USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 957 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 36 MET CE :methyl 149:sc= -0.312 (180deg=-2.06!) USER MOD Set 1.2: A 72 MET CE :methyl 154:sc= -0.0667 (180deg=-0.0013) USER MOD Set 2.1: A 26 THR OG1 : rot -145:sc= 1.07 USER MOD Set 2.2: A 62 THR OG1 : rot 135:sc= 1.22 USER MOD Single : A 8 GLN : amide:sc= 0.505 K(o=0.5,f=-0.0011) USER MOD Single : A 13 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0317) USER MOD Single : A 17 SER OG : rot 105:sc= 0.038 USER MOD Single : A 28 THR OG1 : rot -102:sc= 0.0555 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -2.9! C(o=-2.9!,f=-4!) USER MOD Single : A 42 ASN : amide:sc= -2.17! K(o=-2.2!,f=-0.65) USER MOD Single : A 44 THR OG1 : rot 174:sc= 1.26 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.0061) USER MOD Single : A 51 MET CE :methyl -116:sc= -1.48 (180deg=-4.28!) USER MOD Single : A 53 ASN : amide:sc= -0.0778 X(o=-0.078,f=0) USER MOD Single : A 70 THR OG1 : rot 3:sc= 0.39 USER MOD Single : A 71 MET CE :methyl 170:sc= -0.578 (180deg=-0.722) USER MOD Single : A 81 SER OG : rot 32:sc= 0.0298 USER MOD Single : A 94 LYS NZ :NH3+ 161:sc= -0.0196 (180deg=-0.168) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.585 K(o=-0.58,f=0.14) USER MOD Single : A 109 MET CE :methyl 155:sc= -4.88! (180deg=-6.83!) USER MOD Single : A 110 THR OG1 : rot 83:sc= 0.506 USER MOD Single : A 111 ASN : amide:sc= -0.0914 X(o=-0.091,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -131:sc= -4.24! (180deg=-8.04!) USER MOD Single : A 135 GLN : amide:sc= -0.379 K(o=-0.38,f=-5.1!) USER MOD Single : A 137 ASN : amide:sc= -5.37! C(o=-5.4!,f=-13!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 MET CE :methyl -144:sc= -1.07 (180deg=-2.73!) USER MOD Single : A 145 MET CE :methyl -161:sc= -4.3! (180deg=-5.1!) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N GLU A 7 -0.910 8.537 -11.605 1.00 3.51 N ATOM 91 CA GLU A 7 -2.313 8.932 -11.746 1.00 3.59 C ATOM 92 C GLU A 7 -3.035 9.047 -10.405 1.00 3.35 C ATOM 93 O GLU A 7 -4.089 9.684 -10.331 1.00 3.38 O ATOM 94 CB GLU A 7 -3.061 7.957 -12.662 1.00 3.93 C ATOM 95 CG GLU A 7 -2.704 8.098 -14.135 1.00 4.45 C ATOM 96 CD GLU A 7 -3.465 7.125 -15.015 1.00 5.14 C ATOM 97 OE1 GLU A 7 -4.571 7.480 -15.474 1.00 5.54 O ATOM 98 OE2 GLU A 7 -2.954 6.009 -15.245 1.00 5.58 O ATOM 0 HA GLU A 7 -2.310 9.925 -12.196 1.00 3.59 H new ATOM 0 HB2 GLU A 7 -2.847 6.937 -12.342 1.00 3.93 H new ATOM 0 HB3 GLU A 7 -4.133 8.111 -12.542 1.00 3.93 H new ATOM 0 HG2 GLU A 7 -2.914 9.117 -14.460 1.00 4.45 H new ATOM 0 HG3 GLU A 7 -1.634 7.937 -14.263 1.00 4.45 H new ATOM 105 N GLN A 8 -2.485 8.422 -9.347 1.00 3.16 N ATOM 106 CA GLN A 8 -3.084 8.504 -8.011 1.00 2.96 C ATOM 107 C GLN A 8 -3.097 9.948 -7.544 1.00 2.69 C ATOM 108 O GLN A 8 -4.009 10.378 -6.840 1.00 2.63 O ATOM 109 CB GLN A 8 -2.349 7.591 -7.019 1.00 2.87 C ATOM 110 CG GLN A 8 -3.202 7.130 -5.844 1.00 3.23 C ATOM 111 CD GLN A 8 -2.505 6.088 -4.992 1.00 3.13 C ATOM 112 OE1 GLN A 8 -2.649 4.886 -5.218 1.00 3.27 O ATOM 113 NE2 GLN A 8 -1.738 6.543 -4.009 1.00 3.29 N ATOM 0 H GLN A 8 -1.635 7.861 -9.395 1.00 3.16 H new ATOM 0 HA GLN A 8 -4.114 8.151 -8.061 1.00 2.96 H new ATOM 0 HB2 GLN A 8 -1.982 6.714 -7.553 1.00 2.87 H new ATOM 0 HB3 GLN A 8 -1.476 8.119 -6.635 1.00 2.87 H new ATOM 0 HG2 GLN A 8 -3.456 7.990 -5.224 1.00 3.23 H new ATOM 0 HG3 GLN A 8 -4.139 6.720 -6.219 1.00 3.23 H new ATOM 0 HE21 GLN A 8 -1.647 7.547 -3.857 1.00 3.29 H new ATOM 0 HE22 GLN A 8 -1.240 5.888 -3.406 1.00 3.29 H new ATOM 122 N ILE A 9 -2.060 10.673 -7.947 1.00 2.59 N ATOM 123 CA ILE A 9 -1.946 12.097 -7.707 1.00 2.41 C ATOM 124 C ILE A 9 -3.113 12.788 -8.407 1.00 2.64 C ATOM 125 O ILE A 9 -3.776 13.645 -7.822 1.00 2.55 O ATOM 126 CB ILE A 9 -0.580 12.597 -8.227 1.00 2.42 C ATOM 127 CG1 ILE A 9 0.508 12.127 -7.265 1.00 2.20 C ATOM 128 CG2 ILE A 9 -0.556 14.105 -8.440 1.00 2.45 C ATOM 129 CD1 ILE A 9 1.107 10.800 -7.664 1.00 2.35 C ATOM 0 H ILE A 9 -1.268 10.279 -8.455 1.00 2.59 H new ATOM 0 HA ILE A 9 -1.991 12.326 -6.642 1.00 2.41 H new ATOM 0 HB ILE A 9 -0.394 12.170 -9.212 1.00 2.42 H new ATOM 0 HG12 ILE A 9 1.297 12.878 -7.221 1.00 2.20 H new ATOM 0 HG13 ILE A 9 0.089 12.045 -6.262 1.00 2.20 H new ATOM 0 HG21 ILE A 9 0.426 14.405 -8.806 1.00 2.45 H new ATOM 0 HG22 ILE A 9 -1.316 14.381 -9.171 1.00 2.45 H new ATOM 0 HG23 ILE A 9 -0.761 14.609 -7.496 1.00 2.45 H new ATOM 0 HD11 ILE A 9 1.875 10.516 -6.944 1.00 2.35 H new ATOM 0 HD12 ILE A 9 0.327 10.039 -7.682 1.00 2.35 H new ATOM 0 HD13 ILE A 9 1.553 10.885 -8.655 1.00 2.35 H new ATOM 141 N ALA A 10 -3.344 12.391 -9.677 1.00 2.97 N ATOM 142 CA ALA A 10 -4.487 12.881 -10.459 1.00 3.26 C ATOM 143 C ALA A 10 -5.792 12.609 -9.719 1.00 3.27 C ATOM 144 O ALA A 10 -6.767 13.351 -9.871 1.00 3.43 O ATOM 145 CB ALA A 10 -4.505 12.262 -11.849 1.00 3.61 C ATOM 0 H ALA A 10 -2.750 11.731 -10.178 1.00 2.97 H new ATOM 0 HA ALA A 10 -4.382 13.959 -10.581 1.00 3.26 H new ATOM 0 HB1 ALA A 10 -5.361 12.642 -12.406 1.00 3.61 H new ATOM 0 HB2 ALA A 10 -3.586 12.522 -12.375 1.00 3.61 H new ATOM 0 HB3 ALA A 10 -4.580 11.178 -11.764 1.00 3.61 H new ATOM 151 N GLU A 11 -5.793 11.532 -8.917 1.00 3.14 N ATOM 152 CA GLU A 11 -6.937 11.191 -8.076 1.00 3.18 C ATOM 153 C GLU A 11 -6.919 12.034 -6.824 1.00 2.87 C ATOM 154 O GLU A 11 -7.967 12.370 -6.264 1.00 2.94 O ATOM 155 CB GLU A 11 -6.885 9.729 -7.666 1.00 3.24 C ATOM 156 CG GLU A 11 -7.950 8.870 -8.318 1.00 3.63 C ATOM 157 CD GLU A 11 -7.904 7.428 -7.852 1.00 3.78 C ATOM 158 OE1 GLU A 11 -8.579 7.104 -6.853 1.00 4.13 O ATOM 159 OE2 GLU A 11 -7.192 6.621 -8.488 1.00 3.90 O ATOM 0 H GLU A 11 -5.009 10.885 -8.838 1.00 3.14 H new ATOM 0 HA GLU A 11 -7.845 11.377 -8.649 1.00 3.18 H new ATOM 0 HB2 GLU A 11 -5.904 9.326 -7.917 1.00 3.24 H new ATOM 0 HB3 GLU A 11 -6.990 9.661 -6.583 1.00 3.24 H new ATOM 0 HG2 GLU A 11 -8.933 9.287 -8.098 1.00 3.63 H new ATOM 0 HG3 GLU A 11 -7.825 8.902 -9.400 1.00 3.63 H new ATOM 166 N PHE A 12 -5.703 12.368 -6.401 1.00 2.56 N ATOM 167 CA PHE A 12 -5.493 13.175 -5.213 1.00 2.24 C ATOM 168 C PHE A 12 -5.921 14.631 -5.422 1.00 2.30 C ATOM 169 O PHE A 12 -6.467 15.247 -4.502 1.00 2.22 O ATOM 170 CB PHE A 12 -4.032 13.097 -4.755 1.00 1.94 C ATOM 171 CG PHE A 12 -3.620 11.755 -4.170 1.00 1.85 C ATOM 172 CD1 PHE A 12 -4.547 10.736 -3.951 1.00 2.28 C ATOM 173 CD2 PHE A 12 -2.297 11.519 -3.815 1.00 2.07 C ATOM 174 CE1 PHE A 12 -4.162 9.542 -3.403 1.00 2.34 C ATOM 175 CE2 PHE A 12 -1.917 10.308 -3.265 1.00 2.03 C ATOM 176 CZ PHE A 12 -2.867 9.320 -3.062 1.00 1.90 C ATOM 0 H PHE A 12 -4.843 12.087 -6.872 1.00 2.56 H new ATOM 0 HA PHE A 12 -6.126 12.764 -4.427 1.00 2.24 H new ATOM 0 HB2 PHE A 12 -3.387 13.321 -5.604 1.00 1.94 H new ATOM 0 HB3 PHE A 12 -3.858 13.872 -4.009 1.00 1.94 H new ATOM 0 HD1 PHE A 12 -5.582 10.891 -4.217 1.00 2.28 H new ATOM 0 HD2 PHE A 12 -1.557 12.290 -3.970 1.00 2.07 H new ATOM 0 HE1 PHE A 12 -4.897 8.768 -3.240 1.00 2.34 H new ATOM 0 HE2 PHE A 12 -0.886 10.134 -2.995 1.00 2.03 H new ATOM 0 HZ PHE A 12 -2.577 8.373 -2.632 1.00 1.90 H new ATOM 186 N LYS A 13 -5.677 15.187 -6.627 1.00 2.51 N ATOM 187 CA LYS A 13 -6.073 16.577 -6.917 1.00 2.67 C ATOM 188 C LYS A 13 -7.568 16.685 -7.200 1.00 2.96 C ATOM 189 O LYS A 13 -8.135 17.773 -7.106 1.00 3.07 O ATOM 190 CB LYS A 13 -5.266 17.220 -8.062 1.00 2.86 C ATOM 191 CG LYS A 13 -4.869 16.280 -9.203 1.00 3.04 C ATOM 192 CD LYS A 13 -3.346 16.160 -9.332 1.00 2.93 C ATOM 193 CE LYS A 13 -2.723 17.334 -10.089 1.00 3.15 C ATOM 194 NZ LYS A 13 -3.004 17.272 -11.551 1.00 3.58 N ATOM 0 H LYS A 13 -5.217 14.705 -7.399 1.00 2.51 H new ATOM 0 HA LYS A 13 -5.841 17.139 -6.013 1.00 2.67 H new ATOM 0 HB2 LYS A 13 -5.851 18.040 -8.478 1.00 2.86 H new ATOM 0 HB3 LYS A 13 -4.359 17.656 -7.643 1.00 2.86 H new ATOM 0 HG2 LYS A 13 -5.299 15.294 -9.029 1.00 3.04 H new ATOM 0 HG3 LYS A 13 -5.286 16.648 -10.140 1.00 3.04 H new ATOM 0 HD2 LYS A 13 -2.905 16.100 -8.337 1.00 2.93 H new ATOM 0 HD3 LYS A 13 -3.101 15.231 -9.846 1.00 2.93 H new ATOM 0 HE2 LYS A 13 -3.109 18.270 -9.686 1.00 3.15 H new ATOM 0 HE3 LYS A 13 -1.645 17.338 -9.927 1.00 3.15 H new ATOM 0 HZ1 LYS A 13 -2.454 18.006 -12.042 1.00 3.58 H new ATOM 0 HZ2 LYS A 13 -2.736 16.336 -11.917 1.00 3.58 H new ATOM 0 HZ3 LYS A 13 -4.018 17.431 -11.717 1.00 3.58 H new ATOM 208 N GLU A 14 -8.209 15.557 -7.550 1.00 3.12 N ATOM 209 CA GLU A 14 -9.654 15.546 -7.808 1.00 3.43 C ATOM 210 C GLU A 14 -10.451 15.904 -6.541 1.00 3.34 C ATOM 211 O GLU A 14 -11.444 16.634 -6.615 1.00 3.56 O ATOM 212 CB GLU A 14 -10.098 14.176 -8.331 1.00 3.67 C ATOM 213 CG GLU A 14 -9.765 13.941 -9.796 1.00 4.07 C ATOM 214 CD GLU A 14 -10.238 12.588 -10.291 1.00 4.36 C ATOM 215 OE1 GLU A 14 -9.451 11.621 -10.218 1.00 4.71 O ATOM 216 OE2 GLU A 14 -11.395 12.496 -10.752 1.00 4.52 O ATOM 0 H GLU A 14 -7.753 14.651 -7.659 1.00 3.12 H new ATOM 0 HA GLU A 14 -9.858 16.301 -8.567 1.00 3.43 H new ATOM 0 HB2 GLU A 14 -9.626 13.398 -7.731 1.00 3.67 H new ATOM 0 HB3 GLU A 14 -11.174 14.076 -8.192 1.00 3.67 H new ATOM 0 HG2 GLU A 14 -10.223 14.725 -10.399 1.00 4.07 H new ATOM 0 HG3 GLU A 14 -8.687 14.019 -9.937 1.00 4.07 H new ATOM 223 N ALA A 15 -10.002 15.382 -5.385 1.00 3.04 N ATOM 224 CA ALA A 15 -10.671 15.629 -4.100 1.00 2.97 C ATOM 225 C ALA A 15 -10.178 16.875 -3.375 1.00 2.76 C ATOM 226 O ALA A 15 -10.981 17.754 -3.060 1.00 2.91 O ATOM 227 CB ALA A 15 -10.544 14.413 -3.184 1.00 2.84 C ATOM 0 H ALA A 15 -9.177 14.786 -5.317 1.00 3.04 H new ATOM 0 HA ALA A 15 -11.718 15.807 -4.344 1.00 2.97 H new ATOM 0 HB1 ALA A 15 -11.046 14.616 -2.238 1.00 2.84 H new ATOM 0 HB2 ALA A 15 -11.005 13.548 -3.661 1.00 2.84 H new ATOM 0 HB3 ALA A 15 -9.490 14.206 -2.999 1.00 2.84 H new ATOM 233 N PHE A 16 -8.865 16.937 -3.083 1.00 2.45 N ATOM 234 CA PHE A 16 -8.265 18.080 -2.368 1.00 2.28 C ATOM 235 C PHE A 16 -8.724 19.408 -2.959 1.00 2.56 C ATOM 236 O PHE A 16 -9.047 20.346 -2.233 1.00 2.60 O ATOM 237 CB PHE A 16 -6.732 18.004 -2.438 1.00 2.02 C ATOM 238 CG PHE A 16 -5.981 18.927 -1.490 1.00 1.86 C ATOM 239 CD1 PHE A 16 -5.184 18.392 -0.487 1.00 2.18 C ATOM 240 CD2 PHE A 16 -6.050 20.316 -1.616 1.00 2.17 C ATOM 241 CE1 PHE A 16 -4.478 19.200 0.371 1.00 2.21 C ATOM 242 CE2 PHE A 16 -5.340 21.133 -0.746 1.00 2.07 C ATOM 243 CZ PHE A 16 -4.553 20.567 0.249 1.00 1.79 C ATOM 0 H PHE A 16 -8.198 16.207 -3.332 1.00 2.45 H new ATOM 0 HA PHE A 16 -8.593 18.027 -1.330 1.00 2.28 H new ATOM 0 HB2 PHE A 16 -6.428 16.978 -2.233 1.00 2.02 H new ATOM 0 HB3 PHE A 16 -6.422 18.231 -3.458 1.00 2.02 H new ATOM 0 HD1 PHE A 16 -5.118 17.319 -0.379 1.00 2.18 H new ATOM 0 HD2 PHE A 16 -6.658 20.756 -2.393 1.00 2.17 H new ATOM 0 HE1 PHE A 16 -3.863 18.760 1.142 1.00 2.21 H new ATOM 0 HE2 PHE A 16 -5.400 22.207 -0.843 1.00 2.07 H new ATOM 0 HZ PHE A 16 -4.000 21.201 0.927 1.00 1.79 H new ATOM 253 N SER A 17 -8.764 19.458 -4.283 1.00 2.80 N ATOM 254 CA SER A 17 -9.145 20.653 -4.992 1.00 3.11 C ATOM 255 C SER A 17 -10.634 20.958 -4.907 1.00 3.36 C ATOM 256 O SER A 17 -11.043 22.095 -5.159 1.00 3.59 O ATOM 257 CB SER A 17 -8.712 20.570 -6.449 1.00 3.33 C ATOM 258 OG SER A 17 -7.300 20.613 -6.568 1.00 3.30 O ATOM 0 H SER A 17 -8.532 18.669 -4.887 1.00 2.80 H new ATOM 0 HA SER A 17 -8.628 21.476 -4.499 1.00 3.11 H new ATOM 0 HB2 SER A 17 -9.089 19.648 -6.891 1.00 3.33 H new ATOM 0 HB3 SER A 17 -9.152 21.395 -7.009 1.00 3.33 H new ATOM 0 HG SER A 17 -6.962 19.717 -6.774 1.00 3.30 H new ATOM 264 N LEU A 18 -11.456 19.952 -4.569 1.00 3.35 N ATOM 265 CA LEU A 18 -12.888 20.170 -4.458 1.00 3.63 C ATOM 266 C LEU A 18 -13.193 21.012 -3.224 1.00 3.56 C ATOM 267 O LEU A 18 -14.266 21.607 -3.085 1.00 3.81 O ATOM 268 CB LEU A 18 -13.638 18.833 -4.471 1.00 3.72 C ATOM 269 CG LEU A 18 -13.912 18.218 -3.108 1.00 3.54 C ATOM 270 CD1 LEU A 18 -15.267 18.661 -2.567 1.00 3.79 C ATOM 271 CD2 LEU A 18 -13.830 16.700 -3.144 1.00 3.53 C ATOM 0 H LEU A 18 -11.151 18.999 -4.373 1.00 3.35 H new ATOM 0 HA LEU A 18 -13.242 20.731 -5.323 1.00 3.63 H new ATOM 0 HB2 LEU A 18 -14.590 18.976 -4.983 1.00 3.72 H new ATOM 0 HB3 LEU A 18 -13.063 18.120 -5.062 1.00 3.72 H new ATOM 0 HG LEU A 18 -13.134 18.579 -2.436 1.00 3.54 H new ATOM 0 HD11 LEU A 18 -15.436 18.206 -1.591 1.00 3.79 H new ATOM 0 HD12 LEU A 18 -15.282 19.746 -2.468 1.00 3.79 H new ATOM 0 HD13 LEU A 18 -16.053 18.348 -3.254 1.00 3.79 H new ATOM 0 HD21 LEU A 18 -14.032 16.301 -2.150 1.00 3.53 H new ATOM 0 HD22 LEU A 18 -14.567 16.312 -3.847 1.00 3.53 H new ATOM 0 HD23 LEU A 18 -12.832 16.397 -3.460 1.00 3.53 H new ATOM 283 N PHE A 19 -12.205 21.025 -2.354 1.00 3.24 N ATOM 284 CA PHE A 19 -12.236 21.784 -1.111 1.00 3.16 C ATOM 285 C PHE A 19 -11.170 22.879 -1.171 1.00 3.11 C ATOM 286 O PHE A 19 -10.946 23.601 -0.194 1.00 3.07 O ATOM 287 CB PHE A 19 -11.938 20.875 0.088 1.00 2.89 C ATOM 288 CG PHE A 19 -12.808 19.648 0.225 1.00 3.01 C ATOM 289 CD1 PHE A 19 -12.285 18.393 -0.046 1.00 3.31 C ATOM 290 CD2 PHE A 19 -14.129 19.743 0.643 1.00 3.27 C ATOM 291 CE1 PHE A 19 -13.058 17.259 0.095 1.00 3.50 C ATOM 292 CE2 PHE A 19 -14.909 18.609 0.781 1.00 3.41 C ATOM 293 CZ PHE A 19 -14.370 17.364 0.508 1.00 3.37 C ATOM 0 H PHE A 19 -11.340 20.501 -2.489 1.00 3.24 H new ATOM 0 HA PHE A 19 -13.229 22.217 -0.990 1.00 3.16 H new ATOM 0 HB2 PHE A 19 -10.899 20.553 0.024 1.00 2.89 H new ATOM 0 HB3 PHE A 19 -12.033 21.466 0.999 1.00 2.89 H new ATOM 0 HD1 PHE A 19 -11.259 18.302 -0.372 1.00 3.31 H new ATOM 0 HD2 PHE A 19 -14.552 20.712 0.863 1.00 3.27 H new ATOM 0 HE1 PHE A 19 -12.636 16.288 -0.118 1.00 3.50 H new ATOM 0 HE2 PHE A 19 -15.937 18.695 1.101 1.00 3.41 H new ATOM 0 HZ PHE A 19 -14.975 16.476 0.618 1.00 3.37 H new ATOM 303 N ALA A 20 -10.522 22.994 -2.347 1.00 3.18 N ATOM 304 CA ALA A 20 -9.422 23.968 -2.573 1.00 3.22 C ATOM 305 C ALA A 20 -9.747 25.406 -2.140 1.00 3.51 C ATOM 306 O ALA A 20 -10.825 25.931 -2.434 1.00 3.80 O ATOM 307 CB ALA A 20 -8.996 23.964 -4.033 1.00 3.38 C ATOM 0 H ALA A 20 -10.739 22.423 -3.164 1.00 3.18 H new ATOM 0 HA ALA A 20 -8.606 23.630 -1.934 1.00 3.22 H new ATOM 0 HB1 ALA A 20 -8.190 24.683 -4.179 1.00 3.38 H new ATOM 0 HB2 ALA A 20 -8.648 22.968 -4.308 1.00 3.38 H new ATOM 0 HB3 ALA A 20 -9.844 24.238 -4.660 1.00 3.38 H new ATOM 354 N ASP A 24 -2.957 29.671 -0.321 1.00 3.98 N ATOM 355 CA ASP A 24 -1.861 28.793 -0.778 1.00 3.89 C ATOM 356 C ASP A 24 -2.401 27.564 -1.523 1.00 3.62 C ATOM 357 O ASP A 24 -1.651 26.856 -2.203 1.00 3.56 O ATOM 358 CB ASP A 24 -1.006 28.343 0.411 1.00 3.77 C ATOM 359 CG ASP A 24 -0.188 29.475 1.005 1.00 4.13 C ATOM 360 OD1 ASP A 24 -0.695 30.155 1.922 1.00 4.50 O ATOM 361 OD2 ASP A 24 0.958 29.680 0.554 1.00 4.32 O ATOM 0 HA ASP A 24 -1.244 29.368 -1.469 1.00 3.89 H new ATOM 0 HB2 ASP A 24 -1.654 27.925 1.182 1.00 3.77 H new ATOM 0 HB3 ASP A 24 -0.336 27.545 0.090 1.00 3.77 H new ATOM 366 N GLY A 25 -3.711 27.334 -1.375 1.00 3.50 N ATOM 367 CA GLY A 25 -4.389 26.222 -2.028 1.00 3.30 C ATOM 368 C GLY A 25 -4.391 25.025 -1.127 1.00 2.90 C ATOM 369 O GLY A 25 -3.915 23.943 -1.487 1.00 2.69 O ATOM 0 H GLY A 25 -4.323 27.914 -0.801 1.00 3.50 H new ATOM 0 HA2 GLY A 25 -5.413 26.504 -2.275 1.00 3.30 H new ATOM 0 HA3 GLY A 25 -3.889 25.981 -2.966 1.00 3.30 H new ATOM 373 N THR A 26 -4.945 25.253 0.060 1.00 2.85 N ATOM 374 CA THR A 26 -4.999 24.252 1.101 1.00 2.53 C ATOM 375 C THR A 26 -6.417 23.758 1.378 1.00 2.45 C ATOM 376 O THR A 26 -7.380 24.243 0.777 1.00 2.66 O ATOM 377 CB THR A 26 -4.406 24.800 2.406 1.00 2.59 C ATOM 378 OG1 THR A 26 -5.168 25.908 2.903 1.00 2.84 O ATOM 379 CG2 THR A 26 -2.981 25.208 2.187 1.00 2.74 C ATOM 0 H THR A 26 -5.369 26.144 0.320 1.00 2.85 H new ATOM 0 HA THR A 26 -4.412 23.408 0.739 1.00 2.53 H new ATOM 0 HB THR A 26 -4.444 24.008 3.154 1.00 2.59 H new ATOM 0 HG1 THR A 26 -4.566 26.554 3.328 1.00 2.84 H new ATOM 0 HG21 THR A 26 -2.567 25.596 3.117 1.00 2.74 H new ATOM 0 HG22 THR A 26 -2.401 24.344 1.864 1.00 2.74 H new ATOM 0 HG23 THR A 26 -2.938 25.981 1.420 1.00 2.74 H new ATOM 387 N ILE A 27 -6.527 22.792 2.309 1.00 2.21 N ATOM 388 CA ILE A 27 -7.825 22.213 2.704 1.00 2.22 C ATOM 389 C ILE A 27 -7.754 21.809 4.174 1.00 2.15 C ATOM 390 O ILE A 27 -6.760 22.090 4.844 1.00 2.13 O ATOM 391 CB ILE A 27 -8.301 21.009 1.811 1.00 2.13 C ATOM 392 CG1 ILE A 27 -7.341 19.822 1.913 1.00 1.82 C ATOM 393 CG2 ILE A 27 -8.493 21.460 0.368 1.00 2.31 C ATOM 394 CD1 ILE A 27 -7.960 18.496 1.517 1.00 1.79 C ATOM 0 H ILE A 27 -5.729 22.394 2.804 1.00 2.21 H new ATOM 0 HA ILE A 27 -8.579 22.984 2.550 1.00 2.22 H new ATOM 0 HB ILE A 27 -9.266 20.666 2.186 1.00 2.13 H new ATOM 0 HG12 ILE A 27 -6.475 20.012 1.278 1.00 1.82 H new ATOM 0 HG13 ILE A 27 -6.976 19.750 2.937 1.00 1.82 H new ATOM 0 HG21 ILE A 27 -8.822 20.615 -0.237 1.00 2.31 H new ATOM 0 HG22 ILE A 27 -9.245 22.248 0.330 1.00 2.31 H new ATOM 0 HG23 ILE A 27 -7.549 21.840 -0.023 1.00 2.31 H new ATOM 0 HD11 ILE A 27 -7.218 17.704 1.616 1.00 1.79 H new ATOM 0 HD12 ILE A 27 -8.808 18.282 2.167 1.00 1.79 H new ATOM 0 HD13 ILE A 27 -8.300 18.548 0.483 1.00 1.79 H new ATOM 406 N THR A 28 -8.800 21.169 4.674 1.00 2.23 N ATOM 407 CA THR A 28 -8.833 20.746 6.073 1.00 2.29 C ATOM 408 C THR A 28 -8.820 19.225 6.157 1.00 2.17 C ATOM 409 O THR A 28 -9.416 18.531 5.328 1.00 2.04 O ATOM 410 CB THR A 28 -10.051 21.318 6.852 1.00 2.57 C ATOM 411 OG1 THR A 28 -11.266 20.681 6.430 1.00 2.86 O ATOM 412 CG2 THR A 28 -10.190 22.827 6.662 1.00 3.10 C ATOM 0 H THR A 28 -9.635 20.930 4.139 1.00 2.23 H new ATOM 0 HA THR A 28 -7.940 21.151 6.549 1.00 2.29 H new ATOM 0 HB THR A 28 -9.874 21.115 7.908 1.00 2.57 H new ATOM 0 HG1 THR A 28 -11.752 21.275 5.821 1.00 2.86 H new ATOM 0 HG21 THR A 28 -11.053 23.186 7.223 1.00 3.10 H new ATOM 0 HG22 THR A 28 -9.290 23.324 7.024 1.00 3.10 H new ATOM 0 HG23 THR A 28 -10.327 23.049 5.604 1.00 3.10 H new ATOM 420 N THR A 29 -8.116 18.744 7.177 1.00 2.30 N ATOM 421 CA THR A 29 -7.888 17.316 7.452 1.00 2.30 C ATOM 422 C THR A 29 -9.095 16.393 7.290 1.00 2.50 C ATOM 423 O THR A 29 -8.979 15.341 6.653 1.00 2.44 O ATOM 424 CB THR A 29 -7.317 17.147 8.847 1.00 2.48 C ATOM 425 OG1 THR A 29 -8.073 17.905 9.803 1.00 2.75 O ATOM 426 CG2 THR A 29 -5.874 17.599 8.828 1.00 2.32 C ATOM 0 H THR A 29 -7.670 19.353 7.863 1.00 2.30 H new ATOM 0 HA THR A 29 -7.187 17.002 6.679 1.00 2.30 H new ATOM 0 HB THR A 29 -7.374 16.100 9.144 1.00 2.48 H new ATOM 0 HG1 THR A 29 -7.689 17.781 10.696 1.00 2.75 H new ATOM 0 HG21 THR A 29 -5.444 17.485 9.823 1.00 2.32 H new ATOM 0 HG22 THR A 29 -5.312 16.992 8.118 1.00 2.32 H new ATOM 0 HG23 THR A 29 -5.825 18.646 8.529 1.00 2.32 H new ATOM 434 N LYS A 30 -10.238 16.776 7.870 1.00 2.77 N ATOM 435 CA LYS A 30 -11.473 15.970 7.787 1.00 3.04 C ATOM 436 C LYS A 30 -11.855 15.662 6.331 1.00 2.98 C ATOM 437 O LYS A 30 -12.318 14.560 6.023 1.00 3.14 O ATOM 438 CB LYS A 30 -12.634 16.690 8.490 1.00 3.33 C ATOM 439 CG LYS A 30 -12.533 16.712 10.014 1.00 3.42 C ATOM 440 CD LYS A 30 -11.715 17.896 10.514 1.00 3.38 C ATOM 441 CE LYS A 30 -11.643 17.923 12.032 1.00 3.68 C ATOM 442 NZ LYS A 30 -10.843 19.075 12.530 1.00 3.70 N ATOM 0 H LYS A 30 -10.339 17.639 8.404 1.00 2.77 H new ATOM 0 HA LYS A 30 -11.277 15.024 8.291 1.00 3.04 H new ATOM 0 HB2 LYS A 30 -12.682 17.716 8.126 1.00 3.33 H new ATOM 0 HB3 LYS A 30 -13.569 16.207 8.207 1.00 3.33 H new ATOM 0 HG2 LYS A 30 -13.534 16.756 10.443 1.00 3.42 H new ATOM 0 HG3 LYS A 30 -12.078 15.784 10.361 1.00 3.42 H new ATOM 0 HD2 LYS A 30 -10.707 17.843 10.102 1.00 3.38 H new ATOM 0 HD3 LYS A 30 -12.159 18.824 10.153 1.00 3.38 H new ATOM 0 HE2 LYS A 30 -12.651 17.977 12.442 1.00 3.68 H new ATOM 0 HE3 LYS A 30 -11.202 16.993 12.391 1.00 3.68 H new ATOM 0 HZ1 LYS A 30 -10.818 19.057 13.570 1.00 3.70 H new ATOM 0 HZ2 LYS A 30 -9.873 19.010 12.160 1.00 3.70 H new ATOM 0 HZ3 LYS A 30 -11.277 19.964 12.209 1.00 3.70 H new ATOM 456 N GLU A 31 -11.653 16.652 5.453 1.00 2.81 N ATOM 457 CA GLU A 31 -11.957 16.519 4.024 1.00 2.81 C ATOM 458 C GLU A 31 -10.774 15.976 3.210 1.00 2.52 C ATOM 459 O GLU A 31 -10.970 15.577 2.057 1.00 2.57 O ATOM 460 CB GLU A 31 -12.414 17.866 3.447 1.00 2.89 C ATOM 461 CG GLU A 31 -13.787 18.321 3.934 1.00 3.24 C ATOM 462 CD GLU A 31 -13.726 19.101 5.234 1.00 3.22 C ATOM 463 OE1 GLU A 31 -13.609 20.343 5.174 1.00 3.26 O ATOM 464 OE2 GLU A 31 -13.801 18.471 6.308 1.00 3.60 O ATOM 0 H GLU A 31 -11.276 17.564 5.712 1.00 2.81 H new ATOM 0 HA GLU A 31 -12.764 15.790 3.943 1.00 2.81 H new ATOM 0 HB2 GLU A 31 -11.678 18.628 3.705 1.00 2.89 H new ATOM 0 HB3 GLU A 31 -12.431 17.796 2.359 1.00 2.89 H new ATOM 0 HG2 GLU A 31 -14.252 18.940 3.167 1.00 3.24 H new ATOM 0 HG3 GLU A 31 -14.426 17.448 4.070 1.00 3.24 H new ATOM 471 N LEU A 32 -9.548 15.949 3.786 1.00 2.26 N ATOM 472 CA LEU A 32 -8.384 15.439 3.038 1.00 1.98 C ATOM 473 C LEU A 32 -8.414 13.934 2.913 1.00 2.07 C ATOM 474 O LEU A 32 -7.956 13.374 1.920 1.00 1.98 O ATOM 475 CB LEU A 32 -7.038 15.935 3.585 1.00 1.69 C ATOM 476 CG LEU A 32 -6.480 15.435 4.939 1.00 1.74 C ATOM 477 CD1 LEU A 32 -6.019 13.988 4.942 1.00 1.76 C ATOM 478 CD2 LEU A 32 -5.276 16.260 5.233 1.00 1.59 C ATOM 0 H LEU A 32 -9.347 16.264 4.735 1.00 2.26 H new ATOM 0 HA LEU A 32 -8.471 15.859 2.036 1.00 1.98 H new ATOM 0 HB2 LEU A 32 -6.286 15.707 2.829 1.00 1.69 H new ATOM 0 HB3 LEU A 32 -7.104 17.021 3.652 1.00 1.69 H new ATOM 0 HG LEU A 32 -7.288 15.516 5.666 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -5.644 13.728 5.932 1.00 1.76 H new ATOM 0 HD12 LEU A 32 -6.857 13.339 4.689 1.00 1.76 H new ATOM 0 HD13 LEU A 32 -5.224 13.858 4.208 1.00 1.76 H new ATOM 0 HD21 LEU A 32 -4.843 15.946 6.182 1.00 1.59 H new ATOM 0 HD22 LEU A 32 -4.542 16.129 4.438 1.00 1.59 H new ATOM 0 HD23 LEU A 32 -5.561 17.310 5.294 1.00 1.59 H new ATOM 490 N GLY A 33 -8.921 13.286 3.951 1.00 2.31 N ATOM 491 CA GLY A 33 -9.081 11.842 3.919 1.00 2.52 C ATOM 492 C GLY A 33 -10.077 11.437 2.871 1.00 2.75 C ATOM 493 O GLY A 33 -10.127 10.282 2.466 1.00 2.91 O ATOM 0 H GLY A 33 -9.225 13.732 4.816 1.00 2.31 H new ATOM 0 HA2 GLY A 33 -8.120 11.370 3.715 1.00 2.52 H new ATOM 0 HA3 GLY A 33 -9.410 11.487 4.896 1.00 2.52 H new ATOM 497 N THR A 34 -10.897 12.416 2.462 1.00 2.81 N ATOM 498 CA THR A 34 -11.872 12.230 1.403 1.00 3.07 C ATOM 499 C THR A 34 -11.134 12.080 0.087 1.00 2.93 C ATOM 500 O THR A 34 -11.666 11.608 -0.921 1.00 3.16 O ATOM 501 CB THR A 34 -12.947 13.353 1.367 1.00 3.23 C ATOM 502 OG1 THR A 34 -13.406 13.624 2.697 1.00 3.30 O ATOM 503 CG2 THR A 34 -14.146 12.966 0.502 1.00 3.60 C ATOM 0 H THR A 34 -10.895 13.354 2.862 1.00 2.81 H new ATOM 0 HA THR A 34 -12.438 11.319 1.599 1.00 3.07 H new ATOM 0 HB THR A 34 -12.481 14.238 0.933 1.00 3.23 H new ATOM 0 HG1 THR A 34 -14.082 14.333 2.672 1.00 3.30 H new ATOM 0 HG21 THR A 34 -14.873 13.778 0.504 1.00 3.60 H new ATOM 0 HG22 THR A 34 -13.813 12.780 -0.519 1.00 3.60 H new ATOM 0 HG23 THR A 34 -14.608 12.064 0.903 1.00 3.60 H new ATOM 511 N VAL A 35 -9.892 12.511 0.164 1.00 2.56 N ATOM 512 CA VAL A 35 -8.927 12.376 -0.919 1.00 2.39 C ATOM 513 C VAL A 35 -8.305 10.997 -0.754 1.00 2.44 C ATOM 514 O VAL A 35 -7.983 10.335 -1.744 1.00 2.53 O ATOM 515 CB VAL A 35 -7.738 13.399 -0.923 1.00 2.01 C ATOM 516 CG1 VAL A 35 -6.964 13.293 -2.229 1.00 1.92 C ATOM 517 CG2 VAL A 35 -8.153 14.847 -0.708 1.00 2.02 C ATOM 0 H VAL A 35 -9.514 12.973 0.991 1.00 2.56 H new ATOM 0 HA VAL A 35 -9.476 12.552 -1.844 1.00 2.39 H new ATOM 0 HB VAL A 35 -7.115 13.125 -0.071 1.00 2.01 H new ATOM 0 HG11 VAL A 35 -6.140 14.007 -2.223 1.00 1.92 H new ATOM 0 HG12 VAL A 35 -6.568 12.283 -2.336 1.00 1.92 H new ATOM 0 HG13 VAL A 35 -7.628 13.513 -3.065 1.00 1.92 H new ATOM 0 HG21 VAL A 35 -7.269 15.485 -0.725 1.00 2.02 H new ATOM 0 HG22 VAL A 35 -8.836 15.151 -1.501 1.00 2.02 H new ATOM 0 HG23 VAL A 35 -8.651 14.943 0.257 1.00 2.02 H new ATOM 527 N MET A 36 -8.143 10.570 0.523 1.00 2.44 N ATOM 528 CA MET A 36 -7.546 9.278 0.807 1.00 2.55 C ATOM 529 C MET A 36 -8.567 8.144 0.687 1.00 2.97 C ATOM 530 O MET A 36 -8.203 7.002 0.391 1.00 3.11 O ATOM 531 CB MET A 36 -6.942 9.263 2.199 1.00 2.49 C ATOM 532 CG MET A 36 -5.722 8.353 2.336 1.00 2.24 C ATOM 533 SD MET A 36 -4.953 8.431 3.968 1.00 2.48 S ATOM 534 CE MET A 36 -4.037 9.969 3.860 1.00 1.96 C ATOM 0 H MET A 36 -8.418 11.104 1.347 1.00 2.44 H new ATOM 0 HA MET A 36 -6.763 9.117 0.066 1.00 2.55 H new ATOM 0 HB2 MET A 36 -6.657 10.279 2.472 1.00 2.49 H new ATOM 0 HB3 MET A 36 -7.703 8.943 2.911 1.00 2.49 H new ATOM 0 HG2 MET A 36 -6.019 7.325 2.131 1.00 2.24 H new ATOM 0 HG3 MET A 36 -4.985 8.628 1.581 1.00 2.24 H new ATOM 0 HE1 MET A 36 -3.980 10.429 4.847 1.00 1.96 H new ATOM 0 HE2 MET A 36 -3.030 9.768 3.495 1.00 1.96 H new ATOM 0 HE3 MET A 36 -4.543 10.647 3.173 1.00 1.96 H new ATOM 544 N ARG A 37 -9.843 8.463 0.945 1.00 3.18 N ATOM 545 CA ARG A 37 -10.912 7.498 0.881 1.00 3.60 C ATOM 546 C ARG A 37 -11.324 7.212 -0.585 1.00 3.77 C ATOM 547 O ARG A 37 -11.963 6.196 -0.877 1.00 4.10 O ATOM 548 CB ARG A 37 -12.078 8.028 1.749 1.00 3.78 C ATOM 549 CG ARG A 37 -13.474 7.858 1.173 1.00 4.18 C ATOM 550 CD ARG A 37 -14.002 6.446 1.387 1.00 4.52 C ATOM 551 NE ARG A 37 -15.223 6.189 0.616 1.00 4.90 N ATOM 552 CZ ARG A 37 -15.927 5.048 0.657 1.00 5.36 C ATOM 553 NH1 ARG A 37 -15.548 4.033 1.433 1.00 5.45 N ATOM 554 NH2 ARG A 37 -17.019 4.925 -0.085 1.00 5.91 N ATOM 0 H ARG A 37 -10.147 9.402 1.203 1.00 3.18 H new ATOM 0 HA ARG A 37 -10.589 6.536 1.277 1.00 3.60 H new ATOM 0 HB2 ARG A 37 -12.042 7.525 2.715 1.00 3.78 H new ATOM 0 HB3 ARG A 37 -11.911 9.089 1.936 1.00 3.78 H new ATOM 0 HG2 ARG A 37 -14.150 8.574 1.640 1.00 4.18 H new ATOM 0 HG3 ARG A 37 -13.458 8.083 0.107 1.00 4.18 H new ATOM 0 HD2 ARG A 37 -13.235 5.726 1.101 1.00 4.52 H new ATOM 0 HD3 ARG A 37 -14.204 6.292 2.447 1.00 4.52 H new ATOM 0 HE ARG A 37 -15.561 6.932 0.004 1.00 4.90 H new ATOM 0 HH11 ARG A 37 -14.710 4.116 2.009 1.00 5.45 H new ATOM 0 HH12 ARG A 37 -16.096 3.173 1.451 1.00 5.45 H new ATOM 0 HH21 ARG A 37 -17.319 5.695 -0.682 1.00 5.91 H new ATOM 0 HH22 ARG A 37 -17.559 4.060 -0.058 1.00 5.91 H new ATOM 568 N SER A 38 -10.926 8.122 -1.485 1.00 3.57 N ATOM 569 CA SER A 38 -11.247 8.047 -2.924 1.00 3.76 C ATOM 570 C SER A 38 -10.547 6.883 -3.649 1.00 3.81 C ATOM 571 O SER A 38 -11.186 6.169 -4.427 1.00 4.08 O ATOM 572 CB SER A 38 -10.879 9.372 -3.602 1.00 3.59 C ATOM 573 OG SER A 38 -11.423 9.452 -4.910 1.00 3.89 O ATOM 0 H SER A 38 -10.368 8.939 -1.236 1.00 3.57 H new ATOM 0 HA SER A 38 -12.318 7.860 -2.996 1.00 3.76 H new ATOM 0 HB2 SER A 38 -11.247 10.204 -3.002 1.00 3.59 H new ATOM 0 HB3 SER A 38 -9.794 9.469 -3.651 1.00 3.59 H new ATOM 0 HG SER A 38 -11.173 10.308 -5.316 1.00 3.89 H new ATOM 579 N LEU A 39 -9.239 6.699 -3.392 1.00 3.59 N ATOM 580 CA LEU A 39 -8.447 5.620 -4.034 1.00 3.65 C ATOM 581 C LEU A 39 -8.846 4.227 -3.520 1.00 3.91 C ATOM 582 O LEU A 39 -8.454 3.207 -4.098 1.00 4.06 O ATOM 583 CB LEU A 39 -6.911 5.782 -3.806 1.00 3.29 C ATOM 584 CG LEU A 39 -6.307 7.159 -3.480 1.00 3.06 C ATOM 585 CD1 LEU A 39 -6.630 8.214 -4.530 1.00 2.78 C ATOM 586 CD2 LEU A 39 -6.682 7.633 -2.083 1.00 3.19 C ATOM 0 H LEU A 39 -8.704 7.280 -2.746 1.00 3.59 H new ATOM 0 HA LEU A 39 -8.669 5.708 -5.097 1.00 3.65 H new ATOM 0 HB2 LEU A 39 -6.635 5.110 -2.994 1.00 3.29 H new ATOM 0 HB3 LEU A 39 -6.413 5.418 -4.705 1.00 3.29 H new ATOM 0 HG LEU A 39 -5.226 7.020 -3.501 1.00 3.06 H new ATOM 0 HD11 LEU A 39 -6.177 9.163 -4.244 1.00 2.78 H new ATOM 0 HD12 LEU A 39 -6.234 7.899 -5.496 1.00 2.78 H new ATOM 0 HD13 LEU A 39 -7.711 8.336 -4.603 1.00 2.78 H new ATOM 0 HD21 LEU A 39 -6.233 8.609 -1.897 1.00 3.19 H new ATOM 0 HD22 LEU A 39 -7.766 7.711 -2.004 1.00 3.19 H new ATOM 0 HD23 LEU A 39 -6.315 6.919 -1.346 1.00 3.19 H new ATOM 598 N GLY A 40 -9.631 4.207 -2.445 1.00 4.01 N ATOM 599 CA GLY A 40 -10.053 2.960 -1.823 1.00 4.30 C ATOM 600 C GLY A 40 -9.317 2.735 -0.515 1.00 4.16 C ATOM 601 O GLY A 40 -9.104 1.595 -0.092 1.00 4.36 O ATOM 0 H GLY A 40 -9.988 5.046 -1.987 1.00 4.01 H new ATOM 0 HA2 GLY A 40 -11.128 2.984 -1.642 1.00 4.30 H new ATOM 0 HA3 GLY A 40 -9.863 2.128 -2.501 1.00 4.30 H new ATOM 605 N GLN A 41 -8.938 3.852 0.113 1.00 3.86 N ATOM 606 CA GLN A 41 -8.204 3.864 1.373 1.00 3.74 C ATOM 607 C GLN A 41 -8.930 4.787 2.347 1.00 3.60 C ATOM 608 O GLN A 41 -10.000 5.296 2.024 1.00 3.46 O ATOM 609 CB GLN A 41 -6.760 4.358 1.151 1.00 3.47 C ATOM 610 CG GLN A 41 -5.845 3.370 0.433 1.00 3.68 C ATOM 611 CD GLN A 41 -5.887 3.512 -1.077 1.00 3.94 C ATOM 612 OE1 GLN A 41 -6.668 2.847 -1.757 1.00 4.34 O ATOM 613 NE2 GLN A 41 -5.038 4.382 -1.611 1.00 4.15 N ATOM 0 H GLN A 41 -9.137 4.785 -0.248 1.00 3.86 H new ATOM 0 HA GLN A 41 -8.157 2.854 1.780 1.00 3.74 H new ATOM 0 HB2 GLN A 41 -6.793 5.284 0.576 1.00 3.47 H new ATOM 0 HB3 GLN A 41 -6.321 4.599 2.119 1.00 3.47 H new ATOM 0 HG2 GLN A 41 -4.821 3.515 0.778 1.00 3.68 H new ATOM 0 HG3 GLN A 41 -6.132 2.354 0.705 1.00 3.68 H new ATOM 0 HE21 GLN A 41 -4.407 4.913 -1.011 1.00 4.15 H new ATOM 0 HE22 GLN A 41 -5.017 4.519 -2.622 1.00 4.15 H new ATOM 622 N ASN A 42 -8.392 4.957 3.558 1.00 3.76 N ATOM 623 CA ASN A 42 -8.985 5.853 4.545 1.00 3.68 C ATOM 624 C ASN A 42 -7.963 6.126 5.674 1.00 3.53 C ATOM 625 O ASN A 42 -7.320 5.179 6.136 1.00 3.67 O ATOM 626 CB ASN A 42 -10.275 5.258 5.146 1.00 4.06 C ATOM 627 CG ASN A 42 -11.217 6.318 5.690 1.00 4.60 C ATOM 628 OD1 ASN A 42 -11.090 6.749 6.836 1.00 4.82 O ATOM 629 ND2 ASN A 42 -12.174 6.735 4.871 1.00 5.19 N ATOM 0 H ASN A 42 -7.546 4.484 3.875 1.00 3.76 H new ATOM 0 HA ASN A 42 -9.246 6.785 4.044 1.00 3.68 H new ATOM 0 HB2 ASN A 42 -10.792 4.678 4.382 1.00 4.06 H new ATOM 0 HB3 ASN A 42 -10.012 4.567 5.947 1.00 4.06 H new ATOM 0 HD21 ASN A 42 -12.841 7.440 5.184 1.00 5.19 H new ATOM 0 HD22 ASN A 42 -12.242 6.350 3.929 1.00 5.19 H new ATOM 636 N PRO A 43 -7.781 7.401 6.144 1.00 3.30 N ATOM 637 CA PRO A 43 -6.819 7.726 7.212 1.00 3.22 C ATOM 638 C PRO A 43 -7.421 7.625 8.622 1.00 3.54 C ATOM 639 O PRO A 43 -8.630 7.421 8.774 1.00 3.81 O ATOM 640 CB PRO A 43 -6.425 9.180 6.896 1.00 2.89 C ATOM 641 CG PRO A 43 -7.375 9.665 5.837 1.00 2.92 C ATOM 642 CD PRO A 43 -8.463 8.632 5.703 1.00 3.17 C ATOM 0 HA PRO A 43 -5.982 7.028 7.225 1.00 3.22 H new ATOM 0 HB2 PRO A 43 -6.491 9.802 7.789 1.00 2.89 H new ATOM 0 HB3 PRO A 43 -5.394 9.234 6.545 1.00 2.89 H new ATOM 0 HG2 PRO A 43 -7.795 10.632 6.112 1.00 2.92 H new ATOM 0 HG3 PRO A 43 -6.856 9.801 4.888 1.00 2.92 H new ATOM 0 HD2 PRO A 43 -9.325 8.866 6.328 1.00 3.17 H new ATOM 0 HD3 PRO A 43 -8.824 8.552 4.678 1.00 3.17 H new ATOM 650 N THR A 44 -6.561 7.772 9.646 1.00 3.56 N ATOM 651 CA THR A 44 -6.986 7.720 11.054 1.00 3.90 C ATOM 652 C THR A 44 -7.637 9.051 11.471 1.00 3.85 C ATOM 653 O THR A 44 -7.585 10.029 10.722 1.00 3.54 O ATOM 654 CB THR A 44 -5.797 7.403 11.999 1.00 4.01 C ATOM 655 OG1 THR A 44 -4.756 6.723 11.284 1.00 3.86 O ATOM 656 CG2 THR A 44 -6.246 6.537 13.171 1.00 4.50 C ATOM 0 H THR A 44 -5.561 7.929 9.521 1.00 3.56 H new ATOM 0 HA THR A 44 -7.717 6.916 11.143 1.00 3.90 H new ATOM 0 HB THR A 44 -5.418 8.350 12.382 1.00 4.01 H new ATOM 0 HG1 THR A 44 -3.974 6.619 11.865 1.00 3.86 H new ATOM 0 HG21 THR A 44 -5.393 6.330 13.818 1.00 4.50 H new ATOM 0 HG22 THR A 44 -7.013 7.063 13.739 1.00 4.50 H new ATOM 0 HG23 THR A 44 -6.653 5.598 12.795 1.00 4.50 H new ATOM 664 N GLU A 45 -8.248 9.075 12.665 1.00 4.21 N ATOM 665 CA GLU A 45 -8.935 10.271 13.179 1.00 4.27 C ATOM 666 C GLU A 45 -7.981 11.315 13.781 1.00 4.16 C ATOM 667 O GLU A 45 -8.183 12.518 13.587 1.00 4.02 O ATOM 668 CB GLU A 45 -9.979 9.870 14.227 1.00 4.73 C ATOM 669 CG GLU A 45 -11.218 9.208 13.641 1.00 4.87 C ATOM 670 CD GLU A 45 -12.222 8.808 14.705 1.00 5.41 C ATOM 671 OE1 GLU A 45 -12.120 7.675 15.221 1.00 5.67 O ATOM 672 OE2 GLU A 45 -13.109 9.627 15.022 1.00 5.89 O ATOM 0 H GLU A 45 -8.281 8.275 13.297 1.00 4.21 H new ATOM 0 HA GLU A 45 -9.416 10.738 12.320 1.00 4.27 H new ATOM 0 HB2 GLU A 45 -9.519 9.188 14.942 1.00 4.73 H new ATOM 0 HB3 GLU A 45 -10.282 10.758 14.782 1.00 4.73 H new ATOM 0 HG2 GLU A 45 -11.693 9.892 12.937 1.00 4.87 H new ATOM 0 HG3 GLU A 45 -10.921 8.324 13.076 1.00 4.87 H new ATOM 679 N ALA A 46 -6.951 10.854 14.504 1.00 4.29 N ATOM 680 CA ALA A 46 -5.995 11.758 15.161 1.00 4.30 C ATOM 681 C ALA A 46 -4.762 12.065 14.313 1.00 3.96 C ATOM 682 O ALA A 46 -4.250 13.188 14.352 1.00 3.93 O ATOM 683 CB ALA A 46 -5.553 11.174 16.492 1.00 4.70 C ATOM 0 H ALA A 46 -6.758 9.863 14.649 1.00 4.29 H new ATOM 0 HA ALA A 46 -6.524 12.700 15.309 1.00 4.30 H new ATOM 0 HB1 ALA A 46 -4.845 11.852 16.970 1.00 4.70 H new ATOM 0 HB2 ALA A 46 -6.421 11.042 17.138 1.00 4.70 H new ATOM 0 HB3 ALA A 46 -5.075 10.209 16.325 1.00 4.70 H new ATOM 689 N GLU A 47 -4.287 11.071 13.549 1.00 3.76 N ATOM 690 CA GLU A 47 -3.081 11.219 12.720 1.00 3.47 C ATOM 691 C GLU A 47 -3.177 12.324 11.675 1.00 3.09 C ATOM 692 O GLU A 47 -2.147 12.843 11.247 1.00 2.91 O ATOM 693 CB GLU A 47 -2.705 9.887 12.063 1.00 3.43 C ATOM 694 CG GLU A 47 -2.117 8.870 13.031 1.00 3.78 C ATOM 695 CD GLU A 47 -1.667 7.598 12.339 1.00 3.77 C ATOM 696 OE1 GLU A 47 -2.357 6.567 12.484 1.00 3.72 O ATOM 697 OE2 GLU A 47 -0.625 7.633 11.652 1.00 4.19 O ATOM 0 H GLU A 47 -4.722 10.151 13.488 1.00 3.76 H new ATOM 0 HA GLU A 47 -2.289 11.523 13.404 1.00 3.47 H new ATOM 0 HB2 GLU A 47 -3.592 9.460 11.596 1.00 3.43 H new ATOM 0 HB3 GLU A 47 -1.985 10.076 11.267 1.00 3.43 H new ATOM 0 HG2 GLU A 47 -1.269 9.316 13.550 1.00 3.78 H new ATOM 0 HG3 GLU A 47 -2.861 8.623 13.789 1.00 3.78 H new ATOM 704 N LEU A 48 -4.395 12.695 11.265 1.00 3.03 N ATOM 705 CA LEU A 48 -4.571 13.789 10.297 1.00 2.71 C ATOM 706 C LEU A 48 -4.056 15.094 10.899 1.00 2.75 C ATOM 707 O LEU A 48 -3.683 16.015 10.191 1.00 2.53 O ATOM 708 CB LEU A 48 -6.027 14.002 9.911 1.00 2.77 C ATOM 709 CG LEU A 48 -6.885 12.760 9.734 1.00 2.90 C ATOM 710 CD1 LEU A 48 -8.265 12.971 10.339 1.00 3.19 C ATOM 711 CD2 LEU A 48 -6.990 12.448 8.263 1.00 2.63 C ATOM 0 H LEU A 48 -5.263 12.263 11.581 1.00 3.03 H new ATOM 0 HA LEU A 48 -4.012 13.508 9.404 1.00 2.71 H new ATOM 0 HB2 LEU A 48 -6.491 14.628 10.673 1.00 2.77 H new ATOM 0 HB3 LEU A 48 -6.051 14.565 8.978 1.00 2.77 H new ATOM 0 HG LEU A 48 -6.423 11.920 10.252 1.00 2.90 H new ATOM 0 HD11 LEU A 48 -8.864 12.071 10.202 1.00 3.19 H new ATOM 0 HD12 LEU A 48 -8.167 13.183 11.404 1.00 3.19 H new ATOM 0 HD13 LEU A 48 -8.754 13.811 9.845 1.00 3.19 H new ATOM 0 HD21 LEU A 48 -7.604 11.558 8.123 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -7.448 13.290 7.744 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -5.994 12.270 7.857 1.00 2.63 H new ATOM 723 N GLN A 49 -4.084 15.159 12.228 1.00 3.08 N ATOM 724 CA GLN A 49 -3.596 16.318 12.969 1.00 3.22 C ATOM 725 C GLN A 49 -2.063 16.352 13.013 1.00 3.25 C ATOM 726 O GLN A 49 -1.471 17.430 12.920 1.00 3.25 O ATOM 727 CB GLN A 49 -4.156 16.315 14.396 1.00 3.61 C ATOM 728 CG GLN A 49 -5.633 16.675 14.481 1.00 3.67 C ATOM 729 CD GLN A 49 -6.159 16.655 15.903 1.00 4.10 C ATOM 730 OE1 GLN A 49 -6.632 15.626 16.387 1.00 4.58 O ATOM 731 NE2 GLN A 49 -6.079 17.794 16.581 1.00 4.30 N ATOM 0 H GLN A 49 -4.445 14.411 12.820 1.00 3.08 H new ATOM 0 HA GLN A 49 -3.942 17.211 12.448 1.00 3.22 H new ATOM 0 HB2 GLN A 49 -4.007 15.327 14.832 1.00 3.61 H new ATOM 0 HB3 GLN A 49 -3.585 17.019 15.001 1.00 3.61 H new ATOM 0 HG2 GLN A 49 -5.786 17.667 14.055 1.00 3.67 H new ATOM 0 HG3 GLN A 49 -6.209 15.975 13.875 1.00 3.67 H new ATOM 0 HE21 GLN A 49 -5.680 18.623 16.141 1.00 4.30 H new ATOM 0 HE22 GLN A 49 -6.417 17.840 17.542 1.00 4.30 H new ATOM 740 N ASP A 50 -1.425 15.171 13.156 1.00 3.34 N ATOM 741 CA ASP A 50 0.042 15.094 13.228 1.00 3.43 C ATOM 742 C ASP A 50 0.726 14.962 11.854 1.00 3.13 C ATOM 743 O ASP A 50 1.696 15.673 11.582 1.00 3.13 O ATOM 744 CB ASP A 50 0.481 13.955 14.134 1.00 3.76 C ATOM 745 CG ASP A 50 0.145 14.202 15.594 1.00 4.11 C ATOM 746 OD1 ASP A 50 0.986 14.792 16.305 1.00 4.38 O ATOM 747 OD2 ASP A 50 -0.958 13.806 16.025 1.00 4.38 O ATOM 0 H ASP A 50 -1.899 14.270 13.223 1.00 3.34 H new ATOM 0 HA ASP A 50 0.364 16.047 13.648 1.00 3.43 H new ATOM 0 HB2 ASP A 50 0.003 13.032 13.807 1.00 3.76 H new ATOM 0 HB3 ASP A 50 1.557 13.810 14.033 1.00 3.76 H new ATOM 752 N MET A 51 0.243 14.037 10.997 1.00 2.93 N ATOM 753 CA MET A 51 0.824 13.821 9.642 1.00 2.66 C ATOM 754 C MET A 51 0.708 15.076 8.804 1.00 2.39 C ATOM 755 O MET A 51 1.565 15.375 7.968 1.00 2.30 O ATOM 756 CB MET A 51 0.150 12.642 8.927 1.00 2.59 C ATOM 757 CG MET A 51 0.025 11.378 9.783 1.00 2.35 C ATOM 758 SD MET A 51 -0.953 10.056 9.018 1.00 2.18 S ATOM 759 CE MET A 51 -2.540 10.845 8.732 1.00 2.48 C ATOM 0 H MET A 51 -0.545 13.427 11.213 1.00 2.93 H new ATOM 0 HA MET A 51 1.879 13.581 9.770 1.00 2.66 H new ATOM 0 HB2 MET A 51 -0.845 12.948 8.604 1.00 2.59 H new ATOM 0 HB3 MET A 51 0.718 12.404 8.028 1.00 2.59 H new ATOM 0 HG2 MET A 51 1.024 10.998 9.998 1.00 2.35 H new ATOM 0 HG3 MET A 51 -0.428 11.643 10.739 1.00 2.35 H new ATOM 0 HE1 MET A 51 -3.305 10.351 9.331 1.00 2.48 H new ATOM 0 HE2 MET A 51 -2.480 11.896 9.015 1.00 2.48 H new ATOM 0 HE3 MET A 51 -2.800 10.768 7.676 1.00 2.48 H new ATOM 769 N ILE A 52 -0.370 15.790 9.056 1.00 2.33 N ATOM 770 CA ILE A 52 -0.657 17.059 8.427 1.00 2.15 C ATOM 771 C ILE A 52 0.169 18.146 9.085 1.00 2.40 C ATOM 772 O ILE A 52 0.400 19.192 8.516 1.00 2.36 O ATOM 773 CB ILE A 52 -2.179 17.311 8.502 1.00 2.10 C ATOM 774 CG1 ILE A 52 -2.823 16.658 7.294 1.00 1.78 C ATOM 775 CG2 ILE A 52 -2.584 18.781 8.618 1.00 2.22 C ATOM 776 CD1 ILE A 52 -3.132 15.183 7.475 1.00 1.85 C ATOM 0 H ILE A 52 -1.086 15.495 9.720 1.00 2.33 H new ATOM 0 HA ILE A 52 -0.379 17.056 7.373 1.00 2.15 H new ATOM 0 HB ILE A 52 -2.536 16.867 9.431 1.00 2.10 H new ATOM 0 HG12 ILE A 52 -3.748 17.185 7.060 1.00 1.78 H new ATOM 0 HG13 ILE A 52 -2.162 16.777 6.435 1.00 1.78 H new ATOM 0 HG21 ILE A 52 -3.670 18.857 8.664 1.00 2.22 H new ATOM 0 HG22 ILE A 52 -2.152 19.207 9.523 1.00 2.22 H new ATOM 0 HG23 ILE A 52 -2.219 19.329 7.749 1.00 2.22 H new ATOM 0 HD11 ILE A 52 -3.590 14.793 6.566 1.00 1.85 H new ATOM 0 HD12 ILE A 52 -2.209 14.640 7.678 1.00 1.85 H new ATOM 0 HD13 ILE A 52 -3.819 15.055 8.312 1.00 1.85 H new ATOM 788 N ASN A 53 0.616 17.860 10.293 1.00 2.72 N ATOM 789 CA ASN A 53 1.454 18.771 11.041 1.00 3.03 C ATOM 790 C ASN A 53 2.881 18.654 10.576 1.00 3.09 C ATOM 791 O ASN A 53 3.764 19.426 10.941 1.00 3.36 O ATOM 792 CB ASN A 53 1.334 18.468 12.535 1.00 3.37 C ATOM 793 CG ASN A 53 1.927 19.544 13.433 1.00 3.66 C ATOM 794 OD1 ASN A 53 1.239 20.484 13.832 1.00 3.89 O ATOM 795 ND2 ASN A 53 3.208 19.408 13.753 1.00 3.98 N ATOM 0 H ASN A 53 0.407 16.989 10.781 1.00 2.72 H new ATOM 0 HA ASN A 53 1.126 19.796 10.870 1.00 3.03 H new ATOM 0 HB2 ASN A 53 0.281 18.339 12.786 1.00 3.37 H new ATOM 0 HB3 ASN A 53 1.830 17.520 12.744 1.00 3.37 H new ATOM 0 HD21 ASN A 53 3.660 20.099 14.352 1.00 3.98 H new ATOM 0 HD22 ASN A 53 3.740 18.613 13.400 1.00 3.98 H new ATOM 802 N GLU A 54 3.059 17.618 9.829 1.00 2.90 N ATOM 803 CA GLU A 54 4.325 17.303 9.192 1.00 2.96 C ATOM 804 C GLU A 54 4.419 17.978 7.825 1.00 2.77 C ATOM 805 O GLU A 54 5.517 18.190 7.302 1.00 2.93 O ATOM 806 CB GLU A 54 4.475 15.784 9.027 1.00 2.91 C ATOM 807 CG GLU A 54 4.633 15.029 10.341 1.00 3.22 C ATOM 808 CD GLU A 54 4.727 13.529 10.144 1.00 3.25 C ATOM 809 OE1 GLU A 54 3.671 12.862 10.157 1.00 3.56 O ATOM 810 OE2 GLU A 54 5.856 13.022 9.976 1.00 3.40 O ATOM 0 H GLU A 54 2.322 16.942 9.630 1.00 2.90 H new ATOM 0 HA GLU A 54 5.128 17.676 9.827 1.00 2.96 H new ATOM 0 HB2 GLU A 54 3.602 15.398 8.501 1.00 2.91 H new ATOM 0 HB3 GLU A 54 5.341 15.581 8.397 1.00 2.91 H new ATOM 0 HG2 GLU A 54 5.529 15.381 10.853 1.00 3.22 H new ATOM 0 HG3 GLU A 54 3.786 15.254 10.989 1.00 3.22 H new ATOM 817 N VAL A 55 3.253 18.308 7.264 1.00 2.49 N ATOM 818 CA VAL A 55 3.178 18.937 5.947 1.00 2.36 C ATOM 819 C VAL A 55 2.363 20.230 5.922 1.00 2.40 C ATOM 820 O VAL A 55 2.545 21.051 5.015 1.00 2.49 O ATOM 821 CB VAL A 55 2.668 17.901 4.893 1.00 1.99 C ATOM 822 CG1 VAL A 55 1.961 18.535 3.691 1.00 2.37 C ATOM 823 CG2 VAL A 55 3.828 17.040 4.422 1.00 2.07 C ATOM 0 H VAL A 55 2.347 18.149 7.704 1.00 2.49 H new ATOM 0 HA VAL A 55 4.189 19.246 5.683 1.00 2.36 H new ATOM 0 HB VAL A 55 1.917 17.291 5.396 1.00 1.99 H new ATOM 0 HG11 VAL A 55 1.637 17.752 3.005 1.00 2.37 H new ATOM 0 HG12 VAL A 55 1.094 19.099 4.035 1.00 2.37 H new ATOM 0 HG13 VAL A 55 2.649 19.206 3.177 1.00 2.37 H new ATOM 0 HG21 VAL A 55 3.471 16.318 3.687 1.00 2.07 H new ATOM 0 HG22 VAL A 55 4.590 17.673 3.968 1.00 2.07 H new ATOM 0 HG23 VAL A 55 4.256 16.510 5.273 1.00 2.07 H new ATOM 833 N ALA A 56 1.509 20.439 6.910 1.00 2.43 N ATOM 834 CA ALA A 56 0.688 21.639 6.929 1.00 2.53 C ATOM 835 C ALA A 56 1.220 22.569 8.002 1.00 2.90 C ATOM 836 O ALA A 56 0.569 23.538 8.413 1.00 3.05 O ATOM 837 CB ALA A 56 -0.765 21.263 7.152 1.00 2.36 C ATOM 0 H ALA A 56 1.367 19.806 7.697 1.00 2.43 H new ATOM 0 HA ALA A 56 0.736 22.161 5.973 1.00 2.53 H new ATOM 0 HB1 ALA A 56 -1.376 22.165 7.166 1.00 2.36 H new ATOM 0 HB2 ALA A 56 -1.100 20.610 6.346 1.00 2.36 H new ATOM 0 HB3 ALA A 56 -0.864 20.743 8.105 1.00 2.36 H new ATOM 843 N ALA A 57 2.449 22.251 8.426 1.00 3.08 N ATOM 844 CA ALA A 57 3.148 23.000 9.449 1.00 3.45 C ATOM 845 C ALA A 57 3.925 24.164 8.874 1.00 3.67 C ATOM 846 O ALA A 57 4.682 24.030 7.909 1.00 3.69 O ATOM 847 CB ALA A 57 4.060 22.097 10.252 1.00 3.64 C ATOM 0 H ALA A 57 2.980 21.461 8.060 1.00 3.08 H new ATOM 0 HA ALA A 57 2.390 23.412 10.115 1.00 3.45 H new ATOM 0 HB1 ALA A 57 4.574 22.683 11.014 1.00 3.64 H new ATOM 0 HB2 ALA A 57 3.469 21.317 10.732 1.00 3.64 H new ATOM 0 HB3 ALA A 57 4.795 21.640 9.589 1.00 3.64 H new ATOM 886 N GLY A 61 -3.161 26.842 9.621 1.00 3.52 N ATOM 887 CA GLY A 61 -4.427 26.324 10.127 1.00 3.44 C ATOM 888 C GLY A 61 -5.064 25.266 9.232 1.00 3.11 C ATOM 889 O GLY A 61 -6.122 24.731 9.574 1.00 3.10 O ATOM 0 HA2 GLY A 61 -4.264 25.898 11.117 1.00 3.44 H new ATOM 0 HA3 GLY A 61 -5.125 27.152 10.247 1.00 3.44 H new ATOM 893 N THR A 62 -4.419 24.959 8.094 1.00 2.91 N ATOM 894 CA THR A 62 -4.908 23.936 7.156 1.00 2.61 C ATOM 895 C THR A 62 -3.744 23.260 6.426 1.00 2.41 C ATOM 896 O THR A 62 -2.576 23.556 6.692 1.00 2.55 O ATOM 897 CB THR A 62 -5.921 24.490 6.120 1.00 2.62 C ATOM 898 OG1 THR A 62 -5.434 25.713 5.558 1.00 2.84 O ATOM 899 CG2 THR A 62 -7.280 24.719 6.763 1.00 2.75 C ATOM 0 H THR A 62 -3.552 25.409 7.801 1.00 2.91 H new ATOM 0 HA THR A 62 -5.436 23.202 7.765 1.00 2.61 H new ATOM 0 HB THR A 62 -6.034 23.752 5.325 1.00 2.62 H new ATOM 0 HG1 THR A 62 -5.555 25.697 4.586 1.00 2.84 H new ATOM 0 HG21 THR A 62 -7.974 25.108 6.018 1.00 2.75 H new ATOM 0 HG22 THR A 62 -7.660 23.776 7.156 1.00 2.75 H new ATOM 0 HG23 THR A 62 -7.181 25.438 7.576 1.00 2.75 H new ATOM 907 N ILE A 63 -4.090 22.376 5.490 1.00 2.14 N ATOM 908 CA ILE A 63 -3.137 21.588 4.725 1.00 1.93 C ATOM 909 C ILE A 63 -3.094 22.005 3.280 1.00 1.95 C ATOM 910 O ILE A 63 -4.123 22.245 2.676 1.00 1.99 O ATOM 911 CB ILE A 63 -3.559 20.134 4.630 1.00 1.63 C ATOM 912 CG1 ILE A 63 -4.657 19.795 5.626 1.00 1.70 C ATOM 913 CG2 ILE A 63 -2.421 19.117 4.754 1.00 1.51 C ATOM 914 CD1 ILE A 63 -5.893 19.320 4.958 1.00 1.95 C ATOM 0 H ILE A 63 -5.061 22.188 5.241 1.00 2.14 H new ATOM 0 HA ILE A 63 -2.190 21.734 5.245 1.00 1.93 H new ATOM 0 HB ILE A 63 -3.940 20.043 3.613 1.00 1.63 H new ATOM 0 HG12 ILE A 63 -4.299 19.027 6.312 1.00 1.70 H new ATOM 0 HG13 ILE A 63 -4.886 20.676 6.226 1.00 1.70 H new ATOM 0 HG21 ILE A 63 -2.825 18.108 4.673 1.00 1.51 H new ATOM 0 HG22 ILE A 63 -1.696 19.283 3.957 1.00 1.51 H new ATOM 0 HG23 ILE A 63 -1.931 19.236 5.720 1.00 1.51 H new ATOM 0 HD11 ILE A 63 -6.648 19.090 5.710 1.00 1.95 H new ATOM 0 HD12 ILE A 63 -6.269 20.097 4.292 1.00 1.95 H new ATOM 0 HD13 ILE A 63 -5.672 18.423 4.380 1.00 1.95 H new ATOM 926 N ASP A 64 -1.915 21.945 2.722 1.00 2.01 N ATOM 927 CA ASP A 64 -1.686 22.271 1.332 1.00 2.12 C ATOM 928 C ASP A 64 -1.556 20.974 0.515 1.00 1.86 C ATOM 929 O ASP A 64 -1.337 19.904 1.091 1.00 1.62 O ATOM 930 CB ASP A 64 -0.458 23.182 1.149 1.00 2.46 C ATOM 931 CG ASP A 64 0.852 22.571 1.636 1.00 2.46 C ATOM 932 OD1 ASP A 64 1.532 21.904 0.828 1.00 2.68 O ATOM 933 OD2 ASP A 64 1.191 22.762 2.822 1.00 2.74 O ATOM 0 H ASP A 64 -1.072 21.665 3.223 1.00 2.01 H new ATOM 0 HA ASP A 64 -2.542 22.836 0.963 1.00 2.12 H new ATOM 0 HB2 ASP A 64 -0.359 23.431 0.093 1.00 2.46 H new ATOM 0 HB3 ASP A 64 -0.630 24.117 1.682 1.00 2.46 H new ATOM 938 N PHE A 65 -1.687 21.068 -0.815 1.00 1.97 N ATOM 939 CA PHE A 65 -1.636 19.879 -1.677 1.00 1.80 C ATOM 940 C PHE A 65 -0.192 19.395 -2.022 1.00 1.83 C ATOM 941 O PHE A 65 0.060 18.190 -1.938 1.00 1.60 O ATOM 942 CB PHE A 65 -2.415 20.120 -2.986 1.00 2.04 C ATOM 943 CG PHE A 65 -2.715 18.856 -3.764 1.00 1.95 C ATOM 944 CD1 PHE A 65 -2.078 18.582 -4.964 1.00 2.40 C ATOM 945 CD2 PHE A 65 -3.634 17.947 -3.281 1.00 2.11 C ATOM 946 CE1 PHE A 65 -2.363 17.421 -5.661 1.00 2.45 C ATOM 947 CE2 PHE A 65 -3.930 16.791 -3.960 1.00 2.08 C ATOM 948 CZ PHE A 65 -3.291 16.526 -5.158 1.00 1.96 C ATOM 0 H PHE A 65 -1.828 21.946 -1.314 1.00 1.97 H new ATOM 0 HA PHE A 65 -2.102 19.086 -1.092 1.00 1.80 H new ATOM 0 HB2 PHE A 65 -3.354 20.622 -2.751 1.00 2.04 H new ATOM 0 HB3 PHE A 65 -1.841 20.797 -3.619 1.00 2.04 H new ATOM 0 HD1 PHE A 65 -1.354 19.280 -5.358 1.00 2.40 H new ATOM 0 HD2 PHE A 65 -4.133 18.150 -2.345 1.00 2.11 H new ATOM 0 HE1 PHE A 65 -1.862 17.214 -6.595 1.00 2.45 H new ATOM 0 HE2 PHE A 65 -4.654 16.095 -3.563 1.00 2.08 H new ATOM 0 HZ PHE A 65 -3.516 15.620 -5.701 1.00 1.96 H new ATOM 958 N PRO A 66 0.774 20.304 -2.426 1.00 2.16 N ATOM 959 CA PRO A 66 2.160 19.919 -2.831 1.00 2.30 C ATOM 960 C PRO A 66 2.842 18.798 -2.017 1.00 2.09 C ATOM 961 O PRO A 66 3.294 17.809 -2.600 1.00 2.04 O ATOM 962 CB PRO A 66 2.928 21.232 -2.679 1.00 2.67 C ATOM 963 CG PRO A 66 1.941 22.279 -3.034 1.00 2.78 C ATOM 964 CD PRO A 66 0.608 21.785 -2.529 1.00 2.48 C ATOM 0 HA PRO A 66 2.142 19.484 -3.830 1.00 2.30 H new ATOM 0 HB2 PRO A 66 3.296 21.362 -1.661 1.00 2.67 H new ATOM 0 HB3 PRO A 66 3.795 21.264 -3.338 1.00 2.67 H new ATOM 0 HG2 PRO A 66 2.202 23.233 -2.575 1.00 2.78 H new ATOM 0 HG3 PRO A 66 1.914 22.440 -4.112 1.00 2.78 H new ATOM 0 HD2 PRO A 66 0.361 22.225 -1.563 1.00 2.48 H new ATOM 0 HD3 PRO A 66 -0.198 22.048 -3.214 1.00 2.48 H new ATOM 972 N GLU A 67 2.938 18.958 -0.692 1.00 2.04 N ATOM 973 CA GLU A 67 3.591 17.963 0.165 1.00 1.95 C ATOM 974 C GLU A 67 2.651 16.892 0.685 1.00 1.60 C ATOM 975 O GLU A 67 3.079 15.871 1.230 1.00 1.59 O ATOM 976 CB GLU A 67 4.389 18.623 1.293 1.00 2.24 C ATOM 977 CG GLU A 67 5.635 19.357 0.817 1.00 2.61 C ATOM 978 CD GLU A 67 6.388 20.023 1.952 1.00 3.15 C ATOM 979 OE1 GLU A 67 6.106 21.206 2.237 1.00 3.47 O ATOM 980 OE2 GLU A 67 7.259 19.362 2.556 1.00 3.66 O ATOM 0 H GLU A 67 2.572 19.767 -0.190 1.00 2.04 H new ATOM 0 HA GLU A 67 4.298 17.439 -0.478 1.00 1.95 H new ATOM 0 HB2 GLU A 67 3.743 19.326 1.819 1.00 2.24 H new ATOM 0 HB3 GLU A 67 4.682 17.859 2.013 1.00 2.24 H new ATOM 0 HG2 GLU A 67 6.296 18.653 0.311 1.00 2.61 H new ATOM 0 HG3 GLU A 67 5.350 20.111 0.083 1.00 2.61 H new ATOM 987 N PHE A 68 1.382 17.153 0.515 1.00 1.40 N ATOM 988 CA PHE A 68 0.297 16.247 0.935 1.00 1.10 C ATOM 989 C PHE A 68 0.454 14.869 0.256 1.00 0.99 C ATOM 990 O PHE A 68 0.165 13.839 0.868 1.00 0.94 O ATOM 991 CB PHE A 68 -1.049 16.915 0.608 1.00 1.04 C ATOM 992 CG PHE A 68 -2.322 16.138 0.899 1.00 0.89 C ATOM 993 CD1 PHE A 68 -3.164 15.809 -0.153 1.00 1.36 C ATOM 994 CD2 PHE A 68 -2.720 15.791 2.199 1.00 1.60 C ATOM 995 CE1 PHE A 68 -4.363 15.167 0.067 1.00 1.57 C ATOM 996 CE2 PHE A 68 -3.907 15.143 2.409 1.00 1.57 C ATOM 997 CZ PHE A 68 -4.741 14.834 1.346 1.00 1.15 C ATOM 0 H PHE A 68 1.047 18.010 0.075 1.00 1.40 H new ATOM 0 HA PHE A 68 0.340 16.068 2.009 1.00 1.10 H new ATOM 0 HB2 PHE A 68 -1.098 17.854 1.159 1.00 1.04 H new ATOM 0 HB3 PHE A 68 -1.047 17.167 -0.452 1.00 1.04 H new ATOM 0 HD1 PHE A 68 -2.875 16.061 -1.163 1.00 1.36 H new ATOM 0 HD2 PHE A 68 -2.086 16.037 3.038 1.00 1.60 H new ATOM 0 HE1 PHE A 68 -5.006 14.925 -0.766 1.00 1.57 H new ATOM 0 HE2 PHE A 68 -4.197 14.870 3.413 1.00 1.57 H new ATOM 0 HZ PHE A 68 -5.682 14.335 1.522 1.00 1.15 H new ATOM 1007 N LEU A 69 0.920 14.873 -1.012 1.00 1.15 N ATOM 1008 CA LEU A 69 1.167 13.627 -1.769 1.00 1.24 C ATOM 1009 C LEU A 69 2.525 13.026 -1.409 1.00 1.42 C ATOM 1010 O LEU A 69 2.709 11.809 -1.491 1.00 1.53 O ATOM 1011 CB LEU A 69 1.110 13.821 -3.293 1.00 1.51 C ATOM 1012 CG LEU A 69 0.395 15.067 -3.804 1.00 1.59 C ATOM 1013 CD1 LEU A 69 1.413 16.120 -4.166 1.00 1.82 C ATOM 1014 CD2 LEU A 69 -0.460 14.735 -5.008 1.00 1.76 C ATOM 0 H LEU A 69 1.132 15.724 -1.532 1.00 1.15 H new ATOM 0 HA LEU A 69 0.362 12.950 -1.482 1.00 1.24 H new ATOM 0 HB2 LEU A 69 2.132 13.837 -3.671 1.00 1.51 H new ATOM 0 HB3 LEU A 69 0.623 12.948 -3.728 1.00 1.51 H new ATOM 0 HG LEU A 69 -0.256 15.448 -3.017 1.00 1.59 H new ATOM 0 HD11 LEU A 69 0.901 17.010 -4.531 1.00 1.82 H new ATOM 0 HD12 LEU A 69 2.001 16.375 -3.285 1.00 1.82 H new ATOM 0 HD13 LEU A 69 2.073 15.736 -4.944 1.00 1.82 H new ATOM 0 HD21 LEU A 69 -0.962 15.637 -5.358 1.00 1.76 H new ATOM 0 HD22 LEU A 69 0.171 14.339 -5.804 1.00 1.76 H new ATOM 0 HD23 LEU A 69 -1.205 13.990 -4.731 1.00 1.76 H new ATOM 1026 N THR A 70 3.479 13.892 -1.022 1.00 1.58 N ATOM 1027 CA THR A 70 4.831 13.439 -0.638 1.00 1.88 C ATOM 1028 C THR A 70 4.789 12.730 0.714 1.00 1.87 C ATOM 1029 O THR A 70 5.557 11.794 0.958 1.00 2.04 O ATOM 1030 CB THR A 70 5.872 14.586 -0.590 1.00 2.19 C ATOM 1031 OG1 THR A 70 5.453 15.612 0.313 1.00 2.14 O ATOM 1032 CG2 THR A 70 6.101 15.185 -1.973 1.00 2.80 C ATOM 0 H THR A 70 3.342 14.901 -0.967 1.00 1.58 H new ATOM 0 HA THR A 70 5.153 12.748 -1.417 1.00 1.88 H new ATOM 0 HB THR A 70 6.811 14.159 -0.237 1.00 2.19 H new ATOM 0 HG1 THR A 70 4.618 15.343 0.749 1.00 2.14 H new ATOM 0 HG21 THR A 70 6.836 15.987 -1.905 1.00 2.80 H new ATOM 0 HG22 THR A 70 6.468 14.412 -2.648 1.00 2.80 H new ATOM 0 HG23 THR A 70 5.162 15.585 -2.356 1.00 2.80 H new ATOM 1040 N MET A 71 3.879 13.193 1.585 1.00 1.77 N ATOM 1041 CA MET A 71 3.671 12.581 2.898 1.00 1.91 C ATOM 1042 C MET A 71 2.766 11.349 2.758 1.00 1.83 C ATOM 1043 O MET A 71 2.800 10.452 3.594 1.00 2.06 O ATOM 1044 CB MET A 71 3.097 13.589 3.928 1.00 2.01 C ATOM 1045 CG MET A 71 1.805 14.305 3.516 1.00 2.31 C ATOM 1046 SD MET A 71 0.318 13.417 4.019 1.00 2.07 S ATOM 1047 CE MET A 71 -0.019 14.138 5.631 1.00 1.57 C ATOM 0 H MET A 71 3.275 13.993 1.398 1.00 1.77 H new ATOM 0 HA MET A 71 4.641 12.266 3.283 1.00 1.91 H new ATOM 0 HB2 MET A 71 2.914 13.059 4.863 1.00 2.01 H new ATOM 0 HB3 MET A 71 3.858 14.342 4.133 1.00 2.01 H new ATOM 0 HG2 MET A 71 1.792 15.302 3.956 1.00 2.31 H new ATOM 0 HG3 MET A 71 1.796 14.434 2.434 1.00 2.31 H new ATOM 0 HE1 MET A 71 -1.001 13.814 5.976 1.00 1.57 H new ATOM 0 HE2 MET A 71 0.741 13.813 6.341 1.00 1.57 H new ATOM 0 HE3 MET A 71 -0.002 15.225 5.554 1.00 1.57 H new ATOM 1057 N MET A 72 1.980 11.318 1.659 1.00 1.61 N ATOM 1058 CA MET A 72 1.046 10.216 1.347 1.00 1.69 C ATOM 1059 C MET A 72 1.708 8.829 1.425 1.00 1.97 C ATOM 1060 O MET A 72 1.033 7.834 1.704 1.00 2.17 O ATOM 1061 CB MET A 72 0.440 10.427 -0.045 1.00 1.60 C ATOM 1062 CG MET A 72 -0.902 11.143 -0.023 1.00 1.46 C ATOM 1063 SD MET A 72 -2.187 10.199 0.821 1.00 1.69 S ATOM 1064 CE MET A 72 -3.588 11.301 0.642 1.00 1.53 C ATOM 0 H MET A 72 1.977 12.061 0.961 1.00 1.61 H new ATOM 0 HA MET A 72 0.263 10.237 2.105 1.00 1.69 H new ATOM 0 HB2 MET A 72 1.139 11.001 -0.653 1.00 1.60 H new ATOM 0 HB3 MET A 72 0.318 9.458 -0.529 1.00 1.60 H new ATOM 0 HG2 MET A 72 -0.785 12.109 0.469 1.00 1.46 H new ATOM 0 HG3 MET A 72 -1.218 11.343 -1.047 1.00 1.46 H new ATOM 0 HE1 MET A 72 -4.512 10.723 0.675 1.00 1.53 H new ATOM 0 HE2 MET A 72 -3.585 12.028 1.454 1.00 1.53 H new ATOM 0 HE3 MET A 72 -3.520 11.823 -0.312 1.00 1.53 H new ATOM 1207 N SER A 81 3.235 -2.979 3.051 1.00 3.49 N ATOM 1208 CA SER A 81 2.991 -4.339 2.579 1.00 3.36 C ATOM 1209 C SER A 81 4.202 -5.260 2.754 1.00 2.88 C ATOM 1210 O SER A 81 4.057 -6.485 2.774 1.00 2.79 O ATOM 1211 CB SER A 81 2.570 -4.309 1.110 1.00 3.71 C ATOM 1212 OG SER A 81 1.331 -3.642 0.947 1.00 4.35 O ATOM 0 HA SER A 81 2.190 -4.750 3.194 1.00 3.36 H new ATOM 0 HB2 SER A 81 3.337 -3.808 0.519 1.00 3.71 H new ATOM 0 HB3 SER A 81 2.491 -5.328 0.731 1.00 3.71 H new ATOM 0 HG SER A 81 1.244 -2.943 1.628 1.00 4.35 H new ATOM 1218 N GLU A 82 5.387 -4.662 2.892 1.00 2.97 N ATOM 1219 CA GLU A 82 6.644 -5.418 3.056 1.00 3.25 C ATOM 1220 C GLU A 82 6.796 -5.969 4.467 1.00 3.85 C ATOM 1221 O GLU A 82 7.481 -6.969 4.690 1.00 4.27 O ATOM 1222 CB GLU A 82 7.846 -4.535 2.727 1.00 3.94 C ATOM 1223 CG GLU A 82 7.989 -4.198 1.250 1.00 4.12 C ATOM 1224 CD GLU A 82 9.234 -3.383 0.958 1.00 4.93 C ATOM 1225 OE1 GLU A 82 10.283 -3.990 0.654 1.00 5.51 O ATOM 1226 OE2 GLU A 82 9.161 -2.138 1.036 1.00 5.25 O ATOM 0 H GLU A 82 5.509 -3.649 2.894 1.00 2.97 H new ATOM 0 HA GLU A 82 6.603 -6.259 2.363 1.00 3.25 H new ATOM 0 HB2 GLU A 82 7.766 -3.607 3.293 1.00 3.94 H new ATOM 0 HB3 GLU A 82 8.754 -5.037 3.063 1.00 3.94 H new ATOM 0 HG2 GLU A 82 8.019 -5.121 0.671 1.00 4.12 H new ATOM 0 HG3 GLU A 82 7.110 -3.644 0.920 1.00 4.12 H new ATOM 1233 N GLU A 83 6.171 -5.281 5.407 1.00 4.18 N ATOM 1234 CA GLU A 83 6.173 -5.684 6.817 1.00 5.12 C ATOM 1235 C GLU A 83 5.187 -6.837 7.051 1.00 5.33 C ATOM 1236 O GLU A 83 5.318 -7.590 8.018 1.00 6.21 O ATOM 1237 CB GLU A 83 5.809 -4.493 7.711 1.00 5.53 C ATOM 1238 CG GLU A 83 6.939 -3.490 7.888 1.00 5.74 C ATOM 1239 CD GLU A 83 6.555 -2.329 8.784 1.00 6.48 C ATOM 1240 OE1 GLU A 83 6.042 -1.318 8.259 1.00 6.88 O ATOM 1241 OE2 GLU A 83 6.766 -2.431 10.011 1.00 6.89 O ATOM 0 H GLU A 83 5.646 -4.426 5.222 1.00 4.18 H new ATOM 0 HA GLU A 83 7.176 -6.026 7.074 1.00 5.12 H new ATOM 0 HB2 GLU A 83 4.945 -3.982 7.285 1.00 5.53 H new ATOM 0 HB3 GLU A 83 5.509 -4.865 8.691 1.00 5.53 H new ATOM 0 HG2 GLU A 83 7.807 -3.997 8.309 1.00 5.74 H new ATOM 0 HG3 GLU A 83 7.236 -3.107 6.912 1.00 5.74 H new ATOM 1248 N GLU A 84 4.208 -6.958 6.140 1.00 4.72 N ATOM 1249 CA GLU A 84 3.170 -7.992 6.214 1.00 5.16 C ATOM 1250 C GLU A 84 3.603 -9.339 5.612 1.00 4.87 C ATOM 1251 O GLU A 84 3.097 -10.380 6.035 1.00 5.53 O ATOM 1252 CB GLU A 84 1.892 -7.508 5.514 1.00 5.11 C ATOM 1253 CG GLU A 84 1.120 -6.441 6.285 1.00 5.77 C ATOM 1254 CD GLU A 84 0.284 -7.014 7.418 1.00 6.38 C ATOM 1255 OE1 GLU A 84 -0.894 -7.351 7.174 1.00 6.86 O ATOM 1256 OE2 GLU A 84 0.809 -7.125 8.546 1.00 6.68 O ATOM 0 H GLU A 84 4.116 -6.341 5.333 1.00 4.72 H new ATOM 0 HA GLU A 84 2.985 -8.162 7.275 1.00 5.16 H new ATOM 0 HB2 GLU A 84 2.156 -7.111 4.534 1.00 5.11 H new ATOM 0 HB3 GLU A 84 1.237 -8.363 5.346 1.00 5.11 H new ATOM 0 HG2 GLU A 84 1.823 -5.714 6.692 1.00 5.77 H new ATOM 0 HG3 GLU A 84 0.468 -5.903 5.596 1.00 5.77 H new ATOM 1263 N ILE A 85 4.530 -9.329 4.627 1.00 3.98 N ATOM 1264 CA ILE A 85 4.988 -10.576 3.975 1.00 3.69 C ATOM 1265 C ILE A 85 5.725 -11.507 4.909 1.00 4.63 C ATOM 1266 O ILE A 85 5.283 -12.636 5.135 1.00 5.03 O ATOM 1267 CB ILE A 85 5.820 -10.330 2.685 1.00 2.77 C ATOM 1268 CG1 ILE A 85 6.833 -9.190 2.853 1.00 3.16 C ATOM 1269 CG2 ILE A 85 4.888 -10.020 1.535 1.00 1.99 C ATOM 1270 CD1 ILE A 85 8.214 -9.501 2.311 1.00 3.97 C ATOM 0 H ILE A 85 4.971 -8.481 4.270 1.00 3.98 H new ATOM 0 HA ILE A 85 4.065 -11.074 3.679 1.00 3.69 H new ATOM 0 HB ILE A 85 6.385 -11.239 2.479 1.00 2.77 H new ATOM 0 HG12 ILE A 85 6.450 -8.302 2.351 1.00 3.16 H new ATOM 0 HG13 ILE A 85 6.917 -8.947 3.912 1.00 3.16 H new ATOM 0 HG21 ILE A 85 5.471 -9.847 0.630 1.00 1.99 H new ATOM 0 HG22 ILE A 85 4.213 -10.861 1.377 1.00 1.99 H new ATOM 0 HG23 ILE A 85 4.307 -9.128 1.768 1.00 1.99 H new ATOM 0 HD11 ILE A 85 8.869 -8.644 2.469 1.00 3.97 H new ATOM 0 HD12 ILE A 85 8.621 -10.369 2.829 1.00 3.97 H new ATOM 0 HD13 ILE A 85 8.147 -9.714 1.244 1.00 3.97 H new ATOM 1282 N ARG A 86 6.827 -11.033 5.459 1.00 5.19 N ATOM 1283 CA ARG A 86 7.613 -11.816 6.417 1.00 6.32 C ATOM 1284 C ARG A 86 6.758 -12.241 7.589 1.00 7.11 C ATOM 1285 O ARG A 86 7.056 -13.226 8.272 1.00 7.98 O ATOM 1286 CB ARG A 86 8.739 -10.988 6.992 1.00 6.99 C ATOM 1287 CG ARG A 86 10.038 -11.087 6.211 1.00 7.36 C ATOM 1288 CD ARG A 86 11.117 -10.195 6.802 1.00 8.25 C ATOM 1289 NE ARG A 86 12.373 -10.277 6.046 1.00 8.76 N ATOM 1290 CZ ARG A 86 13.482 -9.579 6.332 1.00 9.65 C ATOM 1291 NH1 ARG A 86 13.519 -8.734 7.360 1.00 10.08 N ATOM 1292 NH2 ARG A 86 14.563 -9.732 5.579 1.00 10.26 N ATOM 0 H ARG A 86 7.206 -10.107 5.263 1.00 5.19 H new ATOM 0 HA ARG A 86 7.998 -12.680 5.875 1.00 6.32 H new ATOM 0 HB2 ARG A 86 8.427 -9.944 7.028 1.00 6.99 H new ATOM 0 HB3 ARG A 86 8.920 -11.303 8.020 1.00 6.99 H new ATOM 0 HG2 ARG A 86 10.382 -12.121 6.207 1.00 7.36 H new ATOM 0 HG3 ARG A 86 9.861 -10.806 5.173 1.00 7.36 H new ATOM 0 HD2 ARG A 86 10.768 -9.163 6.814 1.00 8.25 H new ATOM 0 HD3 ARG A 86 11.298 -10.482 7.838 1.00 8.25 H new ATOM 0 HE ARG A 86 12.404 -10.910 5.247 1.00 8.76 H new ATOM 0 HH11 ARG A 86 12.694 -8.608 7.947 1.00 10.08 H new ATOM 0 HH12 ARG A 86 14.372 -8.212 7.561 1.00 10.08 H new ATOM 0 HH21 ARG A 86 14.547 -10.377 4.789 1.00 10.26 H new ATOM 0 HH22 ARG A 86 15.410 -9.205 5.790 1.00 10.26 H new ATOM 1306 N GLU A 87 5.686 -11.476 7.801 1.00 6.95 N ATOM 1307 CA GLU A 87 4.810 -11.718 8.925 1.00 7.91 C ATOM 1308 C GLU A 87 3.725 -12.746 8.605 1.00 7.97 C ATOM 1309 O GLU A 87 3.261 -13.478 9.484 1.00 8.94 O ATOM 1310 CB GLU A 87 4.180 -10.417 9.426 1.00 8.02 C ATOM 1311 CG GLU A 87 5.099 -9.597 10.318 1.00 8.75 C ATOM 1312 CD GLU A 87 4.382 -8.445 10.994 1.00 9.11 C ATOM 1313 OE1 GLU A 87 3.724 -8.682 12.029 1.00 9.62 O ATOM 1314 OE2 GLU A 87 4.479 -7.306 10.491 1.00 9.05 O ATOM 0 H GLU A 87 5.413 -10.692 7.209 1.00 6.95 H new ATOM 0 HA GLU A 87 5.431 -12.134 9.719 1.00 7.91 H new ATOM 0 HB2 GLU A 87 3.886 -9.812 8.568 1.00 8.02 H new ATOM 0 HB3 GLU A 87 3.269 -10.653 9.977 1.00 8.02 H new ATOM 0 HG2 GLU A 87 5.534 -10.245 11.079 1.00 8.75 H new ATOM 0 HG3 GLU A 87 5.924 -9.207 9.722 1.00 8.75 H new ATOM 1321 N ALA A 88 3.341 -12.776 7.327 1.00 7.00 N ATOM 1322 CA ALA A 88 2.285 -13.657 6.826 1.00 7.06 C ATOM 1323 C ALA A 88 2.790 -15.058 6.487 1.00 7.01 C ATOM 1324 O ALA A 88 2.200 -16.051 6.893 1.00 7.73 O ATOM 1325 CB ALA A 88 1.643 -13.041 5.607 1.00 6.21 C ATOM 0 H ALA A 88 3.757 -12.186 6.607 1.00 7.00 H new ATOM 0 HA ALA A 88 1.554 -13.765 7.627 1.00 7.06 H new ATOM 0 HB1 ALA A 88 0.857 -13.700 5.237 1.00 6.21 H new ATOM 0 HB2 ALA A 88 1.212 -12.075 5.872 1.00 6.21 H new ATOM 0 HB3 ALA A 88 2.395 -12.902 4.831 1.00 6.21 H new ATOM 1331 N PHE A 89 3.842 -15.130 5.677 1.00 6.21 N ATOM 1332 CA PHE A 89 4.473 -16.404 5.289 1.00 6.21 C ATOM 1333 C PHE A 89 4.798 -17.338 6.464 1.00 7.49 C ATOM 1334 O PHE A 89 5.002 -18.538 6.261 1.00 7.70 O ATOM 1335 CB PHE A 89 5.713 -16.103 4.467 1.00 5.56 C ATOM 1336 CG PHE A 89 5.336 -15.661 3.102 1.00 4.24 C ATOM 1337 CD1 PHE A 89 5.294 -16.575 2.075 1.00 3.84 C ATOM 1338 CD2 PHE A 89 4.967 -14.345 2.854 1.00 3.79 C ATOM 1339 CE1 PHE A 89 4.902 -16.198 0.831 1.00 2.77 C ATOM 1340 CE2 PHE A 89 4.584 -13.961 1.611 1.00 2.72 C ATOM 1341 CZ PHE A 89 4.549 -14.894 0.592 1.00 1.93 C ATOM 0 H PHE A 89 4.288 -14.310 5.266 1.00 6.21 H new ATOM 0 HA PHE A 89 3.743 -16.957 4.697 1.00 6.21 H new ATOM 0 HB2 PHE A 89 6.302 -15.328 4.957 1.00 5.56 H new ATOM 0 HB3 PHE A 89 6.342 -16.991 4.407 1.00 5.56 H new ATOM 0 HD1 PHE A 89 5.575 -17.601 2.260 1.00 3.84 H new ATOM 0 HD2 PHE A 89 4.985 -13.623 3.657 1.00 3.79 H new ATOM 0 HE1 PHE A 89 4.868 -16.923 0.031 1.00 2.77 H new ATOM 0 HE2 PHE A 89 4.309 -12.935 1.419 1.00 2.72 H new ATOM 0 HZ PHE A 89 4.242 -14.595 -0.399 1.00 1.93 H new ATOM 1351 N ARG A 90 4.845 -16.784 7.681 1.00 8.36 N ATOM 1352 CA ARG A 90 5.092 -17.577 8.888 1.00 9.63 C ATOM 1353 C ARG A 90 3.802 -18.285 9.333 1.00 10.20 C ATOM 1354 O ARG A 90 3.833 -19.156 10.208 1.00 11.20 O ATOM 1355 CB ARG A 90 5.626 -16.690 10.019 1.00 10.38 C ATOM 1356 CG ARG A 90 7.076 -16.267 9.834 1.00 10.73 C ATOM 1357 CD ARG A 90 7.588 -15.489 11.036 1.00 11.51 C ATOM 1358 NE ARG A 90 8.994 -15.100 10.879 1.00 12.01 N ATOM 1359 CZ ARG A 90 9.796 -14.714 11.882 1.00 12.77 C ATOM 1360 NH1 ARG A 90 9.352 -14.658 13.137 1.00 13.10 N ATOM 1361 NH2 ARG A 90 11.054 -14.384 11.624 1.00 13.29 N ATOM 0 H ARG A 90 4.715 -15.787 7.855 1.00 8.36 H new ATOM 0 HA ARG A 90 5.845 -18.330 8.656 1.00 9.63 H new ATOM 0 HB2 ARG A 90 5.004 -15.798 10.094 1.00 10.38 H new ATOM 0 HB3 ARG A 90 5.531 -17.225 10.964 1.00 10.38 H new ATOM 0 HG2 ARG A 90 7.697 -17.150 9.680 1.00 10.73 H new ATOM 0 HG3 ARG A 90 7.165 -15.654 8.937 1.00 10.73 H new ATOM 0 HD2 ARG A 90 6.978 -14.597 11.177 1.00 11.51 H new ATOM 0 HD3 ARG A 90 7.478 -16.096 11.935 1.00 11.51 H new ATOM 0 HE ARG A 90 9.390 -15.125 9.939 1.00 12.01 H new ATOM 0 HH11 ARG A 90 8.387 -14.911 13.348 1.00 13.10 H new ATOM 0 HH12 ARG A 90 9.977 -14.362 13.886 1.00 13.10 H new ATOM 0 HH21 ARG A 90 11.406 -14.425 10.668 1.00 13.29 H new ATOM 0 HH22 ARG A 90 11.670 -14.089 12.382 1.00 13.29 H new ATOM 1375 N VAL A 91 2.672 -17.897 8.710 1.00 9.66 N ATOM 1376 CA VAL A 91 1.376 -18.458 8.993 1.00 10.29 C ATOM 1377 C VAL A 91 0.977 -19.497 7.951 1.00 9.81 C ATOM 1378 O VAL A 91 0.336 -20.501 8.275 1.00 10.52 O ATOM 1379 CB VAL A 91 0.261 -17.395 8.999 1.00 10.33 C ATOM 1380 CG1 VAL A 91 -0.725 -17.633 10.135 1.00 11.64 C ATOM 1381 CG2 VAL A 91 0.789 -15.968 9.034 1.00 9.85 C ATOM 0 H VAL A 91 2.655 -17.175 7.990 1.00 9.66 H new ATOM 0 HA VAL A 91 1.473 -18.907 9.981 1.00 10.29 H new ATOM 0 HB VAL A 91 -0.264 -17.508 8.050 1.00 10.33 H new ATOM 0 HG11 VAL A 91 -1.499 -16.866 10.112 1.00 11.64 H new ATOM 0 HG12 VAL A 91 -1.183 -18.615 10.019 1.00 11.64 H new ATOM 0 HG13 VAL A 91 -0.199 -17.588 11.089 1.00 11.64 H new ATOM 0 HG21 VAL A 91 -0.048 -15.270 9.037 1.00 9.85 H new ATOM 0 HG22 VAL A 91 1.385 -15.823 9.935 1.00 9.85 H new ATOM 0 HG23 VAL A 91 1.409 -15.788 8.156 1.00 9.85 H new ATOM 1391 N PHE A 92 1.370 -19.240 6.701 1.00 8.63 N ATOM 1392 CA PHE A 92 0.993 -20.106 5.577 1.00 8.08 C ATOM 1393 C PHE A 92 2.132 -20.952 5.010 1.00 7.58 C ATOM 1394 O PHE A 92 1.876 -22.050 4.520 1.00 7.57 O ATOM 1395 CB PHE A 92 0.474 -19.255 4.413 1.00 7.14 C ATOM 1396 CG PHE A 92 -0.515 -18.178 4.766 1.00 7.60 C ATOM 1397 CD1 PHE A 92 -0.082 -16.921 5.167 1.00 7.95 C ATOM 1398 CD2 PHE A 92 -1.874 -18.403 4.631 1.00 7.88 C ATOM 1399 CE1 PHE A 92 -0.984 -15.918 5.428 1.00 8.45 C ATOM 1400 CE2 PHE A 92 -2.784 -17.402 4.904 1.00 8.39 C ATOM 1401 CZ PHE A 92 -2.339 -16.155 5.300 1.00 8.62 C ATOM 0 H PHE A 92 1.948 -18.441 6.440 1.00 8.63 H new ATOM 0 HA PHE A 92 0.240 -20.777 5.991 1.00 8.08 H new ATOM 0 HB2 PHE A 92 1.328 -18.788 3.923 1.00 7.14 H new ATOM 0 HB3 PHE A 92 0.011 -19.919 3.683 1.00 7.14 H new ATOM 0 HD1 PHE A 92 0.975 -16.730 5.275 1.00 7.95 H new ATOM 0 HD2 PHE A 92 -2.226 -19.372 4.309 1.00 7.88 H new ATOM 0 HE1 PHE A 92 -0.633 -14.943 5.734 1.00 8.45 H new ATOM 0 HE2 PHE A 92 -3.843 -17.593 4.808 1.00 8.39 H new ATOM 0 HZ PHE A 92 -3.049 -15.368 5.509 1.00 8.62 H new ATOM 1411 N ALA A 93 3.373 -20.470 5.089 1.00 7.32 N ATOM 1412 CA ALA A 93 4.503 -21.208 4.519 1.00 7.11 C ATOM 1413 C ALA A 93 5.302 -21.980 5.584 1.00 8.33 C ATOM 1414 O ALA A 93 6.367 -21.539 6.033 1.00 8.83 O ATOM 1415 CB ALA A 93 5.380 -20.267 3.683 1.00 6.22 C ATOM 0 H ALA A 93 3.620 -19.586 5.534 1.00 7.32 H new ATOM 0 HA ALA A 93 4.106 -21.973 3.852 1.00 7.11 H new ATOM 0 HB1 ALA A 93 6.217 -20.826 3.264 1.00 6.22 H new ATOM 0 HB2 ALA A 93 4.787 -19.840 2.874 1.00 6.22 H new ATOM 0 HB3 ALA A 93 5.760 -19.465 4.316 1.00 6.22 H new ATOM 1421 N LYS A 94 4.746 -23.140 5.999 1.00 8.92 N ATOM 1422 CA LYS A 94 5.368 -24.034 6.996 1.00 10.13 C ATOM 1423 C LYS A 94 4.602 -25.374 7.094 1.00 10.64 C ATOM 1424 O LYS A 94 3.861 -25.626 8.054 1.00 11.32 O ATOM 1425 CB LYS A 94 5.563 -23.353 8.398 1.00 10.90 C ATOM 1426 CG LYS A 94 4.289 -22.972 9.175 1.00 11.36 C ATOM 1427 CD LYS A 94 3.328 -22.148 8.332 1.00 11.16 C ATOM 1428 CE LYS A 94 2.252 -23.026 7.709 1.00 10.61 C ATOM 1429 NZ LYS A 94 1.278 -23.544 8.713 1.00 11.01 N ATOM 0 H LYS A 94 3.851 -23.482 5.650 1.00 8.92 H new ATOM 0 HA LYS A 94 6.374 -24.253 6.640 1.00 10.13 H new ATOM 0 HB2 LYS A 94 6.152 -24.025 9.022 1.00 10.90 H new ATOM 0 HB3 LYS A 94 6.156 -22.449 8.256 1.00 10.90 H new ATOM 0 HG2 LYS A 94 3.787 -23.878 9.514 1.00 11.36 H new ATOM 0 HG3 LYS A 94 4.564 -22.408 10.066 1.00 11.36 H new ATOM 0 HD2 LYS A 94 2.862 -21.381 8.951 1.00 11.16 H new ATOM 0 HD3 LYS A 94 3.880 -21.632 7.547 1.00 11.16 H new ATOM 0 HE2 LYS A 94 1.717 -22.454 6.951 1.00 10.61 H new ATOM 0 HE3 LYS A 94 2.724 -23.866 7.200 1.00 10.61 H new ATOM 0 HZ1 LYS A 94 0.411 -23.852 8.229 1.00 11.01 H new ATOM 0 HZ2 LYS A 94 1.697 -24.350 9.219 1.00 11.01 H new ATOM 0 HZ3 LYS A 94 1.046 -22.791 9.392 1.00 11.01 H new ATOM 1443 N ASP A 95 4.781 -26.225 6.075 1.00 10.41 N ATOM 1444 CA ASP A 95 4.108 -27.520 6.006 1.00 10.95 C ATOM 1445 C ASP A 95 5.037 -28.698 6.332 1.00 11.36 C ATOM 1446 O ASP A 95 4.750 -29.851 5.981 1.00 11.72 O ATOM 1447 CB ASP A 95 3.449 -27.696 4.631 1.00 10.75 C ATOM 1448 CG ASP A 95 2.204 -28.564 4.683 1.00 10.79 C ATOM 1449 OD1 ASP A 95 1.105 -28.013 4.903 1.00 11.08 O ATOM 1450 OD2 ASP A 95 2.329 -29.794 4.504 1.00 10.72 O ATOM 0 H ASP A 95 5.393 -26.033 5.282 1.00 10.41 H new ATOM 0 HA ASP A 95 3.337 -27.525 6.777 1.00 10.95 H new ATOM 0 HB2 ASP A 95 3.187 -26.717 4.230 1.00 10.75 H new ATOM 0 HB3 ASP A 95 4.168 -28.140 3.943 1.00 10.75 H new ATOM 1455 N GLY A 96 6.125 -28.399 7.023 1.00 11.41 N ATOM 1456 CA GLY A 96 7.102 -29.424 7.377 1.00 11.89 C ATOM 1457 C GLY A 96 8.493 -29.047 6.966 1.00 11.67 C ATOM 1458 O GLY A 96 9.300 -28.558 7.760 1.00 11.82 O ATOM 0 H GLY A 96 6.356 -27.461 7.350 1.00 11.41 H new ATOM 0 HA2 GLY A 96 7.076 -29.592 8.454 1.00 11.89 H new ATOM 0 HA3 GLY A 96 6.827 -30.365 6.901 1.00 11.89 H new ATOM 1462 N ASN A 97 8.738 -29.297 5.690 1.00 11.48 N ATOM 1463 CA ASN A 97 9.996 -29.026 5.014 1.00 11.39 C ATOM 1464 C ASN A 97 10.310 -27.525 4.971 1.00 11.24 C ATOM 1465 O ASN A 97 11.456 -27.112 4.771 1.00 11.69 O ATOM 1466 CB ASN A 97 9.834 -29.583 3.623 1.00 10.47 C ATOM 1467 CG ASN A 97 11.145 -29.998 2.978 1.00 10.82 C ATOM 1468 OD1 ASN A 97 11.581 -31.142 3.110 1.00 11.12 O ATOM 1469 ND2 ASN A 97 11.780 -29.066 2.277 1.00 10.95 N ATOM 0 H ASN A 97 8.039 -29.710 5.073 1.00 11.48 H new ATOM 0 HA ASN A 97 10.831 -29.485 5.542 1.00 11.39 H new ATOM 0 HB2 ASN A 97 9.168 -30.445 3.661 1.00 10.47 H new ATOM 0 HB3 ASN A 97 9.351 -28.835 2.995 1.00 10.47 H new ATOM 0 HD21 ASN A 97 12.666 -29.286 1.822 1.00 10.95 H new ATOM 0 HD22 ASN A 97 11.382 -28.131 2.194 1.00 10.95 H new ATOM 1476 N GLY A 98 9.256 -26.748 5.166 1.00 10.71 N ATOM 1477 CA GLY A 98 9.334 -25.298 5.204 1.00 10.57 C ATOM 1478 C GLY A 98 8.690 -24.607 4.014 1.00 9.35 C ATOM 1479 O GLY A 98 8.413 -23.408 4.095 1.00 9.23 O ATOM 0 H GLY A 98 8.313 -27.111 5.304 1.00 10.71 H new ATOM 0 HA2 GLY A 98 8.856 -24.944 6.117 1.00 10.57 H new ATOM 0 HA3 GLY A 98 10.382 -25.003 5.257 1.00 10.57 H new ATOM 1483 N TYR A 99 8.397 -25.347 2.935 1.00 8.53 N ATOM 1484 CA TYR A 99 7.747 -24.753 1.782 1.00 7.35 C ATOM 1485 C TYR A 99 6.379 -25.392 1.555 1.00 6.60 C ATOM 1486 O TYR A 99 6.287 -26.575 1.208 1.00 6.68 O ATOM 1487 CB TYR A 99 8.608 -24.810 0.488 1.00 7.03 C ATOM 1488 CG TYR A 99 8.811 -26.166 -0.177 1.00 7.42 C ATOM 1489 CD1 TYR A 99 8.502 -26.338 -1.533 1.00 7.29 C ATOM 1490 CD2 TYR A 99 9.307 -27.259 0.526 1.00 8.16 C ATOM 1491 CE1 TYR A 99 8.685 -27.560 -2.151 1.00 7.85 C ATOM 1492 CE2 TYR A 99 9.490 -28.481 -0.092 1.00 8.71 C ATOM 1493 CZ TYR A 99 9.178 -28.627 -1.428 1.00 8.53 C ATOM 1494 OH TYR A 99 9.360 -29.844 -2.043 1.00 9.21 O ATOM 0 H TYR A 99 8.600 -26.343 2.846 1.00 8.53 H new ATOM 0 HA TYR A 99 7.618 -23.695 2.010 1.00 7.35 H new ATOM 0 HB2 TYR A 99 8.154 -24.143 -0.245 1.00 7.03 H new ATOM 0 HB3 TYR A 99 9.591 -24.403 0.723 1.00 7.03 H new ATOM 0 HD1 TYR A 99 8.116 -25.505 -2.102 1.00 7.29 H new ATOM 0 HD2 TYR A 99 9.553 -27.151 1.572 1.00 8.16 H new ATOM 0 HE1 TYR A 99 8.443 -27.680 -3.197 1.00 7.85 H new ATOM 0 HE2 TYR A 99 9.876 -29.319 0.469 1.00 8.71 H new ATOM 0 HH TYR A 99 9.715 -30.488 -1.395 1.00 9.21 H new ATOM 1504 N ILE A 100 5.317 -24.614 1.779 1.00 6.19 N ATOM 1505 CA ILE A 100 3.953 -25.100 1.565 1.00 5.73 C ATOM 1506 C ILE A 100 3.643 -25.056 0.053 1.00 4.64 C ATOM 1507 O ILE A 100 4.541 -24.780 -0.750 1.00 4.17 O ATOM 1508 CB ILE A 100 2.918 -24.276 2.413 1.00 5.84 C ATOM 1509 CG1 ILE A 100 1.601 -25.064 2.595 1.00 5.96 C ATOM 1510 CG2 ILE A 100 2.649 -22.898 1.791 1.00 5.70 C ATOM 1511 CD1 ILE A 100 0.923 -24.848 3.936 1.00 6.65 C ATOM 0 H ILE A 100 5.375 -23.650 2.107 1.00 6.19 H new ATOM 0 HA ILE A 100 3.869 -26.132 1.907 1.00 5.73 H new ATOM 0 HB ILE A 100 3.357 -24.113 3.397 1.00 5.84 H new ATOM 0 HG12 ILE A 100 0.909 -24.781 1.802 1.00 5.96 H new ATOM 0 HG13 ILE A 100 1.808 -26.127 2.473 1.00 5.96 H new ATOM 0 HG21 ILE A 100 1.929 -22.356 2.404 1.00 5.70 H new ATOM 0 HG22 ILE A 100 3.580 -22.333 1.741 1.00 5.70 H new ATOM 0 HG23 ILE A 100 2.247 -23.025 0.786 1.00 5.70 H new ATOM 0 HD11 ILE A 100 0.007 -25.437 3.980 1.00 6.65 H new ATOM 0 HD12 ILE A 100 1.593 -25.159 4.737 1.00 6.65 H new ATOM 0 HD13 ILE A 100 0.681 -23.792 4.055 1.00 6.65 H new ATOM 1523 N SER A 101 2.396 -25.330 -0.333 1.00 4.56 N ATOM 1524 CA SER A 101 2.022 -25.300 -1.731 1.00 3.87 C ATOM 1525 C SER A 101 1.860 -23.873 -2.228 1.00 3.18 C ATOM 1526 O SER A 101 1.297 -23.018 -1.538 1.00 3.33 O ATOM 1527 CB SER A 101 0.736 -26.098 -1.965 1.00 4.59 C ATOM 1528 OG SER A 101 -0.311 -25.646 -1.123 1.00 5.48 O ATOM 0 H SER A 101 1.638 -25.573 0.305 1.00 4.56 H new ATOM 0 HA SER A 101 2.827 -25.765 -2.300 1.00 3.87 H new ATOM 0 HB2 SER A 101 0.433 -26.005 -3.008 1.00 4.59 H new ATOM 0 HB3 SER A 101 0.923 -27.156 -1.780 1.00 4.59 H new ATOM 0 HG SER A 101 -1.120 -26.172 -1.295 1.00 5.48 H new ATOM 1534 N ALA A 102 2.380 -23.640 -3.437 1.00 2.74 N ATOM 1535 CA ALA A 102 2.318 -22.328 -4.122 1.00 2.63 C ATOM 1536 C ALA A 102 0.907 -21.704 -4.142 1.00 3.39 C ATOM 1537 O ALA A 102 0.762 -20.503 -4.388 1.00 3.61 O ATOM 1538 CB ALA A 102 2.838 -22.468 -5.545 1.00 3.06 C ATOM 0 H ALA A 102 2.862 -24.357 -3.979 1.00 2.74 H new ATOM 0 HA ALA A 102 2.947 -21.649 -3.546 1.00 2.63 H new ATOM 0 HB1 ALA A 102 2.791 -21.501 -6.046 1.00 3.06 H new ATOM 0 HB2 ALA A 102 3.871 -22.815 -5.522 1.00 3.06 H new ATOM 0 HB3 ALA A 102 2.225 -23.188 -6.087 1.00 3.06 H new ATOM 1544 N ALA A 103 -0.118 -22.533 -3.881 1.00 4.09 N ATOM 1545 CA ALA A 103 -1.520 -22.094 -3.860 1.00 5.20 C ATOM 1546 C ALA A 103 -1.849 -21.204 -2.649 1.00 5.47 C ATOM 1547 O ALA A 103 -2.846 -20.476 -2.672 1.00 6.33 O ATOM 1548 CB ALA A 103 -2.442 -23.304 -3.883 1.00 5.96 C ATOM 0 H ALA A 103 0.004 -23.525 -3.679 1.00 4.09 H new ATOM 0 HA ALA A 103 -1.678 -21.487 -4.752 1.00 5.20 H new ATOM 0 HB1 ALA A 103 -3.480 -22.971 -3.867 1.00 5.96 H new ATOM 0 HB2 ALA A 103 -2.260 -23.883 -4.789 1.00 5.96 H new ATOM 0 HB3 ALA A 103 -2.247 -23.926 -3.010 1.00 5.96 H new ATOM 1554 N GLU A 104 -1.011 -21.268 -1.598 1.00 4.91 N ATOM 1555 CA GLU A 104 -1.219 -20.471 -0.376 1.00 5.33 C ATOM 1556 C GLU A 104 -0.814 -19.004 -0.560 1.00 4.76 C ATOM 1557 O GLU A 104 -1.423 -18.119 0.041 1.00 5.38 O ATOM 1558 CB GLU A 104 -0.453 -21.069 0.808 1.00 5.44 C ATOM 1559 CG GLU A 104 -1.052 -22.361 1.358 1.00 6.31 C ATOM 1560 CD GLU A 104 -2.292 -22.130 2.206 1.00 6.92 C ATOM 1561 OE1 GLU A 104 -2.147 -21.945 3.432 1.00 7.26 O ATOM 1562 OE2 GLU A 104 -3.406 -22.134 1.641 1.00 7.37 O ATOM 0 H GLU A 104 -0.183 -21.864 -1.571 1.00 4.91 H new ATOM 0 HA GLU A 104 -2.288 -20.501 -0.168 1.00 5.33 H new ATOM 0 HB2 GLU A 104 0.575 -21.261 0.500 1.00 5.44 H new ATOM 0 HB3 GLU A 104 -0.413 -20.331 1.609 1.00 5.44 H new ATOM 0 HG2 GLU A 104 -1.305 -23.020 0.527 1.00 6.31 H new ATOM 0 HG3 GLU A 104 -0.301 -22.877 1.956 1.00 6.31 H new ATOM 1569 N LEU A 105 0.239 -18.760 -1.365 1.00 3.64 N ATOM 1570 CA LEU A 105 0.735 -17.403 -1.672 1.00 3.09 C ATOM 1571 C LEU A 105 -0.359 -16.456 -2.095 1.00 4.03 C ATOM 1572 O LEU A 105 -0.376 -15.289 -1.696 1.00 4.13 O ATOM 1573 CB LEU A 105 1.742 -17.447 -2.822 1.00 2.35 C ATOM 1574 CG LEU A 105 2.805 -18.560 -2.760 1.00 1.65 C ATOM 1575 CD1 LEU A 105 3.434 -18.786 -4.122 1.00 2.00 C ATOM 1576 CD2 LEU A 105 3.865 -18.220 -1.727 1.00 1.38 C ATOM 0 H LEU A 105 0.771 -19.500 -1.822 1.00 3.64 H new ATOM 0 HA LEU A 105 1.187 -17.045 -0.747 1.00 3.09 H new ATOM 0 HB2 LEU A 105 1.190 -17.554 -3.756 1.00 2.35 H new ATOM 0 HB3 LEU A 105 2.255 -16.486 -2.863 1.00 2.35 H new ATOM 0 HG LEU A 105 2.314 -19.486 -2.461 1.00 1.65 H new ATOM 0 HD11 LEU A 105 4.181 -19.577 -4.051 1.00 2.00 H new ATOM 0 HD12 LEU A 105 2.663 -19.078 -4.835 1.00 2.00 H new ATOM 0 HD13 LEU A 105 3.911 -17.866 -4.460 1.00 2.00 H new ATOM 0 HD21 LEU A 105 4.609 -19.015 -1.694 1.00 1.38 H new ATOM 0 HD22 LEU A 105 4.349 -17.281 -1.997 1.00 1.38 H new ATOM 0 HD23 LEU A 105 3.399 -18.119 -0.747 1.00 1.38 H new ATOM 1588 N ARG A 106 -1.261 -16.973 -2.913 1.00 4.83 N ATOM 1589 CA ARG A 106 -2.376 -16.186 -3.421 1.00 5.95 C ATOM 1590 C ARG A 106 -3.280 -15.779 -2.275 1.00 6.65 C ATOM 1591 O ARG A 106 -3.999 -14.795 -2.354 1.00 7.39 O ATOM 1592 CB ARG A 106 -3.195 -16.937 -4.491 1.00 6.81 C ATOM 1593 CG ARG A 106 -2.386 -17.591 -5.621 1.00 6.46 C ATOM 1594 CD ARG A 106 -2.011 -19.008 -5.266 1.00 5.99 C ATOM 1595 NE ARG A 106 -3.042 -19.971 -5.672 1.00 6.40 N ATOM 1596 CZ ARG A 106 -2.911 -20.856 -6.672 1.00 6.89 C ATOM 1597 NH1 ARG A 106 -1.793 -20.924 -7.393 1.00 7.08 N ATOM 1598 NH2 ARG A 106 -3.912 -21.679 -6.952 1.00 7.37 N ATOM 0 H ARG A 106 -1.244 -17.939 -3.241 1.00 4.83 H new ATOM 0 HA ARG A 106 -1.955 -15.302 -3.900 1.00 5.95 H new ATOM 0 HB2 ARG A 106 -3.780 -17.711 -3.995 1.00 6.81 H new ATOM 0 HB3 ARG A 106 -3.903 -16.238 -4.936 1.00 6.81 H new ATOM 0 HG2 ARG A 106 -2.970 -17.585 -6.542 1.00 6.46 H new ATOM 0 HG3 ARG A 106 -1.484 -17.009 -5.812 1.00 6.46 H new ATOM 0 HD2 ARG A 106 -1.067 -19.264 -5.747 1.00 5.99 H new ATOM 0 HD3 ARG A 106 -1.851 -19.081 -4.190 1.00 5.99 H new ATOM 0 HE ARG A 106 -3.922 -19.967 -5.156 1.00 6.40 H new ATOM 0 HH11 ARG A 106 -1.016 -20.296 -7.189 1.00 7.08 H new ATOM 0 HH12 ARG A 106 -1.714 -21.604 -8.149 1.00 7.08 H new ATOM 0 HH21 ARG A 106 -4.774 -21.637 -6.409 1.00 7.37 H new ATOM 0 HH22 ARG A 106 -3.820 -22.354 -7.711 1.00 7.37 H new ATOM 1612 N HIS A 107 -3.238 -16.592 -1.233 1.00 6.60 N ATOM 1613 CA HIS A 107 -3.959 -16.343 -0.005 1.00 7.43 C ATOM 1614 C HIS A 107 -3.100 -15.490 0.941 1.00 6.90 C ATOM 1615 O HIS A 107 -3.630 -14.881 1.872 1.00 7.61 O ATOM 1616 CB HIS A 107 -4.355 -17.658 0.674 1.00 8.00 C ATOM 1617 CG HIS A 107 -5.420 -18.419 -0.057 1.00 8.87 C ATOM 1618 ND1 HIS A 107 -6.747 -18.406 0.318 1.00 9.79 N ATOM 1619 CD2 HIS A 107 -5.347 -19.220 -1.147 1.00 9.07 C ATOM 1620 CE1 HIS A 107 -7.444 -19.165 -0.509 1.00 10.41 C ATOM 1621 NE2 HIS A 107 -6.618 -19.669 -1.406 1.00 10.03 N ATOM 0 H HIS A 107 -2.693 -17.454 -1.220 1.00 6.60 H new ATOM 0 HA HIS A 107 -4.873 -15.799 -0.245 1.00 7.43 H new ATOM 0 HB2 HIS A 107 -3.471 -18.288 0.768 1.00 8.00 H new ATOM 0 HB3 HIS A 107 -4.703 -17.444 1.685 1.00 8.00 H new ATOM 0 HD2 HIS A 107 -4.456 -19.460 -1.707 1.00 9.07 H new ATOM 0 HE1 HIS A 107 -8.508 -19.343 -0.459 1.00 10.41 H new ATOM 0 HE2 HIS A 107 -6.882 -20.292 -2.169 1.00 10.03 H new ATOM 1630 N VAL A 108 -1.763 -15.457 0.694 1.00 5.69 N ATOM 1631 CA VAL A 108 -0.834 -14.681 1.517 1.00 5.20 C ATOM 1632 C VAL A 108 -0.750 -13.235 1.065 1.00 4.84 C ATOM 1633 O VAL A 108 -1.062 -12.324 1.836 1.00 5.36 O ATOM 1634 CB VAL A 108 0.597 -15.310 1.514 1.00 4.27 C ATOM 1635 CG1 VAL A 108 1.562 -14.508 2.374 1.00 4.16 C ATOM 1636 CG2 VAL A 108 0.581 -16.771 1.937 1.00 4.80 C ATOM 0 H VAL A 108 -1.318 -15.963 -0.071 1.00 5.69 H new ATOM 0 HA VAL A 108 -1.230 -14.705 2.532 1.00 5.20 H new ATOM 0 HB VAL A 108 0.952 -15.272 0.484 1.00 4.27 H new ATOM 0 HG11 VAL A 108 2.547 -14.975 2.348 1.00 4.16 H new ATOM 0 HG12 VAL A 108 1.633 -13.490 1.990 1.00 4.16 H new ATOM 0 HG13 VAL A 108 1.199 -14.483 3.402 1.00 4.16 H new ATOM 0 HG21 VAL A 108 1.597 -17.166 1.920 1.00 4.80 H new ATOM 0 HG22 VAL A 108 0.177 -16.853 2.946 1.00 4.80 H new ATOM 0 HG23 VAL A 108 -0.042 -17.342 1.249 1.00 4.80 H new ATOM 1646 N MET A 109 -0.273 -13.037 -0.159 1.00 4.11 N ATOM 1647 CA MET A 109 -0.188 -11.700 -0.753 1.00 4.08 C ATOM 1648 C MET A 109 -1.549 -11.024 -0.680 1.00 5.33 C ATOM 1649 O MET A 109 -1.636 -9.822 -0.423 1.00 5.53 O ATOM 1650 CB MET A 109 0.330 -11.761 -2.177 1.00 3.81 C ATOM 1651 CG MET A 109 1.855 -11.783 -2.235 1.00 2.70 C ATOM 1652 SD MET A 109 2.505 -11.812 -3.908 1.00 3.27 S ATOM 1653 CE MET A 109 2.176 -13.506 -4.342 1.00 3.46 C ATOM 0 H MET A 109 0.063 -13.786 -0.764 1.00 4.11 H new ATOM 0 HA MET A 109 0.527 -11.105 -0.185 1.00 4.08 H new ATOM 0 HB2 MET A 109 -0.063 -12.652 -2.667 1.00 3.81 H new ATOM 0 HB3 MET A 109 -0.041 -10.900 -2.734 1.00 3.81 H new ATOM 0 HG2 MET A 109 2.243 -10.906 -1.717 1.00 2.70 H new ATOM 0 HG3 MET A 109 2.219 -12.658 -1.697 1.00 2.70 H new ATOM 0 HE1 MET A 109 2.092 -13.594 -5.425 1.00 3.46 H new ATOM 0 HE2 MET A 109 2.991 -14.137 -3.988 1.00 3.46 H new ATOM 0 HE3 MET A 109 1.243 -13.826 -3.879 1.00 3.46 H new ATOM 1663 N THR A 110 -2.619 -11.813 -0.915 1.00 6.20 N ATOM 1664 CA THR A 110 -3.985 -11.301 -0.743 1.00 7.45 C ATOM 1665 C THR A 110 -4.217 -10.934 0.741 1.00 7.80 C ATOM 1666 O THR A 110 -4.938 -9.976 1.033 1.00 8.54 O ATOM 1667 CB THR A 110 -5.041 -12.327 -1.205 1.00 8.32 C ATOM 1668 OG1 THR A 110 -4.812 -12.652 -2.578 1.00 8.16 O ATOM 1669 CG2 THR A 110 -6.472 -11.804 -1.059 1.00 9.65 C ATOM 0 H THR A 110 -2.562 -12.785 -1.218 1.00 6.20 H new ATOM 0 HA THR A 110 -4.094 -10.413 -1.365 1.00 7.45 H new ATOM 0 HB THR A 110 -4.939 -13.205 -0.567 1.00 8.32 H new ATOM 0 HG1 THR A 110 -4.119 -13.342 -2.640 1.00 8.16 H new ATOM 0 HG21 THR A 110 -7.174 -12.566 -1.398 1.00 9.65 H new ATOM 0 HG22 THR A 110 -6.669 -11.569 -0.013 1.00 9.65 H new ATOM 0 HG23 THR A 110 -6.594 -10.904 -1.662 1.00 9.65 H new ATOM 1677 N ASN A 111 -3.599 -11.706 1.671 1.00 7.42 N ATOM 1678 CA ASN A 111 -3.717 -11.424 3.113 1.00 8.00 C ATOM 1679 C ASN A 111 -2.778 -10.271 3.543 1.00 7.57 C ATOM 1680 O ASN A 111 -2.777 -9.865 4.711 1.00 8.26 O ATOM 1681 CB ASN A 111 -3.404 -12.690 3.923 1.00 7.98 C ATOM 1682 CG ASN A 111 -4.077 -12.701 5.285 1.00 9.16 C ATOM 1683 OD1 ASN A 111 -5.200 -13.184 5.432 1.00 9.84 O ATOM 1684 ND2 ASN A 111 -3.391 -12.165 6.288 1.00 9.58 N ATOM 0 H ASN A 111 -3.023 -12.517 1.446 1.00 7.42 H new ATOM 0 HA ASN A 111 -4.742 -11.112 3.312 1.00 8.00 H new ATOM 0 HB2 ASN A 111 -3.724 -13.565 3.358 1.00 7.98 H new ATOM 0 HB3 ASN A 111 -2.325 -12.773 4.056 1.00 7.98 H new ATOM 0 HD21 ASN A 111 -3.792 -12.142 7.226 1.00 9.58 H new ATOM 0 HD22 ASN A 111 -2.463 -11.776 6.121 1.00 9.58 H new ATOM 1691 N LEU A 112 -1.995 -9.750 2.582 1.00 6.48 N ATOM 1692 CA LEU A 112 -1.045 -8.665 2.817 1.00 6.02 C ATOM 1693 C LEU A 112 -1.726 -7.282 2.771 1.00 6.50 C ATOM 1694 O LEU A 112 -1.439 -6.423 3.611 1.00 6.87 O ATOM 1695 CB LEU A 112 0.133 -8.807 1.807 1.00 4.81 C ATOM 1696 CG LEU A 112 0.846 -7.529 1.320 1.00 4.44 C ATOM 1697 CD1 LEU A 112 2.236 -7.853 0.797 1.00 4.55 C ATOM 1698 CD2 LEU A 112 0.028 -6.867 0.231 1.00 4.77 C ATOM 0 H LEU A 112 -2.009 -10.077 1.616 1.00 6.48 H new ATOM 0 HA LEU A 112 -0.641 -8.741 3.827 1.00 6.02 H new ATOM 0 HB2 LEU A 112 0.884 -9.452 2.263 1.00 4.81 H new ATOM 0 HB3 LEU A 112 -0.245 -9.330 0.929 1.00 4.81 H new ATOM 0 HG LEU A 112 0.945 -6.846 2.164 1.00 4.44 H new ATOM 0 HD11 LEU A 112 2.720 -6.937 0.459 1.00 4.55 H new ATOM 0 HD12 LEU A 112 2.828 -8.304 1.593 1.00 4.55 H new ATOM 0 HD13 LEU A 112 2.158 -8.551 -0.037 1.00 4.55 H new ATOM 0 HD21 LEU A 112 0.537 -5.965 -0.109 1.00 4.77 H new ATOM 0 HD22 LEU A 112 -0.088 -7.555 -0.606 1.00 4.77 H new ATOM 0 HD23 LEU A 112 -0.954 -6.604 0.623 1.00 4.77 H new ATOM 1710 N GLY A 113 -2.618 -7.084 1.794 1.00 6.67 N ATOM 1711 CA GLY A 113 -3.304 -5.807 1.644 1.00 7.40 C ATOM 1712 C GLY A 113 -4.803 -5.929 1.761 1.00 8.34 C ATOM 1713 O GLY A 113 -5.311 -6.792 2.483 1.00 8.64 O ATOM 0 H GLY A 113 -2.877 -7.789 1.103 1.00 6.67 H new ATOM 0 HA2 GLY A 113 -2.941 -5.114 2.403 1.00 7.40 H new ATOM 0 HA3 GLY A 113 -3.054 -5.378 0.674 1.00 7.40 H new ATOM 1717 N GLU A 114 -5.508 -5.051 1.037 1.00 8.94 N ATOM 1718 CA GLU A 114 -6.975 -5.041 1.015 1.00 10.00 C ATOM 1719 C GLU A 114 -7.497 -6.214 0.190 1.00 10.47 C ATOM 1720 O GLU A 114 -8.497 -6.842 0.549 1.00 11.33 O ATOM 1721 CB GLU A 114 -7.498 -3.713 0.452 1.00 10.43 C ATOM 1722 CG GLU A 114 -7.247 -2.514 1.357 1.00 10.39 C ATOM 1723 CD GLU A 114 -7.772 -1.219 0.769 1.00 11.02 C ATOM 1724 OE1 GLU A 114 -8.945 -0.880 1.033 1.00 11.20 O ATOM 1725 OE2 GLU A 114 -7.010 -0.544 0.046 1.00 11.47 O ATOM 0 H GLU A 114 -5.080 -4.332 0.453 1.00 8.94 H new ATOM 0 HA GLU A 114 -7.338 -5.144 2.038 1.00 10.00 H new ATOM 0 HB2 GLU A 114 -7.029 -3.530 -0.515 1.00 10.43 H new ATOM 0 HB3 GLU A 114 -8.570 -3.803 0.274 1.00 10.43 H new ATOM 0 HG2 GLU A 114 -7.720 -2.688 2.324 1.00 10.39 H new ATOM 0 HG3 GLU A 114 -6.176 -2.418 1.539 1.00 10.39 H new ATOM 1732 N LYS A 115 -6.795 -6.498 -0.921 1.00 10.04 N ATOM 1733 CA LYS A 115 -7.129 -7.613 -1.823 1.00 10.61 C ATOM 1734 C LYS A 115 -6.159 -7.682 -2.991 1.00 10.14 C ATOM 1735 O LYS A 115 -5.809 -6.649 -3.573 1.00 10.70 O ATOM 1736 CB LYS A 115 -8.541 -7.531 -2.423 1.00 11.03 C ATOM 1737 CG LYS A 115 -8.723 -6.342 -3.361 1.00 10.36 C ATOM 1738 CD LYS A 115 -10.004 -5.580 -3.065 1.00 10.71 C ATOM 1739 CE LYS A 115 -9.920 -4.904 -1.704 1.00 10.61 C ATOM 1740 NZ LYS A 115 -11.261 -4.717 -1.085 1.00 10.83 N ATOM 0 H LYS A 115 -5.980 -5.961 -1.218 1.00 10.04 H new ATOM 0 HA LYS A 115 -7.067 -8.499 -1.191 1.00 10.61 H new ATOM 0 HB2 LYS A 115 -8.752 -8.451 -2.967 1.00 11.03 H new ATOM 0 HB3 LYS A 115 -9.270 -7.464 -1.615 1.00 11.03 H new ATOM 0 HG2 LYS A 115 -7.870 -5.670 -3.266 1.00 10.36 H new ATOM 0 HG3 LYS A 115 -8.739 -6.692 -4.393 1.00 10.36 H new ATOM 0 HD2 LYS A 115 -10.176 -4.832 -3.839 1.00 10.71 H new ATOM 0 HD3 LYS A 115 -10.853 -6.263 -3.087 1.00 10.71 H new ATOM 0 HE2 LYS A 115 -9.296 -5.503 -1.041 1.00 10.61 H new ATOM 0 HE3 LYS A 115 -9.433 -3.935 -1.811 1.00 10.61 H new ATOM 0 HZ1 LYS A 115 -11.155 -4.253 -0.160 1.00 10.83 H new ATOM 0 HZ2 LYS A 115 -11.849 -4.124 -1.704 1.00 10.83 H new ATOM 0 HZ3 LYS A 115 -11.717 -5.643 -0.958 1.00 10.83 H new ATOM 1754 N LEU A 116 -5.704 -8.880 -3.309 1.00 9.19 N ATOM 1755 CA LEU A 116 -4.859 -9.074 -4.473 1.00 8.69 C ATOM 1756 C LEU A 116 -5.277 -10.359 -5.184 1.00 9.07 C ATOM 1757 O LEU A 116 -5.881 -11.237 -4.557 1.00 9.05 O ATOM 1758 CB LEU A 116 -3.363 -9.098 -4.113 1.00 7.40 C ATOM 1759 CG LEU A 116 -2.780 -7.760 -3.637 1.00 6.84 C ATOM 1760 CD1 LEU A 116 -2.878 -7.630 -2.123 1.00 6.44 C ATOM 1761 CD2 LEU A 116 -1.336 -7.617 -4.092 1.00 6.43 C ATOM 0 H LEU A 116 -5.904 -9.729 -2.781 1.00 9.19 H new ATOM 0 HA LEU A 116 -4.995 -8.225 -5.142 1.00 8.69 H new ATOM 0 HB2 LEU A 116 -3.206 -9.842 -3.332 1.00 7.40 H new ATOM 0 HB3 LEU A 116 -2.802 -9.430 -4.986 1.00 7.40 H new ATOM 0 HG LEU A 116 -3.366 -6.957 -4.084 1.00 6.84 H new ATOM 0 HD11 LEU A 116 -2.458 -6.673 -1.812 1.00 6.44 H new ATOM 0 HD12 LEU A 116 -3.924 -7.683 -1.820 1.00 6.44 H new ATOM 0 HD13 LEU A 116 -2.322 -8.441 -1.651 1.00 6.44 H new ATOM 0 HD21 LEU A 116 -0.938 -6.663 -3.746 1.00 6.43 H new ATOM 0 HD22 LEU A 116 -0.741 -8.430 -3.676 1.00 6.43 H new ATOM 0 HD23 LEU A 116 -1.292 -7.655 -5.180 1.00 6.43 H new ATOM 1773 N THR A 117 -4.970 -10.483 -6.479 1.00 9.56 N ATOM 1774 CA THR A 117 -5.352 -11.666 -7.219 1.00 10.01 C ATOM 1775 C THR A 117 -4.251 -12.677 -7.377 1.00 9.24 C ATOM 1776 O THR A 117 -3.141 -12.548 -6.854 1.00 8.29 O ATOM 1777 CB THR A 117 -5.878 -11.366 -8.632 1.00 11.26 C ATOM 1778 OG1 THR A 117 -5.054 -10.389 -9.282 1.00 11.46 O ATOM 1779 CG2 THR A 117 -7.298 -10.886 -8.554 1.00 12.18 C ATOM 0 H THR A 117 -4.464 -9.783 -7.021 1.00 9.56 H new ATOM 0 HA THR A 117 -6.146 -12.079 -6.597 1.00 10.01 H new ATOM 0 HB THR A 117 -5.845 -12.283 -9.221 1.00 11.26 H new ATOM 0 HG1 THR A 117 -5.403 -10.212 -10.180 1.00 11.46 H new ATOM 0 HG21 THR A 117 -7.666 -10.675 -9.558 1.00 12.18 H new ATOM 0 HG22 THR A 117 -7.918 -11.656 -8.095 1.00 12.18 H new ATOM 0 HG23 THR A 117 -7.343 -9.978 -7.953 1.00 12.18 H new ATOM 1787 N ASP A 118 -4.636 -13.694 -8.126 1.00 9.74 N ATOM 1788 CA ASP A 118 -3.812 -14.816 -8.496 1.00 9.28 C ATOM 1789 C ASP A 118 -2.833 -14.454 -9.585 1.00 9.42 C ATOM 1790 O ASP A 118 -1.768 -15.057 -9.691 1.00 8.80 O ATOM 1791 CB ASP A 118 -4.749 -15.894 -8.982 1.00 10.08 C ATOM 1792 CG ASP A 118 -5.257 -16.784 -7.863 1.00 9.81 C ATOM 1793 OD1 ASP A 118 -4.674 -17.869 -7.658 1.00 9.86 O ATOM 1794 OD2 ASP A 118 -6.236 -16.394 -7.193 1.00 9.76 O ATOM 0 H ASP A 118 -5.579 -13.757 -8.509 1.00 9.74 H new ATOM 0 HA ASP A 118 -3.221 -15.146 -7.642 1.00 9.28 H new ATOM 0 HB2 ASP A 118 -5.598 -15.431 -9.485 1.00 10.08 H new ATOM 0 HB3 ASP A 118 -4.236 -16.507 -9.723 1.00 10.08 H new ATOM 1799 N GLU A 119 -3.212 -13.471 -10.398 1.00 10.37 N ATOM 1800 CA GLU A 119 -2.353 -12.980 -11.467 1.00 10.83 C ATOM 1801 C GLU A 119 -1.160 -12.259 -10.866 1.00 10.04 C ATOM 1802 O GLU A 119 -0.129 -12.085 -11.517 1.00 10.27 O ATOM 1803 CB GLU A 119 -3.115 -12.075 -12.445 1.00 12.10 C ATOM 1804 CG GLU A 119 -4.111 -12.812 -13.336 1.00 13.08 C ATOM 1805 CD GLU A 119 -3.452 -13.511 -14.513 1.00 14.16 C ATOM 1806 OE1 GLU A 119 -3.320 -12.878 -15.581 1.00 14.50 O ATOM 1807 OE2 GLU A 119 -3.067 -14.690 -14.364 1.00 14.78 O ATOM 0 H GLU A 119 -4.114 -12.998 -10.334 1.00 10.37 H new ATOM 0 HA GLU A 119 -2.001 -13.834 -12.045 1.00 10.83 H new ATOM 0 HB2 GLU A 119 -3.648 -11.313 -11.877 1.00 12.10 H new ATOM 0 HB3 GLU A 119 -2.395 -11.555 -13.077 1.00 12.10 H new ATOM 0 HG2 GLU A 119 -4.649 -13.548 -12.738 1.00 13.08 H new ATOM 0 HG3 GLU A 119 -4.850 -12.103 -13.709 1.00 13.08 H new ATOM 1814 N GLU A 120 -1.333 -11.837 -9.604 1.00 9.24 N ATOM 1815 CA GLU A 120 -0.258 -11.233 -8.830 1.00 8.40 C ATOM 1816 C GLU A 120 0.765 -12.328 -8.606 1.00 7.57 C ATOM 1817 O GLU A 120 1.953 -12.144 -8.834 1.00 7.44 O ATOM 1818 CB GLU A 120 -0.757 -10.728 -7.458 1.00 7.71 C ATOM 1819 CG GLU A 120 0.130 -9.674 -6.791 1.00 7.14 C ATOM 1820 CD GLU A 120 0.133 -8.335 -7.512 1.00 8.10 C ATOM 1821 OE1 GLU A 120 0.982 -8.146 -8.409 1.00 8.52 O ATOM 1822 OE2 GLU A 120 -0.713 -7.479 -7.178 1.00 8.58 O ATOM 0 H GLU A 120 -2.218 -11.908 -9.102 1.00 9.24 H new ATOM 0 HA GLU A 120 0.151 -10.375 -9.364 1.00 8.40 H new ATOM 0 HB2 GLU A 120 -1.757 -10.312 -7.583 1.00 7.71 H new ATOM 0 HB3 GLU A 120 -0.849 -11.581 -6.786 1.00 7.71 H new ATOM 0 HG2 GLU A 120 -0.207 -9.524 -5.765 1.00 7.14 H new ATOM 0 HG3 GLU A 120 1.151 -10.051 -6.739 1.00 7.14 H new ATOM 1829 N VAL A 121 0.248 -13.509 -8.237 1.00 7.19 N ATOM 1830 CA VAL A 121 1.057 -14.653 -7.961 1.00 6.42 C ATOM 1831 C VAL A 121 1.563 -15.325 -9.240 1.00 7.15 C ATOM 1832 O VAL A 121 2.752 -15.603 -9.360 1.00 6.95 O ATOM 1833 CB VAL A 121 0.246 -15.624 -7.082 1.00 5.97 C ATOM 1834 CG1 VAL A 121 1.144 -16.670 -6.507 1.00 5.00 C ATOM 1835 CG2 VAL A 121 -0.467 -14.867 -5.965 1.00 5.72 C ATOM 0 H VAL A 121 -0.753 -13.674 -8.128 1.00 7.19 H new ATOM 0 HA VAL A 121 1.951 -14.338 -7.423 1.00 6.42 H new ATOM 0 HB VAL A 121 -0.506 -16.109 -7.704 1.00 5.97 H new ATOM 0 HG11 VAL A 121 0.560 -17.351 -5.888 1.00 5.00 H new ATOM 0 HG12 VAL A 121 1.615 -17.229 -7.315 1.00 5.00 H new ATOM 0 HG13 VAL A 121 1.913 -16.195 -5.898 1.00 5.00 H new ATOM 0 HG21 VAL A 121 -1.035 -15.569 -5.354 1.00 5.72 H new ATOM 0 HG22 VAL A 121 0.269 -14.358 -5.343 1.00 5.72 H new ATOM 0 HG23 VAL A 121 -1.145 -14.132 -6.399 1.00 5.72 H new ATOM 1845 N ASP A 122 0.658 -15.533 -10.193 1.00 8.17 N ATOM 1846 CA ASP A 122 0.977 -16.174 -11.491 1.00 9.00 C ATOM 1847 C ASP A 122 2.051 -15.396 -12.258 1.00 9.58 C ATOM 1848 O ASP A 122 2.760 -15.960 -13.095 1.00 10.07 O ATOM 1849 CB ASP A 122 -0.293 -16.306 -12.341 1.00 10.08 C ATOM 1850 CG ASP A 122 -0.228 -17.464 -13.321 1.00 9.97 C ATOM 1851 OD1 ASP A 122 0.236 -17.252 -14.461 1.00 10.09 O ATOM 1852 OD2 ASP A 122 -0.640 -18.583 -12.948 1.00 9.98 O ATOM 0 H ASP A 122 -0.322 -15.266 -10.099 1.00 8.17 H new ATOM 0 HA ASP A 122 1.375 -17.167 -11.283 1.00 9.00 H new ATOM 0 HB2 ASP A 122 -1.152 -16.440 -11.684 1.00 10.08 H new ATOM 0 HB3 ASP A 122 -0.454 -15.379 -12.891 1.00 10.08 H new ATOM 1857 N GLU A 123 2.152 -14.099 -11.954 1.00 9.61 N ATOM 1858 CA GLU A 123 3.147 -13.213 -12.567 1.00 10.24 C ATOM 1859 C GLU A 123 4.526 -13.469 -11.944 1.00 9.65 C ATOM 1860 O GLU A 123 5.540 -13.479 -12.648 1.00 10.36 O ATOM 1861 CB GLU A 123 2.742 -11.744 -12.382 1.00 10.45 C ATOM 1862 CG GLU A 123 3.240 -10.820 -13.487 1.00 11.70 C ATOM 1863 CD GLU A 123 2.822 -9.378 -13.273 1.00 11.94 C ATOM 1864 OE1 GLU A 123 1.732 -8.999 -13.751 1.00 12.02 O ATOM 1865 OE2 GLU A 123 3.585 -8.629 -12.628 1.00 12.16 O ATOM 0 H GLU A 123 1.547 -13.634 -11.277 1.00 9.61 H new ATOM 0 HA GLU A 123 3.196 -13.423 -13.635 1.00 10.24 H new ATOM 0 HB2 GLU A 123 1.655 -11.681 -12.332 1.00 10.45 H new ATOM 0 HB3 GLU A 123 3.126 -11.390 -11.425 1.00 10.45 H new ATOM 0 HG2 GLU A 123 4.327 -10.875 -13.539 1.00 11.70 H new ATOM 0 HG3 GLU A 123 2.856 -11.167 -14.446 1.00 11.70 H new ATOM 1872 N MET A 124 4.541 -13.675 -10.614 1.00 8.45 N ATOM 1873 CA MET A 124 5.784 -13.959 -9.881 1.00 7.91 C ATOM 1874 C MET A 124 6.121 -15.446 -9.878 1.00 7.70 C ATOM 1875 O MET A 124 7.270 -15.824 -9.629 1.00 7.76 O ATOM 1876 CB MET A 124 5.794 -13.408 -8.444 1.00 6.78 C ATOM 1877 CG MET A 124 4.472 -13.482 -7.694 1.00 6.98 C ATOM 1878 SD MET A 124 4.269 -12.113 -6.543 1.00 6.62 S ATOM 1879 CE MET A 124 3.871 -10.815 -7.706 1.00 7.40 C ATOM 0 H MET A 124 3.707 -13.650 -10.028 1.00 8.45 H new ATOM 0 HA MET A 124 6.560 -13.426 -10.430 1.00 7.91 H new ATOM 0 HB2 MET A 124 6.545 -13.953 -7.872 1.00 6.78 H new ATOM 0 HB3 MET A 124 6.113 -12.366 -8.477 1.00 6.78 H new ATOM 0 HG2 MET A 124 3.649 -13.479 -8.409 1.00 6.98 H new ATOM 0 HG3 MET A 124 4.417 -14.424 -7.149 1.00 6.98 H new ATOM 0 HE1 MET A 124 4.491 -9.942 -7.503 1.00 7.40 H new ATOM 0 HE2 MET A 124 4.059 -11.166 -8.721 1.00 7.40 H new ATOM 0 HE3 MET A 124 2.820 -10.545 -7.604 1.00 7.40 H new ATOM 1889 N ILE A 125 5.114 -16.285 -10.158 1.00 7.60 N ATOM 1890 CA ILE A 125 5.291 -17.735 -10.198 1.00 7.41 C ATOM 1891 C ILE A 125 6.296 -18.149 -11.270 1.00 8.49 C ATOM 1892 O ILE A 125 7.146 -19.012 -11.040 1.00 8.45 O ATOM 1893 CB ILE A 125 3.957 -18.477 -10.382 1.00 7.24 C ATOM 1894 CG1 ILE A 125 3.178 -18.459 -9.069 1.00 6.16 C ATOM 1895 CG2 ILE A 125 4.233 -19.893 -10.793 1.00 7.27 C ATOM 1896 CD1 ILE A 125 1.695 -18.659 -9.211 1.00 6.48 C ATOM 0 H ILE A 125 4.163 -15.977 -10.361 1.00 7.60 H new ATOM 0 HA ILE A 125 5.694 -18.026 -9.228 1.00 7.41 H new ATOM 0 HB ILE A 125 3.365 -17.985 -11.154 1.00 7.24 H new ATOM 0 HG12 ILE A 125 3.574 -19.238 -8.417 1.00 6.16 H new ATOM 0 HG13 ILE A 125 3.355 -17.506 -8.571 1.00 6.16 H new ATOM 0 HG21 ILE A 125 3.290 -20.424 -10.925 1.00 7.27 H new ATOM 0 HG22 ILE A 125 4.787 -19.898 -11.732 1.00 7.27 H new ATOM 0 HG23 ILE A 125 4.823 -20.387 -10.021 1.00 7.27 H new ATOM 0 HD11 ILE A 125 1.228 -18.631 -8.226 1.00 6.48 H new ATOM 0 HD12 ILE A 125 1.279 -17.866 -9.833 1.00 6.48 H new ATOM 0 HD13 ILE A 125 1.501 -19.625 -9.677 1.00 6.48 H new ATOM 1908 N ARG A 126 6.142 -17.548 -12.443 1.00 9.53 N ATOM 1909 CA ARG A 126 7.049 -17.755 -13.595 1.00 10.70 C ATOM 1910 C ARG A 126 8.515 -17.658 -13.154 1.00 10.89 C ATOM 1911 O ARG A 126 9.384 -18.349 -13.694 1.00 11.45 O ATOM 1912 CB ARG A 126 6.795 -16.708 -14.690 1.00 11.76 C ATOM 1913 CG ARG A 126 5.354 -16.638 -15.181 1.00 12.03 C ATOM 1914 CD ARG A 126 4.856 -15.203 -15.192 1.00 12.20 C ATOM 1915 NE ARG A 126 3.463 -15.107 -15.643 1.00 12.92 N ATOM 1916 CZ ARG A 126 2.856 -13.970 -16.012 1.00 13.50 C ATOM 1917 NH1 ARG A 126 3.503 -12.806 -15.993 1.00 13.44 N ATOM 1918 NH2 ARG A 126 1.589 -14.001 -16.403 1.00 14.26 N ATOM 0 H ARG A 126 5.382 -16.896 -12.636 1.00 9.53 H new ATOM 0 HA ARG A 126 6.849 -18.750 -13.992 1.00 10.70 H new ATOM 0 HB2 ARG A 126 7.083 -15.728 -14.311 1.00 11.76 H new ATOM 0 HB3 ARG A 126 7.444 -16.925 -15.539 1.00 11.76 H new ATOM 0 HG2 ARG A 126 5.286 -17.059 -16.184 1.00 12.03 H new ATOM 0 HG3 ARG A 126 4.716 -17.244 -14.538 1.00 12.03 H new ATOM 0 HD2 ARG A 126 4.942 -14.782 -14.190 1.00 12.20 H new ATOM 0 HD3 ARG A 126 5.491 -14.604 -15.845 1.00 12.20 H new ATOM 0 HE ARG A 126 2.917 -15.968 -15.678 1.00 12.92 H new ATOM 0 HH11 ARG A 126 4.477 -12.769 -15.694 1.00 13.44 H new ATOM 0 HH12 ARG A 126 3.024 -11.952 -16.277 1.00 13.44 H new ATOM 0 HH21 ARG A 126 1.083 -14.886 -16.422 1.00 14.26 H new ATOM 0 HH22 ARG A 126 1.121 -13.140 -16.685 1.00 14.26 H new ATOM 1932 N GLU A 127 8.765 -16.783 -12.160 1.00 10.50 N ATOM 1933 CA GLU A 127 10.101 -16.592 -11.592 1.00 10.79 C ATOM 1934 C GLU A 127 10.414 -17.673 -10.551 1.00 10.06 C ATOM 1935 O GLU A 127 11.575 -18.062 -10.390 1.00 10.61 O ATOM 1936 CB GLU A 127 10.212 -15.213 -10.942 1.00 10.70 C ATOM 1937 CG GLU A 127 10.252 -14.051 -11.934 1.00 11.77 C ATOM 1938 CD GLU A 127 11.612 -13.874 -12.588 1.00 12.85 C ATOM 1939 OE1 GLU A 127 11.842 -14.483 -13.654 1.00 13.26 O ATOM 1940 OE2 GLU A 127 12.444 -13.125 -12.034 1.00 13.42 O ATOM 0 H GLU A 127 8.047 -16.196 -11.735 1.00 10.50 H new ATOM 0 HA GLU A 127 10.823 -16.668 -12.405 1.00 10.79 H new ATOM 0 HB2 GLU A 127 9.366 -15.072 -10.269 1.00 10.70 H new ATOM 0 HB3 GLU A 127 11.114 -15.184 -10.330 1.00 10.70 H new ATOM 0 HG2 GLU A 127 9.502 -14.215 -12.708 1.00 11.77 H new ATOM 0 HG3 GLU A 127 9.981 -13.130 -11.417 1.00 11.77 H new ATOM 1947 N ALA A 128 9.366 -18.155 -9.844 1.00 8.89 N ATOM 1948 CA ALA A 128 9.513 -19.208 -8.824 1.00 8.16 C ATOM 1949 C ALA A 128 10.120 -20.489 -9.419 1.00 8.57 C ATOM 1950 O ALA A 128 11.211 -20.905 -9.020 1.00 8.66 O ATOM 1951 CB ALA A 128 8.164 -19.491 -8.184 1.00 6.87 C ATOM 0 H ALA A 128 8.408 -17.827 -9.965 1.00 8.89 H new ATOM 0 HA ALA A 128 10.203 -18.853 -8.058 1.00 8.16 H new ATOM 0 HB1 ALA A 128 8.275 -20.270 -7.430 1.00 6.87 H new ATOM 0 HB2 ALA A 128 7.786 -18.583 -7.714 1.00 6.87 H new ATOM 0 HB3 ALA A 128 7.461 -19.823 -8.948 1.00 6.87 H new ATOM 1957 N ALA A 129 9.396 -21.108 -10.380 1.00 8.95 N ATOM 1958 CA ALA A 129 9.845 -22.325 -11.101 1.00 9.43 C ATOM 1959 C ALA A 129 10.065 -23.568 -10.217 1.00 8.51 C ATOM 1960 O ALA A 129 10.419 -24.635 -10.734 1.00 8.76 O ATOM 1961 CB ALA A 129 11.107 -22.021 -11.891 1.00 10.42 C ATOM 0 H ALA A 129 8.479 -20.777 -10.680 1.00 8.95 H new ATOM 0 HA ALA A 129 9.021 -22.587 -11.764 1.00 9.43 H new ATOM 0 HB1 ALA A 129 11.431 -22.918 -12.418 1.00 10.42 H new ATOM 0 HB2 ALA A 129 10.903 -21.230 -12.613 1.00 10.42 H new ATOM 0 HB3 ALA A 129 11.893 -21.696 -11.210 1.00 10.42 H new ATOM 1967 N ILE A 130 9.845 -23.448 -8.897 1.00 7.54 N ATOM 1968 CA ILE A 130 10.029 -24.576 -7.960 1.00 6.69 C ATOM 1969 C ILE A 130 9.040 -25.728 -8.257 1.00 6.68 C ATOM 1970 O ILE A 130 9.169 -26.825 -7.706 1.00 6.97 O ATOM 1971 CB ILE A 130 9.872 -24.140 -6.468 1.00 5.80 C ATOM 1972 CG1 ILE A 130 10.570 -22.787 -6.198 1.00 5.43 C ATOM 1973 CG2 ILE A 130 10.439 -25.216 -5.529 1.00 6.19 C ATOM 1974 CD1 ILE A 130 10.066 -22.053 -4.964 1.00 4.53 C ATOM 0 H ILE A 130 9.540 -22.583 -8.452 1.00 7.54 H new ATOM 0 HA ILE A 130 11.049 -24.927 -8.112 1.00 6.69 H new ATOM 0 HB ILE A 130 8.807 -24.019 -6.272 1.00 5.80 H new ATOM 0 HG12 ILE A 130 11.641 -22.960 -6.090 1.00 5.43 H new ATOM 0 HG13 ILE A 130 10.437 -22.144 -7.068 1.00 5.43 H new ATOM 0 HG21 ILE A 130 10.321 -24.895 -4.494 1.00 6.19 H new ATOM 0 HG22 ILE A 130 9.902 -26.152 -5.682 1.00 6.19 H new ATOM 0 HG23 ILE A 130 11.497 -25.366 -5.744 1.00 6.19 H new ATOM 0 HD11 ILE A 130 10.610 -21.115 -4.851 1.00 4.53 H new ATOM 0 HD12 ILE A 130 9.002 -21.844 -5.074 1.00 4.53 H new ATOM 0 HD13 ILE A 130 10.225 -22.673 -4.082 1.00 4.53 H new ATOM 1986 N ASP A 131 8.068 -25.452 -9.138 1.00 6.58 N ATOM 1987 CA ASP A 131 7.037 -26.419 -9.545 1.00 6.68 C ATOM 1988 C ASP A 131 7.626 -27.748 -10.071 1.00 6.59 C ATOM 1989 O ASP A 131 7.973 -27.882 -11.251 1.00 6.80 O ATOM 1990 CB ASP A 131 6.080 -25.789 -10.583 1.00 7.70 C ATOM 1991 CG ASP A 131 6.792 -25.177 -11.784 1.00 7.98 C ATOM 1992 OD1 ASP A 131 7.124 -23.974 -11.728 1.00 8.18 O ATOM 1993 OD2 ASP A 131 7.015 -25.903 -12.776 1.00 8.25 O ATOM 0 H ASP A 131 7.974 -24.544 -9.592 1.00 6.58 H new ATOM 0 HA ASP A 131 6.472 -26.670 -8.647 1.00 6.68 H new ATOM 0 HB2 ASP A 131 5.386 -26.553 -10.934 1.00 7.70 H new ATOM 0 HB3 ASP A 131 5.485 -25.018 -10.094 1.00 7.70 H new ATOM 1998 N GLY A 132 7.745 -28.702 -9.148 1.00 6.49 N ATOM 1999 CA GLY A 132 8.252 -30.037 -9.450 1.00 6.52 C ATOM 2000 C GLY A 132 7.452 -31.085 -8.698 1.00 5.87 C ATOM 2001 O GLY A 132 7.347 -32.240 -9.122 1.00 6.01 O ATOM 0 H GLY A 132 7.492 -28.569 -8.169 1.00 6.49 H new ATOM 0 HA2 GLY A 132 8.191 -30.223 -10.522 1.00 6.52 H new ATOM 0 HA3 GLY A 132 9.304 -30.105 -9.174 1.00 6.52 H new ATOM 2005 N ASP A 133 6.895 -30.641 -7.572 1.00 5.34 N ATOM 2006 CA ASP A 133 6.053 -31.445 -6.695 1.00 4.95 C ATOM 2007 C ASP A 133 4.684 -30.847 -6.756 1.00 4.57 C ATOM 2008 O ASP A 133 3.666 -31.493 -6.490 1.00 4.65 O ATOM 2009 CB ASP A 133 6.501 -31.342 -5.252 1.00 4.99 C ATOM 2010 CG ASP A 133 7.901 -31.877 -5.007 1.00 5.63 C ATOM 2011 OD1 ASP A 133 8.033 -33.085 -4.716 1.00 6.07 O ATOM 2012 OD2 ASP A 133 8.864 -31.088 -5.107 1.00 5.97 O ATOM 0 H ASP A 133 7.022 -29.686 -7.238 1.00 5.34 H new ATOM 0 HA ASP A 133 6.096 -32.487 -7.012 1.00 4.95 H new ATOM 0 HB2 ASP A 133 6.462 -30.298 -4.942 1.00 4.99 H new ATOM 0 HB3 ASP A 133 5.798 -31.888 -4.623 1.00 4.99 H new ATOM 2017 N GLY A 134 4.714 -29.573 -7.123 1.00 4.47 N ATOM 2018 CA GLY A 134 3.544 -28.783 -7.217 1.00 4.33 C ATOM 2019 C GLY A 134 3.402 -27.783 -6.083 1.00 3.73 C ATOM 2020 O GLY A 134 2.282 -27.448 -5.686 1.00 3.75 O ATOM 0 H GLY A 134 5.572 -29.075 -7.361 1.00 4.47 H new ATOM 0 HA2 GLY A 134 3.551 -28.247 -8.166 1.00 4.33 H new ATOM 0 HA3 GLY A 134 2.672 -29.437 -7.227 1.00 4.33 H new ATOM 2024 N GLN A 135 4.548 -27.307 -5.562 1.00 3.55 N ATOM 2025 CA GLN A 135 4.572 -26.323 -4.475 1.00 3.33 C ATOM 2026 C GLN A 135 5.677 -25.287 -4.690 1.00 3.69 C ATOM 2027 O GLN A 135 6.428 -25.355 -5.668 1.00 4.33 O ATOM 2028 CB GLN A 135 4.800 -26.991 -3.119 1.00 3.82 C ATOM 2029 CG GLN A 135 3.835 -28.124 -2.773 1.00 4.41 C ATOM 2030 CD GLN A 135 3.909 -28.528 -1.314 1.00 5.26 C ATOM 2031 OE1 GLN A 135 3.191 -27.991 -0.472 1.00 5.74 O ATOM 2032 NE2 GLN A 135 4.781 -29.482 -1.008 1.00 5.78 N ATOM 0 H GLN A 135 5.473 -27.593 -5.882 1.00 3.55 H new ATOM 0 HA GLN A 135 3.599 -25.833 -4.481 1.00 3.33 H new ATOM 0 HB2 GLN A 135 5.817 -27.383 -3.093 1.00 3.82 H new ATOM 0 HB3 GLN A 135 4.732 -26.229 -2.342 1.00 3.82 H new ATOM 0 HG2 GLN A 135 2.817 -27.814 -3.009 1.00 4.41 H new ATOM 0 HG3 GLN A 135 4.058 -28.989 -3.397 1.00 4.41 H new ATOM 0 HE21 GLN A 135 5.357 -29.900 -1.739 1.00 5.78 H new ATOM 0 HE22 GLN A 135 4.875 -29.797 -0.042 1.00 5.78 H new ATOM 2041 N VAL A 136 5.759 -24.327 -3.756 1.00 3.59 N ATOM 2042 CA VAL A 136 6.771 -23.281 -3.788 1.00 4.23 C ATOM 2043 C VAL A 136 7.267 -22.971 -2.372 1.00 4.67 C ATOM 2044 O VAL A 136 6.704 -23.446 -1.382 1.00 4.74 O ATOM 2045 CB VAL A 136 6.261 -22.006 -4.544 1.00 4.02 C ATOM 2046 CG1 VAL A 136 6.978 -20.718 -4.147 1.00 3.51 C ATOM 2047 CG2 VAL A 136 6.364 -22.210 -6.058 1.00 5.08 C ATOM 0 H VAL A 136 5.123 -24.261 -2.962 1.00 3.59 H new ATOM 0 HA VAL A 136 7.626 -23.646 -4.357 1.00 4.23 H new ATOM 0 HB VAL A 136 5.220 -21.882 -4.246 1.00 4.02 H new ATOM 0 HG11 VAL A 136 6.567 -19.883 -4.715 1.00 3.51 H new ATOM 0 HG12 VAL A 136 6.837 -20.537 -3.081 1.00 3.51 H new ATOM 0 HG13 VAL A 136 8.042 -20.813 -4.361 1.00 3.51 H new ATOM 0 HG21 VAL A 136 6.007 -21.317 -6.571 1.00 5.08 H new ATOM 0 HG22 VAL A 136 7.403 -22.393 -6.331 1.00 5.08 H new ATOM 0 HG23 VAL A 136 5.756 -23.065 -6.352 1.00 5.08 H new ATOM 2057 N ASN A 137 8.311 -22.151 -2.311 1.00 5.28 N ATOM 2058 CA ASN A 137 8.957 -21.785 -1.053 1.00 5.95 C ATOM 2059 C ASN A 137 8.754 -20.307 -0.705 1.00 5.49 C ATOM 2060 O ASN A 137 7.979 -19.591 -1.345 1.00 4.60 O ATOM 2061 CB ASN A 137 10.468 -22.123 -1.077 1.00 7.18 C ATOM 2062 CG ASN A 137 10.809 -23.501 -1.642 1.00 7.90 C ATOM 2063 OD1 ASN A 137 10.172 -23.991 -2.577 1.00 8.11 O ATOM 2064 ND2 ASN A 137 11.825 -24.134 -1.068 1.00 8.51 N ATOM 0 H ASN A 137 8.735 -21.720 -3.133 1.00 5.28 H new ATOM 0 HA ASN A 137 8.477 -22.379 -0.275 1.00 5.95 H new ATOM 0 HB2 ASN A 137 10.986 -21.366 -1.667 1.00 7.18 H new ATOM 0 HB3 ASN A 137 10.857 -22.056 -0.061 1.00 7.18 H new ATOM 0 HD21 ASN A 137 12.102 -25.058 -1.399 1.00 8.51 H new ATOM 0 HD22 ASN A 137 12.328 -23.696 -0.296 1.00 8.51 H new ATOM 2071 N TYR A 138 9.482 -19.892 0.327 1.00 6.22 N ATOM 2072 CA TYR A 138 9.446 -18.545 0.888 1.00 6.03 C ATOM 2073 C TYR A 138 10.660 -17.721 0.443 1.00 6.55 C ATOM 2074 O TYR A 138 10.548 -16.529 0.155 1.00 6.13 O ATOM 2075 CB TYR A 138 9.422 -18.655 2.427 1.00 6.78 C ATOM 2076 CG TYR A 138 10.230 -19.836 2.919 1.00 7.93 C ATOM 2077 CD1 TYR A 138 9.875 -21.122 2.541 1.00 8.62 C ATOM 2078 CD2 TYR A 138 11.375 -19.668 3.676 1.00 8.50 C ATOM 2079 CE1 TYR A 138 10.618 -22.195 2.893 1.00 9.65 C ATOM 2080 CE2 TYR A 138 12.132 -20.757 4.056 1.00 9.54 C ATOM 2081 CZ TYR A 138 11.752 -22.025 3.658 1.00 10.06 C ATOM 2082 OH TYR A 138 12.510 -23.116 4.017 1.00 11.13 O ATOM 0 H TYR A 138 10.136 -20.506 0.813 1.00 6.22 H new ATOM 0 HA TYR A 138 8.552 -18.035 0.528 1.00 6.03 H new ATOM 0 HB2 TYR A 138 9.817 -17.737 2.863 1.00 6.78 H new ATOM 0 HB3 TYR A 138 8.391 -18.752 2.768 1.00 6.78 H new ATOM 0 HD1 TYR A 138 8.983 -21.270 1.951 1.00 8.62 H new ATOM 0 HD2 TYR A 138 11.679 -18.675 3.972 1.00 8.50 H new ATOM 0 HE1 TYR A 138 10.323 -23.184 2.575 1.00 9.65 H new ATOM 0 HE2 TYR A 138 13.016 -20.620 4.661 1.00 9.54 H new ATOM 0 HH TYR A 138 13.275 -22.821 4.554 1.00 11.13 H new ATOM 2092 N GLU A 139 11.823 -18.386 0.384 1.00 7.59 N ATOM 2093 CA GLU A 139 13.096 -17.750 0.003 1.00 8.39 C ATOM 2094 C GLU A 139 13.129 -17.322 -1.466 1.00 8.26 C ATOM 2095 O GLU A 139 13.812 -16.360 -1.817 1.00 8.61 O ATOM 2096 CB GLU A 139 14.255 -18.713 0.260 1.00 9.64 C ATOM 2097 CG GLU A 139 14.558 -18.945 1.734 1.00 10.21 C ATOM 2098 CD GLU A 139 15.702 -19.917 1.948 1.00 11.39 C ATOM 2099 OE1 GLU A 139 16.863 -19.462 2.017 1.00 11.90 O ATOM 2100 OE2 GLU A 139 15.436 -21.134 2.048 1.00 11.94 O ATOM 0 H GLU A 139 11.909 -19.379 0.599 1.00 7.59 H new ATOM 0 HA GLU A 139 13.193 -16.853 0.615 1.00 8.39 H new ATOM 0 HB2 GLU A 139 14.027 -19.671 -0.208 1.00 9.64 H new ATOM 0 HB3 GLU A 139 15.150 -18.325 -0.227 1.00 9.64 H new ATOM 0 HG2 GLU A 139 14.802 -17.993 2.205 1.00 10.21 H new ATOM 0 HG3 GLU A 139 13.665 -19.326 2.229 1.00 10.21 H new ATOM 2107 N GLU A 140 12.418 -18.064 -2.313 1.00 7.94 N ATOM 2108 CA GLU A 140 12.372 -17.777 -3.749 1.00 8.10 C ATOM 2109 C GLU A 140 11.157 -16.937 -4.173 1.00 7.13 C ATOM 2110 O GLU A 140 11.265 -16.140 -5.110 1.00 7.54 O ATOM 2111 CB GLU A 140 12.392 -19.085 -4.544 1.00 8.42 C ATOM 2112 CG GLU A 140 13.766 -19.733 -4.622 1.00 9.47 C ATOM 2113 CD GLU A 140 13.765 -21.005 -5.447 1.00 9.95 C ATOM 2114 OE1 GLU A 140 13.976 -20.916 -6.675 1.00 10.29 O ATOM 2115 OE2 GLU A 140 13.553 -22.089 -4.865 1.00 10.17 O ATOM 0 H GLU A 140 11.863 -18.872 -2.030 1.00 7.94 H new ATOM 0 HA GLU A 140 13.257 -17.180 -3.968 1.00 8.10 H new ATOM 0 HB2 GLU A 140 11.694 -19.787 -4.088 1.00 8.42 H new ATOM 0 HB3 GLU A 140 12.034 -18.891 -5.555 1.00 8.42 H new ATOM 0 HG2 GLU A 140 14.473 -19.025 -5.054 1.00 9.47 H new ATOM 0 HG3 GLU A 140 14.115 -19.958 -3.614 1.00 9.47 H new ATOM 2122 N PHE A 141 10.010 -17.107 -3.492 1.00 5.98 N ATOM 2123 CA PHE A 141 8.785 -16.396 -3.859 1.00 5.06 C ATOM 2124 C PHE A 141 8.653 -14.991 -3.260 1.00 4.76 C ATOM 2125 O PHE A 141 8.583 -14.008 -4.001 1.00 5.06 O ATOM 2126 CB PHE A 141 7.549 -17.249 -3.554 1.00 3.97 C ATOM 2127 CG PHE A 141 6.500 -17.097 -4.601 1.00 3.73 C ATOM 2128 CD1 PHE A 141 6.485 -17.924 -5.711 1.00 3.83 C ATOM 2129 CD2 PHE A 141 5.556 -16.106 -4.488 1.00 4.10 C ATOM 2130 CE1 PHE A 141 5.539 -17.755 -6.704 1.00 4.24 C ATOM 2131 CE2 PHE A 141 4.608 -15.933 -5.460 1.00 4.47 C ATOM 2132 CZ PHE A 141 4.601 -16.749 -6.570 1.00 4.52 C ATOM 0 H PHE A 141 9.912 -17.729 -2.689 1.00 5.98 H new ATOM 0 HA PHE A 141 8.856 -16.235 -4.935 1.00 5.06 H new ATOM 0 HB2 PHE A 141 7.840 -18.297 -3.480 1.00 3.97 H new ATOM 0 HB3 PHE A 141 7.140 -16.963 -2.585 1.00 3.97 H new ATOM 0 HD1 PHE A 141 7.220 -18.710 -5.802 1.00 3.83 H new ATOM 0 HD2 PHE A 141 5.562 -15.457 -3.624 1.00 4.10 H new ATOM 0 HE1 PHE A 141 5.533 -18.399 -7.571 1.00 4.24 H new ATOM 0 HE2 PHE A 141 3.865 -15.156 -5.357 1.00 4.47 H new ATOM 0 HZ PHE A 141 3.858 -16.602 -7.340 1.00 4.52 H new ATOM 2142 N VAL A 142 8.588 -14.911 -1.933 1.00 4.40 N ATOM 2143 CA VAL A 142 8.470 -13.616 -1.193 1.00 4.15 C ATOM 2144 C VAL A 142 9.614 -12.704 -1.576 1.00 5.25 C ATOM 2145 O VAL A 142 9.443 -11.494 -1.738 1.00 5.25 O ATOM 2146 CB VAL A 142 8.510 -13.799 0.350 1.00 4.09 C ATOM 2147 CG1 VAL A 142 7.704 -12.738 1.082 1.00 3.37 C ATOM 2148 CG2 VAL A 142 8.043 -15.177 0.737 1.00 3.96 C ATOM 0 H VAL A 142 8.614 -15.729 -1.324 1.00 4.40 H new ATOM 0 HA VAL A 142 7.505 -13.190 -1.467 1.00 4.15 H new ATOM 0 HB VAL A 142 9.550 -13.679 0.655 1.00 4.09 H new ATOM 0 HG11 VAL A 142 7.765 -12.912 2.156 1.00 3.37 H new ATOM 0 HG12 VAL A 142 8.106 -11.752 0.850 1.00 3.37 H new ATOM 0 HG13 VAL A 142 6.662 -12.789 0.765 1.00 3.37 H new ATOM 0 HG21 VAL A 142 8.079 -15.282 1.821 1.00 3.96 H new ATOM 0 HG22 VAL A 142 7.020 -15.324 0.392 1.00 3.96 H new ATOM 0 HG23 VAL A 142 8.692 -15.923 0.278 1.00 3.96 H new ATOM 2158 N GLN A 143 10.787 -13.316 -1.701 1.00 6.26 N ATOM 2159 CA GLN A 143 11.996 -12.600 -2.125 1.00 7.42 C ATOM 2160 C GLN A 143 11.808 -12.002 -3.525 1.00 7.74 C ATOM 2161 O GLN A 143 12.491 -11.041 -3.890 1.00 8.48 O ATOM 2162 CB GLN A 143 13.216 -13.522 -2.094 1.00 8.47 C ATOM 2163 CG GLN A 143 14.526 -12.806 -1.791 1.00 9.24 C ATOM 2164 CD GLN A 143 15.715 -13.746 -1.780 1.00 10.23 C ATOM 2165 OE1 GLN A 143 16.066 -14.310 -0.743 1.00 10.70 O ATOM 2166 NE2 GLN A 143 16.343 -13.920 -2.937 1.00 10.74 N ATOM 0 H GLN A 143 10.931 -14.309 -1.515 1.00 6.26 H new ATOM 0 HA GLN A 143 12.169 -11.785 -1.423 1.00 7.42 H new ATOM 0 HB2 GLN A 143 13.055 -14.296 -1.344 1.00 8.47 H new ATOM 0 HB3 GLN A 143 13.303 -14.025 -3.057 1.00 8.47 H new ATOM 0 HG2 GLN A 143 14.690 -12.027 -2.535 1.00 9.24 H new ATOM 0 HG3 GLN A 143 14.450 -12.311 -0.823 1.00 9.24 H new ATOM 0 HE21 GLN A 143 16.018 -13.433 -3.772 1.00 10.74 H new ATOM 0 HE22 GLN A 143 17.150 -14.541 -2.991 1.00 10.74 H new ATOM 2175 N MET A 144 10.875 -12.587 -4.297 1.00 7.32 N ATOM 2176 CA MET A 144 10.569 -12.100 -5.636 1.00 7.88 C ATOM 2177 C MET A 144 9.576 -10.952 -5.606 1.00 7.37 C ATOM 2178 O MET A 144 9.259 -10.344 -6.634 1.00 8.01 O ATOM 2179 CB MET A 144 10.088 -13.233 -6.546 1.00 8.04 C ATOM 2180 CG MET A 144 10.780 -13.270 -7.903 1.00 9.33 C ATOM 2181 SD MET A 144 10.526 -11.772 -8.884 1.00 9.76 S ATOM 2182 CE MET A 144 8.837 -11.988 -9.448 1.00 9.64 C ATOM 0 H MET A 144 10.325 -13.396 -4.009 1.00 7.32 H new ATOM 0 HA MET A 144 11.496 -11.711 -6.057 1.00 7.88 H new ATOM 0 HB2 MET A 144 10.249 -14.185 -6.041 1.00 8.04 H new ATOM 0 HB3 MET A 144 9.014 -13.132 -6.699 1.00 8.04 H new ATOM 0 HG2 MET A 144 11.849 -13.419 -7.753 1.00 9.33 H new ATOM 0 HG3 MET A 144 10.414 -14.129 -8.465 1.00 9.33 H new ATOM 0 HE1 MET A 144 8.738 -11.596 -10.460 1.00 9.64 H new ATOM 0 HE2 MET A 144 8.585 -13.048 -9.444 1.00 9.64 H new ATOM 0 HE3 MET A 144 8.160 -11.451 -8.783 1.00 9.64 H new ATOM 2192 N MET A 145 9.108 -10.674 -4.405 1.00 6.37 N ATOM 2193 CA MET A 145 8.209 -9.552 -4.144 1.00 5.88 C ATOM 2194 C MET A 145 9.044 -8.313 -3.866 1.00 6.25 C ATOM 2195 O MET A 145 8.607 -7.178 -4.077 1.00 6.33 O ATOM 2196 CB MET A 145 7.282 -9.820 -2.965 1.00 4.66 C ATOM 2197 CG MET A 145 6.091 -10.686 -3.310 1.00 3.68 C ATOM 2198 SD MET A 145 4.795 -10.576 -2.078 1.00 3.52 S ATOM 2199 CE MET A 145 5.076 -12.090 -1.181 1.00 3.45 C ATOM 0 H MET A 145 9.338 -11.219 -3.574 1.00 6.37 H new ATOM 0 HA MET A 145 7.581 -9.407 -5.023 1.00 5.88 H new ATOM 0 HB2 MET A 145 7.851 -10.301 -2.169 1.00 4.66 H new ATOM 0 HB3 MET A 145 6.926 -8.868 -2.571 1.00 4.66 H new ATOM 0 HG2 MET A 145 5.694 -10.386 -4.280 1.00 3.68 H new ATOM 0 HG3 MET A 145 6.413 -11.723 -3.404 1.00 3.68 H new ATOM 0 HE1 MET A 145 4.182 -12.348 -0.614 1.00 3.45 H new ATOM 0 HE2 MET A 145 5.305 -12.892 -1.883 1.00 3.45 H new ATOM 0 HE3 MET A 145 5.914 -11.957 -0.497 1.00 3.45 H new ATOM 2209 N THR A 146 10.259 -8.577 -3.384 1.00 6.65 N ATOM 2210 CA THR A 146 11.245 -7.548 -3.089 1.00 7.20 C ATOM 2211 C THR A 146 12.068 -7.264 -4.356 1.00 8.45 C ATOM 2212 O THR A 146 12.749 -6.238 -4.448 1.00 8.99 O ATOM 2213 CB THR A 146 12.183 -7.988 -1.933 1.00 7.31 C ATOM 2214 OG1 THR A 146 11.424 -8.651 -0.912 1.00 6.44 O ATOM 2215 CG2 THR A 146 12.911 -6.797 -1.312 1.00 7.72 C ATOM 0 H THR A 146 10.585 -9.523 -3.187 1.00 6.65 H new ATOM 0 HA THR A 146 10.726 -6.643 -2.772 1.00 7.20 H new ATOM 0 HB THR A 146 12.925 -8.666 -2.355 1.00 7.31 H new ATOM 0 HG1 THR A 146 12.023 -8.927 -0.187 1.00 6.44 H new ATOM 0 HG21 THR A 146 13.558 -7.145 -0.507 1.00 7.72 H new ATOM 0 HG22 THR A 146 13.514 -6.302 -2.073 1.00 7.72 H new ATOM 0 HG23 THR A 146 12.181 -6.093 -0.912 1.00 7.72 H new ATOM 2223 N ALA A 147 11.988 -8.197 -5.327 1.00 8.92 N ATOM 2224 CA ALA A 147 12.692 -8.074 -6.602 1.00 10.15 C ATOM 2225 C ALA A 147 11.880 -7.279 -7.629 1.00 10.43 C ATOM 2226 O ALA A 147 12.458 -6.562 -8.451 1.00 11.37 O ATOM 2227 CB ALA A 147 13.020 -9.452 -7.151 1.00 10.68 C ATOM 0 H ALA A 147 11.434 -9.049 -5.242 1.00 8.92 H new ATOM 0 HA ALA A 147 13.616 -7.526 -6.417 1.00 10.15 H new ATOM 0 HB1 ALA A 147 13.544 -9.350 -8.101 1.00 10.68 H new ATOM 0 HB2 ALA A 147 13.654 -9.985 -6.442 1.00 10.68 H new ATOM 0 HB3 ALA A 147 12.097 -10.012 -7.304 1.00 10.68 H new ATOM 2233 N LYS A 148 10.539 -7.409 -7.582 1.00 9.72 N ATOM 2234 CA LYS A 148 9.663 -6.704 -8.513 1.00 10.13 C ATOM 2235 C LYS A 148 9.303 -5.301 -8.005 1.00 9.70 C ATOM 2236 O LYS A 148 9.185 -4.383 -8.844 1.00 9.60 O ATOM 2237 CB LYS A 148 8.406 -7.549 -8.851 1.00 10.60 C ATOM 2238 CG LYS A 148 7.565 -8.000 -7.657 1.00 11.38 C ATOM 2239 CD LYS A 148 6.697 -6.865 -7.165 1.00 11.36 C ATOM 2240 CE LYS A 148 6.076 -7.163 -5.810 1.00 12.34 C ATOM 2241 NZ LYS A 148 5.110 -6.107 -5.399 1.00 12.59 N ATOM 2242 OXT LYS A 148 9.155 -5.135 -6.776 1.00 9.69 O ATOM 0 H LYS A 148 10.049 -7.996 -6.907 1.00 9.72 H new ATOM 0 HA LYS A 148 10.214 -6.564 -9.443 1.00 10.13 H new ATOM 0 HB2 LYS A 148 7.771 -6.968 -9.520 1.00 10.60 H new ATOM 0 HB3 LYS A 148 8.724 -8.434 -9.402 1.00 10.60 H new ATOM 0 HG2 LYS A 148 6.940 -8.846 -7.943 1.00 11.38 H new ATOM 0 HG3 LYS A 148 8.217 -8.342 -6.853 1.00 11.38 H new ATOM 0 HD2 LYS A 148 7.295 -5.956 -7.097 1.00 11.36 H new ATOM 0 HD3 LYS A 148 5.907 -6.673 -7.891 1.00 11.36 H new ATOM 0 HE2 LYS A 148 5.567 -8.126 -5.848 1.00 12.34 H new ATOM 0 HE3 LYS A 148 6.863 -7.247 -5.060 1.00 12.34 H new ATOM 0 HZ1 LYS A 148 4.708 -6.347 -4.470 1.00 12.59 H new ATOM 0 HZ2 LYS A 148 5.601 -5.192 -5.338 1.00 12.59 H new ATOM 0 HZ3 LYS A 148 4.345 -6.044 -6.101 1.00 12.59 H new