USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 833 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 174 GLN : amide:sc= -0.0823 X(o=-0.17,f=-0.63) USER MOD Set 1.2: A 176 THR OG1 : rot 180:sc= -0.0864 USER MOD Set 2.1: A 166 GLN : amide:sc= -0.0144 K(o=0.73,f=-2.9) USER MOD Set 2.2: A 168 LYS NZ :NH3+ -147:sc= 0.747 (180deg=-0.00213) USER MOD Set 3.1: A 145 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 162 ASN : amide:sc= -0.989 K(o=-0.99,f=-0.27) USER MOD Set 4.1: A 68 LYS NZ :NH3+ -156:sc= 2.09 (180deg=-0.579) USER MOD Set 4.2: A 126 ASN : amide:sc= -0.183 K(o=1.9,f=-1.8) USER MOD Set 5.1: A 121 SER OG : rot 170:sc= 0.087 USER MOD Set 5.2: A 150 GLN : amide:sc= -0.0722 K(o=0.015,f=0.71) USER MOD Set 6.1: A 94 THR OG1 : rot 113:sc= -0.406! USER MOD Set 6.2: A 96 ASN : amide:sc= 1.58 K(o=1.2,f=-7.7!) USER MOD Set 7.1: A 60 GLN : amide:sc= -0.0786 X(o=0.044,f=0.47) USER MOD Set 7.2: A 63 SER OG : rot -162:sc= 0.119 USER MOD Set 7.3: A 140 GLN : amide:sc= 0.0235 X(o=0.044,f=0.47) USER MOD Set 7.4: A 142 TYR OH : rot -8:sc= -0.0202 USER MOD Single : A 61 SER OG : rot -44:sc= 0.932 USER MOD Single : A 65 LYS NZ :NH3+ -163:sc= 1.2 (180deg=0.834) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 154:sc= 2.21 (180deg=1.22) USER MOD Single : A 73 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 75 TYR OH : rot 58:sc= 0.774 USER MOD Single : A 76 ASN : amide:sc= -2.62 K(o=-2.6,f=-1.9) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 170:sc= -0.896 (180deg=-1.2) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 0.671 K(o=0.67,f=0) USER MOD Single : A 82 LYS NZ :NH3+ -127:sc= 0.596 (180deg=-1.83!) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 MET CE :methyl -140:sc= -0.0825 (180deg=-0.486) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -179:sc= 0.852 (180deg=0.792) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.291 X(o=0.29,f=0) USER MOD Single : A 102 GLN : amide:sc= -1.33 K(o=-1.3,f=-2.9!) USER MOD Single : A 103 ASN : amide:sc= 1.13 K(o=1.1,f=-0.084) USER MOD Single : A 106 ASN : amide:sc= -0.158 K(o=-0.16,f=-2.3!) USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -139:sc=-0.00147 (180deg=-1.11) USER MOD Single : A 122 SER OG : rot 180:sc= -0.128 USER MOD Single : A 124 ASN : amide:sc= -1.96! X(o=-2!,f=-1.7) USER MOD Single : A 129 LYS NZ :NH3+ 178:sc= 2.42 (180deg=2.34) USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.058) USER MOD Single : A 149 HIS : no HE2:sc= 1.18 K(o=1.2,f=-3.9!) USER MOD Single : A 153 ASN : amide:sc= 0 X(o=0,f=0.0081) USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 LYS NZ :NH3+ 163:sc= 0.216! (180deg=-0.128) USER MOD Single : A 157 ASN : amide:sc= -0.0539 X(o=-0.054,f=0) USER MOD Single : A 163 GLN : amide:sc= -2.67! C(o=-2.7!,f=-6.8!) USER MOD Single : A 169 ASN : amide:sc= -0.248 X(o=-0.25,f=0) USER MOD Single : A 170 GLN : amide:sc= 1.23 K(o=1.2,f=-0.029) USER MOD Single : A 171 LYS NZ :NH3+ -169:sc= 1.99 (180deg=1.77) USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 177 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 56 N GLN A 60 15.234 2.829 -4.580 1.00 0.00 N ATOM 57 CA GLN A 60 14.200 3.820 -4.355 1.00 0.00 C ATOM 58 C GLN A 60 12.938 3.468 -5.145 1.00 0.00 C ATOM 59 O GLN A 60 11.883 3.266 -4.561 1.00 0.00 O ATOM 60 CB GLN A 60 14.702 5.203 -4.780 1.00 0.00 C ATOM 61 CG GLN A 60 15.901 5.724 -3.990 1.00 0.00 C ATOM 62 CD GLN A 60 15.551 6.225 -2.605 1.00 0.00 C ATOM 63 OE1 GLN A 60 15.245 7.388 -2.427 1.00 0.00 O ATOM 64 NE2 GLN A 60 15.602 5.370 -1.623 1.00 0.00 N ATOM 0 HA GLN A 60 13.958 3.832 -3.292 1.00 0.00 H new ATOM 0 HB2 GLN A 60 14.969 5.167 -5.836 1.00 0.00 H new ATOM 0 HB3 GLN A 60 13.884 5.916 -4.682 1.00 0.00 H new ATOM 0 HG2 GLN A 60 16.640 4.927 -3.902 1.00 0.00 H new ATOM 0 HG3 GLN A 60 16.370 6.533 -4.551 1.00 0.00 H new ATOM 0 HE21 GLN A 60 15.862 4.400 -1.804 1.00 0.00 H new ATOM 0 HE22 GLN A 60 15.382 5.670 -0.673 1.00 0.00 H new ATOM 73 N SER A 61 13.091 3.266 -6.432 1.00 0.00 N ATOM 74 CA SER A 61 11.972 2.973 -7.287 1.00 0.00 C ATOM 75 C SER A 61 11.450 1.535 -7.123 1.00 0.00 C ATOM 76 O SER A 61 10.254 1.282 -7.323 1.00 0.00 O ATOM 77 CB SER A 61 12.308 3.326 -8.718 1.00 0.00 C ATOM 78 OG SER A 61 12.649 4.700 -8.788 1.00 0.00 O ATOM 0 H SER A 61 13.991 3.300 -6.911 1.00 0.00 H new ATOM 0 HA SER A 61 11.137 3.601 -6.977 1.00 0.00 H new ATOM 0 HB2 SER A 61 13.138 2.714 -9.072 1.00 0.00 H new ATOM 0 HB3 SER A 61 11.458 3.116 -9.367 1.00 0.00 H new ATOM 0 HG SER A 61 12.007 5.223 -8.264 1.00 0.00 H new ATOM 84 N GLU A 62 12.328 0.587 -6.743 1.00 0.00 N ATOM 85 CA GLU A 62 11.858 -0.756 -6.416 1.00 0.00 C ATOM 86 C GLU A 62 10.974 -0.682 -5.193 1.00 0.00 C ATOM 87 O GLU A 62 9.905 -1.235 -5.164 1.00 0.00 O ATOM 88 CB GLU A 62 12.981 -1.773 -6.152 1.00 0.00 C ATOM 89 CG GLU A 62 13.807 -2.193 -7.355 1.00 0.00 C ATOM 90 CD GLU A 62 14.471 -3.533 -7.102 1.00 0.00 C ATOM 91 OE1 GLU A 62 13.741 -4.526 -7.016 1.00 0.00 O ATOM 92 OE2 GLU A 62 15.702 -3.630 -6.983 1.00 0.00 O ATOM 0 H GLU A 62 13.335 0.727 -6.659 1.00 0.00 H new ATOM 0 HA GLU A 62 11.317 -1.112 -7.293 1.00 0.00 H new ATOM 0 HB2 GLU A 62 13.654 -1.352 -5.405 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.537 -2.667 -5.714 1.00 0.00 H new ATOM 0 HG2 GLU A 62 13.169 -2.257 -8.237 1.00 0.00 H new ATOM 0 HG3 GLU A 62 14.565 -1.438 -7.564 1.00 0.00 H new ATOM 99 N SER A 63 11.427 0.029 -4.207 1.00 0.00 N ATOM 100 CA SER A 63 10.678 0.237 -3.006 1.00 0.00 C ATOM 101 C SER A 63 9.373 0.967 -3.307 1.00 0.00 C ATOM 102 O SER A 63 8.318 0.567 -2.820 1.00 0.00 O ATOM 103 CB SER A 63 11.520 1.016 -2.022 1.00 0.00 C ATOM 104 OG SER A 63 12.693 0.282 -1.667 1.00 0.00 O ATOM 0 H SER A 63 12.338 0.487 -4.214 1.00 0.00 H new ATOM 0 HA SER A 63 10.422 -0.728 -2.568 1.00 0.00 H new ATOM 0 HB2 SER A 63 11.803 1.974 -2.457 1.00 0.00 H new ATOM 0 HB3 SER A 63 10.936 1.232 -1.127 1.00 0.00 H new ATOM 0 HG SER A 63 13.072 0.650 -0.842 1.00 0.00 H new ATOM 110 N GLU A 64 9.451 1.986 -4.170 1.00 0.00 N ATOM 111 CA GLU A 64 8.294 2.771 -4.565 1.00 0.00 C ATOM 112 C GLU A 64 7.250 1.910 -5.132 1.00 0.00 C ATOM 113 O GLU A 64 6.120 1.952 -4.704 1.00 0.00 O ATOM 114 CB GLU A 64 8.599 3.782 -5.648 1.00 0.00 C ATOM 115 CG GLU A 64 9.360 5.018 -5.292 1.00 0.00 C ATOM 116 CD GLU A 64 9.520 5.847 -6.547 1.00 0.00 C ATOM 117 OE1 GLU A 64 8.510 6.489 -6.969 1.00 0.00 O ATOM 118 OE2 GLU A 64 10.591 5.775 -7.180 1.00 0.00 O ATOM 0 H GLU A 64 10.322 2.284 -4.610 1.00 0.00 H new ATOM 0 HA GLU A 64 7.979 3.276 -3.652 1.00 0.00 H new ATOM 0 HB2 GLU A 64 9.155 3.267 -6.431 1.00 0.00 H new ATOM 0 HB3 GLU A 64 7.650 4.094 -6.084 1.00 0.00 H new ATOM 0 HG2 GLU A 64 8.830 5.584 -4.526 1.00 0.00 H new ATOM 0 HG3 GLU A 64 10.335 4.759 -4.879 1.00 0.00 H new ATOM 125 N LYS A 65 7.646 1.128 -6.101 1.00 0.00 N ATOM 126 CA LYS A 65 6.738 0.333 -6.852 1.00 0.00 C ATOM 127 C LYS A 65 5.994 -0.643 -5.953 1.00 0.00 C ATOM 128 O LYS A 65 4.845 -0.820 -6.110 1.00 0.00 O ATOM 129 CB LYS A 65 7.473 -0.370 -7.995 1.00 0.00 C ATOM 130 CG LYS A 65 8.285 -1.580 -7.582 1.00 0.00 C ATOM 131 CD LYS A 65 9.100 -2.147 -8.716 1.00 0.00 C ATOM 132 CE LYS A 65 8.214 -2.540 -9.907 1.00 0.00 C ATOM 133 NZ LYS A 65 7.076 -3.421 -9.505 1.00 0.00 N ATOM 0 H LYS A 65 8.620 1.031 -6.387 1.00 0.00 H new ATOM 0 HA LYS A 65 5.984 0.982 -7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.742 -0.679 -8.742 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.137 0.348 -8.477 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.950 -1.304 -6.764 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.614 -2.350 -7.201 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.838 -1.412 -9.038 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.651 -3.021 -8.368 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.823 -1.638 -10.378 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.820 -3.053 -10.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 6.684 -3.888 -10.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.414 -4.141 -8.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.336 -2.847 -9.052 1.00 0.00 H new ATOM 147 N ILE A 66 6.654 -1.168 -4.943 1.00 0.00 N ATOM 148 CA ILE A 66 6.032 -2.144 -4.042 1.00 0.00 C ATOM 149 C ILE A 66 4.967 -1.428 -3.206 1.00 0.00 C ATOM 150 O ILE A 66 3.878 -1.952 -2.971 1.00 0.00 O ATOM 151 CB ILE A 66 7.104 -2.759 -3.110 1.00 0.00 C ATOM 152 CG1 ILE A 66 8.165 -3.493 -3.916 1.00 0.00 C ATOM 153 CG2 ILE A 66 6.479 -3.691 -2.095 1.00 0.00 C ATOM 154 CD1 ILE A 66 9.478 -3.652 -3.191 1.00 0.00 C ATOM 0 H ILE A 66 7.622 -0.942 -4.716 1.00 0.00 H new ATOM 0 HA ILE A 66 5.574 -2.944 -4.623 1.00 0.00 H new ATOM 0 HB ILE A 66 7.581 -1.940 -2.571 1.00 0.00 H new ATOM 0 HG12 ILE A 66 7.787 -4.480 -4.184 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.338 -2.954 -4.848 1.00 0.00 H new ATOM 0 HG21 ILE A 66 7.257 -4.107 -1.455 1.00 0.00 H new ATOM 0 HG22 ILE A 66 5.765 -3.138 -1.485 1.00 0.00 H new ATOM 0 HG23 ILE A 66 5.964 -4.500 -2.613 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.184 -4.184 -3.829 1.00 0.00 H new ATOM 0 HD12 ILE A 66 9.880 -2.669 -2.947 1.00 0.00 H new ATOM 0 HD13 ILE A 66 9.320 -4.218 -2.273 1.00 0.00 H new ATOM 166 N ILE A 67 5.289 -0.218 -2.798 1.00 0.00 N ATOM 167 CA ILE A 67 4.372 0.620 -2.055 1.00 0.00 C ATOM 168 C ILE A 67 3.208 0.997 -2.964 1.00 0.00 C ATOM 169 O ILE A 67 2.039 0.939 -2.571 1.00 0.00 O ATOM 170 CB ILE A 67 5.073 1.909 -1.583 1.00 0.00 C ATOM 171 CG1 ILE A 67 6.295 1.557 -0.738 1.00 0.00 C ATOM 172 CG2 ILE A 67 4.104 2.761 -0.789 1.00 0.00 C ATOM 173 CD1 ILE A 67 7.197 2.728 -0.422 1.00 0.00 C ATOM 0 H ILE A 67 6.197 0.213 -2.973 1.00 0.00 H new ATOM 0 HA ILE A 67 4.019 0.071 -1.182 1.00 0.00 H new ATOM 0 HB ILE A 67 5.404 2.477 -2.452 1.00 0.00 H new ATOM 0 HG12 ILE A 67 5.958 1.112 0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.876 0.798 -1.261 1.00 0.00 H new ATOM 0 HG21 ILE A 67 4.606 3.670 -0.458 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.252 3.024 -1.416 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.756 2.202 0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 67 8.038 2.387 0.181 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.568 3.162 -1.350 1.00 0.00 H new ATOM 0 HD13 ILE A 67 6.636 3.481 0.131 1.00 0.00 H new ATOM 185 N LYS A 68 3.549 1.363 -4.182 1.00 0.00 N ATOM 186 CA LYS A 68 2.582 1.714 -5.191 1.00 0.00 C ATOM 187 C LYS A 68 1.670 0.552 -5.476 1.00 0.00 C ATOM 188 O LYS A 68 0.478 0.713 -5.426 1.00 0.00 O ATOM 189 CB LYS A 68 3.255 2.254 -6.456 1.00 0.00 C ATOM 190 CG LYS A 68 3.969 3.572 -6.212 1.00 0.00 C ATOM 191 CD LYS A 68 4.708 4.087 -7.431 1.00 0.00 C ATOM 192 CE LYS A 68 5.389 5.407 -7.096 1.00 0.00 C ATOM 193 NZ LYS A 68 6.259 5.911 -8.197 1.00 0.00 N ATOM 0 H LYS A 68 4.517 1.425 -4.499 1.00 0.00 H new ATOM 0 HA LYS A 68 1.965 2.526 -4.805 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.970 1.519 -6.826 1.00 0.00 H new ATOM 0 HB3 LYS A 68 2.504 2.389 -7.235 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.241 4.319 -5.895 1.00 0.00 H new ATOM 0 HG3 LYS A 68 4.676 3.448 -5.392 1.00 0.00 H new ATOM 0 HD2 LYS A 68 5.449 3.356 -7.755 1.00 0.00 H new ATOM 0 HD3 LYS A 68 4.013 4.225 -8.259 1.00 0.00 H new ATOM 0 HE2 LYS A 68 4.629 6.155 -6.870 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.989 5.281 -6.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.984 6.544 -7.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 6.720 5.108 -8.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.680 6.433 -8.886 1.00 0.00 H new ATOM 207 N GLU A 69 2.246 -0.622 -5.711 1.00 0.00 N ATOM 208 CA GLU A 69 1.544 -1.844 -5.894 1.00 0.00 C ATOM 209 C GLU A 69 0.596 -2.086 -4.717 1.00 0.00 C ATOM 210 O GLU A 69 -0.580 -2.383 -4.919 1.00 0.00 O ATOM 211 CB GLU A 69 2.572 -2.960 -5.942 1.00 0.00 C ATOM 212 CG GLU A 69 3.087 -3.422 -7.313 1.00 0.00 C ATOM 213 CD GLU A 69 3.664 -2.387 -8.263 1.00 0.00 C ATOM 214 OE1 GLU A 69 2.898 -1.575 -8.811 1.00 0.00 O ATOM 215 OE2 GLU A 69 4.898 -2.452 -8.543 1.00 0.00 O ATOM 0 H GLU A 69 3.258 -0.730 -5.778 1.00 0.00 H new ATOM 0 HA GLU A 69 0.959 -1.809 -6.813 1.00 0.00 H new ATOM 0 HB2 GLU A 69 3.433 -2.643 -5.354 1.00 0.00 H new ATOM 0 HB3 GLU A 69 2.144 -3.827 -5.439 1.00 0.00 H new ATOM 0 HG2 GLU A 69 3.855 -4.176 -7.140 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.263 -3.918 -7.826 1.00 0.00 H new ATOM 222 N PHE A 70 1.121 -1.937 -3.489 1.00 0.00 N ATOM 223 CA PHE A 70 0.356 -2.165 -2.262 1.00 0.00 C ATOM 224 C PHE A 70 -0.873 -1.286 -2.232 1.00 0.00 C ATOM 225 O PHE A 70 -1.992 -1.783 -2.174 1.00 0.00 O ATOM 226 CB PHE A 70 1.233 -1.869 -1.020 1.00 0.00 C ATOM 227 CG PHE A 70 0.571 -2.148 0.323 1.00 0.00 C ATOM 228 CD1 PHE A 70 -0.159 -1.163 0.988 1.00 0.00 C ATOM 229 CD2 PHE A 70 0.687 -3.387 0.917 1.00 0.00 C ATOM 230 CE1 PHE A 70 -0.756 -1.422 2.210 1.00 0.00 C ATOM 231 CE2 PHE A 70 0.092 -3.647 2.139 1.00 0.00 C ATOM 232 CZ PHE A 70 -0.629 -2.668 2.783 1.00 0.00 C ATOM 0 H PHE A 70 2.087 -1.655 -3.324 1.00 0.00 H new ATOM 0 HA PHE A 70 0.046 -3.210 -2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 70 2.144 -2.464 -1.088 1.00 0.00 H new ATOM 0 HB3 PHE A 70 1.533 -0.822 -1.048 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -0.260 -0.184 0.543 1.00 0.00 H new ATOM 0 HD2 PHE A 70 1.250 -4.165 0.422 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.319 -0.650 2.712 1.00 0.00 H new ATOM 0 HE2 PHE A 70 0.194 -4.623 2.589 1.00 0.00 H new ATOM 0 HZ PHE A 70 -1.094 -2.876 3.735 1.00 0.00 H new ATOM 242 N TYR A 71 -0.666 0.005 -2.371 1.00 0.00 N ATOM 243 CA TYR A 71 -1.753 0.966 -2.308 1.00 0.00 C ATOM 244 C TYR A 71 -2.694 0.794 -3.473 1.00 0.00 C ATOM 245 O TYR A 71 -3.907 0.798 -3.303 1.00 0.00 O ATOM 246 CB TYR A 71 -1.228 2.406 -2.229 1.00 0.00 C ATOM 247 CG TYR A 71 -0.664 2.806 -0.872 1.00 0.00 C ATOM 248 CD1 TYR A 71 0.356 2.089 -0.264 1.00 0.00 C ATOM 249 CD2 TYR A 71 -1.169 3.904 -0.199 1.00 0.00 C ATOM 250 CE1 TYR A 71 0.853 2.451 0.969 1.00 0.00 C ATOM 251 CE2 TYR A 71 -0.676 4.273 1.034 1.00 0.00 C ATOM 252 CZ TYR A 71 0.331 3.542 1.614 1.00 0.00 C ATOM 253 OH TYR A 71 0.822 3.910 2.844 1.00 0.00 O ATOM 0 H TYR A 71 0.252 0.419 -2.530 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.311 0.772 -1.392 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.451 2.537 -2.982 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -2.039 3.088 -2.485 1.00 0.00 H new ATOM 0 HD1 TYR A 71 0.770 1.228 -0.768 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.963 4.482 -0.648 1.00 0.00 H new ATOM 0 HE1 TYR A 71 1.648 1.879 1.424 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -1.081 5.135 1.543 1.00 0.00 H new ATOM 0 HH TYR A 71 0.344 4.704 3.163 1.00 0.00 H new ATOM 263 N LYS A 72 -2.133 0.589 -4.645 1.00 0.00 N ATOM 264 CA LYS A 72 -2.883 0.410 -5.850 1.00 0.00 C ATOM 265 C LYS A 72 -3.706 -0.888 -5.851 1.00 0.00 C ATOM 266 O LYS A 72 -4.606 -1.041 -6.639 1.00 0.00 O ATOM 267 CB LYS A 72 -1.917 0.488 -7.003 1.00 0.00 C ATOM 268 CG LYS A 72 -2.431 0.179 -8.365 1.00 0.00 C ATOM 269 CD LYS A 72 -1.326 0.379 -9.381 1.00 0.00 C ATOM 270 CE LYS A 72 -0.088 -0.487 -9.077 1.00 0.00 C ATOM 271 NZ LYS A 72 0.975 -0.355 -10.095 1.00 0.00 N ATOM 0 H LYS A 72 -1.123 0.543 -4.780 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.629 1.200 -5.940 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.501 1.495 -7.023 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.092 -0.193 -6.795 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.793 -0.848 -8.404 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.277 0.824 -8.601 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.701 0.136 -10.375 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.036 1.430 -9.397 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.313 -0.208 -8.103 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.391 -1.532 -9.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 1.897 -0.571 -9.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.793 -1.019 -10.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.984 0.618 -10.463 1.00 0.00 H new ATOM 285 N THR A 73 -3.422 -1.776 -4.965 1.00 0.00 N ATOM 286 CA THR A 73 -4.183 -2.983 -4.906 1.00 0.00 C ATOM 287 C THR A 73 -5.185 -2.824 -3.834 1.00 0.00 C ATOM 288 O THR A 73 -6.374 -2.871 -4.066 1.00 0.00 O ATOM 289 CB THR A 73 -3.276 -4.213 -4.676 1.00 0.00 C ATOM 290 OG1 THR A 73 -2.296 -4.287 -5.723 1.00 0.00 O ATOM 291 CG2 THR A 73 -4.072 -5.517 -4.614 1.00 0.00 C ATOM 0 H THR A 73 -2.676 -1.696 -4.274 1.00 0.00 H new ATOM 0 HA THR A 73 -4.686 -3.162 -5.857 1.00 0.00 H new ATOM 0 HB THR A 73 -2.786 -4.088 -3.710 1.00 0.00 H new ATOM 0 HG1 THR A 73 -1.502 -3.773 -5.465 1.00 0.00 H new ATOM 0 HG21 THR A 73 -3.390 -6.352 -4.451 1.00 0.00 H new ATOM 0 HG22 THR A 73 -4.788 -5.468 -3.794 1.00 0.00 H new ATOM 0 HG23 THR A 73 -4.606 -5.662 -5.553 1.00 0.00 H new ATOM 299 N VAL A 74 -4.682 -2.495 -2.708 1.00 0.00 N ATOM 300 CA VAL A 74 -5.422 -2.325 -1.529 1.00 0.00 C ATOM 301 C VAL A 74 -6.561 -1.290 -1.653 1.00 0.00 C ATOM 302 O VAL A 74 -7.668 -1.484 -1.119 1.00 0.00 O ATOM 303 CB VAL A 74 -4.442 -1.972 -0.425 1.00 0.00 C ATOM 304 CG1 VAL A 74 -5.130 -1.303 0.659 1.00 0.00 C ATOM 305 CG2 VAL A 74 -3.757 -3.222 0.066 1.00 0.00 C ATOM 0 H VAL A 74 -3.684 -2.328 -2.581 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.941 -3.256 -1.298 1.00 0.00 H new ATOM 0 HB VAL A 74 -3.686 -1.292 -0.819 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.416 -1.055 1.445 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -5.593 -0.389 0.287 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.900 -1.961 1.062 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.054 -2.964 0.858 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -4.502 -3.917 0.453 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.219 -3.690 -0.758 1.00 0.00 H new ATOM 315 N TYR A 75 -6.305 -0.230 -2.347 1.00 0.00 N ATOM 316 CA TYR A 75 -7.266 0.812 -2.457 1.00 0.00 C ATOM 317 C TYR A 75 -7.766 0.965 -3.878 1.00 0.00 C ATOM 318 O TYR A 75 -8.018 2.064 -4.301 1.00 0.00 O ATOM 319 CB TYR A 75 -6.675 2.135 -1.936 1.00 0.00 C ATOM 320 CG TYR A 75 -6.322 2.114 -0.460 1.00 0.00 C ATOM 321 CD1 TYR A 75 -7.318 2.105 0.506 1.00 0.00 C ATOM 322 CD2 TYR A 75 -4.996 2.090 -0.039 1.00 0.00 C ATOM 323 CE1 TYR A 75 -7.004 2.062 1.865 1.00 0.00 C ATOM 324 CE2 TYR A 75 -4.669 2.056 1.309 1.00 0.00 C ATOM 325 CZ TYR A 75 -5.676 2.036 2.261 1.00 0.00 C ATOM 326 OH TYR A 75 -5.345 1.984 3.607 1.00 0.00 O ATOM 0 H TYR A 75 -5.432 -0.064 -2.848 1.00 0.00 H new ATOM 0 HA TYR A 75 -8.125 0.544 -1.842 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -5.779 2.372 -2.510 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -7.391 2.937 -2.117 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -8.354 2.132 0.201 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.206 2.098 -0.776 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -7.791 2.049 2.604 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.633 2.045 1.615 1.00 0.00 H new ATOM 0 HH TYR A 75 -5.747 1.187 4.012 1.00 0.00 H new ATOM 336 N ASN A 76 -7.935 -0.136 -4.605 1.00 0.00 N ATOM 337 CA ASN A 76 -8.498 -0.063 -5.953 1.00 0.00 C ATOM 338 C ASN A 76 -9.499 -1.128 -6.225 1.00 0.00 C ATOM 339 O ASN A 76 -9.163 -2.215 -6.681 1.00 0.00 O ATOM 340 CB ASN A 76 -7.474 -0.058 -7.080 1.00 0.00 C ATOM 341 CG ASN A 76 -6.873 1.306 -7.371 1.00 0.00 C ATOM 342 OD1 ASN A 76 -7.405 2.099 -8.134 1.00 0.00 O ATOM 343 ND2 ASN A 76 -5.758 1.571 -6.795 1.00 0.00 N ATOM 0 H ASN A 76 -7.695 -1.076 -4.291 1.00 0.00 H new ATOM 0 HA ASN A 76 -8.988 0.911 -5.951 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -6.670 -0.750 -6.828 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -7.947 -0.435 -7.987 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -5.293 2.462 -6.969 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -5.336 0.891 -6.163 1.00 0.00 H new ATOM 350 N TYR A 77 -10.716 -0.844 -5.904 1.00 0.00 N ATOM 351 CA TYR A 77 -11.796 -1.723 -6.252 1.00 0.00 C ATOM 352 C TYR A 77 -13.070 -0.945 -6.317 1.00 0.00 C ATOM 353 O TYR A 77 -13.221 0.081 -5.638 1.00 0.00 O ATOM 354 CB TYR A 77 -11.946 -2.966 -5.362 1.00 0.00 C ATOM 355 CG TYR A 77 -12.642 -4.098 -6.118 1.00 0.00 C ATOM 356 CD1 TYR A 77 -11.938 -4.845 -7.056 1.00 0.00 C ATOM 357 CD2 TYR A 77 -13.986 -4.381 -5.943 1.00 0.00 C ATOM 358 CE1 TYR A 77 -12.552 -5.843 -7.786 1.00 0.00 C ATOM 359 CE2 TYR A 77 -14.613 -5.372 -6.674 1.00 0.00 C ATOM 360 CZ TYR A 77 -13.891 -6.102 -7.594 1.00 0.00 C ATOM 361 OH TYR A 77 -14.509 -7.084 -8.326 1.00 0.00 O ATOM 0 H TYR A 77 -10.996 -0.004 -5.397 1.00 0.00 H new ATOM 0 HA TYR A 77 -11.547 -2.131 -7.232 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -10.964 -3.298 -5.026 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -12.519 -2.713 -4.470 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -10.890 -4.640 -7.217 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -14.556 -3.816 -5.220 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -11.985 -6.418 -8.504 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -15.664 -5.574 -6.525 1.00 0.00 H new ATOM 0 HH TYR A 77 -15.453 -7.139 -8.068 1.00 0.00 H new ATOM 371 N GLU A 78 -13.975 -1.424 -7.102 1.00 0.00 N ATOM 372 CA GLU A 78 -15.215 -0.773 -7.334 1.00 0.00 C ATOM 373 C GLU A 78 -16.193 -0.793 -6.156 1.00 0.00 C ATOM 374 O GLU A 78 -16.790 0.197 -5.884 1.00 0.00 O ATOM 375 CB GLU A 78 -15.887 -1.341 -8.542 1.00 0.00 C ATOM 376 CG GLU A 78 -15.964 -2.846 -8.543 1.00 0.00 C ATOM 377 CD GLU A 78 -17.165 -3.302 -9.290 1.00 0.00 C ATOM 378 OE1 GLU A 78 -17.455 -2.740 -10.348 1.00 0.00 O ATOM 379 OE2 GLU A 78 -17.933 -4.106 -8.748 1.00 0.00 O ATOM 0 H GLU A 78 -13.868 -2.301 -7.612 1.00 0.00 H new ATOM 0 HA GLU A 78 -14.951 0.273 -7.487 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -16.896 -0.935 -8.610 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -15.351 -1.013 -9.433 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -15.065 -3.262 -8.998 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -16.003 -3.215 -7.518 1.00 0.00 H new ATOM 386 N LYS A 79 -16.423 -1.914 -5.507 1.00 0.00 N ATOM 387 CA LYS A 79 -17.446 -1.884 -4.451 1.00 0.00 C ATOM 388 C LYS A 79 -16.910 -2.355 -3.113 1.00 0.00 C ATOM 389 O LYS A 79 -17.364 -1.910 -2.065 1.00 0.00 O ATOM 390 CB LYS A 79 -18.676 -2.744 -4.795 1.00 0.00 C ATOM 391 CG LYS A 79 -19.247 -2.659 -6.218 1.00 0.00 C ATOM 392 CD LYS A 79 -19.609 -1.253 -6.714 1.00 0.00 C ATOM 393 CE LYS A 79 -20.442 -1.347 -8.011 1.00 0.00 C ATOM 394 NZ LYS A 79 -19.798 -2.167 -9.084 1.00 0.00 N ATOM 0 H LYS A 79 -15.958 -2.808 -5.665 1.00 0.00 H new ATOM 0 HA LYS A 79 -17.741 -0.837 -4.381 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -18.419 -3.785 -4.601 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -19.473 -2.478 -4.100 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -18.520 -3.090 -6.906 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -20.140 -3.282 -6.268 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -20.174 -0.722 -5.947 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -18.701 -0.678 -6.896 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -21.417 -1.774 -7.776 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -20.619 -0.341 -8.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -20.479 -2.327 -9.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -18.968 -1.663 -9.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -19.499 -3.082 -8.690 1.00 0.00 H new ATOM 408 N SER A 80 -15.990 -3.280 -3.145 1.00 0.00 N ATOM 409 CA SER A 80 -15.473 -3.856 -1.932 1.00 0.00 C ATOM 410 C SER A 80 -13.961 -4.080 -2.025 1.00 0.00 C ATOM 411 O SER A 80 -13.477 -4.703 -2.960 1.00 0.00 O ATOM 412 CB SER A 80 -16.209 -5.177 -1.658 1.00 0.00 C ATOM 413 OG SER A 80 -17.612 -4.960 -1.578 1.00 0.00 O ATOM 0 H SER A 80 -15.581 -3.653 -4.002 1.00 0.00 H new ATOM 0 HA SER A 80 -15.643 -3.166 -1.105 1.00 0.00 H new ATOM 0 HB2 SER A 80 -15.991 -5.893 -2.451 1.00 0.00 H new ATOM 0 HB3 SER A 80 -15.849 -5.614 -0.726 1.00 0.00 H new ATOM 0 HG SER A 80 -18.065 -5.811 -1.405 1.00 0.00 H new ATOM 419 N GLN A 81 -13.226 -3.581 -1.034 1.00 0.00 N ATOM 420 CA GLN A 81 -11.746 -3.706 -0.971 1.00 0.00 C ATOM 421 C GLN A 81 -11.253 -5.134 -0.830 1.00 0.00 C ATOM 422 O GLN A 81 -10.086 -5.376 -0.879 1.00 0.00 O ATOM 423 CB GLN A 81 -11.167 -2.900 0.176 1.00 0.00 C ATOM 424 CG GLN A 81 -10.983 -1.437 -0.088 1.00 0.00 C ATOM 425 CD GLN A 81 -10.468 -0.727 1.140 1.00 0.00 C ATOM 426 OE1 GLN A 81 -11.241 -0.258 1.972 1.00 0.00 O ATOM 427 NE2 GLN A 81 -9.172 -0.655 1.267 1.00 0.00 N ATOM 0 H GLN A 81 -13.627 -3.075 -0.244 1.00 0.00 H new ATOM 0 HA GLN A 81 -11.403 -3.319 -1.930 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -11.818 -3.015 1.042 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -10.201 -3.327 0.445 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -10.284 -1.298 -0.913 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -11.932 -0.997 -0.396 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -8.566 -1.058 0.552 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -8.764 -0.196 2.081 1.00 0.00 H new ATOM 436 N LYS A 82 -12.131 -6.054 -0.622 1.00 0.00 N ATOM 437 CA LYS A 82 -11.739 -7.431 -0.400 1.00 0.00 C ATOM 438 C LYS A 82 -11.410 -8.130 -1.710 1.00 0.00 C ATOM 439 O LYS A 82 -10.590 -9.053 -1.751 1.00 0.00 O ATOM 440 CB LYS A 82 -12.896 -8.174 0.191 1.00 0.00 C ATOM 441 CG LYS A 82 -13.423 -7.696 1.520 1.00 0.00 C ATOM 442 CD LYS A 82 -14.812 -8.296 1.826 1.00 0.00 C ATOM 443 CE LYS A 82 -14.887 -9.795 1.513 1.00 0.00 C ATOM 444 NZ LYS A 82 -15.288 -10.086 0.073 1.00 0.00 N ATOM 0 H LYS A 82 -13.137 -5.890 -0.598 1.00 0.00 H new ATOM 0 HA LYS A 82 -10.867 -7.425 0.253 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -13.716 -8.145 -0.526 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -12.605 -9.219 0.300 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -12.724 -7.971 2.310 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -13.488 -6.608 1.517 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -15.050 -8.136 2.878 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -15.568 -7.769 1.244 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -13.917 -10.251 1.713 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -15.605 -10.265 2.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -16.098 -10.738 0.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -15.552 -9.198 -0.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -14.488 -10.521 -0.429 1.00 0.00 H new ATOM 458 N GLU A 83 -12.022 -7.662 -2.777 1.00 0.00 N ATOM 459 CA GLU A 83 -12.026 -8.389 -4.042 1.00 0.00 C ATOM 460 C GLU A 83 -10.775 -8.097 -4.873 1.00 0.00 C ATOM 461 O GLU A 83 -10.637 -8.540 -6.004 1.00 0.00 O ATOM 462 CB GLU A 83 -13.266 -8.031 -4.848 1.00 0.00 C ATOM 463 CG GLU A 83 -14.565 -7.818 -4.043 1.00 0.00 C ATOM 464 CD GLU A 83 -14.823 -8.777 -2.874 1.00 0.00 C ATOM 465 OE1 GLU A 83 -14.771 -9.997 -3.022 1.00 0.00 O ATOM 466 OE2 GLU A 83 -15.090 -8.278 -1.756 1.00 0.00 O ATOM 0 H GLU A 83 -12.528 -6.777 -2.800 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.032 -9.453 -3.805 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -13.058 -7.120 -5.410 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.441 -8.822 -5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.559 -6.801 -3.652 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -15.407 -7.889 -4.732 1.00 0.00 H new ATOM 473 N ILE A 84 -9.863 -7.390 -4.276 1.00 0.00 N ATOM 474 CA ILE A 84 -8.608 -6.966 -4.913 1.00 0.00 C ATOM 475 C ILE A 84 -7.556 -8.087 -4.933 1.00 0.00 C ATOM 476 O ILE A 84 -6.424 -7.858 -5.322 1.00 0.00 O ATOM 477 CB ILE A 84 -8.004 -5.784 -4.144 1.00 0.00 C ATOM 478 CG1 ILE A 84 -7.768 -6.206 -2.675 1.00 0.00 C ATOM 479 CG2 ILE A 84 -8.908 -4.550 -4.256 1.00 0.00 C ATOM 480 CD1 ILE A 84 -7.120 -5.169 -1.806 1.00 0.00 C ATOM 0 H ILE A 84 -9.953 -7.074 -3.310 1.00 0.00 H new ATOM 0 HA ILE A 84 -8.857 -6.691 -5.938 1.00 0.00 H new ATOM 0 HB ILE A 84 -7.043 -5.508 -4.578 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.727 -6.478 -2.234 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -7.148 -7.102 -2.667 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -8.463 -3.722 -3.704 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -9.015 -4.272 -5.304 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -9.889 -4.778 -3.839 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -6.999 -5.564 -0.797 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -6.143 -4.911 -2.214 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -7.747 -4.278 -1.774 1.00 0.00 H new ATOM 492 N SER A 85 -7.953 -9.287 -4.510 1.00 0.00 N ATOM 493 CA SER A 85 -7.056 -10.436 -4.396 1.00 0.00 C ATOM 494 C SER A 85 -6.027 -10.237 -3.272 1.00 0.00 C ATOM 495 O SER A 85 -4.939 -9.689 -3.459 1.00 0.00 O ATOM 496 CB SER A 85 -6.403 -10.793 -5.744 1.00 0.00 C ATOM 497 OG SER A 85 -7.410 -11.059 -6.708 1.00 0.00 O ATOM 0 H SER A 85 -8.914 -9.490 -4.235 1.00 0.00 H new ATOM 0 HA SER A 85 -7.662 -11.298 -4.116 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.771 -9.972 -6.082 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.758 -11.664 -5.627 1.00 0.00 H new ATOM 0 HG SER A 85 -6.991 -11.284 -7.565 1.00 0.00 H new ATOM 503 N MET A 86 -6.401 -10.698 -2.088 1.00 0.00 N ATOM 504 CA MET A 86 -5.585 -10.553 -0.876 1.00 0.00 C ATOM 505 C MET A 86 -4.256 -11.315 -0.945 1.00 0.00 C ATOM 506 O MET A 86 -3.391 -11.129 -0.112 1.00 0.00 O ATOM 507 CB MET A 86 -6.365 -10.955 0.378 1.00 0.00 C ATOM 508 CG MET A 86 -7.574 -10.070 0.678 1.00 0.00 C ATOM 509 SD MET A 86 -8.453 -10.545 2.192 1.00 0.00 S ATOM 510 CE MET A 86 -8.977 -12.211 1.790 1.00 0.00 C ATOM 0 H MET A 86 -7.283 -11.187 -1.933 1.00 0.00 H new ATOM 0 HA MET A 86 -5.340 -9.493 -0.813 1.00 0.00 H new ATOM 0 HB2 MET A 86 -6.703 -11.985 0.267 1.00 0.00 H new ATOM 0 HB3 MET A 86 -5.691 -10.931 1.234 1.00 0.00 H new ATOM 0 HG2 MET A 86 -7.245 -9.035 0.767 1.00 0.00 H new ATOM 0 HG3 MET A 86 -8.265 -10.113 -0.164 1.00 0.00 H new ATOM 0 HE1 MET A 86 -9.988 -12.374 2.162 1.00 0.00 H new ATOM 0 HE2 MET A 86 -8.962 -12.346 0.709 1.00 0.00 H new ATOM 0 HE3 MET A 86 -8.300 -12.928 2.254 1.00 0.00 H new ATOM 520 N THR A 87 -4.092 -12.156 -1.930 1.00 0.00 N ATOM 521 CA THR A 87 -2.842 -12.849 -2.091 1.00 0.00 C ATOM 522 C THR A 87 -1.785 -11.866 -2.599 1.00 0.00 C ATOM 523 O THR A 87 -0.670 -11.892 -2.144 1.00 0.00 O ATOM 524 CB THR A 87 -2.975 -14.098 -3.033 1.00 0.00 C ATOM 525 OG1 THR A 87 -1.759 -14.845 -3.058 1.00 0.00 O ATOM 526 CG2 THR A 87 -3.362 -13.709 -4.462 1.00 0.00 C ATOM 0 H THR A 87 -4.802 -12.377 -2.628 1.00 0.00 H new ATOM 0 HA THR A 87 -2.531 -13.238 -1.121 1.00 0.00 H new ATOM 0 HB THR A 87 -3.775 -14.714 -2.622 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.863 -15.620 -3.649 1.00 0.00 H new ATOM 0 HG21 THR A 87 -3.442 -14.607 -5.075 1.00 0.00 H new ATOM 0 HG22 THR A 87 -4.321 -13.191 -4.451 1.00 0.00 H new ATOM 0 HG23 THR A 87 -2.599 -13.051 -4.879 1.00 0.00 H new ATOM 534 N THR A 88 -2.202 -10.921 -3.428 1.00 0.00 N ATOM 535 CA THR A 88 -1.292 -9.983 -4.042 1.00 0.00 C ATOM 536 C THR A 88 -0.687 -9.030 -3.004 1.00 0.00 C ATOM 537 O THR A 88 0.513 -8.751 -3.015 1.00 0.00 O ATOM 538 CB THR A 88 -2.016 -9.238 -5.165 1.00 0.00 C ATOM 539 OG1 THR A 88 -2.533 -10.226 -6.068 1.00 0.00 O ATOM 540 CG2 THR A 88 -1.074 -8.305 -5.912 1.00 0.00 C ATOM 0 H THR A 88 -3.179 -10.788 -3.690 1.00 0.00 H new ATOM 0 HA THR A 88 -0.453 -10.526 -4.477 1.00 0.00 H new ATOM 0 HB THR A 88 -2.813 -8.625 -4.744 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.007 -9.782 -6.802 1.00 0.00 H new ATOM 0 HG21 THR A 88 -1.621 -7.792 -6.703 1.00 0.00 H new ATOM 0 HG22 THR A 88 -0.664 -7.570 -5.219 1.00 0.00 H new ATOM 0 HG23 THR A 88 -0.261 -8.884 -6.350 1.00 0.00 H new ATOM 548 N VAL A 89 -1.503 -8.585 -2.065 1.00 0.00 N ATOM 549 CA VAL A 89 -1.009 -7.754 -0.979 1.00 0.00 C ATOM 550 C VAL A 89 0.005 -8.529 -0.108 1.00 0.00 C ATOM 551 O VAL A 89 0.982 -7.974 0.359 1.00 0.00 O ATOM 552 CB VAL A 89 -2.156 -7.088 -0.148 1.00 0.00 C ATOM 553 CG1 VAL A 89 -3.177 -8.087 0.311 1.00 0.00 C ATOM 554 CG2 VAL A 89 -1.606 -6.319 1.033 1.00 0.00 C ATOM 0 H VAL A 89 -2.503 -8.782 -2.031 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.472 -6.918 -1.428 1.00 0.00 H new ATOM 0 HB VAL A 89 -2.656 -6.387 -0.816 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -3.953 -7.578 0.883 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -3.625 -8.573 -0.555 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -2.696 -8.837 0.939 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -2.428 -5.869 1.589 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -1.056 -6.998 1.685 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.937 -5.536 0.677 1.00 0.00 H new ATOM 564 N LYS A 90 -0.199 -9.825 0.020 1.00 0.00 N ATOM 565 CA LYS A 90 0.691 -10.698 0.720 1.00 0.00 C ATOM 566 C LYS A 90 2.049 -10.860 -0.015 1.00 0.00 C ATOM 567 O LYS A 90 3.080 -11.237 0.582 1.00 0.00 O ATOM 568 CB LYS A 90 -0.031 -11.999 0.852 1.00 0.00 C ATOM 569 CG LYS A 90 0.775 -13.223 0.556 1.00 0.00 C ATOM 570 CD LYS A 90 -0.026 -14.427 0.789 1.00 0.00 C ATOM 571 CE LYS A 90 -0.457 -14.500 2.252 1.00 0.00 C ATOM 572 NZ LYS A 90 0.656 -14.822 3.182 1.00 0.00 N ATOM 0 H LYS A 90 -1.011 -10.301 -0.373 1.00 0.00 H new ATOM 0 HA LYS A 90 0.949 -10.290 1.697 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.416 -12.078 1.869 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.893 -11.984 0.185 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.117 -13.200 -0.479 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.665 -13.242 1.186 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.904 -14.418 0.144 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.552 -15.313 0.528 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.897 -13.546 2.541 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.237 -15.255 2.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.292 -14.873 4.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.073 -15.738 2.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 1.383 -14.081 3.123 1.00 0.00 H new ATOM 586 N GLU A 91 2.055 -10.587 -1.286 1.00 0.00 N ATOM 587 CA GLU A 91 3.262 -10.691 -2.070 1.00 0.00 C ATOM 588 C GLU A 91 4.047 -9.386 -1.943 1.00 0.00 C ATOM 589 O GLU A 91 5.276 -9.384 -1.889 1.00 0.00 O ATOM 590 CB GLU A 91 2.909 -10.986 -3.518 1.00 0.00 C ATOM 591 CG GLU A 91 1.889 -12.115 -3.648 1.00 0.00 C ATOM 592 CD GLU A 91 1.516 -12.439 -5.079 1.00 0.00 C ATOM 593 OE1 GLU A 91 2.318 -13.083 -5.768 1.00 0.00 O ATOM 594 OE2 GLU A 91 0.398 -12.036 -5.511 1.00 0.00 O ATOM 0 H GLU A 91 1.233 -10.288 -1.811 1.00 0.00 H new ATOM 0 HA GLU A 91 3.883 -11.509 -1.705 1.00 0.00 H new ATOM 0 HB2 GLU A 91 2.511 -10.084 -3.983 1.00 0.00 H new ATOM 0 HB3 GLU A 91 3.814 -11.253 -4.063 1.00 0.00 H new ATOM 0 HG2 GLU A 91 2.291 -13.011 -3.175 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.987 -11.842 -3.100 1.00 0.00 H new ATOM 601 N LEU A 92 3.323 -8.312 -1.786 1.00 0.00 N ATOM 602 CA LEU A 92 3.885 -6.969 -1.663 1.00 0.00 C ATOM 603 C LEU A 92 4.276 -6.662 -0.228 1.00 0.00 C ATOM 604 O LEU A 92 5.194 -5.922 0.022 1.00 0.00 O ATOM 605 CB LEU A 92 2.827 -5.979 -2.109 1.00 0.00 C ATOM 606 CG LEU A 92 2.249 -6.251 -3.487 1.00 0.00 C ATOM 607 CD1 LEU A 92 1.151 -5.276 -3.806 1.00 0.00 C ATOM 608 CD2 LEU A 92 3.338 -6.232 -4.546 1.00 0.00 C ATOM 0 H LEU A 92 2.304 -8.332 -1.737 1.00 0.00 H new ATOM 0 HA LEU A 92 4.782 -6.899 -2.279 1.00 0.00 H new ATOM 0 HB2 LEU A 92 2.015 -5.982 -1.382 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.258 -4.978 -2.101 1.00 0.00 H new ATOM 0 HG LEU A 92 1.813 -7.250 -3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.752 -5.489 -4.797 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.356 -5.369 -3.067 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.548 -4.261 -3.786 1.00 0.00 H new ATOM 0 HD21 LEU A 92 2.898 -6.429 -5.524 1.00 0.00 H new ATOM 0 HD22 LEU A 92 3.819 -5.254 -4.555 1.00 0.00 H new ATOM 0 HD23 LEU A 92 4.079 -6.999 -4.320 1.00 0.00 H new ATOM 620 N ALA A 93 3.579 -7.231 0.703 1.00 0.00 N ATOM 621 CA ALA A 93 3.813 -6.966 2.098 1.00 0.00 C ATOM 622 C ALA A 93 3.923 -8.256 2.873 1.00 0.00 C ATOM 623 O ALA A 93 3.477 -9.291 2.409 1.00 0.00 O ATOM 624 CB ALA A 93 2.678 -6.119 2.623 1.00 0.00 C ATOM 0 H ALA A 93 2.827 -7.896 0.523 1.00 0.00 H new ATOM 0 HA ALA A 93 4.755 -6.431 2.219 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.840 -5.909 3.680 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.637 -5.181 2.069 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.737 -6.655 2.500 1.00 0.00 H new ATOM 630 N THR A 94 4.574 -8.212 4.001 1.00 0.00 N ATOM 631 CA THR A 94 4.699 -9.360 4.860 1.00 0.00 C ATOM 632 C THR A 94 3.371 -9.684 5.547 1.00 0.00 C ATOM 633 O THR A 94 2.498 -8.828 5.651 1.00 0.00 O ATOM 634 CB THR A 94 5.791 -9.110 5.902 1.00 0.00 C ATOM 635 OG1 THR A 94 5.684 -7.776 6.371 1.00 0.00 O ATOM 636 CG2 THR A 94 7.157 -9.305 5.313 1.00 0.00 C ATOM 0 H THR A 94 5.036 -7.374 4.354 1.00 0.00 H new ATOM 0 HA THR A 94 4.975 -10.219 4.249 1.00 0.00 H new ATOM 0 HB THR A 94 5.658 -9.821 6.718 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.417 -7.781 7.314 1.00 0.00 H new ATOM 0 HG21 THR A 94 7.912 -9.120 6.077 1.00 0.00 H new ATOM 0 HG22 THR A 94 7.253 -10.327 4.947 1.00 0.00 H new ATOM 0 HG23 THR A 94 7.300 -8.609 4.486 1.00 0.00 H new ATOM 644 N ASP A 95 3.232 -10.910 6.007 1.00 0.00 N ATOM 645 CA ASP A 95 2.015 -11.389 6.663 1.00 0.00 C ATOM 646 C ASP A 95 1.523 -10.544 7.821 1.00 0.00 C ATOM 647 O ASP A 95 0.330 -10.477 8.055 1.00 0.00 O ATOM 648 CB ASP A 95 2.082 -12.864 7.014 1.00 0.00 C ATOM 649 CG ASP A 95 1.791 -13.733 5.796 1.00 0.00 C ATOM 650 OD1 ASP A 95 2.587 -13.723 4.822 1.00 0.00 O ATOM 651 OD2 ASP A 95 0.722 -14.385 5.747 1.00 0.00 O ATOM 0 H ASP A 95 3.965 -11.616 5.939 1.00 0.00 H new ATOM 0 HA ASP A 95 1.246 -11.268 5.900 1.00 0.00 H new ATOM 0 HB2 ASP A 95 3.070 -13.103 7.407 1.00 0.00 H new ATOM 0 HB3 ASP A 95 1.363 -13.086 7.803 1.00 0.00 H new ATOM 656 N ASN A 96 2.425 -9.907 8.559 1.00 0.00 N ATOM 657 CA ASN A 96 1.996 -9.021 9.657 1.00 0.00 C ATOM 658 C ASN A 96 1.207 -7.826 9.105 1.00 0.00 C ATOM 659 O ASN A 96 0.083 -7.574 9.518 1.00 0.00 O ATOM 660 CB ASN A 96 3.166 -8.510 10.562 1.00 0.00 C ATOM 661 CG ASN A 96 4.245 -7.742 9.803 1.00 0.00 C ATOM 662 OD1 ASN A 96 4.572 -8.091 8.682 1.00 0.00 O ATOM 663 ND2 ASN A 96 4.739 -6.670 10.360 1.00 0.00 N ATOM 0 H ASN A 96 3.434 -9.978 8.430 1.00 0.00 H new ATOM 0 HA ASN A 96 1.359 -9.633 10.296 1.00 0.00 H new ATOM 0 HB2 ASN A 96 2.756 -7.867 11.341 1.00 0.00 H new ATOM 0 HB3 ASN A 96 3.625 -9.363 11.062 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.418 -6.100 9.855 1.00 0.00 H new ATOM 0 HD22 ASN A 96 4.446 -6.403 11.300 1.00 0.00 H new ATOM 670 N VAL A 97 1.773 -7.148 8.122 1.00 0.00 N ATOM 671 CA VAL A 97 1.122 -5.982 7.537 1.00 0.00 C ATOM 672 C VAL A 97 -0.048 -6.379 6.646 1.00 0.00 C ATOM 673 O VAL A 97 -1.012 -5.649 6.481 1.00 0.00 O ATOM 674 CB VAL A 97 2.102 -5.038 6.815 1.00 0.00 C ATOM 675 CG1 VAL A 97 2.930 -4.318 7.821 1.00 0.00 C ATOM 676 CG2 VAL A 97 3.022 -5.803 5.936 1.00 0.00 C ATOM 0 H VAL A 97 2.677 -7.381 7.712 1.00 0.00 H new ATOM 0 HA VAL A 97 0.719 -5.409 8.372 1.00 0.00 H new ATOM 0 HB VAL A 97 1.517 -4.340 6.216 1.00 0.00 H new ATOM 0 HG11 VAL A 97 3.624 -3.650 7.310 1.00 0.00 H new ATOM 0 HG12 VAL A 97 2.282 -3.736 8.476 1.00 0.00 H new ATOM 0 HG13 VAL A 97 3.492 -5.040 8.414 1.00 0.00 H new ATOM 0 HG21 VAL A 97 3.704 -5.115 5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 97 3.594 -6.510 6.536 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.444 -6.346 5.189 1.00 0.00 H new ATOM 686 N TYR A 98 0.072 -7.524 6.049 1.00 0.00 N ATOM 687 CA TYR A 98 -0.982 -8.118 5.265 1.00 0.00 C ATOM 688 C TYR A 98 -2.236 -8.388 6.121 1.00 0.00 C ATOM 689 O TYR A 98 -3.360 -8.050 5.720 1.00 0.00 O ATOM 690 CB TYR A 98 -0.437 -9.402 4.630 1.00 0.00 C ATOM 691 CG TYR A 98 -1.441 -10.487 4.337 1.00 0.00 C ATOM 692 CD1 TYR A 98 -2.203 -10.476 3.191 1.00 0.00 C ATOM 693 CD2 TYR A 98 -1.606 -11.539 5.227 1.00 0.00 C ATOM 694 CE1 TYR A 98 -3.112 -11.483 2.936 1.00 0.00 C ATOM 695 CE2 TYR A 98 -2.503 -12.546 4.981 1.00 0.00 C ATOM 696 CZ TYR A 98 -3.255 -12.515 3.834 1.00 0.00 C ATOM 697 OH TYR A 98 -4.154 -13.521 3.586 1.00 0.00 O ATOM 0 H TYR A 98 0.920 -8.089 6.090 1.00 0.00 H new ATOM 0 HA TYR A 98 -1.296 -7.429 4.480 1.00 0.00 H new ATOM 0 HB2 TYR A 98 0.060 -9.137 3.697 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.325 -9.813 5.292 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -2.088 -9.669 2.482 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -1.016 -11.565 6.131 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.708 -11.461 2.036 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -2.617 -13.357 5.685 1.00 0.00 H new ATOM 0 HH TYR A 98 -4.129 -14.170 4.319 1.00 0.00 H new ATOM 707 N GLN A 99 -2.039 -8.959 7.302 1.00 0.00 N ATOM 708 CA GLN A 99 -3.168 -9.331 8.144 1.00 0.00 C ATOM 709 C GLN A 99 -3.866 -8.116 8.736 1.00 0.00 C ATOM 710 O GLN A 99 -5.090 -8.109 8.852 1.00 0.00 O ATOM 711 CB GLN A 99 -2.796 -10.350 9.223 1.00 0.00 C ATOM 712 CG GLN A 99 -1.834 -9.843 10.262 1.00 0.00 C ATOM 713 CD GLN A 99 -1.373 -10.930 11.192 1.00 0.00 C ATOM 714 OE1 GLN A 99 -1.957 -11.164 12.234 1.00 0.00 O ATOM 715 NE2 GLN A 99 -0.342 -11.627 10.797 1.00 0.00 N ATOM 0 H GLN A 99 -1.122 -9.172 7.694 1.00 0.00 H new ATOM 0 HA GLN A 99 -3.881 -9.826 7.485 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -3.707 -10.680 9.722 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -2.361 -11.226 8.742 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -0.969 -9.400 9.768 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -2.311 -9.052 10.840 1.00 0.00 H new ATOM 0 HE21 GLN A 99 0.120 -11.399 9.917 1.00 0.00 H new ATOM 0 HE22 GLN A 99 0.001 -12.399 11.369 1.00 0.00 H new ATOM 724 N GLU A 100 -3.112 -7.075 9.075 1.00 0.00 N ATOM 725 CA GLU A 100 -3.730 -5.858 9.609 1.00 0.00 C ATOM 726 C GLU A 100 -4.560 -5.203 8.506 1.00 0.00 C ATOM 727 O GLU A 100 -5.660 -4.704 8.745 1.00 0.00 O ATOM 728 CB GLU A 100 -2.681 -4.864 10.158 1.00 0.00 C ATOM 729 CG GLU A 100 -1.704 -4.381 9.114 1.00 0.00 C ATOM 730 CD GLU A 100 -0.779 -3.286 9.568 1.00 0.00 C ATOM 731 OE1 GLU A 100 0.293 -3.585 10.108 1.00 0.00 O ATOM 732 OE2 GLU A 100 -1.104 -2.106 9.315 1.00 0.00 O ATOM 0 H GLU A 100 -2.096 -7.044 8.994 1.00 0.00 H new ATOM 0 HA GLU A 100 -4.369 -6.135 10.448 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -3.196 -4.005 10.587 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -2.129 -5.341 10.968 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -1.104 -5.228 8.780 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -2.265 -4.027 8.249 1.00 0.00 H new ATOM 739 N LEU A 101 -4.054 -5.319 7.286 1.00 0.00 N ATOM 740 CA LEU A 101 -4.667 -4.746 6.127 1.00 0.00 C ATOM 741 C LEU A 101 -5.990 -5.424 5.834 1.00 0.00 C ATOM 742 O LEU A 101 -7.007 -4.771 5.679 1.00 0.00 O ATOM 743 CB LEU A 101 -3.670 -4.799 4.927 1.00 0.00 C ATOM 744 CG LEU A 101 -4.176 -4.440 3.512 1.00 0.00 C ATOM 745 CD1 LEU A 101 -4.853 -5.612 2.851 1.00 0.00 C ATOM 746 CD2 LEU A 101 -5.080 -3.216 3.554 1.00 0.00 C ATOM 0 H LEU A 101 -3.191 -5.825 7.085 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.898 -3.696 6.308 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.841 -4.130 5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -3.262 -5.809 4.883 1.00 0.00 H new ATOM 0 HG LEU A 101 -3.309 -4.190 2.901 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.196 -5.322 1.858 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -4.147 -6.438 2.764 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.707 -5.925 3.452 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.424 -2.983 2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -5.940 -3.420 4.192 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.525 -2.367 3.954 1.00 0.00 H new ATOM 758 N GLN A 102 -5.996 -6.728 5.799 1.00 0.00 N ATOM 759 CA GLN A 102 -7.227 -7.426 5.497 1.00 0.00 C ATOM 760 C GLN A 102 -8.265 -7.216 6.586 1.00 0.00 C ATOM 761 O GLN A 102 -9.461 -7.301 6.345 1.00 0.00 O ATOM 762 CB GLN A 102 -6.994 -8.888 5.254 1.00 0.00 C ATOM 763 CG GLN A 102 -6.331 -9.618 6.380 1.00 0.00 C ATOM 764 CD GLN A 102 -6.066 -11.072 6.045 1.00 0.00 C ATOM 765 OE1 GLN A 102 -5.141 -11.673 6.558 1.00 0.00 O ATOM 766 NE2 GLN A 102 -6.846 -11.629 5.147 1.00 0.00 N ATOM 0 H GLN A 102 -5.185 -7.323 5.971 1.00 0.00 H new ATOM 0 HA GLN A 102 -7.617 -6.998 4.574 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -7.952 -9.364 5.047 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -6.383 -8.999 4.359 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -5.389 -9.126 6.625 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.961 -9.561 7.268 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -7.613 -11.096 4.737 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -6.685 -12.594 4.860 1.00 0.00 H new ATOM 775 N ASN A 103 -7.793 -6.924 7.764 1.00 0.00 N ATOM 776 CA ASN A 103 -8.652 -6.635 8.880 1.00 0.00 C ATOM 777 C ASN A 103 -9.267 -5.251 8.779 1.00 0.00 C ATOM 778 O ASN A 103 -10.456 -5.089 9.061 1.00 0.00 O ATOM 779 CB ASN A 103 -7.940 -6.858 10.199 1.00 0.00 C ATOM 780 CG ASN A 103 -8.056 -8.298 10.686 1.00 0.00 C ATOM 781 OD1 ASN A 103 -8.989 -8.646 11.391 1.00 0.00 O ATOM 782 ND2 ASN A 103 -7.127 -9.141 10.310 1.00 0.00 N ATOM 0 H ASN A 103 -6.797 -6.879 7.980 1.00 0.00 H new ATOM 0 HA ASN A 103 -9.482 -7.341 8.845 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -6.887 -6.598 10.089 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -8.356 -6.188 10.951 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -7.172 -10.116 10.607 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -6.358 -8.823 9.720 1.00 0.00 H new ATOM 789 N GLU A 104 -8.487 -4.251 8.331 1.00 0.00 N ATOM 790 CA GLU A 104 -9.042 -2.908 8.138 1.00 0.00 C ATOM 791 C GLU A 104 -10.057 -2.961 6.997 1.00 0.00 C ATOM 792 O GLU A 104 -11.080 -2.292 7.018 1.00 0.00 O ATOM 793 CB GLU A 104 -7.949 -1.835 7.887 1.00 0.00 C ATOM 794 CG GLU A 104 -7.250 -1.929 6.542 1.00 0.00 C ATOM 795 CD GLU A 104 -6.169 -0.878 6.321 1.00 0.00 C ATOM 796 OE1 GLU A 104 -5.191 -0.864 7.084 1.00 0.00 O ATOM 797 OE2 GLU A 104 -6.257 -0.093 5.338 1.00 0.00 O ATOM 0 H GLU A 104 -7.498 -4.346 8.102 1.00 0.00 H new ATOM 0 HA GLU A 104 -9.538 -2.600 9.059 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.404 -0.848 7.974 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -7.199 -1.911 8.675 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.803 -2.918 6.447 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -7.995 -1.838 5.752 1.00 0.00 H new ATOM 804 N ILE A 105 -9.767 -3.810 6.025 1.00 0.00 N ATOM 805 CA ILE A 105 -10.666 -4.075 4.927 1.00 0.00 C ATOM 806 C ILE A 105 -11.942 -4.739 5.439 1.00 0.00 C ATOM 807 O ILE A 105 -13.038 -4.311 5.099 1.00 0.00 O ATOM 808 CB ILE A 105 -9.983 -4.975 3.850 1.00 0.00 C ATOM 809 CG1 ILE A 105 -8.831 -4.214 3.171 1.00 0.00 C ATOM 810 CG2 ILE A 105 -10.989 -5.515 2.830 1.00 0.00 C ATOM 811 CD1 ILE A 105 -8.046 -5.025 2.155 1.00 0.00 C ATOM 0 H ILE A 105 -8.894 -4.335 5.980 1.00 0.00 H new ATOM 0 HA ILE A 105 -10.924 -3.124 4.461 1.00 0.00 H new ATOM 0 HB ILE A 105 -9.564 -5.845 4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -9.238 -3.333 2.676 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -8.145 -3.859 3.940 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -10.469 -6.136 2.100 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -11.743 -6.112 3.343 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -11.472 -4.682 2.319 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -7.256 -4.407 1.729 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -7.604 -5.893 2.645 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -8.714 -5.358 1.361 1.00 0.00 H new ATOM 823 N ASN A 106 -11.782 -5.759 6.261 1.00 0.00 N ATOM 824 CA ASN A 106 -12.905 -6.537 6.811 1.00 0.00 C ATOM 825 C ASN A 106 -13.911 -5.610 7.491 1.00 0.00 C ATOM 826 O ASN A 106 -15.070 -5.535 7.078 1.00 0.00 O ATOM 827 CB ASN A 106 -12.374 -7.574 7.830 1.00 0.00 C ATOM 828 CG ASN A 106 -13.410 -8.600 8.308 1.00 0.00 C ATOM 829 OD1 ASN A 106 -14.598 -8.356 8.334 1.00 0.00 O ATOM 830 ND2 ASN A 106 -12.939 -9.758 8.712 1.00 0.00 N ATOM 0 H ASN A 106 -10.867 -6.083 6.575 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.405 -7.057 5.994 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -11.537 -8.108 7.380 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -11.984 -7.042 8.698 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -13.577 -10.475 9.057 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -11.936 -9.940 8.680 1.00 0.00 H new ATOM 1019 N GLN A 119 -18.731 1.206 -1.677 1.00 0.00 N ATOM 1020 CA GLN A 119 -17.518 1.921 -1.469 1.00 0.00 C ATOM 1021 C GLN A 119 -16.629 1.759 -2.643 1.00 0.00 C ATOM 1022 O GLN A 119 -16.188 0.667 -2.951 1.00 0.00 O ATOM 1023 CB GLN A 119 -16.813 1.463 -0.212 1.00 0.00 C ATOM 1024 CG GLN A 119 -17.433 2.004 1.041 1.00 0.00 C ATOM 1025 CD GLN A 119 -16.742 1.525 2.278 1.00 0.00 C ATOM 1026 OE1 GLN A 119 -15.787 2.138 2.731 1.00 0.00 O ATOM 1027 NE2 GLN A 119 -17.233 0.451 2.843 1.00 0.00 N ATOM 0 HA GLN A 119 -17.765 2.975 -1.345 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -16.822 0.374 -0.174 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -15.768 1.771 -0.256 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -17.407 3.093 1.014 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -18.482 1.711 1.079 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -18.032 -0.025 2.425 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -16.816 0.090 3.701 1.00 0.00 H new ATOM 1036 N LYS A 120 -16.352 2.831 -3.300 1.00 0.00 N ATOM 1037 CA LYS A 120 -15.485 2.740 -4.436 1.00 0.00 C ATOM 1038 C LYS A 120 -14.220 3.405 -4.052 1.00 0.00 C ATOM 1039 O LYS A 120 -14.240 4.550 -3.635 1.00 0.00 O ATOM 1040 CB LYS A 120 -16.088 3.402 -5.705 1.00 0.00 C ATOM 1041 CG LYS A 120 -17.526 2.962 -6.046 1.00 0.00 C ATOM 1042 CD LYS A 120 -17.761 2.845 -7.544 1.00 0.00 C ATOM 1043 CE LYS A 120 -17.562 4.164 -8.274 1.00 0.00 C ATOM 1044 NZ LYS A 120 -18.524 5.211 -7.836 1.00 0.00 N ATOM 0 H LYS A 120 -16.701 3.764 -3.082 1.00 0.00 H new ATOM 0 HA LYS A 120 -15.330 1.694 -4.699 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -16.076 4.484 -5.573 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -15.444 3.178 -6.555 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.730 2.001 -5.574 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -18.231 3.679 -5.626 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -17.081 2.100 -7.957 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -18.775 2.485 -7.722 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -16.545 4.518 -8.107 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.671 4.002 -9.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.858 5.744 -8.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -19.335 4.762 -7.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -18.053 5.860 -7.173 1.00 0.00 H new ATOM 1058 N SER A 121 -13.142 2.687 -4.143 1.00 0.00 N ATOM 1059 CA SER A 121 -11.863 3.188 -3.753 1.00 0.00 C ATOM 1060 C SER A 121 -10.904 3.021 -4.890 1.00 0.00 C ATOM 1061 O SER A 121 -10.898 1.978 -5.552 1.00 0.00 O ATOM 1062 CB SER A 121 -11.355 2.434 -2.529 1.00 0.00 C ATOM 1063 OG SER A 121 -12.295 2.480 -1.488 1.00 0.00 O ATOM 0 H SER A 121 -13.127 1.729 -4.493 1.00 0.00 H new ATOM 0 HA SER A 121 -11.949 4.244 -3.499 1.00 0.00 H new ATOM 0 HB2 SER A 121 -11.151 1.397 -2.795 1.00 0.00 H new ATOM 0 HB3 SER A 121 -10.413 2.869 -2.194 1.00 0.00 H new ATOM 0 HG SER A 121 -12.026 1.862 -0.777 1.00 0.00 H new ATOM 1069 N SER A 122 -10.127 4.028 -5.133 1.00 0.00 N ATOM 1070 CA SER A 122 -9.155 4.026 -6.192 1.00 0.00 C ATOM 1071 C SER A 122 -8.036 5.019 -5.851 1.00 0.00 C ATOM 1072 O SER A 122 -8.271 6.001 -5.132 1.00 0.00 O ATOM 1073 CB SER A 122 -9.829 4.376 -7.523 1.00 0.00 C ATOM 1074 OG SER A 122 -10.826 3.421 -7.873 1.00 0.00 O ATOM 0 H SER A 122 -10.147 4.894 -4.594 1.00 0.00 H new ATOM 0 HA SER A 122 -8.717 3.033 -6.294 1.00 0.00 H new ATOM 0 HB2 SER A 122 -10.281 5.366 -7.454 1.00 0.00 H new ATOM 0 HB3 SER A 122 -9.077 4.423 -8.311 1.00 0.00 H new ATOM 0 HG SER A 122 -11.237 3.675 -8.726 1.00 0.00 H new ATOM 1080 N VAL A 123 -6.839 4.739 -6.311 1.00 0.00 N ATOM 1081 CA VAL A 123 -5.684 5.590 -6.076 1.00 0.00 C ATOM 1082 C VAL A 123 -4.711 5.516 -7.253 1.00 0.00 C ATOM 1083 O VAL A 123 -4.427 4.425 -7.771 1.00 0.00 O ATOM 1084 CB VAL A 123 -4.933 5.229 -4.735 1.00 0.00 C ATOM 1085 CG1 VAL A 123 -4.638 3.745 -4.646 1.00 0.00 C ATOM 1086 CG2 VAL A 123 -3.623 6.012 -4.604 1.00 0.00 C ATOM 0 H VAL A 123 -6.632 3.908 -6.865 1.00 0.00 H new ATOM 0 HA VAL A 123 -6.059 6.609 -5.979 1.00 0.00 H new ATOM 0 HB VAL A 123 -5.599 5.506 -3.918 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -4.121 3.532 -3.710 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -5.573 3.186 -4.679 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.008 3.448 -5.485 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -3.129 5.742 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -2.970 5.772 -5.443 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -3.836 7.081 -4.605 1.00 0.00 H new ATOM 1096 N ASN A 124 -4.235 6.674 -7.691 1.00 0.00 N ATOM 1097 CA ASN A 124 -3.211 6.748 -8.723 1.00 0.00 C ATOM 1098 C ASN A 124 -1.869 6.429 -8.103 1.00 0.00 C ATOM 1099 O ASN A 124 -1.432 7.116 -7.186 1.00 0.00 O ATOM 1100 CB ASN A 124 -3.166 8.152 -9.376 1.00 0.00 C ATOM 1101 CG ASN A 124 -1.970 8.337 -10.334 1.00 0.00 C ATOM 1102 OD1 ASN A 124 -1.492 7.393 -10.948 1.00 0.00 O ATOM 1103 ND2 ASN A 124 -1.463 9.543 -10.434 1.00 0.00 N ATOM 0 H ASN A 124 -4.545 7.582 -7.344 1.00 0.00 H new ATOM 0 HA ASN A 124 -3.450 6.026 -9.504 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -4.093 8.321 -9.925 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -3.117 8.909 -8.593 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -0.654 9.708 -11.033 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -1.878 10.315 -9.913 1.00 0.00 H new ATOM 1110 N GLU A 125 -1.222 5.395 -8.602 1.00 0.00 N ATOM 1111 CA GLU A 125 0.079 4.957 -8.103 1.00 0.00 C ATOM 1112 C GLU A 125 1.157 6.046 -8.148 1.00 0.00 C ATOM 1113 O GLU A 125 2.091 6.024 -7.367 1.00 0.00 O ATOM 1114 CB GLU A 125 0.563 3.764 -8.874 1.00 0.00 C ATOM 1115 CG GLU A 125 0.496 3.969 -10.360 1.00 0.00 C ATOM 1116 CD GLU A 125 1.247 2.911 -11.105 1.00 0.00 C ATOM 1117 OE1 GLU A 125 0.667 1.854 -11.381 1.00 0.00 O ATOM 1118 OE2 GLU A 125 2.434 3.118 -11.375 1.00 0.00 O ATOM 0 H GLU A 125 -1.581 4.827 -9.370 1.00 0.00 H new ATOM 0 HA GLU A 125 -0.081 4.702 -7.055 1.00 0.00 H new ATOM 0 HB2 GLU A 125 1.591 3.544 -8.588 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -0.036 2.894 -8.604 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -0.546 3.967 -10.680 1.00 0.00 H new ATOM 0 HG3 GLU A 125 0.905 4.948 -10.610 1.00 0.00 H new ATOM 1125 N ASN A 126 1.024 7.013 -9.020 1.00 0.00 N ATOM 1126 CA ASN A 126 2.063 8.016 -9.110 1.00 0.00 C ATOM 1127 C ASN A 126 1.633 9.304 -8.520 1.00 0.00 C ATOM 1128 O ASN A 126 2.261 10.328 -8.684 1.00 0.00 O ATOM 1129 CB ASN A 126 2.701 8.128 -10.501 1.00 0.00 C ATOM 1130 CG ASN A 126 3.533 6.885 -10.809 1.00 0.00 C ATOM 1131 OD1 ASN A 126 4.718 6.801 -10.434 1.00 0.00 O ATOM 1132 ND2 ASN A 126 2.943 5.930 -11.484 1.00 0.00 N ATOM 0 H ASN A 126 0.237 7.130 -9.659 1.00 0.00 H new ATOM 0 HA ASN A 126 2.889 7.668 -8.489 1.00 0.00 H new ATOM 0 HB2 ASN A 126 1.924 8.249 -11.256 1.00 0.00 H new ATOM 0 HB3 ASN A 126 3.332 9.016 -10.548 1.00 0.00 H new ATOM 0 HD21 ASN A 126 3.456 5.080 -11.720 1.00 0.00 H new ATOM 0 HD22 ASN A 126 1.971 6.036 -11.774 1.00 0.00 H new ATOM 1139 N GLU A 127 0.565 9.204 -7.774 1.00 0.00 N ATOM 1140 CA GLU A 127 0.066 10.272 -6.959 1.00 0.00 C ATOM 1141 C GLU A 127 0.391 9.863 -5.519 1.00 0.00 C ATOM 1142 O GLU A 127 0.090 10.540 -4.543 1.00 0.00 O ATOM 1143 CB GLU A 127 -1.434 10.407 -7.196 1.00 0.00 C ATOM 1144 CG GLU A 127 -2.112 11.540 -6.480 1.00 0.00 C ATOM 1145 CD GLU A 127 -1.453 12.888 -6.695 1.00 0.00 C ATOM 1146 OE1 GLU A 127 -1.409 13.346 -7.841 1.00 0.00 O ATOM 1147 OE2 GLU A 127 -0.964 13.485 -5.690 1.00 0.00 O ATOM 0 H GLU A 127 0.005 8.353 -7.717 1.00 0.00 H new ATOM 0 HA GLU A 127 0.510 11.241 -7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -1.604 10.526 -8.266 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -1.915 9.475 -6.898 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.149 11.597 -6.811 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -2.130 11.322 -5.412 1.00 0.00 H new ATOM 1154 N ILE A 128 1.025 8.710 -5.420 1.00 0.00 N ATOM 1155 CA ILE A 128 1.503 8.204 -4.190 1.00 0.00 C ATOM 1156 C ILE A 128 2.826 8.855 -3.957 1.00 0.00 C ATOM 1157 O ILE A 128 3.833 8.515 -4.587 1.00 0.00 O ATOM 1158 CB ILE A 128 1.677 6.680 -4.226 1.00 0.00 C ATOM 1159 CG1 ILE A 128 0.359 6.009 -4.572 1.00 0.00 C ATOM 1160 CG2 ILE A 128 2.207 6.166 -2.895 1.00 0.00 C ATOM 1161 CD1 ILE A 128 0.479 4.520 -4.675 1.00 0.00 C ATOM 0 H ILE A 128 1.215 8.104 -6.218 1.00 0.00 H new ATOM 0 HA ILE A 128 0.790 8.419 -3.394 1.00 0.00 H new ATOM 0 HB ILE A 128 2.406 6.434 -4.998 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -0.382 6.258 -3.812 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -0.009 6.406 -5.518 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.323 5.083 -2.943 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.173 6.625 -2.686 1.00 0.00 H new ATOM 0 HG23 ILE A 128 1.505 6.421 -2.101 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -0.492 4.093 -4.924 1.00 0.00 H new ATOM 0 HD12 ILE A 128 1.198 4.266 -5.454 1.00 0.00 H new ATOM 0 HD13 ILE A 128 0.819 4.116 -3.722 1.00 0.00 H new ATOM 1173 N LYS A 129 2.806 9.810 -3.120 1.00 0.00 N ATOM 1174 CA LYS A 129 3.947 10.596 -2.841 1.00 0.00 C ATOM 1175 C LYS A 129 4.768 9.931 -1.770 1.00 0.00 C ATOM 1176 O LYS A 129 4.349 9.806 -0.616 1.00 0.00 O ATOM 1177 CB LYS A 129 3.486 12.017 -2.506 1.00 0.00 C ATOM 1178 CG LYS A 129 2.918 12.707 -3.753 1.00 0.00 C ATOM 1179 CD LYS A 129 1.853 13.768 -3.474 1.00 0.00 C ATOM 1180 CE LYS A 129 0.586 13.148 -2.878 1.00 0.00 C ATOM 1181 NZ LYS A 129 -0.604 13.987 -3.116 1.00 0.00 N ATOM 0 H LYS A 129 1.976 10.080 -2.592 1.00 0.00 H new ATOM 0 HA LYS A 129 4.609 10.678 -3.703 1.00 0.00 H new ATOM 0 HB2 LYS A 129 2.727 11.984 -1.724 1.00 0.00 H new ATOM 0 HB3 LYS A 129 4.323 12.594 -2.114 1.00 0.00 H new ATOM 0 HG2 LYS A 129 3.739 13.172 -4.298 1.00 0.00 H new ATOM 0 HG3 LYS A 129 2.490 11.947 -4.407 1.00 0.00 H new ATOM 0 HD2 LYS A 129 2.252 14.514 -2.787 1.00 0.00 H new ATOM 0 HD3 LYS A 129 1.604 14.288 -4.399 1.00 0.00 H new ATOM 0 HE2 LYS A 129 0.427 12.161 -3.312 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.721 13.006 -1.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -1.445 13.515 -2.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -0.478 14.909 -2.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.730 14.129 -4.139 1.00 0.00 H new ATOM 1195 N ILE A 130 5.900 9.447 -2.191 1.00 0.00 N ATOM 1196 CA ILE A 130 6.794 8.698 -1.366 1.00 0.00 C ATOM 1197 C ILE A 130 8.027 9.522 -1.072 1.00 0.00 C ATOM 1198 O ILE A 130 8.667 10.050 -1.976 1.00 0.00 O ATOM 1199 CB ILE A 130 7.180 7.377 -2.085 1.00 0.00 C ATOM 1200 CG1 ILE A 130 5.905 6.567 -2.357 1.00 0.00 C ATOM 1201 CG2 ILE A 130 8.185 6.560 -1.270 1.00 0.00 C ATOM 1202 CD1 ILE A 130 6.114 5.327 -3.178 1.00 0.00 C ATOM 0 H ILE A 130 6.234 9.568 -3.147 1.00 0.00 H new ATOM 0 HA ILE A 130 6.305 8.454 -0.423 1.00 0.00 H new ATOM 0 HB ILE A 130 7.667 7.620 -3.029 1.00 0.00 H new ATOM 0 HG12 ILE A 130 5.460 6.284 -1.403 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.186 7.207 -2.867 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.430 5.644 -1.807 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.092 7.145 -1.119 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.750 6.309 -0.303 1.00 0.00 H new ATOM 0 HD11 ILE A 130 5.160 4.819 -3.319 1.00 0.00 H new ATOM 0 HD12 ILE A 130 6.528 5.599 -4.149 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.806 4.661 -2.662 1.00 0.00 H new ATOM 1214 N LEU A 131 8.325 9.655 0.175 1.00 0.00 N ATOM 1215 CA LEU A 131 9.463 10.383 0.618 1.00 0.00 C ATOM 1216 C LEU A 131 10.375 9.412 1.338 1.00 0.00 C ATOM 1217 O LEU A 131 9.989 8.825 2.346 1.00 0.00 O ATOM 1218 CB LEU A 131 8.994 11.577 1.515 1.00 0.00 C ATOM 1219 CG LEU A 131 10.053 12.564 2.084 1.00 0.00 C ATOM 1220 CD1 LEU A 131 10.771 12.006 3.298 1.00 0.00 C ATOM 1221 CD2 LEU A 131 11.061 12.939 1.020 1.00 0.00 C ATOM 0 H LEU A 131 7.772 9.252 0.931 1.00 0.00 H new ATOM 0 HA LEU A 131 10.022 10.821 -0.209 1.00 0.00 H new ATOM 0 HB2 LEU A 131 8.280 12.162 0.935 1.00 0.00 H new ATOM 0 HB3 LEU A 131 8.450 11.157 2.361 1.00 0.00 H new ATOM 0 HG LEU A 131 9.511 13.455 2.401 1.00 0.00 H new ATOM 0 HD11 LEU A 131 11.499 12.734 3.656 1.00 0.00 H new ATOM 0 HD12 LEU A 131 10.047 11.799 4.086 1.00 0.00 H new ATOM 0 HD13 LEU A 131 11.284 11.084 3.025 1.00 0.00 H new ATOM 0 HD21 LEU A 131 11.792 13.630 1.439 1.00 0.00 H new ATOM 0 HD22 LEU A 131 11.570 12.041 0.668 1.00 0.00 H new ATOM 0 HD23 LEU A 131 10.548 13.416 0.185 1.00 0.00 H new ATOM 1233 N ALA A 132 11.542 9.191 0.780 1.00 0.00 N ATOM 1234 CA ALA A 132 12.514 8.300 1.378 1.00 0.00 C ATOM 1235 C ALA A 132 12.941 8.860 2.721 1.00 0.00 C ATOM 1236 O ALA A 132 13.433 9.984 2.806 1.00 0.00 O ATOM 1237 CB ALA A 132 13.716 8.137 0.465 1.00 0.00 C ATOM 0 H ALA A 132 11.845 9.619 -0.095 1.00 0.00 H new ATOM 0 HA ALA A 132 12.064 7.318 1.522 1.00 0.00 H new ATOM 0 HB1 ALA A 132 14.437 7.464 0.929 1.00 0.00 H new ATOM 0 HB2 ALA A 132 13.394 7.721 -0.490 1.00 0.00 H new ATOM 0 HB3 ALA A 132 14.181 9.109 0.299 1.00 0.00 H new ATOM 1349 N GLN A 140 15.314 0.557 5.069 1.00 0.00 N ATOM 1350 CA GLN A 140 14.932 1.686 4.277 1.00 0.00 C ATOM 1351 C GLN A 140 13.476 1.933 4.587 1.00 0.00 C ATOM 1352 O GLN A 140 12.632 1.047 4.341 1.00 0.00 O ATOM 1353 CB GLN A 140 15.023 1.318 2.813 1.00 0.00 C ATOM 1354 CG GLN A 140 16.380 0.894 2.348 1.00 0.00 C ATOM 1355 CD GLN A 140 16.273 -0.009 1.155 1.00 0.00 C ATOM 1356 OE1 GLN A 140 16.271 0.429 0.006 1.00 0.00 O ATOM 1357 NE2 GLN A 140 16.125 -1.283 1.425 1.00 0.00 N ATOM 0 HA GLN A 140 15.565 2.548 4.485 1.00 0.00 H new ATOM 0 HB2 GLN A 140 14.319 0.510 2.613 1.00 0.00 H new ATOM 0 HB3 GLN A 140 14.703 2.174 2.219 1.00 0.00 H new ATOM 0 HG2 GLN A 140 16.974 1.772 2.094 1.00 0.00 H new ATOM 0 HG3 GLN A 140 16.902 0.379 3.155 1.00 0.00 H new ATOM 0 HE21 GLN A 140 16.133 -1.603 2.393 1.00 0.00 H new ATOM 0 HE22 GLN A 140 16.002 -1.954 0.667 1.00 0.00 H new ATOM 1366 N GLN A 141 13.161 3.045 5.165 1.00 0.00 N ATOM 1367 CA GLN A 141 11.793 3.338 5.421 1.00 0.00 C ATOM 1368 C GLN A 141 11.358 4.470 4.517 1.00 0.00 C ATOM 1369 O GLN A 141 12.125 5.375 4.218 1.00 0.00 O ATOM 1370 CB GLN A 141 11.523 3.606 6.906 1.00 0.00 C ATOM 1371 CG GLN A 141 12.087 4.886 7.438 1.00 0.00 C ATOM 1372 CD GLN A 141 11.805 5.063 8.903 1.00 0.00 C ATOM 1373 OE1 GLN A 141 10.795 5.628 9.289 1.00 0.00 O ATOM 1374 NE2 GLN A 141 12.686 4.566 9.727 1.00 0.00 N ATOM 0 H GLN A 141 13.826 3.758 5.466 1.00 0.00 H new ATOM 0 HA GLN A 141 11.186 2.463 5.188 1.00 0.00 H new ATOM 0 HB2 GLN A 141 10.445 3.608 7.068 1.00 0.00 H new ATOM 0 HB3 GLN A 141 11.931 2.779 7.487 1.00 0.00 H new ATOM 0 HG2 GLN A 141 13.164 4.903 7.272 1.00 0.00 H new ATOM 0 HG3 GLN A 141 11.666 5.725 6.884 1.00 0.00 H new ATOM 0 HE21 GLN A 141 13.518 4.101 9.364 1.00 0.00 H new ATOM 0 HE22 GLN A 141 12.543 4.643 10.734 1.00 0.00 H new ATOM 1383 N TYR A 142 10.182 4.380 4.037 1.00 0.00 N ATOM 1384 CA TYR A 142 9.674 5.304 3.085 1.00 0.00 C ATOM 1385 C TYR A 142 8.372 5.880 3.591 1.00 0.00 C ATOM 1386 O TYR A 142 7.456 5.146 3.955 1.00 0.00 O ATOM 1387 CB TYR A 142 9.498 4.583 1.733 1.00 0.00 C ATOM 1388 CG TYR A 142 10.808 4.147 1.096 1.00 0.00 C ATOM 1389 CD1 TYR A 142 11.368 2.915 1.389 1.00 0.00 C ATOM 1390 CD2 TYR A 142 11.481 4.973 0.203 1.00 0.00 C ATOM 1391 CE1 TYR A 142 12.553 2.516 0.820 1.00 0.00 C ATOM 1392 CE2 TYR A 142 12.675 4.576 -0.377 1.00 0.00 C ATOM 1393 CZ TYR A 142 13.204 3.346 -0.063 1.00 0.00 C ATOM 1394 OH TYR A 142 14.393 2.940 -0.635 1.00 0.00 O ATOM 0 H TYR A 142 9.523 3.646 4.296 1.00 0.00 H new ATOM 0 HA TYR A 142 10.369 6.132 2.941 1.00 0.00 H new ATOM 0 HB2 TYR A 142 8.866 3.707 1.878 1.00 0.00 H new ATOM 0 HB3 TYR A 142 8.972 5.245 1.045 1.00 0.00 H new ATOM 0 HD1 TYR A 142 10.863 2.255 2.079 1.00 0.00 H new ATOM 0 HD2 TYR A 142 11.066 5.940 -0.043 1.00 0.00 H new ATOM 0 HE1 TYR A 142 12.973 1.552 1.066 1.00 0.00 H new ATOM 0 HE2 TYR A 142 13.186 5.227 -1.070 1.00 0.00 H new ATOM 0 HH TYR A 142 14.689 2.104 -0.217 1.00 0.00 H new ATOM 1404 N LEU A 143 8.317 7.176 3.669 1.00 0.00 N ATOM 1405 CA LEU A 143 7.149 7.870 4.111 1.00 0.00 C ATOM 1406 C LEU A 143 6.208 7.911 2.938 1.00 0.00 C ATOM 1407 O LEU A 143 6.614 8.262 1.830 1.00 0.00 O ATOM 1408 CB LEU A 143 7.546 9.279 4.502 1.00 0.00 C ATOM 1409 CG LEU A 143 6.760 9.964 5.621 1.00 0.00 C ATOM 1410 CD1 LEU A 143 5.286 10.121 5.290 1.00 0.00 C ATOM 1411 CD2 LEU A 143 6.957 9.225 6.933 1.00 0.00 C ATOM 0 H LEU A 143 9.095 7.788 3.423 1.00 0.00 H new ATOM 0 HA LEU A 143 6.681 7.384 4.967 1.00 0.00 H new ATOM 0 HB2 LEU A 143 8.596 9.261 4.795 1.00 0.00 H new ATOM 0 HB3 LEU A 143 7.474 9.905 3.612 1.00 0.00 H new ATOM 0 HG LEU A 143 7.157 10.974 5.725 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.777 10.613 6.119 1.00 0.00 H new ATOM 0 HD12 LEU A 143 5.178 10.724 4.389 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.844 9.139 5.125 1.00 0.00 H new ATOM 0 HD21 LEU A 143 6.392 9.724 7.720 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.605 8.199 6.829 1.00 0.00 H new ATOM 0 HD23 LEU A 143 8.015 9.221 7.193 1.00 0.00 H new ATOM 1423 N VAL A 144 4.992 7.555 3.155 1.00 0.00 N ATOM 1424 CA VAL A 144 4.060 7.471 2.082 1.00 0.00 C ATOM 1425 C VAL A 144 2.856 8.359 2.350 1.00 0.00 C ATOM 1426 O VAL A 144 2.286 8.351 3.442 1.00 0.00 O ATOM 1427 CB VAL A 144 3.580 6.015 1.859 1.00 0.00 C ATOM 1428 CG1 VAL A 144 2.715 5.916 0.617 1.00 0.00 C ATOM 1429 CG2 VAL A 144 4.753 5.048 1.779 1.00 0.00 C ATOM 0 H VAL A 144 4.615 7.315 4.072 1.00 0.00 H new ATOM 0 HA VAL A 144 4.572 7.811 1.182 1.00 0.00 H new ATOM 0 HB VAL A 144 2.976 5.731 2.721 1.00 0.00 H new ATOM 0 HG11 VAL A 144 2.390 4.884 0.481 1.00 0.00 H new ATOM 0 HG12 VAL A 144 1.842 6.560 0.729 1.00 0.00 H new ATOM 0 HG13 VAL A 144 3.290 6.233 -0.253 1.00 0.00 H new ATOM 0 HG21 VAL A 144 4.380 4.036 1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.400 5.329 0.948 1.00 0.00 H new ATOM 0 HG23 VAL A 144 5.320 5.086 2.709 1.00 0.00 H new ATOM 1439 N THR A 145 2.516 9.147 1.392 1.00 0.00 N ATOM 1440 CA THR A 145 1.356 9.976 1.446 1.00 0.00 C ATOM 1441 C THR A 145 0.578 9.801 0.135 1.00 0.00 C ATOM 1442 O THR A 145 1.091 10.107 -0.944 1.00 0.00 O ATOM 1443 CB THR A 145 1.783 11.437 1.656 1.00 0.00 C ATOM 1444 OG1 THR A 145 2.554 11.515 2.868 1.00 0.00 O ATOM 1445 CG2 THR A 145 0.586 12.336 1.772 1.00 0.00 C ATOM 0 H THR A 145 3.047 9.238 0.526 1.00 0.00 H new ATOM 0 HA THR A 145 0.712 9.694 2.279 1.00 0.00 H new ATOM 0 HB THR A 145 2.373 11.763 0.799 1.00 0.00 H new ATOM 0 HG1 THR A 145 2.836 12.442 3.017 1.00 0.00 H new ATOM 0 HG21 THR A 145 0.916 13.364 1.920 1.00 0.00 H new ATOM 0 HG22 THR A 145 -0.006 12.273 0.859 1.00 0.00 H new ATOM 0 HG23 THR A 145 -0.022 12.024 2.621 1.00 0.00 H new ATOM 1453 N ALA A 146 -0.622 9.268 0.222 1.00 0.00 N ATOM 1454 CA ALA A 146 -1.391 8.969 -0.970 1.00 0.00 C ATOM 1455 C ALA A 146 -2.864 9.277 -0.784 1.00 0.00 C ATOM 1456 O ALA A 146 -3.450 8.930 0.252 1.00 0.00 O ATOM 1457 CB ALA A 146 -1.216 7.512 -1.359 1.00 0.00 C ATOM 0 H ALA A 146 -1.085 9.033 1.100 1.00 0.00 H new ATOM 0 HA ALA A 146 -1.013 9.607 -1.769 1.00 0.00 H new ATOM 0 HB1 ALA A 146 -1.799 7.302 -2.256 1.00 0.00 H new ATOM 0 HB2 ALA A 146 -0.163 7.312 -1.556 1.00 0.00 H new ATOM 0 HB3 ALA A 146 -1.560 6.874 -0.545 1.00 0.00 H new ATOM 1463 N PRO A 147 -3.469 9.963 -1.755 1.00 0.00 N ATOM 1464 CA PRO A 147 -4.879 10.263 -1.739 1.00 0.00 C ATOM 1465 C PRO A 147 -5.702 9.075 -2.178 1.00 0.00 C ATOM 1466 O PRO A 147 -5.400 8.413 -3.179 1.00 0.00 O ATOM 1467 CB PRO A 147 -5.026 11.412 -2.730 1.00 0.00 C ATOM 1468 CG PRO A 147 -3.916 11.223 -3.687 1.00 0.00 C ATOM 1469 CD PRO A 147 -2.804 10.537 -2.934 1.00 0.00 C ATOM 0 HA PRO A 147 -5.233 10.516 -0.739 1.00 0.00 H new ATOM 0 HB2 PRO A 147 -5.993 11.381 -3.233 1.00 0.00 H new ATOM 0 HB3 PRO A 147 -4.958 12.378 -2.230 1.00 0.00 H new ATOM 0 HG2 PRO A 147 -4.237 10.620 -4.537 1.00 0.00 H new ATOM 0 HG3 PRO A 147 -3.580 12.181 -4.084 1.00 0.00 H new ATOM 0 HD2 PRO A 147 -2.330 9.765 -3.540 1.00 0.00 H new ATOM 0 HD3 PRO A 147 -2.023 11.241 -2.648 1.00 0.00 H new ATOM 1477 N ILE A 148 -6.720 8.801 -1.442 1.00 0.00 N ATOM 1478 CA ILE A 148 -7.573 7.715 -1.757 1.00 0.00 C ATOM 1479 C ILE A 148 -8.889 8.283 -2.210 1.00 0.00 C ATOM 1480 O ILE A 148 -9.574 8.987 -1.448 1.00 0.00 O ATOM 1481 CB ILE A 148 -7.782 6.760 -0.551 1.00 0.00 C ATOM 1482 CG1 ILE A 148 -6.425 6.356 0.061 1.00 0.00 C ATOM 1483 CG2 ILE A 148 -8.522 5.508 -1.014 1.00 0.00 C ATOM 1484 CD1 ILE A 148 -5.526 5.579 -0.883 1.00 0.00 C ATOM 0 H ILE A 148 -6.983 9.323 -0.606 1.00 0.00 H new ATOM 0 HA ILE A 148 -7.113 7.118 -2.544 1.00 0.00 H new ATOM 0 HB ILE A 148 -8.369 7.278 0.207 1.00 0.00 H new ATOM 0 HG12 ILE A 148 -5.902 7.256 0.385 1.00 0.00 H new ATOM 0 HG13 ILE A 148 -6.605 5.754 0.952 1.00 0.00 H new ATOM 0 HG21 ILE A 148 -8.668 4.838 -0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 148 -9.491 5.790 -1.426 1.00 0.00 H new ATOM 0 HG23 ILE A 148 -7.936 5.001 -1.780 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -4.593 5.333 -0.377 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -6.026 4.660 -1.188 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -5.313 6.185 -1.763 1.00 0.00 H new ATOM 1496 N HIS A 149 -9.217 8.027 -3.440 1.00 0.00 N ATOM 1497 CA HIS A 149 -10.426 8.529 -4.020 1.00 0.00 C ATOM 1498 C HIS A 149 -11.535 7.571 -3.726 1.00 0.00 C ATOM 1499 O HIS A 149 -11.615 6.493 -4.322 1.00 0.00 O ATOM 1500 CB HIS A 149 -10.279 8.724 -5.535 1.00 0.00 C ATOM 1501 CG HIS A 149 -9.184 9.671 -5.915 1.00 0.00 C ATOM 1502 ND1 HIS A 149 -9.240 11.019 -5.692 1.00 0.00 N ATOM 1503 CD2 HIS A 149 -7.980 9.434 -6.490 1.00 0.00 C ATOM 1504 CE1 HIS A 149 -8.102 11.563 -6.124 1.00 0.00 C ATOM 1505 NE2 HIS A 149 -7.296 10.637 -6.621 1.00 0.00 N ATOM 0 H HIS A 149 -8.651 7.461 -4.073 1.00 0.00 H new ATOM 0 HA HIS A 149 -10.649 9.503 -3.586 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -10.089 7.757 -6.000 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -11.222 9.092 -5.939 1.00 0.00 H new ATOM 0 HD1 HIS A 149 -10.019 11.522 -5.268 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -7.611 8.466 -6.797 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -7.869 12.616 -6.075 1.00 0.00 H new ATOM 1513 N GLN A 150 -12.356 7.920 -2.778 1.00 0.00 N ATOM 1514 CA GLN A 150 -13.422 7.066 -2.379 1.00 0.00 C ATOM 1515 C GLN A 150 -14.752 7.683 -2.590 1.00 0.00 C ATOM 1516 O GLN A 150 -14.878 8.897 -2.896 1.00 0.00 O ATOM 1517 CB GLN A 150 -13.270 6.636 -0.934 1.00 0.00 C ATOM 1518 CG GLN A 150 -12.056 5.796 -0.729 1.00 0.00 C ATOM 1519 CD GLN A 150 -11.946 5.217 0.637 1.00 0.00 C ATOM 1520 OE1 GLN A 150 -12.381 5.799 1.619 1.00 0.00 O ATOM 1521 NE2 GLN A 150 -11.401 4.043 0.696 1.00 0.00 N ATOM 0 H GLN A 150 -12.301 8.801 -2.266 1.00 0.00 H new ATOM 0 HA GLN A 150 -13.364 6.184 -3.017 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -13.213 7.518 -0.297 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -14.154 6.078 -0.626 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -12.060 4.985 -1.457 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -11.171 6.400 -0.929 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -11.053 3.599 -0.154 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -11.320 3.563 1.592 1.00 0.00 H new ATOM 1530 N VAL A 151 -15.743 6.843 -2.543 1.00 0.00 N ATOM 1531 CA VAL A 151 -17.080 7.258 -2.527 1.00 0.00 C ATOM 1532 C VAL A 151 -17.774 6.348 -1.545 1.00 0.00 C ATOM 1533 O VAL A 151 -17.472 5.149 -1.490 1.00 0.00 O ATOM 1534 CB VAL A 151 -17.810 7.232 -3.926 1.00 0.00 C ATOM 1535 CG1 VAL A 151 -16.953 7.740 -5.074 1.00 0.00 C ATOM 1536 CG2 VAL A 151 -18.490 5.914 -4.246 1.00 0.00 C ATOM 0 H VAL A 151 -15.622 5.831 -2.515 1.00 0.00 H new ATOM 0 HA VAL A 151 -17.117 8.310 -2.244 1.00 0.00 H new ATOM 0 HB VAL A 151 -18.618 7.956 -3.815 1.00 0.00 H new ATOM 0 HG11 VAL A 151 -17.522 7.692 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -16.661 8.772 -4.881 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -16.060 7.121 -5.163 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -18.968 5.979 -5.224 1.00 0.00 H new ATOM 0 HG22 VAL A 151 -17.748 5.115 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -19.243 5.700 -3.488 1.00 0.00 H new ATOM 1546 N PHE A 152 -18.635 6.896 -0.785 1.00 0.00 N ATOM 1547 CA PHE A 152 -19.336 6.194 0.194 1.00 0.00 C ATOM 1548 C PHE A 152 -20.788 6.298 -0.144 1.00 0.00 C ATOM 1549 O PHE A 152 -21.372 7.367 -0.062 1.00 0.00 O ATOM 1550 CB PHE A 152 -19.027 6.784 1.560 1.00 0.00 C ATOM 1551 CG PHE A 152 -19.503 5.955 2.699 1.00 0.00 C ATOM 1552 CD1 PHE A 152 -19.055 4.657 2.843 1.00 0.00 C ATOM 1553 CD2 PHE A 152 -20.359 6.480 3.649 1.00 0.00 C ATOM 1554 CE1 PHE A 152 -19.455 3.895 3.915 1.00 0.00 C ATOM 1555 CE2 PHE A 152 -20.772 5.718 4.722 1.00 0.00 C ATOM 1556 CZ PHE A 152 -20.317 4.423 4.856 1.00 0.00 C ATOM 0 H PHE A 152 -18.876 7.886 -0.834 1.00 0.00 H new ATOM 0 HA PHE A 152 -19.046 5.144 0.226 1.00 0.00 H new ATOM 0 HB2 PHE A 152 -17.949 6.922 1.650 1.00 0.00 H new ATOM 0 HB3 PHE A 152 -19.481 7.772 1.629 1.00 0.00 H new ATOM 0 HD1 PHE A 152 -18.385 4.237 2.108 1.00 0.00 H new ATOM 0 HD2 PHE A 152 -20.708 7.497 3.550 1.00 0.00 H new ATOM 0 HE1 PHE A 152 -19.095 2.882 4.021 1.00 0.00 H new ATOM 0 HE2 PHE A 152 -21.449 6.134 5.454 1.00 0.00 H new ATOM 0 HZ PHE A 152 -20.634 3.823 5.696 1.00 0.00 H new ATOM 1566 N ASN A 153 -21.323 5.193 -0.615 1.00 0.00 N ATOM 1567 CA ASN A 153 -22.712 5.062 -1.075 1.00 0.00 C ATOM 1568 C ASN A 153 -22.937 6.049 -2.236 1.00 0.00 C ATOM 1569 O ASN A 153 -23.993 6.608 -2.420 1.00 0.00 O ATOM 1570 CB ASN A 153 -23.693 5.309 0.095 1.00 0.00 C ATOM 1571 CG ASN A 153 -25.051 4.653 -0.104 1.00 0.00 C ATOM 1572 OD1 ASN A 153 -25.967 5.221 -0.661 1.00 0.00 O ATOM 1573 ND2 ASN A 153 -25.174 3.441 0.379 1.00 0.00 N ATOM 0 H ASN A 153 -20.795 4.324 -0.696 1.00 0.00 H new ATOM 0 HA ASN A 153 -22.900 4.050 -1.434 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -23.249 4.934 1.017 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -23.832 6.383 0.222 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -26.061 2.945 0.292 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -24.383 2.994 0.841 1.00 0.00 H new ATOM 1580 N GLY A 154 -21.887 6.214 -3.040 1.00 0.00 N ATOM 1581 CA GLY A 154 -21.934 7.102 -4.191 1.00 0.00 C ATOM 1582 C GLY A 154 -21.339 8.465 -3.894 1.00 0.00 C ATOM 1583 O GLY A 154 -20.804 9.132 -4.779 1.00 0.00 O ATOM 0 H GLY A 154 -20.993 5.741 -2.911 1.00 0.00 H new ATOM 0 HA2 GLY A 154 -21.394 6.646 -5.021 1.00 0.00 H new ATOM 0 HA3 GLY A 154 -22.969 7.222 -4.512 1.00 0.00 H new ATOM 1587 N THR A 155 -21.351 8.803 -2.647 1.00 0.00 N ATOM 1588 CA THR A 155 -20.942 10.102 -2.144 1.00 0.00 C ATOM 1589 C THR A 155 -19.469 10.201 -2.000 1.00 0.00 C ATOM 1590 O THR A 155 -18.831 9.373 -1.423 1.00 0.00 O ATOM 1591 CB THR A 155 -21.697 10.401 -0.836 1.00 0.00 C ATOM 1592 OG1 THR A 155 -23.086 10.629 -1.105 1.00 0.00 O ATOM 1593 CG2 THR A 155 -21.092 11.540 -0.033 1.00 0.00 C ATOM 0 H THR A 155 -21.656 8.167 -1.910 1.00 0.00 H new ATOM 0 HA THR A 155 -21.209 10.869 -2.871 1.00 0.00 H new ATOM 0 HB THR A 155 -21.597 9.517 -0.206 1.00 0.00 H new ATOM 0 HG1 THR A 155 -23.555 10.816 -0.265 1.00 0.00 H new ATOM 0 HG21 THR A 155 -21.675 11.695 0.875 1.00 0.00 H new ATOM 0 HG22 THR A 155 -20.065 11.292 0.233 1.00 0.00 H new ATOM 0 HG23 THR A 155 -21.102 12.452 -0.630 1.00 0.00 H new ATOM 1601 N LYS A 156 -18.964 11.237 -2.544 1.00 0.00 N ATOM 1602 CA LYS A 156 -17.606 11.456 -2.637 1.00 0.00 C ATOM 1603 C LYS A 156 -16.947 11.709 -1.296 1.00 0.00 C ATOM 1604 O LYS A 156 -17.489 12.398 -0.439 1.00 0.00 O ATOM 1605 CB LYS A 156 -17.403 12.627 -3.505 1.00 0.00 C ATOM 1606 CG LYS A 156 -16.258 12.454 -4.362 1.00 0.00 C ATOM 1607 CD LYS A 156 -16.500 11.427 -5.436 1.00 0.00 C ATOM 1608 CE LYS A 156 -15.171 11.061 -6.114 1.00 0.00 C ATOM 1609 NZ LYS A 156 -14.134 10.634 -5.124 1.00 0.00 N ATOM 0 H LYS A 156 -19.527 11.983 -2.952 1.00 0.00 H new ATOM 0 HA LYS A 156 -17.144 10.556 -3.043 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -18.293 12.790 -4.113 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -17.269 13.518 -2.891 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -16.005 13.408 -4.825 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -15.399 12.154 -3.762 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -16.956 10.536 -5.004 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -17.200 11.818 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -15.339 10.258 -6.831 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -14.803 11.919 -6.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -13.369 10.131 -5.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -13.745 11.472 -4.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -14.566 10.002 -4.420 1.00 0.00 H new ATOM 1623 N ASN A 157 -15.787 11.139 -1.151 1.00 0.00 N ATOM 1624 CA ASN A 157 -14.946 11.321 -0.020 1.00 0.00 C ATOM 1625 C ASN A 157 -13.520 11.074 -0.472 1.00 0.00 C ATOM 1626 O ASN A 157 -13.138 9.941 -0.776 1.00 0.00 O ATOM 1627 CB ASN A 157 -15.341 10.375 1.121 1.00 0.00 C ATOM 1628 CG ASN A 157 -14.360 10.390 2.275 1.00 0.00 C ATOM 1629 OD1 ASN A 157 -14.463 11.188 3.192 1.00 0.00 O ATOM 1630 ND2 ASN A 157 -13.421 9.487 2.246 1.00 0.00 N ATOM 0 H ASN A 157 -15.391 10.510 -1.850 1.00 0.00 H new ATOM 0 HA ASN A 157 -15.048 12.334 0.371 1.00 0.00 H new ATOM 0 HB2 ASN A 157 -16.329 10.652 1.489 1.00 0.00 H new ATOM 0 HB3 ASN A 157 -15.419 9.360 0.732 1.00 0.00 H new ATOM 0 HD21 ASN A 157 -12.743 9.432 3.006 1.00 0.00 H new ATOM 0 HD22 ASN A 157 -13.364 8.835 1.463 1.00 0.00 H new ATOM 1637 N ASP A 158 -12.768 12.119 -0.572 1.00 0.00 N ATOM 1638 CA ASP A 158 -11.411 12.051 -1.051 1.00 0.00 C ATOM 1639 C ASP A 158 -10.507 12.591 0.016 1.00 0.00 C ATOM 1640 O ASP A 158 -10.711 13.700 0.504 1.00 0.00 O ATOM 1641 CB ASP A 158 -11.256 12.861 -2.350 1.00 0.00 C ATOM 1642 CG ASP A 158 -12.075 12.307 -3.506 1.00 0.00 C ATOM 1643 OD1 ASP A 158 -13.297 12.538 -3.559 1.00 0.00 O ATOM 1644 OD2 ASP A 158 -11.527 11.601 -4.378 1.00 0.00 O ATOM 0 H ASP A 158 -13.074 13.060 -0.323 1.00 0.00 H new ATOM 0 HA ASP A 158 -11.147 11.017 -1.272 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -11.554 13.893 -2.164 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -10.204 12.880 -2.635 1.00 0.00 H new ATOM 1649 N PHE A 159 -9.532 11.819 0.397 1.00 0.00 N ATOM 1650 CA PHE A 159 -8.656 12.182 1.492 1.00 0.00 C ATOM 1651 C PHE A 159 -7.281 11.615 1.241 1.00 0.00 C ATOM 1652 O PHE A 159 -7.141 10.682 0.459 1.00 0.00 O ATOM 1653 CB PHE A 159 -9.230 11.643 2.825 1.00 0.00 C ATOM 1654 CG PHE A 159 -9.290 10.131 2.929 1.00 0.00 C ATOM 1655 CD1 PHE A 159 -10.153 9.393 2.133 1.00 0.00 C ATOM 1656 CD2 PHE A 159 -8.474 9.455 3.815 1.00 0.00 C ATOM 1657 CE1 PHE A 159 -10.198 8.024 2.219 1.00 0.00 C ATOM 1658 CE2 PHE A 159 -8.518 8.079 3.905 1.00 0.00 C ATOM 1659 CZ PHE A 159 -9.381 7.364 3.105 1.00 0.00 C ATOM 0 H PHE A 159 -9.315 10.921 -0.036 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.585 13.268 1.560 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -8.624 12.025 3.646 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -10.235 12.042 2.959 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -10.800 9.903 1.435 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -7.794 10.010 4.444 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -10.876 7.465 1.590 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -7.876 7.563 4.603 1.00 0.00 H new ATOM 0 HZ PHE A 159 -9.416 6.287 3.174 1.00 0.00 H new ATOM 1669 N GLU A 160 -6.288 12.149 1.895 1.00 0.00 N ATOM 1670 CA GLU A 160 -4.939 11.686 1.704 1.00 0.00 C ATOM 1671 C GLU A 160 -4.471 11.032 2.978 1.00 0.00 C ATOM 1672 O GLU A 160 -4.701 11.560 4.058 1.00 0.00 O ATOM 1673 CB GLU A 160 -4.036 12.851 1.254 1.00 0.00 C ATOM 1674 CG GLU A 160 -2.708 12.424 0.678 1.00 0.00 C ATOM 1675 CD GLU A 160 -2.150 13.426 -0.324 1.00 0.00 C ATOM 1676 OE1 GLU A 160 -2.573 13.394 -1.491 1.00 0.00 O ATOM 1677 OE2 GLU A 160 -1.261 14.209 0.009 1.00 0.00 O ATOM 0 H GLU A 160 -6.386 12.909 2.568 1.00 0.00 H new ATOM 0 HA GLU A 160 -4.892 10.941 0.910 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -4.569 13.441 0.508 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -3.855 13.505 2.107 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -1.992 12.290 1.489 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -2.823 11.456 0.191 1.00 0.00 H new ATOM 1684 N ILE A 161 -3.906 9.845 2.861 1.00 0.00 N ATOM 1685 CA ILE A 161 -3.459 9.126 4.030 1.00 0.00 C ATOM 1686 C ILE A 161 -1.967 9.272 4.165 1.00 0.00 C ATOM 1687 O ILE A 161 -1.247 9.423 3.155 1.00 0.00 O ATOM 1688 CB ILE A 161 -3.842 7.607 4.031 1.00 0.00 C ATOM 1689 CG1 ILE A 161 -2.971 6.781 3.081 1.00 0.00 C ATOM 1690 CG2 ILE A 161 -5.294 7.442 3.651 1.00 0.00 C ATOM 1691 CD1 ILE A 161 -3.211 5.294 3.211 1.00 0.00 C ATOM 0 H ILE A 161 -3.748 9.365 1.975 1.00 0.00 H new ATOM 0 HA ILE A 161 -3.976 9.569 4.881 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.671 7.236 5.041 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -3.169 7.088 2.054 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.921 6.994 3.280 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -5.553 6.383 3.654 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -5.920 7.971 4.369 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -5.458 7.853 2.655 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -2.566 4.759 2.514 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -2.986 4.977 4.229 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -4.254 5.073 2.984 1.00 0.00 H new ATOM 1703 N ASN A 162 -1.499 9.220 5.376 1.00 0.00 N ATOM 1704 CA ASN A 162 -0.106 9.414 5.654 1.00 0.00 C ATOM 1705 C ASN A 162 0.377 8.254 6.486 1.00 0.00 C ATOM 1706 O ASN A 162 -0.048 8.077 7.629 1.00 0.00 O ATOM 1707 CB ASN A 162 0.113 10.731 6.438 1.00 0.00 C ATOM 1708 CG ASN A 162 -0.640 11.925 5.845 1.00 0.00 C ATOM 1709 OD1 ASN A 162 -1.778 12.181 6.204 1.00 0.00 O ATOM 1710 ND2 ASN A 162 -0.031 12.640 4.934 1.00 0.00 N ATOM 0 H ASN A 162 -2.072 9.042 6.201 1.00 0.00 H new ATOM 0 HA ASN A 162 0.447 9.473 4.716 1.00 0.00 H new ATOM 0 HB2 ASN A 162 -0.205 10.587 7.471 1.00 0.00 H new ATOM 0 HB3 ASN A 162 1.179 10.958 6.461 1.00 0.00 H new ATOM 0 HD21 ASN A 162 -0.508 13.433 4.505 1.00 0.00 H new ATOM 0 HD22 ASN A 162 0.921 12.404 4.652 1.00 0.00 H new ATOM 1717 N GLN A 163 1.208 7.422 5.925 1.00 0.00 N ATOM 1718 CA GLN A 163 1.739 6.312 6.675 1.00 0.00 C ATOM 1719 C GLN A 163 3.201 6.144 6.358 1.00 0.00 C ATOM 1720 O GLN A 163 3.661 6.555 5.306 1.00 0.00 O ATOM 1721 CB GLN A 163 1.019 4.979 6.378 1.00 0.00 C ATOM 1722 CG GLN A 163 -0.511 5.018 6.346 1.00 0.00 C ATOM 1723 CD GLN A 163 -1.138 3.625 6.328 1.00 0.00 C ATOM 1724 OE1 GLN A 163 -2.179 3.409 5.754 1.00 0.00 O ATOM 1725 NE2 GLN A 163 -0.522 2.682 7.002 1.00 0.00 N ATOM 0 H GLN A 163 1.532 7.487 4.960 1.00 0.00 H new ATOM 0 HA GLN A 163 1.583 6.546 7.728 1.00 0.00 H new ATOM 0 HB2 GLN A 163 1.370 4.609 5.415 1.00 0.00 H new ATOM 0 HB3 GLN A 163 1.325 4.252 7.130 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -0.874 5.564 7.217 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -0.838 5.570 5.465 1.00 0.00 H new ATOM 0 HE21 GLN A 163 0.356 2.887 7.479 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -0.921 1.745 7.049 1.00 0.00 H new ATOM 1734 N LEU A 164 3.926 5.573 7.261 1.00 0.00 N ATOM 1735 CA LEU A 164 5.302 5.269 7.019 1.00 0.00 C ATOM 1736 C LEU A 164 5.338 3.794 6.644 1.00 0.00 C ATOM 1737 O LEU A 164 4.624 2.980 7.258 1.00 0.00 O ATOM 1738 CB LEU A 164 6.150 5.548 8.296 1.00 0.00 C ATOM 1739 CG LEU A 164 6.397 4.364 9.253 1.00 0.00 C ATOM 1740 CD1 LEU A 164 7.691 3.614 8.900 1.00 0.00 C ATOM 1741 CD2 LEU A 164 6.387 4.799 10.696 1.00 0.00 C ATOM 0 H LEU A 164 3.586 5.304 8.184 1.00 0.00 H new ATOM 0 HA LEU A 164 5.724 5.886 6.225 1.00 0.00 H new ATOM 0 HB2 LEU A 164 7.119 5.934 7.980 1.00 0.00 H new ATOM 0 HB3 LEU A 164 5.659 6.341 8.860 1.00 0.00 H new ATOM 0 HG LEU A 164 5.569 3.667 9.122 1.00 0.00 H new ATOM 0 HD11 LEU A 164 7.833 2.786 9.595 1.00 0.00 H new ATOM 0 HD12 LEU A 164 7.621 3.227 7.884 1.00 0.00 H new ATOM 0 HD13 LEU A 164 8.538 4.296 8.971 1.00 0.00 H new ATOM 0 HD21 LEU A 164 6.565 3.936 11.337 1.00 0.00 H new ATOM 0 HD22 LEU A 164 7.171 5.539 10.858 1.00 0.00 H new ATOM 0 HD23 LEU A 164 5.419 5.237 10.937 1.00 0.00 H new ATOM 1753 N ILE A 165 6.069 3.457 5.637 1.00 0.00 N ATOM 1754 CA ILE A 165 6.216 2.086 5.226 1.00 0.00 C ATOM 1755 C ILE A 165 7.685 1.714 5.195 1.00 0.00 C ATOM 1756 O ILE A 165 8.491 2.393 4.576 1.00 0.00 O ATOM 1757 CB ILE A 165 5.519 1.789 3.829 1.00 0.00 C ATOM 1758 CG1 ILE A 165 4.076 1.267 3.988 1.00 0.00 C ATOM 1759 CG2 ILE A 165 6.321 0.829 2.959 1.00 0.00 C ATOM 1760 CD1 ILE A 165 3.076 2.236 4.578 1.00 0.00 C ATOM 0 H ILE A 165 6.589 4.123 5.066 1.00 0.00 H new ATOM 0 HA ILE A 165 5.704 1.464 5.960 1.00 0.00 H new ATOM 0 HB ILE A 165 5.483 2.753 3.322 1.00 0.00 H new ATOM 0 HG12 ILE A 165 3.714 0.956 3.008 1.00 0.00 H new ATOM 0 HG13 ILE A 165 4.101 0.376 4.616 1.00 0.00 H new ATOM 0 HG21 ILE A 165 5.795 0.665 2.019 1.00 0.00 H new ATOM 0 HG22 ILE A 165 7.303 1.256 2.756 1.00 0.00 H new ATOM 0 HG23 ILE A 165 6.439 -0.121 3.480 1.00 0.00 H new ATOM 0 HD11 ILE A 165 2.099 1.757 4.641 1.00 0.00 H new ATOM 0 HD12 ILE A 165 3.400 2.531 5.576 1.00 0.00 H new ATOM 0 HD13 ILE A 165 3.007 3.119 3.943 1.00 0.00 H new ATOM 1772 N GLN A 166 8.044 0.684 5.898 1.00 0.00 N ATOM 1773 CA GLN A 166 9.390 0.206 5.818 1.00 0.00 C ATOM 1774 C GLN A 166 9.480 -0.942 4.832 1.00 0.00 C ATOM 1775 O GLN A 166 8.663 -1.880 4.864 1.00 0.00 O ATOM 1776 CB GLN A 166 9.989 -0.155 7.185 1.00 0.00 C ATOM 1777 CG GLN A 166 11.389 -0.772 7.082 1.00 0.00 C ATOM 1778 CD GLN A 166 12.080 -0.990 8.409 1.00 0.00 C ATOM 1779 OE1 GLN A 166 12.851 -1.954 8.565 1.00 0.00 O ATOM 1780 NE2 GLN A 166 11.886 -0.083 9.338 1.00 0.00 N ATOM 0 H GLN A 166 7.432 0.163 6.527 1.00 0.00 H new ATOM 0 HA GLN A 166 10.004 1.028 5.449 1.00 0.00 H new ATOM 0 HB2 GLN A 166 10.038 0.742 7.802 1.00 0.00 H new ATOM 0 HB3 GLN A 166 9.326 -0.855 7.693 1.00 0.00 H new ATOM 0 HG2 GLN A 166 11.313 -1.729 6.565 1.00 0.00 H new ATOM 0 HG3 GLN A 166 12.012 -0.125 6.465 1.00 0.00 H new ATOM 0 HE21 GLN A 166 11.245 0.692 9.168 1.00 0.00 H new ATOM 0 HE22 GLN A 166 12.377 -0.153 10.229 1.00 0.00 H new ATOM 1789 N ILE A 167 10.464 -0.860 3.970 1.00 0.00 N ATOM 1790 CA ILE A 167 10.684 -1.834 2.940 1.00 0.00 C ATOM 1791 C ILE A 167 11.795 -2.788 3.355 1.00 0.00 C ATOM 1792 O ILE A 167 12.879 -2.367 3.794 1.00 0.00 O ATOM 1793 CB ILE A 167 11.037 -1.132 1.593 1.00 0.00 C ATOM 1794 CG1 ILE A 167 9.822 -0.303 1.100 1.00 0.00 C ATOM 1795 CG2 ILE A 167 11.462 -2.164 0.535 1.00 0.00 C ATOM 1796 CD1 ILE A 167 8.717 -1.143 0.478 1.00 0.00 C ATOM 0 H ILE A 167 11.144 -0.100 3.968 1.00 0.00 H new ATOM 0 HA ILE A 167 9.768 -2.407 2.795 1.00 0.00 H new ATOM 0 HB ILE A 167 11.878 -0.459 1.756 1.00 0.00 H new ATOM 0 HG12 ILE A 167 9.411 0.257 1.940 1.00 0.00 H new ATOM 0 HG13 ILE A 167 10.166 0.428 0.368 1.00 0.00 H new ATOM 0 HG21 ILE A 167 11.704 -1.652 -0.396 1.00 0.00 H new ATOM 0 HG22 ILE A 167 12.338 -2.707 0.888 1.00 0.00 H new ATOM 0 HG23 ILE A 167 10.646 -2.865 0.362 1.00 0.00 H new ATOM 0 HD11 ILE A 167 7.903 -0.493 0.158 1.00 0.00 H new ATOM 0 HD12 ILE A 167 9.111 -1.682 -0.383 1.00 0.00 H new ATOM 0 HD13 ILE A 167 8.344 -1.856 1.213 1.00 0.00 H new ATOM 1808 N LYS A 168 11.513 -4.054 3.252 1.00 0.00 N ATOM 1809 CA LYS A 168 12.447 -5.088 3.576 1.00 0.00 C ATOM 1810 C LYS A 168 12.027 -6.297 2.795 1.00 0.00 C ATOM 1811 O LYS A 168 10.844 -6.573 2.710 1.00 0.00 O ATOM 1812 CB LYS A 168 12.381 -5.398 5.079 1.00 0.00 C ATOM 1813 CG LYS A 168 13.585 -6.134 5.665 1.00 0.00 C ATOM 1814 CD LYS A 168 14.845 -5.280 5.620 1.00 0.00 C ATOM 1815 CE LYS A 168 14.683 -3.980 6.419 1.00 0.00 C ATOM 1816 NZ LYS A 168 14.517 -4.200 7.886 1.00 0.00 N ATOM 0 H LYS A 168 10.608 -4.402 2.934 1.00 0.00 H new ATOM 0 HA LYS A 168 13.467 -4.790 3.334 1.00 0.00 H new ATOM 0 HB2 LYS A 168 12.257 -4.459 5.618 1.00 0.00 H new ATOM 0 HB3 LYS A 168 11.488 -5.995 5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 168 13.373 -6.415 6.697 1.00 0.00 H new ATOM 0 HG3 LYS A 168 13.752 -7.058 5.111 1.00 0.00 H new ATOM 0 HD2 LYS A 168 15.684 -5.850 6.019 1.00 0.00 H new ATOM 0 HD3 LYS A 168 15.086 -5.042 4.584 1.00 0.00 H new ATOM 0 HE2 LYS A 168 15.555 -3.348 6.251 1.00 0.00 H new ATOM 0 HE3 LYS A 168 13.818 -3.436 6.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 13.894 -3.466 8.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 14.096 -5.136 8.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 15.446 -4.151 8.352 1.00 0.00 H new ATOM 1830 N ASN A 169 12.987 -6.983 2.205 1.00 0.00 N ATOM 1831 CA ASN A 169 12.745 -8.214 1.411 1.00 0.00 C ATOM 1832 C ASN A 169 11.845 -7.963 0.230 1.00 0.00 C ATOM 1833 O ASN A 169 11.080 -8.845 -0.135 1.00 0.00 O ATOM 1834 CB ASN A 169 12.081 -9.317 2.270 1.00 0.00 C ATOM 1835 CG ASN A 169 12.957 -9.867 3.374 1.00 0.00 C ATOM 1836 OD1 ASN A 169 13.749 -10.764 3.163 1.00 0.00 O ATOM 1837 ND2 ASN A 169 12.785 -9.364 4.576 1.00 0.00 N ATOM 0 H ASN A 169 13.970 -6.716 2.252 1.00 0.00 H new ATOM 0 HA ASN A 169 13.727 -8.536 1.064 1.00 0.00 H new ATOM 0 HB2 ASN A 169 11.170 -8.915 2.713 1.00 0.00 H new ATOM 0 HB3 ASN A 169 11.783 -10.138 1.617 1.00 0.00 H new ATOM 0 HD21 ASN A 169 13.324 -9.726 5.362 1.00 0.00 H new ATOM 0 HD22 ASN A 169 12.113 -8.611 4.722 1.00 0.00 H new ATOM 1844 N GLN A 170 11.983 -6.776 -0.411 1.00 0.00 N ATOM 1845 CA GLN A 170 11.174 -6.424 -1.601 1.00 0.00 C ATOM 1846 C GLN A 170 9.714 -6.353 -1.232 1.00 0.00 C ATOM 1847 O GLN A 170 8.835 -6.520 -2.068 1.00 0.00 O ATOM 1848 CB GLN A 170 11.377 -7.465 -2.692 1.00 0.00 C ATOM 1849 CG GLN A 170 12.781 -7.477 -3.251 1.00 0.00 C ATOM 1850 CD GLN A 170 12.867 -6.744 -4.569 1.00 0.00 C ATOM 1851 OE1 GLN A 170 12.709 -7.339 -5.640 1.00 0.00 O ATOM 1852 NE2 GLN A 170 13.105 -5.461 -4.515 1.00 0.00 N ATOM 0 H GLN A 170 12.642 -6.052 -0.125 1.00 0.00 H new ATOM 0 HA GLN A 170 11.496 -5.450 -1.970 1.00 0.00 H new ATOM 0 HB2 GLN A 170 11.144 -8.452 -2.291 1.00 0.00 H new ATOM 0 HB3 GLN A 170 10.672 -7.275 -3.502 1.00 0.00 H new ATOM 0 HG2 GLN A 170 13.461 -7.017 -2.534 1.00 0.00 H new ATOM 0 HG3 GLN A 170 13.109 -8.507 -3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 170 13.230 -5.003 -3.612 1.00 0.00 H new ATOM 0 HE22 GLN A 170 13.166 -4.917 -5.376 1.00 0.00 H new ATOM 1861 N LYS A 171 9.461 -6.083 0.014 1.00 0.00 N ATOM 1862 CA LYS A 171 8.135 -6.062 0.508 1.00 0.00 C ATOM 1863 C LYS A 171 8.014 -4.981 1.545 1.00 0.00 C ATOM 1864 O LYS A 171 9.024 -4.397 1.982 1.00 0.00 O ATOM 1865 CB LYS A 171 7.833 -7.393 1.210 1.00 0.00 C ATOM 1866 CG LYS A 171 8.070 -8.643 0.389 1.00 0.00 C ATOM 1867 CD LYS A 171 7.937 -9.858 1.255 1.00 0.00 C ATOM 1868 CE LYS A 171 6.508 -10.171 1.581 1.00 0.00 C ATOM 1869 NZ LYS A 171 5.745 -10.630 0.416 1.00 0.00 N ATOM 0 H LYS A 171 10.176 -5.872 0.710 1.00 0.00 H new ATOM 0 HA LYS A 171 7.449 -5.893 -0.322 1.00 0.00 H new ATOM 0 HB2 LYS A 171 8.443 -7.453 2.111 1.00 0.00 H new ATOM 0 HB3 LYS A 171 6.791 -7.384 1.530 1.00 0.00 H new ATOM 0 HG2 LYS A 171 7.353 -8.691 -0.431 1.00 0.00 H new ATOM 0 HG3 LYS A 171 9.064 -8.612 -0.058 1.00 0.00 H new ATOM 0 HD2 LYS A 171 8.388 -10.712 0.750 1.00 0.00 H new ATOM 0 HD3 LYS A 171 8.493 -9.705 2.180 1.00 0.00 H new ATOM 0 HE2 LYS A 171 6.477 -10.938 2.355 1.00 0.00 H new ATOM 0 HE3 LYS A 171 6.032 -9.282 1.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 4.732 -10.653 0.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 5.901 -9.979 -0.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 6.060 -11.585 0.149 1.00 0.00 H new ATOM 1883 N ILE A 172 6.809 -4.726 1.937 1.00 0.00 N ATOM 1884 CA ILE A 172 6.545 -3.889 3.069 1.00 0.00 C ATOM 1885 C ILE A 172 6.615 -4.788 4.252 1.00 0.00 C ATOM 1886 O ILE A 172 5.946 -5.811 4.285 1.00 0.00 O ATOM 1887 CB ILE A 172 5.141 -3.192 3.066 1.00 0.00 C ATOM 1888 CG1 ILE A 172 4.990 -2.219 1.924 1.00 0.00 C ATOM 1889 CG2 ILE A 172 4.848 -2.486 4.380 1.00 0.00 C ATOM 1890 CD1 ILE A 172 4.473 -2.835 0.671 1.00 0.00 C ATOM 0 H ILE A 172 5.973 -5.093 1.481 1.00 0.00 H new ATOM 0 HA ILE A 172 7.271 -3.076 3.066 1.00 0.00 H new ATOM 0 HB ILE A 172 4.414 -3.994 2.935 1.00 0.00 H new ATOM 0 HG12 ILE A 172 4.316 -1.418 2.229 1.00 0.00 H new ATOM 0 HG13 ILE A 172 5.958 -1.761 1.720 1.00 0.00 H new ATOM 0 HG21 ILE A 172 3.865 -2.018 4.330 1.00 0.00 H new ATOM 0 HG22 ILE A 172 4.864 -3.211 5.194 1.00 0.00 H new ATOM 0 HG23 ILE A 172 5.605 -1.722 4.559 1.00 0.00 H new ATOM 0 HD11 ILE A 172 4.392 -2.072 -0.103 1.00 0.00 H new ATOM 0 HD12 ILE A 172 5.157 -3.616 0.340 1.00 0.00 H new ATOM 0 HD13 ILE A 172 3.490 -3.268 0.857 1.00 0.00 H new ATOM 1902 N THR A 173 7.418 -4.441 5.178 1.00 0.00 N ATOM 1903 CA THR A 173 7.598 -5.261 6.343 1.00 0.00 C ATOM 1904 C THR A 173 6.850 -4.670 7.529 1.00 0.00 C ATOM 1905 O THR A 173 6.570 -5.366 8.511 1.00 0.00 O ATOM 1906 CB THR A 173 9.105 -5.441 6.662 1.00 0.00 C ATOM 1907 OG1 THR A 173 9.313 -6.294 7.794 1.00 0.00 O ATOM 1908 CG2 THR A 173 9.771 -4.101 6.900 1.00 0.00 C ATOM 0 H THR A 173 7.975 -3.587 5.166 1.00 0.00 H new ATOM 0 HA THR A 173 7.183 -6.248 6.140 1.00 0.00 H new ATOM 0 HB THR A 173 9.559 -5.916 5.792 1.00 0.00 H new ATOM 0 HG1 THR A 173 10.274 -6.385 7.963 1.00 0.00 H new ATOM 0 HG21 THR A 173 10.827 -4.254 7.122 1.00 0.00 H new ATOM 0 HG22 THR A 173 9.673 -3.483 6.008 1.00 0.00 H new ATOM 0 HG23 THR A 173 9.292 -3.601 7.742 1.00 0.00 H new ATOM 1916 N GLN A 174 6.513 -3.392 7.424 1.00 0.00 N ATOM 1917 CA GLN A 174 5.806 -2.698 8.469 1.00 0.00 C ATOM 1918 C GLN A 174 5.255 -1.393 7.931 1.00 0.00 C ATOM 1919 O GLN A 174 5.968 -0.643 7.253 1.00 0.00 O ATOM 1920 CB GLN A 174 6.709 -2.427 9.692 1.00 0.00 C ATOM 1921 CG GLN A 174 5.966 -1.756 10.844 1.00 0.00 C ATOM 1922 CD GLN A 174 4.811 -2.603 11.372 1.00 0.00 C ATOM 1923 OE1 GLN A 174 4.865 -3.828 11.365 1.00 0.00 O ATOM 1924 NE2 GLN A 174 3.748 -1.953 11.767 1.00 0.00 N ATOM 0 H GLN A 174 6.726 -2.816 6.610 1.00 0.00 H new ATOM 0 HA GLN A 174 4.987 -3.336 8.801 1.00 0.00 H new ATOM 0 HB2 GLN A 174 7.133 -3.369 10.040 1.00 0.00 H new ATOM 0 HB3 GLN A 174 7.543 -1.795 9.388 1.00 0.00 H new ATOM 0 HG2 GLN A 174 6.666 -1.557 11.656 1.00 0.00 H new ATOM 0 HG3 GLN A 174 5.582 -0.792 10.511 1.00 0.00 H new ATOM 0 HE21 GLN A 174 3.741 -0.933 11.758 1.00 0.00 H new ATOM 0 HE22 GLN A 174 2.925 -2.466 12.084 1.00 0.00 H new ATOM 1933 N ARG A 175 3.996 -1.153 8.182 1.00 0.00 N ATOM 1934 CA ARG A 175 3.360 0.077 7.827 1.00 0.00 C ATOM 1935 C ARG A 175 2.872 0.715 9.102 1.00 0.00 C ATOM 1936 O ARG A 175 2.504 0.021 10.032 1.00 0.00 O ATOM 1937 CB ARG A 175 2.204 -0.161 6.860 1.00 0.00 C ATOM 1938 CG ARG A 175 1.126 -0.991 7.424 1.00 0.00 C ATOM 1939 CD ARG A 175 0.107 -1.390 6.408 1.00 0.00 C ATOM 1940 NE ARG A 175 -0.839 -0.316 6.021 1.00 0.00 N ATOM 1941 CZ ARG A 175 -2.172 -0.361 6.332 1.00 0.00 C ATOM 1942 NH1 ARG A 175 -2.584 -1.084 7.352 1.00 0.00 N ATOM 1943 NH2 ARG A 175 -3.058 0.428 5.717 1.00 0.00 N ATOM 0 H ARG A 175 3.379 -1.819 8.646 1.00 0.00 H new ATOM 0 HA ARG A 175 4.065 0.734 7.317 1.00 0.00 H new ATOM 0 HB2 ARG A 175 1.790 0.801 6.557 1.00 0.00 H new ATOM 0 HB3 ARG A 175 2.587 -0.641 5.959 1.00 0.00 H new ATOM 0 HG2 ARG A 175 1.559 -1.887 7.868 1.00 0.00 H new ATOM 0 HG3 ARG A 175 0.635 -0.442 8.228 1.00 0.00 H new ATOM 0 HD2 ARG A 175 0.623 -1.739 5.514 1.00 0.00 H new ATOM 0 HD3 ARG A 175 -0.463 -2.234 6.797 1.00 0.00 H new ATOM 0 HE ARG A 175 -0.483 0.487 5.503 1.00 0.00 H new ATOM 0 HH11 ARG A 175 -1.911 -1.610 7.909 1.00 0.00 H new ATOM 0 HH12 ARG A 175 -3.576 -1.118 7.585 1.00 0.00 H new ATOM 0 HH21 ARG A 175 -2.746 1.082 4.999 1.00 0.00 H new ATOM 0 HH22 ARG A 175 -4.046 0.376 5.966 1.00 0.00 H new ATOM 1957 N THR A 176 2.958 1.988 9.215 1.00 0.00 N ATOM 1958 CA THR A 176 2.464 2.629 10.396 1.00 0.00 C ATOM 1959 C THR A 176 1.793 3.930 10.037 1.00 0.00 C ATOM 1960 O THR A 176 2.400 4.779 9.398 1.00 0.00 O ATOM 1961 CB THR A 176 3.594 2.849 11.422 1.00 0.00 C ATOM 1962 OG1 THR A 176 4.334 1.626 11.540 1.00 0.00 O ATOM 1963 CG2 THR A 176 3.013 3.179 12.786 1.00 0.00 C ATOM 0 H THR A 176 3.361 2.611 8.515 1.00 0.00 H new ATOM 0 HA THR A 176 1.725 1.977 10.861 1.00 0.00 H new ATOM 0 HB THR A 176 4.227 3.671 11.089 1.00 0.00 H new ATOM 0 HG1 THR A 176 5.060 1.744 12.188 1.00 0.00 H new ATOM 0 HG21 THR A 176 3.823 3.331 13.499 1.00 0.00 H new ATOM 0 HG22 THR A 176 2.415 4.088 12.717 1.00 0.00 H new ATOM 0 HG23 THR A 176 2.384 2.355 13.122 1.00 0.00 H new ATOM 1971 N THR A 177 0.523 4.041 10.375 1.00 0.00 N ATOM 1972 CA THR A 177 -0.236 5.238 10.106 1.00 0.00 C ATOM 1973 C THR A 177 0.303 6.375 10.973 1.00 0.00 C ATOM 1974 O THR A 177 0.547 6.194 12.172 1.00 0.00 O ATOM 1975 CB THR A 177 -1.776 5.009 10.316 1.00 0.00 C ATOM 1976 OG1 THR A 177 -2.515 6.186 9.998 1.00 0.00 O ATOM 1977 CG2 THR A 177 -2.107 4.559 11.740 1.00 0.00 C ATOM 0 H THR A 177 -0.006 3.305 10.842 1.00 0.00 H new ATOM 0 HA THR A 177 -0.116 5.511 9.058 1.00 0.00 H new ATOM 0 HB THR A 177 -2.067 4.208 9.637 1.00 0.00 H new ATOM 0 HG1 THR A 177 -3.471 6.019 10.135 1.00 0.00 H new ATOM 0 HG21 THR A 177 -3.183 4.414 11.835 1.00 0.00 H new ATOM 0 HG22 THR A 177 -1.594 3.621 11.954 1.00 0.00 H new ATOM 0 HG23 THR A 177 -1.780 5.321 12.448 1.00 0.00 H new ATOM 1985 N ILE A 178 0.539 7.504 10.363 1.00 0.00 N ATOM 1986 CA ILE A 178 1.153 8.624 11.049 1.00 0.00 C ATOM 1987 C ILE A 178 0.424 9.921 10.765 1.00 0.00 C ATOM 1988 O ILE A 178 -0.485 9.969 9.950 1.00 0.00 O ATOM 1989 CB ILE A 178 2.637 8.828 10.655 1.00 0.00 C ATOM 1990 CG1 ILE A 178 2.754 9.057 9.161 1.00 0.00 C ATOM 1991 CG2 ILE A 178 3.497 7.652 11.085 1.00 0.00 C ATOM 1992 CD1 ILE A 178 4.072 9.606 8.748 1.00 0.00 C ATOM 0 H ILE A 178 0.316 7.680 9.383 1.00 0.00 H new ATOM 0 HA ILE A 178 1.091 8.375 12.108 1.00 0.00 H new ATOM 0 HB ILE A 178 3.005 9.710 11.179 1.00 0.00 H new ATOM 0 HG12 ILE A 178 2.583 8.114 8.642 1.00 0.00 H new ATOM 0 HG13 ILE A 178 1.968 9.742 8.844 1.00 0.00 H new ATOM 0 HG21 ILE A 178 4.531 7.831 10.792 1.00 0.00 H new ATOM 0 HG22 ILE A 178 3.442 7.537 12.168 1.00 0.00 H new ATOM 0 HG23 ILE A 178 3.136 6.742 10.605 1.00 0.00 H new ATOM 0 HD11 ILE A 178 4.086 9.745 7.667 1.00 0.00 H new ATOM 0 HD12 ILE A 178 4.237 10.565 9.239 1.00 0.00 H new ATOM 0 HD13 ILE A 178 4.861 8.911 9.035 1.00 0.00 H new