.510 25.628 -10.565 1.00 0.63 H new ATOM 0 HA GLN A 127 -3.086 24.993 -11.778 1.00 0.65 H new ATOM 0 HB2 GLN A 127 -0.930 27.040 -12.561 1.00 0.72 H new ATOM 0 HB3 GLN A 127 -2.595 27.064 -13.107 1.00 0.72 H new ATOM 0 HG2 GLN A 127 -2.175 26.954 -10.129 1.00 0.89 H new ATOM 0 HG3 GLN A 127 -1.736 28.456 -10.918 1.00 0.89 H new ATOM 0 HE21 GLN A 127 -3.431 29.817 -11.749 1.00 1.50 H new ATOM 0 HE22 GLN A 127 -5.140 29.412 -11.561 1.00 1.50 H new ATOM 1903 N GLU A 128 -0.450 24.796 -13.762 1.00 0.57 N ATOM 1904 CA GLU A 128 0.034 24.145 -15.025 1.00 0.54 C ATOM 1905 C GLU A 128 0.530 22.711 -14.803 1.00 0.49 C ATOM 1906 O GLU A 128 0.504 21.903 -15.704 1.00 0.49 O ATOM 1907 CB GLU A 128 1.174 24.974 -15.615 1.00 0.57 C ATOM 1908 CG GLU A 128 2.256 25.196 -14.555 1.00 0.56 C ATOM 1909 CD GLU A 128 3.570 25.577 -15.240 1.00 1.07 C ATOM 1910 OE1 GLU A 128 4.270 24.679 -15.677 1.00 1.83 O ATOM 1911 OE2 GLU A 128 3.853 26.761 -15.314 1.00 1.76 O ATOM 0 H GLU A 128 0.209 25.450 -13.341 1.00 0.57 H new ATOM 0 HA GLU A 128 -0.815 24.098 -15.707 1.00 0.54 H new ATOM 0 HB2 GLU A 128 1.598 24.463 -16.479 1.00 0.57 H new ATOM 0 HB3 GLU A 128 0.794 25.933 -15.967 1.00 0.57 H new ATOM 0 HG2 GLU A 128 1.950 25.984 -13.867 1.00 0.56 H new ATOM 0 HG3 GLU A 128 2.391 24.291 -13.963 1.00 0.56 H new ATOM 1918 N ALA A 129 1.040 22.412 -13.642 1.00 0.47 N ATOM 1919 CA ALA A 129 1.613 21.049 -13.378 1.00 0.43 C ATOM 1920 C ALA A 129 0.691 19.912 -13.842 1.00 0.42 C ATOM 1921 O ALA A 129 1.105 19.039 -14.582 1.00 0.43 O ATOM 1922 CB ALA A 129 1.868 20.894 -11.878 1.00 0.43 C ATOM 0 H ALA A 129 1.088 23.056 -12.852 1.00 0.47 H new ATOM 0 HA ALA A 129 2.539 20.974 -13.949 1.00 0.43 H new ATOM 0 HB1 ALA A 129 2.284 19.906 -11.680 1.00 0.43 H new ATOM 0 HB2 ALA A 129 2.572 21.657 -11.548 1.00 0.43 H new ATOM 0 HB3 ALA A 129 0.929 21.008 -11.336 1.00 0.43 H new ATOM 1928 N TRP A 130 -0.532 19.893 -13.389 1.00 0.43 N ATOM 1929 CA TRP A 130 -1.459 18.790 -13.767 1.00 0.45 C ATOM 1930 C TRP A 130 -2.022 18.981 -15.187 1.00 0.46 C ATOM 1931 O TRP A 130 -2.435 18.034 -15.822 1.00 0.48 O ATOM 1932 CB TRP A 130 -2.582 18.686 -12.728 1.00 0.49 C ATOM 1933 CG TRP A 130 -3.391 19.931 -12.718 1.00 0.51 C ATOM 1934 CD1 TRP A 130 -3.336 20.887 -11.770 1.00 0.54 C ATOM 1935 CD2 TRP A 130 -4.377 20.365 -13.682 1.00 0.53 C ATOM 1936 NE1 TRP A 130 -4.223 21.894 -12.101 1.00 0.57 N ATOM 1937 CE2 TRP A 130 -4.890 21.615 -13.277 1.00 0.56 C ATOM 1938 CE3 TRP A 130 -4.864 19.796 -14.863 1.00 0.53 C ATOM 1939 CZ2 TRP A 130 -5.859 22.280 -14.026 1.00 0.59 C ATOM 1940 CZ3 TRP A 130 -5.832 20.454 -15.620 1.00 0.56 C ATOM 1941 CH2 TRP A 130 -6.333 21.698 -15.208 1.00 0.59 C ATOM 0 H TRP A 130 -0.931 20.598 -12.770 1.00 0.43 H new ATOM 0 HA TRP A 130 -0.900 17.854 -13.777 1.00 0.45 H new ATOM 0 HB2 TRP A 130 -3.220 17.832 -12.956 1.00 0.49 H new ATOM 0 HB3 TRP A 130 -2.157 18.512 -11.739 1.00 0.49 H new ATOM 0 HD1 TRP A 130 -2.703 20.869 -10.895 1.00 0.54 H new ATOM 0 HE1 TRP A 130 -4.367 22.738 -11.546 1.00 0.57 H new ATOM 0 HE3 TRP A 130 -4.487 18.839 -15.191 1.00 0.53 H new ATOM 0 HZ2 TRP A 130 -6.241 23.235 -13.698 1.00 0.59 H new ATOM 0 HZ3 TRP A 130 -6.199 20.003 -16.530 1.00 0.56 H new ATOM 0 HH2 TRP A 130 -7.081 22.204 -15.800 1.00 0.59 H new ATOM 1952 N ALA A 131 -2.091 20.201 -15.661 1.00 0.46 N ATOM 1953 CA ALA A 131 -2.685 20.489 -17.018 1.00 0.49 C ATOM 1954 C ALA A 131 -2.254 19.473 -18.107 1.00 0.50 C ATOM 1955 O ALA A 131 -3.109 18.891 -18.743 1.00 0.52 O ATOM 1956 CB ALA A 131 -2.266 21.899 -17.449 1.00 0.50 C ATOM 0 H ALA A 131 -1.758 21.026 -15.162 1.00 0.46 H new ATOM 0 HA ALA A 131 -3.767 20.405 -16.921 1.00 0.49 H new ATOM 0 HB1 ALA A 131 -2.689 22.121 -18.429 1.00 0.50 H new ATOM 0 HB2 ALA A 131 -2.632 22.625 -16.723 1.00 0.50 H new ATOM 0 HB3 ALA A 131 -1.179 21.955 -17.502 1.00 0.50 H new ATOM 1962 N PRO A 132 -0.969 19.299 -18.329 1.00 0.49 N ATOM 1963 CA PRO A 132 -0.487 18.375 -19.377 1.00 0.52 C ATOM 1964 C PRO A 132 -0.609 16.901 -18.964 1.00 0.52 C ATOM 1965 O PRO A 132 -0.906 16.050 -19.780 1.00 0.55 O ATOM 1966 CB PRO A 132 0.984 18.762 -19.548 1.00 0.54 C ATOM 1967 CG PRO A 132 1.408 19.460 -18.238 1.00 0.52 C ATOM 1968 CD PRO A 132 0.116 19.977 -17.582 1.00 0.49 C ATOM 0 HA PRO A 132 -1.073 18.461 -20.292 1.00 0.52 H new ATOM 0 HB2 PRO A 132 1.598 17.881 -19.734 1.00 0.54 H new ATOM 0 HB3 PRO A 132 1.114 19.427 -20.402 1.00 0.54 H new ATOM 0 HG2 PRO A 132 1.927 18.765 -17.578 1.00 0.52 H new ATOM 0 HG3 PRO A 132 2.096 20.281 -18.441 1.00 0.52 H new ATOM 0 HD2 PRO A 132 0.083 19.731 -16.521 1.00 0.49 H new ATOM 0 HD3 PRO A 132 0.036 21.061 -17.661 1.00 0.49 H new ATOM 1976 N VAL A 133 -0.357 16.589 -17.719 1.00 0.50 N ATOM 1977 CA VAL A 133 -0.432 15.160 -17.273 1.00 0.52 C ATOM 1978 C VAL A 133 -1.887 14.733 -17.052 1.00 0.53 C ATOM 1979 O VAL A 133 -2.216 13.568 -17.130 1.00 0.65 O ATOM 1980 CB VAL A 133 0.382 14.971 -15.987 1.00 0.53 C ATOM 1981 CG1 VAL A 133 1.818 15.442 -16.228 1.00 1.08 C ATOM 1982 CG2 VAL A 133 -0.234 15.787 -14.848 1.00 1.44 C ATOM 0 H VAL A 133 -0.103 17.258 -16.992 1.00 0.50 H new ATOM 0 HA VAL A 133 -0.011 14.530 -18.056 1.00 0.52 H new ATOM 0 HB VAL A 133 0.376 13.916 -15.712 1.00 0.53 H new ATOM 0 HG11 VAL A 133 2.402 15.310 -15.317 1.00 1.08 H new ATOM 0 HG12 VAL A 133 2.263 14.856 -17.032 1.00 1.08 H new ATOM 0 HG13 VAL A 133 1.813 16.496 -16.507 1.00 1.08 H new ATOM 0 HG21 VAL A 133 0.352 15.645 -13.940 1.00 1.44 H new ATOM 0 HG22 VAL A 133 -0.236 16.843 -15.117 1.00 1.44 H new ATOM 0 HG23 VAL A 133 -1.258 15.455 -14.675 1.00 1.44 H new ATOM 1992 N GLN A 134 -2.755 15.667 -16.764 1.00 0.47 N ATOM 1993 CA GLN A 134 -4.194 15.335 -16.518 1.00 0.49 C ATOM 1994 C GLN A 134 -4.745 14.491 -17.688 1.00 0.48 C ATOM 1995 O GLN A 134 -5.488 13.552 -17.484 1.00 0.51 O ATOM 1996 CB GLN A 134 -4.964 16.671 -16.336 1.00 0.50 C ATOM 1997 CG GLN A 134 -6.404 16.610 -16.879 1.00 1.35 C ATOM 1998 CD GLN A 134 -6.384 16.898 -18.382 1.00 2.40 C ATOM 1999 OE1 GLN A 134 -6.932 16.147 -19.164 1.00 3.17 O ATOM 2000 NE2 GLN A 134 -5.770 17.964 -18.822 1.00 2.75 N ATOM 0 H GLN A 134 -2.527 16.658 -16.687 1.00 0.47 H new ATOM 0 HA GLN A 134 -4.316 14.735 -15.616 1.00 0.49 H new ATOM 0 HB2 GLN A 134 -4.991 16.928 -15.277 1.00 0.50 H new ATOM 0 HB3 GLN A 134 -4.423 17.469 -16.844 1.00 0.50 H new ATOM 0 HG2 GLN A 134 -6.836 15.627 -16.690 1.00 1.35 H new ATOM 0 HG3 GLN A 134 -7.031 17.338 -16.365 1.00 1.35 H new ATOM 0 HE21 GLN A 134 -5.310 18.595 -18.166 1.00 2.75 H new ATOM 0 HE22 GLN A 134 -5.751 18.165 -19.822 1.00 2.75 H new ATOM 2009 N SER A 135 -4.388 14.826 -18.900 1.00 0.47 N ATOM 2010 CA SER A 135 -4.892 14.054 -20.073 1.00 0.48 C ATOM 2011 C SER A 135 -4.156 12.713 -20.183 1.00 0.40 C ATOM 2012 O SER A 135 -4.743 11.703 -20.512 1.00 0.36 O ATOM 2013 CB SER A 135 -4.663 14.864 -21.349 1.00 0.57 C ATOM 2014 OG SER A 135 -5.774 15.724 -21.565 1.00 0.93 O ATOM 0 H SER A 135 -3.768 15.603 -19.128 1.00 0.47 H new ATOM 0 HA SER A 135 -5.957 13.864 -19.941 1.00 0.48 H new ATOM 0 HB2 SER A 135 -3.747 15.449 -21.263 1.00 0.57 H new ATOM 0 HB3 SER A 135 -4.535 14.195 -22.200 1.00 0.57 H new ATOM 0 HG SER A 135 -6.145 16.002 -20.702 1.00 0.93 H new ATOM 2020 N ALA A 136 -2.871 12.708 -19.934 1.00 0.41 N ATOM 2021 CA ALA A 136 -2.072 11.447 -20.046 1.00 0.39 C ATOM 2022 C ALA A 136 -2.324 10.521 -18.846 1.00 0.36 C ATOM 2023 O ALA A 136 -2.457 9.321 -19.001 1.00 0.36 O ATOM 2024 CB ALA A 136 -0.584 11.803 -20.111 1.00 0.47 C ATOM 0 H ALA A 136 -2.335 13.530 -19.655 1.00 0.41 H new ATOM 0 HA ALA A 136 -2.377 10.922 -20.951 1.00 0.39 H new ATOM 0 HB1 ALA A 136 0.005 10.890 -20.193 1.00 0.47 H new ATOM 0 HB2 ALA A 136 -0.398 12.434 -20.980 1.00 0.47 H new ATOM 0 HB3 ALA A 136 -0.298 12.339 -19.206 1.00 0.47 H new ATOM 2030 N LEU A 137 -2.358 11.059 -17.655 1.00 0.40 N ATOM 2031 CA LEU A 137 -2.572 10.202 -16.450 1.00 0.40 C ATOM 2032 C LEU A 137 -4.040 9.785 -16.347 1.00 0.38 C ATOM 2033 O LEU A 137 -4.345 8.644 -16.050 1.00 0.37 O ATOM 2034 CB LEU A 137 -2.163 10.973 -15.189 1.00 0.47 C ATOM 2035 CG LEU A 137 -0.675 11.342 -15.261 1.00 0.73 C ATOM 2036 CD1 LEU A 137 -0.275 12.089 -13.987 1.00 1.43 C ATOM 2037 CD2 LEU A 137 0.175 10.070 -15.388 1.00 1.27 C ATOM 0 H LEU A 137 -2.247 12.055 -17.464 1.00 0.40 H new ATOM 0 HA LEU A 137 -1.959 9.306 -16.543 1.00 0.40 H new ATOM 0 HB2 LEU A 137 -2.766 11.876 -15.093 1.00 0.47 H new ATOM 0 HB3 LEU A 137 -2.354 10.366 -14.304 1.00 0.47 H new ATOM 0 HG LEU A 137 -0.506 11.976 -16.131 1.00 0.73 H new ATOM 0 HD11 LEU A 137 0.782 12.352 -14.036 1.00 1.43 H new ATOM 0 HD12 LEU A 137 -0.871 12.997 -13.895 1.00 1.43 H new ATOM 0 HD13 LEU A 137 -0.450 11.451 -13.121 1.00 1.43 H new ATOM 0 HD21 LEU A 137 1.230 10.341 -15.439 1.00 1.27 H new ATOM 0 HD22 LEU A 137 0.005 9.431 -14.521 1.00 1.27 H new ATOM 0 HD23 LEU A 137 -0.106 9.534 -16.295 1.00 1.27 H new ATOM 2049 N GLN A 138 -4.952 10.693 -16.586 1.00 0.41 N ATOM 2050 CA GLN A 138 -6.400 10.344 -16.499 1.00 0.42 C ATOM 2051 C GLN A 138 -6.728 9.282 -17.552 1.00 0.37 C ATOM 2052 O GLN A 138 -7.507 8.378 -17.311 1.00 0.39 O ATOM 2053 CB GLN A 138 -7.245 11.597 -16.749 1.00 0.47 C ATOM 2054 CG GLN A 138 -8.730 11.263 -16.576 1.00 0.53 C ATOM 2055 CD GLN A 138 -9.345 10.959 -17.943 1.00 1.39 C ATOM 2056 OE1 GLN A 138 -9.702 11.859 -18.676 1.00 2.30 O ATOM 2057 NE2 GLN A 138 -9.484 9.718 -18.320 1.00 1.68 N ATOM 0 H GLN A 138 -4.755 11.662 -16.838 1.00 0.41 H new ATOM 0 HA GLN A 138 -6.623 9.953 -15.506 1.00 0.42 H new ATOM 0 HB2 GLN A 138 -6.957 12.386 -16.054 1.00 0.47 H new ATOM 0 HB3 GLN A 138 -7.062 11.975 -17.755 1.00 0.47 H new ATOM 0 HG2 GLN A 138 -8.846 10.405 -15.914 1.00 0.53 H new ATOM 0 HG3 GLN A 138 -9.250 12.099 -16.109 1.00 0.53 H new ATOM 0 HE21 GLN A 138 -9.184 8.962 -17.705 1.00 1.68 H new ATOM 0 HE22 GLN A 138 -9.892 9.504 -19.230 1.00 1.68 H new ATOM 2066 N GLU A 139 -6.135 9.384 -18.715 1.00 0.35 N ATOM 2067 CA GLU A 139 -6.406 8.383 -19.786 1.00 0.33 C ATOM 2068 C GLU A 139 -5.604 7.099 -19.512 1.00 0.30 C ATOM 2069 O GLU A 139 -5.957 6.031 -19.973 1.00 0.31 O ATOM 2070 CB GLU A 139 -6.034 8.983 -21.157 1.00 0.33 C ATOM 2071 CG GLU A 139 -4.511 9.100 -21.313 1.00 0.32 C ATOM 2072 CD GLU A 139 -4.187 9.931 -22.555 1.00 0.69 C ATOM 2073 OE1 GLU A 139 -4.938 10.848 -22.844 1.00 1.58 O ATOM 2074 OE2 GLU A 139 -3.191 9.638 -23.197 1.00 1.17 O ATOM 0 H GLU A 139 -5.474 10.119 -18.967 1.00 0.35 H new ATOM 0 HA GLU A 139 -7.466 8.129 -19.794 1.00 0.33 H new ATOM 0 HB2 GLU A 139 -6.437 8.357 -21.953 1.00 0.33 H new ATOM 0 HB3 GLU A 139 -6.490 9.967 -21.263 1.00 0.33 H new ATOM 0 HG2 GLU A 139 -4.079 9.567 -20.428 1.00 0.32 H new ATOM 0 HG3 GLU A 139 -4.067 8.109 -21.400 1.00 0.32 H new ATOM 2081 N ALA A 140 -4.527 7.201 -18.768 1.00 0.31 N ATOM 2082 CA ALA A 140 -3.701 5.994 -18.469 1.00 0.31 C ATOM 2083 C ALA A 140 -4.229 5.305 -17.208 1.00 0.33 C ATOM 2084 O ALA A 140 -4.248 4.092 -17.118 1.00 0.33 O ATOM 2085 CB ALA A 140 -2.247 6.413 -18.249 1.00 0.37 C ATOM 0 H ALA A 140 -4.187 8.070 -18.356 1.00 0.31 H new ATOM 0 HA ALA A 140 -3.759 5.302 -19.309 1.00 0.31 H new ATOM 0 HB1 ALA A 140 -1.644 5.532 -18.031 1.00 0.37 H new ATOM 0 HB2 ALA A 140 -1.868 6.898 -19.148 1.00 0.37 H new ATOM 0 HB3 ALA A 140 -2.191 7.108 -17.411 1.00 0.37 H new ATOM 2091 N ALA A 141 -4.658 6.071 -16.235 1.00 0.38 N ATOM 2092 CA ALA A 141 -5.185 5.463 -14.977 1.00 0.43 C ATOM 2093 C ALA A 141 -6.445 4.658 -15.293 1.00 0.45 C ATOM 2094 O ALA A 141 -6.725 3.652 -14.670 1.00 0.48 O ATOM 2095 CB ALA A 141 -5.525 6.571 -13.975 1.00 0.52 C ATOM 0 H ALA A 141 -4.665 7.091 -16.259 1.00 0.38 H new ATOM 0 HA ALA A 141 -4.430 4.806 -14.547 1.00 0.43 H new ATOM 0 HB1 ALA A 141 -5.910 6.126 -13.057 1.00 0.52 H new ATOM 0 HB2 ALA A 141 -4.627 7.147 -13.751 1.00 0.52 H new ATOM 0 HB3 ALA A 141 -6.281 7.230 -14.403 1.00 0.52 H new ATOM 2101 N GLU A 142 -7.209 5.098 -16.259 1.00 0.46 N ATOM 2102 CA GLU A 142 -8.458 4.369 -16.627 1.00 0.54 C ATOM 2103 C GLU A 142 -8.105 3.108 -17.424 1.00 0.51 C ATOM 2104 O GLU A 142 -8.736 2.078 -17.282 1.00 0.58 O ATOM 2105 CB GLU A 142 -9.366 5.287 -17.458 1.00 0.60 C ATOM 2106 CG GLU A 142 -8.661 5.701 -18.754 1.00 0.77 C ATOM 2107 CD GLU A 142 -9.592 6.593 -19.578 1.00 1.17 C ATOM 2108 OE1 GLU A 142 -10.333 7.356 -18.981 1.00 1.67 O ATOM 2109 OE2 GLU A 142 -9.548 6.497 -20.794 1.00 1.78 O ATOM 0 H GLU A 142 -7.020 5.935 -16.811 1.00 0.46 H new ATOM 0 HA GLU A 142 -8.988 4.075 -15.721 1.00 0.54 H new ATOM 0 HB2 GLU A 142 -10.298 4.773 -17.691 1.00 0.60 H new ATOM 0 HB3 GLU A 142 -9.627 6.173 -16.879 1.00 0.60 H new ATOM 0 HG2 GLU A 142 -7.738 6.234 -18.524 1.00 0.77 H new ATOM 0 HG3 GLU A 142 -8.384 4.817 -19.328 1.00 0.77 H new ATOM 2116 N LYS A 143 -7.101 3.187 -18.263 1.00 0.45 N ATOM 2117 CA LYS A 143 -6.700 1.999 -19.075 1.00 0.46 C ATOM 2118 C LYS A 143 -5.962 0.997 -18.187 1.00 0.40 C ATOM 2119 O LYS A 143 -6.176 -0.198 -18.276 1.00 0.44 O ATOM 2120 CB LYS A 143 -5.774 2.441 -20.208 1.00 0.49 C ATOM 2121 CG LYS A 143 -6.523 3.395 -21.137 1.00 1.00 C ATOM 2122 CD LYS A 143 -5.527 4.072 -22.079 1.00 1.74 C ATOM 2123 CE LYS A 143 -6.288 4.818 -23.177 1.00 1.95 C ATOM 2124 NZ LYS A 143 -5.458 4.860 -24.414 1.00 1.92 N ATOM 0 H LYS A 143 -6.542 4.025 -18.420 1.00 0.45 H new ATOM 0 HA LYS A 143 -7.592 1.532 -19.492 1.00 0.46 H new ATOM 0 HB2 LYS A 143 -4.891 2.933 -19.799 1.00 0.49 H new ATOM 0 HB3 LYS A 143 -5.425 1.572 -20.766 1.00 0.49 H new ATOM 0 HG2 LYS A 143 -7.270 2.848 -21.712 1.00 1.00 H new ATOM 0 HG3 LYS A 143 -7.056 4.145 -20.553 1.00 1.00 H new ATOM 0 HD2 LYS A 143 -4.898 4.766 -21.522 1.00 1.74 H new ATOM 0 HD3 LYS A 143 -4.866 3.327 -22.522 1.00 1.74 H new ATOM 0 HE2 LYS A 143 -7.237 4.321 -23.379 1.00 1.95 H new ATOM 0 HE3 LYS A 143 -6.522 5.831 -22.849 1.00 1.95 H new ATOM 0 HZ1 LYS A 143 -5.974 5.367 -25.161 1.00 1.92 H new ATOM 0 HZ2 LYS A 143 -4.564 5.353 -24.216 1.00 1.92 H new ATOM 0 HZ3 LYS A 143 -5.256 3.890 -24.730 1.00 1.92 H new ATOM 2138 N THR A 144 -5.096 1.478 -17.333 1.00 0.36 N ATOM 2139 CA THR A 144 -4.340 0.561 -16.435 1.00 0.35 C ATOM 2140 C THR A 144 -5.302 -0.024 -15.399 1.00 0.36 C ATOM 2141 O THR A 144 -5.150 -1.148 -14.959 1.00 0.38 O ATOM 2142 CB THR A 144 -3.209 1.341 -15.744 1.00 0.38 C ATOM 2143 OG1 THR A 144 -2.416 0.443 -14.981 1.00 0.45 O ATOM 2144 CG2 THR A 144 -3.786 2.421 -14.824 1.00 0.40 C ATOM 0 H THR A 144 -4.881 2.469 -17.220 1.00 0.36 H new ATOM 0 HA THR A 144 -3.899 -0.253 -17.011 1.00 0.35 H new ATOM 0 HB THR A 144 -2.596 1.822 -16.506 1.00 0.38 H new ATOM 0 HG1 THR A 144 -1.694 0.938 -14.541 1.00 0.45 H new ATOM 0 HG21 THR A 144 -2.971 2.963 -14.343 1.00 0.40 H new ATOM 0 HG22 THR A 144 -4.387 3.115 -15.411 1.00 0.40 H new ATOM 0 HG23 THR A 144 -4.410 1.954 -14.062 1.00 0.40 H new ATOM 2152 N LYS A 145 -6.297 0.736 -15.020 1.00 0.40 N ATOM 2153 CA LYS A 145 -7.287 0.240 -14.026 1.00 0.48 C ATOM 2154 C LYS A 145 -8.110 -0.874 -14.682 1.00 0.50 C ATOM 2155 O LYS A 145 -8.415 -1.878 -14.065 1.00 0.55 O ATOM 2156 CB LYS A 145 -8.188 1.416 -13.588 1.00 0.56 C ATOM 2157 CG LYS A 145 -9.449 0.927 -12.853 1.00 0.87 C ATOM 2158 CD LYS A 145 -9.069 0.071 -11.642 1.00 0.85 C ATOM 2159 CE LYS A 145 -10.254 -0.823 -11.276 1.00 1.65 C ATOM 2160 NZ LYS A 145 -10.180 -2.094 -12.052 1.00 2.12 N ATOM 0 H LYS A 145 -6.464 1.683 -15.360 1.00 0.40 H new ATOM 0 HA LYS A 145 -6.792 -0.160 -13.141 1.00 0.48 H new ATOM 0 HB2 LYS A 145 -7.624 2.083 -12.937 1.00 0.56 H new ATOM 0 HB3 LYS A 145 -8.480 1.996 -14.463 1.00 0.56 H new ATOM 0 HG2 LYS A 145 -10.042 1.782 -12.529 1.00 0.87 H new ATOM 0 HG3 LYS A 145 -10.072 0.347 -13.534 1.00 0.87 H new ATOM 0 HD2 LYS A 145 -8.194 -0.538 -11.870 1.00 0.85 H new ATOM 0 HD3 LYS A 145 -8.803 0.708 -10.799 1.00 0.85 H new ATOM 0 HE2 LYS A 145 -10.245 -1.037 -10.207 1.00 1.65 H new ATOM 0 HE3 LYS A 145 -11.191 -0.308 -11.490 1.00 1.65 H new ATOM 0 HZ1 LYS A 145 -10.990 -2.152 -12.701 1.00 2.12 H new ATOM 0 HZ2 LYS A 145 -9.296 -2.116 -12.599 1.00 2.12 H new ATOM 0 HZ3 LYS A 145 -10.202 -2.902 -11.398 1.00 2.12 H new ATOM 2174 N GLU A 146 -8.456 -0.705 -15.932 1.00 0.49 N ATOM 2175 CA GLU A 146 -9.248 -1.752 -16.644 1.00 0.55 C ATOM 2176 C GLU A 146 -8.431 -3.044 -16.697 1.00 0.55 C ATOM 2177 O GLU A 146 -8.971 -4.134 -16.666 1.00 0.60 O ATOM 2178 CB GLU A 146 -9.556 -1.281 -18.067 1.00 0.58 C ATOM 2179 CG GLU A 146 -10.724 -2.093 -18.632 1.00 0.67 C ATOM 2180 CD GLU A 146 -11.537 -1.219 -19.589 1.00 1.18 C ATOM 2181 OE1 GLU A 146 -12.221 -0.328 -19.113 1.00 1.87 O ATOM 2182 OE2 GLU A 146 -11.462 -1.457 -20.784 1.00 1.83 O ATOM 0 H GLU A 146 -8.223 0.115 -16.492 1.00 0.49 H new ATOM 0 HA GLU A 146 -10.184 -1.930 -16.115 1.00 0.55 H new ATOM 0 HB2 GLU A 146 -9.805 -0.220 -18.064 1.00 0.58 H new ATOM 0 HB3 GLU A 146 -8.676 -1.401 -18.699 1.00 0.58 H new ATOM 0 HG2 GLU A 146 -10.350 -2.973 -19.155 1.00 0.67 H new ATOM 0 HG3 GLU A 146 -11.358 -2.450 -17.821 1.00 0.67 H new ATOM 2189 N ALA A 147 -7.129 -2.924 -16.767 1.00 0.50 N ATOM 2190 CA ALA A 147 -6.261 -4.134 -16.809 1.00 0.52 C ATOM 2191 C ALA A 147 -6.229 -4.769 -15.418 1.00 0.52 C ATOM 2192 O ALA A 147 -6.135 -5.974 -15.277 1.00 0.56 O ATOM 2193 CB ALA A 147 -4.844 -3.731 -17.229 1.00 0.51 C ATOM 0 H ALA A 147 -6.630 -2.035 -16.797 1.00 0.50 H new ATOM 0 HA ALA A 147 -6.655 -4.851 -17.529 1.00 0.52 H new ATOM 0 HB1 ALA A 147 -4.208 -4.616 -17.260 1.00 0.51 H new ATOM 0 HB2 ALA A 147 -4.874 -3.271 -18.217 1.00 0.51 H new ATOM 0 HB3 ALA A 147 -4.440 -3.019 -16.509 1.00 0.51 H new ATOM 2199 N ALA A 148 -6.313 -3.960 -14.390 1.00 0.50 N ATOM 2200 CA ALA A 148 -6.295 -4.503 -13.001 1.00 0.53 C ATOM 2201 C ALA A 148 -7.620 -5.215 -12.727 1.00 0.58 C ATOM 2202 O ALA A 148 -7.663 -6.223 -12.046 1.00 0.60 O ATOM 2203 CB ALA A 148 -6.117 -3.354 -12.006 1.00 0.53 C ATOM 0 H ALA A 148 -6.393 -2.945 -14.456 1.00 0.50 H new ATOM 0 HA ALA A 148 -5.469 -5.206 -12.891 1.00 0.53 H new ATOM 0 HB1 ALA A 148 -6.104 -3.751 -10.991 1.00 0.53 H new ATOM 0 HB2 ALA A 148 -5.177 -2.841 -12.207 1.00 0.53 H new ATOM 0 HB3 ALA A 148 -6.944 -2.651 -12.110 1.00 0.53 H new ATOM 2209 N ALA A 149 -8.700 -4.699 -13.260 1.00 0.60 N ATOM 2210 CA ALA A 149 -10.030 -5.341 -13.042 1.00 0.66 C ATOM 2211 C ALA A 149 -10.018 -6.751 -13.639 1.00 0.61 C ATOM 2212 O ALA A 149 -10.380 -7.713 -12.988 1.00 0.63 O ATOM 2213 CB ALA A 149 -11.117 -4.505 -13.723 1.00 0.78 C ATOM 0 H ALA A 149 -8.716 -3.859 -13.838 1.00 0.60 H new ATOM 0 HA ALA A 149 -10.236 -5.401 -11.973 1.00 0.66 H new ATOM 0 HB1 ALA A 149 -12.089 -4.973 -13.564 1.00 0.78 H new ATOM 0 HB2 ALA A 149 -11.124 -3.501 -13.298 1.00 0.78 H new ATOM 0 HB3 ALA A 149 -10.913 -4.445 -14.792 1.00 0.78 H new ATOM 2219 N ASN A 150 -9.599 -6.875 -14.874 1.00 0.61 N ATOM 2220 CA ASN A 150 -9.554 -8.219 -15.522 1.00 0.62 C ATOM 2221 C ASN A 150 -8.492 -9.077 -14.833 1.00 0.53 C ATOM 2222 O ASN A 150 -8.622 -10.282 -14.737 1.00 0.55 O ATOM 2223 CB ASN A 150 -9.200 -8.060 -17.002 1.00 0.71 C ATOM 2224 CG ASN A 150 -9.425 -9.388 -17.727 1.00 0.69 C ATOM 2225 OD1 ASN A 150 -10.492 -9.964 -17.647 1.00 0.80 O ATOM 2226 ND2 ASN A 150 -8.458 -9.902 -18.437 1.00 1.07 N ATOM 0 H ASN A 150 -9.286 -6.102 -15.461 1.00 0.61 H new ATOM 0 HA ASN A 150 -10.528 -8.701 -15.432 1.00 0.62 H new ATOM 0 HB2 ASN A 150 -9.814 -7.280 -17.452 1.00 0.71 H new ATOM 0 HB3 ASN A 150 -8.161 -7.748 -17.107 1.00 0.71 H new ATOM 0 HD21 ASN A 150 -8.598 -10.787 -18.925 1.00 1.07 H new ATOM 0 HD22 ASN A 150 -7.562 -9.419 -18.504 1.00 1.07 H new ATOM 2233 N LEU A 151 -7.444 -8.458 -14.350 1.00 0.48 N ATOM 2234 CA LEU A 151 -6.367 -9.225 -13.658 1.00 0.46 C ATOM 2235 C LEU A 151 -6.927 -9.821 -12.367 1.00 0.43 C ATOM 2236 O LEU A 151 -6.897 -11.020 -12.161 1.00 0.44 O ATOM 2237 CB LEU A 151 -5.208 -8.283 -13.325 1.00 0.47 C ATOM 2238 CG LEU A 151 -3.990 -9.100 -12.894 1.00 0.39 C ATOM 2239 CD1 LEU A 151 -3.150 -9.454 -14.122 1.00 0.63 C ATOM 2240 CD2 LEU A 151 -3.145 -8.276 -11.920 1.00 0.66 C ATOM 0 H LEU A 151 -7.289 -7.451 -14.406 1.00 0.48 H new ATOM 0 HA LEU A 151 -6.009 -10.025 -14.306 1.00 0.46 H new ATOM 0 HB2 LEU A 151 -4.960 -7.673 -14.194 1.00 0.47 H new ATOM 0 HB3 LEU A 151 -5.500 -7.599 -12.528 1.00 0.47 H new ATOM 0 HG LEU A 151 -4.322 -10.016 -12.406 1.00 0.39 H new ATOM 0 HD11 LEU A 151 -2.282 -10.036 -13.813 1.00 0.63 H new ATOM 0 HD12 LEU A 151 -3.751 -10.039 -14.818 1.00 0.63 H new ATOM 0 HD13 LEU A 151 -2.817 -8.539 -14.611 1.00 0.63 H new ATOM 0 HD21 LEU A 151 -2.276 -8.857 -11.611 1.00 0.66 H new ATOM 0 HD22 LEU A 151 -2.814 -7.360 -12.410 1.00 0.66 H new ATOM 0 HD23 LEU A 151 -3.742 -8.023 -11.044 1.00 0.66 H new ATOM 2252 N GLN A 152 -7.442 -8.988 -11.500 1.00 0.46 N ATOM 2253 CA GLN A 152 -8.015 -9.488 -10.218 1.00 0.49 C ATOM 2254 C GLN A 152 -9.219 -10.383 -10.516 1.00 0.50 C ATOM 2255 O GLN A 152 -9.512 -11.309 -9.783 1.00 0.53 O ATOM 2256 CB GLN A 152 -8.459 -8.300 -9.362 1.00 0.51 C ATOM 2257 CG GLN A 152 -8.913 -8.802 -7.990 1.00 0.60 C ATOM 2258 CD GLN A 152 -10.024 -7.895 -7.456 1.00 0.89 C ATOM 2259 OE1 GLN A 152 -10.995 -8.368 -6.902 1.00 1.47 O ATOM 2260 NE2 GLN A 152 -9.921 -6.602 -7.602 1.00 0.82 N ATOM 0 H GLN A 152 -7.490 -7.977 -11.627 1.00 0.46 H new ATOM 0 HA GLN A 152 -7.261 -10.061 -9.679 1.00 0.49 H new ATOM 0 HB2 GLN A 152 -7.638 -7.592 -9.249 1.00 0.51 H new ATOM 0 HB3 GLN A 152 -9.273 -7.767 -9.854 1.00 0.51 H new ATOM 0 HG2 GLN A 152 -9.272 -9.828 -8.067 1.00 0.60 H new ATOM 0 HG3 GLN A 152 -8.071 -8.810 -7.297 1.00 0.60 H new ATOM 0 HE21 GLN A 152 -9.105 -6.205 -8.068 1.00 0.82 H new ATOM 0 HE22 GLN A 152 -10.656 -5.989 -7.251 1.00 0.82 H new ATOM 2269 N ASN A 153 -9.925 -10.108 -11.587 1.00 0.51 N ATOM 2270 CA ASN A 153 -11.123 -10.931 -11.948 1.00 0.56 C ATOM 2271 C ASN A 153 -10.749 -12.417 -12.011 1.00 0.59 C ATOM 2272 O ASN A 153 -11.450 -13.260 -11.489 1.00 0.67 O ATOM 2273 CB ASN A 153 -11.653 -10.483 -13.312 1.00 0.60 C ATOM 2274 CG ASN A 153 -12.976 -11.192 -13.604 1.00 0.95 C ATOM 2275 OD1 ASN A 153 -13.071 -12.398 -13.489 1.00 1.83 O ATOM 2276 ND2 ASN A 153 -14.009 -10.490 -13.980 1.00 0.94 N ATOM 0 H ASN A 153 -9.721 -9.344 -12.231 1.00 0.51 H new ATOM 0 HA ASN A 153 -11.891 -10.792 -11.187 1.00 0.56 H new ATOM 0 HB2 ASN A 153 -11.798 -9.403 -13.321 1.00 0.60 H new ATOM 0 HB3 ASN A 153 -10.925 -10.713 -14.090 1.00 0.60 H new ATOM 0 HD21 ASN A 153 -14.896 -10.953 -14.177 1.00 0.94 H new ATOM 0 HD22 ASN A 153 -13.930 -9.478 -14.077 1.00 0.94 H new ATOM 2283 N SER A 154 -9.649 -12.739 -12.645 1.00 0.59 N ATOM 2284 CA SER A 154 -9.226 -14.169 -12.739 1.00 0.67 C ATOM 2285 C SER A 154 -8.857 -14.676 -11.343 1.00 0.64 C ATOM 2286 O SER A 154 -9.318 -15.714 -10.907 1.00 0.70 O ATOM 2287 CB SER A 154 -8.012 -14.283 -13.663 1.00 0.74 C ATOM 2288 OG SER A 154 -8.454 -14.571 -14.983 1.00 1.42 O ATOM 0 H SER A 154 -9.026 -12.073 -13.101 1.00 0.59 H new ATOM 0 HA SER A 154 -10.043 -14.768 -13.142 1.00 0.67 H new ATOM 0 HB2 SER A 154 -7.443 -13.353 -13.652 1.00 0.74 H new ATOM 0 HB3 SER A 154 -7.344 -15.069 -13.311 1.00 0.74 H new ATOM 0 HG SER A 154 -8.071 -15.424 -15.277 1.00 1.42 H new ATOM 2294 N ILE A 155 -8.029 -13.944 -10.643 1.00 0.59 N ATOM 2295 CA ILE A 155 -7.615 -14.358 -9.271 1.00 0.62 C ATOM 2296 C ILE A 155 -8.854 -14.476 -8.371 1.00 0.62 C ATOM 2297 O ILE A 155 -8.992 -15.416 -7.611 1.00 0.69 O ATOM 2298 CB ILE A 155 -6.657 -13.299 -8.712 1.00 0.60 C ATOM 2299 CG1 ILE A 155 -5.427 -13.203 -9.623 1.00 0.71 C ATOM 2300 CG2 ILE A 155 -6.211 -13.682 -7.298 1.00 0.72 C ATOM 2301 CD1 ILE A 155 -4.960 -11.749 -9.703 1.00 0.56 C ATOM 0 H ILE A 155 -7.619 -13.069 -10.968 1.00 0.59 H new ATOM 0 HA ILE A 155 -7.116 -15.326 -9.304 1.00 0.62 H new ATOM 0 HB ILE A 155 -7.170 -12.338 -8.674 1.00 0.60 H new ATOM 0 HG12 ILE A 155 -4.625 -13.832 -9.236 1.00 0.71 H new ATOM 0 HG13 ILE A 155 -5.670 -13.573 -10.619 1.00 0.71 H new ATOM 0 HG21 ILE A 155 -5.531 -12.922 -6.913 1.00 0.72 H new ATOM 0 HG22 ILE A 155 -7.083 -13.752 -6.648 1.00 0.72 H new ATOM 0 HG23 ILE A 155 -5.701 -14.645 -7.326 1.00 0.72 H new ATOM 0 HD11 ILE A 155 -4.086 -11.683 -10.351 1.00 0.56 H new ATOM 0 HD12 ILE A 155 -5.761 -11.132 -10.110 1.00 0.56 H new ATOM 0 HD13 ILE A 155 -4.700 -11.395 -8.705 1.00 0.56 H new ATOM 2313 N GLN A 156 -9.748 -13.524 -8.452 1.00 0.57 N ATOM 2314 CA GLN A 156 -10.977 -13.567 -7.605 1.00 0.62 C ATOM 2315 C GLN A 156 -11.953 -14.609 -8.161 1.00 0.66 C ATOM 2316 O GLN A 156 -12.669 -15.255 -7.423 1.00 0.75 O ATOM 2317 CB GLN A 156 -11.647 -12.190 -7.614 1.00 0.66 C ATOM 2318 CG GLN A 156 -12.553 -12.054 -6.389 1.00 0.84 C ATOM 2319 CD GLN A 156 -13.579 -10.946 -6.633 1.00 1.31 C ATOM 2320 OE1 GLN A 156 -13.712 -10.040 -5.835 1.00 1.70 O ATOM 2321 NE2 GLN A 156 -14.314 -10.981 -7.710 1.00 2.17 N ATOM 0 H GLN A 156 -9.679 -12.716 -9.071 1.00 0.57 H new ATOM 0 HA GLN A 156 -10.703 -13.837 -6.585 1.00 0.62 H new ATOM 0 HB2 GLN A 156 -10.890 -11.406 -7.608 1.00 0.66 H new ATOM 0 HB3 GLN A 156 -12.230 -12.064 -8.526 1.00 0.66 H new ATOM 0 HG2 GLN A 156 -13.061 -12.998 -6.193 1.00 0.84 H new ATOM 0 HG3 GLN A 156 -11.957 -11.824 -5.506 1.00 0.84 H new ATOM 0 HE21 GLN A 156 -14.202 -11.742 -8.380 1.00 2.17 H new ATOM 0 HE22 GLN A 156 -15.001 -10.247 -7.883 1.00 2.17 H new ATOM 2330 N SER A 157 -11.984 -14.772 -9.456 1.00 0.67 N ATOM 2331 CA SER A 157 -12.914 -15.766 -10.074 1.00 0.81 C ATOM 2332 C SER A 157 -12.372 -17.178 -9.859 1.00 0.84 C ATOM 2333 O SER A 157 -13.122 -18.128 -9.732 1.00 0.96 O ATOM 2334 CB SER A 157 -13.031 -15.492 -11.574 1.00 0.90 C ATOM 2335 OG SER A 157 -13.712 -16.574 -12.196 1.00 1.43 O ATOM 0 H SER A 157 -11.403 -14.257 -10.118 1.00 0.67 H new ATOM 0 HA SER A 157 -13.896 -15.679 -9.609 1.00 0.81 H new ATOM 0 HB2 SER A 157 -13.571 -14.561 -11.744 1.00 0.90 H new ATOM 0 HB3 SER A 157 -12.040 -15.371 -12.012 1.00 0.90 H new ATOM 0 HG SER A 157 -13.791 -16.402 -13.158 1.00 1.43 H new ATOM 2341 N ALA A 158 -11.076 -17.317 -9.821 1.00 0.78 N ATOM 2342 CA ALA A 158 -10.464 -18.663 -9.618 1.00 0.87 C ATOM 2343 C ALA A 158 -10.598 -19.066 -8.150 1.00 0.93 C ATOM 2344 O ALA A 158 -10.805 -20.222 -7.831 1.00 1.06 O ATOM 2345 CB ALA A 158 -8.983 -18.613 -10.001 1.00 0.82 C ATOM 0 H ALA A 158 -10.409 -16.552 -9.922 1.00 0.78 H new ATOM 0 HA ALA A 158 -10.976 -19.394 -10.244 1.00 0.87 H new ATOM 0 HB1 ALA A 158 -8.536 -19.596 -9.853 1.00 0.82 H new ATOM 0 HB2 ALA A 158 -8.887 -18.325 -11.048 1.00 0.82 H new ATOM 0 HB3 ALA A 158 -8.470 -17.883 -9.375 1.00 0.82 H new ATOM 2351 N VAL A 159 -10.474 -18.120 -7.259 1.00 0.90 N ATOM 2352 CA VAL A 159 -10.585 -18.429 -5.804 1.00 1.06 C ATOM 2353 C VAL A 159 -12.059 -18.648 -5.431 1.00 1.20 C ATOM 2354 O VAL A 159 -12.383 -19.490 -4.615 1.00 1.36 O ATOM 2355 CB VAL A 159 -9.986 -17.264 -4.999 1.00 1.12 C ATOM 2356 CG1 VAL A 159 -10.824 -15.997 -5.186 1.00 1.31 C ATOM 2357 CG2 VAL A 159 -9.947 -17.636 -3.515 1.00 1.54 C ATOM 0 H VAL A 159 -10.299 -17.139 -7.478 1.00 0.90 H new ATOM 0 HA VAL A 159 -10.035 -19.341 -5.572 1.00 1.06 H new ATOM 0 HB VAL A 159 -8.975 -17.072 -5.358 1.00 1.12 H new ATOM 0 HG11 VAL A 159 -10.386 -15.182 -4.609 1.00 1.31 H new ATOM 0 HG12 VAL A 159 -10.842 -15.725 -6.241 1.00 1.31 H new ATOM 0 HG13 VAL A 159 -11.842 -16.180 -4.841 1.00 1.31 H new ATOM 0 HG21 VAL A 159 -9.522 -16.810 -2.944 1.00 1.54 H new ATOM 0 HG22 VAL A 159 -10.959 -17.838 -3.164 1.00 1.54 H new ATOM 0 HG23 VAL A 159 -9.332 -18.525 -3.379 1.00 1.54 H new ATOM 2367 N GLN A 160 -12.946 -17.888 -6.022 1.00 1.18 N ATOM 2368 CA GLN A 160 -14.401 -18.032 -5.713 1.00 1.37 C ATOM 2369 C GLN A 160 -14.967 -19.281 -6.397 1.00 1.46 C ATOM 2370 O GLN A 160 -15.901 -19.891 -5.914 1.00 1.63 O ATOM 2371 CB GLN A 160 -15.155 -16.799 -6.219 1.00 1.40 C ATOM 2372 CG GLN A 160 -14.686 -15.560 -5.454 1.00 1.53 C ATOM 2373 CD GLN A 160 -15.197 -14.301 -6.159 1.00 1.33 C ATOM 2374 OE1 GLN A 160 -15.793 -13.443 -5.539 1.00 1.51 O ATOM 2375 NE2 GLN A 160 -14.986 -14.155 -7.439 1.00 1.53 N ATOM 0 H GLN A 160 -12.723 -17.169 -6.710 1.00 1.18 H new ATOM 0 HA GLN A 160 -14.524 -18.127 -4.634 1.00 1.37 H new ATOM 0 HB2 GLN A 160 -14.981 -16.667 -7.287 1.00 1.40 H new ATOM 0 HB3 GLN A 160 -16.228 -16.936 -6.086 1.00 1.40 H new ATOM 0 HG2 GLN A 160 -15.055 -15.591 -4.429 1.00 1.53 H new ATOM 0 HG3 GLN A 160 -13.597 -15.543 -5.400 1.00 1.53 H new ATOM 0 HE21 GLN A 160 -14.485 -14.876 -7.959 1.00 1.53 H new ATOM 0 HE22 GLN A 160 -15.322 -13.320 -7.919 1.00 1.53 H new