USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=27 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 145 MET CE :methyl -145:sc= -1.9! (180deg=-5.05!) USER MOD Set 1.2: A 146 THR OG1 : rot 66:sc= 1.06 USER MOD Set 2.1: A 36 MET CE :methyl 142:sc= -1.78 (180deg=-5.3!) USER MOD Set 2.2: A 72 MET CE :methyl 136:sc= -0.19 (180deg=-0.366) USER MOD Set 3.1: A 26 THR OG1 : rot -143:sc= 1.03 USER MOD Set 3.2: A 62 THR OG1 : rot 125:sc= 1.25 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 102:sc= 0.242 USER MOD Single : A 28 THR OG1 : rot -107:sc= 0.676 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0135 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0968 USER MOD Single : A 38 SER OG : rot 107:sc= 1.23 USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 ASN : amide:sc= -0.0135 X(o=-0.013,f=-0.0054) USER MOD Single : A 44 THR OG1 : rot -154:sc= 1.28 USER MOD Single : A 49 GLN : amide:sc= -0.0704 X(o=-0.07,f=0) USER MOD Single : A 51 MET CE :methyl 175:sc= -1.18 (180deg=-1.23) USER MOD Single : A 53 ASN : amide:sc=-0.00505 X(o=-0.005,f=-0.027) USER MOD Single : A 70 THR OG1 : rot 7:sc= 0.722 USER MOD Single : A 71 MET CE :methyl -158:sc= -1.4 (180deg=-2.59) USER MOD Single : A 81 SER OG : rot 140:sc= -0.14 USER MOD Single : A 94 LYS NZ :NH3+ 171:sc= 1.88 (180deg=1.77) USER MOD Single : A 97 ASN : amide:sc= -1.99! C(o=-2!,f=-2.8!) USER MOD Single : A 99 TYR OH : rot -18:sc= 1.26 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 MET CE :methyl 132:sc= -2.46! (180deg=-4.69!) USER MOD Single : A 110 THR OG1 : rot 95:sc= 0.677 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 115 LYS NZ :NH3+ 164:sc= 0.0967 (180deg=0.0454) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0.00339 USER MOD Single : A 124 MET CE :methyl 138:sc= -4.26! (180deg=-7.53!) USER MOD Single : A 135 GLN :FLIP amide:sc= -0.0172 F(o=-4!,f=-0.017) USER MOD Single : A 137 ASN : amide:sc= -1.61 K(o=-1.6,f=-2.8!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.011) USER MOD Single : A 144 MET CE :methyl -147:sc= -0.817 (180deg=-3.48!) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N GLU A 7 -2.420 16.876 -13.300 1.00 3.51 N ATOM 91 CA GLU A 7 -3.580 17.762 -13.123 1.00 3.59 C ATOM 92 C GLU A 7 -4.389 17.449 -11.865 1.00 3.35 C ATOM 93 O GLU A 7 -5.168 18.294 -11.417 1.00 3.38 O ATOM 94 CB GLU A 7 -4.491 17.714 -14.358 1.00 3.93 C ATOM 95 CG GLU A 7 -3.918 18.414 -15.588 1.00 4.45 C ATOM 96 CD GLU A 7 -4.081 19.924 -15.541 1.00 5.14 C ATOM 97 OE1 GLU A 7 -3.173 20.603 -15.017 1.00 5.54 O ATOM 98 OE2 GLU A 7 -5.117 20.425 -16.027 1.00 5.58 O ATOM 0 HA GLU A 7 -3.179 18.768 -13.001 1.00 3.59 H new ATOM 0 HB2 GLU A 7 -4.691 16.672 -14.607 1.00 3.93 H new ATOM 0 HB3 GLU A 7 -5.448 18.171 -14.107 1.00 3.93 H new ATOM 0 HG2 GLU A 7 -2.859 18.171 -15.677 1.00 4.45 H new ATOM 0 HG3 GLU A 7 -4.410 18.028 -16.481 1.00 4.45 H new ATOM 105 N GLN A 8 -4.229 16.236 -11.304 1.00 3.16 N ATOM 106 CA GLN A 8 -4.929 15.870 -10.068 1.00 2.96 C ATOM 107 C GLN A 8 -4.517 16.806 -8.955 1.00 2.69 C ATOM 108 O GLN A 8 -5.320 17.140 -8.090 1.00 2.63 O ATOM 109 CB GLN A 8 -4.682 14.408 -9.684 1.00 2.87 C ATOM 110 CG GLN A 8 -5.421 13.411 -10.564 1.00 3.23 C ATOM 111 CD GLN A 8 -5.217 11.976 -10.119 1.00 3.13 C ATOM 112 OE1 GLN A 8 -5.975 11.453 -9.302 1.00 3.27 O ATOM 113 NE2 GLN A 8 -4.189 11.330 -10.657 1.00 3.29 N ATOM 0 H GLN A 8 -3.628 15.504 -11.684 1.00 3.16 H new ATOM 0 HA GLN A 8 -6.001 15.971 -10.238 1.00 2.96 H new ATOM 0 HB2 GLN A 8 -3.613 14.203 -9.737 1.00 2.87 H new ATOM 0 HB3 GLN A 8 -4.984 14.258 -8.647 1.00 2.87 H new ATOM 0 HG2 GLN A 8 -6.486 13.643 -10.554 1.00 3.23 H new ATOM 0 HG3 GLN A 8 -5.081 13.520 -11.594 1.00 3.23 H new ATOM 0 HE21 GLN A 8 -3.586 11.802 -11.331 1.00 3.29 H new ATOM 0 HE22 GLN A 8 -4.002 10.362 -10.397 1.00 3.29 H new ATOM 122 N ILE A 9 -3.251 17.214 -8.999 1.00 2.59 N ATOM 123 CA ILE A 9 -2.707 18.204 -8.092 1.00 2.41 C ATOM 124 C ILE A 9 -3.538 19.480 -8.206 1.00 2.64 C ATOM 125 O ILE A 9 -3.899 20.079 -7.194 1.00 2.55 O ATOM 126 CB ILE A 9 -1.221 18.449 -8.431 1.00 2.42 C ATOM 127 CG1 ILE A 9 -0.403 17.283 -7.879 1.00 2.20 C ATOM 128 CG2 ILE A 9 -0.724 19.799 -7.928 1.00 2.45 C ATOM 129 CD1 ILE A 9 -0.218 16.169 -8.882 1.00 2.35 C ATOM 0 H ILE A 9 -2.573 16.859 -9.674 1.00 2.59 H new ATOM 0 HA ILE A 9 -2.755 17.855 -7.060 1.00 2.41 H new ATOM 0 HB ILE A 9 -1.101 18.492 -9.514 1.00 2.42 H new ATOM 0 HG12 ILE A 9 0.575 17.648 -7.565 1.00 2.20 H new ATOM 0 HG13 ILE A 9 -0.896 16.888 -6.991 1.00 2.20 H new ATOM 0 HG21 ILE A 9 0.326 19.921 -8.192 1.00 2.45 H new ATOM 0 HG22 ILE A 9 -1.309 20.596 -8.387 1.00 2.45 H new ATOM 0 HG23 ILE A 9 -0.833 19.846 -6.845 1.00 2.45 H new ATOM 0 HD11 ILE A 9 0.371 15.369 -8.433 1.00 2.35 H new ATOM 0 HD12 ILE A 9 -1.192 15.780 -9.178 1.00 2.35 H new ATOM 0 HD13 ILE A 9 0.301 16.553 -9.760 1.00 2.35 H new ATOM 141 N ALA A 10 -3.833 19.879 -9.463 1.00 2.97 N ATOM 142 CA ALA A 10 -4.706 21.031 -9.731 1.00 3.26 C ATOM 143 C ALA A 10 -6.066 20.831 -9.068 1.00 3.27 C ATOM 144 O ALA A 10 -6.739 21.800 -8.704 1.00 3.43 O ATOM 145 CB ALA A 10 -4.856 21.271 -11.226 1.00 3.61 C ATOM 0 H ALA A 10 -3.478 19.419 -10.301 1.00 2.97 H new ATOM 0 HA ALA A 10 -4.242 21.919 -9.302 1.00 3.26 H new ATOM 0 HB1 ALA A 10 -5.507 22.129 -11.393 1.00 3.61 H new ATOM 0 HB2 ALA A 10 -3.877 21.468 -11.663 1.00 3.61 H new ATOM 0 HB3 ALA A 10 -5.292 20.388 -11.694 1.00 3.61 H new ATOM 151 N GLU A 11 -6.453 19.555 -8.921 1.00 3.14 N ATOM 152 CA GLU A 11 -7.694 19.190 -8.232 1.00 3.18 C ATOM 153 C GLU A 11 -7.449 19.132 -6.734 1.00 2.87 C ATOM 154 O GLU A 11 -8.367 19.300 -5.928 1.00 2.94 O ATOM 155 CB GLU A 11 -8.199 17.829 -8.696 1.00 3.24 C ATOM 156 CG GLU A 11 -8.589 17.766 -10.167 1.00 3.63 C ATOM 157 CD GLU A 11 -9.085 16.394 -10.580 1.00 3.78 C ATOM 158 OE1 GLU A 11 -8.251 15.562 -10.998 1.00 4.13 O ATOM 159 OE2 GLU A 11 -10.306 16.151 -10.486 1.00 3.90 O ATOM 0 H GLU A 11 -5.921 18.759 -9.272 1.00 3.14 H new ATOM 0 HA GLU A 11 -8.444 19.946 -8.466 1.00 3.18 H new ATOM 0 HB2 GLU A 11 -7.425 17.085 -8.506 1.00 3.24 H new ATOM 0 HB3 GLU A 11 -9.063 17.551 -8.092 1.00 3.24 H new ATOM 0 HG2 GLU A 11 -9.366 18.504 -10.365 1.00 3.63 H new ATOM 0 HG3 GLU A 11 -7.729 18.037 -10.779 1.00 3.63 H new ATOM 166 N PHE A 12 -6.192 18.864 -6.386 1.00 2.56 N ATOM 167 CA PHE A 12 -5.761 18.788 -4.997 1.00 2.24 C ATOM 168 C PHE A 12 -5.674 20.183 -4.360 1.00 2.30 C ATOM 169 O PHE A 12 -5.986 20.337 -3.175 1.00 2.22 O ATOM 170 CB PHE A 12 -4.398 18.083 -4.897 1.00 1.94 C ATOM 171 CG PHE A 12 -4.417 16.573 -5.105 1.00 1.85 C ATOM 172 CD1 PHE A 12 -3.268 15.826 -4.866 1.00 2.28 C ATOM 173 CD2 PHE A 12 -5.567 15.892 -5.505 1.00 2.07 C ATOM 174 CE1 PHE A 12 -3.268 14.451 -5.011 1.00 2.34 C ATOM 175 CE2 PHE A 12 -5.557 14.525 -5.659 1.00 2.03 C ATOM 176 CZ PHE A 12 -4.423 13.803 -5.411 1.00 1.90 C ATOM 0 H PHE A 12 -5.446 18.694 -7.061 1.00 2.56 H new ATOM 0 HA PHE A 12 -6.506 18.210 -4.451 1.00 2.24 H new ATOM 0 HB2 PHE A 12 -3.727 18.524 -5.634 1.00 1.94 H new ATOM 0 HB3 PHE A 12 -3.974 18.290 -3.915 1.00 1.94 H new ATOM 0 HD1 PHE A 12 -2.361 16.328 -4.562 1.00 2.28 H new ATOM 0 HD2 PHE A 12 -6.475 16.444 -5.696 1.00 2.07 H new ATOM 0 HE1 PHE A 12 -2.370 13.885 -4.813 1.00 2.34 H new ATOM 0 HE2 PHE A 12 -6.455 14.017 -5.979 1.00 2.03 H new ATOM 0 HZ PHE A 12 -4.429 12.729 -5.527 1.00 1.90 H new ATOM 186 N LYS A 13 -5.249 21.203 -5.147 1.00 2.51 N ATOM 187 CA LYS A 13 -5.132 22.579 -4.626 1.00 2.67 C ATOM 188 C LYS A 13 -6.474 23.300 -4.554 1.00 2.96 C ATOM 189 O LYS A 13 -6.610 24.243 -3.775 1.00 3.07 O ATOM 190 CB LYS A 13 -4.110 23.436 -5.400 1.00 2.86 C ATOM 191 CG LYS A 13 -4.058 23.210 -6.915 1.00 3.04 C ATOM 192 CD LYS A 13 -2.667 22.763 -7.372 1.00 2.93 C ATOM 193 CE LYS A 13 -1.672 23.921 -7.447 1.00 3.15 C ATOM 194 NZ LYS A 13 -0.325 23.468 -7.893 1.00 3.58 N ATOM 0 H LYS A 13 -4.987 21.098 -6.127 1.00 2.51 H new ATOM 0 HA LYS A 13 -4.759 22.458 -3.609 1.00 2.67 H new ATOM 0 HB2 LYS A 13 -4.333 24.487 -5.216 1.00 2.86 H new ATOM 0 HB3 LYS A 13 -3.119 23.244 -4.989 1.00 2.86 H new ATOM 0 HG2 LYS A 13 -4.793 22.456 -7.196 1.00 3.04 H new ATOM 0 HG3 LYS A 13 -4.332 24.131 -7.430 1.00 3.04 H new ATOM 0 HD2 LYS A 13 -2.288 22.007 -6.684 1.00 2.93 H new ATOM 0 HD3 LYS A 13 -2.745 22.292 -8.352 1.00 2.93 H new ATOM 0 HE2 LYS A 13 -2.047 24.678 -8.136 1.00 3.15 H new ATOM 0 HE3 LYS A 13 -1.590 24.394 -6.468 1.00 3.15 H new ATOM 0 HZ1 LYS A 13 0.320 24.283 -7.931 1.00 3.58 H new ATOM 0 HZ2 LYS A 13 0.044 22.764 -7.222 1.00 3.58 H new ATOM 0 HZ3 LYS A 13 -0.398 23.040 -8.838 1.00 3.58 H new ATOM 208 N GLU A 14 -7.466 22.875 -5.356 1.00 3.12 N ATOM 209 CA GLU A 14 -8.793 23.508 -5.296 1.00 3.43 C ATOM 210 C GLU A 14 -9.512 23.117 -3.989 1.00 3.34 C ATOM 211 O GLU A 14 -10.369 23.854 -3.495 1.00 3.56 O ATOM 212 CB GLU A 14 -9.647 23.162 -6.537 1.00 3.67 C ATOM 213 CG GLU A 14 -9.961 21.680 -6.727 1.00 4.07 C ATOM 214 CD GLU A 14 -10.579 21.383 -8.079 1.00 4.36 C ATOM 215 OE1 GLU A 14 -9.819 21.188 -9.050 1.00 4.71 O ATOM 216 OE2 GLU A 14 -11.825 21.344 -8.166 1.00 4.52 O ATOM 0 H GLU A 14 -7.379 22.118 -6.034 1.00 3.12 H new ATOM 0 HA GLU A 14 -8.654 24.589 -5.301 1.00 3.43 H new ATOM 0 HB2 GLU A 14 -10.587 23.709 -6.473 1.00 3.67 H new ATOM 0 HB3 GLU A 14 -9.128 23.522 -7.425 1.00 3.67 H new ATOM 0 HG2 GLU A 14 -9.044 21.101 -6.616 1.00 4.07 H new ATOM 0 HG3 GLU A 14 -10.642 21.353 -5.941 1.00 4.07 H new ATOM 223 N ALA A 15 -9.136 21.942 -3.453 1.00 3.04 N ATOM 224 CA ALA A 15 -9.705 21.416 -2.212 1.00 2.97 C ATOM 225 C ALA A 15 -8.953 21.892 -0.973 1.00 2.76 C ATOM 226 O ALA A 15 -9.538 22.536 -0.106 1.00 2.91 O ATOM 227 CB ALA A 15 -9.745 19.883 -2.252 1.00 2.84 C ATOM 0 H ALA A 15 -8.430 21.336 -3.872 1.00 3.04 H new ATOM 0 HA ALA A 15 -10.721 21.805 -2.138 1.00 2.97 H new ATOM 0 HB1 ALA A 15 -10.171 19.506 -1.322 1.00 2.84 H new ATOM 0 HB2 ALA A 15 -10.360 19.557 -3.091 1.00 2.84 H new ATOM 0 HB3 ALA A 15 -8.733 19.496 -2.371 1.00 2.84 H new ATOM 233 N PHE A 16 -7.656 21.557 -0.888 1.00 2.45 N ATOM 234 CA PHE A 16 -6.806 21.946 0.250 1.00 2.28 C ATOM 235 C PHE A 16 -6.961 23.432 0.568 1.00 2.56 C ATOM 236 O PHE A 16 -7.079 23.823 1.727 1.00 2.60 O ATOM 237 CB PHE A 16 -5.342 21.639 -0.085 1.00 2.02 C ATOM 238 CG PHE A 16 -4.354 21.766 1.058 1.00 1.86 C ATOM 239 CD1 PHE A 16 -3.709 20.640 1.548 1.00 2.18 C ATOM 240 CD2 PHE A 16 -4.044 23.006 1.612 1.00 2.17 C ATOM 241 CE1 PHE A 16 -2.784 20.736 2.557 1.00 2.21 C ATOM 242 CE2 PHE A 16 -3.117 23.102 2.635 1.00 2.07 C ATOM 243 CZ PHE A 16 -2.489 21.961 3.103 1.00 1.79 C ATOM 0 H PHE A 16 -7.169 21.013 -1.600 1.00 2.45 H new ATOM 0 HA PHE A 16 -7.115 21.377 1.127 1.00 2.28 H new ATOM 0 HB2 PHE A 16 -5.286 20.623 -0.476 1.00 2.02 H new ATOM 0 HB3 PHE A 16 -5.026 22.307 -0.887 1.00 2.02 H new ATOM 0 HD1 PHE A 16 -3.939 19.672 1.128 1.00 2.18 H new ATOM 0 HD2 PHE A 16 -4.529 23.897 1.241 1.00 2.17 H new ATOM 0 HE1 PHE A 16 -2.288 19.849 2.922 1.00 2.21 H new ATOM 0 HE2 PHE A 16 -2.884 24.064 3.067 1.00 2.07 H new ATOM 0 HZ PHE A 16 -1.764 22.034 3.900 1.00 1.79 H new ATOM 253 N SER A 17 -6.985 24.237 -0.487 1.00 2.80 N ATOM 254 CA SER A 17 -7.099 25.672 -0.365 1.00 3.11 C ATOM 255 C SER A 17 -8.467 26.129 0.112 1.00 3.36 C ATOM 256 O SER A 17 -8.600 27.256 0.599 1.00 3.59 O ATOM 257 CB SER A 17 -6.760 26.345 -1.689 1.00 3.33 C ATOM 258 OG SER A 17 -5.387 26.196 -2.004 1.00 3.30 O ATOM 0 H SER A 17 -6.925 23.906 -1.450 1.00 2.80 H new ATOM 0 HA SER A 17 -6.383 25.972 0.400 1.00 3.11 H new ATOM 0 HB2 SER A 17 -7.367 25.914 -2.485 1.00 3.33 H new ATOM 0 HB3 SER A 17 -7.010 27.404 -1.636 1.00 3.33 H new ATOM 0 HG SER A 17 -5.281 25.495 -2.681 1.00 3.30 H new ATOM 264 N LEU A 18 -9.491 25.268 -0.020 1.00 3.35 N ATOM 265 CA LEU A 18 -10.830 25.632 0.415 1.00 3.63 C ATOM 266 C LEU A 18 -10.880 25.751 1.932 1.00 3.56 C ATOM 267 O LEU A 18 -11.780 26.367 2.509 1.00 3.81 O ATOM 268 CB LEU A 18 -11.869 24.646 -0.136 1.00 3.72 C ATOM 269 CG LEU A 18 -12.178 23.446 0.750 1.00 3.54 C ATOM 270 CD1 LEU A 18 -13.346 23.734 1.688 1.00 3.79 C ATOM 271 CD2 LEU A 18 -12.457 22.195 -0.071 1.00 3.53 C ATOM 0 H LEU A 18 -9.410 24.333 -0.419 1.00 3.35 H new ATOM 0 HA LEU A 18 -11.084 26.611 0.008 1.00 3.63 H new ATOM 0 HB2 LEU A 18 -12.797 25.189 -0.317 1.00 3.72 H new ATOM 0 HB3 LEU A 18 -11.519 24.281 -1.102 1.00 3.72 H new ATOM 0 HG LEU A 18 -11.289 23.262 1.353 1.00 3.54 H new ATOM 0 HD11 LEU A 18 -13.541 22.858 2.306 1.00 3.79 H new ATOM 0 HD12 LEU A 18 -13.099 24.582 2.327 1.00 3.79 H new ATOM 0 HD13 LEU A 18 -14.234 23.969 1.102 1.00 3.79 H new ATOM 0 HD21 LEU A 18 -12.673 21.362 0.598 1.00 3.53 H new ATOM 0 HD22 LEU A 18 -13.314 22.370 -0.721 1.00 3.53 H new ATOM 0 HD23 LEU A 18 -11.584 21.956 -0.678 1.00 3.53 H new ATOM 283 N PHE A 19 -9.883 25.138 2.530 1.00 3.24 N ATOM 284 CA PHE A 19 -9.704 25.128 3.972 1.00 3.16 C ATOM 285 C PHE A 19 -8.496 25.985 4.348 1.00 3.11 C ATOM 286 O PHE A 19 -8.139 26.093 5.528 1.00 3.07 O ATOM 287 CB PHE A 19 -9.505 23.693 4.467 1.00 2.89 C ATOM 288 CG PHE A 19 -10.672 22.769 4.208 1.00 3.01 C ATOM 289 CD1 PHE A 19 -11.850 22.884 4.935 1.00 3.31 C ATOM 290 CD2 PHE A 19 -10.585 21.783 3.238 1.00 3.27 C ATOM 291 CE1 PHE A 19 -12.914 22.034 4.698 1.00 3.50 C ATOM 292 CE2 PHE A 19 -11.646 20.931 2.997 1.00 3.41 C ATOM 293 CZ PHE A 19 -12.812 21.057 3.728 1.00 3.37 C ATOM 0 H PHE A 19 -9.161 24.624 2.025 1.00 3.24 H new ATOM 0 HA PHE A 19 -10.595 25.541 4.445 1.00 3.16 H new ATOM 0 HB2 PHE A 19 -8.617 23.278 3.989 1.00 2.89 H new ATOM 0 HB3 PHE A 19 -9.309 23.717 5.539 1.00 2.89 H new ATOM 0 HD1 PHE A 19 -11.936 23.647 5.695 1.00 3.31 H new ATOM 0 HD2 PHE A 19 -9.677 21.679 2.663 1.00 3.27 H new ATOM 0 HE1 PHE A 19 -13.824 22.134 5.271 1.00 3.50 H new ATOM 0 HE2 PHE A 19 -11.564 20.167 2.238 1.00 3.41 H new ATOM 0 HZ PHE A 19 -13.642 20.392 3.541 1.00 3.37 H new ATOM 303 N ALA A 20 -7.878 26.610 3.327 1.00 3.18 N ATOM 304 CA ALA A 20 -6.683 27.461 3.534 1.00 3.22 C ATOM 305 C ALA A 20 -6.999 28.741 4.331 1.00 3.51 C ATOM 306 O ALA A 20 -7.336 29.786 3.758 1.00 3.80 O ATOM 307 CB ALA A 20 -6.032 27.807 2.199 1.00 3.38 C ATOM 0 H ALA A 20 -8.182 26.544 2.355 1.00 3.18 H new ATOM 0 HA ALA A 20 -5.981 26.880 4.132 1.00 3.22 H new ATOM 0 HB1 ALA A 20 -5.156 28.432 2.372 1.00 3.38 H new ATOM 0 HB2 ALA A 20 -5.729 26.890 1.694 1.00 3.38 H new ATOM 0 HB3 ALA A 20 -6.745 28.346 1.575 1.00 3.38 H new ATOM 354 N ASP A 24 0.478 29.609 7.059 1.00 3.98 N ATOM 355 CA ASP A 24 1.656 29.052 6.357 1.00 3.89 C ATOM 356 C ASP A 24 1.237 28.310 5.077 1.00 3.62 C ATOM 357 O ASP A 24 2.078 27.890 4.275 1.00 3.56 O ATOM 358 CB ASP A 24 2.428 28.104 7.282 1.00 3.77 C ATOM 359 CG ASP A 24 3.131 28.833 8.412 1.00 4.13 C ATOM 360 OD1 ASP A 24 4.300 29.232 8.226 1.00 4.50 O ATOM 361 OD2 ASP A 24 2.512 29.006 9.483 1.00 4.32 O ATOM 0 HA ASP A 24 2.303 29.883 6.076 1.00 3.89 H new ATOM 0 HB2 ASP A 24 1.739 27.371 7.701 1.00 3.77 H new ATOM 0 HB3 ASP A 24 3.164 27.552 6.698 1.00 3.77 H new ATOM 366 N GLY A 25 -0.083 28.176 4.918 1.00 3.50 N ATOM 367 CA GLY A 25 -0.684 27.523 3.769 1.00 3.30 C ATOM 368 C GLY A 25 -0.898 26.077 4.076 1.00 2.90 C ATOM 369 O GLY A 25 -0.442 25.187 3.352 1.00 2.69 O ATOM 0 H GLY A 25 -0.764 28.523 5.593 1.00 3.50 H new ATOM 0 HA2 GLY A 25 -1.633 27.998 3.522 1.00 3.30 H new ATOM 0 HA3 GLY A 25 -0.038 27.629 2.897 1.00 3.30 H new ATOM 373 N THR A 26 -1.616 25.869 5.183 1.00 2.85 N ATOM 374 CA THR A 26 -1.890 24.543 5.685 1.00 2.53 C ATOM 375 C THR A 26 -3.373 24.303 5.948 1.00 2.45 C ATOM 376 O THR A 26 -4.194 25.219 5.835 1.00 2.66 O ATOM 377 CB THR A 26 -1.115 24.267 6.981 1.00 2.59 C ATOM 378 OG1 THR A 26 -1.564 25.099 8.058 1.00 2.84 O ATOM 379 CG2 THR A 26 0.344 24.471 6.745 1.00 2.74 C ATOM 0 H THR A 26 -2.017 26.619 5.746 1.00 2.85 H new ATOM 0 HA THR A 26 -1.564 23.861 4.900 1.00 2.53 H new ATOM 0 HB THR A 26 -1.299 23.232 7.270 1.00 2.59 H new ATOM 0 HG1 THR A 26 -0.798 25.359 8.612 1.00 2.84 H new ATOM 0 HG21 THR A 26 0.893 24.275 7.666 1.00 2.74 H new ATOM 0 HG22 THR A 26 0.686 23.789 5.967 1.00 2.74 H new ATOM 0 HG23 THR A 26 0.521 25.499 6.429 1.00 2.74 H new ATOM 387 N ILE A 27 -3.695 23.051 6.314 1.00 2.21 N ATOM 388 CA ILE A 27 -5.079 22.640 6.622 1.00 2.22 C ATOM 389 C ILE A 27 -5.054 21.543 7.687 1.00 2.15 C ATOM 390 O ILE A 27 -4.001 21.240 8.229 1.00 2.13 O ATOM 391 CB ILE A 27 -5.892 22.168 5.371 1.00 2.13 C ATOM 392 CG1 ILE A 27 -5.278 20.895 4.763 1.00 1.82 C ATOM 393 CG2 ILE A 27 -6.015 23.299 4.349 1.00 2.31 C ATOM 394 CD1 ILE A 27 -6.177 20.201 3.760 1.00 1.79 C ATOM 0 H ILE A 27 -3.011 22.300 6.405 1.00 2.21 H new ATOM 0 HA ILE A 27 -5.597 23.524 6.994 1.00 2.22 H new ATOM 0 HB ILE A 27 -6.902 21.910 5.689 1.00 2.13 H new ATOM 0 HG12 ILE A 27 -4.338 21.153 4.276 1.00 1.82 H new ATOM 0 HG13 ILE A 27 -5.040 20.198 5.567 1.00 1.82 H new ATOM 0 HG21 ILE A 27 -6.584 22.950 3.487 1.00 2.31 H new ATOM 0 HG22 ILE A 27 -6.529 24.146 4.804 1.00 2.31 H new ATOM 0 HG23 ILE A 27 -5.021 23.608 4.027 1.00 2.31 H new ATOM 0 HD11 ILE A 27 -5.676 19.313 3.375 1.00 1.79 H new ATOM 0 HD12 ILE A 27 -7.108 19.910 4.246 1.00 1.79 H new ATOM 0 HD13 ILE A 27 -6.395 20.880 2.936 1.00 1.79 H new ATOM 406 N THR A 28 -6.210 20.980 8.005 1.00 2.23 N ATOM 407 CA THR A 28 -6.287 19.915 9.005 1.00 2.29 C ATOM 408 C THR A 28 -6.425 18.560 8.304 1.00 2.17 C ATOM 409 O THR A 28 -6.369 18.490 7.070 1.00 2.04 O ATOM 410 CB THR A 28 -7.433 20.144 10.032 1.00 2.57 C ATOM 411 OG1 THR A 28 -8.714 19.969 9.411 1.00 2.86 O ATOM 412 CG2 THR A 28 -7.364 21.537 10.657 1.00 3.10 C ATOM 0 H THR A 28 -7.105 21.238 7.590 1.00 2.23 H new ATOM 0 HA THR A 28 -5.361 19.926 9.580 1.00 2.29 H new ATOM 0 HB THR A 28 -7.305 19.403 10.821 1.00 2.57 H new ATOM 0 HG1 THR A 28 -9.143 20.842 9.295 1.00 2.86 H new ATOM 0 HG21 THR A 28 -8.181 21.658 11.368 1.00 3.10 H new ATOM 0 HG22 THR A 28 -6.412 21.657 11.174 1.00 3.10 H new ATOM 0 HG23 THR A 28 -7.450 22.291 9.875 1.00 3.10 H new ATOM 420 N THR A 29 -6.604 17.493 9.082 1.00 2.30 N ATOM 421 CA THR A 29 -6.667 16.143 8.527 1.00 2.30 C ATOM 422 C THR A 29 -8.056 15.695 8.084 1.00 2.50 C ATOM 423 O THR A 29 -8.209 15.176 6.975 1.00 2.44 O ATOM 424 CB THR A 29 -6.098 15.125 9.500 1.00 2.48 C ATOM 425 OG1 THR A 29 -6.614 15.337 10.822 1.00 2.75 O ATOM 426 CG2 THR A 29 -4.590 15.237 9.492 1.00 2.32 C ATOM 0 H THR A 29 -6.708 17.538 10.096 1.00 2.30 H new ATOM 0 HA THR A 29 -6.058 16.192 7.625 1.00 2.30 H new ATOM 0 HB THR A 29 -6.394 14.123 9.191 1.00 2.48 H new ATOM 0 HG1 THR A 29 -6.236 14.669 11.432 1.00 2.75 H new ATOM 0 HG21 THR A 29 -4.168 14.511 10.187 1.00 2.32 H new ATOM 0 HG22 THR A 29 -4.216 15.038 8.488 1.00 2.32 H new ATOM 0 HG23 THR A 29 -4.298 16.242 9.796 1.00 2.32 H new ATOM 434 N LYS A 30 -9.060 15.872 8.950 1.00 2.77 N ATOM 435 CA LYS A 30 -10.449 15.476 8.636 1.00 3.04 C ATOM 436 C LYS A 30 -10.940 16.107 7.325 1.00 2.98 C ATOM 437 O LYS A 30 -11.685 15.482 6.565 1.00 3.14 O ATOM 438 CB LYS A 30 -11.384 15.872 9.784 1.00 3.33 C ATOM 439 CG LYS A 30 -11.209 15.026 11.039 1.00 3.42 C ATOM 440 CD LYS A 30 -11.118 15.895 12.282 1.00 3.38 C ATOM 441 CE LYS A 30 -10.951 15.055 13.538 1.00 3.68 C ATOM 442 NZ LYS A 30 -10.861 15.898 14.763 1.00 3.70 N ATOM 0 H LYS A 30 -8.943 16.286 9.875 1.00 2.77 H new ATOM 0 HA LYS A 30 -10.460 14.393 8.512 1.00 3.04 H new ATOM 0 HB2 LYS A 30 -11.212 16.919 10.036 1.00 3.33 H new ATOM 0 HB3 LYS A 30 -12.416 15.791 9.444 1.00 3.33 H new ATOM 0 HG2 LYS A 30 -12.048 14.337 11.135 1.00 3.42 H new ATOM 0 HG3 LYS A 30 -10.307 14.420 10.949 1.00 3.42 H new ATOM 0 HD2 LYS A 30 -10.276 16.581 12.187 1.00 3.38 H new ATOM 0 HD3 LYS A 30 -12.017 16.505 12.368 1.00 3.38 H new ATOM 0 HE2 LYS A 30 -11.793 14.369 13.631 1.00 3.68 H new ATOM 0 HE3 LYS A 30 -10.052 14.445 13.450 1.00 3.68 H new ATOM 0 HZ1 LYS A 30 -10.748 15.287 15.597 1.00 3.70 H new ATOM 0 HZ2 LYS A 30 -10.043 16.535 14.687 1.00 3.70 H new ATOM 0 HZ3 LYS A 30 -11.730 16.461 14.862 1.00 3.70 H new ATOM 456 N GLU A 31 -10.507 17.348 7.086 1.00 2.81 N ATOM 457 CA GLU A 31 -10.874 18.105 5.885 1.00 2.81 C ATOM 458 C GLU A 31 -9.904 17.883 4.714 1.00 2.52 C ATOM 459 O GLU A 31 -10.227 18.264 3.584 1.00 2.57 O ATOM 460 CB GLU A 31 -10.968 19.601 6.221 1.00 2.89 C ATOM 461 CG GLU A 31 -12.047 19.935 7.248 1.00 3.24 C ATOM 462 CD GLU A 31 -11.857 21.299 7.887 1.00 3.22 C ATOM 463 OE1 GLU A 31 -10.841 21.492 8.590 1.00 3.26 O ATOM 464 OE2 GLU A 31 -12.728 22.172 7.692 1.00 3.60 O ATOM 0 H GLU A 31 -9.891 17.857 7.720 1.00 2.81 H new ATOM 0 HA GLU A 31 -11.846 17.734 5.558 1.00 2.81 H new ATOM 0 HB2 GLU A 31 -10.003 19.941 6.598 1.00 2.89 H new ATOM 0 HB3 GLU A 31 -11.166 20.158 5.305 1.00 2.89 H new ATOM 0 HG2 GLU A 31 -13.024 19.899 6.765 1.00 3.24 H new ATOM 0 HG3 GLU A 31 -12.048 19.172 8.027 1.00 3.24 H new ATOM 471 N LEU A 32 -8.720 17.270 4.960 1.00 2.26 N ATOM 472 CA LEU A 32 -7.757 17.040 3.866 1.00 1.98 C ATOM 473 C LEU A 32 -8.155 15.876 2.990 1.00 2.07 C ATOM 474 O LEU A 32 -7.920 15.894 1.787 1.00 1.98 O ATOM 475 CB LEU A 32 -6.311 16.889 4.337 1.00 1.69 C ATOM 476 CG LEU A 32 -5.907 15.733 5.260 1.00 1.74 C ATOM 477 CD1 LEU A 32 -5.753 14.395 4.541 1.00 1.76 C ATOM 478 CD2 LEU A 32 -4.586 16.111 5.834 1.00 1.59 C ATOM 0 H LEU A 32 -8.419 16.937 5.876 1.00 2.26 H new ATOM 0 HA LEU A 32 -7.795 17.950 3.267 1.00 1.98 H new ATOM 0 HB2 LEU A 32 -5.688 16.820 3.445 1.00 1.69 H new ATOM 0 HB3 LEU A 32 -6.040 17.815 4.844 1.00 1.69 H new ATOM 0 HG LEU A 32 -6.691 15.591 6.004 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -5.466 13.627 5.259 1.00 1.76 H new ATOM 0 HD12 LEU A 32 -6.700 14.121 4.075 1.00 1.76 H new ATOM 0 HD13 LEU A 32 -4.983 14.480 3.774 1.00 1.76 H new ATOM 0 HD21 LEU A 32 -4.242 15.323 6.504 1.00 1.59 H new ATOM 0 HD22 LEU A 32 -3.864 16.243 5.028 1.00 1.59 H new ATOM 0 HD23 LEU A 32 -4.684 17.043 6.390 1.00 1.59 H new ATOM 490 N GLY A 33 -8.711 14.842 3.609 1.00 2.31 N ATOM 491 CA GLY A 33 -9.206 13.705 2.847 1.00 2.52 C ATOM 492 C GLY A 33 -10.336 14.127 1.955 1.00 2.75 C ATOM 493 O GLY A 33 -10.696 13.422 1.022 1.00 2.91 O ATOM 0 H GLY A 33 -8.829 14.768 4.619 1.00 2.31 H new ATOM 0 HA2 GLY A 33 -8.400 13.281 2.248 1.00 2.52 H new ATOM 0 HA3 GLY A 33 -9.543 12.922 3.527 1.00 2.52 H new ATOM 497 N THR A 34 -10.917 15.289 2.294 1.00 2.81 N ATOM 498 CA THR A 34 -11.971 15.896 1.505 1.00 3.07 C ATOM 499 C THR A 34 -11.372 16.374 0.196 1.00 2.93 C ATOM 500 O THR A 34 -12.063 16.639 -0.791 1.00 3.16 O ATOM 501 CB THR A 34 -12.715 17.029 2.260 1.00 3.23 C ATOM 502 OG1 THR A 34 -12.930 16.645 3.624 1.00 3.30 O ATOM 503 CG2 THR A 34 -14.063 17.347 1.616 1.00 3.60 C ATOM 0 H THR A 34 -10.661 15.824 3.124 1.00 2.81 H new ATOM 0 HA THR A 34 -12.738 15.148 1.305 1.00 3.07 H new ATOM 0 HB THR A 34 -12.091 17.921 2.211 1.00 3.23 H new ATOM 0 HG1 THR A 34 -13.398 17.365 4.096 1.00 3.30 H new ATOM 0 HG21 THR A 34 -14.553 18.145 2.173 1.00 3.60 H new ATOM 0 HG22 THR A 34 -13.908 17.666 0.586 1.00 3.60 H new ATOM 0 HG23 THR A 34 -14.691 16.457 1.629 1.00 3.60 H new ATOM 511 N VAL A 35 -10.058 16.468 0.257 1.00 2.56 N ATOM 512 CA VAL A 35 -9.217 16.783 -0.892 1.00 2.39 C ATOM 513 C VAL A 35 -9.079 15.489 -1.657 1.00 2.44 C ATOM 514 O VAL A 35 -9.078 15.491 -2.883 1.00 2.53 O ATOM 515 CB VAL A 35 -7.758 17.262 -0.558 1.00 2.01 C ATOM 516 CG1 VAL A 35 -6.921 17.424 -1.827 1.00 1.92 C ATOM 517 CG2 VAL A 35 -7.716 18.563 0.213 1.00 2.02 C ATOM 0 H VAL A 35 -9.531 16.326 1.119 1.00 2.56 H new ATOM 0 HA VAL A 35 -9.693 17.608 -1.422 1.00 2.39 H new ATOM 0 HB VAL A 35 -7.339 16.478 0.074 1.00 2.01 H new ATOM 0 HG11 VAL A 35 -5.918 17.756 -1.561 1.00 1.92 H new ATOM 0 HG12 VAL A 35 -6.861 16.468 -2.348 1.00 1.92 H new ATOM 0 HG13 VAL A 35 -7.387 18.163 -2.478 1.00 1.92 H new ATOM 0 HG21 VAL A 35 -6.679 18.836 0.410 1.00 2.02 H new ATOM 0 HG22 VAL A 35 -8.193 19.349 -0.373 1.00 2.02 H new ATOM 0 HG23 VAL A 35 -8.246 18.443 1.158 1.00 2.02 H new ATOM 527 N MET A 36 -8.969 14.374 -0.900 1.00 2.44 N ATOM 528 CA MET A 36 -8.799 13.079 -1.514 1.00 2.55 C ATOM 529 C MET A 36 -10.129 12.466 -1.971 1.00 2.97 C ATOM 530 O MET A 36 -10.207 11.904 -3.068 1.00 3.11 O ATOM 531 CB MET A 36 -8.093 12.126 -0.550 1.00 2.49 C ATOM 532 CG MET A 36 -7.097 11.185 -1.216 1.00 2.24 C ATOM 533 SD MET A 36 -6.392 9.982 -0.067 1.00 2.48 S ATOM 534 CE MET A 36 -5.150 10.968 0.771 1.00 1.96 C ATOM 0 H MET A 36 -8.997 14.364 0.120 1.00 2.44 H new ATOM 0 HA MET A 36 -8.186 13.227 -2.403 1.00 2.55 H new ATOM 0 HB2 MET A 36 -7.571 12.713 0.206 1.00 2.49 H new ATOM 0 HB3 MET A 36 -8.844 11.532 -0.029 1.00 2.49 H new ATOM 0 HG2 MET A 36 -7.593 10.656 -2.030 1.00 2.24 H new ATOM 0 HG3 MET A 36 -6.292 11.771 -1.660 1.00 2.24 H new ATOM 0 HE1 MET A 36 -5.117 10.693 1.825 1.00 1.96 H new ATOM 0 HE2 MET A 36 -4.175 10.787 0.318 1.00 1.96 H new ATOM 0 HE3 MET A 36 -5.402 12.025 0.679 1.00 1.96 H new ATOM 544 N ARG A 37 -11.180 12.605 -1.136 1.00 3.18 N ATOM 545 CA ARG A 37 -12.486 12.000 -1.399 1.00 3.60 C ATOM 546 C ARG A 37 -13.196 12.581 -2.631 1.00 3.77 C ATOM 547 O ARG A 37 -14.120 11.964 -3.170 1.00 4.10 O ATOM 548 CB ARG A 37 -13.398 12.198 -0.179 1.00 3.78 C ATOM 549 CG ARG A 37 -13.592 10.958 0.686 1.00 4.18 C ATOM 550 CD ARG A 37 -14.689 10.047 0.141 1.00 4.52 C ATOM 551 NE ARG A 37 -15.031 8.972 1.078 1.00 4.90 N ATOM 552 CZ ARG A 37 -16.079 8.146 0.945 1.00 5.36 C ATOM 553 NH1 ARG A 37 -16.912 8.252 -0.089 1.00 5.45 N ATOM 554 NH2 ARG A 37 -16.292 7.207 1.856 1.00 5.91 N ATOM 0 H ARG A 37 -11.140 13.138 -0.267 1.00 3.18 H new ATOM 0 HA ARG A 37 -12.299 10.944 -1.596 1.00 3.60 H new ATOM 0 HB2 ARG A 37 -12.984 12.994 0.440 1.00 3.78 H new ATOM 0 HB3 ARG A 37 -14.374 12.538 -0.525 1.00 3.78 H new ATOM 0 HG2 ARG A 37 -12.655 10.404 0.741 1.00 4.18 H new ATOM 0 HG3 ARG A 37 -13.844 11.261 1.702 1.00 4.18 H new ATOM 0 HD2 ARG A 37 -15.579 10.639 -0.071 1.00 4.52 H new ATOM 0 HD3 ARG A 37 -14.363 9.613 -0.804 1.00 4.52 H new ATOM 0 HE ARG A 37 -14.428 8.843 1.890 1.00 4.90 H new ATOM 0 HH11 ARG A 37 -16.758 8.971 -0.796 1.00 5.45 H new ATOM 0 HH12 ARG A 37 -17.704 7.615 -0.173 1.00 5.45 H new ATOM 0 HH21 ARG A 37 -15.661 7.116 2.652 1.00 5.91 H new ATOM 0 HH22 ARG A 37 -17.087 6.575 1.761 1.00 5.91 H new ATOM 568 N SER A 38 -12.751 13.763 -3.060 1.00 3.57 N ATOM 569 CA SER A 38 -13.348 14.479 -4.199 1.00 3.76 C ATOM 570 C SER A 38 -12.958 13.895 -5.561 1.00 3.81 C ATOM 571 O SER A 38 -13.693 14.072 -6.537 1.00 4.08 O ATOM 572 CB SER A 38 -12.960 15.957 -4.149 1.00 3.59 C ATOM 573 OG SER A 38 -13.538 16.599 -3.026 1.00 3.89 O ATOM 0 H SER A 38 -11.967 14.255 -2.631 1.00 3.57 H new ATOM 0 HA SER A 38 -14.427 14.362 -4.102 1.00 3.76 H new ATOM 0 HB2 SER A 38 -11.875 16.050 -4.106 1.00 3.59 H new ATOM 0 HB3 SER A 38 -13.286 16.453 -5.063 1.00 3.59 H new ATOM 0 HG SER A 38 -12.843 16.782 -2.360 1.00 3.89 H new ATOM 579 N LEU A 39 -11.813 13.205 -5.628 1.00 3.59 N ATOM 580 CA LEU A 39 -11.348 12.617 -6.891 1.00 3.65 C ATOM 581 C LEU A 39 -11.760 11.148 -7.023 1.00 3.91 C ATOM 582 O LEU A 39 -11.588 10.540 -8.085 1.00 4.06 O ATOM 583 CB LEU A 39 -9.829 12.754 -7.039 1.00 3.29 C ATOM 584 CG LEU A 39 -9.289 14.158 -6.779 1.00 3.06 C ATOM 585 CD1 LEU A 39 -8.802 14.263 -5.355 1.00 2.78 C ATOM 586 CD2 LEU A 39 -8.188 14.519 -7.750 1.00 3.19 C ATOM 0 H LEU A 39 -11.197 13.041 -4.832 1.00 3.59 H new ATOM 0 HA LEU A 39 -11.829 13.174 -7.695 1.00 3.65 H new ATOM 0 HB2 LEU A 39 -9.346 12.060 -6.351 1.00 3.29 H new ATOM 0 HB3 LEU A 39 -9.547 12.451 -8.047 1.00 3.29 H new ATOM 0 HG LEU A 39 -10.101 14.869 -6.932 1.00 3.06 H new ATOM 0 HD11 LEU A 39 -8.418 15.267 -5.175 1.00 2.78 H new ATOM 0 HD12 LEU A 39 -9.628 14.063 -4.672 1.00 2.78 H new ATOM 0 HD13 LEU A 39 -8.008 13.535 -5.187 1.00 2.78 H new ATOM 0 HD21 LEU A 39 -7.828 15.525 -7.534 1.00 3.19 H new ATOM 0 HD22 LEU A 39 -7.366 13.810 -7.648 1.00 3.19 H new ATOM 0 HD23 LEU A 39 -8.575 14.482 -8.768 1.00 3.19 H new ATOM 598 N GLY A 40 -12.311 10.595 -5.938 1.00 4.01 N ATOM 599 CA GLY A 40 -12.744 9.206 -5.927 1.00 4.30 C ATOM 600 C GLY A 40 -11.796 8.301 -5.160 1.00 4.16 C ATOM 601 O GLY A 40 -11.678 7.114 -5.478 1.00 4.36 O ATOM 0 H GLY A 40 -12.465 11.092 -5.061 1.00 4.01 H new ATOM 0 HA2 GLY A 40 -13.738 9.143 -5.483 1.00 4.30 H new ATOM 0 HA3 GLY A 40 -12.830 8.849 -6.953 1.00 4.30 H new ATOM 605 N GLN A 41 -11.118 8.866 -4.147 1.00 3.86 N ATOM 606 CA GLN A 41 -10.171 8.117 -3.316 1.00 3.74 C ATOM 607 C GLN A 41 -10.237 8.656 -1.898 1.00 3.60 C ATOM 608 O GLN A 41 -9.924 9.819 -1.662 1.00 3.46 O ATOM 609 CB GLN A 41 -8.732 8.257 -3.847 1.00 3.47 C ATOM 610 CG GLN A 41 -8.483 7.601 -5.199 1.00 3.68 C ATOM 611 CD GLN A 41 -7.007 7.415 -5.492 1.00 3.94 C ATOM 612 OE1 GLN A 41 -6.363 8.290 -6.071 1.00 4.34 O ATOM 613 NE2 GLN A 41 -6.464 6.271 -5.093 1.00 4.15 N ATOM 0 H GLN A 41 -11.212 9.847 -3.885 1.00 3.86 H new ATOM 0 HA GLN A 41 -10.441 7.061 -3.340 1.00 3.74 H new ATOM 0 HB2 GLN A 41 -8.489 9.317 -3.923 1.00 3.47 H new ATOM 0 HB3 GLN A 41 -8.047 7.825 -3.118 1.00 3.47 H new ATOM 0 HG2 GLN A 41 -8.980 6.631 -5.226 1.00 3.68 H new ATOM 0 HG3 GLN A 41 -8.932 8.211 -5.983 1.00 3.68 H new ATOM 0 HE21 GLN A 41 -7.036 5.574 -4.616 1.00 4.15 H new ATOM 0 HE22 GLN A 41 -5.475 6.089 -5.263 1.00 4.15 H new ATOM 622 N ASN A 42 -10.615 7.815 -0.949 1.00 3.76 N ATOM 623 CA ASN A 42 -10.727 8.255 0.425 1.00 3.68 C ATOM 624 C ASN A 42 -9.558 7.712 1.282 1.00 3.53 C ATOM 625 O ASN A 42 -9.148 6.566 1.077 1.00 3.67 O ATOM 626 CB ASN A 42 -12.083 7.821 1.022 1.00 4.06 C ATOM 627 CG ASN A 42 -12.308 6.312 1.011 1.00 4.60 C ATOM 628 OD1 ASN A 42 -12.845 5.760 0.051 1.00 4.82 O ATOM 629 ND2 ASN A 42 -11.896 5.644 2.082 1.00 5.19 N ATOM 0 H ASN A 42 -10.847 6.834 -1.106 1.00 3.76 H new ATOM 0 HA ASN A 42 -10.674 9.344 0.436 1.00 3.68 H new ATOM 0 HB2 ASN A 42 -12.149 8.181 2.049 1.00 4.06 H new ATOM 0 HB3 ASN A 42 -12.886 8.302 0.463 1.00 4.06 H new ATOM 0 HD21 ASN A 42 -12.020 4.633 2.131 1.00 5.19 H new ATOM 0 HD22 ASN A 42 -11.456 6.142 2.855 1.00 5.19 H new ATOM 636 N PRO A 43 -8.998 8.504 2.252 1.00 3.30 N ATOM 637 CA PRO A 43 -7.897 8.044 3.118 1.00 3.22 C ATOM 638 C PRO A 43 -8.402 7.329 4.383 1.00 3.54 C ATOM 639 O PRO A 43 -9.609 7.304 4.643 1.00 3.81 O ATOM 640 CB PRO A 43 -7.166 9.348 3.487 1.00 2.89 C ATOM 641 CG PRO A 43 -7.998 10.479 2.949 1.00 2.92 C ATOM 642 CD PRO A 43 -9.339 9.903 2.580 1.00 3.17 C ATOM 0 HA PRO A 43 -7.264 7.312 2.617 1.00 3.22 H new ATOM 0 HB2 PRO A 43 -7.050 9.434 4.567 1.00 2.89 H new ATOM 0 HB3 PRO A 43 -6.165 9.365 3.056 1.00 2.89 H new ATOM 0 HG2 PRO A 43 -8.108 11.265 3.696 1.00 2.92 H new ATOM 0 HG3 PRO A 43 -7.520 10.930 2.080 1.00 2.92 H new ATOM 0 HD2 PRO A 43 -10.050 9.966 3.404 1.00 3.17 H new ATOM 0 HD3 PRO A 43 -9.786 10.423 1.732 1.00 3.17 H new ATOM 650 N THR A 44 -7.470 6.752 5.166 1.00 3.56 N ATOM 651 CA THR A 44 -7.814 6.038 6.409 1.00 3.90 C ATOM 652 C THR A 44 -8.209 7.021 7.524 1.00 3.85 C ATOM 653 O THR A 44 -8.010 8.228 7.386 1.00 3.54 O ATOM 654 CB THR A 44 -6.649 5.148 6.905 1.00 4.01 C ATOM 655 OG1 THR A 44 -5.667 4.978 5.872 1.00 3.86 O ATOM 656 CG2 THR A 44 -7.162 3.783 7.341 1.00 4.50 C ATOM 0 H THR A 44 -6.471 6.767 4.958 1.00 3.56 H new ATOM 0 HA THR A 44 -8.665 5.398 6.173 1.00 3.90 H new ATOM 0 HB THR A 44 -6.190 5.647 7.759 1.00 4.01 H new ATOM 0 HG1 THR A 44 -5.179 4.141 6.019 1.00 3.86 H new ATOM 0 HG21 THR A 44 -6.327 3.174 7.686 1.00 4.50 H new ATOM 0 HG22 THR A 44 -7.880 3.906 8.151 1.00 4.50 H new ATOM 0 HG23 THR A 44 -7.647 3.290 6.498 1.00 4.50 H new ATOM 664 N GLU A 45 -8.773 6.490 8.620 1.00 4.21 N ATOM 665 CA GLU A 45 -9.223 7.311 9.756 1.00 4.27 C ATOM 666 C GLU A 45 -8.077 7.730 10.690 1.00 4.16 C ATOM 667 O GLU A 45 -8.013 8.890 11.107 1.00 4.02 O ATOM 668 CB GLU A 45 -10.298 6.563 10.560 1.00 4.73 C ATOM 669 CG GLU A 45 -11.654 6.469 9.863 1.00 4.87 C ATOM 670 CD GLU A 45 -11.704 5.381 8.804 1.00 5.41 C ATOM 671 OE1 GLU A 45 -12.062 4.235 9.147 1.00 5.67 O ATOM 672 OE2 GLU A 45 -11.385 5.677 7.633 1.00 5.89 O ATOM 0 H GLU A 45 -8.929 5.490 8.744 1.00 4.21 H new ATOM 0 HA GLU A 45 -9.639 8.224 9.331 1.00 4.27 H new ATOM 0 HB2 GLU A 45 -9.941 5.555 10.771 1.00 4.73 H new ATOM 0 HB3 GLU A 45 -10.430 7.062 11.520 1.00 4.73 H new ATOM 0 HG2 GLU A 45 -12.427 6.279 10.608 1.00 4.87 H new ATOM 0 HG3 GLU A 45 -11.886 7.429 9.401 1.00 4.87 H new ATOM 679 N ALA A 46 -7.181 6.786 11.010 1.00 4.29 N ATOM 680 CA ALA A 46 -6.058 7.053 11.921 1.00 4.30 C ATOM 681 C ALA A 46 -4.781 7.477 11.197 1.00 3.96 C ATOM 682 O ALA A 46 -4.000 8.268 11.734 1.00 3.93 O ATOM 683 CB ALA A 46 -5.766 5.826 12.768 1.00 4.70 C ATOM 0 H ALA A 46 -7.212 5.831 10.652 1.00 4.29 H new ATOM 0 HA ALA A 46 -6.368 7.888 12.550 1.00 4.30 H new ATOM 0 HB1 ALA A 46 -4.933 6.036 13.438 1.00 4.70 H new ATOM 0 HB2 ALA A 46 -6.648 5.571 13.355 1.00 4.70 H new ATOM 0 HB3 ALA A 46 -5.507 4.989 12.119 1.00 4.70 H new ATOM 689 N GLU A 47 -4.571 6.952 9.982 1.00 3.76 N ATOM 690 CA GLU A 47 -3.364 7.244 9.196 1.00 3.47 C ATOM 691 C GLU A 47 -3.204 8.723 8.846 1.00 3.09 C ATOM 692 O GLU A 47 -2.084 9.170 8.585 1.00 2.91 O ATOM 693 CB GLU A 47 -3.294 6.366 7.940 1.00 3.43 C ATOM 694 CG GLU A 47 -3.164 4.875 8.234 1.00 3.78 C ATOM 695 CD GLU A 47 -2.876 4.052 6.992 1.00 3.77 C ATOM 696 OE1 GLU A 47 -1.768 4.190 6.431 1.00 3.72 O ATOM 697 OE2 GLU A 47 -3.754 3.263 6.586 1.00 4.19 O ATOM 0 H GLU A 47 -5.225 6.320 9.520 1.00 3.76 H new ATOM 0 HA GLU A 47 -2.521 6.997 9.841 1.00 3.47 H new ATOM 0 HB2 GLU A 47 -4.191 6.532 7.343 1.00 3.43 H new ATOM 0 HB3 GLU A 47 -2.445 6.682 7.335 1.00 3.43 H new ATOM 0 HG2 GLU A 47 -2.365 4.721 8.959 1.00 3.78 H new ATOM 0 HG3 GLU A 47 -4.086 4.519 8.694 1.00 3.78 H new ATOM 704 N LEU A 48 -4.311 9.482 8.834 1.00 3.03 N ATOM 705 CA LEU A 48 -4.250 10.934 8.577 1.00 2.71 C ATOM 706 C LEU A 48 -3.425 11.619 9.661 1.00 2.75 C ATOM 707 O LEU A 48 -2.869 12.688 9.454 1.00 2.53 O ATOM 708 CB LEU A 48 -5.627 11.590 8.586 1.00 2.77 C ATOM 709 CG LEU A 48 -6.735 10.878 7.828 1.00 2.90 C ATOM 710 CD1 LEU A 48 -8.066 11.039 8.548 1.00 3.19 C ATOM 711 CD2 LEU A 48 -6.812 11.448 6.435 1.00 2.63 C ATOM 0 H LEU A 48 -5.251 9.121 8.997 1.00 3.03 H new ATOM 0 HA LEU A 48 -3.803 11.050 7.590 1.00 2.71 H new ATOM 0 HB2 LEU A 48 -5.943 11.700 9.623 1.00 2.77 H new ATOM 0 HB3 LEU A 48 -5.526 12.594 8.175 1.00 2.77 H new ATOM 0 HG LEU A 48 -6.515 9.812 7.775 1.00 2.90 H new ATOM 0 HD11 LEU A 48 -8.847 10.522 7.990 1.00 3.19 H new ATOM 0 HD12 LEU A 48 -7.992 10.612 9.548 1.00 3.19 H new ATOM 0 HD13 LEU A 48 -8.314 12.098 8.622 1.00 3.19 H new ATOM 0 HD21 LEU A 48 -7.604 10.945 5.880 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -7.028 12.515 6.490 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -5.860 11.296 5.927 1.00 2.63 H new ATOM 723 N GLN A 49 -3.404 10.994 10.836 1.00 3.08 N ATOM 724 CA GLN A 49 -2.647 11.491 11.979 1.00 3.22 C ATOM 725 C GLN A 49 -1.156 11.171 11.843 1.00 3.25 C ATOM 726 O GLN A 49 -0.320 11.986 12.233 1.00 3.25 O ATOM 727 CB GLN A 49 -3.185 10.888 13.280 1.00 3.61 C ATOM 728 CG GLN A 49 -4.532 11.451 13.711 1.00 3.67 C ATOM 729 CD GLN A 49 -5.038 10.832 14.999 1.00 4.10 C ATOM 730 OE1 GLN A 49 -4.756 11.326 16.091 1.00 4.58 O ATOM 731 NE2 GLN A 49 -5.788 9.743 14.878 1.00 4.30 N ATOM 0 H GLN A 49 -3.912 10.129 11.021 1.00 3.08 H new ATOM 0 HA GLN A 49 -2.766 12.574 12.006 1.00 3.22 H new ATOM 0 HB2 GLN A 49 -3.276 9.809 13.158 1.00 3.61 H new ATOM 0 HB3 GLN A 49 -2.460 11.059 14.075 1.00 3.61 H new ATOM 0 HG2 GLN A 49 -4.446 12.530 13.840 1.00 3.67 H new ATOM 0 HG3 GLN A 49 -5.262 11.282 12.920 1.00 3.67 H new ATOM 0 HE21 GLN A 49 -5.997 9.368 13.953 1.00 4.30 H new ATOM 0 HE22 GLN A 49 -6.155 9.282 15.710 1.00 4.30 H new ATOM 740 N ASP A 50 -0.832 9.983 11.295 1.00 3.34 N ATOM 741 CA ASP A 50 0.569 9.569 11.139 1.00 3.43 C ATOM 742 C ASP A 50 1.221 10.016 9.818 1.00 3.13 C ATOM 743 O ASP A 50 2.317 10.579 9.851 1.00 3.13 O ATOM 744 CB ASP A 50 0.721 8.068 11.306 1.00 3.76 C ATOM 745 CG ASP A 50 0.411 7.595 12.716 1.00 4.11 C ATOM 746 OD1 ASP A 50 -0.765 7.276 12.990 1.00 4.38 O ATOM 747 OD2 ASP A 50 1.345 7.545 13.544 1.00 4.38 O ATOM 0 H ASP A 50 -1.514 9.304 10.958 1.00 3.34 H new ATOM 0 HA ASP A 50 1.103 10.086 11.936 1.00 3.43 H new ATOM 0 HB2 ASP A 50 0.059 7.561 10.604 1.00 3.76 H new ATOM 0 HB3 ASP A 50 1.740 7.780 11.048 1.00 3.76 H new ATOM 752 N MET A 51 0.584 9.746 8.650 1.00 2.93 N ATOM 753 CA MET A 51 1.165 10.147 7.342 1.00 2.66 C ATOM 754 C MET A 51 1.358 11.653 7.279 1.00 2.39 C ATOM 755 O MET A 51 2.352 12.155 6.747 1.00 2.30 O ATOM 756 CB MET A 51 0.302 9.638 6.165 1.00 2.59 C ATOM 757 CG MET A 51 -1.021 10.381 5.971 1.00 2.35 C ATOM 758 SD MET A 51 -1.981 9.791 4.567 1.00 2.18 S ATOM 759 CE MET A 51 -2.755 8.351 5.281 1.00 2.48 C ATOM 0 H MET A 51 -0.312 9.263 8.586 1.00 2.93 H new ATOM 0 HA MET A 51 2.145 9.680 7.250 1.00 2.66 H new ATOM 0 HB2 MET A 51 0.884 9.715 5.246 1.00 2.59 H new ATOM 0 HB3 MET A 51 0.089 8.580 6.320 1.00 2.59 H new ATOM 0 HG2 MET A 51 -1.619 10.282 6.877 1.00 2.35 H new ATOM 0 HG3 MET A 51 -0.815 11.443 5.839 1.00 2.35 H new ATOM 0 HE1 MET A 51 -3.454 7.921 4.564 1.00 2.48 H new ATOM 0 HE2 MET A 51 -1.992 7.614 5.531 1.00 2.48 H new ATOM 0 HE3 MET A 51 -3.292 8.637 6.185 1.00 2.48 H new ATOM 769 N ILE A 52 0.383 12.344 7.843 1.00 2.33 N ATOM 770 CA ILE A 52 0.378 13.786 7.946 1.00 2.15 C ATOM 771 C ILE A 52 1.413 14.227 8.969 1.00 2.40 C ATOM 772 O ILE A 52 1.876 15.350 8.952 1.00 2.36 O ATOM 773 CB ILE A 52 -1.055 14.262 8.296 1.00 2.10 C ATOM 774 CG1 ILE A 52 -1.820 14.533 7.008 1.00 1.78 C ATOM 775 CG2 ILE A 52 -1.103 15.471 9.229 1.00 2.22 C ATOM 776 CD1 ILE A 52 -2.724 13.395 6.580 1.00 1.85 C ATOM 0 H ILE A 52 -0.443 11.905 8.250 1.00 2.33 H new ATOM 0 HA ILE A 52 0.654 14.245 6.997 1.00 2.15 H new ATOM 0 HB ILE A 52 -1.530 13.457 8.857 1.00 2.10 H new ATOM 0 HG12 ILE A 52 -2.421 15.433 7.137 1.00 1.78 H new ATOM 0 HG13 ILE A 52 -1.107 14.738 6.209 1.00 1.78 H new ATOM 0 HG21 ILE A 52 -2.141 15.739 9.424 1.00 2.22 H new ATOM 0 HG22 ILE A 52 -0.610 15.225 10.169 1.00 2.22 H new ATOM 0 HG23 ILE A 52 -0.592 16.312 8.761 1.00 2.22 H new ATOM 0 HD11 ILE A 52 -3.234 13.664 5.655 1.00 1.85 H new ATOM 0 HD12 ILE A 52 -2.127 12.498 6.418 1.00 1.85 H new ATOM 0 HD13 ILE A 52 -3.462 13.204 7.359 1.00 1.85 H new ATOM 788 N ASN A 53 1.776 13.302 9.842 1.00 2.72 N ATOM 789 CA ASN A 53 2.770 13.549 10.866 1.00 3.03 C ATOM 790 C ASN A 53 4.158 13.433 10.294 1.00 3.09 C ATOM 791 O ASN A 53 5.162 13.763 10.923 1.00 3.36 O ATOM 792 CB ASN A 53 2.570 12.563 12.018 1.00 3.37 C ATOM 793 CG ASN A 53 3.371 12.898 13.267 1.00 3.66 C ATOM 794 OD1 ASN A 53 4.508 12.454 13.427 1.00 3.89 O ATOM 795 ND2 ASN A 53 2.778 13.685 14.157 1.00 3.98 N ATOM 0 H ASN A 53 1.388 12.359 9.858 1.00 2.72 H new ATOM 0 HA ASN A 53 2.651 14.564 11.246 1.00 3.03 H new ATOM 0 HB2 ASN A 53 1.511 12.531 12.276 1.00 3.37 H new ATOM 0 HB3 ASN A 53 2.846 11.564 11.679 1.00 3.37 H new ATOM 0 HD21 ASN A 53 3.266 13.944 15.014 1.00 3.98 H new ATOM 0 HD22 ASN A 53 1.834 14.030 13.984 1.00 3.98 H new ATOM 802 N GLU A 54 4.160 12.892 9.127 1.00 2.90 N ATOM 803 CA GLU A 54 5.367 12.723 8.336 1.00 2.96 C ATOM 804 C GLU A 54 5.616 13.956 7.469 1.00 2.77 C ATOM 805 O GLU A 54 6.741 14.192 7.018 1.00 2.93 O ATOM 806 CB GLU A 54 5.252 11.477 7.451 1.00 2.91 C ATOM 807 CG GLU A 54 5.293 10.164 8.223 1.00 3.22 C ATOM 808 CD GLU A 54 5.125 8.954 7.325 1.00 3.25 C ATOM 809 OE1 GLU A 54 6.149 8.432 6.836 1.00 3.56 O ATOM 810 OE2 GLU A 54 3.971 8.529 7.111 1.00 3.40 O ATOM 0 H GLU A 54 3.317 12.542 8.671 1.00 2.90 H new ATOM 0 HA GLU A 54 6.209 12.598 9.017 1.00 2.96 H new ATOM 0 HB2 GLU A 54 4.319 11.528 6.889 1.00 2.91 H new ATOM 0 HB3 GLU A 54 6.063 11.484 6.723 1.00 2.91 H new ATOM 0 HG2 GLU A 54 6.242 10.089 8.754 1.00 3.22 H new ATOM 0 HG3 GLU A 54 4.505 10.165 8.976 1.00 3.22 H new ATOM 817 N VAL A 55 4.551 14.731 7.247 1.00 2.49 N ATOM 818 CA VAL A 55 4.627 15.932 6.419 1.00 2.36 C ATOM 819 C VAL A 55 4.091 17.189 7.103 1.00 2.40 C ATOM 820 O VAL A 55 4.470 18.303 6.721 1.00 2.49 O ATOM 821 CB VAL A 55 3.932 15.679 5.045 1.00 1.99 C ATOM 822 CG1 VAL A 55 3.477 16.960 4.342 1.00 2.37 C ATOM 823 CG2 VAL A 55 4.861 14.889 4.139 1.00 2.07 C ATOM 0 H VAL A 55 3.625 14.545 7.631 1.00 2.49 H new ATOM 0 HA VAL A 55 5.685 16.134 6.252 1.00 2.36 H new ATOM 0 HB VAL A 55 3.027 15.108 5.254 1.00 1.99 H new ATOM 0 HG11 VAL A 55 3.003 16.706 3.394 1.00 2.37 H new ATOM 0 HG12 VAL A 55 2.763 17.488 4.974 1.00 2.37 H new ATOM 0 HG13 VAL A 55 4.340 17.599 4.156 1.00 2.37 H new ATOM 0 HG21 VAL A 55 4.372 14.714 3.180 1.00 2.07 H new ATOM 0 HG22 VAL A 55 5.780 15.453 3.980 1.00 2.07 H new ATOM 0 HG23 VAL A 55 5.098 13.933 4.605 1.00 2.07 H new ATOM 833 N ALA A 56 3.257 17.031 8.120 1.00 2.43 N ATOM 834 CA ALA A 56 2.692 18.191 8.791 1.00 2.53 C ATOM 835 C ALA A 56 3.395 18.373 10.124 1.00 2.90 C ATOM 836 O ALA A 56 2.951 19.122 11.003 1.00 3.05 O ATOM 837 CB ALA A 56 1.190 18.025 8.938 1.00 2.36 C ATOM 0 H ALA A 56 2.961 16.129 8.493 1.00 2.43 H new ATOM 0 HA ALA A 56 2.850 19.094 8.202 1.00 2.53 H new ATOM 0 HB1 ALA A 56 0.775 18.898 9.442 1.00 2.36 H new ATOM 0 HB2 ALA A 56 0.737 17.925 7.952 1.00 2.36 H new ATOM 0 HB3 ALA A 56 0.978 17.132 9.526 1.00 2.36 H new ATOM 843 N ALA A 57 4.527 17.671 10.232 1.00 3.08 N ATOM 844 CA ALA A 57 5.358 17.698 11.415 1.00 3.45 C ATOM 845 C ALA A 57 6.492 18.688 11.281 1.00 3.67 C ATOM 846 O ALA A 57 7.218 18.719 10.283 1.00 3.69 O ATOM 847 CB ALA A 57 5.889 16.318 11.742 1.00 3.64 C ATOM 0 H ALA A 57 4.885 17.068 9.491 1.00 3.08 H new ATOM 0 HA ALA A 57 4.728 18.027 12.242 1.00 3.45 H new ATOM 0 HB1 ALA A 57 6.510 16.370 12.636 1.00 3.64 H new ATOM 0 HB2 ALA A 57 5.054 15.639 11.919 1.00 3.64 H new ATOM 0 HB3 ALA A 57 6.485 15.950 10.907 1.00 3.64 H new ATOM 886 N GLY A 61 0.792 22.163 13.916 1.00 3.52 N ATOM 887 CA GLY A 61 -0.530 21.695 14.316 1.00 3.44 C ATOM 888 C GLY A 61 -1.453 21.376 13.145 1.00 3.11 C ATOM 889 O GLY A 61 -2.588 20.943 13.361 1.00 3.10 O ATOM 0 HA2 GLY A 61 -0.418 20.802 14.931 1.00 3.44 H new ATOM 0 HA3 GLY A 61 -1.000 22.455 14.940 1.00 3.44 H new ATOM 893 N THR A 62 -0.969 21.583 11.909 1.00 2.91 N ATOM 894 CA THR A 62 -1.749 21.291 10.699 1.00 2.61 C ATOM 895 C THR A 62 -0.849 20.850 9.537 1.00 2.41 C ATOM 896 O THR A 62 0.370 20.740 9.690 1.00 2.55 O ATOM 897 CB THR A 62 -2.642 22.478 10.262 1.00 2.62 C ATOM 898 OG1 THR A 62 -1.921 23.712 10.361 1.00 2.84 O ATOM 899 CG2 THR A 62 -3.900 22.536 11.115 1.00 2.75 C ATOM 0 H THR A 62 -0.037 21.953 11.723 1.00 2.91 H new ATOM 0 HA THR A 62 -2.409 20.464 10.962 1.00 2.61 H new ATOM 0 HB THR A 62 -2.930 22.326 9.222 1.00 2.62 H new ATOM 0 HG1 THR A 62 -1.948 24.177 9.499 1.00 2.84 H new ATOM 0 HG21 THR A 62 -4.518 23.376 10.796 1.00 2.75 H new ATOM 0 HG22 THR A 62 -4.461 21.608 11.000 1.00 2.75 H new ATOM 0 HG23 THR A 62 -3.624 22.666 12.162 1.00 2.75 H new ATOM 907 N ILE A 63 -1.475 20.642 8.375 1.00 2.14 N ATOM 908 CA ILE A 63 -0.825 20.153 7.168 1.00 1.93 C ATOM 909 C ILE A 63 -0.625 21.224 6.138 1.00 1.95 C ATOM 910 O ILE A 63 -1.536 21.973 5.850 1.00 1.99 O ATOM 911 CB ILE A 63 -1.686 19.161 6.373 1.00 1.63 C ATOM 912 CG1 ILE A 63 -3.085 18.935 6.981 1.00 1.70 C ATOM 913 CG2 ILE A 63 -0.994 17.832 6.046 1.00 1.51 C ATOM 914 CD1 ILE A 63 -3.109 18.110 8.250 1.00 1.95 C ATOM 0 H ILE A 63 -2.472 20.815 8.251 1.00 2.14 H new ATOM 0 HA ILE A 63 0.097 19.727 7.564 1.00 1.93 H new ATOM 0 HB ILE A 63 -1.829 19.663 5.416 1.00 1.63 H new ATOM 0 HG12 ILE A 63 -3.535 19.906 7.189 1.00 1.70 H new ATOM 0 HG13 ILE A 63 -3.713 18.446 6.236 1.00 1.70 H new ATOM 0 HG21 ILE A 63 -1.677 17.195 5.484 1.00 1.51 H new ATOM 0 HG22 ILE A 63 -0.102 18.023 5.450 1.00 1.51 H new ATOM 0 HG23 ILE A 63 -0.711 17.332 6.972 1.00 1.51 H new ATOM 0 HD11 ILE A 63 -4.137 18.008 8.598 1.00 1.95 H new ATOM 0 HD12 ILE A 63 -2.694 17.122 8.050 1.00 1.95 H new ATOM 0 HD13 ILE A 63 -2.513 18.605 9.017 1.00 1.95 H new ATOM 926 N ASP A 64 0.521 21.199 5.510 1.00 2.01 N ATOM 927 CA ASP A 64 0.831 22.107 4.431 1.00 2.12 C ATOM 928 C ASP A 64 0.597 21.377 3.100 1.00 1.86 C ATOM 929 O ASP A 64 0.609 20.143 3.066 1.00 1.62 O ATOM 930 CB ASP A 64 2.255 22.675 4.517 1.00 2.46 C ATOM 931 CG ASP A 64 3.334 21.623 4.752 1.00 2.46 C ATOM 932 OD1 ASP A 64 3.640 21.339 5.929 1.00 2.68 O ATOM 933 OD2 ASP A 64 3.868 21.089 3.757 1.00 2.74 O ATOM 0 H ASP A 64 1.272 20.545 5.732 1.00 2.01 H new ATOM 0 HA ASP A 64 0.171 22.971 4.505 1.00 2.12 H new ATOM 0 HB2 ASP A 64 2.478 23.208 3.593 1.00 2.46 H new ATOM 0 HB3 ASP A 64 2.294 23.406 5.324 1.00 2.46 H new ATOM 938 N PHE A 65 0.398 22.127 2.015 1.00 1.97 N ATOM 939 CA PHE A 65 0.092 21.529 0.706 1.00 1.80 C ATOM 940 C PHE A 65 1.312 20.879 -0.021 1.00 1.83 C ATOM 941 O PHE A 65 1.183 19.746 -0.488 1.00 1.60 O ATOM 942 CB PHE A 65 -0.555 22.581 -0.214 1.00 2.04 C ATOM 943 CG PHE A 65 -1.245 22.007 -1.434 1.00 1.95 C ATOM 944 CD1 PHE A 65 -2.375 21.225 -1.291 1.00 2.40 C ATOM 945 CD2 PHE A 65 -0.771 22.257 -2.710 1.00 2.11 C ATOM 946 CE1 PHE A 65 -3.031 20.697 -2.377 1.00 2.45 C ATOM 947 CE2 PHE A 65 -1.417 21.731 -3.813 1.00 2.08 C ATOM 948 CZ PHE A 65 -2.548 20.950 -3.645 1.00 1.96 C ATOM 0 H PHE A 65 0.442 23.146 2.012 1.00 1.97 H new ATOM 0 HA PHE A 65 -0.598 20.712 0.916 1.00 1.80 H new ATOM 0 HB2 PHE A 65 -1.281 23.153 0.363 1.00 2.04 H new ATOM 0 HB3 PHE A 65 0.214 23.281 -0.542 1.00 2.04 H new ATOM 0 HD1 PHE A 65 -2.753 21.023 -0.300 1.00 2.40 H new ATOM 0 HD2 PHE A 65 0.110 22.867 -2.845 1.00 2.11 H new ATOM 0 HE1 PHE A 65 -3.914 20.091 -2.240 1.00 2.45 H new ATOM 0 HE2 PHE A 65 -1.040 21.929 -4.805 1.00 2.08 H new ATOM 0 HZ PHE A 65 -3.053 20.539 -4.507 1.00 1.96 H new ATOM 958 N PRO A 66 2.502 21.572 -0.134 1.00 2.16 N ATOM 959 CA PRO A 66 3.703 21.076 -0.868 1.00 2.30 C ATOM 960 C PRO A 66 4.013 19.561 -0.790 1.00 2.09 C ATOM 961 O PRO A 66 4.091 18.904 -1.831 1.00 2.04 O ATOM 962 CB PRO A 66 4.863 21.891 -0.250 1.00 2.67 C ATOM 963 CG PRO A 66 4.251 22.776 0.791 1.00 2.78 C ATOM 964 CD PRO A 66 2.802 22.902 0.431 1.00 2.48 C ATOM 0 HA PRO A 66 3.538 21.211 -1.937 1.00 2.30 H new ATOM 0 HB2 PRO A 66 5.609 21.231 0.192 1.00 2.67 H new ATOM 0 HB3 PRO A 66 5.371 22.482 -1.012 1.00 2.67 H new ATOM 0 HG2 PRO A 66 4.369 22.347 1.786 1.00 2.78 H new ATOM 0 HG3 PRO A 66 4.735 23.752 0.806 1.00 2.78 H new ATOM 0 HD2 PRO A 66 2.184 23.123 1.302 1.00 2.48 H new ATOM 0 HD3 PRO A 66 2.630 23.699 -0.292 1.00 2.48 H new ATOM 972 N GLU A 67 4.212 19.015 0.418 1.00 2.04 N ATOM 973 CA GLU A 67 4.544 17.593 0.579 1.00 1.95 C ATOM 974 C GLU A 67 3.344 16.681 0.745 1.00 1.60 C ATOM 975 O GLU A 67 3.458 15.454 0.666 1.00 1.59 O ATOM 976 CB GLU A 67 5.582 17.378 1.682 1.00 2.24 C ATOM 977 CG GLU A 67 6.988 17.809 1.293 1.00 2.61 C ATOM 978 CD GLU A 67 7.996 17.579 2.403 1.00 3.15 C ATOM 979 OE1 GLU A 67 8.192 18.498 3.226 1.00 3.47 O ATOM 980 OE2 GLU A 67 8.589 16.481 2.449 1.00 3.66 O ATOM 0 H GLU A 67 4.149 19.534 1.294 1.00 2.04 H new ATOM 0 HA GLU A 67 4.990 17.296 -0.370 1.00 1.95 H new ATOM 0 HB2 GLU A 67 5.275 17.931 2.570 1.00 2.24 H new ATOM 0 HB3 GLU A 67 5.597 16.322 1.953 1.00 2.24 H new ATOM 0 HG2 GLU A 67 7.300 17.260 0.404 1.00 2.61 H new ATOM 0 HG3 GLU A 67 6.980 18.866 1.028 1.00 2.61 H new ATOM 987 N PHE A 68 2.215 17.288 0.985 1.00 1.40 N ATOM 988 CA PHE A 68 0.944 16.566 1.170 1.00 1.10 C ATOM 989 C PHE A 68 0.557 15.825 -0.138 1.00 0.99 C ATOM 990 O PHE A 68 -0.132 14.802 -0.089 1.00 0.94 O ATOM 991 CB PHE A 68 -0.127 17.557 1.690 1.00 1.04 C ATOM 992 CG PHE A 68 -1.576 17.135 1.632 1.00 0.89 C ATOM 993 CD1 PHE A 68 -2.122 16.257 2.567 1.00 1.36 C ATOM 994 CD2 PHE A 68 -2.417 17.701 0.685 1.00 1.60 C ATOM 995 CE1 PHE A 68 -3.463 15.966 2.546 1.00 1.57 C ATOM 996 CE2 PHE A 68 -3.762 17.393 0.652 1.00 1.57 C ATOM 997 CZ PHE A 68 -4.291 16.530 1.586 1.00 1.15 C ATOM 0 H PHE A 68 2.129 18.301 1.062 1.00 1.40 H new ATOM 0 HA PHE A 68 1.037 15.786 1.926 1.00 1.10 H new ATOM 0 HB2 PHE A 68 0.111 17.790 2.728 1.00 1.04 H new ATOM 0 HB3 PHE A 68 -0.027 18.483 1.124 1.00 1.04 H new ATOM 0 HD1 PHE A 68 -1.486 15.803 3.312 1.00 1.36 H new ATOM 0 HD2 PHE A 68 -2.013 18.394 -0.038 1.00 1.60 H new ATOM 0 HE1 PHE A 68 -3.877 15.293 3.282 1.00 1.57 H new ATOM 0 HE2 PHE A 68 -4.398 17.828 -0.105 1.00 1.57 H new ATOM 0 HZ PHE A 68 -5.345 16.294 1.571 1.00 1.15 H new ATOM 1007 N LEU A 69 1.000 16.363 -1.302 1.00 1.15 N ATOM 1008 CA LEU A 69 0.770 15.711 -2.613 1.00 1.24 C ATOM 1009 C LEU A 69 1.825 14.642 -2.891 1.00 1.42 C ATOM 1010 O LEU A 69 1.530 13.617 -3.507 1.00 1.53 O ATOM 1011 CB LEU A 69 0.771 16.679 -3.802 1.00 1.51 C ATOM 1012 CG LEU A 69 0.352 18.114 -3.533 1.00 1.59 C ATOM 1013 CD1 LEU A 69 1.582 18.976 -3.425 1.00 1.82 C ATOM 1014 CD2 LEU A 69 -0.535 18.615 -4.648 1.00 1.76 C ATOM 0 H LEU A 69 1.515 17.241 -1.358 1.00 1.15 H new ATOM 0 HA LEU A 69 -0.225 15.274 -2.527 1.00 1.24 H new ATOM 0 HB2 LEU A 69 1.776 16.695 -4.223 1.00 1.51 H new ATOM 0 HB3 LEU A 69 0.111 16.273 -4.568 1.00 1.51 H new ATOM 0 HG LEU A 69 -0.208 18.159 -2.599 1.00 1.59 H new ATOM 0 HD11 LEU A 69 1.288 20.008 -3.232 1.00 1.82 H new ATOM 0 HD12 LEU A 69 2.207 18.618 -2.607 1.00 1.82 H new ATOM 0 HD13 LEU A 69 2.143 18.928 -4.358 1.00 1.82 H new ATOM 0 HD21 LEU A 69 -0.829 19.645 -4.444 1.00 1.76 H new ATOM 0 HD22 LEU A 69 0.008 18.573 -5.592 1.00 1.76 H new ATOM 0 HD23 LEU A 69 -1.425 17.990 -4.714 1.00 1.76 H new ATOM 1026 N THR A 70 3.068 14.905 -2.453 1.00 1.58 N ATOM 1027 CA THR A 70 4.188 13.964 -2.667 1.00 1.88 C ATOM 1028 C THR A 70 3.918 12.631 -1.970 1.00 1.87 C ATOM 1029 O THR A 70 4.324 11.571 -2.452 1.00 2.04 O ATOM 1030 CB THR A 70 5.544 14.530 -2.187 1.00 2.19 C ATOM 1031 OG1 THR A 70 5.437 15.021 -0.849 1.00 2.14 O ATOM 1032 CG2 THR A 70 6.030 15.645 -3.104 1.00 2.80 C ATOM 0 H THR A 70 3.325 15.755 -1.951 1.00 1.58 H new ATOM 0 HA THR A 70 4.255 13.810 -3.744 1.00 1.88 H new ATOM 0 HB THR A 70 6.270 13.717 -2.214 1.00 2.19 H new ATOM 0 HG1 THR A 70 4.555 14.794 -0.487 1.00 2.14 H new ATOM 0 HG21 THR A 70 6.986 16.024 -2.741 1.00 2.80 H new ATOM 0 HG22 THR A 70 6.153 15.257 -4.115 1.00 2.80 H new ATOM 0 HG23 THR A 70 5.299 16.454 -3.113 1.00 2.80 H new ATOM 1040 N MET A 71 3.220 12.717 -0.833 1.00 1.77 N ATOM 1041 CA MET A 71 2.823 11.545 -0.045 1.00 1.91 C ATOM 1042 C MET A 71 1.555 10.902 -0.628 1.00 1.83 C ATOM 1043 O MET A 71 1.297 9.716 -0.411 1.00 2.06 O ATOM 1044 CB MET A 71 2.613 11.925 1.435 1.00 2.01 C ATOM 1045 CG MET A 71 1.715 13.142 1.666 1.00 2.31 C ATOM 1046 SD MET A 71 1.879 13.822 3.324 1.00 2.07 S ATOM 1047 CE MET A 71 0.752 12.777 4.233 1.00 1.57 C ATOM 0 H MET A 71 2.914 13.603 -0.432 1.00 1.77 H new ATOM 0 HA MET A 71 3.629 10.813 -0.095 1.00 1.91 H new ATOM 0 HB2 MET A 71 2.183 11.070 1.957 1.00 2.01 H new ATOM 0 HB3 MET A 71 3.586 12.118 1.887 1.00 2.01 H new ATOM 0 HG2 MET A 71 1.960 13.913 0.936 1.00 2.31 H new ATOM 0 HG3 MET A 71 0.676 12.860 1.495 1.00 2.31 H new ATOM 0 HE1 MET A 71 0.440 13.285 5.146 1.00 1.57 H new ATOM 0 HE2 MET A 71 -0.123 12.565 3.619 1.00 1.57 H new ATOM 0 HE3 MET A 71 1.250 11.842 4.490 1.00 1.57 H new ATOM 1057 N MET A 72 0.783 11.710 -1.383 1.00 1.61 N ATOM 1058 CA MET A 72 -0.469 11.273 -2.027 1.00 1.69 C ATOM 1059 C MET A 72 -0.265 10.040 -2.923 1.00 1.97 C ATOM 1060 O MET A 72 -1.182 9.229 -3.085 1.00 2.17 O ATOM 1061 CB MET A 72 -1.065 12.429 -2.841 1.00 1.60 C ATOM 1062 CG MET A 72 -1.996 13.326 -2.039 1.00 1.46 C ATOM 1063 SD MET A 72 -3.576 12.544 -1.671 1.00 1.69 S ATOM 1064 CE MET A 72 -4.540 13.967 -1.166 1.00 1.53 C ATOM 0 H MET A 72 1.013 12.687 -1.563 1.00 1.61 H new ATOM 0 HA MET A 72 -1.162 10.983 -1.237 1.00 1.69 H new ATOM 0 HB2 MET A 72 -0.253 13.033 -3.246 1.00 1.60 H new ATOM 0 HB3 MET A 72 -1.612 12.019 -3.690 1.00 1.60 H new ATOM 0 HG2 MET A 72 -1.508 13.605 -1.105 1.00 1.46 H new ATOM 0 HG3 MET A 72 -2.173 14.247 -2.594 1.00 1.46 H new ATOM 0 HE1 MET A 72 -5.528 13.919 -1.625 1.00 1.53 H new ATOM 0 HE2 MET A 72 -4.644 13.970 -0.081 1.00 1.53 H new ATOM 0 HE3 MET A 72 -4.036 14.879 -1.485 1.00 1.53 H new ATOM 1207 N SER A 81 -1.344 -3.884 -4.448 1.00 3.49 N ATOM 1208 CA SER A 81 -1.471 -5.316 -4.186 1.00 3.36 C ATOM 1209 C SER A 81 -0.119 -6.029 -4.080 1.00 2.88 C ATOM 1210 O SER A 81 -0.033 -7.120 -3.508 1.00 2.79 O ATOM 1211 CB SER A 81 -2.318 -5.970 -5.277 1.00 3.71 C ATOM 1212 OG SER A 81 -3.593 -5.360 -5.361 1.00 4.35 O ATOM 0 HA SER A 81 -1.959 -5.418 -3.217 1.00 3.36 H new ATOM 0 HB2 SER A 81 -1.808 -5.889 -6.237 1.00 3.71 H new ATOM 0 HB3 SER A 81 -2.432 -7.033 -5.066 1.00 3.71 H new ATOM 0 HG SER A 81 -3.854 -5.277 -6.302 1.00 4.35 H new ATOM 1218 N GLU A 82 0.922 -5.405 -4.632 1.00 2.97 N ATOM 1219 CA GLU A 82 2.283 -5.969 -4.620 1.00 3.25 C ATOM 1220 C GLU A 82 3.022 -5.652 -3.328 1.00 3.85 C ATOM 1221 O GLU A 82 3.878 -6.420 -2.885 1.00 4.27 O ATOM 1222 CB GLU A 82 3.090 -5.449 -5.810 1.00 3.94 C ATOM 1223 CG GLU A 82 2.645 -6.009 -7.154 1.00 4.12 C ATOM 1224 CD GLU A 82 3.474 -5.481 -8.308 1.00 4.93 C ATOM 1225 OE1 GLU A 82 4.501 -6.110 -8.638 1.00 5.51 O ATOM 1226 OE2 GLU A 82 3.097 -4.438 -8.881 1.00 5.25 O ATOM 0 H GLU A 82 0.853 -4.500 -5.098 1.00 2.97 H new ATOM 0 HA GLU A 82 2.179 -7.052 -4.693 1.00 3.25 H new ATOM 0 HB2 GLU A 82 3.016 -4.362 -5.839 1.00 3.94 H new ATOM 0 HB3 GLU A 82 4.141 -5.693 -5.657 1.00 3.94 H new ATOM 0 HG2 GLU A 82 2.712 -7.097 -7.131 1.00 4.12 H new ATOM 0 HG3 GLU A 82 1.597 -5.758 -7.319 1.00 4.12 H new ATOM 1233 N GLU A 83 2.687 -4.510 -2.746 1.00 4.18 N ATOM 1234 CA GLU A 83 3.288 -4.061 -1.483 1.00 5.12 C ATOM 1235 C GLU A 83 2.716 -4.839 -0.292 1.00 5.33 C ATOM 1236 O GLU A 83 3.358 -4.939 0.755 1.00 6.21 O ATOM 1237 CB GLU A 83 3.057 -2.557 -1.279 1.00 5.53 C ATOM 1238 CG GLU A 83 3.871 -1.664 -2.212 1.00 5.74 C ATOM 1239 CD GLU A 83 5.311 -1.490 -1.761 1.00 6.48 C ATOM 1240 OE1 GLU A 83 6.166 -2.300 -2.176 1.00 6.88 O ATOM 1241 OE2 GLU A 83 5.582 -0.543 -0.992 1.00 6.89 O ATOM 0 H GLU A 83 1.995 -3.866 -3.128 1.00 4.18 H new ATOM 0 HA GLU A 83 4.360 -4.252 -1.540 1.00 5.12 H new ATOM 0 HB2 GLU A 83 1.998 -2.341 -1.421 1.00 5.53 H new ATOM 0 HB3 GLU A 83 3.299 -2.301 -0.247 1.00 5.53 H new ATOM 0 HG2 GLU A 83 3.859 -2.090 -3.215 1.00 5.74 H new ATOM 0 HG3 GLU A 83 3.395 -0.685 -2.276 1.00 5.74 H new ATOM 1248 N GLU A 84 1.502 -5.383 -0.475 1.00 4.72 N ATOM 1249 CA GLU A 84 0.810 -6.158 0.562 1.00 5.16 C ATOM 1250 C GLU A 84 1.234 -7.636 0.588 1.00 4.87 C ATOM 1251 O GLU A 84 1.160 -8.275 1.639 1.00 5.53 O ATOM 1252 CB GLU A 84 -0.706 -6.060 0.376 1.00 5.11 C ATOM 1253 CG GLU A 84 -1.290 -4.711 0.772 1.00 5.77 C ATOM 1254 CD GLU A 84 -2.792 -4.645 0.577 1.00 6.38 C ATOM 1255 OE1 GLU A 84 -3.529 -4.981 1.528 1.00 6.86 O ATOM 1256 OE2 GLU A 84 -3.231 -4.257 -0.526 1.00 6.68 O ATOM 0 H GLU A 84 0.976 -5.297 -1.344 1.00 4.72 H new ATOM 0 HA GLU A 84 1.097 -5.722 1.519 1.00 5.16 H new ATOM 0 HB2 GLU A 84 -0.948 -6.257 -0.668 1.00 5.11 H new ATOM 0 HB3 GLU A 84 -1.186 -6.840 0.967 1.00 5.11 H new ATOM 0 HG2 GLU A 84 -1.054 -4.510 1.817 1.00 5.77 H new ATOM 0 HG3 GLU A 84 -0.816 -3.927 0.182 1.00 5.77 H new ATOM 1263 N ILE A 85 1.673 -8.178 -0.570 1.00 3.98 N ATOM 1264 CA ILE A 85 2.101 -9.586 -0.678 1.00 3.69 C ATOM 1265 C ILE A 85 3.293 -9.873 0.227 1.00 4.63 C ATOM 1266 O ILE A 85 3.158 -10.594 1.212 1.00 5.03 O ATOM 1267 CB ILE A 85 2.378 -9.893 -2.185 1.00 2.77 C ATOM 1268 CG1 ILE A 85 2.162 -11.375 -2.520 1.00 3.16 C ATOM 1269 CG2 ILE A 85 3.766 -9.410 -2.597 1.00 1.99 C ATOM 1270 CD1 ILE A 85 3.416 -12.032 -3.001 1.00 3.97 C ATOM 0 H ILE A 85 1.739 -7.657 -1.445 1.00 3.98 H new ATOM 0 HA ILE A 85 1.315 -10.255 -0.329 1.00 3.69 H new ATOM 0 HB ILE A 85 1.649 -9.335 -2.772 1.00 2.77 H new ATOM 0 HG12 ILE A 85 1.796 -11.897 -1.635 1.00 3.16 H new ATOM 0 HG13 ILE A 85 1.390 -11.465 -3.284 1.00 3.16 H new ATOM 0 HG21 ILE A 85 3.932 -9.636 -3.650 1.00 1.99 H new ATOM 0 HG22 ILE A 85 3.838 -8.334 -2.442 1.00 1.99 H new ATOM 0 HG23 ILE A 85 4.521 -9.915 -1.994 1.00 1.99 H new ATOM 0 HD11 ILE A 85 3.215 -13.079 -3.226 1.00 3.97 H new ATOM 0 HD12 ILE A 85 3.768 -11.529 -3.901 1.00 3.97 H new ATOM 0 HD13 ILE A 85 4.181 -11.967 -2.227 1.00 3.97 H new ATOM 1282 N ARG A 86 4.411 -9.240 -0.075 1.00 5.19 N ATOM 1283 CA ARG A 86 5.629 -9.324 0.743 1.00 6.32 C ATOM 1284 C ARG A 86 5.348 -8.870 2.162 1.00 7.11 C ATOM 1285 O ARG A 86 6.097 -9.188 3.092 1.00 7.98 O ATOM 1286 CB ARG A 86 6.694 -8.383 0.217 1.00 6.99 C ATOM 1287 CG ARG A 86 8.052 -9.036 0.008 1.00 7.36 C ATOM 1288 CD ARG A 86 9.095 -8.032 -0.466 1.00 8.25 C ATOM 1289 NE ARG A 86 8.899 -7.641 -1.868 1.00 8.76 N ATOM 1290 CZ ARG A 86 9.544 -6.637 -2.479 1.00 9.65 C ATOM 1291 NH1 ARG A 86 10.442 -5.898 -1.829 1.00 10.08 N ATOM 1292 NH2 ARG A 86 9.287 -6.372 -3.753 1.00 10.26 N ATOM 0 H ARG A 86 4.511 -8.646 -0.898 1.00 5.19 H new ATOM 0 HA ARG A 86 5.960 -10.362 0.709 1.00 6.32 H new ATOM 0 HB2 ARG A 86 6.356 -7.962 -0.730 1.00 6.99 H new ATOM 0 HB3 ARG A 86 6.806 -7.552 0.914 1.00 6.99 H new ATOM 0 HG2 ARG A 86 8.384 -9.492 0.941 1.00 7.36 H new ATOM 0 HG3 ARG A 86 7.961 -9.838 -0.724 1.00 7.36 H new ATOM 0 HD2 ARG A 86 9.054 -7.144 0.165 1.00 8.25 H new ATOM 0 HD3 ARG A 86 10.090 -8.462 -0.347 1.00 8.25 H new ATOM 0 HE ARG A 86 8.223 -8.172 -2.417 1.00 8.76 H new ATOM 0 HH11 ARG A 86 10.649 -6.092 -0.849 1.00 10.08 H new ATOM 0 HH12 ARG A 86 10.922 -5.138 -2.311 1.00 10.08 H new ATOM 0 HH21 ARG A 86 8.602 -6.931 -4.262 1.00 10.26 H new ATOM 0 HH22 ARG A 86 9.774 -5.609 -4.224 1.00 10.26 H new ATOM 1306 N GLU A 87 4.247 -8.125 2.308 1.00 6.95 N ATOM 1307 CA GLU A 87 3.885 -7.568 3.600 1.00 7.91 C ATOM 1308 C GLU A 87 3.100 -8.591 4.418 1.00 7.97 C ATOM 1309 O GLU A 87 3.055 -8.539 5.650 1.00 8.94 O ATOM 1310 CB GLU A 87 3.073 -6.280 3.435 1.00 8.02 C ATOM 1311 CG GLU A 87 3.331 -5.246 4.522 1.00 8.75 C ATOM 1312 CD GLU A 87 2.511 -3.985 4.333 1.00 9.11 C ATOM 1313 OE1 GLU A 87 1.379 -3.929 4.857 1.00 9.62 O ATOM 1314 OE2 GLU A 87 3.002 -3.053 3.662 1.00 9.05 O ATOM 0 H GLU A 87 3.602 -7.900 1.551 1.00 6.95 H new ATOM 0 HA GLU A 87 4.804 -7.323 4.133 1.00 7.91 H new ATOM 0 HB2 GLU A 87 3.303 -5.839 2.465 1.00 8.02 H new ATOM 0 HB3 GLU A 87 2.012 -6.529 3.428 1.00 8.02 H new ATOM 0 HG2 GLU A 87 3.102 -5.682 5.495 1.00 8.75 H new ATOM 0 HG3 GLU A 87 4.390 -4.989 4.530 1.00 8.75 H new ATOM 1321 N ALA A 88 2.490 -9.515 3.678 1.00 7.00 N ATOM 1322 CA ALA A 88 1.676 -10.595 4.223 1.00 7.06 C ATOM 1323 C ALA A 88 2.542 -11.745 4.734 1.00 7.01 C ATOM 1324 O ALA A 88 2.221 -12.401 5.718 1.00 7.73 O ATOM 1325 CB ALA A 88 0.760 -11.096 3.138 1.00 6.21 C ATOM 0 H ALA A 88 2.551 -9.532 2.660 1.00 7.00 H new ATOM 0 HA ALA A 88 1.102 -10.212 5.067 1.00 7.06 H new ATOM 0 HB1 ALA A 88 0.143 -11.905 3.528 1.00 6.21 H new ATOM 0 HB2 ALA A 88 0.119 -10.282 2.798 1.00 6.21 H new ATOM 0 HB3 ALA A 88 1.354 -11.464 2.301 1.00 6.21 H new ATOM 1331 N PHE A 89 3.614 -12.013 3.999 1.00 6.21 N ATOM 1332 CA PHE A 89 4.599 -13.045 4.338 1.00 6.21 C ATOM 1333 C PHE A 89 5.180 -12.899 5.750 1.00 7.49 C ATOM 1334 O PHE A 89 5.745 -13.850 6.292 1.00 7.70 O ATOM 1335 CB PHE A 89 5.681 -13.039 3.263 1.00 5.56 C ATOM 1336 CG PHE A 89 5.140 -13.599 1.994 1.00 4.24 C ATOM 1337 CD1 PHE A 89 5.328 -14.927 1.704 1.00 3.84 C ATOM 1338 CD2 PHE A 89 4.374 -12.819 1.129 1.00 3.79 C ATOM 1339 CE1 PHE A 89 4.779 -15.476 0.593 1.00 2.77 C ATOM 1340 CE2 PHE A 89 3.828 -13.358 0.009 1.00 2.72 C ATOM 1341 CZ PHE A 89 4.031 -14.706 -0.260 1.00 1.93 C ATOM 0 H PHE A 89 3.831 -11.514 3.136 1.00 6.21 H new ATOM 0 HA PHE A 89 4.097 -14.012 4.357 1.00 6.21 H new ATOM 0 HB2 PHE A 89 6.037 -12.022 3.099 1.00 5.56 H new ATOM 0 HB3 PHE A 89 6.537 -13.627 3.594 1.00 5.56 H new ATOM 0 HD1 PHE A 89 5.919 -15.541 2.367 1.00 3.84 H new ATOM 0 HD2 PHE A 89 4.213 -11.775 1.352 1.00 3.79 H new ATOM 0 HE1 PHE A 89 4.931 -16.524 0.379 1.00 2.77 H new ATOM 0 HE2 PHE A 89 3.244 -12.747 -0.664 1.00 2.72 H new ATOM 0 HZ PHE A 89 3.598 -15.149 -1.145 1.00 1.93 H new ATOM 1351 N ARG A 90 5.035 -11.706 6.339 1.00 8.36 N ATOM 1352 CA ARG A 90 5.494 -11.453 7.706 1.00 9.63 C ATOM 1353 C ARG A 90 4.479 -12.010 8.720 1.00 10.20 C ATOM 1354 O ARG A 90 4.758 -12.061 9.923 1.00 11.20 O ATOM 1355 CB ARG A 90 5.701 -9.951 7.938 1.00 10.38 C ATOM 1356 CG ARG A 90 6.933 -9.385 7.243 1.00 10.73 C ATOM 1357 CD ARG A 90 7.150 -7.916 7.584 1.00 11.51 C ATOM 1358 NE ARG A 90 7.662 -7.731 8.949 1.00 12.01 N ATOM 1359 CZ ARG A 90 8.098 -6.566 9.450 1.00 12.77 C ATOM 1360 NH1 ARG A 90 8.095 -5.456 8.715 1.00 13.10 N ATOM 1361 NH2 ARG A 90 8.541 -6.516 10.699 1.00 13.29 N ATOM 0 H ARG A 90 4.602 -10.900 5.887 1.00 8.36 H new ATOM 0 HA ARG A 90 6.449 -11.959 7.847 1.00 9.63 H new ATOM 0 HB2 ARG A 90 4.819 -9.414 7.588 1.00 10.38 H new ATOM 0 HB3 ARG A 90 5.783 -9.766 9.009 1.00 10.38 H new ATOM 0 HG2 ARG A 90 7.812 -9.960 7.536 1.00 10.73 H new ATOM 0 HG3 ARG A 90 6.825 -9.496 6.164 1.00 10.73 H new ATOM 0 HD2 ARG A 90 7.851 -7.480 6.873 1.00 11.51 H new ATOM 0 HD3 ARG A 90 6.209 -7.377 7.475 1.00 11.51 H new ATOM 0 HE ARG A 90 7.688 -8.548 9.559 1.00 12.01 H new ATOM 0 HH11 ARG A 90 7.757 -5.482 7.753 1.00 13.10 H new ATOM 0 HH12 ARG A 90 8.431 -4.579 9.114 1.00 13.10 H new ATOM 0 HH21 ARG A 90 8.549 -7.360 11.272 1.00 13.29 H new ATOM 0 HH22 ARG A 90 8.874 -5.633 11.087 1.00 13.29 H new ATOM 1375 N VAL A 91 3.302 -12.428 8.212 1.00 9.66 N ATOM 1376 CA VAL A 91 2.243 -12.980 9.023 1.00 10.29 C ATOM 1377 C VAL A 91 2.223 -14.505 8.955 1.00 9.81 C ATOM 1378 O VAL A 91 2.075 -15.181 9.978 1.00 10.52 O ATOM 1379 CB VAL A 91 0.848 -12.490 8.586 1.00 10.33 C ATOM 1380 CG1 VAL A 91 -0.050 -12.232 9.789 1.00 11.64 C ATOM 1381 CG2 VAL A 91 0.896 -11.269 7.678 1.00 9.85 C ATOM 0 H VAL A 91 3.076 -12.384 7.218 1.00 9.66 H new ATOM 0 HA VAL A 91 2.453 -12.640 10.037 1.00 10.29 H new ATOM 0 HB VAL A 91 0.419 -13.299 7.996 1.00 10.33 H new ATOM 0 HG11 VAL A 91 -1.026 -11.888 9.447 1.00 11.64 H new ATOM 0 HG12 VAL A 91 -0.169 -13.154 10.358 1.00 11.64 H new ATOM 0 HG13 VAL A 91 0.402 -11.470 10.423 1.00 11.64 H new ATOM 0 HG21 VAL A 91 -0.119 -10.976 7.408 1.00 9.85 H new ATOM 0 HG22 VAL A 91 1.384 -10.446 8.200 1.00 9.85 H new ATOM 0 HG23 VAL A 91 1.457 -11.509 6.775 1.00 9.85 H new ATOM 1391 N PHE A 92 2.373 -15.024 7.737 1.00 8.63 N ATOM 1392 CA PHE A 92 2.312 -16.471 7.489 1.00 8.08 C ATOM 1393 C PHE A 92 3.689 -17.124 7.379 1.00 7.58 C ATOM 1394 O PHE A 92 3.846 -18.297 7.734 1.00 7.57 O ATOM 1395 CB PHE A 92 1.572 -16.737 6.175 1.00 7.14 C ATOM 1396 CG PHE A 92 0.283 -15.976 5.985 1.00 7.60 C ATOM 1397 CD1 PHE A 92 -0.936 -16.573 6.262 1.00 7.95 C ATOM 1398 CD2 PHE A 92 0.292 -14.679 5.484 1.00 7.88 C ATOM 1399 CE1 PHE A 92 -2.120 -15.895 6.043 1.00 8.45 C ATOM 1400 CE2 PHE A 92 -0.884 -14.000 5.267 1.00 8.39 C ATOM 1401 CZ PHE A 92 -2.094 -14.607 5.542 1.00 8.62 C ATOM 0 H PHE A 92 2.539 -14.464 6.901 1.00 8.63 H new ATOM 0 HA PHE A 92 1.795 -16.903 8.346 1.00 8.08 H new ATOM 0 HB2 PHE A 92 2.240 -16.496 5.348 1.00 7.14 H new ATOM 0 HB3 PHE A 92 1.356 -17.803 6.110 1.00 7.14 H new ATOM 0 HD1 PHE A 92 -0.961 -17.579 6.653 1.00 7.95 H new ATOM 0 HD2 PHE A 92 1.234 -14.199 5.263 1.00 7.88 H new ATOM 0 HE1 PHE A 92 -3.064 -16.371 6.263 1.00 8.45 H new ATOM 0 HE2 PHE A 92 -0.862 -12.991 4.881 1.00 8.39 H new ATOM 0 HZ PHE A 92 -3.018 -14.076 5.366 1.00 8.62 H new ATOM 1411 N ALA A 93 4.675 -16.372 6.890 1.00 7.32 N ATOM 1412 CA ALA A 93 6.037 -16.881 6.759 1.00 7.11 C ATOM 1413 C ALA A 93 6.895 -16.342 7.912 1.00 8.33 C ATOM 1414 O ALA A 93 6.534 -15.332 8.525 1.00 8.83 O ATOM 1415 CB ALA A 93 6.606 -16.550 5.372 1.00 6.22 C ATOM 0 H ALA A 93 4.554 -15.408 6.578 1.00 7.32 H new ATOM 0 HA ALA A 93 6.041 -17.968 6.833 1.00 7.11 H new ATOM 0 HB1 ALA A 93 7.622 -16.937 5.294 1.00 6.22 H new ATOM 0 HB2 ALA A 93 5.983 -17.008 4.604 1.00 6.22 H new ATOM 0 HB3 ALA A 93 6.618 -15.469 5.232 1.00 6.22 H new ATOM 1421 N LYS A 94 8.022 -17.028 8.212 1.00 8.92 N ATOM 1422 CA LYS A 94 8.957 -16.656 9.319 1.00 10.13 C ATOM 1423 C LYS A 94 8.418 -17.064 10.704 1.00 10.64 C ATOM 1424 O LYS A 94 9.104 -16.889 11.718 1.00 11.32 O ATOM 1425 CB LYS A 94 9.282 -15.141 9.344 1.00 10.90 C ATOM 1426 CG LYS A 94 10.262 -14.688 8.275 1.00 11.36 C ATOM 1427 CD LYS A 94 9.570 -14.446 6.938 1.00 11.16 C ATOM 1428 CE LYS A 94 10.387 -14.995 5.786 1.00 10.61 C ATOM 1429 NZ LYS A 94 11.633 -14.209 5.556 1.00 11.01 N ATOM 0 H LYS A 94 8.316 -17.858 7.697 1.00 8.92 H new ATOM 0 HA LYS A 94 9.872 -17.211 9.110 1.00 10.13 H new ATOM 0 HB2 LYS A 94 8.354 -14.581 9.228 1.00 10.90 H new ATOM 0 HB3 LYS A 94 9.688 -14.886 10.323 1.00 10.90 H new ATOM 0 HG2 LYS A 94 10.756 -13.772 8.600 1.00 11.36 H new ATOM 0 HG3 LYS A 94 11.039 -15.442 8.151 1.00 11.36 H new ATOM 0 HD2 LYS A 94 8.587 -14.916 6.945 1.00 11.16 H new ATOM 0 HD3 LYS A 94 9.411 -13.377 6.797 1.00 11.16 H new ATOM 0 HE2 LYS A 94 10.647 -16.034 5.989 1.00 10.61 H new ATOM 0 HE3 LYS A 94 9.783 -14.989 4.879 1.00 10.61 H new ATOM 0 HZ1 LYS A 94 12.233 -14.704 4.866 1.00 11.01 H new ATOM 0 HZ2 LYS A 94 11.387 -13.268 5.189 1.00 11.01 H new ATOM 0 HZ3 LYS A 94 12.149 -14.107 6.453 1.00 11.01 H new ATOM 1443 N ASP A 95 7.199 -17.622 10.736 1.00 10.41 N ATOM 1444 CA ASP A 95 6.546 -18.029 11.983 1.00 10.95 C ATOM 1445 C ASP A 95 6.994 -19.405 12.491 1.00 11.36 C ATOM 1446 O ASP A 95 6.304 -20.044 13.297 1.00 11.72 O ATOM 1447 CB ASP A 95 5.019 -17.971 11.828 1.00 10.75 C ATOM 1448 CG ASP A 95 4.495 -16.550 11.733 1.00 10.79 C ATOM 1449 OD1 ASP A 95 4.518 -15.982 10.621 1.00 11.08 O ATOM 1450 OD2 ASP A 95 4.063 -16.006 12.771 1.00 10.72 O ATOM 0 H ASP A 95 6.642 -17.802 9.901 1.00 10.41 H new ATOM 0 HA ASP A 95 6.861 -17.315 12.745 1.00 10.95 H new ATOM 0 HB2 ASP A 95 4.727 -18.522 10.934 1.00 10.75 H new ATOM 0 HB3 ASP A 95 4.552 -18.470 12.677 1.00 10.75 H new ATOM 1455 N GLY A 96 8.162 -19.834 12.035 1.00 11.41 N ATOM 1456 CA GLY A 96 8.696 -21.131 12.432 1.00 11.89 C ATOM 1457 C GLY A 96 10.169 -21.294 12.162 1.00 11.67 C ATOM 1458 O GLY A 96 11.014 -20.574 12.700 1.00 11.82 O ATOM 0 H GLY A 96 8.756 -19.308 11.394 1.00 11.41 H new ATOM 0 HA2 GLY A 96 8.514 -21.277 13.497 1.00 11.89 H new ATOM 0 HA3 GLY A 96 8.151 -21.914 11.905 1.00 11.89 H new ATOM 1462 N ASN A 97 10.440 -22.271 11.306 1.00 11.48 N ATOM 1463 CA ASN A 97 11.776 -22.669 10.877 1.00 11.39 C ATOM 1464 C ASN A 97 12.518 -21.586 10.087 1.00 11.24 C ATOM 1465 O ASN A 97 13.740 -21.648 9.917 1.00 11.69 O ATOM 1466 CB ASN A 97 11.591 -23.877 10.003 1.00 10.47 C ATOM 1467 CG ASN A 97 12.692 -24.908 10.170 1.00 10.82 C ATOM 1468 OD1 ASN A 97 13.740 -24.825 9.530 1.00 11.12 O ATOM 1469 ND2 ASN A 97 12.457 -25.889 11.034 1.00 10.95 N ATOM 0 H ASN A 97 9.705 -22.831 10.874 1.00 11.48 H new ATOM 0 HA ASN A 97 12.386 -22.862 11.760 1.00 11.39 H new ATOM 0 HB2 ASN A 97 10.631 -24.340 10.232 1.00 10.47 H new ATOM 0 HB3 ASN A 97 11.553 -23.561 8.960 1.00 10.47 H new ATOM 0 HD21 ASN A 97 13.160 -26.612 11.188 1.00 10.95 H new ATOM 0 HD22 ASN A 97 11.574 -25.919 11.544 1.00 10.95 H new ATOM 1476 N GLY A 98 11.755 -20.615 9.621 1.00 10.71 N ATOM 1477 CA GLY A 98 12.295 -19.501 8.850 1.00 10.57 C ATOM 1478 C GLY A 98 11.868 -19.512 7.389 1.00 9.35 C ATOM 1479 O GLY A 98 12.060 -18.513 6.690 1.00 9.23 O ATOM 0 H GLY A 98 10.746 -20.572 9.763 1.00 10.71 H new ATOM 0 HA2 GLY A 98 11.976 -18.564 9.307 1.00 10.57 H new ATOM 0 HA3 GLY A 98 13.383 -19.526 8.903 1.00 10.57 H new ATOM 1483 N TYR A 99 11.291 -20.629 6.926 1.00 8.53 N ATOM 1484 CA TYR A 99 10.792 -20.725 5.563 1.00 7.35 C ATOM 1485 C TYR A 99 9.305 -21.069 5.553 1.00 6.60 C ATOM 1486 O TYR A 99 8.598 -20.735 4.602 1.00 6.68 O ATOM 1487 CB TYR A 99 11.590 -21.718 4.673 1.00 7.03 C ATOM 1488 CG TYR A 99 11.780 -23.148 5.165 1.00 7.42 C ATOM 1489 CD1 TYR A 99 11.450 -24.222 4.332 1.00 7.29 C ATOM 1490 CD2 TYR A 99 12.314 -23.436 6.419 1.00 8.16 C ATOM 1491 CE1 TYR A 99 11.645 -25.527 4.742 1.00 7.85 C ATOM 1492 CE2 TYR A 99 12.504 -24.742 6.830 1.00 8.71 C ATOM 1493 CZ TYR A 99 12.170 -25.780 5.990 1.00 8.53 C ATOM 1494 OH TYR A 99 12.365 -27.079 6.400 1.00 9.21 O ATOM 0 H TYR A 99 11.162 -21.475 7.482 1.00 8.53 H new ATOM 0 HA TYR A 99 10.937 -19.739 5.121 1.00 7.35 H new ATOM 0 HB2 TYR A 99 11.095 -21.765 3.703 1.00 7.03 H new ATOM 0 HB3 TYR A 99 12.579 -21.291 4.506 1.00 7.03 H new ATOM 0 HD1 TYR A 99 11.036 -24.028 3.353 1.00 7.29 H new ATOM 0 HD2 TYR A 99 12.584 -22.626 7.081 1.00 8.16 H new ATOM 0 HE1 TYR A 99 11.387 -26.346 4.086 1.00 7.85 H new ATOM 0 HE2 TYR A 99 12.914 -24.947 7.808 1.00 8.71 H new ATOM 0 HH TYR A 99 11.836 -27.682 5.837 1.00 9.21 H new ATOM 1504 N ILE A 100 8.837 -21.732 6.634 1.00 6.19 N ATOM 1505 CA ILE A 100 7.431 -22.164 6.794 1.00 5.73 C ATOM 1506 C ILE A 100 6.997 -23.083 5.630 1.00 4.64 C ATOM 1507 O ILE A 100 7.787 -23.346 4.717 1.00 4.17 O ATOM 1508 CB ILE A 100 6.450 -20.942 6.996 1.00 5.84 C ATOM 1509 CG1 ILE A 100 5.285 -21.329 7.919 1.00 5.96 C ATOM 1510 CG2 ILE A 100 5.909 -20.381 5.677 1.00 5.70 C ATOM 1511 CD1 ILE A 100 5.567 -21.097 9.391 1.00 6.65 C ATOM 0 H ILE A 100 9.429 -21.984 7.426 1.00 6.19 H new ATOM 0 HA ILE A 100 7.370 -22.752 7.710 1.00 5.73 H new ATOM 0 HB ILE A 100 7.039 -20.151 7.461 1.00 5.84 H new ATOM 0 HG12 ILE A 100 4.402 -20.757 7.633 1.00 5.96 H new ATOM 0 HG13 ILE A 100 5.047 -22.382 7.766 1.00 5.96 H new ATOM 0 HG21 ILE A 100 5.242 -19.544 5.884 1.00 5.70 H new ATOM 0 HG22 ILE A 100 6.739 -20.039 5.059 1.00 5.70 H new ATOM 0 HG23 ILE A 100 5.360 -21.160 5.148 1.00 5.70 H new ATOM 0 HD11 ILE A 100 4.698 -21.394 9.979 1.00 6.65 H new ATOM 0 HD12 ILE A 100 6.430 -21.690 9.694 1.00 6.65 H new ATOM 0 HD13 ILE A 100 5.775 -20.040 9.559 1.00 6.65 H new ATOM 1523 N SER A 101 5.756 -23.575 5.672 1.00 4.56 N ATOM 1524 CA SER A 101 5.258 -24.447 4.628 1.00 3.87 C ATOM 1525 C SER A 101 4.620 -23.670 3.493 1.00 3.18 C ATOM 1526 O SER A 101 3.888 -22.700 3.710 1.00 3.33 O ATOM 1527 CB SER A 101 4.274 -25.477 5.191 1.00 4.59 C ATOM 1528 OG SER A 101 3.118 -24.853 5.731 1.00 5.48 O ATOM 0 H SER A 101 5.088 -23.380 6.418 1.00 4.56 H new ATOM 0 HA SER A 101 6.120 -24.976 4.221 1.00 3.87 H new ATOM 0 HB2 SER A 101 3.980 -26.169 4.402 1.00 4.59 H new ATOM 0 HB3 SER A 101 4.766 -26.066 5.965 1.00 4.59 H new ATOM 0 HG SER A 101 2.510 -25.537 6.080 1.00 5.48 H new ATOM 1534 N ALA A 102 4.922 -24.128 2.278 1.00 2.74 N ATOM 1535 CA ALA A 102 4.400 -23.529 1.035 1.00 2.63 C ATOM 1536 C ALA A 102 2.863 -23.521 0.956 1.00 3.39 C ATOM 1537 O ALA A 102 2.286 -22.789 0.148 1.00 3.61 O ATOM 1538 CB ALA A 102 4.975 -24.257 -0.164 1.00 3.06 C ATOM 0 H ALA A 102 5.537 -24.927 2.120 1.00 2.74 H new ATOM 0 HA ALA A 102 4.715 -22.485 1.035 1.00 2.63 H new ATOM 0 HB1 ALA A 102 4.587 -23.812 -1.080 1.00 3.06 H new ATOM 0 HB2 ALA A 102 6.062 -24.175 -0.153 1.00 3.06 H new ATOM 0 HB3 ALA A 102 4.690 -25.308 -0.122 1.00 3.06 H new ATOM 1544 N ALA A 103 2.210 -24.340 1.798 1.00 4.09 N ATOM 1545 CA ALA A 103 0.742 -24.432 1.844 1.00 5.20 C ATOM 1546 C ALA A 103 0.088 -23.125 2.320 1.00 5.47 C ATOM 1547 O ALA A 103 -1.102 -22.900 2.084 1.00 6.33 O ATOM 1548 CB ALA A 103 0.321 -25.585 2.742 1.00 5.96 C ATOM 0 H ALA A 103 2.682 -24.953 2.462 1.00 4.09 H new ATOM 0 HA ALA A 103 0.396 -24.613 0.826 1.00 5.20 H new ATOM 0 HB1 ALA A 103 -0.767 -25.646 2.770 1.00 5.96 H new ATOM 0 HB2 ALA A 103 0.726 -26.518 2.350 1.00 5.96 H new ATOM 0 HB3 ALA A 103 0.701 -25.419 3.750 1.00 5.96 H new ATOM 1554 N GLU A 104 0.882 -22.274 2.992 1.00 4.91 N ATOM 1555 CA GLU A 104 0.405 -20.985 3.517 1.00 5.33 C ATOM 1556 C GLU A 104 0.292 -19.917 2.420 1.00 4.76 C ATOM 1557 O GLU A 104 -0.635 -19.107 2.444 1.00 5.38 O ATOM 1558 CB GLU A 104 1.336 -20.486 4.628 1.00 5.44 C ATOM 1559 CG GLU A 104 1.222 -21.260 5.939 1.00 6.31 C ATOM 1560 CD GLU A 104 0.022 -20.843 6.772 1.00 6.92 C ATOM 1561 OE1 GLU A 104 0.167 -19.920 7.601 1.00 7.26 O ATOM 1562 OE2 GLU A 104 -1.060 -21.440 6.595 1.00 7.37 O ATOM 0 H GLU A 104 1.866 -22.459 3.185 1.00 4.91 H new ATOM 0 HA GLU A 104 -0.593 -21.154 3.920 1.00 5.33 H new ATOM 0 HB2 GLU A 104 2.366 -20.542 4.275 1.00 5.44 H new ATOM 0 HB3 GLU A 104 1.122 -19.435 4.821 1.00 5.44 H new ATOM 0 HG2 GLU A 104 1.153 -22.326 5.721 1.00 6.31 H new ATOM 0 HG3 GLU A 104 2.131 -21.112 6.522 1.00 6.31 H new ATOM 1569 N LEU A 105 1.263 -19.910 1.483 1.00 3.64 N ATOM 1570 CA LEU A 105 1.308 -18.972 0.340 1.00 3.09 C ATOM 1571 C LEU A 105 -0.016 -18.775 -0.357 1.00 4.03 C ATOM 1572 O LEU A 105 -0.363 -17.660 -0.743 1.00 4.13 O ATOM 1573 CB LEU A 105 2.271 -19.483 -0.726 1.00 2.35 C ATOM 1574 CG LEU A 105 3.633 -19.993 -0.235 1.00 1.65 C ATOM 1575 CD1 LEU A 105 4.247 -20.934 -1.250 1.00 2.00 C ATOM 1576 CD2 LEU A 105 4.563 -18.829 0.054 1.00 1.38 C ATOM 0 H LEU A 105 2.047 -20.562 1.498 1.00 3.64 H new ATOM 0 HA LEU A 105 1.620 -18.024 0.779 1.00 3.09 H new ATOM 0 HB2 LEU A 105 1.780 -20.291 -1.269 1.00 2.35 H new ATOM 0 HB3 LEU A 105 2.446 -18.679 -1.441 1.00 2.35 H new ATOM 0 HG LEU A 105 3.481 -20.547 0.692 1.00 1.65 H new ATOM 0 HD11 LEU A 105 5.212 -21.285 -0.884 1.00 2.00 H new ATOM 0 HD12 LEU A 105 3.585 -21.786 -1.403 1.00 2.00 H new ATOM 0 HD13 LEU A 105 4.387 -20.409 -2.195 1.00 2.00 H new ATOM 0 HD21 LEU A 105 5.524 -19.209 0.401 1.00 1.38 H new ATOM 0 HD22 LEU A 105 4.710 -18.246 -0.855 1.00 1.38 H new ATOM 0 HD23 LEU A 105 4.124 -18.195 0.824 1.00 1.38 H new ATOM 1588 N ARG A 106 -0.735 -19.870 -0.531 1.00 4.83 N ATOM 1589 CA ARG A 106 -2.019 -19.844 -1.213 1.00 5.95 C ATOM 1590 C ARG A 106 -3.014 -19.011 -0.429 1.00 6.65 C ATOM 1591 O ARG A 106 -3.984 -18.500 -0.972 1.00 7.39 O ATOM 1592 CB ARG A 106 -2.579 -21.259 -1.435 1.00 6.81 C ATOM 1593 CG ARG A 106 -1.623 -22.252 -2.114 1.00 6.46 C ATOM 1594 CD ARG A 106 -0.721 -22.951 -1.114 1.00 5.99 C ATOM 1595 NE ARG A 106 -0.096 -24.152 -1.680 1.00 6.40 N ATOM 1596 CZ ARG A 106 -0.348 -25.408 -1.280 1.00 6.89 C ATOM 1597 NH1 ARG A 106 -1.217 -25.662 -0.303 1.00 7.08 N ATOM 1598 NH2 ARG A 106 0.280 -26.419 -1.867 1.00 7.37 N ATOM 0 H ARG A 106 -0.450 -20.794 -0.207 1.00 4.83 H new ATOM 0 HA ARG A 106 -1.859 -19.392 -2.192 1.00 5.95 H new ATOM 0 HB2 ARG A 106 -2.874 -21.669 -0.469 1.00 6.81 H new ATOM 0 HB3 ARG A 106 -3.483 -21.182 -2.039 1.00 6.81 H new ATOM 0 HG2 ARG A 106 -2.202 -22.996 -2.661 1.00 6.46 H new ATOM 0 HG3 ARG A 106 -1.012 -21.723 -2.845 1.00 6.46 H new ATOM 0 HD2 ARG A 106 0.055 -22.261 -0.782 1.00 5.99 H new ATOM 0 HD3 ARG A 106 -1.301 -23.226 -0.233 1.00 5.99 H new ATOM 0 HE ARG A 106 0.580 -24.023 -2.433 1.00 6.40 H new ATOM 0 HH11 ARG A 106 -1.706 -24.894 0.157 1.00 7.08 H new ATOM 0 HH12 ARG A 106 -1.393 -26.624 -0.015 1.00 7.08 H new ATOM 0 HH21 ARG A 106 0.948 -26.238 -2.616 1.00 7.37 H new ATOM 0 HH22 ARG A 106 0.094 -27.377 -1.569 1.00 7.37 H new ATOM 1612 N HIS A 107 -2.760 -18.936 0.864 1.00 6.60 N ATOM 1613 CA HIS A 107 -3.531 -18.124 1.775 1.00 7.43 C ATOM 1614 C HIS A 107 -2.905 -16.726 1.863 1.00 6.90 C ATOM 1615 O HIS A 107 -3.565 -15.777 2.291 1.00 7.61 O ATOM 1616 CB HIS A 107 -3.595 -18.767 3.164 1.00 8.00 C ATOM 1617 CG HIS A 107 -4.425 -20.014 3.216 1.00 8.87 C ATOM 1618 ND1 HIS A 107 -5.717 -20.039 3.700 1.00 9.79 N ATOM 1619 CD2 HIS A 107 -4.141 -21.284 2.840 1.00 9.07 C ATOM 1620 CE1 HIS A 107 -6.190 -21.270 3.621 1.00 10.41 C ATOM 1621 NE2 HIS A 107 -5.255 -22.043 3.103 1.00 10.03 N ATOM 0 H HIS A 107 -2.000 -19.447 1.314 1.00 6.60 H new ATOM 0 HA HIS A 107 -4.551 -18.044 1.398 1.00 7.43 H new ATOM 0 HB2 HIS A 107 -2.582 -19.002 3.492 1.00 8.00 H new ATOM 0 HB3 HIS A 107 -4.000 -18.043 3.871 1.00 8.00 H new ATOM 0 HD2 HIS A 107 -3.213 -21.634 2.413 1.00 9.07 H new ATOM 0 HE1 HIS A 107 -7.175 -21.589 3.928 1.00 10.41 H new ATOM 0 HE2 HIS A 107 -5.345 -23.044 2.926 1.00 10.03 H new ATOM 1630 N VAL A 108 -1.615 -16.616 1.455 1.00 5.69 N ATOM 1631 CA VAL A 108 -0.886 -15.350 1.484 1.00 5.20 C ATOM 1632 C VAL A 108 -1.122 -14.521 0.235 1.00 4.84 C ATOM 1633 O VAL A 108 -1.632 -13.401 0.320 1.00 5.36 O ATOM 1634 CB VAL A 108 0.646 -15.582 1.653 1.00 4.27 C ATOM 1635 CG1 VAL A 108 1.382 -14.268 1.809 1.00 4.16 C ATOM 1636 CG2 VAL A 108 0.965 -16.527 2.799 1.00 4.80 C ATOM 0 H VAL A 108 -1.068 -17.401 1.103 1.00 5.69 H new ATOM 0 HA VAL A 108 -1.270 -14.801 2.344 1.00 5.20 H new ATOM 0 HB VAL A 108 0.996 -16.063 0.740 1.00 4.27 H new ATOM 0 HG11 VAL A 108 2.449 -14.460 1.925 1.00 4.16 H new ATOM 0 HG12 VAL A 108 1.218 -13.652 0.925 1.00 4.16 H new ATOM 0 HG13 VAL A 108 1.010 -13.745 2.690 1.00 4.16 H new ATOM 0 HG21 VAL A 108 2.045 -16.656 2.875 1.00 4.80 H new ATOM 0 HG22 VAL A 108 0.583 -16.111 3.731 1.00 4.80 H new ATOM 0 HG23 VAL A 108 0.497 -17.494 2.615 1.00 4.80 H new ATOM 1646 N MET A 109 -0.687 -15.051 -0.901 1.00 4.11 N ATOM 1647 CA MET A 109 -0.894 -14.398 -2.194 1.00 4.08 C ATOM 1648 C MET A 109 -2.370 -14.098 -2.389 1.00 5.33 C ATOM 1649 O MET A 109 -2.726 -13.070 -2.964 1.00 5.53 O ATOM 1650 CB MET A 109 -0.329 -15.237 -3.323 1.00 3.81 C ATOM 1651 CG MET A 109 1.173 -15.027 -3.482 1.00 2.70 C ATOM 1652 SD MET A 109 1.845 -15.780 -4.971 1.00 3.27 S ATOM 1653 CE MET A 109 1.836 -17.499 -4.496 1.00 3.46 C ATOM 0 H MET A 109 -0.185 -15.937 -0.956 1.00 4.11 H new ATOM 0 HA MET A 109 -0.354 -13.451 -2.206 1.00 4.08 H new ATOM 0 HB2 MET A 109 -0.531 -16.291 -3.130 1.00 3.81 H new ATOM 0 HB3 MET A 109 -0.833 -14.981 -4.255 1.00 3.81 H new ATOM 0 HG2 MET A 109 1.383 -13.958 -3.498 1.00 2.70 H new ATOM 0 HG3 MET A 109 1.684 -15.440 -2.612 1.00 2.70 H new ATOM 0 HE1 MET A 109 1.390 -18.094 -5.293 1.00 3.46 H new ATOM 0 HE2 MET A 109 2.859 -17.834 -4.322 1.00 3.46 H new ATOM 0 HE3 MET A 109 1.254 -17.621 -3.583 1.00 3.46 H new ATOM 1663 N THR A 110 -3.232 -15.017 -1.914 1.00 6.20 N ATOM 1664 CA THR A 110 -4.675 -14.764 -1.919 1.00 7.45 C ATOM 1665 C THR A 110 -4.989 -13.586 -0.964 1.00 7.80 C ATOM 1666 O THR A 110 -5.924 -12.821 -1.208 1.00 8.54 O ATOM 1667 CB THR A 110 -5.468 -16.017 -1.493 1.00 8.32 C ATOM 1668 OG1 THR A 110 -5.160 -17.093 -2.384 1.00 8.16 O ATOM 1669 CG2 THR A 110 -6.981 -15.792 -1.506 1.00 9.65 C ATOM 0 H THR A 110 -2.957 -15.921 -1.531 1.00 6.20 H new ATOM 0 HA THR A 110 -4.979 -14.510 -2.934 1.00 7.45 H new ATOM 0 HB THR A 110 -5.175 -16.251 -0.469 1.00 8.32 H new ATOM 0 HG1 THR A 110 -4.449 -17.645 -1.997 1.00 8.16 H new ATOM 0 HG21 THR A 110 -7.488 -16.707 -1.198 1.00 9.65 H new ATOM 0 HG22 THR A 110 -7.235 -14.987 -0.817 1.00 9.65 H new ATOM 0 HG23 THR A 110 -7.300 -15.522 -2.513 1.00 9.65 H new ATOM 1677 N ASN A 111 -4.196 -13.457 0.127 1.00 7.42 N ATOM 1678 CA ASN A 111 -4.372 -12.356 1.089 1.00 8.00 C ATOM 1679 C ASN A 111 -3.661 -11.056 0.631 1.00 7.57 C ATOM 1680 O ASN A 111 -3.750 -10.029 1.312 1.00 8.26 O ATOM 1681 CB ASN A 111 -3.850 -12.783 2.469 1.00 7.98 C ATOM 1682 CG ASN A 111 -4.525 -12.041 3.610 1.00 9.16 C ATOM 1683 OD1 ASN A 111 -4.064 -10.981 4.035 1.00 9.84 O ATOM 1684 ND2 ASN A 111 -5.622 -12.596 4.111 1.00 9.58 N ATOM 0 H ASN A 111 -3.437 -14.098 0.357 1.00 7.42 H new ATOM 0 HA ASN A 111 -5.438 -12.138 1.147 1.00 8.00 H new ATOM 0 HB2 ASN A 111 -4.006 -13.854 2.596 1.00 7.98 H new ATOM 0 HB3 ASN A 111 -2.775 -12.610 2.515 1.00 7.98 H new ATOM 0 HD21 ASN A 111 -6.118 -12.143 4.879 1.00 9.58 H new ATOM 0 HD22 ASN A 111 -5.969 -13.476 3.728 1.00 9.58 H new ATOM 1691 N LEU A 112 -2.970 -11.105 -0.529 1.00 6.48 N ATOM 1692 CA LEU A 112 -2.227 -9.950 -1.076 1.00 6.02 C ATOM 1693 C LEU A 112 -3.122 -8.711 -1.345 1.00 6.50 C ATOM 1694 O LEU A 112 -2.622 -7.585 -1.375 1.00 6.87 O ATOM 1695 CB LEU A 112 -1.425 -10.389 -2.338 1.00 4.81 C ATOM 1696 CG LEU A 112 -1.829 -9.792 -3.699 1.00 4.44 C ATOM 1697 CD1 LEU A 112 -0.769 -10.085 -4.749 1.00 4.55 C ATOM 1698 CD2 LEU A 112 -3.169 -10.347 -4.131 1.00 4.77 C ATOM 0 H LEU A 112 -2.912 -11.942 -1.109 1.00 6.48 H new ATOM 0 HA LEU A 112 -1.523 -9.620 -0.312 1.00 6.02 H new ATOM 0 HB2 LEU A 112 -0.376 -10.148 -2.167 1.00 4.81 H new ATOM 0 HB3 LEU A 112 -1.494 -11.474 -2.416 1.00 4.81 H new ATOM 0 HG LEU A 112 -1.914 -8.710 -3.594 1.00 4.44 H new ATOM 0 HD11 LEU A 112 -1.073 -9.655 -5.703 1.00 4.55 H new ATOM 0 HD12 LEU A 112 0.180 -9.647 -4.440 1.00 4.55 H new ATOM 0 HD13 LEU A 112 -0.653 -11.163 -4.858 1.00 4.55 H new ATOM 0 HD21 LEU A 112 -3.447 -9.919 -5.094 1.00 4.77 H new ATOM 0 HD22 LEU A 112 -3.102 -11.431 -4.221 1.00 4.77 H new ATOM 0 HD23 LEU A 112 -3.925 -10.091 -3.389 1.00 4.77 H new ATOM 1710 N GLY A 113 -4.430 -8.934 -1.549 1.00 6.67 N ATOM 1711 CA GLY A 113 -5.355 -7.832 -1.813 1.00 7.40 C ATOM 1712 C GLY A 113 -6.368 -8.164 -2.888 1.00 8.34 C ATOM 1713 O GLY A 113 -7.507 -8.528 -2.585 1.00 8.64 O ATOM 0 H GLY A 113 -4.863 -9.858 -1.536 1.00 6.67 H new ATOM 0 HA2 GLY A 113 -5.879 -7.575 -0.893 1.00 7.40 H new ATOM 0 HA3 GLY A 113 -4.788 -6.951 -2.114 1.00 7.40 H new ATOM 1717 N GLU A 114 -5.940 -8.029 -4.153 1.00 8.94 N ATOM 1718 CA GLU A 114 -6.775 -8.340 -5.334 1.00 10.00 C ATOM 1719 C GLU A 114 -7.015 -9.839 -5.440 1.00 10.47 C ATOM 1720 O GLU A 114 -7.824 -10.315 -6.239 1.00 11.33 O ATOM 1721 CB GLU A 114 -6.059 -7.878 -6.587 1.00 10.43 C ATOM 1722 CG GLU A 114 -6.117 -6.376 -6.823 1.00 10.39 C ATOM 1723 CD GLU A 114 -5.385 -5.955 -8.082 1.00 11.02 C ATOM 1724 OE1 GLU A 114 -6.023 -5.913 -9.154 1.00 11.20 O ATOM 1725 OE2 GLU A 114 -4.173 -5.667 -7.995 1.00 11.47 O ATOM 0 H GLU A 114 -5.004 -7.701 -4.391 1.00 8.94 H new ATOM 0 HA GLU A 114 -7.732 -7.829 -5.227 1.00 10.00 H new ATOM 0 HB2 GLU A 114 -5.015 -8.185 -6.529 1.00 10.43 H new ATOM 0 HB3 GLU A 114 -6.493 -8.386 -7.448 1.00 10.43 H new ATOM 0 HG2 GLU A 114 -7.159 -6.063 -6.891 1.00 10.39 H new ATOM 0 HG3 GLU A 114 -5.684 -5.860 -5.966 1.00 10.39 H new ATOM 1732 N LYS A 115 -6.248 -10.537 -4.610 1.00 10.04 N ATOM 1733 CA LYS A 115 -6.218 -11.998 -4.429 1.00 10.61 C ATOM 1734 C LYS A 115 -5.974 -12.780 -5.714 1.00 10.14 C ATOM 1735 O LYS A 115 -6.317 -12.334 -6.813 1.00 10.70 O ATOM 1736 CB LYS A 115 -7.475 -12.565 -3.752 1.00 11.03 C ATOM 1737 CG LYS A 115 -8.697 -12.509 -4.647 1.00 10.36 C ATOM 1738 CD LYS A 115 -9.907 -11.935 -3.921 1.00 10.71 C ATOM 1739 CE LYS A 115 -9.665 -10.480 -3.530 1.00 10.61 C ATOM 1740 NZ LYS A 115 -10.279 -9.531 -4.498 1.00 10.83 N ATOM 0 H LYS A 115 -5.579 -10.070 -3.998 1.00 10.04 H new ATOM 0 HA LYS A 115 -5.363 -12.137 -3.767 1.00 10.61 H new ATOM 0 HB2 LYS A 115 -7.291 -13.599 -3.460 1.00 11.03 H new ATOM 0 HB3 LYS A 115 -7.674 -12.006 -2.837 1.00 11.03 H new ATOM 0 HG2 LYS A 115 -8.477 -11.900 -5.524 1.00 10.36 H new ATOM 0 HG3 LYS A 115 -8.931 -13.511 -5.006 1.00 10.36 H new ATOM 0 HD2 LYS A 115 -10.787 -12.003 -4.561 1.00 10.71 H new ATOM 0 HD3 LYS A 115 -10.116 -12.526 -3.029 1.00 10.71 H new ATOM 0 HE2 LYS A 115 -10.075 -10.299 -2.536 1.00 10.61 H new ATOM 0 HE3 LYS A 115 -8.593 -10.294 -3.471 1.00 10.61 H new ATOM 0 HZ1 LYS A 115 -10.332 -8.584 -4.070 1.00 10.83 H new ATOM 0 HZ2 LYS A 115 -9.698 -9.490 -5.360 1.00 10.83 H new ATOM 0 HZ3 LYS A 115 -11.237 -9.855 -4.741 1.00 10.83 H new ATOM 1754 N LEU A 116 -5.374 -13.950 -5.548 1.00 9.19 N ATOM 1755 CA LEU A 116 -5.147 -14.856 -6.652 1.00 8.69 C ATOM 1756 C LEU A 116 -5.447 -16.283 -6.186 1.00 9.07 C ATOM 1757 O LEU A 116 -5.567 -16.522 -4.979 1.00 9.05 O ATOM 1758 CB LEU A 116 -3.717 -14.724 -7.204 1.00 7.40 C ATOM 1759 CG LEU A 116 -3.382 -13.354 -7.808 1.00 6.84 C ATOM 1760 CD1 LEU A 116 -2.054 -12.838 -7.273 1.00 6.44 C ATOM 1761 CD2 LEU A 116 -3.351 -13.434 -9.326 1.00 6.43 C ATOM 0 H LEU A 116 -5.035 -14.291 -4.649 1.00 9.19 H new ATOM 0 HA LEU A 116 -5.816 -14.601 -7.474 1.00 8.69 H new ATOM 0 HB2 LEU A 116 -3.012 -14.932 -6.399 1.00 7.40 H new ATOM 0 HB3 LEU A 116 -3.565 -15.488 -7.967 1.00 7.40 H new ATOM 0 HG LEU A 116 -4.163 -12.652 -7.515 1.00 6.84 H new ATOM 0 HD11 LEU A 116 -1.837 -11.866 -7.715 1.00 6.44 H new ATOM 0 HD12 LEU A 116 -2.112 -12.739 -6.189 1.00 6.44 H new ATOM 0 HD13 LEU A 116 -1.260 -13.539 -7.531 1.00 6.44 H new ATOM 0 HD21 LEU A 116 -3.112 -12.453 -9.737 1.00 6.43 H new ATOM 0 HD22 LEU A 116 -2.593 -14.153 -9.637 1.00 6.43 H new ATOM 0 HD23 LEU A 116 -4.326 -13.754 -9.693 1.00 6.43 H new ATOM 1773 N THR A 117 -5.566 -17.232 -7.123 1.00 9.56 N ATOM 1774 CA THR A 117 -5.881 -18.604 -6.765 1.00 10.01 C ATOM 1775 C THR A 117 -4.674 -19.448 -6.447 1.00 9.24 C ATOM 1776 O THR A 117 -3.531 -18.989 -6.408 1.00 8.29 O ATOM 1777 CB THR A 117 -6.674 -19.354 -7.849 1.00 11.26 C ATOM 1778 OG1 THR A 117 -6.169 -19.042 -9.155 1.00 11.46 O ATOM 1779 CG2 THR A 117 -8.134 -19.006 -7.752 1.00 12.18 C ATOM 0 H THR A 117 -5.449 -17.069 -8.123 1.00 9.56 H new ATOM 0 HA THR A 117 -6.489 -18.479 -5.869 1.00 10.01 H new ATOM 0 HB THR A 117 -6.556 -20.425 -7.687 1.00 11.26 H new ATOM 0 HG1 THR A 117 -6.685 -19.530 -9.830 1.00 11.46 H new ATOM 0 HG21 THR A 117 -8.688 -19.541 -8.523 1.00 12.18 H new ATOM 0 HG22 THR A 117 -8.512 -19.291 -6.770 1.00 12.18 H new ATOM 0 HG23 THR A 117 -8.262 -17.933 -7.892 1.00 12.18 H new ATOM 1787 N ASP A 118 -5.003 -20.705 -6.206 1.00 9.74 N ATOM 1788 CA ASP A 118 -4.068 -21.763 -5.907 1.00 9.28 C ATOM 1789 C ASP A 118 -3.266 -22.158 -7.124 1.00 9.42 C ATOM 1790 O ASP A 118 -2.146 -22.650 -7.002 1.00 8.80 O ATOM 1791 CB ASP A 118 -4.883 -22.936 -5.422 1.00 10.08 C ATOM 1792 CG ASP A 118 -5.144 -22.896 -3.929 1.00 9.81 C ATOM 1793 OD1 ASP A 118 -4.313 -23.433 -3.166 1.00 9.86 O ATOM 1794 OD2 ASP A 118 -6.179 -22.327 -3.522 1.00 9.76 O ATOM 0 H ASP A 118 -5.972 -21.025 -6.215 1.00 9.74 H new ATOM 0 HA ASP A 118 -3.353 -21.430 -5.155 1.00 9.28 H new ATOM 0 HB2 ASP A 118 -5.835 -22.954 -5.952 1.00 10.08 H new ATOM 0 HB3 ASP A 118 -4.363 -23.861 -5.670 1.00 10.08 H new ATOM 1799 N GLU A 119 -3.862 -21.949 -8.294 1.00 10.37 N ATOM 1800 CA GLU A 119 -3.199 -22.233 -9.558 1.00 10.83 C ATOM 1801 C GLU A 119 -2.089 -21.222 -9.787 1.00 10.04 C ATOM 1802 O GLU A 119 -1.163 -21.466 -10.560 1.00 10.27 O ATOM 1803 CB GLU A 119 -4.187 -22.244 -10.730 1.00 12.10 C ATOM 1804 CG GLU A 119 -5.110 -23.454 -10.746 1.00 13.08 C ATOM 1805 CD GLU A 119 -6.071 -23.438 -11.918 1.00 14.16 C ATOM 1806 OE1 GLU A 119 -5.718 -23.987 -12.983 1.00 14.50 O ATOM 1807 OE2 GLU A 119 -7.178 -22.878 -11.771 1.00 14.78 O ATOM 0 H GLU A 119 -4.809 -21.582 -8.391 1.00 10.37 H new ATOM 0 HA GLU A 119 -2.767 -23.232 -9.503 1.00 10.83 H new ATOM 0 HB2 GLU A 119 -4.792 -21.338 -10.691 1.00 12.10 H new ATOM 0 HB3 GLU A 119 -3.627 -22.214 -11.665 1.00 12.10 H new ATOM 0 HG2 GLU A 119 -4.510 -24.363 -10.785 1.00 13.08 H new ATOM 0 HG3 GLU A 119 -5.677 -23.486 -9.816 1.00 13.08 H new ATOM 1814 N GLU A 120 -2.207 -20.081 -9.092 1.00 9.24 N ATOM 1815 CA GLU A 120 -1.176 -19.051 -9.106 1.00 8.40 C ATOM 1816 C GLU A 120 0.005 -19.619 -8.348 1.00 7.57 C ATOM 1817 O GLU A 120 1.148 -19.486 -8.763 1.00 7.44 O ATOM 1818 CB GLU A 120 -1.645 -17.755 -8.416 1.00 7.71 C ATOM 1819 CG GLU A 120 -0.868 -16.495 -8.808 1.00 7.14 C ATOM 1820 CD GLU A 120 -0.950 -16.155 -10.289 1.00 8.10 C ATOM 1821 OE1 GLU A 120 0.088 -16.248 -10.978 1.00 8.52 O ATOM 1822 OE2 GLU A 120 -2.052 -15.802 -10.758 1.00 8.58 O ATOM 0 H GLU A 120 -3.015 -19.854 -8.512 1.00 9.24 H new ATOM 0 HA GLU A 120 -0.927 -18.792 -10.135 1.00 8.40 H new ATOM 0 HB2 GLU A 120 -2.699 -17.600 -8.646 1.00 7.71 H new ATOM 0 HB3 GLU A 120 -1.571 -17.888 -7.337 1.00 7.71 H new ATOM 0 HG2 GLU A 120 -1.247 -15.652 -8.230 1.00 7.14 H new ATOM 0 HG3 GLU A 120 0.179 -16.625 -8.533 1.00 7.14 H new ATOM 1829 N VAL A 121 -0.308 -20.318 -7.248 1.00 7.19 N ATOM 1830 CA VAL A 121 0.684 -20.929 -6.424 1.00 6.42 C ATOM 1831 C VAL A 121 1.239 -22.190 -7.089 1.00 7.15 C ATOM 1832 O VAL A 121 2.451 -22.338 -7.216 1.00 6.95 O ATOM 1833 CB VAL A 121 0.070 -21.226 -5.040 1.00 5.97 C ATOM 1834 CG1 VAL A 121 1.121 -21.734 -4.101 1.00 5.00 C ATOM 1835 CG2 VAL A 121 -0.597 -19.977 -4.463 1.00 5.72 C ATOM 0 H VAL A 121 -1.264 -20.462 -6.924 1.00 7.19 H new ATOM 0 HA VAL A 121 1.526 -20.250 -6.291 1.00 6.42 H new ATOM 0 HB VAL A 121 -0.692 -21.996 -5.163 1.00 5.97 H new ATOM 0 HG11 VAL A 121 0.672 -21.939 -3.129 1.00 5.00 H new ATOM 0 HG12 VAL A 121 1.554 -22.651 -4.501 1.00 5.00 H new ATOM 0 HG13 VAL A 121 1.902 -20.982 -3.989 1.00 5.00 H new ATOM 0 HG21 VAL A 121 -1.023 -20.210 -3.487 1.00 5.72 H new ATOM 0 HG22 VAL A 121 0.144 -19.185 -4.356 1.00 5.72 H new ATOM 0 HG23 VAL A 121 -1.389 -19.644 -5.134 1.00 5.72 H new ATOM 1845 N ASP A 122 0.332 -23.047 -7.563 1.00 8.17 N ATOM 1846 CA ASP A 122 0.691 -24.313 -8.238 1.00 9.00 C ATOM 1847 C ASP A 122 1.554 -24.060 -9.478 1.00 9.58 C ATOM 1848 O ASP A 122 2.317 -24.931 -9.896 1.00 10.07 O ATOM 1849 CB ASP A 122 -0.577 -25.086 -8.621 1.00 10.08 C ATOM 1850 CG ASP A 122 -0.353 -26.587 -8.690 1.00 9.97 C ATOM 1851 OD1 ASP A 122 0.012 -27.084 -9.776 1.00 10.09 O ATOM 1852 OD2 ASP A 122 -0.543 -27.264 -7.657 1.00 9.98 O ATOM 0 H ASP A 122 -0.674 -22.890 -7.494 1.00 8.17 H new ATOM 0 HA ASP A 122 1.277 -24.912 -7.540 1.00 9.00 H new ATOM 0 HB2 ASP A 122 -1.360 -24.873 -7.894 1.00 10.08 H new ATOM 0 HB3 ASP A 122 -0.935 -24.732 -9.588 1.00 10.08 H new ATOM 1857 N GLU A 123 1.420 -22.852 -10.040 1.00 9.61 N ATOM 1858 CA GLU A 123 2.193 -22.427 -11.213 1.00 10.24 C ATOM 1859 C GLU A 123 3.644 -22.135 -10.818 1.00 9.65 C ATOM 1860 O GLU A 123 4.575 -22.476 -11.554 1.00 10.36 O ATOM 1861 CB GLU A 123 1.569 -21.187 -11.859 1.00 10.45 C ATOM 1862 CG GLU A 123 0.619 -21.509 -13.002 1.00 11.70 C ATOM 1863 CD GLU A 123 0.011 -20.267 -13.623 1.00 11.94 C ATOM 1864 OE1 GLU A 123 0.612 -19.724 -14.575 1.00 12.02 O ATOM 1865 OE2 GLU A 123 -1.065 -19.836 -13.159 1.00 12.16 O ATOM 0 H GLU A 123 0.773 -22.143 -9.695 1.00 9.61 H new ATOM 0 HA GLU A 123 2.178 -23.240 -11.939 1.00 10.24 H new ATOM 0 HB2 GLU A 123 1.030 -20.623 -11.098 1.00 10.45 H new ATOM 0 HB3 GLU A 123 2.365 -20.541 -12.230 1.00 10.45 H new ATOM 0 HG2 GLU A 123 1.155 -22.068 -13.768 1.00 11.70 H new ATOM 0 HG3 GLU A 123 -0.179 -22.155 -12.635 1.00 11.70 H new ATOM 1872 N MET A 124 3.819 -21.499 -9.644 1.00 8.45 N ATOM 1873 CA MET A 124 5.147 -21.178 -9.115 1.00 7.91 C ATOM 1874 C MET A 124 5.728 -22.335 -8.326 1.00 7.70 C ATOM 1875 O MET A 124 6.941 -22.392 -8.105 1.00 7.76 O ATOM 1876 CB MET A 124 5.098 -19.926 -8.238 1.00 6.78 C ATOM 1877 CG MET A 124 5.422 -18.639 -8.984 1.00 6.98 C ATOM 1878 SD MET A 124 4.305 -17.286 -8.566 1.00 6.62 S ATOM 1879 CE MET A 124 2.874 -17.728 -9.543 1.00 7.40 C ATOM 0 H MET A 124 3.050 -21.198 -9.046 1.00 8.45 H new ATOM 0 HA MET A 124 5.795 -20.987 -9.970 1.00 7.91 H new ATOM 0 HB2 MET A 124 4.104 -19.840 -7.799 1.00 6.78 H new ATOM 0 HB3 MET A 124 5.801 -20.044 -7.414 1.00 6.78 H new ATOM 0 HG2 MET A 124 6.446 -18.341 -8.757 1.00 6.98 H new ATOM 0 HG3 MET A 124 5.374 -18.825 -10.057 1.00 6.98 H new ATOM 0 HE1 MET A 124 1.969 -17.566 -8.957 1.00 7.40 H new ATOM 0 HE2 MET A 124 2.841 -17.110 -10.440 1.00 7.40 H new ATOM 0 HE3 MET A 124 2.939 -18.778 -9.828 1.00 7.40 H new ATOM 1889 N ILE A 125 4.858 -23.252 -7.903 1.00 7.60 N ATOM 1890 CA ILE A 125 5.275 -24.415 -7.145 1.00 7.41 C ATOM 1891 C ILE A 125 6.163 -25.346 -7.967 1.00 8.49 C ATOM 1892 O ILE A 125 7.191 -25.817 -7.483 1.00 8.45 O ATOM 1893 CB ILE A 125 4.087 -25.180 -6.564 1.00 7.24 C ATOM 1894 CG1 ILE A 125 3.396 -24.333 -5.500 1.00 6.16 C ATOM 1895 CG2 ILE A 125 4.603 -26.448 -5.965 1.00 7.27 C ATOM 1896 CD1 ILE A 125 2.039 -24.822 -5.109 1.00 6.48 C ATOM 0 H ILE A 125 3.854 -23.204 -8.078 1.00 7.60 H new ATOM 0 HA ILE A 125 5.867 -24.038 -6.311 1.00 7.41 H new ATOM 0 HB ILE A 125 3.359 -25.405 -7.344 1.00 7.24 H new ATOM 0 HG12 ILE A 125 4.027 -24.301 -4.612 1.00 6.16 H new ATOM 0 HG13 ILE A 125 3.309 -23.310 -5.867 1.00 6.16 H new ATOM 0 HG21 ILE A 125 3.773 -27.015 -5.542 1.00 7.27 H new ATOM 0 HG22 ILE A 125 5.092 -27.042 -6.737 1.00 7.27 H new ATOM 0 HG23 ILE A 125 5.320 -26.213 -5.179 1.00 7.27 H new ATOM 0 HD11 ILE A 125 1.620 -24.163 -4.349 1.00 6.48 H new ATOM 0 HD12 ILE A 125 1.388 -24.827 -5.983 1.00 6.48 H new ATOM 0 HD13 ILE A 125 2.118 -25.833 -4.709 1.00 6.48 H new ATOM 1908 N ARG A 126 5.709 -25.637 -9.181 1.00 9.53 N ATOM 1909 CA ARG A 126 6.450 -26.473 -10.155 1.00 10.70 C ATOM 1910 C ARG A 126 7.936 -26.102 -10.183 1.00 10.89 C ATOM 1911 O ARG A 126 8.798 -26.976 -10.313 1.00 11.45 O ATOM 1912 CB ARG A 126 5.892 -26.306 -11.574 1.00 11.76 C ATOM 1913 CG ARG A 126 4.390 -26.501 -11.708 1.00 12.03 C ATOM 1914 CD ARG A 126 3.775 -25.340 -12.464 1.00 12.20 C ATOM 1915 NE ARG A 126 2.321 -25.479 -12.605 1.00 12.92 N ATOM 1916 CZ ARG A 126 1.576 -24.832 -13.513 1.00 13.50 C ATOM 1917 NH1 ARG A 126 2.128 -23.989 -14.384 1.00 13.44 N ATOM 1918 NH2 ARG A 126 0.266 -25.035 -13.548 1.00 14.26 N ATOM 0 H ARG A 126 4.811 -25.303 -9.532 1.00 9.53 H new ATOM 0 HA ARG A 126 6.330 -27.507 -9.832 1.00 10.70 H new ATOM 0 HB2 ARG A 126 6.146 -25.308 -11.931 1.00 11.76 H new ATOM 0 HB3 ARG A 126 6.394 -27.017 -12.230 1.00 11.76 H new ATOM 0 HG2 ARG A 126 4.183 -27.435 -12.231 1.00 12.03 H new ATOM 0 HG3 ARG A 126 3.937 -26.581 -10.720 1.00 12.03 H new ATOM 0 HD2 ARG A 126 4.001 -24.409 -11.943 1.00 12.20 H new ATOM 0 HD3 ARG A 126 4.229 -25.271 -13.452 1.00 12.20 H new ATOM 0 HE ARG A 126 1.842 -26.114 -11.966 1.00 12.92 H new ATOM 0 HH11 ARG A 126 3.135 -23.826 -14.368 1.00 13.44 H new ATOM 0 HH12 ARG A 126 1.544 -23.506 -15.067 1.00 13.44 H new ATOM 0 HH21 ARG A 126 -0.168 -25.679 -12.887 1.00 14.26 H new ATOM 0 HH22 ARG A 126 -0.308 -24.547 -14.236 1.00 14.26 H new ATOM 1932 N GLU A 127 8.219 -24.788 -10.058 1.00 10.50 N ATOM 1933 CA GLU A 127 9.595 -24.289 -10.038 1.00 10.79 C ATOM 1934 C GLU A 127 10.216 -24.440 -8.646 1.00 10.06 C ATOM 1935 O GLU A 127 11.431 -24.621 -8.519 1.00 10.61 O ATOM 1936 CB GLU A 127 9.628 -22.823 -10.457 1.00 10.70 C ATOM 1937 CG GLU A 127 9.410 -22.593 -11.951 1.00 11.77 C ATOM 1938 CD GLU A 127 10.652 -22.867 -12.783 1.00 12.85 C ATOM 1939 OE1 GLU A 127 11.445 -21.926 -12.993 1.00 13.26 O ATOM 1940 OE2 GLU A 127 10.830 -24.023 -13.221 1.00 13.42 O ATOM 0 H GLU A 127 7.509 -24.061 -9.970 1.00 10.50 H new ATOM 0 HA GLU A 127 10.178 -24.882 -10.743 1.00 10.79 H new ATOM 0 HB2 GLU A 127 8.862 -22.281 -9.902 1.00 10.70 H new ATOM 0 HB3 GLU A 127 10.590 -22.397 -10.172 1.00 10.70 H new ATOM 0 HG2 GLU A 127 8.599 -23.234 -12.297 1.00 11.77 H new ATOM 0 HG3 GLU A 127 9.092 -21.563 -12.112 1.00 11.77 H new ATOM 1947 N ALA A 128 9.367 -24.364 -7.606 1.00 8.89 N ATOM 1948 CA ALA A 128 9.806 -24.499 -6.211 1.00 8.16 C ATOM 1949 C ALA A 128 10.131 -25.944 -5.821 1.00 8.57 C ATOM 1950 O ALA A 128 10.941 -26.177 -4.920 1.00 8.66 O ATOM 1951 CB ALA A 128 8.715 -23.997 -5.299 1.00 6.87 C ATOM 0 H ALA A 128 8.364 -24.208 -7.710 1.00 8.89 H new ATOM 0 HA ALA A 128 10.720 -23.914 -6.109 1.00 8.16 H new ATOM 0 HB1 ALA A 128 9.035 -24.094 -4.261 1.00 6.87 H new ATOM 0 HB2 ALA A 128 8.510 -22.949 -5.519 1.00 6.87 H new ATOM 0 HB3 ALA A 128 7.810 -24.584 -5.457 1.00 6.87 H new ATOM 1957 N ALA A 129 9.469 -26.903 -6.503 1.00 8.95 N ATOM 1958 CA ALA A 129 9.610 -28.358 -6.257 1.00 9.43 C ATOM 1959 C ALA A 129 8.801 -28.768 -5.022 1.00 8.51 C ATOM 1960 O ALA A 129 7.900 -29.606 -5.119 1.00 8.76 O ATOM 1961 CB ALA A 129 11.074 -28.807 -6.139 1.00 10.42 C ATOM 0 H ALA A 129 8.811 -26.687 -7.252 1.00 8.95 H new ATOM 0 HA ALA A 129 9.208 -28.872 -7.130 1.00 9.43 H new ATOM 0 HB1 ALA A 129 11.112 -29.881 -5.959 1.00 10.42 H new ATOM 0 HB2 ALA A 129 11.601 -28.575 -7.064 1.00 10.42 H new ATOM 0 HB3 ALA A 129 11.549 -28.284 -5.309 1.00 10.42 H new ATOM 1967 N ILE A 130 9.125 -28.152 -3.860 1.00 7.54 N ATOM 1968 CA ILE A 130 8.433 -28.395 -2.569 1.00 6.69 C ATOM 1969 C ILE A 130 8.706 -29.783 -1.978 1.00 6.68 C ATOM 1970 O ILE A 130 8.894 -29.921 -0.769 1.00 6.97 O ATOM 1971 CB ILE A 130 6.888 -28.108 -2.687 1.00 5.80 C ATOM 1972 CG1 ILE A 130 6.517 -26.797 -1.969 1.00 5.43 C ATOM 1973 CG2 ILE A 130 6.019 -29.249 -2.152 1.00 6.19 C ATOM 1974 CD1 ILE A 130 7.049 -25.537 -2.629 1.00 4.53 C ATOM 0 H ILE A 130 9.878 -27.468 -3.790 1.00 7.54 H new ATOM 0 HA ILE A 130 8.860 -27.685 -1.860 1.00 6.69 H new ATOM 0 HB ILE A 130 6.682 -28.017 -3.753 1.00 5.80 H new ATOM 0 HG12 ILE A 130 5.431 -26.727 -1.908 1.00 5.43 H new ATOM 0 HG13 ILE A 130 6.892 -26.841 -0.946 1.00 5.43 H new ATOM 0 HG21 ILE A 130 4.967 -28.988 -2.263 1.00 6.19 H new ATOM 0 HG22 ILE A 130 6.228 -30.160 -2.714 1.00 6.19 H new ATOM 0 HG23 ILE A 130 6.243 -29.413 -1.098 1.00 6.19 H new ATOM 0 HD11 ILE A 130 6.738 -24.665 -2.053 1.00 4.53 H new ATOM 0 HD12 ILE A 130 8.138 -25.577 -2.666 1.00 4.53 H new ATOM 0 HD13 ILE A 130 6.654 -25.463 -3.642 1.00 4.53 H new ATOM 1986 N ASP A 131 8.730 -30.786 -2.845 1.00 6.58 N ATOM 1987 CA ASP A 131 8.950 -32.181 -2.459 1.00 6.68 C ATOM 1988 C ASP A 131 10.282 -32.389 -1.736 1.00 6.59 C ATOM 1989 O ASP A 131 11.261 -31.685 -2.000 1.00 6.80 O ATOM 1990 CB ASP A 131 8.872 -33.073 -3.696 1.00 7.70 C ATOM 1991 CG ASP A 131 7.454 -33.514 -4.001 1.00 7.98 C ATOM 1992 OD1 ASP A 131 7.042 -34.579 -3.495 1.00 8.18 O ATOM 1993 OD2 ASP A 131 6.756 -32.795 -4.746 1.00 8.25 O ATOM 0 H ASP A 131 8.596 -30.657 -3.848 1.00 6.58 H new ATOM 0 HA ASP A 131 8.165 -32.454 -1.754 1.00 6.68 H new ATOM 0 HB2 ASP A 131 9.275 -32.536 -4.554 1.00 7.70 H new ATOM 0 HB3 ASP A 131 9.499 -33.952 -3.547 1.00 7.70 H new ATOM 1998 N GLY A 132 10.289 -33.366 -0.826 1.00 6.49 N ATOM 1999 CA GLY A 132 11.472 -33.664 -0.036 1.00 6.52 C ATOM 2000 C GLY A 132 11.355 -33.107 1.369 1.00 5.87 C ATOM 2001 O GLY A 132 11.656 -33.800 2.346 1.00 6.01 O ATOM 0 H GLY A 132 9.486 -33.961 -0.623 1.00 6.49 H new ATOM 0 HA2 GLY A 132 11.618 -34.743 0.010 1.00 6.52 H new ATOM 0 HA3 GLY A 132 12.352 -33.244 -0.523 1.00 6.52 H new ATOM 2005 N ASP A 133 10.913 -31.847 1.459 1.00 5.34 N ATOM 2006 CA ASP A 133 10.731 -31.162 2.735 1.00 4.95 C ATOM 2007 C ASP A 133 9.266 -30.885 2.929 1.00 4.57 C ATOM 2008 O ASP A 133 8.743 -30.880 4.048 1.00 4.65 O ATOM 2009 CB ASP A 133 11.419 -29.814 2.703 1.00 4.99 C ATOM 2010 CG ASP A 133 12.039 -29.432 4.034 1.00 5.63 C ATOM 2011 OD1 ASP A 133 11.283 -29.062 4.956 1.00 6.07 O ATOM 2012 OD2 ASP A 133 13.281 -29.502 4.152 1.00 5.97 O ATOM 0 H ASP A 133 10.673 -31.278 0.647 1.00 5.34 H new ATOM 0 HA ASP A 133 11.140 -31.788 3.528 1.00 4.95 H new ATOM 0 HB2 ASP A 133 12.195 -29.827 1.938 1.00 4.99 H new ATOM 0 HB3 ASP A 133 10.697 -29.051 2.413 1.00 4.99 H new ATOM 2017 N GLY A 134 8.625 -30.655 1.786 1.00 4.47 N ATOM 2018 CA GLY A 134 7.236 -30.345 1.735 1.00 4.33 C ATOM 2019 C GLY A 134 6.908 -28.873 1.993 1.00 3.73 C ATOM 2020 O GLY A 134 5.732 -28.503 2.052 1.00 3.75 O ATOM 0 H GLY A 134 9.077 -30.684 0.872 1.00 4.47 H new ATOM 0 HA2 GLY A 134 6.849 -30.625 0.755 1.00 4.33 H new ATOM 0 HA3 GLY A 134 6.712 -30.956 2.470 1.00 4.33 H new ATOM 2024 N GLN A 135 7.949 -28.041 2.144 1.00 3.55 N ATOM 2025 CA GLN A 135 7.786 -26.603 2.410 1.00 3.33 C ATOM 2026 C GLN A 135 8.683 -25.772 1.492 1.00 3.69 C ATOM 2027 O GLN A 135 9.445 -26.326 0.692 1.00 4.33 O ATOM 2028 CB GLN A 135 8.130 -26.285 3.864 1.00 3.82 C ATOM 2029 CG GLN A 135 7.443 -27.172 4.901 1.00 4.41 C ATOM 2030 CD GLN A 135 7.837 -26.821 6.323 1.00 5.26 C ATOM 2031 OE1 GLN A 135 7.094 -25.909 6.938 1.00 5.74 O flip ATOM 2032 NE2 GLN A 135 8.800 -27.365 6.864 1.00 5.78 N flip ATOM 0 H GLN A 135 8.922 -28.343 2.086 1.00 3.55 H new ATOM 0 HA GLN A 135 6.744 -26.348 2.217 1.00 3.33 H new ATOM 0 HB2 GLN A 135 9.209 -26.371 3.993 1.00 3.82 H new ATOM 0 HB3 GLN A 135 7.866 -25.247 4.065 1.00 3.82 H new ATOM 0 HG2 GLN A 135 6.362 -27.079 4.794 1.00 4.41 H new ATOM 0 HG3 GLN A 135 7.694 -28.214 4.705 1.00 4.41 H new ATOM 0 HE21 GLN A 135 9.345 -28.061 6.355 1.00 5.78 H new ATOM 0 HE22 GLN A 135 9.053 -27.119 7.821 1.00 5.78 H new ATOM 2041 N VAL A 136 8.588 -24.436 1.613 1.00 3.59 N ATOM 2042 CA VAL A 136 9.403 -23.531 0.808 1.00 4.23 C ATOM 2043 C VAL A 136 9.813 -22.284 1.590 1.00 4.67 C ATOM 2044 O VAL A 136 9.467 -22.132 2.759 1.00 4.74 O ATOM 2045 CB VAL A 136 8.704 -23.166 -0.541 1.00 4.02 C ATOM 2046 CG1 VAL A 136 7.686 -22.038 -0.400 1.00 3.51 C ATOM 2047 CG2 VAL A 136 9.716 -22.856 -1.646 1.00 5.08 C ATOM 0 H VAL A 136 7.955 -23.967 2.261 1.00 3.59 H new ATOM 0 HA VAL A 136 10.320 -24.065 0.559 1.00 4.23 H new ATOM 0 HB VAL A 136 8.149 -24.057 -0.835 1.00 4.02 H new ATOM 0 HG11 VAL A 136 7.235 -21.831 -1.371 1.00 3.51 H new ATOM 0 HG12 VAL A 136 6.909 -22.335 0.305 1.00 3.51 H new ATOM 0 HG13 VAL A 136 8.185 -21.141 -0.033 1.00 3.51 H new ATOM 0 HG21 VAL A 136 9.186 -22.608 -2.566 1.00 5.08 H new ATOM 0 HG22 VAL A 136 10.336 -22.012 -1.345 1.00 5.08 H new ATOM 0 HG23 VAL A 136 10.348 -23.728 -1.816 1.00 5.08 H new ATOM 2057 N ASN A 137 10.523 -21.397 0.897 1.00 5.28 N ATOM 2058 CA ASN A 137 11.036 -20.157 1.489 1.00 5.95 C ATOM 2059 C ASN A 137 10.366 -18.914 0.889 1.00 5.49 C ATOM 2060 O ASN A 137 9.390 -19.006 0.139 1.00 4.60 O ATOM 2061 CB ASN A 137 12.571 -20.058 1.335 1.00 7.18 C ATOM 2062 CG ASN A 137 13.311 -21.334 1.708 1.00 7.90 C ATOM 2063 OD1 ASN A 137 13.899 -21.434 2.784 1.00 8.11 O ATOM 2064 ND2 ASN A 137 13.284 -22.316 0.815 1.00 8.51 N ATOM 0 H ASN A 137 10.760 -21.514 -0.088 1.00 5.28 H new ATOM 0 HA ASN A 137 10.791 -20.191 2.551 1.00 5.95 H new ATOM 0 HB2 ASN A 137 12.807 -19.801 0.302 1.00 7.18 H new ATOM 0 HB3 ASN A 137 12.937 -19.242 1.958 1.00 7.18 H new ATOM 0 HD21 ASN A 137 13.763 -23.195 1.009 1.00 8.51 H new ATOM 0 HD22 ASN A 137 12.784 -22.191 -0.065 1.00 8.51 H new ATOM 2071 N TYR A 138 10.927 -17.762 1.249 1.00 6.22 N ATOM 2072 CA TYR A 138 10.455 -16.440 0.839 1.00 6.03 C ATOM 2073 C TYR A 138 11.222 -15.916 -0.378 1.00 6.55 C ATOM 2074 O TYR A 138 10.642 -15.301 -1.277 1.00 6.13 O ATOM 2075 CB TYR A 138 10.625 -15.457 2.013 1.00 6.78 C ATOM 2076 CG TYR A 138 11.869 -15.747 2.820 1.00 7.93 C ATOM 2077 CD1 TYR A 138 12.938 -14.870 2.860 1.00 8.62 C ATOM 2078 CD2 TYR A 138 11.980 -16.950 3.493 1.00 8.50 C ATOM 2079 CE1 TYR A 138 14.083 -15.193 3.556 1.00 9.65 C ATOM 2080 CE2 TYR A 138 13.098 -17.280 4.182 1.00 9.54 C ATOM 2081 CZ TYR A 138 14.163 -16.404 4.217 1.00 10.06 C ATOM 2082 OH TYR A 138 15.302 -16.734 4.915 1.00 11.13 O ATOM 0 H TYR A 138 11.748 -17.721 1.853 1.00 6.22 H new ATOM 0 HA TYR A 138 9.405 -16.526 0.561 1.00 6.03 H new ATOM 0 HB2 TYR A 138 10.672 -14.438 1.629 1.00 6.78 H new ATOM 0 HB3 TYR A 138 9.751 -15.513 2.662 1.00 6.78 H new ATOM 0 HD1 TYR A 138 12.875 -13.925 2.342 1.00 8.62 H new ATOM 0 HD2 TYR A 138 11.153 -17.645 3.468 1.00 8.50 H new ATOM 0 HE1 TYR A 138 14.913 -14.503 3.585 1.00 9.65 H new ATOM 0 HE2 TYR A 138 13.156 -18.225 4.702 1.00 9.54 H new ATOM 0 HH TYR A 138 15.192 -17.619 5.321 1.00 11.13 H new ATOM 2092 N GLU A 139 12.538 -16.177 -0.379 1.00 7.59 N ATOM 2093 CA GLU A 139 13.456 -15.732 -1.441 1.00 8.39 C ATOM 2094 C GLU A 139 13.273 -16.511 -2.742 1.00 8.26 C ATOM 2095 O GLU A 139 13.606 -16.016 -3.820 1.00 8.61 O ATOM 2096 CB GLU A 139 14.898 -15.906 -0.975 1.00 9.64 C ATOM 2097 CG GLU A 139 15.325 -14.933 0.116 1.00 10.21 C ATOM 2098 CD GLU A 139 16.763 -15.137 0.549 1.00 11.39 C ATOM 2099 OE1 GLU A 139 17.659 -14.506 -0.050 1.00 11.90 O ATOM 2100 OE2 GLU A 139 16.994 -15.928 1.488 1.00 11.94 O ATOM 0 H GLU A 139 12.999 -16.706 0.361 1.00 7.59 H new ATOM 0 HA GLU A 139 13.227 -14.685 -1.639 1.00 8.39 H new ATOM 0 HB2 GLU A 139 15.029 -16.924 -0.609 1.00 9.64 H new ATOM 0 HB3 GLU A 139 15.561 -15.787 -1.832 1.00 9.64 H new ATOM 0 HG2 GLU A 139 15.199 -13.912 -0.244 1.00 10.21 H new ATOM 0 HG3 GLU A 139 14.670 -15.050 0.979 1.00 10.21 H new ATOM 2107 N GLU A 140 12.780 -17.738 -2.621 1.00 7.94 N ATOM 2108 CA GLU A 140 12.561 -18.603 -3.780 1.00 8.10 C ATOM 2109 C GLU A 140 11.131 -18.523 -4.327 1.00 7.13 C ATOM 2110 O GLU A 140 10.944 -18.529 -5.546 1.00 7.54 O ATOM 2111 CB GLU A 140 12.892 -20.057 -3.425 1.00 8.42 C ATOM 2112 CG GLU A 140 14.383 -20.338 -3.302 1.00 9.47 C ATOM 2113 CD GLU A 140 14.676 -21.784 -2.952 1.00 9.95 C ATOM 2114 OE1 GLU A 140 14.751 -22.100 -1.746 1.00 10.29 O ATOM 2115 OE2 GLU A 140 14.831 -22.600 -3.885 1.00 10.17 O ATOM 0 H GLU A 140 12.523 -18.160 -1.729 1.00 7.94 H new ATOM 0 HA GLU A 140 13.228 -18.244 -4.564 1.00 8.10 H new ATOM 0 HB2 GLU A 140 12.406 -20.310 -2.483 1.00 8.42 H new ATOM 0 HB3 GLU A 140 12.471 -20.712 -4.188 1.00 8.42 H new ATOM 0 HG2 GLU A 140 14.875 -20.089 -4.242 1.00 9.47 H new ATOM 0 HG3 GLU A 140 14.810 -19.689 -2.537 1.00 9.47 H new ATOM 2122 N PHE A 141 10.129 -18.451 -3.435 1.00 5.98 N ATOM 2123 CA PHE A 141 8.730 -18.426 -3.857 1.00 5.06 C ATOM 2124 C PHE A 141 8.174 -17.040 -4.199 1.00 4.76 C ATOM 2125 O PHE A 141 7.812 -16.787 -5.352 1.00 5.06 O ATOM 2126 CB PHE A 141 7.848 -19.131 -2.822 1.00 3.97 C ATOM 2127 CG PHE A 141 6.813 -19.983 -3.467 1.00 3.73 C ATOM 2128 CD1 PHE A 141 5.611 -19.434 -3.855 1.00 3.83 C ATOM 2129 CD2 PHE A 141 7.067 -21.318 -3.726 1.00 4.10 C ATOM 2130 CE1 PHE A 141 4.670 -20.202 -4.497 1.00 4.24 C ATOM 2131 CE2 PHE A 141 6.121 -22.105 -4.356 1.00 4.47 C ATOM 2132 CZ PHE A 141 4.925 -21.533 -4.740 1.00 4.52 C ATOM 0 H PHE A 141 10.266 -18.410 -2.425 1.00 5.98 H new ATOM 0 HA PHE A 141 8.706 -18.970 -4.801 1.00 5.06 H new ATOM 0 HB2 PHE A 141 8.471 -19.745 -2.172 1.00 3.97 H new ATOM 0 HB3 PHE A 141 7.364 -18.387 -2.190 1.00 3.97 H new ATOM 0 HD1 PHE A 141 5.407 -18.393 -3.653 1.00 3.83 H new ATOM 0 HD2 PHE A 141 8.013 -21.749 -3.433 1.00 4.10 H new ATOM 0 HE1 PHE A 141 3.734 -19.763 -4.810 1.00 4.24 H new ATOM 0 HE2 PHE A 141 6.315 -23.151 -4.545 1.00 4.47 H new ATOM 0 HZ PHE A 141 4.180 -22.137 -5.237 1.00 4.52 H new ATOM 2142 N VAL A 142 8.103 -16.164 -3.199 1.00 4.40 N ATOM 2143 CA VAL A 142 7.574 -14.778 -3.368 1.00 4.15 C ATOM 2144 C VAL A 142 8.364 -14.050 -4.432 1.00 5.25 C ATOM 2145 O VAL A 142 7.807 -13.357 -5.284 1.00 5.25 O ATOM 2146 CB VAL A 142 7.640 -13.923 -2.071 1.00 4.09 C ATOM 2147 CG1 VAL A 142 6.521 -12.897 -2.021 1.00 3.37 C ATOM 2148 CG2 VAL A 142 7.607 -14.794 -0.845 1.00 3.96 C ATOM 0 H VAL A 142 8.404 -16.376 -2.248 1.00 4.40 H new ATOM 0 HA VAL A 142 6.527 -14.895 -3.646 1.00 4.15 H new ATOM 0 HB VAL A 142 8.588 -13.386 -2.087 1.00 4.09 H new ATOM 0 HG11 VAL A 142 6.599 -12.318 -1.101 1.00 3.37 H new ATOM 0 HG12 VAL A 142 6.602 -12.229 -2.878 1.00 3.37 H new ATOM 0 HG13 VAL A 142 5.558 -13.407 -2.048 1.00 3.37 H new ATOM 0 HG21 VAL A 142 7.655 -14.169 0.047 1.00 3.96 H new ATOM 0 HG22 VAL A 142 6.683 -15.372 -0.834 1.00 3.96 H new ATOM 0 HG23 VAL A 142 8.460 -15.473 -0.858 1.00 3.96 H new ATOM 2158 N GLN A 143 9.678 -14.208 -4.352 1.00 6.26 N ATOM 2159 CA GLN A 143 10.579 -13.600 -5.335 1.00 7.42 C ATOM 2160 C GLN A 143 10.301 -14.127 -6.742 1.00 7.74 C ATOM 2161 O GLN A 143 10.528 -13.418 -7.727 1.00 8.48 O ATOM 2162 CB GLN A 143 12.048 -13.816 -4.964 1.00 8.47 C ATOM 2163 CG GLN A 143 12.547 -12.918 -3.835 1.00 9.24 C ATOM 2164 CD GLN A 143 12.806 -11.488 -4.281 1.00 10.23 C ATOM 2165 OE1 GLN A 143 13.910 -11.147 -4.706 1.00 10.70 O ATOM 2166 NE2 GLN A 143 11.785 -10.644 -4.184 1.00 10.74 N ATOM 0 H GLN A 143 10.146 -14.747 -3.624 1.00 6.26 H new ATOM 0 HA GLN A 143 10.385 -12.527 -5.326 1.00 7.42 H new ATOM 0 HB2 GLN A 143 12.188 -14.857 -4.674 1.00 8.47 H new ATOM 0 HB3 GLN A 143 12.663 -13.645 -5.848 1.00 8.47 H new ATOM 0 HG2 GLN A 143 11.812 -12.914 -3.030 1.00 9.24 H new ATOM 0 HG3 GLN A 143 13.466 -13.337 -3.425 1.00 9.24 H new ATOM 0 HE21 GLN A 143 10.887 -10.969 -3.826 1.00 10.74 H new ATOM 0 HE22 GLN A 143 11.899 -9.671 -4.467 1.00 10.74 H new ATOM 2175 N MET A 144 9.810 -15.372 -6.827 1.00 7.32 N ATOM 2176 CA MET A 144 9.472 -15.970 -8.112 1.00 7.88 C ATOM 2177 C MET A 144 8.047 -15.661 -8.528 1.00 7.37 C ATOM 2178 O MET A 144 7.601 -16.019 -9.625 1.00 8.01 O ATOM 2179 CB MET A 144 9.739 -17.473 -8.126 1.00 8.04 C ATOM 2180 CG MET A 144 10.434 -17.953 -9.392 1.00 9.33 C ATOM 2181 SD MET A 144 10.029 -19.659 -9.803 1.00 9.76 S ATOM 2182 CE MET A 144 8.509 -19.438 -10.729 1.00 9.64 C ATOM 0 H MET A 144 9.641 -15.976 -6.022 1.00 7.32 H new ATOM 0 HA MET A 144 10.130 -15.513 -8.851 1.00 7.88 H new ATOM 0 HB2 MET A 144 10.352 -17.733 -7.263 1.00 8.04 H new ATOM 0 HB3 MET A 144 8.793 -18.003 -8.017 1.00 8.04 H new ATOM 0 HG2 MET A 144 10.153 -17.307 -10.223 1.00 9.33 H new ATOM 0 HG3 MET A 144 11.513 -17.860 -9.267 1.00 9.33 H new ATOM 0 HE1 MET A 144 7.851 -20.290 -10.557 1.00 9.64 H new ATOM 0 HE2 MET A 144 8.013 -18.524 -10.402 1.00 9.64 H new ATOM 0 HE3 MET A 144 8.738 -19.366 -11.792 1.00 9.64 H new ATOM 2192 N MET A 145 7.362 -14.986 -7.636 1.00 6.37 N ATOM 2193 CA MET A 145 5.988 -14.553 -7.861 1.00 5.88 C ATOM 2194 C MET A 145 6.021 -13.106 -8.346 1.00 6.25 C ATOM 2195 O MET A 145 5.085 -12.618 -8.985 1.00 6.33 O ATOM 2196 CB MET A 145 5.118 -14.745 -6.597 1.00 4.66 C ATOM 2197 CG MET A 145 4.950 -13.502 -5.741 1.00 3.68 C ATOM 2198 SD MET A 145 3.593 -12.450 -6.301 1.00 3.52 S ATOM 2199 CE MET A 145 4.313 -10.817 -6.134 1.00 3.45 C ATOM 0 H MET A 145 7.737 -14.716 -6.726 1.00 6.37 H new ATOM 0 HA MET A 145 5.518 -15.170 -8.627 1.00 5.88 H new ATOM 0 HB2 MET A 145 4.132 -15.094 -6.902 1.00 4.66 H new ATOM 0 HB3 MET A 145 5.560 -15.532 -5.986 1.00 4.66 H new ATOM 0 HG2 MET A 145 4.772 -13.799 -4.707 1.00 3.68 H new ATOM 0 HG3 MET A 145 5.877 -12.929 -5.753 1.00 3.68 H new ATOM 0 HE1 MET A 145 3.542 -10.109 -5.830 1.00 3.45 H new ATOM 0 HE2 MET A 145 5.100 -10.842 -5.381 1.00 3.45 H new ATOM 0 HE3 MET A 145 4.735 -10.506 -7.090 1.00 3.45 H new ATOM 2209 N THR A 146 7.137 -12.447 -8.015 1.00 6.65 N ATOM 2210 CA THR A 146 7.401 -11.077 -8.415 1.00 7.20 C ATOM 2211 C THR A 146 8.165 -11.085 -9.749 1.00 8.45 C ATOM 2212 O THR A 146 8.121 -10.107 -10.502 1.00 8.99 O ATOM 2213 CB THR A 146 8.227 -10.326 -7.338 1.00 7.31 C ATOM 2214 OG1 THR A 146 7.788 -10.708 -6.027 1.00 6.44 O ATOM 2215 CG2 THR A 146 8.095 -8.812 -7.483 1.00 7.72 C ATOM 0 H THR A 146 7.884 -12.861 -7.457 1.00 6.65 H new ATOM 0 HA THR A 146 6.451 -10.556 -8.530 1.00 7.20 H new ATOM 0 HB THR A 146 9.273 -10.599 -7.479 1.00 7.31 H new ATOM 0 HG1 THR A 146 7.990 -11.655 -5.877 1.00 6.44 H new ATOM 0 HG21 THR A 146 8.687 -8.320 -6.712 1.00 7.72 H new ATOM 0 HG22 THR A 146 8.455 -8.508 -8.466 1.00 7.72 H new ATOM 0 HG23 THR A 146 7.049 -8.526 -7.375 1.00 7.72 H new ATOM 2223 N ALA A 147 8.864 -12.208 -10.025 1.00 8.92 N ATOM 2224 CA ALA A 147 9.623 -12.372 -11.263 1.00 10.15 C ATOM 2225 C ALA A 147 8.793 -13.090 -12.330 1.00 10.43 C ATOM 2226 O ALA A 147 8.929 -12.803 -13.523 1.00 11.37 O ATOM 2227 CB ALA A 147 10.909 -13.138 -10.992 1.00 10.68 C ATOM 0 H ALA A 147 8.912 -13.011 -9.398 1.00 8.92 H new ATOM 0 HA ALA A 147 9.872 -11.381 -11.641 1.00 10.15 H new ATOM 0 HB1 ALA A 147 11.466 -13.254 -11.922 1.00 10.68 H new ATOM 0 HB2 ALA A 147 11.515 -12.588 -10.272 1.00 10.68 H new ATOM 0 HB3 ALA A 147 10.669 -14.121 -10.588 1.00 10.68 H new ATOM 2233 N LYS A 148 7.933 -14.025 -11.888 1.00 9.72 N ATOM 2234 CA LYS A 148 7.077 -14.787 -12.785 1.00 10.13 C ATOM 2235 C LYS A 148 5.658 -14.889 -12.227 1.00 9.70 C ATOM 2236 O LYS A 148 5.489 -15.458 -11.126 1.00 9.60 O ATOM 2237 CB LYS A 148 7.651 -16.193 -13.043 1.00 10.60 C ATOM 2238 CG LYS A 148 8.862 -16.219 -13.973 1.00 11.38 C ATOM 2239 CD LYS A 148 10.171 -16.087 -13.205 1.00 11.36 C ATOM 2240 CE LYS A 148 11.369 -16.106 -14.140 1.00 12.34 C ATOM 2241 NZ LYS A 148 12.654 -15.985 -13.398 1.00 12.59 N ATOM 2242 OXT LYS A 148 4.726 -14.397 -12.897 1.00 9.69 O ATOM 0 H LYS A 148 7.820 -14.265 -10.903 1.00 9.72 H new ATOM 0 HA LYS A 148 7.039 -14.255 -13.735 1.00 10.13 H new ATOM 0 HB2 LYS A 148 7.932 -16.638 -12.089 1.00 10.60 H new ATOM 0 HB3 LYS A 148 6.867 -16.820 -13.469 1.00 10.60 H new ATOM 0 HG2 LYS A 148 8.865 -17.151 -14.539 1.00 11.38 H new ATOM 0 HG3 LYS A 148 8.782 -15.407 -14.696 1.00 11.38 H new ATOM 0 HD2 LYS A 148 10.168 -15.158 -12.635 1.00 11.36 H new ATOM 0 HD3 LYS A 148 10.256 -16.902 -12.486 1.00 11.36 H new ATOM 0 HE2 LYS A 148 11.367 -17.033 -14.714 1.00 12.34 H new ATOM 0 HE3 LYS A 148 11.284 -15.288 -14.855 1.00 12.34 H new ATOM 0 HZ1 LYS A 148 13.447 -16.002 -14.071 1.00 12.59 H new ATOM 0 HZ2 LYS A 148 12.667 -15.089 -12.870 1.00 12.59 H new ATOM 0 HZ3 LYS A 148 12.747 -16.779 -12.733 1.00 12.59 H new