USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1272 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 99 MET CE :methyl -173:sc= -1.34 (180deg=-1.98) USER MOD Set 1.2: A 124 MET CE :methyl -142:sc= -0.249 (180deg=0) USER MOD Set 2.1: A 31 SER OG : rot -29:sc= 0.495 USER MOD Set 2.2: A 62 THR OG1 : rot 29:sc= 2.5 USER MOD Set 3.1: A 48 GLN : amide:sc= -22.1! C(o=-40!,f=-27!) USER MOD Set 3.2: A 50 GLN : amide:sc= -18.4! C(o=-40!,f=-27!) USER MOD Set 4.1: A 37 SER OG : rot 180:sc= 0.208 USER MOD Set 4.2: A 38 SER OG : rot 7:sc= 1.93 USER MOD Set 4.3: A 40 TYR OH : rot -62:sc= 0.613 USER MOD Single : A 1 THR N :NH3+ -168:sc= 1.33 (180deg=1.21) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot -122:sc= -2! USER MOD Single : A 9 SER OG : rot -180:sc= -0.229! USER MOD Single : A 10 ASN : amide:sc= -8! C(o=-8!,f=-9.9!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -5.32! C(o=-5.3!,f=-10!) USER MOD Single : A 19 ASN : amide:sc= -1.41! K(o=-1.4!,f=-0.15) USER MOD Single : A 23 LYS NZ :NH3+ 167:sc= -0.0301 (180deg=-0.242) USER MOD Single : A 32 HIS : no HD1:sc= -0.115 X(o=-0.12,f=0) USER MOD Single : A 35 THR OG1 : rot 150:sc= -0.3 USER MOD Single : A 42 THR OG1 : rot -150:sc=-0.00365 USER MOD Single : A 53 TYR OH : rot 180:sc= -0.0211 USER MOD Single : A 55 ASN : amide:sc= -4.65! C(o=-4.6!,f=-6.1!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.456 K(o=-0.46,f=-2.3) USER MOD Single : A 72 HIS : no HD1:sc= -3! C(o=-3!,f=-6.2!) USER MOD Single : A 73 THR OG1 : rot -20:sc= 0.984 USER MOD Single : A 74 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.49) USER MOD Single : A 79 GLN : amide:sc= -4.43! K(o=-4.4!,f=-0.66) USER MOD Single : A 80 GLN : amide:sc= -5.76! C(o=-5.8!,f=-3.9!) USER MOD Single : A 85 LYS NZ :NH3+ 156:sc= -4.3! (180deg=-6.18!) USER MOD Single : A 93 THR OG1 : rot -148:sc= -3.05! USER MOD Single : A 103 ASN : amide:sc= -0.0232 X(o=-0.023,f=-0.24) USER MOD Single : A 107 ASN : amide:sc= -0.0662 K(o=-0.066,f=-1.1) USER MOD Single : A 108 THR OG1 : rot -61:sc= -6.34! USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 HIS : no HD1:sc= -0.649 K(o=-0.65,f=-3.5) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 MET CE :methyl 152:sc= -3.59! (180deg=-4.47!) USER MOD Single : A 119 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.102) USER MOD Single : A 120 ASN : amide:sc= -0.48 X(o=-0.48,f=-0.019) USER MOD Single : A 142 MET CE :methyl -143:sc= -0.14 (180deg=-0.816) USER MOD Single : A 145 GLN : amide:sc= -8.88! K(o=-8.9!,f=-4.4) USER MOD Single : A 148 HIS : no HD1:sc= -1.21 K(o=-1.2,f=-3!) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.00225) USER MOD Single : A 156 ASN : amide:sc= -1.03 K(o=-1,f=-2.8!) USER MOD Single : A 157 LYS NZ :NH3+ -169:sc= -0.0454 (180deg=-0.221) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 2.398 -13.218 -9.597 1.00 0.73 N ATOM 2 CA THR A 1 1.347 -12.870 -8.606 1.00 0.53 C ATOM 3 C THR A 1 1.272 -11.363 -8.389 1.00 0.47 C ATOM 4 O THR A 1 2.257 -10.728 -8.009 1.00 0.70 O ATOM 5 CB THR A 1 1.666 -13.579 -7.289 1.00 0.54 C ATOM 6 OG1 THR A 1 1.744 -14.981 -7.479 1.00 0.58 O ATOM 7 CG2 THR A 1 0.639 -13.321 -6.207 1.00 0.81 C ATOM 0 H1 THR A 1 2.294 -14.214 -9.878 1.00 0.73 H new ATOM 0 H2 THR A 1 2.300 -12.610 -10.435 1.00 0.73 H new ATOM 0 H3 THR A 1 3.337 -13.074 -9.173 1.00 0.73 H new ATOM 0 HA THR A 1 0.377 -13.195 -8.983 1.00 0.53 H new ATOM 0 HB THR A 1 2.623 -13.170 -6.966 1.00 0.54 H new ATOM 0 HG1 THR A 1 1.951 -15.416 -6.625 1.00 0.58 H new ATOM 0 HG21 THR A 1 0.925 -13.853 -5.300 1.00 0.81 H new ATOM 0 HG22 THR A 1 0.589 -12.252 -6.001 1.00 0.81 H new ATOM 0 HG23 THR A 1 -0.337 -13.672 -6.541 1.00 0.81 H new ATOM 17 N VAL A 2 0.096 -10.796 -8.630 1.00 0.44 N ATOM 18 CA VAL A 2 -0.117 -9.364 -8.462 1.00 0.42 C ATOM 19 C VAL A 2 -0.018 -8.962 -6.990 1.00 0.38 C ATOM 20 O VAL A 2 -0.415 -9.720 -6.105 1.00 0.43 O ATOM 21 CB VAL A 2 -1.484 -8.942 -9.030 1.00 0.51 C ATOM 22 CG1 VAL A 2 -2.605 -9.718 -8.362 1.00 1.29 C ATOM 23 CG2 VAL A 2 -1.691 -7.446 -8.876 1.00 0.85 C ATOM 0 H VAL A 2 -0.728 -11.309 -8.944 1.00 0.44 H new ATOM 0 HA VAL A 2 0.667 -8.848 -9.016 1.00 0.42 H new ATOM 0 HB VAL A 2 -1.500 -9.176 -10.094 1.00 0.51 H new ATOM 0 HG11 VAL A 2 -3.563 -9.405 -8.778 1.00 1.29 H new ATOM 0 HG12 VAL A 2 -2.465 -10.784 -8.538 1.00 1.29 H new ATOM 0 HG13 VAL A 2 -2.594 -9.523 -7.290 1.00 1.29 H new ATOM 0 HG21 VAL A 2 -2.663 -7.169 -9.284 1.00 0.85 H new ATOM 0 HG22 VAL A 2 -1.652 -7.180 -7.820 1.00 0.85 H new ATOM 0 HG23 VAL A 2 -0.907 -6.913 -9.414 1.00 0.85 H new ATOM 33 N ALA A 3 0.530 -7.774 -6.732 1.00 0.38 N ATOM 34 CA ALA A 3 0.699 -7.287 -5.366 1.00 0.40 C ATOM 35 C ALA A 3 -0.134 -6.035 -5.092 1.00 0.40 C ATOM 36 O ALA A 3 -0.082 -5.060 -5.839 1.00 0.65 O ATOM 37 CB ALA A 3 2.168 -7.013 -5.088 1.00 0.43 C ATOM 0 H ALA A 3 0.864 -7.133 -7.452 1.00 0.38 H new ATOM 0 HA ALA A 3 0.341 -8.067 -4.694 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.284 -6.650 -4.067 1.00 0.43 H new ATOM 0 HB2 ALA A 3 2.740 -7.933 -5.213 1.00 0.43 H new ATOM 0 HB3 ALA A 3 2.536 -6.259 -5.784 1.00 0.43 H new ATOM 43 N TYR A 4 -0.892 -6.078 -4.001 1.00 0.25 N ATOM 44 CA TYR A 4 -1.743 -4.963 -3.584 1.00 0.24 C ATOM 45 C TYR A 4 -1.073 -4.198 -2.448 1.00 0.27 C ATOM 46 O TYR A 4 -1.306 -4.482 -1.274 1.00 0.35 O ATOM 47 CB TYR A 4 -3.100 -5.495 -3.125 1.00 0.25 C ATOM 48 CG TYR A 4 -3.884 -6.237 -4.195 1.00 0.27 C ATOM 49 CD1 TYR A 4 -3.278 -6.600 -5.389 1.00 0.55 C ATOM 50 CD2 TYR A 4 -5.221 -6.576 -4.014 1.00 0.62 C ATOM 51 CE1 TYR A 4 -3.979 -7.273 -6.369 1.00 0.61 C ATOM 52 CE2 TYR A 4 -5.926 -7.250 -4.987 1.00 0.66 C ATOM 53 CZ TYR A 4 -5.335 -7.589 -6.143 1.00 0.45 C ATOM 54 OH TYR A 4 -6.006 -8.270 -7.134 1.00 0.55 O ATOM 0 H TYR A 4 -0.935 -6.886 -3.379 1.00 0.25 H new ATOM 0 HA TYR A 4 -1.890 -4.288 -4.427 1.00 0.24 H new ATOM 0 HB2 TYR A 4 -2.946 -6.163 -2.277 1.00 0.25 H new ATOM 0 HB3 TYR A 4 -3.701 -4.659 -2.767 1.00 0.25 H new ATOM 0 HD1 TYR A 4 -2.240 -6.352 -5.554 1.00 0.55 H new ATOM 0 HD2 TYR A 4 -5.716 -6.306 -3.093 1.00 0.62 H new ATOM 0 HE1 TYR A 4 -3.497 -7.553 -7.294 1.00 0.61 H new ATOM 0 HE2 TYR A 4 -6.961 -7.507 -4.818 1.00 0.66 H new ATOM 0 HH TYR A 4 -6.781 -7.745 -7.424 1.00 0.55 H new ATOM 64 N ILE A 5 -0.213 -3.251 -2.806 1.00 0.28 N ATOM 65 CA ILE A 5 0.520 -2.470 -1.817 1.00 0.34 C ATOM 66 C ILE A 5 -0.121 -1.111 -1.564 1.00 0.34 C ATOM 67 O ILE A 5 -0.688 -0.501 -2.469 1.00 0.39 O ATOM 68 CB ILE A 5 1.977 -2.250 -2.268 1.00 0.41 C ATOM 69 CG1 ILE A 5 2.583 -3.568 -2.750 1.00 0.44 C ATOM 70 CG2 ILE A 5 2.800 -1.660 -1.133 1.00 0.53 C ATOM 71 CD1 ILE A 5 4.006 -3.441 -3.252 1.00 0.95 C ATOM 0 H ILE A 5 -0.006 -3.006 -3.774 1.00 0.28 H new ATOM 0 HA ILE A 5 0.495 -3.044 -0.891 1.00 0.34 H new ATOM 0 HB ILE A 5 1.986 -1.543 -3.097 1.00 0.41 H new ATOM 0 HG12 ILE A 5 2.559 -4.288 -1.932 1.00 0.44 H new ATOM 0 HG13 ILE A 5 1.961 -3.972 -3.549 1.00 0.44 H new ATOM 0 HG21 ILE A 5 3.827 -1.511 -1.467 1.00 0.53 H new ATOM 0 HG22 ILE A 5 2.373 -0.703 -0.833 1.00 0.53 H new ATOM 0 HG23 ILE A 5 2.791 -2.343 -0.284 1.00 0.53 H new ATOM 0 HD11 ILE A 5 4.366 -4.417 -3.576 1.00 0.95 H new ATOM 0 HD12 ILE A 5 4.035 -2.747 -4.092 1.00 0.95 H new ATOM 0 HD13 ILE A 5 4.643 -3.067 -2.450 1.00 0.95 H new ATOM 83 N ALA A 6 -0.005 -0.637 -0.327 1.00 0.40 N ATOM 84 CA ALA A 6 -0.547 0.659 0.056 1.00 0.44 C ATOM 85 C ALA A 6 0.589 1.650 0.283 1.00 0.42 C ATOM 86 O ALA A 6 1.290 1.584 1.293 1.00 0.58 O ATOM 87 CB ALA A 6 -1.401 0.530 1.308 1.00 0.53 C ATOM 0 H ALA A 6 0.463 -1.136 0.430 1.00 0.40 H new ATOM 0 HA ALA A 6 -1.180 1.029 -0.751 1.00 0.44 H new ATOM 0 HB1 ALA A 6 -1.798 1.508 1.580 1.00 0.53 H new ATOM 0 HB2 ALA A 6 -2.226 -0.156 1.117 1.00 0.53 H new ATOM 0 HB3 ALA A 6 -0.792 0.145 2.126 1.00 0.53 H new ATOM 93 N ILE A 7 0.779 2.554 -0.673 1.00 0.41 N ATOM 94 CA ILE A 7 1.847 3.543 -0.588 1.00 0.40 C ATOM 95 C ILE A 7 1.337 4.879 -0.066 1.00 0.44 C ATOM 96 O ILE A 7 0.334 5.402 -0.553 1.00 0.52 O ATOM 97 CB ILE A 7 2.504 3.767 -1.964 1.00 0.50 C ATOM 98 CG1 ILE A 7 2.933 2.429 -2.572 1.00 0.65 C ATOM 99 CG2 ILE A 7 3.695 4.706 -1.832 1.00 0.53 C ATOM 100 CD1 ILE A 7 3.491 2.546 -3.974 1.00 0.99 C ATOM 0 H ILE A 7 0.207 2.622 -1.515 1.00 0.41 H new ATOM 0 HA ILE A 7 2.584 3.147 0.111 1.00 0.40 H new ATOM 0 HB ILE A 7 1.775 4.228 -2.631 1.00 0.50 H new ATOM 0 HG12 ILE A 7 3.685 1.973 -1.929 1.00 0.65 H new ATOM 0 HG13 ILE A 7 2.076 1.756 -2.587 1.00 0.65 H new ATOM 0 HG21 ILE A 7 4.150 4.856 -2.811 1.00 0.53 H new ATOM 0 HG22 ILE A 7 3.360 5.665 -1.437 1.00 0.53 H new ATOM 0 HG23 ILE A 7 4.429 4.270 -1.154 1.00 0.53 H new ATOM 0 HD11 ILE A 7 3.773 1.558 -4.337 1.00 0.99 H new ATOM 0 HD12 ILE A 7 2.734 2.972 -4.632 1.00 0.99 H new ATOM 0 HD13 ILE A 7 4.369 3.192 -3.964 1.00 0.99 H new ATOM 112 N GLY A 8 2.044 5.442 0.912 1.00 0.50 N ATOM 113 CA GLY A 8 1.656 6.724 1.462 1.00 0.61 C ATOM 114 C GLY A 8 2.731 7.764 1.256 1.00 0.62 C ATOM 115 O GLY A 8 3.871 7.430 0.930 1.00 0.90 O ATOM 0 H GLY A 8 2.878 5.031 1.331 1.00 0.50 H new ATOM 0 HA2 GLY A 8 0.731 7.058 0.992 1.00 0.61 H new ATOM 0 HA3 GLY A 8 1.451 6.617 2.527 1.00 0.61 H new ATOM 119 N SER A 9 2.374 9.023 1.440 1.00 0.56 N ATOM 120 CA SER A 9 3.322 10.111 1.263 1.00 0.63 C ATOM 121 C SER A 9 2.905 11.316 2.085 1.00 0.66 C ATOM 122 O SER A 9 1.865 11.922 1.831 1.00 0.77 O ATOM 123 CB SER A 9 3.415 10.474 -0.210 1.00 0.77 C ATOM 124 OG SER A 9 2.152 10.865 -0.721 1.00 1.58 O ATOM 0 H SER A 9 1.436 9.318 1.712 1.00 0.56 H new ATOM 0 HA SER A 9 4.304 9.788 1.610 1.00 0.63 H new ATOM 0 HB2 SER A 9 4.131 11.285 -0.343 1.00 0.77 H new ATOM 0 HB3 SER A 9 3.791 9.621 -0.775 1.00 0.77 H new ATOM 0 HG SER A 9 2.239 11.092 -1.670 1.00 1.58 H new ATOM 130 N ASN A 10 3.708 11.649 3.091 1.00 0.69 N ATOM 131 CA ASN A 10 3.385 12.770 3.954 1.00 0.79 C ATOM 132 C ASN A 10 4.523 13.786 4.051 1.00 0.83 C ATOM 133 O ASN A 10 4.474 14.849 3.432 1.00 0.98 O ATOM 134 CB ASN A 10 3.024 12.273 5.358 1.00 0.99 C ATOM 135 CG ASN A 10 1.959 11.188 5.361 1.00 1.05 C ATOM 136 OD1 ASN A 10 1.983 10.271 4.539 1.00 2.01 O ATOM 137 ND2 ASN A 10 1.038 11.267 6.320 1.00 1.01 N ATOM 0 H ASN A 10 4.575 11.164 3.323 1.00 0.69 H new ATOM 0 HA ASN A 10 2.530 13.275 3.504 1.00 0.79 H new ATOM 0 HB2 ASN A 10 3.923 11.890 5.842 1.00 0.99 H new ATOM 0 HB3 ASN A 10 2.675 13.116 5.955 1.00 0.99 H new ATOM 0 HD21 ASN A 10 0.316 10.550 6.394 1.00 1.01 H new ATOM 0 HD22 ASN A 10 1.055 12.044 6.981 1.00 1.01 H new ATOM 144 N LEU A 11 5.530 13.467 4.859 1.00 0.83 N ATOM 145 CA LEU A 11 6.662 14.367 5.073 1.00 0.95 C ATOM 146 C LEU A 11 7.844 14.051 4.160 1.00 0.93 C ATOM 147 O LEU A 11 8.867 13.539 4.615 1.00 1.38 O ATOM 148 CB LEU A 11 7.105 14.305 6.539 1.00 1.12 C ATOM 149 CG LEU A 11 6.086 14.842 7.546 1.00 0.90 C ATOM 150 CD1 LEU A 11 6.577 14.627 8.969 1.00 1.77 C ATOM 151 CD2 LEU A 11 5.814 16.319 7.296 1.00 1.54 C ATOM 0 H LEU A 11 5.586 12.591 5.378 1.00 0.83 H new ATOM 0 HA LEU A 11 6.325 15.374 4.826 1.00 0.95 H new ATOM 0 HB2 LEU A 11 7.331 13.269 6.791 1.00 1.12 H new ATOM 0 HB3 LEU A 11 8.032 14.869 6.647 1.00 1.12 H new ATOM 0 HG LEU A 11 5.154 14.292 7.416 1.00 0.90 H new ATOM 0 HD11 LEU A 11 5.839 15.015 9.671 1.00 1.77 H new ATOM 0 HD12 LEU A 11 6.722 13.561 9.147 1.00 1.77 H new ATOM 0 HD13 LEU A 11 7.523 15.150 9.110 1.00 1.77 H new ATOM 0 HD21 LEU A 11 5.087 16.683 8.022 1.00 1.54 H new ATOM 0 HD22 LEU A 11 6.742 16.882 7.398 1.00 1.54 H new ATOM 0 HD23 LEU A 11 5.418 16.451 6.289 1.00 1.54 H new ATOM 163 N ALA A 12 7.701 14.382 2.873 1.00 0.84 N ATOM 164 CA ALA A 12 8.756 14.157 1.881 1.00 0.91 C ATOM 165 C ALA A 12 8.224 14.374 0.469 1.00 0.95 C ATOM 166 O ALA A 12 8.517 13.595 -0.438 1.00 1.72 O ATOM 167 CB ALA A 12 9.329 12.751 2.005 1.00 0.97 C ATOM 0 H ALA A 12 6.857 14.810 2.492 1.00 0.84 H new ATOM 0 HA ALA A 12 9.551 14.877 2.074 1.00 0.91 H new ATOM 0 HB1 ALA A 12 10.110 12.609 1.258 1.00 0.97 H new ATOM 0 HB2 ALA A 12 9.751 12.617 3.001 1.00 0.97 H new ATOM 0 HB3 ALA A 12 8.537 12.020 1.845 1.00 0.97 H new ATOM 173 N SER A 13 7.426 15.426 0.292 1.00 0.81 N ATOM 174 CA SER A 13 6.831 15.727 -1.007 1.00 0.79 C ATOM 175 C SER A 13 5.824 14.636 -1.366 1.00 0.71 C ATOM 176 O SER A 13 6.122 13.736 -2.153 1.00 0.71 O ATOM 177 CB SER A 13 7.906 15.843 -2.093 1.00 0.89 C ATOM 178 OG SER A 13 8.831 16.873 -1.786 1.00 1.47 O ATOM 0 H SER A 13 7.177 16.083 1.032 1.00 0.81 H new ATOM 0 HA SER A 13 6.320 16.688 -0.946 1.00 0.79 H new ATOM 0 HB2 SER A 13 8.433 14.894 -2.191 1.00 0.89 H new ATOM 0 HB3 SER A 13 7.435 16.047 -3.055 1.00 0.89 H new ATOM 0 HG SER A 13 9.508 16.926 -2.493 1.00 1.47 H new ATOM 184 N PRO A 14 4.625 14.692 -0.760 1.00 0.69 N ATOM 185 CA PRO A 14 3.565 13.699 -0.978 1.00 0.66 C ATOM 186 C PRO A 14 3.322 13.365 -2.451 1.00 0.67 C ATOM 187 O PRO A 14 2.808 12.295 -2.772 1.00 0.66 O ATOM 188 CB PRO A 14 2.332 14.371 -0.377 1.00 0.68 C ATOM 189 CG PRO A 14 2.871 15.245 0.700 1.00 0.80 C ATOM 190 CD PRO A 14 4.212 15.725 0.214 1.00 0.78 C ATOM 0 HA PRO A 14 3.826 12.741 -0.529 1.00 0.66 H new ATOM 0 HB2 PRO A 14 1.792 14.951 -1.125 1.00 0.68 H new ATOM 0 HB3 PRO A 14 1.634 13.635 0.021 1.00 0.68 H new ATOM 0 HG2 PRO A 14 2.203 16.084 0.892 1.00 0.80 H new ATOM 0 HG3 PRO A 14 2.969 14.695 1.636 1.00 0.80 H new ATOM 0 HD2 PRO A 14 4.140 16.708 -0.252 1.00 0.78 H new ATOM 0 HD3 PRO A 14 4.927 15.811 1.033 1.00 0.78 H new ATOM 198 N LEU A 15 3.672 14.284 -3.343 1.00 0.73 N ATOM 199 CA LEU A 15 3.464 14.074 -4.772 1.00 0.78 C ATOM 200 C LEU A 15 4.619 13.301 -5.414 1.00 0.73 C ATOM 201 O LEU A 15 4.410 12.525 -6.347 1.00 0.79 O ATOM 202 CB LEU A 15 3.285 15.420 -5.480 1.00 0.92 C ATOM 203 CG LEU A 15 2.969 15.333 -6.974 1.00 0.98 C ATOM 204 CD1 LEU A 15 1.662 14.587 -7.202 1.00 1.00 C ATOM 205 CD2 LEU A 15 2.903 16.724 -7.584 1.00 1.15 C ATOM 0 H LEU A 15 4.100 15.179 -3.104 1.00 0.73 H new ATOM 0 HA LEU A 15 2.561 13.474 -4.885 1.00 0.78 H new ATOM 0 HB2 LEU A 15 2.482 15.968 -4.987 1.00 0.92 H new ATOM 0 HB3 LEU A 15 4.196 16.004 -5.351 1.00 0.92 H new ATOM 0 HG LEU A 15 3.769 14.779 -7.464 1.00 0.98 H new ATOM 0 HD11 LEU A 15 1.454 14.535 -8.271 1.00 1.00 H new ATOM 0 HD12 LEU A 15 1.744 13.578 -6.799 1.00 1.00 H new ATOM 0 HD13 LEU A 15 0.850 15.113 -6.700 1.00 1.00 H new ATOM 0 HD21 LEU A 15 2.677 16.645 -8.647 1.00 1.15 H new ATOM 0 HD22 LEU A 15 2.122 17.301 -7.089 1.00 1.15 H new ATOM 0 HD23 LEU A 15 3.862 17.225 -7.453 1.00 1.15 H new ATOM 217 N GLU A 16 5.833 13.529 -4.927 1.00 0.71 N ATOM 218 CA GLU A 16 7.017 12.872 -5.469 1.00 0.71 C ATOM 219 C GLU A 16 7.230 11.476 -4.889 1.00 0.63 C ATOM 220 O GLU A 16 7.756 10.591 -5.563 1.00 0.65 O ATOM 221 CB GLU A 16 8.239 13.739 -5.198 1.00 0.81 C ATOM 222 CG GLU A 16 8.275 15.013 -6.027 1.00 0.95 C ATOM 223 CD GLU A 16 8.535 14.748 -7.499 1.00 1.57 C ATOM 224 OE1 GLU A 16 7.705 14.061 -8.131 1.00 2.35 O ATOM 225 OE2 GLU A 16 9.564 15.227 -8.018 1.00 2.01 O ATOM 0 H GLU A 16 6.024 14.167 -4.154 1.00 0.71 H new ATOM 0 HA GLU A 16 6.867 12.750 -6.542 1.00 0.71 H new ATOM 0 HB2 GLU A 16 8.260 14.002 -4.141 1.00 0.81 H new ATOM 0 HB3 GLU A 16 9.139 13.158 -5.400 1.00 0.81 H new ATOM 0 HG2 GLU A 16 7.326 15.539 -5.919 1.00 0.95 H new ATOM 0 HG3 GLU A 16 9.051 15.673 -5.638 1.00 0.95 H new ATOM 232 N GLN A 17 6.839 11.289 -3.636 1.00 0.59 N ATOM 233 CA GLN A 17 7.008 10.005 -2.963 1.00 0.56 C ATOM 234 C GLN A 17 6.323 8.866 -3.710 1.00 0.55 C ATOM 235 O GLN A 17 6.805 7.734 -3.703 1.00 0.61 O ATOM 236 CB GLN A 17 6.460 10.080 -1.544 1.00 0.62 C ATOM 237 CG GLN A 17 7.185 11.085 -0.673 1.00 0.71 C ATOM 238 CD GLN A 17 6.656 11.111 0.741 1.00 1.20 C ATOM 239 OE1 GLN A 17 6.718 10.114 1.456 1.00 1.99 O ATOM 240 NE2 GLN A 17 6.126 12.254 1.153 1.00 1.63 N ATOM 0 H GLN A 17 6.402 12.010 -3.063 1.00 0.59 H new ATOM 0 HA GLN A 17 8.077 9.795 -2.941 1.00 0.56 H new ATOM 0 HB2 GLN A 17 5.402 10.341 -1.584 1.00 0.62 H new ATOM 0 HB3 GLN A 17 6.528 9.095 -1.083 1.00 0.62 H new ATOM 0 HG2 GLN A 17 8.248 10.846 -0.656 1.00 0.71 H new ATOM 0 HG3 GLN A 17 7.089 12.078 -1.112 1.00 0.71 H new ATOM 0 HE21 GLN A 17 6.095 13.057 0.525 1.00 1.63 H new ATOM 0 HE22 GLN A 17 5.749 12.330 2.098 1.00 1.63 H new ATOM 249 N VAL A 18 5.186 9.160 -4.331 1.00 0.56 N ATOM 250 CA VAL A 18 4.430 8.142 -5.050 1.00 0.62 C ATOM 251 C VAL A 18 4.983 7.878 -6.451 1.00 0.60 C ATOM 252 O VAL A 18 4.856 6.768 -6.966 1.00 0.64 O ATOM 253 CB VAL A 18 2.935 8.514 -5.134 1.00 0.76 C ATOM 254 CG1 VAL A 18 2.164 7.488 -5.955 1.00 0.82 C ATOM 255 CG2 VAL A 18 2.352 8.627 -3.737 1.00 0.83 C ATOM 0 H VAL A 18 4.769 10.091 -4.351 1.00 0.56 H new ATOM 0 HA VAL A 18 4.537 7.221 -4.477 1.00 0.62 H new ATOM 0 HB VAL A 18 2.845 9.478 -5.634 1.00 0.76 H new ATOM 0 HG11 VAL A 18 1.113 7.773 -5.999 1.00 0.82 H new ATOM 0 HG12 VAL A 18 2.572 7.449 -6.965 1.00 0.82 H new ATOM 0 HG13 VAL A 18 2.255 6.507 -5.489 1.00 0.82 H new ATOM 0 HG21 VAL A 18 1.296 8.890 -3.803 1.00 0.83 H new ATOM 0 HG22 VAL A 18 2.457 7.673 -3.221 1.00 0.83 H new ATOM 0 HG23 VAL A 18 2.884 9.400 -3.182 1.00 0.83 H new ATOM 265 N ASN A 19 5.598 8.883 -7.071 1.00 0.60 N ATOM 266 CA ASN A 19 6.153 8.705 -8.411 1.00 0.64 C ATOM 267 C ASN A 19 7.255 7.649 -8.420 1.00 0.56 C ATOM 268 O ASN A 19 7.288 6.786 -9.296 1.00 0.63 O ATOM 269 CB ASN A 19 6.685 10.026 -8.968 1.00 0.72 C ATOM 270 CG ASN A 19 5.575 11.008 -9.286 1.00 0.82 C ATOM 271 OD1 ASN A 19 4.624 10.680 -9.997 1.00 0.92 O ATOM 272 ND2 ASN A 19 5.699 12.227 -8.777 1.00 0.84 N ATOM 0 H ASN A 19 5.724 9.815 -6.675 1.00 0.60 H new ATOM 0 HA ASN A 19 5.343 8.360 -9.053 1.00 0.64 H new ATOM 0 HB2 ASN A 19 7.366 10.474 -8.245 1.00 0.72 H new ATOM 0 HB3 ASN A 19 7.263 9.830 -9.871 1.00 0.72 H new ATOM 0 HD21 ASN A 19 4.990 12.935 -8.970 1.00 0.84 H new ATOM 0 HD22 ASN A 19 6.503 12.456 -8.193 1.00 0.84 H new ATOM 279 N ALA A 20 8.156 7.719 -7.443 1.00 0.47 N ATOM 280 CA ALA A 20 9.256 6.762 -7.351 1.00 0.42 C ATOM 281 C ALA A 20 8.805 5.471 -6.678 1.00 0.35 C ATOM 282 O ALA A 20 9.443 4.429 -6.827 1.00 0.36 O ATOM 283 CB ALA A 20 10.429 7.371 -6.599 1.00 0.43 C ATOM 0 H ALA A 20 8.147 8.425 -6.707 1.00 0.47 H new ATOM 0 HA ALA A 20 9.578 6.520 -8.364 1.00 0.42 H new ATOM 0 HB1 ALA A 20 11.240 6.645 -6.540 1.00 0.43 H new ATOM 0 HB2 ALA A 20 10.776 8.260 -7.125 1.00 0.43 H new ATOM 0 HB3 ALA A 20 10.113 7.645 -5.592 1.00 0.43 H new ATOM 289 N ALA A 21 7.701 5.542 -5.943 1.00 0.36 N ATOM 290 CA ALA A 21 7.166 4.375 -5.254 1.00 0.39 C ATOM 291 C ALA A 21 6.626 3.355 -6.252 1.00 0.41 C ATOM 292 O ALA A 21 6.888 2.159 -6.132 1.00 0.44 O ATOM 293 CB ALA A 21 6.074 4.797 -4.284 1.00 0.46 C ATOM 0 H ALA A 21 7.159 6.396 -5.809 1.00 0.36 H new ATOM 0 HA ALA A 21 7.974 3.905 -4.694 1.00 0.39 H new ATOM 0 HB1 ALA A 21 5.681 3.918 -3.774 1.00 0.46 H new ATOM 0 HB2 ALA A 21 6.487 5.488 -3.549 1.00 0.46 H new ATOM 0 HB3 ALA A 21 5.270 5.288 -4.832 1.00 0.46 H new ATOM 299 N LEU A 22 5.873 3.840 -7.235 1.00 0.47 N ATOM 300 CA LEU A 22 5.294 2.974 -8.258 1.00 0.53 C ATOM 301 C LEU A 22 6.287 2.710 -9.388 1.00 0.50 C ATOM 302 O LEU A 22 6.119 1.770 -10.166 1.00 0.64 O ATOM 303 CB LEU A 22 4.002 3.596 -8.808 1.00 0.70 C ATOM 304 CG LEU A 22 4.130 5.029 -9.347 1.00 0.81 C ATOM 305 CD1 LEU A 22 4.846 5.048 -10.689 1.00 1.28 C ATOM 306 CD2 LEU A 22 2.759 5.676 -9.467 1.00 1.35 C ATOM 0 H LEU A 22 5.649 4.829 -7.345 1.00 0.47 H new ATOM 0 HA LEU A 22 5.055 2.016 -7.797 1.00 0.53 H new ATOM 0 HB2 LEU A 22 3.626 2.959 -9.608 1.00 0.70 H new ATOM 0 HB3 LEU A 22 3.252 3.591 -8.017 1.00 0.70 H new ATOM 0 HG LEU A 22 4.727 5.603 -8.639 1.00 0.81 H new ATOM 0 HD11 LEU A 22 4.922 6.075 -11.046 1.00 1.28 H new ATOM 0 HD12 LEU A 22 5.846 4.629 -10.574 1.00 1.28 H new ATOM 0 HD13 LEU A 22 4.284 4.454 -11.410 1.00 1.28 H new ATOM 0 HD21 LEU A 22 2.868 6.691 -9.850 1.00 1.35 H new ATOM 0 HD22 LEU A 22 2.141 5.094 -10.151 1.00 1.35 H new ATOM 0 HD23 LEU A 22 2.284 5.708 -8.486 1.00 1.35 H new ATOM 318 N LYS A 23 7.314 3.546 -9.481 1.00 0.45 N ATOM 319 CA LYS A 23 8.325 3.400 -10.525 1.00 0.49 C ATOM 320 C LYS A 23 9.413 2.418 -10.103 1.00 0.43 C ATOM 321 O LYS A 23 9.957 1.687 -10.931 1.00 0.51 O ATOM 322 CB LYS A 23 8.947 4.757 -10.854 1.00 0.56 C ATOM 323 CG LYS A 23 9.994 4.704 -11.957 1.00 0.93 C ATOM 324 CD LYS A 23 9.403 4.210 -13.270 1.00 1.62 C ATOM 325 CE LYS A 23 10.448 4.170 -14.373 1.00 2.52 C ATOM 326 NZ LYS A 23 11.581 3.265 -14.031 1.00 3.23 N ATOM 0 H LYS A 23 7.470 4.331 -8.848 1.00 0.45 H new ATOM 0 HA LYS A 23 7.834 3.006 -11.415 1.00 0.49 H new ATOM 0 HB2 LYS A 23 8.156 5.446 -11.150 1.00 0.56 H new ATOM 0 HB3 LYS A 23 9.404 5.165 -9.952 1.00 0.56 H new ATOM 0 HG2 LYS A 23 10.422 5.696 -12.101 1.00 0.93 H new ATOM 0 HG3 LYS A 23 10.809 4.046 -11.654 1.00 0.93 H new ATOM 0 HD2 LYS A 23 8.983 3.214 -13.129 1.00 1.62 H new ATOM 0 HD3 LYS A 23 8.582 4.862 -13.569 1.00 1.62 H new ATOM 0 HE2 LYS A 23 9.984 3.836 -15.301 1.00 2.52 H new ATOM 0 HE3 LYS A 23 10.828 5.176 -14.550 1.00 2.52 H new ATOM 0 HZ1 LYS A 23 12.155 3.091 -14.881 1.00 3.23 H new ATOM 0 HZ2 LYS A 23 12.171 3.709 -13.299 1.00 3.23 H new ATOM 0 HZ3 LYS A 23 11.208 2.362 -13.674 1.00 3.23 H new ATOM 340 N ALA A 24 9.729 2.412 -8.813 1.00 0.37 N ATOM 341 CA ALA A 24 10.756 1.523 -8.282 1.00 0.41 C ATOM 342 C ALA A 24 10.313 0.065 -8.343 1.00 0.41 C ATOM 343 O ALA A 24 11.144 -0.842 -8.382 1.00 0.43 O ATOM 344 CB ALA A 24 11.106 1.911 -6.854 1.00 0.46 C ATOM 0 H ALA A 24 9.289 3.012 -8.116 1.00 0.37 H new ATOM 0 HA ALA A 24 11.645 1.629 -8.904 1.00 0.41 H new ATOM 0 HB1 ALA A 24 11.874 1.238 -6.472 1.00 0.46 H new ATOM 0 HB2 ALA A 24 11.479 2.935 -6.836 1.00 0.46 H new ATOM 0 HB3 ALA A 24 10.216 1.838 -6.229 1.00 0.46 H new ATOM 350 N LEU A 25 9.002 -0.157 -8.355 1.00 0.43 N ATOM 351 CA LEU A 25 8.457 -1.510 -8.416 1.00 0.48 C ATOM 352 C LEU A 25 8.705 -2.123 -9.788 1.00 0.49 C ATOM 353 O LEU A 25 8.965 -3.321 -9.906 1.00 0.57 O ATOM 354 CB LEU A 25 6.954 -1.499 -8.112 1.00 0.53 C ATOM 355 CG LEU A 25 6.568 -0.956 -6.733 1.00 0.70 C ATOM 356 CD1 LEU A 25 5.055 -0.895 -6.589 1.00 0.95 C ATOM 357 CD2 LEU A 25 7.167 -1.818 -5.632 1.00 1.00 C ATOM 0 H LEU A 25 8.298 0.581 -8.323 1.00 0.43 H new ATOM 0 HA LEU A 25 8.963 -2.115 -7.664 1.00 0.48 H new ATOM 0 HB2 LEU A 25 6.451 -0.902 -8.873 1.00 0.53 H new ATOM 0 HB3 LEU A 25 6.575 -2.517 -8.203 1.00 0.53 H new ATOM 0 HG LEU A 25 6.968 0.054 -6.639 1.00 0.70 H new ATOM 0 HD11 LEU A 25 4.799 -0.507 -5.603 1.00 0.95 H new ATOM 0 HD12 LEU A 25 4.643 -0.239 -7.356 1.00 0.95 H new ATOM 0 HD13 LEU A 25 4.638 -1.895 -6.705 1.00 0.95 H new ATOM 0 HD21 LEU A 25 6.882 -1.416 -4.660 1.00 1.00 H new ATOM 0 HD22 LEU A 25 6.796 -2.838 -5.726 1.00 1.00 H new ATOM 0 HD23 LEU A 25 8.253 -1.818 -5.720 1.00 1.00 H new ATOM 369 N GLY A 26 8.629 -1.291 -10.822 1.00 0.47 N ATOM 370 CA GLY A 26 8.858 -1.767 -12.172 1.00 0.53 C ATOM 371 C GLY A 26 10.292 -2.203 -12.381 1.00 0.50 C ATOM 372 O GLY A 26 10.626 -2.816 -13.395 1.00 0.64 O ATOM 0 H GLY A 26 8.413 -0.297 -10.748 1.00 0.47 H new ATOM 0 HA2 GLY A 26 8.190 -2.603 -12.380 1.00 0.53 H new ATOM 0 HA3 GLY A 26 8.611 -0.978 -12.882 1.00 0.53 H new ATOM 376 N ASP A 27 11.141 -1.888 -11.408 1.00 0.43 N ATOM 377 CA ASP A 27 12.552 -2.247 -11.468 1.00 0.46 C ATOM 378 C ASP A 27 12.853 -3.391 -10.507 1.00 0.41 C ATOM 379 O ASP A 27 13.792 -4.159 -10.716 1.00 0.56 O ATOM 380 CB ASP A 27 13.420 -1.029 -11.136 1.00 0.59 C ATOM 381 CG ASP A 27 14.907 -1.321 -11.232 1.00 1.05 C ATOM 382 OD1 ASP A 27 15.401 -2.144 -10.434 1.00 1.50 O ATOM 383 OD2 ASP A 27 15.576 -0.728 -12.104 1.00 1.48 O ATOM 0 H ASP A 27 10.873 -1.382 -10.564 1.00 0.43 H new ATOM 0 HA ASP A 27 12.785 -2.578 -12.480 1.00 0.46 H new ATOM 0 HB2 ASP A 27 13.170 -0.214 -11.816 1.00 0.59 H new ATOM 0 HB3 ASP A 27 13.186 -0.686 -10.128 1.00 0.59 H new ATOM 388 N ILE A 28 12.044 -3.502 -9.453 1.00 0.37 N ATOM 389 CA ILE A 28 12.221 -4.556 -8.459 1.00 0.36 C ATOM 390 C ILE A 28 12.300 -5.931 -9.124 1.00 0.42 C ATOM 391 O ILE A 28 11.560 -6.223 -10.063 1.00 0.47 O ATOM 392 CB ILE A 28 11.087 -4.545 -7.408 1.00 0.41 C ATOM 393 CG1 ILE A 28 11.192 -3.289 -6.536 1.00 0.45 C ATOM 394 CG2 ILE A 28 11.130 -5.800 -6.545 1.00 0.47 C ATOM 395 CD1 ILE A 28 10.174 -3.236 -5.417 1.00 1.27 C ATOM 0 H ILE A 28 11.261 -2.875 -9.267 1.00 0.37 H new ATOM 0 HA ILE A 28 13.163 -4.357 -7.948 1.00 0.36 H new ATOM 0 HB ILE A 28 10.132 -4.532 -7.932 1.00 0.41 H new ATOM 0 HG12 ILE A 28 12.193 -3.238 -6.107 1.00 0.45 H new ATOM 0 HG13 ILE A 28 11.071 -2.409 -7.167 1.00 0.45 H new ATOM 0 HG21 ILE A 28 10.322 -5.767 -5.814 1.00 0.47 H new ATOM 0 HG22 ILE A 28 11.012 -6.680 -7.177 1.00 0.47 H new ATOM 0 HG23 ILE A 28 12.087 -5.852 -6.026 1.00 0.47 H new ATOM 0 HD11 ILE A 28 10.311 -2.319 -4.844 1.00 1.27 H new ATOM 0 HD12 ILE A 28 9.169 -3.254 -5.838 1.00 1.27 H new ATOM 0 HD13 ILE A 28 10.308 -4.097 -4.762 1.00 1.27 H new ATOM 407 N PRO A 29 13.219 -6.788 -8.644 1.00 0.49 N ATOM 408 CA PRO A 29 13.428 -8.137 -9.182 1.00 0.65 C ATOM 409 C PRO A 29 12.134 -8.935 -9.333 1.00 0.73 C ATOM 410 O PRO A 29 11.345 -9.046 -8.396 1.00 0.77 O ATOM 411 CB PRO A 29 14.349 -8.811 -8.149 1.00 0.75 C ATOM 412 CG PRO A 29 14.410 -7.873 -6.986 1.00 0.74 C ATOM 413 CD PRO A 29 14.144 -6.506 -7.540 1.00 0.51 C ATOM 0 HA PRO A 29 13.847 -8.093 -10.187 1.00 0.65 H new ATOM 0 HB2 PRO A 29 13.955 -9.782 -7.848 1.00 0.75 H new ATOM 0 HB3 PRO A 29 15.342 -8.984 -8.564 1.00 0.75 H new ATOM 0 HG2 PRO A 29 13.669 -8.139 -6.232 1.00 0.74 H new ATOM 0 HG3 PRO A 29 15.386 -7.914 -6.503 1.00 0.74 H new ATOM 0 HD2 PRO A 29 13.699 -5.846 -6.796 1.00 0.51 H new ATOM 0 HD3 PRO A 29 15.057 -6.024 -7.888 1.00 0.51 H new ATOM 421 N GLU A 30 11.941 -9.498 -10.524 1.00 0.83 N ATOM 422 CA GLU A 30 10.762 -10.308 -10.828 1.00 0.95 C ATOM 423 C GLU A 30 9.466 -9.562 -10.532 1.00 0.84 C ATOM 424 O GLU A 30 8.419 -10.181 -10.353 1.00 1.18 O ATOM 425 CB GLU A 30 10.800 -11.616 -10.033 1.00 1.17 C ATOM 426 CG GLU A 30 12.034 -12.461 -10.307 1.00 1.47 C ATOM 427 CD GLU A 30 12.097 -12.972 -11.735 1.00 2.16 C ATOM 428 OE1 GLU A 30 11.149 -12.703 -12.502 1.00 2.84 O ATOM 429 OE2 GLU A 30 13.095 -13.637 -12.091 1.00 2.65 O ATOM 0 H GLU A 30 12.594 -9.407 -11.302 1.00 0.83 H new ATOM 0 HA GLU A 30 10.784 -10.527 -11.896 1.00 0.95 H new ATOM 0 HB2 GLU A 30 10.757 -11.385 -8.969 1.00 1.17 H new ATOM 0 HB3 GLU A 30 9.911 -12.200 -10.269 1.00 1.17 H new ATOM 0 HG2 GLU A 30 12.926 -11.870 -10.099 1.00 1.47 H new ATOM 0 HG3 GLU A 30 12.046 -13.309 -9.622 1.00 1.47 H new ATOM 436 N SER A 31 9.533 -8.238 -10.489 1.00 0.60 N ATOM 437 CA SER A 31 8.351 -7.426 -10.220 1.00 0.54 C ATOM 438 C SER A 31 7.973 -6.597 -11.437 1.00 0.47 C ATOM 439 O SER A 31 8.836 -6.013 -12.093 1.00 0.59 O ATOM 440 CB SER A 31 8.590 -6.516 -9.016 1.00 0.57 C ATOM 441 OG SER A 31 8.850 -7.274 -7.846 1.00 1.37 O ATOM 0 H SER A 31 10.389 -7.704 -10.636 1.00 0.60 H new ATOM 0 HA SER A 31 7.524 -8.099 -9.993 1.00 0.54 H new ATOM 0 HB2 SER A 31 9.432 -5.854 -9.218 1.00 0.57 H new ATOM 0 HB3 SER A 31 7.717 -5.883 -8.856 1.00 0.57 H new ATOM 0 HG SER A 31 8.397 -8.141 -7.910 1.00 1.37 H new ATOM 447 N HIS A 32 6.680 -6.562 -11.749 1.00 0.38 N ATOM 448 CA HIS A 32 6.207 -5.815 -12.907 1.00 0.42 C ATOM 449 C HIS A 32 4.801 -5.263 -12.684 1.00 0.39 C ATOM 450 O HIS A 32 3.820 -5.993 -12.800 1.00 0.39 O ATOM 451 CB HIS A 32 6.212 -6.726 -14.132 1.00 0.52 C ATOM 452 CG HIS A 32 6.032 -6.007 -15.436 1.00 1.10 C ATOM 453 ND1 HIS A 32 5.998 -6.657 -16.653 1.00 1.90 N ATOM 454 CD2 HIS A 32 5.880 -4.688 -15.712 1.00 1.90 C ATOM 455 CE1 HIS A 32 5.833 -5.772 -17.619 1.00 2.46 C ATOM 456 NE2 HIS A 32 5.759 -4.572 -17.077 1.00 2.42 N ATOM 0 H HIS A 32 5.949 -7.038 -11.221 1.00 0.38 H new ATOM 0 HA HIS A 32 6.877 -4.970 -13.063 1.00 0.42 H new ATOM 0 HB2 HIS A 32 7.154 -7.274 -14.159 1.00 0.52 H new ATOM 0 HB3 HIS A 32 5.417 -7.464 -14.025 1.00 0.52 H new ATOM 0 HD2 HIS A 32 5.858 -3.881 -14.995 1.00 1.90 H new ATOM 0 HE1 HIS A 32 5.769 -5.993 -18.674 1.00 2.46 H new ATOM 0 HE2 HIS A 32 5.632 -3.698 -17.588 1.00 2.42 H new ATOM 465 N ILE A 33 4.708 -3.972 -12.376 1.00 0.42 N ATOM 466 CA ILE A 33 3.414 -3.338 -12.149 1.00 0.42 C ATOM 467 C ILE A 33 2.517 -3.459 -13.376 1.00 0.41 C ATOM 468 O ILE A 33 2.952 -3.242 -14.507 1.00 0.48 O ATOM 469 CB ILE A 33 3.570 -1.853 -11.755 1.00 0.51 C ATOM 470 CG1 ILE A 33 3.918 -1.748 -10.271 1.00 0.61 C ATOM 471 CG2 ILE A 33 2.302 -1.068 -12.067 1.00 0.79 C ATOM 472 CD1 ILE A 33 4.118 -0.329 -9.792 1.00 0.70 C ATOM 0 H ILE A 33 5.509 -3.348 -12.278 1.00 0.42 H new ATOM 0 HA ILE A 33 2.943 -3.865 -11.319 1.00 0.42 H new ATOM 0 HB ILE A 33 4.380 -1.420 -12.342 1.00 0.51 H new ATOM 0 HG12 ILE A 33 3.122 -2.210 -9.687 1.00 0.61 H new ATOM 0 HG13 ILE A 33 4.827 -2.318 -10.079 1.00 0.61 H new ATOM 0 HG21 ILE A 33 2.439 -0.026 -11.780 1.00 0.79 H new ATOM 0 HG22 ILE A 33 2.092 -1.125 -13.135 1.00 0.79 H new ATOM 0 HG23 ILE A 33 1.466 -1.491 -11.510 1.00 0.79 H new ATOM 0 HD11 ILE A 33 4.362 -0.335 -8.730 1.00 0.70 H new ATOM 0 HD12 ILE A 33 4.934 0.132 -10.349 1.00 0.70 H new ATOM 0 HD13 ILE A 33 3.203 0.241 -9.951 1.00 0.70 H new ATOM 484 N LEU A 34 1.256 -3.813 -13.138 1.00 0.39 N ATOM 485 CA LEU A 34 0.287 -3.974 -14.211 1.00 0.40 C ATOM 486 C LEU A 34 -0.589 -2.729 -14.332 1.00 0.37 C ATOM 487 O LEU A 34 -0.808 -2.217 -15.431 1.00 0.50 O ATOM 488 CB LEU A 34 -0.566 -5.221 -13.948 1.00 0.43 C ATOM 489 CG LEU A 34 -1.310 -5.790 -15.161 1.00 0.66 C ATOM 490 CD1 LEU A 34 -1.855 -7.171 -14.840 1.00 1.42 C ATOM 491 CD2 LEU A 34 -2.437 -4.866 -15.595 1.00 1.39 C ATOM 0 H LEU A 34 0.884 -3.994 -12.206 1.00 0.39 H new ATOM 0 HA LEU A 34 0.815 -4.102 -15.156 1.00 0.40 H new ATOM 0 HB2 LEU A 34 0.080 -6.001 -13.543 1.00 0.43 H new ATOM 0 HB3 LEU A 34 -1.298 -4.981 -13.177 1.00 0.43 H new ATOM 0 HG LEU A 34 -0.603 -5.870 -15.987 1.00 0.66 H new ATOM 0 HD11 LEU A 34 -2.382 -7.565 -15.709 1.00 1.42 H new ATOM 0 HD12 LEU A 34 -1.031 -7.836 -14.582 1.00 1.42 H new ATOM 0 HD13 LEU A 34 -2.544 -7.104 -13.998 1.00 1.42 H new ATOM 0 HD21 LEU A 34 -2.947 -5.295 -16.457 1.00 1.39 H new ATOM 0 HD22 LEU A 34 -3.146 -4.747 -14.776 1.00 1.39 H new ATOM 0 HD23 LEU A 34 -2.026 -3.893 -15.863 1.00 1.39 H new ATOM 503 N THR A 35 -1.075 -2.235 -13.194 1.00 0.30 N ATOM 504 CA THR A 35 -1.912 -1.039 -13.173 1.00 0.33 C ATOM 505 C THR A 35 -1.550 -0.156 -11.987 1.00 0.34 C ATOM 506 O THR A 35 -0.890 -0.601 -11.049 1.00 0.44 O ATOM 507 CB THR A 35 -3.394 -1.414 -13.105 1.00 0.39 C ATOM 508 OG1 THR A 35 -3.648 -2.252 -11.993 1.00 0.97 O ATOM 509 CG2 THR A 35 -3.895 -2.124 -14.344 1.00 0.93 C ATOM 0 H THR A 35 -0.903 -2.645 -12.276 1.00 0.30 H new ATOM 0 HA THR A 35 -1.733 -0.487 -14.096 1.00 0.33 H new ATOM 0 HB THR A 35 -3.926 -0.467 -13.015 1.00 0.39 H new ATOM 0 HG1 THR A 35 -4.564 -2.107 -11.677 1.00 0.97 H new ATOM 0 HG21 THR A 35 -4.953 -2.359 -14.226 1.00 0.93 H new ATOM 0 HG22 THR A 35 -3.762 -1.479 -15.212 1.00 0.93 H new ATOM 0 HG23 THR A 35 -3.332 -3.046 -14.488 1.00 0.93 H new ATOM 517 N VAL A 36 -1.981 1.100 -12.036 1.00 0.33 N ATOM 518 CA VAL A 36 -1.695 2.045 -10.967 1.00 0.39 C ATOM 519 C VAL A 36 -2.869 2.993 -10.734 1.00 0.36 C ATOM 520 O VAL A 36 -3.514 3.445 -11.682 1.00 0.38 O ATOM 521 CB VAL A 36 -0.430 2.867 -11.277 1.00 0.51 C ATOM 522 CG1 VAL A 36 -0.600 3.649 -12.571 1.00 1.05 C ATOM 523 CG2 VAL A 36 -0.100 3.799 -10.120 1.00 1.21 C ATOM 0 H VAL A 36 -2.529 1.485 -12.805 1.00 0.33 H new ATOM 0 HA VAL A 36 -1.528 1.461 -10.062 1.00 0.39 H new ATOM 0 HB VAL A 36 0.404 2.177 -11.406 1.00 0.51 H new ATOM 0 HG11 VAL A 36 0.305 4.223 -12.771 1.00 1.05 H new ATOM 0 HG12 VAL A 36 -0.780 2.957 -13.393 1.00 1.05 H new ATOM 0 HG13 VAL A 36 -1.447 4.329 -12.477 1.00 1.05 H new ATOM 0 HG21 VAL A 36 0.797 4.371 -10.358 1.00 1.21 H new ATOM 0 HG22 VAL A 36 -0.933 4.482 -9.954 1.00 1.21 H new ATOM 0 HG23 VAL A 36 0.073 3.212 -9.218 1.00 1.21 H new ATOM 533 N SER A 37 -3.139 3.289 -9.467 1.00 0.35 N ATOM 534 CA SER A 37 -4.230 4.186 -9.105 1.00 0.35 C ATOM 535 C SER A 37 -3.799 5.642 -9.288 1.00 0.40 C ATOM 536 O SER A 37 -2.832 5.920 -9.997 1.00 0.72 O ATOM 537 CB SER A 37 -4.662 3.929 -7.659 1.00 0.36 C ATOM 538 OG SER A 37 -5.827 4.666 -7.329 1.00 1.35 O ATOM 0 H SER A 37 -2.616 2.920 -8.673 1.00 0.35 H new ATOM 0 HA SER A 37 -5.080 3.994 -9.760 1.00 0.35 H new ATOM 0 HB2 SER A 37 -4.851 2.865 -7.518 1.00 0.36 H new ATOM 0 HB3 SER A 37 -3.853 4.202 -6.982 1.00 0.36 H new ATOM 0 HG SER A 37 -6.079 4.481 -6.400 1.00 1.35 H new ATOM 544 N SER A 38 -4.510 6.568 -8.646 1.00 0.43 N ATOM 545 CA SER A 38 -4.178 7.987 -8.753 1.00 0.45 C ATOM 546 C SER A 38 -3.839 8.568 -7.384 1.00 0.47 C ATOM 547 O SER A 38 -3.555 7.828 -6.442 1.00 0.70 O ATOM 548 CB SER A 38 -5.337 8.764 -9.382 1.00 0.50 C ATOM 549 OG SER A 38 -6.513 8.654 -8.602 1.00 1.19 O ATOM 0 H SER A 38 -5.313 6.363 -8.051 1.00 0.43 H new ATOM 0 HA SER A 38 -3.303 8.082 -9.396 1.00 0.45 H new ATOM 0 HB2 SER A 38 -5.062 9.814 -9.483 1.00 0.50 H new ATOM 0 HB3 SER A 38 -5.528 8.387 -10.387 1.00 0.50 H new ATOM 0 HG SER A 38 -6.307 8.190 -7.764 1.00 1.19 H new ATOM 555 N PHE A 39 -3.870 9.891 -7.279 1.00 0.38 N ATOM 556 CA PHE A 39 -3.565 10.566 -6.023 1.00 0.43 C ATOM 557 C PHE A 39 -4.829 10.779 -5.193 1.00 0.40 C ATOM 558 O PHE A 39 -5.892 11.089 -5.734 1.00 0.65 O ATOM 559 CB PHE A 39 -2.856 11.898 -6.292 1.00 0.59 C ATOM 560 CG PHE A 39 -3.455 12.706 -7.415 1.00 1.42 C ATOM 561 CD1 PHE A 39 -4.752 13.185 -7.314 1.00 1.93 C ATOM 562 CD2 PHE A 39 -2.730 12.987 -8.560 1.00 2.21 C ATOM 563 CE1 PHE A 39 -5.312 13.929 -8.333 1.00 2.75 C ATOM 564 CE2 PHE A 39 -3.284 13.732 -9.584 1.00 3.01 C ATOM 565 CZ PHE A 39 -4.546 14.191 -9.497 1.00 3.17 C ATOM 0 H PHE A 39 -4.103 10.518 -8.049 1.00 0.38 H new ATOM 0 HA PHE A 39 -2.894 9.929 -5.447 1.00 0.43 H new ATOM 0 HB2 PHE A 39 -2.874 12.496 -5.381 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -1.809 11.699 -6.522 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -5.331 12.974 -6.427 1.00 1.93 H new ATOM 0 HD2 PHE A 39 -1.719 12.620 -8.655 1.00 2.21 H new ATOM 0 HE1 PHE A 39 -6.320 14.306 -8.245 1.00 2.75 H new ATOM 0 HE2 PHE A 39 -2.697 13.948 -10.464 1.00 3.01 H new ATOM 0 HZ PHE A 39 -4.974 14.757 -10.311 1.00 3.17 H new ATOM 575 N TYR A 40 -4.714 10.599 -3.879 1.00 0.38 N ATOM 576 CA TYR A 40 -5.859 10.766 -2.987 1.00 0.37 C ATOM 577 C TYR A 40 -5.445 11.353 -1.640 1.00 0.40 C ATOM 578 O TYR A 40 -4.446 10.943 -1.049 1.00 0.53 O ATOM 579 CB TYR A 40 -6.563 9.427 -2.744 1.00 0.44 C ATOM 580 CG TYR A 40 -7.035 8.723 -3.997 1.00 0.49 C ATOM 581 CD1 TYR A 40 -6.164 7.946 -4.748 1.00 0.49 C ATOM 582 CD2 TYR A 40 -8.347 8.855 -4.440 1.00 0.59 C ATOM 583 CE1 TYR A 40 -6.585 7.316 -5.903 1.00 0.57 C ATOM 584 CE2 TYR A 40 -8.775 8.228 -5.592 1.00 0.67 C ATOM 585 CZ TYR A 40 -7.918 7.400 -6.276 1.00 0.66 C ATOM 586 OH TYR A 40 -8.315 6.834 -7.470 1.00 0.76 O ATOM 0 H TYR A 40 -3.846 10.339 -3.411 1.00 0.38 H new ATOM 0 HA TYR A 40 -6.542 11.458 -3.480 1.00 0.37 H new ATOM 0 HB2 TYR A 40 -5.882 8.766 -2.207 1.00 0.44 H new ATOM 0 HB3 TYR A 40 -7.421 9.596 -2.094 1.00 0.44 H new ATOM 0 HD1 TYR A 40 -5.140 7.832 -4.424 1.00 0.49 H new ATOM 0 HD2 TYR A 40 -9.041 9.458 -3.873 1.00 0.59 H new ATOM 0 HE1 TYR A 40 -5.883 6.763 -6.510 1.00 0.57 H new ATOM 0 HE2 TYR A 40 -9.780 8.387 -5.955 1.00 0.67 H new ATOM 0 HH TYR A 40 -7.851 7.276 -8.212 1.00 0.76 H new ATOM 596 N ARG A 41 -6.249 12.290 -1.149 1.00 0.43 N ATOM 597 CA ARG A 41 -6.013 12.919 0.147 1.00 0.50 C ATOM 598 C ARG A 41 -6.654 12.063 1.230 1.00 0.54 C ATOM 599 O ARG A 41 -7.797 11.633 1.080 1.00 0.67 O ATOM 600 CB ARG A 41 -6.620 14.325 0.162 1.00 0.66 C ATOM 601 CG ARG A 41 -6.481 15.052 1.491 1.00 0.69 C ATOM 602 CD ARG A 41 -7.258 16.360 1.477 1.00 0.94 C ATOM 603 NE ARG A 41 -7.234 17.038 2.771 1.00 1.56 N ATOM 604 CZ ARG A 41 -7.823 16.564 3.868 1.00 2.07 C ATOM 605 NH1 ARG A 41 -8.481 15.413 3.829 1.00 2.32 N ATOM 606 NH2 ARG A 41 -7.752 17.243 5.005 1.00 2.95 N ATOM 0 H ARG A 41 -7.078 12.634 -1.634 1.00 0.43 H new ATOM 0 HA ARG A 41 -4.941 13.001 0.329 1.00 0.50 H new ATOM 0 HB2 ARG A 41 -6.145 14.922 -0.617 1.00 0.66 H new ATOM 0 HB3 ARG A 41 -7.678 14.254 -0.091 1.00 0.66 H new ATOM 0 HG2 ARG A 41 -6.845 14.416 2.298 1.00 0.69 H new ATOM 0 HG3 ARG A 41 -5.429 15.251 1.693 1.00 0.69 H new ATOM 0 HD2 ARG A 41 -6.839 17.020 0.717 1.00 0.94 H new ATOM 0 HD3 ARG A 41 -8.292 16.162 1.193 1.00 0.94 H new ATOM 0 HE ARG A 41 -6.737 17.926 2.838 1.00 1.56 H new ATOM 0 HH11 ARG A 41 -8.537 14.887 2.957 1.00 2.32 H new ATOM 0 HH12 ARG A 41 -8.930 15.054 4.671 1.00 2.32 H new ATOM 0 HH21 ARG A 41 -7.246 18.128 5.040 1.00 2.95 H new ATOM 0 HH22 ARG A 41 -8.203 16.880 5.845 1.00 2.95 H new ATOM 620 N THR A 42 -5.929 11.790 2.313 1.00 0.61 N ATOM 621 CA THR A 42 -6.490 10.955 3.370 1.00 0.73 C ATOM 622 C THR A 42 -5.833 11.203 4.718 1.00 0.84 C ATOM 623 O THR A 42 -4.638 10.962 4.883 1.00 1.10 O ATOM 624 CB THR A 42 -6.347 9.479 2.998 1.00 0.81 C ATOM 625 OG1 THR A 42 -6.800 8.650 4.052 1.00 1.30 O ATOM 626 CG2 THR A 42 -4.927 9.075 2.673 1.00 1.28 C ATOM 0 H THR A 42 -4.980 12.124 2.479 1.00 0.61 H new ATOM 0 HA THR A 42 -7.543 11.221 3.463 1.00 0.73 H new ATOM 0 HB THR A 42 -6.956 9.349 2.103 1.00 0.81 H new ATOM 0 HG1 THR A 42 -6.303 7.805 4.040 1.00 1.30 H new ATOM 0 HG21 THR A 42 -4.899 8.016 2.418 1.00 1.28 H new ATOM 0 HG22 THR A 42 -4.566 9.661 1.828 1.00 1.28 H new ATOM 0 HG23 THR A 42 -4.290 9.257 3.539 1.00 1.28 H new ATOM 634 N PRO A 43 -6.614 11.654 5.718 1.00 0.74 N ATOM 635 CA PRO A 43 -6.100 11.892 7.061 1.00 0.86 C ATOM 636 C PRO A 43 -5.226 10.731 7.513 1.00 0.90 C ATOM 637 O PRO A 43 -5.731 9.645 7.806 1.00 0.94 O ATOM 638 CB PRO A 43 -7.363 12.000 7.932 1.00 0.98 C ATOM 639 CG PRO A 43 -8.511 11.648 7.037 1.00 0.87 C ATOM 640 CD PRO A 43 -8.052 11.928 5.636 1.00 0.71 C ATOM 0 HA PRO A 43 -5.476 12.783 7.121 1.00 0.86 H new ATOM 0 HB2 PRO A 43 -7.309 11.321 8.783 1.00 0.98 H new ATOM 0 HB3 PRO A 43 -7.475 13.007 8.334 1.00 0.98 H new ATOM 0 HG2 PRO A 43 -8.788 10.600 7.154 1.00 0.87 H new ATOM 0 HG3 PRO A 43 -9.392 12.240 7.283 1.00 0.87 H new ATOM 0 HD2 PRO A 43 -8.548 11.284 4.909 1.00 0.71 H new ATOM 0 HD3 PRO A 43 -8.254 12.957 5.340 1.00 0.71 H new ATOM 648 N PRO A 44 -3.897 10.932 7.544 1.00 0.98 N ATOM 649 CA PRO A 44 -2.949 9.885 7.933 1.00 1.12 C ATOM 650 C PRO A 44 -3.281 9.249 9.280 1.00 1.19 C ATOM 651 O PRO A 44 -4.338 9.500 9.859 1.00 2.06 O ATOM 652 CB PRO A 44 -1.603 10.604 7.970 1.00 1.28 C ATOM 653 CG PRO A 44 -1.768 11.798 7.096 1.00 1.18 C ATOM 654 CD PRO A 44 -3.217 12.188 7.181 1.00 1.03 C ATOM 0 HA PRO A 44 -2.968 9.048 7.235 1.00 1.12 H new ATOM 0 HB2 PRO A 44 -1.341 10.895 8.987 1.00 1.28 H new ATOM 0 HB3 PRO A 44 -0.803 9.959 7.607 1.00 1.28 H new ATOM 0 HG2 PRO A 44 -1.126 12.614 7.428 1.00 1.18 H new ATOM 0 HG3 PRO A 44 -1.487 11.569 6.068 1.00 1.18 H new ATOM 0 HD2 PRO A 44 -3.380 12.962 7.931 1.00 1.03 H new ATOM 0 HD3 PRO A 44 -3.582 12.581 6.232 1.00 1.03 H new ATOM 662 N LEU A 45 -2.372 8.419 9.765 1.00 0.99 N ATOM 663 CA LEU A 45 -2.553 7.721 11.032 1.00 1.03 C ATOM 664 C LEU A 45 -1.207 7.443 11.662 1.00 1.08 C ATOM 665 O LEU A 45 -0.179 7.688 11.049 1.00 1.32 O ATOM 666 CB LEU A 45 -3.314 6.405 10.822 1.00 1.15 C ATOM 667 CG LEU A 45 -4.780 6.553 10.404 1.00 1.53 C ATOM 668 CD1 LEU A 45 -5.391 5.188 10.132 1.00 1.83 C ATOM 669 CD2 LEU A 45 -5.572 7.286 11.477 1.00 2.21 C ATOM 0 H LEU A 45 -1.491 8.209 9.296 1.00 0.99 H new ATOM 0 HA LEU A 45 -3.138 8.356 11.697 1.00 1.03 H new ATOM 0 HB2 LEU A 45 -2.794 5.822 10.062 1.00 1.15 H new ATOM 0 HB3 LEU A 45 -3.274 5.830 11.747 1.00 1.15 H new ATOM 0 HG LEU A 45 -4.820 7.141 9.487 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -6.433 5.308 9.836 1.00 1.83 H new ATOM 0 HD12 LEU A 45 -4.840 4.696 9.330 1.00 1.83 H new ATOM 0 HD13 LEU A 45 -5.338 4.579 11.035 1.00 1.83 H new ATOM 0 HD21 LEU A 45 -6.611 7.381 11.161 1.00 2.21 H new ATOM 0 HD22 LEU A 45 -5.526 6.725 12.410 1.00 2.21 H new ATOM 0 HD23 LEU A 45 -5.147 8.278 11.629 1.00 2.21 H new ATOM 681 N GLY A 46 -1.219 6.935 12.881 1.00 1.09 N ATOM 682 CA GLY A 46 0.022 6.631 13.568 1.00 1.18 C ATOM 683 C GLY A 46 0.732 7.873 14.078 1.00 1.11 C ATOM 684 O GLY A 46 0.083 8.807 14.547 1.00 1.19 O ATOM 0 H GLY A 46 -2.065 6.726 13.411 1.00 1.09 H new ATOM 0 HA2 GLY A 46 -0.186 5.967 14.407 1.00 1.18 H new ATOM 0 HA3 GLY A 46 0.684 6.092 12.891 1.00 1.18 H new ATOM 688 N PRO A 47 2.078 7.886 14.061 1.00 1.12 N ATOM 689 CA PRO A 47 2.885 8.981 14.570 1.00 1.16 C ATOM 690 C PRO A 47 3.602 9.821 13.499 1.00 1.14 C ATOM 691 O PRO A 47 4.723 9.503 13.108 1.00 1.99 O ATOM 692 CB PRO A 47 3.922 8.202 15.363 1.00 1.36 C ATOM 693 CG PRO A 47 4.110 6.914 14.601 1.00 1.39 C ATOM 694 CD PRO A 47 2.953 6.797 13.628 1.00 1.26 C ATOM 0 HA PRO A 47 2.282 9.715 15.105 1.00 1.16 H new ATOM 0 HB2 PRO A 47 4.858 8.756 15.439 1.00 1.36 H new ATOM 0 HB3 PRO A 47 3.580 8.012 16.380 1.00 1.36 H new ATOM 0 HG2 PRO A 47 5.061 6.917 14.069 1.00 1.39 H new ATOM 0 HG3 PRO A 47 4.128 6.063 15.282 1.00 1.39 H new ATOM 0 HD2 PRO A 47 3.276 6.920 12.594 1.00 1.26 H new ATOM 0 HD3 PRO A 47 2.460 5.827 13.695 1.00 1.26 H new ATOM 702 N GLN A 48 2.986 10.920 13.071 1.00 0.95 N ATOM 703 CA GLN A 48 3.616 11.823 12.102 1.00 0.84 C ATOM 704 C GLN A 48 2.893 13.167 12.095 1.00 0.90 C ATOM 705 O GLN A 48 3.535 14.210 11.970 1.00 1.04 O ATOM 706 CB GLN A 48 3.710 11.223 10.681 1.00 0.83 C ATOM 707 CG GLN A 48 2.414 11.186 9.884 1.00 1.00 C ATOM 708 CD GLN A 48 1.396 10.195 10.408 1.00 1.29 C ATOM 709 OE1 GLN A 48 0.253 10.185 9.968 1.00 2.23 O ATOM 710 NE2 GLN A 48 1.797 9.344 11.339 1.00 1.15 N ATOM 0 H GLN A 48 2.056 11.209 13.376 1.00 0.95 H new ATOM 0 HA GLN A 48 4.646 11.974 12.424 1.00 0.84 H new ATOM 0 HB2 GLN A 48 4.445 11.795 10.115 1.00 0.83 H new ATOM 0 HB3 GLN A 48 4.092 10.205 10.763 1.00 0.83 H new ATOM 0 HG2 GLN A 48 1.970 12.182 9.885 1.00 1.00 H new ATOM 0 HG3 GLN A 48 2.644 10.941 8.847 1.00 1.00 H new ATOM 0 HE21 GLN A 48 2.756 9.380 11.683 1.00 1.15 H new ATOM 0 HE22 GLN A 48 1.147 8.652 11.712 1.00 1.15 H new ATOM 719 N ASP A 49 1.561 13.125 12.275 1.00 0.99 N ATOM 720 CA ASP A 49 0.715 14.330 12.335 1.00 1.16 C ATOM 721 C ASP A 49 -0.723 14.002 11.929 1.00 1.20 C ATOM 722 O ASP A 49 -1.672 14.639 12.384 1.00 1.33 O ATOM 723 CB ASP A 49 1.249 15.449 11.430 1.00 1.28 C ATOM 724 CG ASP A 49 0.542 16.773 11.655 1.00 1.51 C ATOM 725 OD1 ASP A 49 -0.332 16.833 12.544 1.00 1.81 O ATOM 726 OD2 ASP A 49 0.857 17.749 10.940 1.00 1.70 O ATOM 0 H ASP A 49 1.041 12.254 12.383 1.00 0.99 H new ATOM 0 HA ASP A 49 0.736 14.679 13.367 1.00 1.16 H new ATOM 0 HB2 ASP A 49 2.317 15.577 11.609 1.00 1.28 H new ATOM 0 HB3 ASP A 49 1.134 15.153 10.387 1.00 1.28 H new ATOM 731 N GLN A 50 -0.859 13.008 11.060 1.00 1.19 N ATOM 732 CA GLN A 50 -2.165 12.578 10.554 1.00 1.31 C ATOM 733 C GLN A 50 -2.981 13.748 9.990 1.00 1.33 C ATOM 734 O GLN A 50 -4.180 13.846 10.253 1.00 1.40 O ATOM 735 CB GLN A 50 -2.994 11.897 11.640 1.00 1.42 C ATOM 736 CG GLN A 50 -2.357 10.688 12.288 1.00 1.67 C ATOM 737 CD GLN A 50 -1.057 11.007 12.973 1.00 1.43 C ATOM 738 OE1 GLN A 50 -0.983 11.891 13.828 1.00 2.03 O ATOM 739 NE2 GLN A 50 -0.029 10.268 12.614 1.00 1.24 N ATOM 0 H GLN A 50 -0.073 12.477 10.685 1.00 1.19 H new ATOM 0 HA GLN A 50 -1.952 11.869 9.754 1.00 1.31 H new ATOM 0 HB2 GLN A 50 -3.214 12.629 12.417 1.00 1.42 H new ATOM 0 HB3 GLN A 50 -3.948 11.595 11.208 1.00 1.42 H new ATOM 0 HG2 GLN A 50 -3.050 10.264 13.015 1.00 1.67 H new ATOM 0 HG3 GLN A 50 -2.184 9.924 11.530 1.00 1.67 H new ATOM 0 HE21 GLN A 50 -0.143 9.548 11.900 1.00 1.24 H new ATOM 0 HE22 GLN A 50 0.882 10.415 13.049 1.00 1.24 H new ATOM 748 N PRO A 51 -2.361 14.659 9.218 1.00 1.35 N ATOM 749 CA PRO A 51 -3.070 15.815 8.648 1.00 1.46 C ATOM 750 C PRO A 51 -3.991 15.433 7.483 1.00 1.54 C ATOM 751 O PRO A 51 -5.212 15.400 7.635 1.00 2.26 O ATOM 752 CB PRO A 51 -1.939 16.738 8.166 1.00 1.52 C ATOM 753 CG PRO A 51 -0.679 16.139 8.703 1.00 1.53 C ATOM 754 CD PRO A 51 -0.943 14.670 8.846 1.00 1.37 C ATOM 0 HA PRO A 51 -3.730 16.280 9.381 1.00 1.46 H new ATOM 0 HB2 PRO A 51 -1.915 16.793 7.078 1.00 1.52 H new ATOM 0 HB3 PRO A 51 -2.078 17.755 8.534 1.00 1.52 H new ATOM 0 HG2 PRO A 51 0.157 16.320 8.028 1.00 1.53 H new ATOM 0 HG3 PRO A 51 -0.415 16.583 9.663 1.00 1.53 H new ATOM 0 HD2 PRO A 51 -0.759 14.129 7.918 1.00 1.37 H new ATOM 0 HD3 PRO A 51 -0.315 14.214 9.611 1.00 1.37 H new ATOM 762 N ASP A 52 -3.400 15.150 6.326 1.00 1.24 N ATOM 763 CA ASP A 52 -4.160 14.772 5.137 1.00 1.23 C ATOM 764 C ASP A 52 -3.268 13.992 4.177 1.00 0.91 C ATOM 765 O ASP A 52 -3.539 12.837 3.858 1.00 1.55 O ATOM 766 CB ASP A 52 -4.728 16.017 4.448 1.00 1.67 C ATOM 767 CG ASP A 52 -3.663 17.043 4.114 1.00 2.16 C ATOM 768 OD1 ASP A 52 -2.994 17.530 5.049 1.00 2.69 O ATOM 769 OD2 ASP A 52 -3.498 17.358 2.918 1.00 2.56 O ATOM 0 H ASP A 52 -2.390 15.175 6.185 1.00 1.24 H new ATOM 0 HA ASP A 52 -4.993 14.137 5.438 1.00 1.23 H new ATOM 0 HB2 ASP A 52 -5.238 15.719 3.532 1.00 1.67 H new ATOM 0 HB3 ASP A 52 -5.476 16.475 5.095 1.00 1.67 H new ATOM 774 N TYR A 53 -2.178 14.625 3.759 1.00 0.76 N ATOM 775 CA TYR A 53 -1.194 14.007 2.878 1.00 1.08 C ATOM 776 C TYR A 53 -1.814 13.170 1.747 1.00 0.87 C ATOM 777 O TYR A 53 -3.005 13.291 1.461 1.00 0.98 O ATOM 778 CB TYR A 53 -0.236 13.231 3.748 1.00 1.83 C ATOM 779 CG TYR A 53 0.572 14.185 4.587 1.00 2.62 C ATOM 780 CD1 TYR A 53 1.291 15.210 3.981 1.00 3.32 C ATOM 781 CD2 TYR A 53 0.619 14.075 5.962 1.00 3.26 C ATOM 782 CE1 TYR A 53 2.041 16.095 4.727 1.00 4.46 C ATOM 783 CE2 TYR A 53 1.374 14.956 6.716 1.00 4.34 C ATOM 784 CZ TYR A 53 2.082 15.962 6.095 1.00 4.90 C ATOM 785 OH TYR A 53 2.830 16.837 6.846 1.00 6.13 O ATOM 0 H TYR A 53 -1.951 15.584 4.022 1.00 0.76 H new ATOM 0 HA TYR A 53 -0.653 14.782 2.335 1.00 1.08 H new ATOM 0 HB2 TYR A 53 -0.787 12.544 4.390 1.00 1.83 H new ATOM 0 HB3 TYR A 53 0.426 12.626 3.128 1.00 1.83 H new ATOM 0 HD1 TYR A 53 1.261 15.315 2.907 1.00 3.32 H new ATOM 0 HD2 TYR A 53 0.060 13.293 6.455 1.00 3.26 H new ATOM 0 HE1 TYR A 53 2.592 16.886 4.240 1.00 4.46 H new ATOM 0 HE2 TYR A 53 1.408 14.855 7.791 1.00 4.34 H new ATOM 0 HH TYR A 53 2.750 16.605 7.795 1.00 6.13 H new ATOM 795 N LEU A 54 -0.992 12.366 1.067 1.00 0.72 N ATOM 796 CA LEU A 54 -1.463 11.568 -0.064 1.00 0.59 C ATOM 797 C LEU A 54 -1.236 10.071 0.159 1.00 0.61 C ATOM 798 O LEU A 54 -0.304 9.667 0.850 1.00 0.88 O ATOM 799 CB LEU A 54 -0.735 12.048 -1.333 1.00 0.60 C ATOM 800 CG LEU A 54 -1.082 11.339 -2.649 1.00 0.54 C ATOM 801 CD1 LEU A 54 -0.653 12.198 -3.826 1.00 0.92 C ATOM 802 CD2 LEU A 54 -0.408 9.979 -2.732 1.00 1.10 C ATOM 0 H LEU A 54 -0.001 12.252 1.280 1.00 0.72 H new ATOM 0 HA LEU A 54 -2.539 11.706 -0.172 1.00 0.59 H new ATOM 0 HB2 LEU A 54 -0.939 13.111 -1.458 1.00 0.60 H new ATOM 0 HB3 LEU A 54 0.337 11.946 -1.167 1.00 0.60 H new ATOM 0 HG LEU A 54 -2.161 11.188 -2.681 1.00 0.54 H new ATOM 0 HD11 LEU A 54 -0.902 11.689 -4.757 1.00 0.92 H new ATOM 0 HD12 LEU A 54 -1.172 13.156 -3.786 1.00 0.92 H new ATOM 0 HD13 LEU A 54 0.423 12.366 -3.781 1.00 0.92 H new ATOM 0 HD21 LEU A 54 -0.671 9.499 -3.675 1.00 1.10 H new ATOM 0 HD22 LEU A 54 0.673 10.105 -2.679 1.00 1.10 H new ATOM 0 HD23 LEU A 54 -0.742 9.356 -1.902 1.00 1.10 H new ATOM 814 N ASN A 55 -2.098 9.258 -0.456 1.00 0.50 N ATOM 815 CA ASN A 55 -2.002 7.804 -0.360 1.00 0.58 C ATOM 816 C ASN A 55 -2.631 7.150 -1.588 1.00 0.57 C ATOM 817 O ASN A 55 -3.543 7.710 -2.196 1.00 0.70 O ATOM 818 CB ASN A 55 -2.704 7.294 0.900 1.00 0.82 C ATOM 819 CG ASN A 55 -2.477 5.813 1.127 1.00 1.80 C ATOM 820 OD1 ASN A 55 -1.360 5.381 1.410 1.00 2.63 O ATOM 821 ND2 ASN A 55 -3.535 5.023 0.989 1.00 2.49 N ATOM 0 H ASN A 55 -2.875 9.587 -1.029 1.00 0.50 H new ATOM 0 HA ASN A 55 -0.946 7.540 -0.308 1.00 0.58 H new ATOM 0 HB2 ASN A 55 -2.343 7.851 1.765 1.00 0.82 H new ATOM 0 HB3 ASN A 55 -3.774 7.487 0.820 1.00 0.82 H new ATOM 0 HD21 ASN A 55 -3.440 4.016 1.118 1.00 2.49 H new ATOM 0 HD22 ASN A 55 -4.443 5.423 0.754 1.00 2.49 H new ATOM 828 N ALA A 56 -2.143 5.965 -1.948 1.00 0.51 N ATOM 829 CA ALA A 56 -2.664 5.244 -3.104 1.00 0.57 C ATOM 830 C ALA A 56 -2.032 3.862 -3.226 1.00 0.54 C ATOM 831 O ALA A 56 -0.864 3.670 -2.891 1.00 0.75 O ATOM 832 CB ALA A 56 -2.421 6.042 -4.376 1.00 0.61 C ATOM 0 H ALA A 56 -1.389 5.486 -1.456 1.00 0.51 H new ATOM 0 HA ALA A 56 -3.737 5.115 -2.961 1.00 0.57 H new ATOM 0 HB1 ALA A 56 -2.815 5.492 -5.231 1.00 0.61 H new ATOM 0 HB2 ALA A 56 -2.923 7.006 -4.302 1.00 0.61 H new ATOM 0 HB3 ALA A 56 -1.351 6.200 -4.508 1.00 0.61 H new ATOM 838 N ALA A 57 -2.813 2.903 -3.718 1.00 0.31 N ATOM 839 CA ALA A 57 -2.331 1.541 -3.894 1.00 0.29 C ATOM 840 C ALA A 57 -1.903 1.304 -5.337 1.00 0.29 C ATOM 841 O ALA A 57 -2.104 2.160 -6.199 1.00 0.39 O ATOM 842 CB ALA A 57 -3.409 0.553 -3.491 1.00 0.33 C ATOM 0 H ALA A 57 -3.782 3.047 -4.001 1.00 0.31 H new ATOM 0 HA ALA A 57 -1.461 1.394 -3.254 1.00 0.29 H new ATOM 0 HB1 ALA A 57 -3.040 -0.464 -3.626 1.00 0.33 H new ATOM 0 HB2 ALA A 57 -3.672 0.708 -2.444 1.00 0.33 H new ATOM 0 HB3 ALA A 57 -4.292 0.704 -4.113 1.00 0.33 H new ATOM 848 N VAL A 58 -1.315 0.137 -5.606 1.00 0.26 N ATOM 849 CA VAL A 58 -0.871 -0.189 -6.956 1.00 0.27 C ATOM 850 C VAL A 58 -0.565 -1.674 -7.111 1.00 0.27 C ATOM 851 O VAL A 58 0.183 -2.251 -6.320 1.00 0.28 O ATOM 852 CB VAL A 58 0.365 0.638 -7.348 1.00 0.31 C ATOM 853 CG1 VAL A 58 1.489 0.440 -6.341 1.00 1.20 C ATOM 854 CG2 VAL A 58 0.828 0.288 -8.753 1.00 0.98 C ATOM 0 H VAL A 58 -1.138 -0.590 -4.912 1.00 0.26 H new ATOM 0 HA VAL A 58 -1.694 0.061 -7.625 1.00 0.27 H new ATOM 0 HB VAL A 58 0.084 1.691 -7.339 1.00 0.31 H new ATOM 0 HG11 VAL A 58 2.353 1.034 -6.638 1.00 1.20 H new ATOM 0 HG12 VAL A 58 1.153 0.757 -5.354 1.00 1.20 H new ATOM 0 HG13 VAL A 58 1.767 -0.613 -6.309 1.00 1.20 H new ATOM 0 HG21 VAL A 58 1.703 0.886 -9.007 1.00 0.98 H new ATOM 0 HG22 VAL A 58 1.086 -0.770 -8.798 1.00 0.98 H new ATOM 0 HG23 VAL A 58 0.027 0.497 -9.463 1.00 0.98 H new ATOM 864 N ALA A 59 -1.161 -2.290 -8.131 1.00 0.28 N ATOM 865 CA ALA A 59 -0.961 -3.708 -8.384 1.00 0.29 C ATOM 866 C ALA A 59 0.381 -3.971 -9.060 1.00 0.31 C ATOM 867 O ALA A 59 0.675 -3.424 -10.124 1.00 0.50 O ATOM 868 CB ALA A 59 -2.093 -4.242 -9.243 1.00 0.31 C ATOM 0 H ALA A 59 -1.784 -1.827 -8.792 1.00 0.28 H new ATOM 0 HA ALA A 59 -0.957 -4.226 -7.425 1.00 0.29 H new ATOM 0 HB1 ALA A 59 -1.938 -5.305 -9.429 1.00 0.31 H new ATOM 0 HB2 ALA A 59 -3.041 -4.099 -8.725 1.00 0.31 H new ATOM 0 HB3 ALA A 59 -2.113 -3.706 -10.192 1.00 0.31 H new ATOM 874 N LEU A 60 1.187 -4.821 -8.431 1.00 0.28 N ATOM 875 CA LEU A 60 2.501 -5.177 -8.955 1.00 0.28 C ATOM 876 C LEU A 60 2.537 -6.644 -9.349 1.00 0.30 C ATOM 877 O LEU A 60 2.580 -7.525 -8.489 1.00 0.33 O ATOM 878 CB LEU A 60 3.592 -4.907 -7.913 1.00 0.29 C ATOM 879 CG LEU A 60 5.005 -5.372 -8.299 1.00 0.29 C ATOM 880 CD1 LEU A 60 5.512 -4.602 -9.506 1.00 0.35 C ATOM 881 CD2 LEU A 60 5.955 -5.205 -7.124 1.00 0.31 C ATOM 0 H LEU A 60 0.950 -5.279 -7.551 1.00 0.28 H new ATOM 0 HA LEU A 60 2.687 -4.562 -9.835 1.00 0.28 H new ATOM 0 HB2 LEU A 60 3.623 -3.836 -7.714 1.00 0.29 H new ATOM 0 HB3 LEU A 60 3.309 -5.397 -6.981 1.00 0.29 H new ATOM 0 HG LEU A 60 4.960 -6.429 -8.563 1.00 0.29 H new ATOM 0 HD11 LEU A 60 6.514 -4.946 -9.763 1.00 0.35 H new ATOM 0 HD12 LEU A 60 4.843 -4.768 -10.351 1.00 0.35 H new ATOM 0 HD13 LEU A 60 5.543 -3.538 -9.272 1.00 0.35 H new ATOM 0 HD21 LEU A 60 6.952 -5.538 -7.412 1.00 0.31 H new ATOM 0 HD22 LEU A 60 5.993 -4.155 -6.833 1.00 0.31 H new ATOM 0 HD23 LEU A 60 5.602 -5.802 -6.283 1.00 0.31 H new ATOM 893 N GLU A 61 2.537 -6.909 -10.648 1.00 0.32 N ATOM 894 CA GLU A 61 2.586 -8.277 -11.126 1.00 0.36 C ATOM 895 C GLU A 61 3.999 -8.807 -10.950 1.00 0.34 C ATOM 896 O GLU A 61 4.852 -8.638 -11.820 1.00 0.36 O ATOM 897 CB GLU A 61 2.170 -8.345 -12.593 1.00 0.43 C ATOM 898 CG GLU A 61 1.841 -9.748 -13.078 1.00 0.52 C ATOM 899 CD GLU A 61 3.049 -10.666 -13.097 1.00 1.37 C ATOM 900 OE1 GLU A 61 4.025 -10.348 -13.809 1.00 1.88 O ATOM 901 OE2 GLU A 61 3.019 -11.701 -12.399 1.00 2.11 O ATOM 0 H GLU A 61 2.504 -6.200 -11.381 1.00 0.32 H new ATOM 0 HA GLU A 61 1.891 -8.890 -10.552 1.00 0.36 H new ATOM 0 HB2 GLU A 61 1.300 -7.706 -12.743 1.00 0.43 H new ATOM 0 HB3 GLU A 61 2.974 -7.938 -13.207 1.00 0.43 H new ATOM 0 HG2 GLU A 61 1.074 -10.179 -12.434 1.00 0.52 H new ATOM 0 HG3 GLU A 61 1.419 -9.690 -14.081 1.00 0.52 H new ATOM 908 N THR A 62 4.242 -9.425 -9.803 1.00 0.34 N ATOM 909 CA THR A 62 5.556 -9.955 -9.490 1.00 0.35 C ATOM 910 C THR A 62 5.493 -11.422 -9.098 1.00 0.39 C ATOM 911 O THR A 62 4.485 -11.900 -8.584 1.00 0.61 O ATOM 912 CB THR A 62 6.184 -9.142 -8.355 1.00 0.40 C ATOM 913 OG1 THR A 62 7.450 -9.667 -7.998 1.00 0.43 O ATOM 914 CG2 THR A 62 5.333 -9.106 -7.105 1.00 0.52 C ATOM 0 H THR A 62 3.543 -9.571 -9.074 1.00 0.34 H new ATOM 0 HA THR A 62 6.170 -9.876 -10.387 1.00 0.35 H new ATOM 0 HB THR A 62 6.275 -8.128 -8.744 1.00 0.40 H new ATOM 0 HG1 THR A 62 7.856 -10.101 -8.777 1.00 0.43 H new ATOM 0 HG21 THR A 62 5.835 -8.514 -6.340 1.00 0.52 H new ATOM 0 HG22 THR A 62 4.367 -8.657 -7.335 1.00 0.52 H new ATOM 0 HG23 THR A 62 5.183 -10.121 -6.738 1.00 0.52 H new ATOM 922 N SER A 63 6.595 -12.117 -9.325 1.00 0.37 N ATOM 923 CA SER A 63 6.699 -13.525 -8.979 1.00 0.48 C ATOM 924 C SER A 63 7.688 -13.673 -7.839 1.00 0.42 C ATOM 925 O SER A 63 8.035 -14.780 -7.432 1.00 0.45 O ATOM 926 CB SER A 63 7.151 -14.345 -10.189 1.00 0.69 C ATOM 927 OG SER A 63 6.226 -14.233 -11.256 1.00 1.22 O ATOM 0 H SER A 63 7.436 -11.726 -9.750 1.00 0.37 H new ATOM 0 HA SER A 63 5.723 -13.898 -8.670 1.00 0.48 H new ATOM 0 HB2 SER A 63 8.133 -14.003 -10.517 1.00 0.69 H new ATOM 0 HB3 SER A 63 7.257 -15.392 -9.904 1.00 0.69 H new ATOM 0 HG SER A 63 6.539 -14.765 -12.017 1.00 1.22 H new ATOM 933 N LEU A 64 8.130 -12.528 -7.327 1.00 0.37 N ATOM 934 CA LEU A 64 9.079 -12.497 -6.227 1.00 0.35 C ATOM 935 C LEU A 64 8.416 -13.023 -4.954 1.00 0.50 C ATOM 936 O LEU A 64 7.209 -12.861 -4.767 1.00 0.82 O ATOM 937 CB LEU A 64 9.585 -11.062 -6.035 1.00 0.49 C ATOM 938 CG LEU A 64 10.902 -10.906 -5.270 1.00 0.48 C ATOM 939 CD1 LEU A 64 10.705 -11.157 -3.784 1.00 0.90 C ATOM 940 CD2 LEU A 64 11.966 -11.839 -5.832 1.00 0.84 C ATOM 0 H LEU A 64 7.843 -11.608 -7.660 1.00 0.37 H new ATOM 0 HA LEU A 64 9.931 -13.139 -6.453 1.00 0.35 H new ATOM 0 HB2 LEU A 64 9.704 -10.606 -7.018 1.00 0.49 H new ATOM 0 HB3 LEU A 64 8.816 -10.495 -5.512 1.00 0.49 H new ATOM 0 HG LEU A 64 11.242 -9.878 -5.397 1.00 0.48 H new ATOM 0 HD11 LEU A 64 11.657 -11.039 -3.266 1.00 0.90 H new ATOM 0 HD12 LEU A 64 9.985 -10.442 -3.387 1.00 0.90 H new ATOM 0 HD13 LEU A 64 10.332 -12.170 -3.632 1.00 0.90 H new ATOM 0 HD21 LEU A 64 12.893 -11.711 -5.274 1.00 0.84 H new ATOM 0 HD22 LEU A 64 11.628 -12.872 -5.743 1.00 0.84 H new ATOM 0 HD23 LEU A 64 12.139 -11.603 -6.882 1.00 0.84 H new ATOM 952 N ALA A 65 9.204 -13.660 -4.091 1.00 0.58 N ATOM 953 CA ALA A 65 8.690 -14.215 -2.844 1.00 0.89 C ATOM 954 C ALA A 65 7.829 -13.196 -2.104 1.00 0.60 C ATOM 955 O ALA A 65 8.223 -12.043 -1.950 1.00 0.59 O ATOM 956 CB ALA A 65 9.837 -14.681 -1.963 1.00 1.41 C ATOM 0 H ALA A 65 10.204 -13.804 -4.234 1.00 0.58 H new ATOM 0 HA ALA A 65 8.062 -15.073 -3.087 1.00 0.89 H new ATOM 0 HB1 ALA A 65 9.439 -15.093 -1.036 1.00 1.41 H new ATOM 0 HB2 ALA A 65 10.408 -15.448 -2.485 1.00 1.41 H new ATOM 0 HB3 ALA A 65 10.487 -13.836 -1.735 1.00 1.41 H new ATOM 962 N PRO A 66 6.636 -13.607 -1.639 1.00 0.50 N ATOM 963 CA PRO A 66 5.726 -12.713 -0.919 1.00 0.40 C ATOM 964 C PRO A 66 6.363 -12.101 0.317 1.00 0.41 C ATOM 965 O PRO A 66 5.843 -11.142 0.877 1.00 0.62 O ATOM 966 CB PRO A 66 4.574 -13.617 -0.492 1.00 0.47 C ATOM 967 CG PRO A 66 4.644 -14.817 -1.373 1.00 0.75 C ATOM 968 CD PRO A 66 6.081 -14.967 -1.786 1.00 0.64 C ATOM 0 HA PRO A 66 5.427 -11.875 -1.549 1.00 0.40 H new ATOM 0 HB2 PRO A 66 4.667 -13.898 0.557 1.00 0.47 H new ATOM 0 HB3 PRO A 66 3.617 -13.107 -0.602 1.00 0.47 H new ATOM 0 HG2 PRO A 66 4.299 -15.706 -0.845 1.00 0.75 H new ATOM 0 HG3 PRO A 66 4.002 -14.695 -2.245 1.00 0.75 H new ATOM 0 HD2 PRO A 66 6.606 -15.683 -1.154 1.00 0.64 H new ATOM 0 HD3 PRO A 66 6.167 -15.325 -2.812 1.00 0.64 H new ATOM 976 N GLU A 67 7.479 -12.675 0.742 1.00 0.40 N ATOM 977 CA GLU A 67 8.175 -12.195 1.925 1.00 0.44 C ATOM 978 C GLU A 67 9.295 -11.229 1.576 1.00 0.37 C ATOM 979 O GLU A 67 9.548 -10.274 2.310 1.00 0.40 O ATOM 980 CB GLU A 67 8.714 -13.373 2.735 1.00 0.57 C ATOM 981 CG GLU A 67 9.131 -14.541 1.872 1.00 0.65 C ATOM 982 CD GLU A 67 9.687 -15.699 2.675 1.00 0.80 C ATOM 983 OE1 GLU A 67 8.947 -16.244 3.520 1.00 1.28 O ATOM 984 OE2 GLU A 67 10.862 -16.061 2.459 1.00 1.19 O ATOM 0 H GLU A 67 7.921 -13.473 0.285 1.00 0.40 H new ATOM 0 HA GLU A 67 7.454 -11.646 2.530 1.00 0.44 H new ATOM 0 HB2 GLU A 67 9.568 -13.041 3.325 1.00 0.57 H new ATOM 0 HB3 GLU A 67 7.950 -13.703 3.439 1.00 0.57 H new ATOM 0 HG2 GLU A 67 8.272 -14.885 1.295 1.00 0.65 H new ATOM 0 HG3 GLU A 67 9.883 -14.207 1.157 1.00 0.65 H new ATOM 991 N GLU A 68 9.962 -11.472 0.458 1.00 0.34 N ATOM 992 CA GLU A 68 11.052 -10.599 0.043 1.00 0.31 C ATOM 993 C GLU A 68 10.551 -9.425 -0.793 1.00 0.29 C ATOM 994 O GLU A 68 11.208 -8.389 -0.858 1.00 0.30 O ATOM 995 CB GLU A 68 12.132 -11.369 -0.713 1.00 0.37 C ATOM 996 CG GLU A 68 13.340 -10.510 -1.058 1.00 0.34 C ATOM 997 CD GLU A 68 14.505 -11.328 -1.583 1.00 0.53 C ATOM 998 OE1 GLU A 68 15.008 -12.194 -0.838 1.00 1.21 O ATOM 999 OE2 GLU A 68 14.915 -11.099 -2.740 1.00 1.02 O ATOM 0 H GLU A 68 9.773 -12.253 -0.170 1.00 0.34 H new ATOM 0 HA GLU A 68 11.496 -10.197 0.954 1.00 0.31 H new ATOM 0 HB2 GLU A 68 12.456 -12.217 -0.110 1.00 0.37 H new ATOM 0 HB3 GLU A 68 11.707 -11.775 -1.631 1.00 0.37 H new ATOM 0 HG2 GLU A 68 13.054 -9.770 -1.806 1.00 0.34 H new ATOM 0 HG3 GLU A 68 13.656 -9.961 -0.171 1.00 0.34 H new ATOM 1006 N LEU A 69 9.389 -9.580 -1.430 1.00 0.32 N ATOM 1007 CA LEU A 69 8.834 -8.503 -2.243 1.00 0.36 C ATOM 1008 C LEU A 69 8.730 -7.237 -1.416 1.00 0.35 C ATOM 1009 O LEU A 69 9.395 -6.244 -1.708 1.00 0.41 O ATOM 1010 CB LEU A 69 7.464 -8.875 -2.803 1.00 0.42 C ATOM 1011 CG LEU A 69 6.722 -7.729 -3.492 1.00 0.54 C ATOM 1012 CD1 LEU A 69 7.468 -7.283 -4.741 1.00 1.08 C ATOM 1013 CD2 LEU A 69 5.302 -8.139 -3.836 1.00 1.51 C ATOM 0 H LEU A 69 8.823 -10.428 -1.399 1.00 0.32 H new ATOM 0 HA LEU A 69 9.505 -8.335 -3.085 1.00 0.36 H new ATOM 0 HB2 LEU A 69 7.587 -9.690 -3.516 1.00 0.42 H new ATOM 0 HB3 LEU A 69 6.845 -9.254 -1.990 1.00 0.42 H new ATOM 0 HG LEU A 69 6.676 -6.888 -2.801 1.00 0.54 H new ATOM 0 HD11 LEU A 69 6.925 -6.467 -5.217 1.00 1.08 H new ATOM 0 HD12 LEU A 69 8.466 -6.943 -4.466 1.00 1.08 H new ATOM 0 HD13 LEU A 69 7.548 -8.120 -5.435 1.00 1.08 H new ATOM 0 HD21 LEU A 69 4.792 -7.309 -4.325 1.00 1.51 H new ATOM 0 HD22 LEU A 69 5.324 -8.998 -4.507 1.00 1.51 H new ATOM 0 HD23 LEU A 69 4.769 -8.405 -2.923 1.00 1.51 H new ATOM 1025 N LEU A 70 7.921 -7.284 -0.362 1.00 0.33 N ATOM 1026 CA LEU A 70 7.788 -6.136 0.527 1.00 0.39 C ATOM 1027 C LEU A 70 9.175 -5.720 0.980 1.00 0.42 C ATOM 1028 O LEU A 70 9.550 -4.551 0.900 1.00 0.61 O ATOM 1029 CB LEU A 70 6.906 -6.487 1.732 1.00 0.44 C ATOM 1030 CG LEU A 70 6.888 -5.470 2.882 1.00 0.58 C ATOM 1031 CD1 LEU A 70 5.647 -5.668 3.738 1.00 1.16 C ATOM 1032 CD2 LEU A 70 8.133 -5.606 3.748 1.00 1.01 C ATOM 0 H LEU A 70 7.355 -8.093 -0.105 1.00 0.33 H new ATOM 0 HA LEU A 70 7.309 -5.311 -0.001 1.00 0.39 H new ATOM 0 HB2 LEU A 70 5.884 -6.623 1.379 1.00 0.44 H new ATOM 0 HB3 LEU A 70 7.236 -7.447 2.129 1.00 0.44 H new ATOM 0 HG LEU A 70 6.873 -4.470 2.448 1.00 0.58 H new ATOM 0 HD11 LEU A 70 5.645 -4.941 4.550 1.00 1.16 H new ATOM 0 HD12 LEU A 70 4.756 -5.529 3.125 1.00 1.16 H new ATOM 0 HD13 LEU A 70 5.648 -6.676 4.153 1.00 1.16 H new ATOM 0 HD21 LEU A 70 8.096 -4.875 4.555 1.00 1.01 H new ATOM 0 HD22 LEU A 70 8.175 -6.610 4.170 1.00 1.01 H new ATOM 0 HD23 LEU A 70 9.020 -5.431 3.140 1.00 1.01 H new ATOM 1044 N ASN A 71 9.937 -6.706 1.441 1.00 0.31 N ATOM 1045 CA ASN A 71 11.303 -6.471 1.893 1.00 0.35 C ATOM 1046 C ASN A 71 12.085 -5.683 0.842 1.00 0.38 C ATOM 1047 O ASN A 71 12.966 -4.892 1.174 1.00 0.45 O ATOM 1048 CB ASN A 71 12.005 -7.796 2.192 1.00 0.36 C ATOM 1049 CG ASN A 71 13.420 -7.598 2.701 1.00 1.06 C ATOM 1050 OD1 ASN A 71 14.292 -7.115 1.978 1.00 1.87 O ATOM 1051 ND2 ASN A 71 13.654 -7.962 3.956 1.00 1.53 N ATOM 0 H ASN A 71 9.631 -7.677 1.511 1.00 0.31 H new ATOM 0 HA ASN A 71 11.264 -5.885 2.811 1.00 0.35 H new ATOM 0 HB2 ASN A 71 11.429 -8.350 2.933 1.00 0.36 H new ATOM 0 HB3 ASN A 71 12.029 -8.404 1.288 1.00 0.36 H new ATOM 0 HD21 ASN A 71 14.585 -7.845 4.356 1.00 1.53 H new ATOM 0 HD22 ASN A 71 12.903 -8.358 4.521 1.00 1.53 H new ATOM 1058 N HIS A 72 11.735 -5.882 -0.430 1.00 0.35 N ATOM 1059 CA HIS A 72 12.381 -5.165 -1.521 1.00 0.42 C ATOM 1060 C HIS A 72 11.850 -3.744 -1.580 1.00 0.41 C ATOM 1061 O HIS A 72 12.617 -2.785 -1.625 1.00 0.43 O ATOM 1062 CB HIS A 72 12.146 -5.857 -2.864 1.00 0.51 C ATOM 1063 CG HIS A 72 13.127 -6.945 -3.167 1.00 1.07 C ATOM 1064 ND1 HIS A 72 14.492 -6.757 -3.129 1.00 2.09 N ATOM 1065 CD2 HIS A 72 12.936 -8.230 -3.546 1.00 1.39 C ATOM 1066 CE1 HIS A 72 15.099 -7.877 -3.473 1.00 2.99 C ATOM 1067 NE2 HIS A 72 14.178 -8.787 -3.731 1.00 2.56 N ATOM 0 H HIS A 72 11.008 -6.534 -0.726 1.00 0.35 H new ATOM 0 HA HIS A 72 13.454 -5.155 -1.330 1.00 0.42 H new ATOM 0 HB2 HIS A 72 11.140 -6.276 -2.874 1.00 0.51 H new ATOM 0 HB3 HIS A 72 12.189 -5.111 -3.658 1.00 0.51 H new ATOM 0 HD2 HIS A 72 11.985 -8.725 -3.678 1.00 1.39 H new ATOM 0 HE1 HIS A 72 16.167 -8.024 -3.533 1.00 2.99 H new ATOM 0 HE2 HIS A 72 14.359 -9.748 -4.021 1.00 2.56 H new ATOM 1076 N THR A 73 10.525 -3.619 -1.564 1.00 0.45 N ATOM 1077 CA THR A 73 9.886 -2.310 -1.596 1.00 0.49 C ATOM 1078 C THR A 73 10.388 -1.462 -0.432 1.00 0.46 C ATOM 1079 O THR A 73 10.250 -0.239 -0.431 1.00 0.47 O ATOM 1080 CB THR A 73 8.365 -2.458 -1.528 1.00 0.58 C ATOM 1081 OG1 THR A 73 7.965 -2.997 -0.283 1.00 0.62 O ATOM 1082 CG2 THR A 73 7.803 -3.350 -2.614 1.00 0.66 C ATOM 0 H THR A 73 9.877 -4.406 -1.529 1.00 0.45 H new ATOM 0 HA THR A 73 10.142 -1.814 -2.532 1.00 0.49 H new ATOM 0 HB THR A 73 7.973 -1.450 -1.664 1.00 0.58 H new ATOM 0 HG1 THR A 73 8.726 -3.450 0.137 1.00 0.62 H new ATOM 0 HG21 THR A 73 6.720 -3.413 -2.509 1.00 0.66 H new ATOM 0 HG22 THR A 73 8.049 -2.933 -3.591 1.00 0.66 H new ATOM 0 HG23 THR A 73 8.234 -4.347 -2.525 1.00 0.66 H new ATOM 1090 N GLN A 74 10.980 -2.133 0.551 1.00 0.49 N ATOM 1091 CA GLN A 74 11.522 -1.468 1.727 1.00 0.49 C ATOM 1092 C GLN A 74 12.631 -0.492 1.345 1.00 0.43 C ATOM 1093 O GLN A 74 12.734 0.593 1.916 1.00 0.45 O ATOM 1094 CB GLN A 74 12.058 -2.501 2.720 1.00 0.60 C ATOM 1095 CG GLN A 74 10.969 -3.283 3.434 1.00 0.65 C ATOM 1096 CD GLN A 74 10.042 -2.390 4.234 1.00 0.87 C ATOM 1097 OE1 GLN A 74 10.472 -1.701 5.158 1.00 1.66 O ATOM 1098 NE2 GLN A 74 8.762 -2.394 3.880 1.00 1.05 N ATOM 0 H GLN A 74 11.096 -3.146 0.554 1.00 0.49 H new ATOM 0 HA GLN A 74 10.715 -0.904 2.195 1.00 0.49 H new ATOM 0 HB2 GLN A 74 12.707 -3.199 2.190 1.00 0.60 H new ATOM 0 HB3 GLN A 74 12.674 -1.993 3.462 1.00 0.60 H new ATOM 0 HG2 GLN A 74 10.387 -3.841 2.701 1.00 0.65 H new ATOM 0 HG3 GLN A 74 11.428 -4.014 4.100 1.00 0.65 H new ATOM 0 HE21 GLN A 74 8.448 -2.981 3.107 1.00 1.05 H new ATOM 0 HE22 GLN A 74 8.092 -1.810 4.381 1.00 1.05 H new ATOM 1107 N ARG A 75 13.463 -0.882 0.383 1.00 0.44 N ATOM 1108 CA ARG A 75 14.560 -0.030 -0.058 1.00 0.46 C ATOM 1109 C ARG A 75 14.028 1.182 -0.807 1.00 0.43 C ATOM 1110 O ARG A 75 14.707 2.197 -0.915 1.00 0.52 O ATOM 1111 CB ARG A 75 15.531 -0.802 -0.952 1.00 0.59 C ATOM 1112 CG ARG A 75 14.986 -1.098 -2.339 1.00 1.17 C ATOM 1113 CD ARG A 75 15.944 -1.954 -3.149 1.00 1.93 C ATOM 1114 NE ARG A 75 15.406 -2.272 -4.469 1.00 2.51 N ATOM 1115 CZ ARG A 75 16.040 -3.021 -5.366 1.00 2.97 C ATOM 1116 NH1 ARG A 75 17.238 -3.519 -5.093 1.00 3.08 N ATOM 1117 NH2 ARG A 75 15.473 -3.273 -6.538 1.00 3.82 N ATOM 0 H ARG A 75 13.398 -1.777 -0.102 1.00 0.44 H new ATOM 0 HA ARG A 75 15.096 0.305 0.830 1.00 0.46 H new ATOM 0 HB2 ARG A 75 16.454 -0.230 -1.049 1.00 0.59 H new ATOM 0 HB3 ARG A 75 15.789 -1.742 -0.465 1.00 0.59 H new ATOM 0 HG2 ARG A 75 14.027 -1.609 -2.252 1.00 1.17 H new ATOM 0 HG3 ARG A 75 14.802 -0.161 -2.865 1.00 1.17 H new ATOM 0 HD2 ARG A 75 16.893 -1.430 -3.260 1.00 1.93 H new ATOM 0 HD3 ARG A 75 16.151 -2.878 -2.609 1.00 1.93 H new ATOM 0 HE ARG A 75 14.490 -1.898 -4.717 1.00 2.51 H new ATOM 0 HH11 ARG A 75 17.677 -3.328 -4.192 1.00 3.08 H new ATOM 0 HH12 ARG A 75 17.721 -4.093 -5.784 1.00 3.08 H new ATOM 0 HH21 ARG A 75 14.551 -2.892 -6.751 1.00 3.82 H new ATOM 0 HH22 ARG A 75 15.959 -3.848 -7.227 1.00 3.82 H new ATOM 1131 N ILE A 76 12.801 1.075 -1.307 1.00 0.43 N ATOM 1132 CA ILE A 76 12.181 2.177 -2.030 1.00 0.48 C ATOM 1133 C ILE A 76 11.942 3.325 -1.069 1.00 0.49 C ATOM 1134 O ILE A 76 11.865 4.490 -1.458 1.00 0.60 O ATOM 1135 CB ILE A 76 10.848 1.756 -2.680 1.00 0.53 C ATOM 1136 CG1 ILE A 76 11.069 0.542 -3.587 1.00 0.62 C ATOM 1137 CG2 ILE A 76 10.255 2.918 -3.468 1.00 0.64 C ATOM 1138 CD1 ILE A 76 9.805 0.035 -4.248 1.00 1.42 C ATOM 0 H ILE A 76 12.220 0.241 -1.225 1.00 0.43 H new ATOM 0 HA ILE A 76 12.855 2.485 -2.830 1.00 0.48 H new ATOM 0 HB ILE A 76 10.142 1.480 -1.897 1.00 0.53 H new ATOM 0 HG12 ILE A 76 11.792 0.804 -4.360 1.00 0.62 H new ATOM 0 HG13 ILE A 76 11.509 -0.264 -2.999 1.00 0.62 H new ATOM 0 HG21 ILE A 76 9.314 2.607 -3.922 1.00 0.64 H new ATOM 0 HG22 ILE A 76 10.074 3.758 -2.797 1.00 0.64 H new ATOM 0 HG23 ILE A 76 10.952 3.221 -4.249 1.00 0.64 H new ATOM 0 HD11 ILE A 76 10.042 -0.825 -4.874 1.00 1.42 H new ATOM 0 HD12 ILE A 76 9.087 -0.260 -3.483 1.00 1.42 H new ATOM 0 HD13 ILE A 76 9.375 0.825 -4.864 1.00 1.42 H new ATOM 1150 N GLU A 77 11.853 2.967 0.205 1.00 0.45 N ATOM 1151 CA GLU A 77 11.650 3.930 1.268 1.00 0.52 C ATOM 1152 C GLU A 77 12.929 4.727 1.501 1.00 0.52 C ATOM 1153 O GLU A 77 12.888 5.896 1.883 1.00 0.71 O ATOM 1154 CB GLU A 77 11.240 3.199 2.546 1.00 0.59 C ATOM 1155 CG GLU A 77 9.868 2.553 2.466 1.00 0.95 C ATOM 1156 CD GLU A 77 9.487 1.841 3.750 1.00 1.15 C ATOM 1157 OE1 GLU A 77 10.211 0.902 4.146 1.00 1.59 O ATOM 1158 OE2 GLU A 77 8.466 2.222 4.360 1.00 1.52 O ATOM 0 H GLU A 77 11.920 2.001 0.526 1.00 0.45 H new ATOM 0 HA GLU A 77 10.857 4.622 0.983 1.00 0.52 H new ATOM 0 HB2 GLU A 77 11.981 2.431 2.769 1.00 0.59 H new ATOM 0 HB3 GLU A 77 11.252 3.904 3.377 1.00 0.59 H new ATOM 0 HG2 GLU A 77 9.123 3.316 2.242 1.00 0.95 H new ATOM 0 HG3 GLU A 77 9.852 1.841 1.641 1.00 0.95 H new ATOM 1165 N LEU A 78 14.064 4.077 1.260 1.00 0.47 N ATOM 1166 CA LEU A 78 15.366 4.710 1.435 1.00 0.56 C ATOM 1167 C LEU A 78 15.772 5.472 0.179 1.00 0.57 C ATOM 1168 O LEU A 78 16.245 6.608 0.253 1.00 0.66 O ATOM 1169 CB LEU A 78 16.424 3.651 1.758 1.00 0.63 C ATOM 1170 CG LEU A 78 16.099 2.740 2.944 1.00 0.71 C ATOM 1171 CD1 LEU A 78 17.180 1.685 3.115 1.00 0.83 C ATOM 1172 CD2 LEU A 78 15.943 3.553 4.219 1.00 0.84 C ATOM 0 H LEU A 78 14.107 3.109 0.942 1.00 0.47 H new ATOM 0 HA LEU A 78 15.293 5.416 2.262 1.00 0.56 H new ATOM 0 HB2 LEU A 78 16.574 3.030 0.875 1.00 0.63 H new ATOM 0 HB3 LEU A 78 17.370 4.155 1.957 1.00 0.63 H new ATOM 0 HG LEU A 78 15.153 2.238 2.741 1.00 0.71 H new ATOM 0 HD11 LEU A 78 16.934 1.046 3.963 1.00 0.83 H new ATOM 0 HD12 LEU A 78 17.244 1.080 2.211 1.00 0.83 H new ATOM 0 HD13 LEU A 78 18.139 2.172 3.295 1.00 0.83 H new ATOM 0 HD21 LEU A 78 15.712 2.886 5.050 1.00 0.84 H new ATOM 0 HD22 LEU A 78 16.871 4.085 4.427 1.00 0.84 H new ATOM 0 HD23 LEU A 78 15.133 4.272 4.095 1.00 0.84 H new ATOM 1184 N GLN A 79 15.600 4.832 -0.973 1.00 0.56 N ATOM 1185 CA GLN A 79 15.960 5.439 -2.252 1.00 0.63 C ATOM 1186 C GLN A 79 15.170 6.716 -2.520 1.00 0.66 C ATOM 1187 O GLN A 79 15.594 7.559 -3.313 1.00 0.84 O ATOM 1188 CB GLN A 79 15.732 4.451 -3.391 1.00 0.67 C ATOM 1189 CG GLN A 79 16.446 3.130 -3.193 1.00 0.93 C ATOM 1190 CD GLN A 79 16.503 2.305 -4.460 1.00 1.22 C ATOM 1191 OE1 GLN A 79 17.085 2.722 -5.462 1.00 1.95 O ATOM 1192 NE2 GLN A 79 15.894 1.129 -4.424 1.00 1.30 N ATOM 0 H GLN A 79 15.213 3.891 -1.048 1.00 0.56 H new ATOM 0 HA GLN A 79 17.017 5.701 -2.198 1.00 0.63 H new ATOM 0 HB2 GLN A 79 14.663 4.266 -3.493 1.00 0.67 H new ATOM 0 HB3 GLN A 79 16.068 4.901 -4.325 1.00 0.67 H new ATOM 0 HG2 GLN A 79 17.460 3.318 -2.840 1.00 0.93 H new ATOM 0 HG3 GLN A 79 15.939 2.560 -2.415 1.00 0.93 H new ATOM 0 HE21 GLN A 79 15.424 0.824 -3.572 1.00 1.30 H new ATOM 0 HE22 GLN A 79 15.895 0.529 -5.249 1.00 1.30 H new ATOM 1201 N GLN A 80 14.018 6.861 -1.869 1.00 0.54 N ATOM 1202 CA GLN A 80 13.186 8.041 -2.061 1.00 0.59 C ATOM 1203 C GLN A 80 13.625 9.162 -1.129 1.00 0.68 C ATOM 1204 O GLN A 80 13.260 10.323 -1.320 1.00 0.78 O ATOM 1205 CB GLN A 80 11.712 7.692 -1.828 1.00 0.54 C ATOM 1206 CG GLN A 80 10.755 8.852 -2.063 1.00 0.99 C ATOM 1207 CD GLN A 80 10.910 9.478 -3.438 1.00 0.98 C ATOM 1208 OE1 GLN A 80 11.936 10.084 -3.746 1.00 1.68 O ATOM 1209 NE2 GLN A 80 9.891 9.328 -4.275 1.00 0.74 N ATOM 0 H GLN A 80 13.643 6.180 -1.209 1.00 0.54 H new ATOM 0 HA GLN A 80 13.303 8.387 -3.088 1.00 0.59 H new ATOM 0 HB2 GLN A 80 11.436 6.868 -2.486 1.00 0.54 H new ATOM 0 HB3 GLN A 80 11.591 7.337 -0.805 1.00 0.54 H new ATOM 0 HG2 GLN A 80 9.730 8.501 -1.943 1.00 0.99 H new ATOM 0 HG3 GLN A 80 10.922 9.614 -1.302 1.00 0.99 H new ATOM 0 HE21 GLN A 80 9.059 8.818 -3.979 1.00 0.74 H new ATOM 0 HE22 GLN A 80 9.940 9.723 -5.214 1.00 0.74 H new ATOM 1218 N GLY A 81 14.413 8.807 -0.120 1.00 0.74 N ATOM 1219 CA GLY A 81 14.890 9.790 0.825 1.00 0.88 C ATOM 1220 C GLY A 81 13.905 10.009 1.947 1.00 0.89 C ATOM 1221 O GLY A 81 13.570 11.149 2.271 1.00 0.99 O ATOM 0 H GLY A 81 14.728 7.853 0.057 1.00 0.74 H new ATOM 0 HA2 GLY A 81 15.845 9.465 1.237 1.00 0.88 H new ATOM 0 HA3 GLY A 81 15.070 10.733 0.309 1.00 0.88 H new ATOM 1225 N ARG A 82 13.437 8.916 2.541 1.00 0.95 N ATOM 1226 CA ARG A 82 12.480 9.004 3.632 1.00 1.07 C ATOM 1227 C ARG A 82 13.038 9.877 4.744 1.00 1.09 C ATOM 1228 O ARG A 82 14.222 10.214 4.751 1.00 1.50 O ATOM 1229 CB ARG A 82 12.123 7.614 4.167 1.00 1.34 C ATOM 1230 CG ARG A 82 13.269 6.902 4.861 1.00 1.78 C ATOM 1231 CD ARG A 82 12.853 5.510 5.309 1.00 2.05 C ATOM 1232 NE ARG A 82 13.862 4.882 6.158 1.00 2.68 N ATOM 1233 CZ ARG A 82 13.716 3.683 6.713 1.00 3.14 C ATOM 1234 NH1 ARG A 82 12.612 2.979 6.503 1.00 3.20 N ATOM 1235 NH2 ARG A 82 14.677 3.185 7.480 1.00 3.90 N ATOM 0 H ARG A 82 13.704 7.965 2.285 1.00 0.95 H new ATOM 0 HA ARG A 82 11.566 9.458 3.250 1.00 1.07 H new ATOM 0 HB2 ARG A 82 11.292 7.708 4.866 1.00 1.34 H new ATOM 0 HB3 ARG A 82 11.775 6.997 3.339 1.00 1.34 H new ATOM 0 HG2 ARG A 82 14.121 6.831 4.185 1.00 1.78 H new ATOM 0 HG3 ARG A 82 13.594 7.484 5.724 1.00 1.78 H new ATOM 0 HD2 ARG A 82 11.910 5.571 5.852 1.00 2.05 H new ATOM 0 HD3 ARG A 82 12.677 4.885 4.433 1.00 2.05 H new ATOM 0 HE ARG A 82 14.727 5.392 6.335 1.00 2.68 H new ATOM 0 HH11 ARG A 82 11.870 3.357 5.913 1.00 3.20 H new ATOM 0 HH12 ARG A 82 12.504 2.059 6.931 1.00 3.20 H new ATOM 0 HH21 ARG A 82 15.528 3.722 7.644 1.00 3.90 H new ATOM 0 HH22 ARG A 82 14.564 2.265 7.906 1.00 3.90 H new ATOM 1249 N VAL A 83 12.176 10.262 5.669 1.00 1.01 N ATOM 1250 CA VAL A 83 12.583 11.120 6.763 1.00 1.24 C ATOM 1251 C VAL A 83 12.369 10.441 8.109 1.00 1.17 C ATOM 1252 O VAL A 83 11.290 10.510 8.700 1.00 1.65 O ATOM 1253 CB VAL A 83 11.827 12.453 6.699 1.00 1.94 C ATOM 1254 CG1 VAL A 83 12.406 13.451 7.689 1.00 2.77 C ATOM 1255 CG2 VAL A 83 11.875 12.992 5.275 1.00 2.45 C ATOM 0 H VAL A 83 11.192 9.994 5.683 1.00 1.01 H new ATOM 0 HA VAL A 83 13.650 11.317 6.661 1.00 1.24 H new ATOM 0 HB VAL A 83 10.786 12.291 6.977 1.00 1.94 H new ATOM 0 HG11 VAL A 83 11.854 14.389 7.625 1.00 2.77 H new ATOM 0 HG12 VAL A 83 12.325 13.050 8.699 1.00 2.77 H new ATOM 0 HG13 VAL A 83 13.455 13.631 7.453 1.00 2.77 H new ATOM 0 HG21 VAL A 83 11.338 13.940 5.226 1.00 2.45 H new ATOM 0 HG22 VAL A 83 12.913 13.147 4.979 1.00 2.45 H new ATOM 0 HG23 VAL A 83 11.408 12.276 4.599 1.00 2.45 H new ATOM 1265 N ARG A 84 13.415 9.765 8.564 1.00 1.26 N ATOM 1266 CA ARG A 84 13.399 9.030 9.818 1.00 1.64 C ATOM 1267 C ARG A 84 13.034 9.906 11.012 1.00 1.64 C ATOM 1268 O ARG A 84 13.677 10.917 11.292 1.00 2.28 O ATOM 1269 CB ARG A 84 14.760 8.373 10.052 1.00 2.64 C ATOM 1270 CG ARG A 84 15.924 9.347 9.984 1.00 3.46 C ATOM 1271 CD ARG A 84 17.253 8.636 10.180 1.00 4.08 C ATOM 1272 NE ARG A 84 18.387 9.555 10.097 1.00 4.79 N ATOM 1273 CZ ARG A 84 18.584 10.571 10.934 1.00 5.36 C ATOM 1274 NH1 ARG A 84 17.730 10.799 11.924 1.00 5.36 N ATOM 1275 NH2 ARG A 84 19.638 11.360 10.782 1.00 6.26 N ATOM 0 H ARG A 84 14.305 9.712 8.068 1.00 1.26 H new ATOM 0 HA ARG A 84 12.624 8.268 9.732 1.00 1.64 H new ATOM 0 HB2 ARG A 84 14.758 7.890 11.029 1.00 2.64 H new ATOM 0 HB3 ARG A 84 14.909 7.589 9.309 1.00 2.64 H new ATOM 0 HG2 ARG A 84 15.920 9.855 9.019 1.00 3.46 H new ATOM 0 HG3 ARG A 84 15.804 10.114 10.749 1.00 3.46 H new ATOM 0 HD2 ARG A 84 17.259 8.141 11.151 1.00 4.08 H new ATOM 0 HD3 ARG A 84 17.362 7.858 9.425 1.00 4.08 H new ATOM 0 HE ARG A 84 19.069 9.409 9.352 1.00 4.79 H new ATOM 0 HH11 ARG A 84 16.918 10.194 12.046 1.00 5.36 H new ATOM 0 HH12 ARG A 84 17.886 11.579 12.563 1.00 5.36 H new ATOM 0 HH21 ARG A 84 20.298 11.189 10.024 1.00 6.26 H new ATOM 0 HH22 ARG A 84 19.789 12.139 11.423 1.00 6.26 H new ATOM 1289 N LYS A 85 12.004 9.467 11.717 1.00 1.79 N ATOM 1290 CA LYS A 85 11.506 10.130 12.914 1.00 2.53 C ATOM 1291 C LYS A 85 10.818 9.083 13.775 1.00 2.61 C ATOM 1292 O LYS A 85 11.472 8.367 14.535 1.00 3.08 O ATOM 1293 CB LYS A 85 10.549 11.272 12.551 1.00 3.13 C ATOM 1294 CG LYS A 85 11.251 12.494 11.974 1.00 3.58 C ATOM 1295 CD LYS A 85 10.264 13.577 11.554 1.00 4.39 C ATOM 1296 CE LYS A 85 9.486 13.186 10.306 1.00 5.02 C ATOM 1297 NZ LYS A 85 8.587 12.022 10.537 1.00 5.50 N ATOM 0 H LYS A 85 11.481 8.627 11.471 1.00 1.79 H new ATOM 0 HA LYS A 85 12.331 10.579 13.467 1.00 2.53 H new ATOM 0 HB2 LYS A 85 9.819 10.908 11.828 1.00 3.13 H new ATOM 0 HB3 LYS A 85 9.995 11.568 13.442 1.00 3.13 H new ATOM 0 HG2 LYS A 85 11.940 12.899 12.715 1.00 3.58 H new ATOM 0 HG3 LYS A 85 11.849 12.195 11.113 1.00 3.58 H new ATOM 0 HD2 LYS A 85 9.567 13.769 12.370 1.00 4.39 H new ATOM 0 HD3 LYS A 85 10.803 14.506 11.369 1.00 4.39 H new ATOM 0 HE2 LYS A 85 8.894 14.037 9.969 1.00 5.02 H new ATOM 0 HE3 LYS A 85 10.186 12.947 9.505 1.00 5.02 H new ATOM 0 HZ1 LYS A 85 7.812 12.039 9.844 1.00 5.50 H new ATOM 0 HZ2 LYS A 85 9.127 11.140 10.430 1.00 5.50 H new ATOM 0 HZ3 LYS A 85 8.193 12.073 11.498 1.00 5.50 H new ATOM 1311 N ALA A 86 9.512 8.945 13.605 1.00 2.48 N ATOM 1312 CA ALA A 86 8.765 7.923 14.317 1.00 2.58 C ATOM 1313 C ALA A 86 7.683 7.357 13.410 1.00 2.00 C ATOM 1314 O ALA A 86 6.688 8.019 13.126 1.00 1.95 O ATOM 1315 CB ALA A 86 8.154 8.498 15.588 1.00 3.19 C ATOM 0 H ALA A 86 8.950 9.526 12.982 1.00 2.48 H new ATOM 0 HA ALA A 86 9.443 7.119 14.603 1.00 2.58 H new ATOM 0 HB1 ALA A 86 7.598 7.719 16.109 1.00 3.19 H new ATOM 0 HB2 ALA A 86 8.947 8.873 16.235 1.00 3.19 H new ATOM 0 HB3 ALA A 86 7.480 9.315 15.330 1.00 3.19 H new ATOM 1321 N GLU A 87 7.882 6.125 12.962 1.00 2.01 N ATOM 1322 CA GLU A 87 6.920 5.460 12.092 1.00 1.67 C ATOM 1323 C GLU A 87 6.552 4.084 12.637 1.00 1.90 C ATOM 1324 O GLU A 87 7.178 3.085 12.286 1.00 2.39 O ATOM 1325 CB GLU A 87 7.476 5.358 10.668 1.00 2.04 C ATOM 1326 CG GLU A 87 6.616 4.520 9.733 1.00 2.47 C ATOM 1327 CD GLU A 87 7.248 4.339 8.366 1.00 3.23 C ATOM 1328 OE1 GLU A 87 8.366 3.785 8.298 1.00 3.66 O ATOM 1329 OE2 GLU A 87 6.625 4.746 7.364 1.00 3.80 O ATOM 0 H GLU A 87 8.703 5.564 13.187 1.00 2.01 H new ATOM 0 HA GLU A 87 6.009 6.058 12.063 1.00 1.67 H new ATOM 0 HB2 GLU A 87 7.576 6.361 10.254 1.00 2.04 H new ATOM 0 HB3 GLU A 87 8.477 4.929 10.708 1.00 2.04 H new ATOM 0 HG2 GLU A 87 6.444 3.542 10.182 1.00 2.47 H new ATOM 0 HG3 GLU A 87 5.641 4.994 9.619 1.00 2.47 H new ATOM 1336 N ARG A 88 5.544 4.035 13.498 1.00 1.97 N ATOM 1337 CA ARG A 88 5.119 2.768 14.079 1.00 2.47 C ATOM 1338 C ARG A 88 3.840 2.269 13.415 1.00 2.28 C ATOM 1339 O ARG A 88 3.801 1.168 12.867 1.00 2.54 O ATOM 1340 CB ARG A 88 4.897 2.928 15.585 1.00 2.97 C ATOM 1341 CG ARG A 88 6.121 3.444 16.325 1.00 3.30 C ATOM 1342 CD ARG A 88 5.852 3.593 17.812 1.00 3.95 C ATOM 1343 NE ARG A 88 7.000 4.152 18.522 1.00 4.47 N ATOM 1344 CZ ARG A 88 7.019 4.376 19.834 1.00 5.01 C ATOM 1345 NH1 ARG A 88 5.962 4.079 20.576 1.00 5.17 N ATOM 1346 NH2 ARG A 88 8.098 4.897 20.403 1.00 5.74 N ATOM 0 H ARG A 88 5.011 4.848 13.807 1.00 1.97 H new ATOM 0 HA ARG A 88 5.906 2.033 13.909 1.00 2.47 H new ATOM 0 HB2 ARG A 88 4.066 3.613 15.751 1.00 2.97 H new ATOM 0 HB3 ARG A 88 4.606 1.966 16.006 1.00 2.97 H new ATOM 0 HG2 ARG A 88 6.955 2.759 16.172 1.00 3.30 H new ATOM 0 HG3 ARG A 88 6.419 4.407 15.910 1.00 3.30 H new ATOM 0 HD2 ARG A 88 4.985 4.237 17.961 1.00 3.95 H new ATOM 0 HD3 ARG A 88 5.603 2.620 18.235 1.00 3.95 H new ATOM 0 HE ARG A 88 7.834 4.384 17.982 1.00 4.47 H new ATOM 0 HH11 ARG A 88 5.131 3.678 20.142 1.00 5.17 H new ATOM 0 HH12 ARG A 88 5.980 4.252 21.581 1.00 5.17 H new ATOM 0 HH21 ARG A 88 8.914 5.126 19.835 1.00 5.74 H new ATOM 0 HH22 ARG A 88 8.112 5.068 21.408 1.00 5.74 H new ATOM 1360 N TRP A 89 2.797 3.090 13.464 1.00 1.98 N ATOM 1361 CA TRP A 89 1.517 2.737 12.865 1.00 1.91 C ATOM 1362 C TRP A 89 1.090 3.779 11.832 1.00 1.60 C ATOM 1363 O TRP A 89 -0.038 3.756 11.341 1.00 1.71 O ATOM 1364 CB TRP A 89 0.450 2.602 13.958 1.00 2.11 C ATOM 1365 CG TRP A 89 -0.864 2.075 13.462 1.00 2.00 C ATOM 1366 CD1 TRP A 89 -1.074 0.929 12.750 1.00 2.28 C ATOM 1367 CD2 TRP A 89 -2.150 2.682 13.637 1.00 2.29 C ATOM 1368 NE1 TRP A 89 -2.413 0.783 12.476 1.00 2.69 N ATOM 1369 CE2 TRP A 89 -3.093 1.847 13.008 1.00 2.74 C ATOM 1370 CE3 TRP A 89 -2.594 3.847 14.264 1.00 2.65 C ATOM 1371 CZ2 TRP A 89 -4.454 2.143 12.991 1.00 3.44 C ATOM 1372 CZ3 TRP A 89 -3.945 4.141 14.245 1.00 3.33 C ATOM 1373 CH2 TRP A 89 -4.860 3.292 13.612 1.00 3.70 C ATOM 0 H TRP A 89 2.814 4.006 13.913 1.00 1.98 H new ATOM 0 HA TRP A 89 1.627 1.781 12.353 1.00 1.91 H new ATOM 0 HB2 TRP A 89 0.825 1.940 14.738 1.00 2.11 H new ATOM 0 HB3 TRP A 89 0.289 3.577 14.418 1.00 2.11 H new ATOM 0 HD1 TRP A 89 -0.301 0.238 12.447 1.00 2.28 H new ATOM 0 HE1 TRP A 89 -2.832 0.009 11.961 1.00 2.69 H new ATOM 0 HE3 TRP A 89 -1.895 4.507 14.755 1.00 2.65 H new ATOM 0 HZ2 TRP A 89 -5.163 1.489 12.505 1.00 3.44 H new ATOM 0 HZ3 TRP A 89 -4.300 5.040 14.726 1.00 3.33 H new ATOM 0 HH2 TRP A 89 -5.909 3.550 13.614 1.00 3.70 H new ATOM 1384 N GLY A 90 1.989 4.709 11.515 1.00 1.35 N ATOM 1385 CA GLY A 90 1.652 5.748 10.559 1.00 1.15 C ATOM 1386 C GLY A 90 2.646 5.902 9.425 1.00 1.08 C ATOM 1387 O GLY A 90 3.652 5.197 9.374 1.00 1.29 O ATOM 0 H GLY A 90 2.933 4.761 11.898 1.00 1.35 H new ATOM 0 HA2 GLY A 90 0.670 5.533 10.138 1.00 1.15 H new ATOM 0 HA3 GLY A 90 1.571 6.698 11.087 1.00 1.15 H new ATOM 1391 N PRO A 91 2.371 6.827 8.480 1.00 0.96 N ATOM 1392 CA PRO A 91 3.234 7.077 7.317 1.00 1.07 C ATOM 1393 C PRO A 91 4.537 7.793 7.679 1.00 1.17 C ATOM 1394 O PRO A 91 5.616 7.207 7.580 1.00 1.60 O ATOM 1395 CB PRO A 91 2.364 7.974 6.409 1.00 1.09 C ATOM 1396 CG PRO A 91 0.987 7.877 6.975 1.00 1.09 C ATOM 1397 CD PRO A 91 1.188 7.699 8.447 1.00 0.91 C ATOM 0 HA PRO A 91 3.551 6.145 6.850 1.00 1.07 H new ATOM 0 HB2 PRO A 91 2.721 9.004 6.413 1.00 1.09 H new ATOM 0 HB3 PRO A 91 2.390 7.632 5.374 1.00 1.09 H new ATOM 0 HG2 PRO A 91 0.408 8.775 6.761 1.00 1.09 H new ATOM 0 HG3 PRO A 91 0.442 7.036 6.546 1.00 1.09 H new ATOM 0 HD2 PRO A 91 1.364 8.648 8.954 1.00 0.91 H new ATOM 0 HD3 PRO A 91 0.325 7.237 8.926 1.00 0.91 H new ATOM 1405 N ARG A 92 4.432 9.071 8.061 1.00 0.93 N ATOM 1406 CA ARG A 92 5.601 9.889 8.404 1.00 1.03 C ATOM 1407 C ARG A 92 6.383 10.259 7.145 1.00 1.13 C ATOM 1408 O ARG A 92 7.140 11.225 7.132 1.00 1.95 O ATOM 1409 CB ARG A 92 6.488 9.178 9.447 1.00 1.21 C ATOM 1410 CG ARG A 92 7.990 9.226 9.171 1.00 1.04 C ATOM 1411 CD ARG A 92 8.439 8.011 8.380 1.00 1.71 C ATOM 1412 NE ARG A 92 9.892 7.863 8.386 1.00 2.57 N ATOM 1413 CZ ARG A 92 10.528 6.825 7.854 1.00 3.53 C ATOM 1414 NH1 ARG A 92 9.845 5.867 7.240 1.00 3.96 N ATOM 1415 NH2 ARG A 92 11.848 6.746 7.932 1.00 4.39 N ATOM 0 H ARG A 92 3.543 9.564 8.141 1.00 0.93 H new ATOM 0 HA ARG A 92 5.254 10.816 8.860 1.00 1.03 H new ATOM 0 HB2 ARG A 92 6.301 9.625 10.423 1.00 1.21 H new ATOM 0 HB3 ARG A 92 6.180 8.134 9.510 1.00 1.21 H new ATOM 0 HG2 ARG A 92 8.233 10.134 8.618 1.00 1.04 H new ATOM 0 HG3 ARG A 92 8.535 9.272 10.114 1.00 1.04 H new ATOM 0 HD2 ARG A 92 7.981 7.115 8.800 1.00 1.71 H new ATOM 0 HD3 ARG A 92 8.087 8.097 7.352 1.00 1.71 H new ATOM 0 HE ARG A 92 10.449 8.597 8.823 1.00 2.57 H new ATOM 0 HH11 ARG A 92 8.829 5.926 7.175 1.00 3.96 H new ATOM 0 HH12 ARG A 92 10.336 5.071 6.833 1.00 3.96 H new ATOM 0 HH21 ARG A 92 12.376 7.482 8.401 1.00 4.39 H new ATOM 0 HH22 ARG A 92 12.336 5.949 7.524 1.00 4.39 H new ATOM 1429 N THR A 93 6.138 9.489 6.091 1.00 0.94 N ATOM 1430 CA THR A 93 6.751 9.683 4.773 1.00 0.91 C ATOM 1431 C THR A 93 6.114 8.720 3.778 1.00 0.83 C ATOM 1432 O THR A 93 5.042 8.990 3.242 1.00 1.08 O ATOM 1433 CB THR A 93 8.272 9.458 4.791 1.00 1.02 C ATOM 1434 OG1 THR A 93 8.602 8.290 5.515 1.00 1.52 O ATOM 1435 CG2 THR A 93 9.067 10.608 5.366 1.00 1.47 C ATOM 0 H THR A 93 5.497 8.697 6.124 1.00 0.94 H new ATOM 0 HA THR A 93 6.577 10.718 4.480 1.00 0.91 H new ATOM 0 HB THR A 93 8.546 9.362 3.740 1.00 1.02 H new ATOM 0 HG1 THR A 93 9.473 8.409 5.948 1.00 1.52 H new ATOM 0 HG21 THR A 93 10.129 10.365 5.340 1.00 1.47 H new ATOM 0 HG22 THR A 93 8.886 11.506 4.776 1.00 1.47 H new ATOM 0 HG23 THR A 93 8.760 10.783 6.397 1.00 1.47 H new ATOM 1443 N LEU A 94 6.772 7.588 3.550 1.00 0.68 N ATOM 1444 CA LEU A 94 6.264 6.576 2.632 1.00 0.64 C ATOM 1445 C LEU A 94 6.447 5.192 3.232 1.00 0.56 C ATOM 1446 O LEU A 94 7.481 4.895 3.830 1.00 0.71 O ATOM 1447 CB LEU A 94 6.982 6.657 1.280 1.00 0.72 C ATOM 1448 CG LEU A 94 8.447 6.211 1.286 1.00 1.00 C ATOM 1449 CD1 LEU A 94 8.982 6.132 -0.136 1.00 1.44 C ATOM 1450 CD2 LEU A 94 9.301 7.157 2.117 1.00 1.87 C ATOM 0 H LEU A 94 7.661 7.348 3.990 1.00 0.68 H new ATOM 0 HA LEU A 94 5.202 6.761 2.470 1.00 0.64 H new ATOM 0 HB2 LEU A 94 6.437 6.045 0.561 1.00 0.72 H new ATOM 0 HB3 LEU A 94 6.935 7.686 0.924 1.00 0.72 H new ATOM 0 HG LEU A 94 8.497 5.220 1.738 1.00 1.00 H new ATOM 0 HD11 LEU A 94 10.024 5.814 -0.115 1.00 1.44 H new ATOM 0 HD12 LEU A 94 8.394 5.413 -0.706 1.00 1.44 H new ATOM 0 HD13 LEU A 94 8.911 7.113 -0.606 1.00 1.44 H new ATOM 0 HD21 LEU A 94 10.337 6.818 2.105 1.00 1.87 H new ATOM 0 HD22 LEU A 94 9.243 8.162 1.699 1.00 1.87 H new ATOM 0 HD23 LEU A 94 8.936 7.170 3.144 1.00 1.87 H new ATOM 1462 N ASP A 95 5.440 4.349 3.066 1.00 0.52 N ATOM 1463 CA ASP A 95 5.493 2.996 3.591 1.00 0.53 C ATOM 1464 C ASP A 95 4.701 2.048 2.705 1.00 0.46 C ATOM 1465 O ASP A 95 3.512 1.809 2.928 1.00 0.59 O ATOM 1466 CB ASP A 95 4.962 2.959 5.025 1.00 0.73 C ATOM 1467 CG ASP A 95 3.543 3.486 5.138 1.00 1.16 C ATOM 1468 OD1 ASP A 95 3.323 4.671 4.812 1.00 1.72 O ATOM 1469 OD2 ASP A 95 2.654 2.713 5.555 1.00 1.64 O ATOM 0 H ASP A 95 4.577 4.579 2.572 1.00 0.52 H new ATOM 0 HA ASP A 95 6.533 2.670 3.599 1.00 0.53 H new ATOM 0 HB2 ASP A 95 4.995 1.934 5.394 1.00 0.73 H new ATOM 0 HB3 ASP A 95 5.617 3.550 5.666 1.00 0.73 H new ATOM 1474 N LEU A 96 5.373 1.503 1.700 1.00 0.38 N ATOM 1475 CA LEU A 96 4.738 0.574 0.782 1.00 0.36 C ATOM 1476 C LEU A 96 4.966 -0.861 1.245 1.00 0.40 C ATOM 1477 O LEU A 96 6.047 -1.426 1.071 1.00 0.53 O ATOM 1478 CB LEU A 96 5.253 0.789 -0.656 1.00 0.43 C ATOM 1479 CG LEU A 96 6.749 0.546 -0.898 1.00 0.52 C ATOM 1480 CD1 LEU A 96 7.042 0.560 -2.388 1.00 0.97 C ATOM 1481 CD2 LEU A 96 7.597 1.595 -0.194 1.00 0.89 C ATOM 0 H LEU A 96 6.356 1.689 1.502 1.00 0.38 H new ATOM 0 HA LEU A 96 3.664 0.763 0.778 1.00 0.36 H new ATOM 0 HB2 LEU A 96 4.690 0.133 -1.320 1.00 0.43 H new ATOM 0 HB3 LEU A 96 5.023 1.813 -0.950 1.00 0.43 H new ATOM 0 HG LEU A 96 7.005 -0.431 -0.487 1.00 0.52 H new ATOM 0 HD11 LEU A 96 8.106 0.387 -2.551 1.00 0.97 H new ATOM 0 HD12 LEU A 96 6.467 -0.225 -2.879 1.00 0.97 H new ATOM 0 HD13 LEU A 96 6.764 1.528 -2.804 1.00 0.97 H new ATOM 0 HD21 LEU A 96 8.652 1.397 -0.383 1.00 0.89 H new ATOM 0 HD22 LEU A 96 7.340 2.584 -0.572 1.00 0.89 H new ATOM 0 HD23 LEU A 96 7.408 1.556 0.879 1.00 0.89 H new ATOM 1493 N ASP A 97 3.936 -1.440 1.859 1.00 0.38 N ATOM 1494 CA ASP A 97 4.014 -2.802 2.372 1.00 0.44 C ATOM 1495 C ASP A 97 2.922 -3.675 1.769 1.00 0.39 C ATOM 1496 O ASP A 97 1.833 -3.197 1.453 1.00 0.40 O ATOM 1497 CB ASP A 97 3.886 -2.803 3.899 1.00 0.55 C ATOM 1498 CG ASP A 97 4.889 -1.880 4.564 1.00 1.14 C ATOM 1499 OD1 ASP A 97 6.105 -2.101 4.391 1.00 1.93 O ATOM 1500 OD2 ASP A 97 4.456 -0.936 5.256 1.00 1.45 O ATOM 0 H ASP A 97 3.037 -0.984 2.012 1.00 0.38 H new ATOM 0 HA ASP A 97 4.984 -3.211 2.090 1.00 0.44 H new ATOM 0 HB2 ASP A 97 2.877 -2.499 4.176 1.00 0.55 H new ATOM 0 HB3 ASP A 97 4.027 -3.817 4.272 1.00 0.55 H new ATOM 1505 N ILE A 98 3.219 -4.962 1.623 1.00 0.39 N ATOM 1506 CA ILE A 98 2.263 -5.910 1.072 1.00 0.36 C ATOM 1507 C ILE A 98 0.979 -5.931 1.894 1.00 0.35 C ATOM 1508 O ILE A 98 0.992 -6.233 3.087 1.00 0.53 O ATOM 1509 CB ILE A 98 2.868 -7.333 0.986 1.00 0.36 C ATOM 1510 CG1 ILE A 98 3.658 -7.481 -0.316 1.00 0.48 C ATOM 1511 CG2 ILE A 98 1.789 -8.404 1.089 1.00 0.44 C ATOM 1512 CD1 ILE A 98 2.800 -7.426 -1.564 1.00 1.20 C ATOM 0 H ILE A 98 4.117 -5.371 1.880 1.00 0.39 H new ATOM 0 HA ILE A 98 2.022 -5.581 0.061 1.00 0.36 H new ATOM 0 HB ILE A 98 3.544 -7.471 1.830 1.00 0.36 H new ATOM 0 HG12 ILE A 98 4.407 -6.691 -0.367 1.00 0.48 H new ATOM 0 HG13 ILE A 98 4.195 -8.429 -0.298 1.00 0.48 H new ATOM 0 HG21 ILE A 98 2.248 -9.390 1.025 1.00 0.44 H new ATOM 0 HG22 ILE A 98 1.270 -8.307 2.042 1.00 0.44 H new ATOM 0 HG23 ILE A 98 1.076 -8.282 0.273 1.00 0.44 H new ATOM 0 HD11 ILE A 98 3.432 -7.538 -2.445 1.00 1.20 H new ATOM 0 HD12 ILE A 98 2.068 -8.233 -1.538 1.00 1.20 H new ATOM 0 HD13 ILE A 98 2.283 -6.468 -1.608 1.00 1.20 H new ATOM 1524 N MET A 99 -0.128 -5.607 1.239 1.00 0.32 N ATOM 1525 CA MET A 99 -1.431 -5.581 1.888 1.00 0.36 C ATOM 1526 C MET A 99 -2.317 -6.679 1.317 1.00 0.33 C ATOM 1527 O MET A 99 -3.347 -7.024 1.895 1.00 0.37 O ATOM 1528 CB MET A 99 -2.096 -4.218 1.694 1.00 0.43 C ATOM 1529 CG MET A 99 -1.229 -3.055 2.139 1.00 0.68 C ATOM 1530 SD MET A 99 -0.749 -3.168 3.873 1.00 1.56 S ATOM 1531 CE MET A 99 0.303 -1.727 4.026 1.00 2.37 C ATOM 0 H MET A 99 -0.148 -5.357 0.250 1.00 0.32 H new ATOM 0 HA MET A 99 -1.293 -5.752 2.956 1.00 0.36 H new ATOM 0 HB2 MET A 99 -2.348 -4.092 0.641 1.00 0.43 H new ATOM 0 HB3 MET A 99 -3.033 -4.197 2.251 1.00 0.43 H new ATOM 0 HG2 MET A 99 -0.333 -3.018 1.520 1.00 0.68 H new ATOM 0 HG3 MET A 99 -1.768 -2.122 1.976 1.00 0.68 H new ATOM 0 HE1 MET A 99 0.778 -1.726 5.007 1.00 2.37 H new ATOM 0 HE2 MET A 99 1.070 -1.752 3.252 1.00 2.37 H new ATOM 0 HE3 MET A 99 -0.297 -0.824 3.912 1.00 2.37 H new ATOM 1541 N LEU A 100 -1.906 -7.217 0.173 1.00 0.30 N ATOM 1542 CA LEU A 100 -2.662 -8.274 -0.491 1.00 0.30 C ATOM 1543 C LEU A 100 -1.852 -8.895 -1.623 1.00 0.31 C ATOM 1544 O LEU A 100 -2.014 -8.526 -2.787 1.00 0.58 O ATOM 1545 CB LEU A 100 -3.983 -7.716 -1.036 1.00 0.30 C ATOM 1546 CG LEU A 100 -5.238 -8.186 -0.302 1.00 0.37 C ATOM 1547 CD1 LEU A 100 -6.475 -7.507 -0.873 1.00 0.40 C ATOM 1548 CD2 LEU A 100 -5.373 -9.699 -0.388 1.00 0.43 C ATOM 0 H LEU A 100 -1.054 -6.939 -0.314 1.00 0.30 H new ATOM 0 HA LEU A 100 -2.877 -9.051 0.243 1.00 0.30 H new ATOM 0 HB2 LEU A 100 -3.944 -6.627 -0.996 1.00 0.30 H new ATOM 0 HB3 LEU A 100 -4.070 -7.993 -2.087 1.00 0.30 H new ATOM 0 HG LEU A 100 -5.146 -7.909 0.748 1.00 0.37 H new ATOM 0 HD11 LEU A 100 -7.360 -7.853 -0.339 1.00 0.40 H new ATOM 0 HD12 LEU A 100 -6.382 -6.427 -0.760 1.00 0.40 H new ATOM 0 HD13 LEU A 100 -6.570 -7.754 -1.930 1.00 0.40 H new ATOM 0 HD21 LEU A 100 -6.273 -10.015 0.141 1.00 0.43 H new ATOM 0 HD22 LEU A 100 -5.442 -9.999 -1.434 1.00 0.43 H new ATOM 0 HD23 LEU A 100 -4.501 -10.169 0.067 1.00 0.43 H new ATOM 1560 N PHE A 101 -0.978 -9.842 -1.284 1.00 0.36 N ATOM 1561 CA PHE A 101 -0.158 -10.498 -2.295 1.00 0.36 C ATOM 1562 C PHE A 101 -0.854 -11.746 -2.831 1.00 0.38 C ATOM 1563 O PHE A 101 -0.588 -12.861 -2.381 1.00 0.88 O ATOM 1564 CB PHE A 101 1.215 -10.872 -1.730 1.00 0.46 C ATOM 1565 CG PHE A 101 2.169 -11.366 -2.782 1.00 0.70 C ATOM 1566 CD1 PHE A 101 2.835 -10.474 -3.602 1.00 1.13 C ATOM 1567 CD2 PHE A 101 2.413 -12.720 -2.934 1.00 1.10 C ATOM 1568 CE1 PHE A 101 3.726 -10.923 -4.560 1.00 1.59 C ATOM 1569 CE2 PHE A 101 3.304 -13.175 -3.887 1.00 1.59 C ATOM 1570 CZ PHE A 101 3.900 -12.282 -4.755 1.00 1.75 C ATOM 0 H PHE A 101 -0.822 -10.167 -0.330 1.00 0.36 H new ATOM 0 HA PHE A 101 -0.018 -9.793 -3.114 1.00 0.36 H new ATOM 0 HB2 PHE A 101 1.647 -10.002 -1.235 1.00 0.46 H new ATOM 0 HB3 PHE A 101 1.091 -11.643 -0.969 1.00 0.46 H new ATOM 0 HD1 PHE A 101 2.657 -9.414 -3.493 1.00 1.13 H new ATOM 0 HD2 PHE A 101 1.901 -13.429 -2.300 1.00 1.10 H new ATOM 0 HE1 PHE A 101 4.284 -10.215 -5.154 1.00 1.59 H new ATOM 0 HE2 PHE A 101 3.534 -14.228 -3.953 1.00 1.59 H new ATOM 0 HZ PHE A 101 4.497 -12.641 -5.580 1.00 1.75 H new ATOM 1580 N GLY A 102 -1.744 -11.551 -3.800 1.00 0.58 N ATOM 1581 CA GLY A 102 -2.461 -12.668 -4.391 1.00 0.60 C ATOM 1582 C GLY A 102 -3.408 -13.352 -3.420 1.00 0.73 C ATOM 1583 O GLY A 102 -4.260 -12.706 -2.811 1.00 1.49 O ATOM 0 H GLY A 102 -1.982 -10.638 -4.187 1.00 0.58 H new ATOM 0 HA2 GLY A 102 -3.028 -12.313 -5.252 1.00 0.60 H new ATOM 0 HA3 GLY A 102 -1.741 -13.398 -4.762 1.00 0.60 H new ATOM 1587 N ASN A 103 -3.262 -14.668 -3.294 1.00 0.56 N ATOM 1588 CA ASN A 103 -4.112 -15.462 -2.410 1.00 0.58 C ATOM 1589 C ASN A 103 -3.287 -16.214 -1.373 1.00 0.52 C ATOM 1590 O ASN A 103 -3.795 -17.121 -0.713 1.00 0.67 O ATOM 1591 CB ASN A 103 -4.904 -16.480 -3.227 1.00 0.76 C ATOM 1592 CG ASN A 103 -3.988 -17.427 -3.974 1.00 0.85 C ATOM 1593 OD1 ASN A 103 -3.441 -17.084 -5.021 1.00 1.55 O ATOM 1594 ND2 ASN A 103 -3.784 -18.613 -3.414 1.00 0.90 N ATOM 0 H ASN A 103 -2.559 -15.210 -3.796 1.00 0.56 H new ATOM 0 HA ASN A 103 -4.786 -14.775 -1.898 1.00 0.58 H new ATOM 0 HB2 ASN A 103 -5.557 -17.050 -2.566 1.00 0.76 H new ATOM 0 HB3 ASN A 103 -5.546 -15.958 -3.937 1.00 0.76 H new ATOM 0 HD21 ASN A 103 -3.152 -19.282 -3.853 1.00 0.90 H new ATOM 0 HD22 ASN A 103 -4.259 -18.855 -2.545 1.00 0.90 H new ATOM 1601 N GLU A 104 -2.020 -15.847 -1.229 1.00 0.43 N ATOM 1602 CA GLU A 104 -1.159 -16.515 -0.270 1.00 0.42 C ATOM 1603 C GLU A 104 -1.233 -15.853 1.087 1.00 0.42 C ATOM 1604 O GLU A 104 -1.805 -14.771 1.241 1.00 0.58 O ATOM 1605 CB GLU A 104 0.282 -16.560 -0.763 1.00 0.51 C ATOM 1606 CG GLU A 104 0.863 -15.202 -1.125 1.00 0.56 C ATOM 1607 CD GLU A 104 1.075 -14.314 0.082 1.00 1.57 C ATOM 1608 OE1 GLU A 104 1.872 -14.692 0.966 1.00 2.29 O ATOM 1609 OE2 GLU A 104 0.448 -13.236 0.141 1.00 2.14 O ATOM 0 H GLU A 104 -1.573 -15.099 -1.759 1.00 0.43 H new ATOM 0 HA GLU A 104 -1.517 -17.539 -0.168 1.00 0.42 H new ATOM 0 HB2 GLU A 104 0.904 -17.014 0.009 1.00 0.51 H new ATOM 0 HB3 GLU A 104 0.334 -17.209 -1.637 1.00 0.51 H new ATOM 0 HG2 GLU A 104 1.814 -15.344 -1.637 1.00 0.56 H new ATOM 0 HG3 GLU A 104 0.195 -14.701 -1.826 1.00 0.56 H new ATOM 1616 N VAL A 105 -0.658 -16.517 2.070 1.00 0.50 N ATOM 1617 CA VAL A 105 -0.652 -16.023 3.427 1.00 0.56 C ATOM 1618 C VAL A 105 0.669 -16.347 4.106 1.00 0.61 C ATOM 1619 O VAL A 105 0.850 -17.426 4.673 1.00 0.72 O ATOM 1620 CB VAL A 105 -1.821 -16.623 4.223 1.00 0.66 C ATOM 1621 CG1 VAL A 105 -1.634 -16.424 5.721 1.00 0.80 C ATOM 1622 CG2 VAL A 105 -3.135 -16.003 3.771 1.00 0.67 C ATOM 0 H VAL A 105 -0.184 -17.412 1.948 1.00 0.50 H new ATOM 0 HA VAL A 105 -0.771 -14.940 3.398 1.00 0.56 H new ATOM 0 HB VAL A 105 -1.844 -17.695 4.028 1.00 0.66 H new ATOM 0 HG11 VAL A 105 -2.479 -16.860 6.254 1.00 0.80 H new ATOM 0 HG12 VAL A 105 -0.713 -16.911 6.041 1.00 0.80 H new ATOM 0 HG13 VAL A 105 -1.577 -15.358 5.942 1.00 0.80 H new ATOM 0 HG21 VAL A 105 -3.957 -16.436 4.342 1.00 0.67 H new ATOM 0 HG22 VAL A 105 -3.105 -14.926 3.937 1.00 0.67 H new ATOM 0 HG23 VAL A 105 -3.286 -16.203 2.710 1.00 0.67 H new ATOM 1632 N ILE A 106 1.592 -15.400 4.038 1.00 0.58 N ATOM 1633 CA ILE A 106 2.898 -15.566 4.642 1.00 0.64 C ATOM 1634 C ILE A 106 3.326 -14.278 5.303 1.00 0.61 C ATOM 1635 O ILE A 106 3.786 -13.356 4.643 1.00 0.57 O ATOM 1636 CB ILE A 106 3.961 -15.968 3.599 1.00 0.74 C ATOM 1637 CG1 ILE A 106 3.530 -17.228 2.844 1.00 0.76 C ATOM 1638 CG2 ILE A 106 5.309 -16.184 4.275 1.00 1.31 C ATOM 1639 CD1 ILE A 106 4.443 -17.580 1.692 1.00 1.45 C ATOM 0 H ILE A 106 1.456 -14.505 3.567 1.00 0.58 H new ATOM 0 HA ILE A 106 2.818 -16.363 5.381 1.00 0.64 H new ATOM 0 HB ILE A 106 4.060 -15.157 2.877 1.00 0.74 H new ATOM 0 HG12 ILE A 106 3.496 -18.066 3.540 1.00 0.76 H new ATOM 0 HG13 ILE A 106 2.518 -17.087 2.465 1.00 0.76 H new ATOM 0 HG21 ILE A 106 6.050 -16.467 3.527 1.00 1.31 H new ATOM 0 HG22 ILE A 106 5.622 -15.262 4.765 1.00 1.31 H new ATOM 0 HG23 ILE A 106 5.221 -16.977 5.017 1.00 1.31 H new ATOM 0 HD11 ILE A 106 4.079 -18.483 1.202 1.00 1.45 H new ATOM 0 HD12 ILE A 106 4.458 -16.759 0.975 1.00 1.45 H new ATOM 0 HD13 ILE A 106 5.452 -17.753 2.067 1.00 1.45 H new ATOM 1651 N ASN A 107 3.180 -14.230 6.613 1.00 0.84 N ATOM 1652 CA ASN A 107 3.563 -13.062 7.378 1.00 0.90 C ATOM 1653 C ASN A 107 4.982 -13.249 7.873 1.00 0.91 C ATOM 1654 O ASN A 107 5.238 -14.058 8.766 1.00 1.02 O ATOM 1655 CB ASN A 107 2.608 -12.867 8.552 1.00 1.09 C ATOM 1656 CG ASN A 107 1.176 -13.198 8.179 1.00 1.00 C ATOM 1657 OD1 ASN A 107 0.800 -14.366 8.086 1.00 1.28 O ATOM 1658 ND2 ASN A 107 0.382 -12.171 7.924 1.00 1.21 N ATOM 0 H ASN A 107 2.796 -14.992 7.172 1.00 0.84 H new ATOM 0 HA ASN A 107 3.511 -12.173 6.749 1.00 0.90 H new ATOM 0 HB2 ASN A 107 2.921 -13.498 9.383 1.00 1.09 H new ATOM 0 HB3 ASN A 107 2.664 -11.835 8.897 1.00 1.09 H new ATOM 0 HD21 ASN A 107 -0.584 -12.332 7.638 1.00 1.21 H new ATOM 0 HD22 ASN A 107 0.735 -11.218 8.014 1.00 1.21 H new ATOM 1665 N THR A 108 5.907 -12.530 7.263 1.00 0.86 N ATOM 1666 CA THR A 108 7.309 -12.661 7.624 1.00 0.89 C ATOM 1667 C THR A 108 7.718 -11.629 8.669 1.00 0.91 C ATOM 1668 O THR A 108 6.887 -11.144 9.438 1.00 1.16 O ATOM 1669 CB THR A 108 8.170 -12.536 6.373 1.00 0.90 C ATOM 1670 OG1 THR A 108 7.411 -12.862 5.225 1.00 1.07 O ATOM 1671 CG2 THR A 108 9.365 -13.454 6.385 1.00 0.92 C ATOM 0 H THR A 108 5.717 -11.855 6.522 1.00 0.86 H new ATOM 0 HA THR A 108 7.461 -13.645 8.069 1.00 0.89 H new ATOM 0 HB THR A 108 8.516 -11.503 6.354 1.00 0.90 H new ATOM 0 HG1 THR A 108 7.099 -13.789 5.291 1.00 1.07 H new ATOM 0 HG21 THR A 108 9.938 -13.318 5.468 1.00 0.92 H new ATOM 0 HG22 THR A 108 9.994 -13.221 7.244 1.00 0.92 H new ATOM 0 HG23 THR A 108 9.028 -14.489 6.452 1.00 0.92 H new ATOM 1679 N GLU A 109 9.005 -11.300 8.692 1.00 0.83 N ATOM 1680 CA GLU A 109 9.533 -10.330 9.643 1.00 0.86 C ATOM 1681 C GLU A 109 9.063 -8.930 9.282 1.00 0.73 C ATOM 1682 O GLU A 109 8.075 -8.435 9.825 1.00 0.87 O ATOM 1683 CB GLU A 109 11.062 -10.380 9.660 1.00 0.95 C ATOM 1684 CG GLU A 109 11.628 -11.725 10.086 1.00 1.22 C ATOM 1685 CD GLU A 109 11.405 -12.813 9.053 1.00 1.93 C ATOM 1686 OE1 GLU A 109 11.902 -12.663 7.918 1.00 2.60 O ATOM 1687 OE2 GLU A 109 10.733 -13.814 9.380 1.00 2.37 O ATOM 0 H GLU A 109 9.703 -11.693 8.061 1.00 0.83 H new ATOM 0 HA GLU A 109 9.162 -10.582 10.637 1.00 0.86 H new ATOM 0 HB2 GLU A 109 11.435 -10.138 8.665 1.00 0.95 H new ATOM 0 HB3 GLU A 109 11.434 -9.610 10.336 1.00 0.95 H new ATOM 0 HG2 GLU A 109 12.697 -11.621 10.272 1.00 1.22 H new ATOM 0 HG3 GLU A 109 11.168 -12.025 11.028 1.00 1.22 H new ATOM 1694 N ARG A 110 9.762 -8.309 8.341 1.00 0.63 N ATOM 1695 CA ARG A 110 9.400 -6.982 7.880 1.00 0.64 C ATOM 1696 C ARG A 110 8.224 -7.095 6.939 1.00 0.66 C ATOM 1697 O ARG A 110 7.519 -6.123 6.669 1.00 0.77 O ATOM 1698 CB ARG A 110 10.573 -6.327 7.153 1.00 0.63 C ATOM 1699 CG ARG A 110 11.822 -6.183 8.007 1.00 0.86 C ATOM 1700 CD ARG A 110 12.941 -5.490 7.246 1.00 1.64 C ATOM 1701 NE ARG A 110 14.175 -5.416 8.025 1.00 2.22 N ATOM 1702 CZ ARG A 110 14.287 -4.766 9.182 1.00 2.77 C ATOM 1703 NH1 ARG A 110 13.245 -4.132 9.699 1.00 3.01 N ATOM 1704 NH2 ARG A 110 15.448 -4.748 9.823 1.00 3.68 N ATOM 0 H ARG A 110 10.583 -8.706 7.884 1.00 0.63 H new ATOM 0 HA ARG A 110 9.137 -6.365 8.739 1.00 0.64 H new ATOM 0 HB2 ARG A 110 10.815 -6.917 6.269 1.00 0.63 H new ATOM 0 HB3 ARG A 110 10.267 -5.341 6.804 1.00 0.63 H new ATOM 0 HG2 ARG A 110 11.586 -5.614 8.906 1.00 0.86 H new ATOM 0 HG3 ARG A 110 12.157 -7.168 8.332 1.00 0.86 H new ATOM 0 HD2 ARG A 110 13.132 -6.026 6.316 1.00 1.64 H new ATOM 0 HD3 ARG A 110 12.624 -4.483 6.974 1.00 1.64 H new ATOM 0 HE ARG A 110 15.001 -5.891 7.661 1.00 2.22 H new ATOM 0 HH11 ARG A 110 12.350 -4.140 9.211 1.00 3.01 H new ATOM 0 HH12 ARG A 110 13.338 -3.636 10.586 1.00 3.01 H new ATOM 0 HH21 ARG A 110 16.255 -5.232 9.430 1.00 3.68 H new ATOM 0 HH22 ARG A 110 15.534 -4.250 10.709 1.00 3.68 H new ATOM 1718 N LEU A 111 8.031 -8.308 6.442 1.00 0.62 N ATOM 1719 CA LEU A 111 6.954 -8.597 5.518 1.00 0.63 C ATOM 1720 C LEU A 111 5.690 -9.015 6.249 1.00 0.56 C ATOM 1721 O LEU A 111 5.729 -9.770 7.221 1.00 0.66 O ATOM 1722 CB LEU A 111 7.364 -9.717 4.550 1.00 0.73 C ATOM 1723 CG LEU A 111 6.262 -10.226 3.611 1.00 0.94 C ATOM 1724 CD1 LEU A 111 5.283 -11.127 4.335 1.00 1.15 C ATOM 1725 CD2 LEU A 111 5.522 -9.078 2.945 1.00 1.64 C ATOM 0 H LEU A 111 8.615 -9.113 6.669 1.00 0.62 H new ATOM 0 HA LEU A 111 6.751 -7.682 4.962 1.00 0.63 H new ATOM 0 HB2 LEU A 111 8.196 -9.360 3.943 1.00 0.73 H new ATOM 0 HB3 LEU A 111 7.734 -10.559 5.135 1.00 0.73 H new ATOM 0 HG LEU A 111 6.756 -10.812 2.836 1.00 0.94 H new ATOM 0 HD11 LEU A 111 4.518 -11.467 3.638 1.00 1.15 H new ATOM 0 HD12 LEU A 111 5.813 -11.989 4.741 1.00 1.15 H new ATOM 0 HD13 LEU A 111 4.813 -10.574 5.148 1.00 1.15 H new ATOM 0 HD21 LEU A 111 4.749 -9.476 2.287 1.00 1.64 H new ATOM 0 HD22 LEU A 111 5.061 -8.451 3.708 1.00 1.64 H new ATOM 0 HD23 LEU A 111 6.224 -8.483 2.361 1.00 1.64 H new ATOM 1737 N THR A 112 4.573 -8.557 5.721 1.00 0.46 N ATOM 1738 CA THR A 112 3.266 -8.897 6.236 1.00 0.42 C ATOM 1739 C THR A 112 2.307 -9.054 5.074 1.00 0.39 C ATOM 1740 O THR A 112 2.156 -8.135 4.269 1.00 0.43 O ATOM 1741 CB THR A 112 2.752 -7.820 7.191 1.00 0.45 C ATOM 1742 OG1 THR A 112 3.136 -6.530 6.752 1.00 0.65 O ATOM 1743 CG2 THR A 112 3.223 -7.991 8.620 1.00 0.68 C ATOM 0 H THR A 112 4.549 -7.933 4.915 1.00 0.46 H new ATOM 0 HA THR A 112 3.339 -9.831 6.793 1.00 0.42 H new ATOM 0 HB THR A 112 1.668 -7.931 7.181 1.00 0.45 H new ATOM 0 HG1 THR A 112 2.795 -5.857 7.377 1.00 0.65 H new ATOM 0 HG21 THR A 112 2.816 -7.189 9.236 1.00 0.68 H new ATOM 0 HG22 THR A 112 2.880 -8.952 9.004 1.00 0.68 H new ATOM 0 HG23 THR A 112 4.312 -7.956 8.651 1.00 0.68 H new ATOM 1751 N VAL A 113 1.644 -10.198 4.979 1.00 0.36 N ATOM 1752 CA VAL A 113 0.703 -10.397 3.900 1.00 0.38 C ATOM 1753 C VAL A 113 -0.633 -9.799 4.324 1.00 0.32 C ATOM 1754 O VAL A 113 -0.700 -9.254 5.423 1.00 0.30 O ATOM 1755 CB VAL A 113 0.554 -11.885 3.526 1.00 0.45 C ATOM 1756 CG1 VAL A 113 1.761 -12.350 2.745 1.00 1.52 C ATOM 1757 CG2 VAL A 113 0.333 -12.744 4.753 1.00 1.18 C ATOM 0 H VAL A 113 1.740 -10.983 5.623 1.00 0.36 H new ATOM 0 HA VAL A 113 1.072 -9.898 3.004 1.00 0.38 H new ATOM 0 HB VAL A 113 -0.328 -11.991 2.895 1.00 0.45 H new ATOM 0 HG11 VAL A 113 1.644 -13.402 2.487 1.00 1.52 H new ATOM 0 HG12 VAL A 113 1.853 -11.761 1.833 1.00 1.52 H new ATOM 0 HG13 VAL A 113 2.658 -12.223 3.351 1.00 1.52 H new ATOM 0 HG21 VAL A 113 0.232 -13.787 4.453 1.00 1.18 H new ATOM 0 HG22 VAL A 113 1.183 -12.641 5.427 1.00 1.18 H new ATOM 0 HG23 VAL A 113 -0.576 -12.423 5.263 1.00 1.18 H new ATOM 1767 N PRO A 114 -1.715 -9.871 3.501 1.00 0.35 N ATOM 1768 CA PRO A 114 -3.015 -9.322 3.849 1.00 0.36 C ATOM 1769 C PRO A 114 -3.145 -9.039 5.343 1.00 0.33 C ATOM 1770 O PRO A 114 -3.545 -9.898 6.127 1.00 0.35 O ATOM 1771 CB PRO A 114 -3.927 -10.450 3.376 1.00 0.43 C ATOM 1772 CG PRO A 114 -3.226 -11.027 2.172 1.00 0.46 C ATOM 1773 CD PRO A 114 -1.806 -10.492 2.177 1.00 0.42 C ATOM 0 HA PRO A 114 -3.235 -8.353 3.402 1.00 0.36 H new ATOM 0 HB2 PRO A 114 -4.063 -11.202 4.153 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -4.918 -10.076 3.117 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -3.226 -12.116 2.213 1.00 0.46 H new ATOM 0 HG3 PRO A 114 -3.741 -10.742 1.254 1.00 0.46 H new ATOM 0 HD2 PRO A 114 -1.071 -11.287 2.048 1.00 0.42 H new ATOM 0 HD3 PRO A 114 -1.640 -9.771 1.377 1.00 0.42 H new ATOM 1781 N HIS A 115 -2.752 -7.821 5.716 1.00 0.33 N ATOM 1782 CA HIS A 115 -2.758 -7.383 7.100 1.00 0.33 C ATOM 1783 C HIS A 115 -4.150 -6.981 7.542 1.00 0.34 C ATOM 1784 O HIS A 115 -4.773 -6.113 6.932 1.00 0.46 O ATOM 1785 CB HIS A 115 -1.806 -6.191 7.236 1.00 0.39 C ATOM 1786 CG HIS A 115 -1.497 -5.794 8.647 1.00 0.44 C ATOM 1787 ND1 HIS A 115 -2.468 -5.562 9.599 1.00 0.97 N ATOM 1788 CD2 HIS A 115 -0.310 -5.563 9.256 1.00 0.76 C ATOM 1789 CE1 HIS A 115 -1.890 -5.207 10.733 1.00 0.87 C ATOM 1790 NE2 HIS A 115 -0.583 -5.199 10.552 1.00 0.67 N ATOM 0 H HIS A 115 -2.421 -7.113 5.060 1.00 0.33 H new ATOM 0 HA HIS A 115 -2.433 -8.206 7.736 1.00 0.33 H new ATOM 0 HB2 HIS A 115 -0.872 -6.430 6.727 1.00 0.39 H new ATOM 0 HB3 HIS A 115 -2.241 -5.335 6.719 1.00 0.39 H new ATOM 0 HD2 HIS A 115 0.668 -5.649 8.807 1.00 0.76 H new ATOM 0 HE1 HIS A 115 -2.401 -4.964 11.653 1.00 0.87 H new ATOM 0 HE2 HIS A 115 0.112 -4.961 11.260 1.00 0.67 H new ATOM 1799 N TYR A 116 -4.629 -7.598 8.616 1.00 0.34 N ATOM 1800 CA TYR A 116 -5.944 -7.263 9.140 1.00 0.42 C ATOM 1801 C TYR A 116 -5.971 -5.794 9.536 1.00 0.43 C ATOM 1802 O TYR A 116 -5.620 -5.431 10.659 1.00 0.49 O ATOM 1803 CB TYR A 116 -6.312 -8.161 10.333 1.00 0.52 C ATOM 1804 CG TYR A 116 -5.147 -8.591 11.211 1.00 0.70 C ATOM 1805 CD1 TYR A 116 -4.095 -7.714 11.452 1.00 1.13 C ATOM 1806 CD2 TYR A 116 -5.086 -9.855 11.791 1.00 0.89 C ATOM 1807 CE1 TYR A 116 -3.021 -8.081 12.240 1.00 1.64 C ATOM 1808 CE2 TYR A 116 -4.014 -10.228 12.583 1.00 1.31 C ATOM 1809 CZ TYR A 116 -3.038 -9.414 12.835 1.00 1.68 C ATOM 1810 OH TYR A 116 -1.917 -9.706 13.587 1.00 2.22 O ATOM 0 H TYR A 116 -4.133 -8.323 9.134 1.00 0.34 H new ATOM 0 HA TYR A 116 -6.688 -7.437 8.363 1.00 0.42 H new ATOM 0 HB2 TYR A 116 -7.036 -7.633 10.953 1.00 0.52 H new ATOM 0 HB3 TYR A 116 -6.808 -9.054 9.954 1.00 0.52 H new ATOM 0 HD1 TYR A 116 -4.118 -6.727 11.015 1.00 1.13 H new ATOM 0 HD2 TYR A 116 -5.889 -10.557 11.620 1.00 0.89 H new ATOM 0 HE1 TYR A 116 -2.197 -7.404 12.410 1.00 1.64 H new ATOM 0 HE2 TYR A 116 -3.990 -11.223 13.002 1.00 1.31 H new ATOM 0 HH TYR A 116 -1.996 -10.611 13.955 1.00 2.22 H new ATOM 1820 N ASP A 117 -6.357 -4.945 8.586 1.00 0.42 N ATOM 1821 CA ASP A 117 -6.388 -3.510 8.815 1.00 0.50 C ATOM 1822 C ASP A 117 -7.009 -2.784 7.626 1.00 0.52 C ATOM 1823 O ASP A 117 -7.897 -1.948 7.781 1.00 0.73 O ATOM 1824 CB ASP A 117 -4.959 -3.009 9.015 1.00 0.52 C ATOM 1825 CG ASP A 117 -4.903 -1.657 9.700 1.00 0.67 C ATOM 1826 OD1 ASP A 117 -5.461 -0.687 9.146 1.00 1.07 O ATOM 1827 OD2 ASP A 117 -4.300 -1.570 10.789 1.00 0.87 O ATOM 0 H ASP A 117 -6.652 -5.230 7.652 1.00 0.42 H new ATOM 0 HA ASP A 117 -6.992 -3.309 9.700 1.00 0.50 H new ATOM 0 HB2 ASP A 117 -4.403 -3.735 9.608 1.00 0.52 H new ATOM 0 HB3 ASP A 117 -4.463 -2.942 8.047 1.00 0.52 H new ATOM 1832 N MET A 118 -6.507 -3.113 6.439 1.00 0.38 N ATOM 1833 CA MET A 118 -6.963 -2.509 5.190 1.00 0.39 C ATOM 1834 C MET A 118 -8.478 -2.572 5.031 1.00 0.38 C ATOM 1835 O MET A 118 -9.090 -1.680 4.448 1.00 0.45 O ATOM 1836 CB MET A 118 -6.314 -3.238 4.015 1.00 0.44 C ATOM 1837 CG MET A 118 -6.587 -4.732 4.003 1.00 0.48 C ATOM 1838 SD MET A 118 -5.826 -5.569 2.601 1.00 1.29 S ATOM 1839 CE MET A 118 -6.268 -7.270 2.949 1.00 2.05 C ATOM 0 H MET A 118 -5.771 -3.808 6.316 1.00 0.38 H new ATOM 0 HA MET A 118 -6.674 -1.458 5.211 1.00 0.39 H new ATOM 0 HB2 MET A 118 -6.676 -2.803 3.083 1.00 0.44 H new ATOM 0 HB3 MET A 118 -5.237 -3.074 4.046 1.00 0.44 H new ATOM 0 HG2 MET A 118 -6.216 -5.172 4.928 1.00 0.48 H new ATOM 0 HG3 MET A 118 -7.664 -4.900 3.980 1.00 0.48 H new ATOM 0 HE1 MET A 118 -6.332 -7.828 2.015 1.00 2.05 H new ATOM 0 HE2 MET A 118 -5.508 -7.720 3.588 1.00 2.05 H new ATOM 0 HE3 MET A 118 -7.232 -7.299 3.456 1.00 2.05 H new ATOM 1849 N LYS A 119 -9.059 -3.643 5.533 1.00 0.40 N ATOM 1850 CA LYS A 119 -10.499 -3.870 5.432 1.00 0.47 C ATOM 1851 C LYS A 119 -11.275 -3.112 6.499 1.00 0.50 C ATOM 1852 O LYS A 119 -12.467 -3.343 6.698 1.00 0.80 O ATOM 1853 CB LYS A 119 -10.782 -5.366 5.511 1.00 0.57 C ATOM 1854 CG LYS A 119 -10.015 -6.065 6.619 1.00 0.69 C ATOM 1855 CD LYS A 119 -10.253 -7.566 6.601 1.00 0.80 C ATOM 1856 CE LYS A 119 -9.371 -8.284 7.610 1.00 1.02 C ATOM 1857 NZ LYS A 119 -9.607 -7.803 8.999 1.00 1.93 N ATOM 0 H LYS A 119 -8.554 -4.382 6.022 1.00 0.40 H new ATOM 0 HA LYS A 119 -10.838 -3.486 4.470 1.00 0.47 H new ATOM 0 HB2 LYS A 119 -11.850 -5.519 5.666 1.00 0.57 H new ATOM 0 HB3 LYS A 119 -10.529 -5.827 4.556 1.00 0.57 H new ATOM 0 HG2 LYS A 119 -8.950 -5.863 6.508 1.00 0.69 H new ATOM 0 HG3 LYS A 119 -10.318 -5.659 7.584 1.00 0.69 H new ATOM 0 HD2 LYS A 119 -11.301 -7.772 6.821 1.00 0.80 H new ATOM 0 HD3 LYS A 119 -10.055 -7.955 5.602 1.00 0.80 H new ATOM 0 HE2 LYS A 119 -9.562 -9.356 7.560 1.00 1.02 H new ATOM 0 HE3 LYS A 119 -8.324 -8.134 7.347 1.00 1.02 H new ATOM 0 HZ1 LYS A 119 -9.089 -8.407 9.668 1.00 1.93 H new ATOM 0 HZ2 LYS A 119 -9.273 -6.822 9.088 1.00 1.93 H new ATOM 0 HZ3 LYS A 119 -10.624 -7.843 9.212 1.00 1.93 H new ATOM 1871 N ASN A 120 -10.596 -2.197 7.171 1.00 0.49 N ATOM 1872 CA ASN A 120 -11.218 -1.387 8.209 1.00 0.52 C ATOM 1873 C ASN A 120 -10.871 0.077 7.985 1.00 0.56 C ATOM 1874 O ASN A 120 -10.830 0.868 8.928 1.00 0.74 O ATOM 1875 CB ASN A 120 -10.731 -1.831 9.589 1.00 0.53 C ATOM 1876 CG ASN A 120 -10.826 -3.329 9.784 1.00 1.17 C ATOM 1877 OD1 ASN A 120 -11.894 -3.926 9.640 1.00 2.11 O ATOM 1878 ND2 ASN A 120 -9.700 -3.943 10.123 1.00 1.30 N ATOM 0 H ASN A 120 -9.608 -1.995 7.016 1.00 0.49 H new ATOM 0 HA ASN A 120 -12.299 -1.516 8.162 1.00 0.52 H new ATOM 0 HB2 ASN A 120 -9.697 -1.515 9.724 1.00 0.53 H new ATOM 0 HB3 ASN A 120 -11.320 -1.330 10.357 1.00 0.53 H new ATOM 0 HD21 ASN A 120 -9.695 -4.951 10.276 1.00 1.30 H new ATOM 0 HD22 ASN A 120 -8.839 -3.407 10.231 1.00 1.30 H new ATOM 1885 N ARG A 121 -10.607 0.425 6.724 1.00 0.49 N ATOM 1886 CA ARG A 121 -10.236 1.788 6.361 1.00 0.58 C ATOM 1887 C ARG A 121 -10.722 2.124 4.955 1.00 0.63 C ATOM 1888 O ARG A 121 -11.533 1.399 4.377 1.00 1.07 O ATOM 1889 CB ARG A 121 -8.713 1.948 6.426 1.00 0.64 C ATOM 1890 CG ARG A 121 -8.097 1.521 7.751 1.00 0.91 C ATOM 1891 CD ARG A 121 -8.403 2.504 8.876 1.00 1.24 C ATOM 1892 NE ARG A 121 -7.968 3.867 8.568 1.00 1.84 N ATOM 1893 CZ ARG A 121 -8.733 4.773 7.959 1.00 2.55 C ATOM 1894 NH1 ARG A 121 -9.992 4.490 7.653 1.00 2.86 N ATOM 1895 NH2 ARG A 121 -8.246 5.973 7.678 1.00 3.50 N ATOM 0 H ARG A 121 -10.644 -0.223 5.937 1.00 0.49 H new ATOM 0 HA ARG A 121 -10.707 2.471 7.068 1.00 0.58 H new ATOM 0 HB2 ARG A 121 -8.263 1.363 5.624 1.00 0.64 H new ATOM 0 HB3 ARG A 121 -8.460 2.992 6.240 1.00 0.64 H new ATOM 0 HG2 ARG A 121 -8.472 0.534 8.022 1.00 0.91 H new ATOM 0 HG3 ARG A 121 -7.017 1.431 7.634 1.00 0.91 H new ATOM 0 HD2 ARG A 121 -9.475 2.504 9.071 1.00 1.24 H new ATOM 0 HD3 ARG A 121 -7.913 2.168 9.790 1.00 1.24 H new ATOM 0 HE ARG A 121 -7.022 4.140 8.835 1.00 1.84 H new ATOM 0 HH11 ARG A 121 -10.380 3.575 7.884 1.00 2.86 H new ATOM 0 HH12 ARG A 121 -10.573 5.187 7.187 1.00 2.86 H new ATOM 0 HH21 ARG A 121 -7.285 6.204 7.928 1.00 3.50 H new ATOM 0 HH22 ARG A 121 -8.833 6.665 7.212 1.00 3.50 H new ATOM 1909 N GLY A 122 -10.214 3.227 4.409 1.00 0.62 N ATOM 1910 CA GLY A 122 -10.600 3.641 3.071 1.00 0.61 C ATOM 1911 C GLY A 122 -9.410 4.004 2.208 1.00 0.56 C ATOM 1912 O GLY A 122 -9.576 4.440 1.069 1.00 0.70 O ATOM 0 H GLY A 122 -9.542 3.841 4.870 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -11.159 2.837 2.593 1.00 0.61 H new ATOM 0 HA3 GLY A 122 -11.270 4.498 3.139 1.00 0.61 H new ATOM 1916 N PHE A 123 -8.206 3.814 2.740 1.00 0.52 N ATOM 1917 CA PHE A 123 -6.995 4.120 1.989 1.00 0.58 C ATOM 1918 C PHE A 123 -6.385 2.852 1.407 1.00 0.42 C ATOM 1919 O PHE A 123 -5.723 2.888 0.373 1.00 0.43 O ATOM 1920 CB PHE A 123 -5.981 4.888 2.853 1.00 0.84 C ATOM 1921 CG PHE A 123 -5.775 4.347 4.243 1.00 1.19 C ATOM 1922 CD1 PHE A 123 -5.495 3.002 4.434 1.00 1.62 C ATOM 1923 CD2 PHE A 123 -5.877 5.166 5.353 1.00 2.11 C ATOM 1924 CE1 PHE A 123 -5.321 2.489 5.705 1.00 2.59 C ATOM 1925 CE2 PHE A 123 -5.701 4.660 6.626 1.00 3.16 C ATOM 1926 CZ PHE A 123 -5.368 3.372 6.815 1.00 3.31 C ATOM 0 H PHE A 123 -8.044 3.453 3.680 1.00 0.52 H new ATOM 0 HA PHE A 123 -7.269 4.770 1.158 1.00 0.58 H new ATOM 0 HB2 PHE A 123 -5.021 4.893 2.338 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.307 5.925 2.930 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -5.412 2.348 3.579 1.00 1.62 H new ATOM 0 HD2 PHE A 123 -6.097 6.215 5.222 1.00 2.11 H new ATOM 0 HE1 PHE A 123 -5.152 1.432 5.852 1.00 2.59 H new ATOM 0 HE2 PHE A 123 -5.833 5.308 7.480 1.00 3.16 H new ATOM 0 HZ PHE A 123 -5.137 3.011 7.806 1.00 3.31 H new ATOM 1936 N MET A 124 -6.626 1.732 2.068 1.00 0.37 N ATOM 1937 CA MET A 124 -6.123 0.450 1.596 1.00 0.38 C ATOM 1938 C MET A 124 -7.141 -0.239 0.689 1.00 0.38 C ATOM 1939 O MET A 124 -6.776 -1.006 -0.195 1.00 0.57 O ATOM 1940 CB MET A 124 -5.737 -0.448 2.773 1.00 0.50 C ATOM 1941 CG MET A 124 -4.452 -0.012 3.464 1.00 0.90 C ATOM 1942 SD MET A 124 -4.011 -1.056 4.868 1.00 1.99 S ATOM 1943 CE MET A 124 -2.514 -0.250 5.433 1.00 2.44 C ATOM 0 H MET A 124 -7.166 1.683 2.932 1.00 0.37 H new ATOM 0 HA MET A 124 -5.226 0.636 1.006 1.00 0.38 H new ATOM 0 HB2 MET A 124 -6.549 -0.452 3.500 1.00 0.50 H new ATOM 0 HB3 MET A 124 -5.621 -1.472 2.418 1.00 0.50 H new ATOM 0 HG2 MET A 124 -3.636 -0.023 2.741 1.00 0.90 H new ATOM 0 HG3 MET A 124 -4.562 1.017 3.805 1.00 0.90 H new ATOM 0 HE1 MET A 124 -1.796 -1.003 5.758 1.00 2.44 H new ATOM 0 HE2 MET A 124 -2.085 0.333 4.618 1.00 2.44 H new ATOM 0 HE3 MET A 124 -2.749 0.411 6.267 1.00 2.44 H new ATOM 1953 N LEU A 125 -8.425 0.032 0.932 1.00 0.37 N ATOM 1954 CA LEU A 125 -9.509 -0.566 0.148 1.00 0.41 C ATOM 1955 C LEU A 125 -9.784 0.184 -1.154 1.00 0.34 C ATOM 1956 O LEU A 125 -9.646 -0.369 -2.244 1.00 0.40 O ATOM 1957 CB LEU A 125 -10.802 -0.605 0.968 1.00 0.53 C ATOM 1958 CG LEU A 125 -10.859 -1.645 2.086 1.00 0.61 C ATOM 1959 CD1 LEU A 125 -12.228 -1.640 2.745 1.00 0.85 C ATOM 1960 CD2 LEU A 125 -10.528 -3.031 1.550 1.00 0.76 C ATOM 0 H LEU A 125 -8.741 0.664 1.668 1.00 0.37 H new ATOM 0 HA LEU A 125 -9.181 -1.574 -0.104 1.00 0.41 H new ATOM 0 HB2 LEU A 125 -10.959 0.380 1.408 1.00 0.53 H new ATOM 0 HB3 LEU A 125 -11.634 -0.787 0.288 1.00 0.53 H new ATOM 0 HG LEU A 125 -10.113 -1.384 2.836 1.00 0.61 H new ATOM 0 HD11 LEU A 125 -12.252 -2.386 3.539 1.00 0.85 H new ATOM 0 HD12 LEU A 125 -12.425 -0.655 3.167 1.00 0.85 H new ATOM 0 HD13 LEU A 125 -12.990 -1.876 2.002 1.00 0.85 H new ATOM 0 HD21 LEU A 125 -10.574 -3.756 2.363 1.00 0.76 H new ATOM 0 HD22 LEU A 125 -11.248 -3.304 0.778 1.00 0.76 H new ATOM 0 HD23 LEU A 125 -9.524 -3.027 1.125 1.00 0.76 H new ATOM 1972 N TRP A 126 -10.226 1.432 -1.015 1.00 0.31 N ATOM 1973 CA TRP A 126 -10.589 2.267 -2.158 1.00 0.32 C ATOM 1974 C TRP A 126 -9.534 2.248 -3.277 1.00 0.29 C ATOM 1975 O TRP A 126 -9.847 1.861 -4.401 1.00 0.31 O ATOM 1976 CB TRP A 126 -10.864 3.697 -1.683 1.00 0.38 C ATOM 1977 CG TRP A 126 -11.086 4.681 -2.790 1.00 0.46 C ATOM 1978 CD1 TRP A 126 -10.555 5.932 -2.874 1.00 0.46 C ATOM 1979 CD2 TRP A 126 -11.895 4.509 -3.960 1.00 0.93 C ATOM 1980 NE1 TRP A 126 -10.980 6.552 -4.023 1.00 0.54 N ATOM 1981 CE2 TRP A 126 -11.803 5.697 -4.708 1.00 0.94 C ATOM 1982 CE3 TRP A 126 -12.688 3.465 -4.452 1.00 1.45 C ATOM 1983 CZ2 TRP A 126 -12.470 5.872 -5.919 1.00 1.42 C ATOM 1984 CZ3 TRP A 126 -13.349 3.640 -5.653 1.00 1.96 C ATOM 1985 CH2 TRP A 126 -13.236 4.835 -6.375 1.00 1.93 C ATOM 0 H TRP A 126 -10.342 1.891 -0.112 1.00 0.31 H new ATOM 0 HA TRP A 126 -11.495 1.847 -2.596 1.00 0.32 H new ATOM 0 HB2 TRP A 126 -11.742 3.690 -1.037 1.00 0.38 H new ATOM 0 HB3 TRP A 126 -10.024 4.034 -1.076 1.00 0.38 H new ATOM 0 HD1 TRP A 126 -9.895 6.373 -2.142 1.00 0.46 H new ATOM 0 HE1 TRP A 126 -10.725 7.494 -4.318 1.00 0.54 H new ATOM 0 HE3 TRP A 126 -12.781 2.540 -3.903 1.00 1.45 H new ATOM 0 HZ2 TRP A 126 -12.385 6.793 -6.477 1.00 1.42 H new ATOM 0 HZ3 TRP A 126 -13.963 2.841 -6.042 1.00 1.96 H new ATOM 0 HH2 TRP A 126 -13.765 4.940 -7.311 1.00 1.93 H new ATOM 1996 N PRO A 127 -8.279 2.664 -3.009 1.00 0.28 N ATOM 1997 CA PRO A 127 -7.229 2.676 -4.042 1.00 0.29 C ATOM 1998 C PRO A 127 -6.943 1.283 -4.606 1.00 0.28 C ATOM 1999 O PRO A 127 -6.743 1.126 -5.811 1.00 0.31 O ATOM 2000 CB PRO A 127 -6.003 3.227 -3.307 1.00 0.30 C ATOM 2001 CG PRO A 127 -6.564 3.960 -2.141 1.00 0.31 C ATOM 2002 CD PRO A 127 -7.772 3.170 -1.722 1.00 0.29 C ATOM 0 HA PRO A 127 -7.521 3.271 -4.907 1.00 0.29 H new ATOM 0 HB2 PRO A 127 -5.338 2.424 -2.988 1.00 0.30 H new ATOM 0 HB3 PRO A 127 -5.420 3.888 -3.948 1.00 0.30 H new ATOM 0 HG2 PRO A 127 -5.837 4.027 -1.331 1.00 0.31 H new ATOM 0 HG3 PRO A 127 -6.835 4.981 -2.411 1.00 0.31 H new ATOM 0 HD2 PRO A 127 -7.512 2.360 -1.041 1.00 0.29 H new ATOM 0 HD3 PRO A 127 -8.507 3.792 -1.212 1.00 0.29 H new ATOM 2010 N LEU A 128 -6.932 0.278 -3.735 1.00 0.25 N ATOM 2011 CA LEU A 128 -6.680 -1.101 -4.155 1.00 0.26 C ATOM 2012 C LEU A 128 -7.750 -1.550 -5.144 1.00 0.27 C ATOM 2013 O LEU A 128 -7.488 -2.335 -6.056 1.00 0.29 O ATOM 2014 CB LEU A 128 -6.701 -2.033 -2.943 1.00 0.26 C ATOM 2015 CG LEU A 128 -5.595 -3.077 -2.881 1.00 0.29 C ATOM 2016 CD1 LEU A 128 -4.263 -2.419 -2.561 1.00 0.30 C ATOM 2017 CD2 LEU A 128 -5.930 -4.133 -1.838 1.00 0.44 C ATOM 0 H LEU A 128 -7.094 0.390 -2.734 1.00 0.25 H new ATOM 0 HA LEU A 128 -5.700 -1.143 -4.631 1.00 0.26 H new ATOM 0 HB2 LEU A 128 -6.648 -1.424 -2.041 1.00 0.26 H new ATOM 0 HB3 LEU A 128 -7.661 -2.549 -2.924 1.00 0.26 H new ATOM 0 HG LEU A 128 -5.515 -3.561 -3.855 1.00 0.29 H new ATOM 0 HD11 LEU A 128 -3.482 -3.179 -2.520 1.00 0.30 H new ATOM 0 HD12 LEU A 128 -4.021 -1.691 -3.336 1.00 0.30 H new ATOM 0 HD13 LEU A 128 -4.329 -1.914 -1.597 1.00 0.30 H new ATOM 0 HD21 LEU A 128 -5.132 -4.875 -1.802 1.00 0.44 H new ATOM 0 HD22 LEU A 128 -6.030 -3.660 -0.861 1.00 0.44 H new ATOM 0 HD23 LEU A 128 -6.868 -4.621 -2.103 1.00 0.44 H new ATOM 2029 N PHE A 129 -8.955 -1.034 -4.943 1.00 0.28 N ATOM 2030 CA PHE A 129 -10.101 -1.353 -5.795 1.00 0.30 C ATOM 2031 C PHE A 129 -9.829 -0.946 -7.244 1.00 0.30 C ATOM 2032 O PHE A 129 -10.544 -1.345 -8.160 1.00 0.32 O ATOM 2033 CB PHE A 129 -11.347 -0.622 -5.275 1.00 0.36 C ATOM 2034 CG PHE A 129 -12.558 -0.745 -6.159 1.00 0.42 C ATOM 2035 CD1 PHE A 129 -13.185 -1.970 -6.322 1.00 0.47 C ATOM 2036 CD2 PHE A 129 -13.072 0.358 -6.821 1.00 0.48 C ATOM 2037 CE1 PHE A 129 -14.301 -2.093 -7.129 1.00 0.55 C ATOM 2038 CE2 PHE A 129 -14.187 0.242 -7.630 1.00 0.56 C ATOM 2039 CZ PHE A 129 -14.792 -0.958 -7.800 1.00 0.58 C ATOM 0 H PHE A 129 -9.169 -0.383 -4.187 1.00 0.28 H new ATOM 0 HA PHE A 129 -10.269 -2.430 -5.765 1.00 0.30 H new ATOM 0 HB2 PHE A 129 -11.594 -1.010 -4.287 1.00 0.36 H new ATOM 0 HB3 PHE A 129 -11.108 0.434 -5.153 1.00 0.36 H new ATOM 0 HD1 PHE A 129 -12.797 -2.840 -5.812 1.00 0.47 H new ATOM 0 HD2 PHE A 129 -12.596 1.320 -6.704 1.00 0.48 H new ATOM 0 HE1 PHE A 129 -14.790 -3.049 -7.243 1.00 0.55 H new ATOM 0 HE2 PHE A 129 -14.579 1.115 -8.130 1.00 0.56 H new ATOM 0 HZ PHE A 129 -15.650 -1.043 -8.450 1.00 0.58 H new ATOM 2049 N GLU A 130 -8.799 -0.136 -7.436 1.00 0.29 N ATOM 2050 CA GLU A 130 -8.440 0.341 -8.765 1.00 0.31 C ATOM 2051 C GLU A 130 -7.206 -0.375 -9.301 1.00 0.29 C ATOM 2052 O GLU A 130 -7.027 -0.492 -10.513 1.00 0.32 O ATOM 2053 CB GLU A 130 -8.192 1.850 -8.735 1.00 0.36 C ATOM 2054 CG GLU A 130 -7.920 2.455 -10.105 1.00 0.93 C ATOM 2055 CD GLU A 130 -9.112 2.357 -11.040 1.00 1.41 C ATOM 2056 OE1 GLU A 130 -9.533 1.223 -11.351 1.00 2.43 O ATOM 2057 OE2 GLU A 130 -9.627 3.416 -11.457 1.00 1.52 O ATOM 0 H GLU A 130 -8.196 0.206 -6.688 1.00 0.29 H new ATOM 0 HA GLU A 130 -9.274 0.123 -9.432 1.00 0.31 H new ATOM 0 HB2 GLU A 130 -9.060 2.343 -8.296 1.00 0.36 H new ATOM 0 HB3 GLU A 130 -7.344 2.057 -8.082 1.00 0.36 H new ATOM 0 HG2 GLU A 130 -7.643 3.502 -9.986 1.00 0.93 H new ATOM 0 HG3 GLU A 130 -7.067 1.949 -10.557 1.00 0.93 H new ATOM 2064 N ILE A 131 -6.347 -0.843 -8.397 1.00 0.26 N ATOM 2065 CA ILE A 131 -5.131 -1.528 -8.812 1.00 0.27 C ATOM 2066 C ILE A 131 -5.445 -2.955 -9.229 1.00 0.27 C ATOM 2067 O ILE A 131 -4.787 -3.517 -10.101 1.00 0.30 O ATOM 2068 CB ILE A 131 -4.074 -1.522 -7.687 1.00 0.27 C ATOM 2069 CG1 ILE A 131 -4.299 -2.662 -6.678 1.00 0.29 C ATOM 2070 CG2 ILE A 131 -4.113 -0.181 -6.973 1.00 0.32 C ATOM 2071 CD1 ILE A 131 -3.181 -2.796 -5.674 1.00 0.59 C ATOM 0 H ILE A 131 -6.470 -0.761 -7.388 1.00 0.26 H new ATOM 0 HA ILE A 131 -4.719 -0.991 -9.666 1.00 0.27 H new ATOM 0 HB ILE A 131 -3.095 -1.679 -8.140 1.00 0.27 H new ATOM 0 HG12 ILE A 131 -5.236 -2.490 -6.148 1.00 0.29 H new ATOM 0 HG13 ILE A 131 -4.407 -3.602 -7.219 1.00 0.29 H new ATOM 0 HG21 ILE A 131 -3.368 -0.171 -6.177 1.00 0.32 H new ATOM 0 HG22 ILE A 131 -3.895 0.616 -7.684 1.00 0.32 H new ATOM 0 HG23 ILE A 131 -5.103 -0.025 -6.545 1.00 0.32 H new ATOM 0 HD11 ILE A 131 -3.401 -3.617 -4.992 1.00 0.59 H new ATOM 0 HD12 ILE A 131 -2.246 -2.998 -6.196 1.00 0.59 H new ATOM 0 HD13 ILE A 131 -3.087 -1.869 -5.108 1.00 0.59 H new ATOM 2083 N ALA A 132 -6.488 -3.505 -8.621 1.00 0.24 N ATOM 2084 CA ALA A 132 -6.958 -4.856 -8.927 1.00 0.25 C ATOM 2085 C ALA A 132 -7.935 -5.360 -7.873 1.00 0.23 C ATOM 2086 O ALA A 132 -7.537 -5.974 -6.891 1.00 0.28 O ATOM 2087 CB ALA A 132 -5.793 -5.828 -9.065 1.00 0.30 C ATOM 0 H ALA A 132 -7.034 -3.030 -7.902 1.00 0.24 H new ATOM 0 HA ALA A 132 -7.481 -4.803 -9.882 1.00 0.25 H new ATOM 0 HB1 ALA A 132 -6.175 -6.823 -9.292 1.00 0.30 H new ATOM 0 HB2 ALA A 132 -5.137 -5.498 -9.871 1.00 0.30 H new ATOM 0 HB3 ALA A 132 -5.232 -5.859 -8.131 1.00 0.30 H new ATOM 2093 N PRO A 133 -9.236 -5.101 -8.052 1.00 0.25 N ATOM 2094 CA PRO A 133 -10.263 -5.520 -7.113 1.00 0.31 C ATOM 2095 C PRO A 133 -10.944 -6.822 -7.524 1.00 0.35 C ATOM 2096 O PRO A 133 -12.014 -7.161 -7.018 1.00 0.45 O ATOM 2097 CB PRO A 133 -11.230 -4.362 -7.218 1.00 0.37 C ATOM 2098 CG PRO A 133 -11.228 -4.043 -8.679 1.00 0.37 C ATOM 2099 CD PRO A 133 -9.832 -4.353 -9.175 1.00 0.29 C ATOM 0 HA PRO A 133 -9.878 -5.724 -6.114 1.00 0.31 H new ATOM 0 HB2 PRO A 133 -12.225 -4.636 -6.868 1.00 0.37 H new ATOM 0 HB3 PRO A 133 -10.905 -3.511 -6.620 1.00 0.37 H new ATOM 0 HG2 PRO A 133 -11.971 -4.639 -9.209 1.00 0.37 H new ATOM 0 HG3 PRO A 133 -11.479 -2.996 -8.850 1.00 0.37 H new ATOM 0 HD2 PRO A 133 -9.852 -4.946 -10.089 1.00 0.29 H new ATOM 0 HD3 PRO A 133 -9.272 -3.445 -9.397 1.00 0.29 H new ATOM 2107 N GLU A 134 -10.323 -7.544 -8.451 1.00 0.32 N ATOM 2108 CA GLU A 134 -10.876 -8.803 -8.934 1.00 0.37 C ATOM 2109 C GLU A 134 -10.233 -9.977 -8.216 1.00 0.37 C ATOM 2110 O GLU A 134 -10.210 -11.097 -8.728 1.00 0.52 O ATOM 2111 CB GLU A 134 -10.666 -8.930 -10.444 1.00 0.44 C ATOM 2112 CG GLU A 134 -9.204 -8.900 -10.861 1.00 0.46 C ATOM 2113 CD GLU A 134 -9.022 -9.052 -12.359 1.00 0.54 C ATOM 2114 OE1 GLU A 134 -9.549 -8.207 -13.111 1.00 0.87 O ATOM 2115 OE2 GLU A 134 -8.352 -10.019 -12.780 1.00 1.14 O ATOM 0 H GLU A 134 -9.437 -7.279 -8.882 1.00 0.32 H new ATOM 0 HA GLU A 134 -11.946 -8.812 -8.726 1.00 0.37 H new ATOM 0 HB2 GLU A 134 -11.114 -9.863 -10.787 1.00 0.44 H new ATOM 0 HB3 GLU A 134 -11.195 -8.119 -10.945 1.00 0.44 H new ATOM 0 HG2 GLU A 134 -8.757 -7.960 -10.538 1.00 0.46 H new ATOM 0 HG3 GLU A 134 -8.668 -9.700 -10.350 1.00 0.46 H new ATOM 2122 N LEU A 135 -9.707 -9.710 -7.028 1.00 0.30 N ATOM 2123 CA LEU A 135 -9.056 -10.743 -6.239 1.00 0.35 C ATOM 2124 C LEU A 135 -9.997 -11.290 -5.182 1.00 0.34 C ATOM 2125 O LEU A 135 -10.784 -10.552 -4.597 1.00 0.39 O ATOM 2126 CB LEU A 135 -7.804 -10.190 -5.560 1.00 0.41 C ATOM 2127 CG LEU A 135 -6.705 -11.225 -5.287 1.00 0.69 C ATOM 2128 CD1 LEU A 135 -5.418 -10.549 -4.857 1.00 1.27 C ATOM 2129 CD2 LEU A 135 -7.137 -12.224 -4.224 1.00 1.41 C ATOM 0 H LEU A 135 -9.719 -8.788 -6.592 1.00 0.30 H new ATOM 0 HA LEU A 135 -8.775 -11.549 -6.916 1.00 0.35 H new ATOM 0 HB2 LEU A 135 -7.390 -9.398 -6.184 1.00 0.41 H new ATOM 0 HB3 LEU A 135 -8.094 -9.732 -4.614 1.00 0.41 H new ATOM 0 HG LEU A 135 -6.530 -11.762 -6.219 1.00 0.69 H new ATOM 0 HD11 LEU A 135 -4.655 -11.305 -4.670 1.00 1.27 H new ATOM 0 HD12 LEU A 135 -5.078 -9.878 -5.646 1.00 1.27 H new ATOM 0 HD13 LEU A 135 -5.594 -9.977 -3.946 1.00 1.27 H new ATOM 0 HD21 LEU A 135 -6.336 -12.944 -4.054 1.00 1.41 H new ATOM 0 HD22 LEU A 135 -7.354 -11.696 -3.295 1.00 1.41 H new ATOM 0 HD23 LEU A 135 -8.031 -12.749 -4.560 1.00 1.41 H new ATOM 2141 N VAL A 136 -9.882 -12.581 -4.925 1.00 0.36 N ATOM 2142 CA VAL A 136 -10.695 -13.238 -3.916 1.00 0.38 C ATOM 2143 C VAL A 136 -9.806 -13.961 -2.910 1.00 0.42 C ATOM 2144 O VAL A 136 -9.054 -14.867 -3.269 1.00 0.53 O ATOM 2145 CB VAL A 136 -11.703 -14.223 -4.546 1.00 0.41 C ATOM 2146 CG1 VAL A 136 -11.016 -15.118 -5.565 1.00 0.46 C ATOM 2147 CG2 VAL A 136 -12.386 -15.060 -3.473 1.00 0.44 C ATOM 0 H VAL A 136 -9.228 -13.199 -5.405 1.00 0.36 H new ATOM 0 HA VAL A 136 -11.267 -12.467 -3.399 1.00 0.38 H new ATOM 0 HB VAL A 136 -12.467 -13.641 -5.061 1.00 0.41 H new ATOM 0 HG11 VAL A 136 -11.745 -15.804 -5.996 1.00 0.46 H new ATOM 0 HG12 VAL A 136 -10.583 -14.504 -6.355 1.00 0.46 H new ATOM 0 HG13 VAL A 136 -10.227 -15.688 -5.075 1.00 0.46 H new ATOM 0 HG21 VAL A 136 -13.092 -15.746 -3.941 1.00 0.44 H new ATOM 0 HG22 VAL A 136 -11.636 -15.629 -2.924 1.00 0.44 H new ATOM 0 HG23 VAL A 136 -12.920 -14.404 -2.785 1.00 0.44 H new ATOM 2157 N PHE A 137 -9.893 -13.542 -1.651 1.00 0.46 N ATOM 2158 CA PHE A 137 -9.099 -14.134 -0.588 1.00 0.53 C ATOM 2159 C PHE A 137 -9.309 -15.640 -0.550 1.00 0.57 C ATOM 2160 O PHE A 137 -10.388 -16.124 -0.893 1.00 0.60 O ATOM 2161 CB PHE A 137 -9.484 -13.532 0.770 1.00 0.59 C ATOM 2162 CG PHE A 137 -9.089 -12.089 0.964 1.00 0.58 C ATOM 2163 CD1 PHE A 137 -9.212 -11.187 -0.082 1.00 0.55 C ATOM 2164 CD2 PHE A 137 -8.586 -11.633 2.175 1.00 0.66 C ATOM 2165 CE1 PHE A 137 -8.845 -9.865 0.073 1.00 0.59 C ATOM 2166 CE2 PHE A 137 -8.219 -10.311 2.336 1.00 0.68 C ATOM 2167 CZ PHE A 137 -8.371 -9.429 1.358 1.00 0.64 C ATOM 0 H PHE A 137 -10.510 -12.790 -1.344 1.00 0.46 H new ATOM 0 HA PHE A 137 -8.049 -13.920 -0.788 1.00 0.53 H new ATOM 0 HB2 PHE A 137 -10.563 -13.617 0.895 1.00 0.59 H new ATOM 0 HB3 PHE A 137 -9.024 -14.128 1.558 1.00 0.59 H new ATOM 0 HD1 PHE A 137 -9.601 -11.523 -1.032 1.00 0.55 H new ATOM 0 HD2 PHE A 137 -8.480 -12.320 3.001 1.00 0.66 H new ATOM 0 HE1 PHE A 137 -8.913 -9.173 -0.754 1.00 0.59 H new ATOM 0 HE2 PHE A 137 -7.800 -9.989 3.278 1.00 0.68 H new ATOM 0 HZ PHE A 137 -8.140 -8.388 1.526 1.00 0.64 H new ATOM 2177 N PRO A 138 -8.291 -16.402 -0.115 1.00 0.60 N ATOM 2178 CA PRO A 138 -8.393 -17.857 -0.017 1.00 0.66 C ATOM 2179 C PRO A 138 -9.674 -18.261 0.707 1.00 0.73 C ATOM 2180 O PRO A 138 -10.164 -19.380 0.561 1.00 0.78 O ATOM 2181 CB PRO A 138 -7.157 -18.263 0.798 1.00 0.70 C ATOM 2182 CG PRO A 138 -6.541 -16.990 1.282 1.00 0.75 C ATOM 2183 CD PRO A 138 -6.981 -15.918 0.329 1.00 0.62 C ATOM 0 HA PRO A 138 -8.430 -18.342 -0.993 1.00 0.66 H new ATOM 0 HB2 PRO A 138 -7.436 -18.904 1.635 1.00 0.70 H new ATOM 0 HB3 PRO A 138 -6.454 -18.827 0.185 1.00 0.70 H new ATOM 0 HG2 PRO A 138 -6.865 -16.763 2.298 1.00 0.75 H new ATOM 0 HG3 PRO A 138 -5.454 -17.068 1.304 1.00 0.75 H new ATOM 0 HD2 PRO A 138 -7.052 -14.946 0.817 1.00 0.62 H new ATOM 0 HD3 PRO A 138 -6.287 -15.806 -0.504 1.00 0.62 H new ATOM 2191 N ASP A 139 -10.207 -17.318 1.476 1.00 0.77 N ATOM 2192 CA ASP A 139 -11.439 -17.522 2.227 1.00 0.87 C ATOM 2193 C ASP A 139 -12.627 -17.648 1.279 1.00 0.80 C ATOM 2194 O ASP A 139 -13.280 -18.691 1.218 1.00 1.03 O ATOM 2195 CB ASP A 139 -11.666 -16.345 3.174 1.00 0.92 C ATOM 2196 CG ASP A 139 -12.728 -16.633 4.216 1.00 1.33 C ATOM 2197 OD1 ASP A 139 -12.539 -17.578 5.011 1.00 1.72 O ATOM 2198 OD2 ASP A 139 -13.750 -15.915 4.239 1.00 1.91 O ATOM 0 H ASP A 139 -9.797 -16.392 1.596 1.00 0.77 H new ATOM 0 HA ASP A 139 -11.348 -18.443 2.802 1.00 0.87 H new ATOM 0 HB2 ASP A 139 -10.729 -16.099 3.674 1.00 0.92 H new ATOM 0 HB3 ASP A 139 -11.958 -15.469 2.595 1.00 0.92 H new ATOM 2203 N GLY A 140 -12.900 -16.572 0.544 1.00 0.59 N ATOM 2204 CA GLY A 140 -14.008 -16.568 -0.394 1.00 0.59 C ATOM 2205 C GLY A 140 -14.453 -15.161 -0.763 1.00 0.61 C ATOM 2206 O GLY A 140 -15.218 -14.976 -1.709 1.00 0.95 O ATOM 0 H GLY A 140 -12.371 -15.701 0.583 1.00 0.59 H new ATOM 0 HA2 GLY A 140 -13.716 -17.102 -1.298 1.00 0.59 H new ATOM 0 HA3 GLY A 140 -14.849 -17.110 0.039 1.00 0.59 H new ATOM 2210 N GLU A 141 -13.971 -14.173 -0.014 1.00 0.51 N ATOM 2211 CA GLU A 141 -14.321 -12.775 -0.265 1.00 0.62 C ATOM 2212 C GLU A 141 -13.409 -12.161 -1.317 1.00 0.53 C ATOM 2213 O GLU A 141 -12.387 -12.734 -1.668 1.00 0.59 O ATOM 2214 CB GLU A 141 -14.230 -11.961 1.024 1.00 0.86 C ATOM 2215 CG GLU A 141 -15.413 -12.141 1.967 1.00 1.38 C ATOM 2216 CD GLU A 141 -15.566 -13.563 2.475 1.00 2.15 C ATOM 2217 OE1 GLU A 141 -15.894 -14.451 1.659 1.00 2.76 O ATOM 2218 OE2 GLU A 141 -15.361 -13.792 3.685 1.00 2.53 O ATOM 0 H GLU A 141 -13.337 -14.313 0.772 1.00 0.51 H new ATOM 0 HA GLU A 141 -15.346 -12.753 -0.635 1.00 0.62 H new ATOM 0 HB2 GLU A 141 -13.316 -12.237 1.550 1.00 0.86 H new ATOM 0 HB3 GLU A 141 -14.143 -10.905 0.767 1.00 0.86 H new ATOM 0 HG2 GLU A 141 -15.296 -11.470 2.818 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -16.327 -11.846 1.452 1.00 1.38 H new ATOM 2225 N MET A 142 -13.791 -10.988 -1.814 1.00 0.48 N ATOM 2226 CA MET A 142 -13.003 -10.293 -2.833 1.00 0.41 C ATOM 2227 C MET A 142 -12.722 -8.849 -2.426 1.00 0.37 C ATOM 2228 O MET A 142 -13.417 -8.296 -1.576 1.00 0.39 O ATOM 2229 CB MET A 142 -13.744 -10.311 -4.172 1.00 0.42 C ATOM 2230 CG MET A 142 -14.076 -11.709 -4.668 1.00 0.49 C ATOM 2231 SD MET A 142 -14.934 -11.698 -6.254 1.00 0.55 S ATOM 2232 CE MET A 142 -16.394 -10.743 -5.844 1.00 1.68 C ATOM 0 H MET A 142 -14.639 -10.498 -1.530 1.00 0.48 H new ATOM 0 HA MET A 142 -12.051 -10.815 -2.933 1.00 0.41 H new ATOM 0 HB2 MET A 142 -14.668 -9.741 -4.074 1.00 0.42 H new ATOM 0 HB3 MET A 142 -13.135 -9.804 -4.921 1.00 0.42 H new ATOM 0 HG2 MET A 142 -13.156 -12.285 -4.761 1.00 0.49 H new ATOM 0 HG3 MET A 142 -14.695 -12.215 -3.928 1.00 0.49 H new ATOM 0 HE1 MET A 142 -17.255 -11.148 -6.375 1.00 1.68 H new ATOM 0 HE2 MET A 142 -16.573 -10.795 -4.770 1.00 1.68 H new ATOM 0 HE3 MET A 142 -16.243 -9.704 -6.137 1.00 1.68 H new ATOM 2242 N LEU A 143 -11.710 -8.227 -3.046 1.00 0.38 N ATOM 2243 CA LEU A 143 -11.376 -6.844 -2.740 1.00 0.39 C ATOM 2244 C LEU A 143 -12.580 -5.950 -3.009 1.00 0.41 C ATOM 2245 O LEU A 143 -12.709 -4.867 -2.438 1.00 0.50 O ATOM 2246 CB LEU A 143 -10.178 -6.388 -3.577 1.00 0.44 C ATOM 2247 CG LEU A 143 -9.718 -4.947 -3.337 1.00 0.51 C ATOM 2248 CD1 LEU A 143 -9.357 -4.736 -1.875 1.00 1.38 C ATOM 2249 CD2 LEU A 143 -8.533 -4.618 -4.232 1.00 1.56 C ATOM 0 H LEU A 143 -11.118 -8.661 -3.754 1.00 0.38 H new ATOM 0 HA LEU A 143 -11.108 -6.770 -1.686 1.00 0.39 H new ATOM 0 HB2 LEU A 143 -9.341 -7.057 -3.376 1.00 0.44 H new ATOM 0 HB3 LEU A 143 -10.430 -6.500 -4.632 1.00 0.44 H new ATOM 0 HG LEU A 143 -10.540 -4.275 -3.585 1.00 0.51 H new ATOM 0 HD11 LEU A 143 -9.033 -3.706 -1.725 1.00 1.38 H new ATOM 0 HD12 LEU A 143 -10.229 -4.936 -1.252 1.00 1.38 H new ATOM 0 HD13 LEU A 143 -8.550 -5.414 -1.598 1.00 1.38 H new ATOM 0 HD21 LEU A 143 -8.215 -3.591 -4.052 1.00 1.56 H new ATOM 0 HD22 LEU A 143 -7.710 -5.297 -4.010 1.00 1.56 H new ATOM 0 HD23 LEU A 143 -8.824 -4.730 -5.277 1.00 1.56 H new ATOM 2261 N ARG A 144 -13.465 -6.430 -3.878 1.00 0.39 N ATOM 2262 CA ARG A 144 -14.676 -5.703 -4.227 1.00 0.47 C ATOM 2263 C ARG A 144 -15.753 -5.966 -3.180 1.00 0.49 C ATOM 2264 O ARG A 144 -16.469 -5.055 -2.762 1.00 0.56 O ATOM 2265 CB ARG A 144 -15.157 -6.130 -5.621 1.00 0.54 C ATOM 2266 CG ARG A 144 -16.260 -5.254 -6.206 1.00 0.77 C ATOM 2267 CD ARG A 144 -17.609 -5.505 -5.551 1.00 0.88 C ATOM 2268 NE ARG A 144 -18.656 -4.657 -6.116 1.00 1.47 N ATOM 2269 CZ ARG A 144 -19.926 -4.691 -5.725 1.00 2.12 C ATOM 2270 NH1 ARG A 144 -20.310 -5.530 -4.772 1.00 2.68 N ATOM 2271 NH2 ARG A 144 -20.816 -3.883 -6.288 1.00 2.83 N ATOM 0 H ARG A 144 -13.362 -7.326 -4.355 1.00 0.39 H new ATOM 0 HA ARG A 144 -14.465 -4.634 -4.248 1.00 0.47 H new ATOM 0 HB2 ARG A 144 -14.306 -6.124 -6.302 1.00 0.54 H new ATOM 0 HB3 ARG A 144 -15.516 -7.158 -5.568 1.00 0.54 H new ATOM 0 HG2 ARG A 144 -15.990 -4.205 -6.084 1.00 0.77 H new ATOM 0 HG3 ARG A 144 -16.339 -5.441 -7.277 1.00 0.77 H new ATOM 0 HD2 ARG A 144 -17.884 -6.552 -5.676 1.00 0.88 H new ATOM 0 HD3 ARG A 144 -17.532 -5.321 -4.479 1.00 0.88 H new ATOM 0 HE ARG A 144 -18.398 -4.001 -6.853 1.00 1.47 H new ATOM 0 HH11 ARG A 144 -19.630 -6.152 -4.336 1.00 2.68 H new ATOM 0 HH12 ARG A 144 -21.286 -5.553 -4.475 1.00 2.68 H new ATOM 0 HH21 ARG A 144 -20.525 -3.236 -7.021 1.00 2.83 H new ATOM 0 HH22 ARG A 144 -21.790 -3.909 -5.988 1.00 2.83 H new ATOM 2285 N GLN A 145 -15.854 -7.224 -2.755 1.00 0.47 N ATOM 2286 CA GLN A 145 -16.833 -7.623 -1.752 1.00 0.52 C ATOM 2287 C GLN A 145 -16.574 -6.912 -0.426 1.00 0.48 C ATOM 2288 O GLN A 145 -17.510 -6.569 0.294 1.00 0.56 O ATOM 2289 CB GLN A 145 -16.806 -9.147 -1.566 1.00 0.57 C ATOM 2290 CG GLN A 145 -17.701 -9.655 -0.445 1.00 0.64 C ATOM 2291 CD GLN A 145 -17.061 -9.545 0.931 1.00 0.60 C ATOM 2292 OE1 GLN A 145 -17.716 -9.764 1.949 1.00 0.67 O ATOM 2293 NE2 GLN A 145 -15.770 -9.225 0.968 1.00 0.52 N ATOM 0 H GLN A 145 -15.266 -7.986 -3.093 1.00 0.47 H new ATOM 0 HA GLN A 145 -17.824 -7.331 -2.100 1.00 0.52 H new ATOM 0 HB2 GLN A 145 -17.108 -9.621 -2.500 1.00 0.57 H new ATOM 0 HB3 GLN A 145 -15.781 -9.459 -1.367 1.00 0.57 H new ATOM 0 HG2 GLN A 145 -18.634 -9.092 -0.450 1.00 0.64 H new ATOM 0 HG3 GLN A 145 -17.957 -10.697 -0.637 1.00 0.64 H new ATOM 0 HE21 GLN A 145 -15.263 -9.051 0.100 1.00 0.52 H new ATOM 0 HE22 GLN A 145 -15.288 -9.154 1.864 1.00 0.52 H new ATOM 2302 N ILE A 146 -15.301 -6.689 -0.114 1.00 0.40 N ATOM 2303 CA ILE A 146 -14.930 -6.011 1.123 1.00 0.40 C ATOM 2304 C ILE A 146 -15.514 -4.603 1.148 1.00 0.43 C ATOM 2305 O ILE A 146 -15.920 -4.104 2.197 1.00 0.53 O ATOM 2306 CB ILE A 146 -13.399 -5.932 1.289 1.00 0.42 C ATOM 2307 CG1 ILE A 146 -12.795 -7.338 1.295 1.00 0.43 C ATOM 2308 CG2 ILE A 146 -13.043 -5.190 2.570 1.00 0.50 C ATOM 2309 CD1 ILE A 146 -11.281 -7.353 1.372 1.00 0.78 C ATOM 0 H ILE A 146 -14.512 -6.967 -0.698 1.00 0.40 H new ATOM 0 HA ILE A 146 -15.336 -6.594 1.950 1.00 0.40 H new ATOM 0 HB ILE A 146 -12.983 -5.380 0.446 1.00 0.42 H new ATOM 0 HG12 ILE A 146 -13.198 -7.893 2.142 1.00 0.43 H new ATOM 0 HG13 ILE A 146 -13.109 -7.862 0.392 1.00 0.43 H new ATOM 0 HG21 ILE A 146 -11.959 -5.142 2.674 1.00 0.50 H new ATOM 0 HG22 ILE A 146 -13.449 -4.179 2.530 1.00 0.50 H new ATOM 0 HG23 ILE A 146 -13.466 -5.717 3.425 1.00 0.50 H new ATOM 0 HD11 ILE A 146 -10.927 -8.384 1.372 1.00 0.78 H new ATOM 0 HD12 ILE A 146 -10.868 -6.827 0.511 1.00 0.78 H new ATOM 0 HD13 ILE A 146 -10.958 -6.859 2.288 1.00 0.78 H new ATOM 2321 N LEU A 147 -15.565 -3.976 -0.024 1.00 0.42 N ATOM 2322 CA LEU A 147 -16.112 -2.632 -0.153 1.00 0.50 C ATOM 2323 C LEU A 147 -17.632 -2.657 -0.025 1.00 0.59 C ATOM 2324 O LEU A 147 -18.264 -1.622 0.172 1.00 0.72 O ATOM 2325 CB LEU A 147 -15.719 -2.023 -1.498 1.00 0.55 C ATOM 2326 CG LEU A 147 -14.230 -1.711 -1.660 1.00 0.61 C ATOM 2327 CD1 LEU A 147 -13.944 -1.213 -3.067 1.00 0.76 C ATOM 2328 CD2 LEU A 147 -13.789 -0.682 -0.631 1.00 0.62 C ATOM 0 H LEU A 147 -15.233 -4.380 -0.900 1.00 0.42 H new ATOM 0 HA LEU A 147 -15.700 -2.020 0.649 1.00 0.50 H new ATOM 0 HB2 LEU A 147 -16.019 -2.708 -2.291 1.00 0.55 H new ATOM 0 HB3 LEU A 147 -16.285 -1.102 -1.641 1.00 0.55 H new ATOM 0 HG LEU A 147 -13.663 -2.628 -1.496 1.00 0.61 H new ATOM 0 HD11 LEU A 147 -12.881 -0.995 -3.167 1.00 0.76 H new ATOM 0 HD12 LEU A 147 -14.227 -1.979 -3.789 1.00 0.76 H new ATOM 0 HD13 LEU A 147 -14.519 -0.307 -3.256 1.00 0.76 H new ATOM 0 HD21 LEU A 147 -12.727 -0.471 -0.759 1.00 0.62 H new ATOM 0 HD22 LEU A 147 -14.361 0.236 -0.767 1.00 0.62 H new ATOM 0 HD23 LEU A 147 -13.962 -1.073 0.372 1.00 0.62 H new ATOM 2340 N HIS A 148 -18.213 -3.846 -0.141 1.00 0.59 N ATOM 2341 CA HIS A 148 -19.660 -3.997 -0.036 1.00 0.73 C ATOM 2342 C HIS A 148 -20.089 -3.939 1.427 1.00 0.79 C ATOM 2343 O HIS A 148 -21.178 -3.459 1.747 1.00 0.90 O ATOM 2344 CB HIS A 148 -20.108 -5.320 -0.664 1.00 0.77 C ATOM 2345 CG HIS A 148 -21.593 -5.506 -0.682 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -22.362 -5.548 0.463 1.00 1.36 N ATOM 2347 CD2 HIS A 148 -22.454 -5.658 -1.717 1.00 1.58 C ATOM 2348 CE1 HIS A 148 -23.631 -5.718 0.133 1.00 1.28 C ATOM 2349 NE2 HIS A 148 -23.713 -5.788 -1.182 1.00 1.34 N ATOM 0 H HIS A 148 -17.707 -4.716 -0.307 1.00 0.59 H new ATOM 0 HA HIS A 148 -20.134 -3.178 -0.577 1.00 0.73 H new ATOM 0 HB2 HIS A 148 -19.732 -5.373 -1.686 1.00 0.77 H new ATOM 0 HB3 HIS A 148 -19.654 -6.145 -0.114 1.00 0.77 H new ATOM 0 HD2 HIS A 148 -22.199 -5.674 -2.766 1.00 1.58 H new ATOM 0 HE1 HIS A 148 -24.459 -5.788 0.822 1.00 1.28 H new ATOM 0 HE2 HIS A 148 -24.573 -5.918 -1.716 1.00 1.34 H new ATOM 2358 N THR A 149 -19.222 -4.423 2.307 1.00 0.77 N ATOM 2359 CA THR A 149 -19.496 -4.424 3.737 1.00 0.88 C ATOM 2360 C THR A 149 -18.963 -3.149 4.386 1.00 0.86 C ATOM 2361 O THR A 149 -19.502 -2.675 5.386 1.00 0.94 O ATOM 2362 CB THR A 149 -18.864 -5.652 4.397 1.00 0.90 C ATOM 2363 OG1 THR A 149 -19.363 -6.843 3.819 1.00 1.10 O ATOM 2364 CG2 THR A 149 -19.108 -5.726 5.889 1.00 1.18 C ATOM 0 H THR A 149 -18.318 -4.822 2.053 1.00 0.77 H new ATOM 0 HA THR A 149 -20.576 -4.462 3.880 1.00 0.88 H new ATOM 0 HB THR A 149 -17.792 -5.550 4.228 1.00 0.90 H new ATOM 0 HG1 THR A 149 -18.946 -7.617 4.253 1.00 1.10 H new ATOM 0 HG21 THR A 149 -18.633 -6.620 6.292 1.00 1.18 H new ATOM 0 HG22 THR A 149 -18.687 -4.843 6.371 1.00 1.18 H new ATOM 0 HG23 THR A 149 -20.180 -5.768 6.081 1.00 1.18 H new ATOM 2372 N ARG A 150 -17.902 -2.600 3.803 1.00 0.86 N ATOM 2373 CA ARG A 150 -17.292 -1.378 4.314 1.00 0.93 C ATOM 2374 C ARG A 150 -17.819 -0.155 3.571 1.00 0.95 C ATOM 2375 O ARG A 150 -18.400 0.747 4.175 1.00 1.05 O ATOM 2376 CB ARG A 150 -15.768 -1.447 4.181 1.00 0.99 C ATOM 2377 CG ARG A 150 -15.114 -2.553 4.998 1.00 0.96 C ATOM 2378 CD ARG A 150 -15.286 -2.338 6.497 1.00 1.26 C ATOM 2379 NE ARG A 150 -16.669 -2.526 6.930 1.00 2.01 N ATOM 2380 CZ ARG A 150 -17.076 -2.375 8.188 1.00 2.55 C ATOM 2381 NH1 ARG A 150 -16.210 -2.036 9.135 1.00 2.55 N ATOM 2382 NH2 ARG A 150 -18.351 -2.564 8.500 1.00 3.55 N ATOM 0 H ARG A 150 -17.446 -2.983 2.975 1.00 0.86 H new ATOM 0 HA ARG A 150 -17.556 -1.286 5.368 1.00 0.93 H new ATOM 0 HB2 ARG A 150 -15.513 -1.589 3.131 1.00 0.99 H new ATOM 0 HB3 ARG A 150 -15.345 -0.489 4.485 1.00 0.99 H new ATOM 0 HG2 ARG A 150 -15.546 -3.514 4.718 1.00 0.96 H new ATOM 0 HG3 ARG A 150 -14.052 -2.600 4.759 1.00 0.96 H new ATOM 0 HD2 ARG A 150 -14.641 -3.031 7.037 1.00 1.26 H new ATOM 0 HD3 ARG A 150 -14.960 -1.331 6.757 1.00 1.26 H new ATOM 0 HE ARG A 150 -17.362 -2.788 6.228 1.00 2.01 H new ATOM 0 HH11 ARG A 150 -15.228 -1.890 8.900 1.00 2.55 H new ATOM 0 HH12 ARG A 150 -16.526 -1.921 10.098 1.00 2.55 H new ATOM 0 HH21 ARG A 150 -19.020 -2.825 7.776 1.00 3.55 H new ATOM 0 HH22 ARG A 150 -18.663 -2.448 9.464 1.00 3.55 H new ATOM 2396 N ALA A 151 -17.600 -0.132 2.257 1.00 0.94 N ATOM 2397 CA ALA A 151 -18.040 0.980 1.417 1.00 1.04 C ATOM 2398 C ALA A 151 -17.293 2.259 1.770 1.00 1.11 C ATOM 2399 O ALA A 151 -17.897 3.253 2.180 1.00 1.59 O ATOM 2400 CB ALA A 151 -19.544 1.184 1.542 1.00 1.61 C ATOM 0 H ALA A 151 -17.118 -0.874 1.750 1.00 0.94 H new ATOM 0 HA ALA A 151 -17.812 0.732 0.381 1.00 1.04 H new ATOM 0 HB1 ALA A 151 -19.852 2.016 0.909 1.00 1.61 H new ATOM 0 HB2 ALA A 151 -20.061 0.278 1.227 1.00 1.61 H new ATOM 0 HB3 ALA A 151 -19.796 1.404 2.579 1.00 1.61 H new ATOM 2406 N PHE A 152 -15.972 2.229 1.609 1.00 1.09 N ATOM 2407 CA PHE A 152 -15.143 3.381 1.909 1.00 1.61 C ATOM 2408 C PHE A 152 -14.586 4.001 0.633 1.00 1.38 C ATOM 2409 O PHE A 152 -13.371 4.135 0.471 1.00 1.90 O ATOM 2410 CB PHE A 152 -14.001 2.991 2.857 1.00 2.51 C ATOM 2411 CG PHE A 152 -14.440 2.711 4.272 1.00 3.40 C ATOM 2412 CD1 PHE A 152 -15.558 1.937 4.533 1.00 3.42 C ATOM 2413 CD2 PHE A 152 -13.728 3.226 5.344 1.00 4.44 C ATOM 2414 CE1 PHE A 152 -15.959 1.681 5.832 1.00 4.40 C ATOM 2415 CE2 PHE A 152 -14.123 2.975 6.645 1.00 5.41 C ATOM 2416 CZ PHE A 152 -15.239 2.200 6.890 1.00 5.37 C ATOM 0 H PHE A 152 -15.457 1.415 1.272 1.00 1.09 H new ATOM 0 HA PHE A 152 -15.767 4.125 2.404 1.00 1.61 H new ATOM 0 HB2 PHE A 152 -13.502 2.106 2.462 1.00 2.51 H new ATOM 0 HB3 PHE A 152 -13.264 3.794 2.869 1.00 2.51 H new ATOM 0 HD1 PHE A 152 -16.125 1.527 3.710 1.00 3.42 H new ATOM 0 HD2 PHE A 152 -12.853 3.832 5.161 1.00 4.44 H new ATOM 0 HE1 PHE A 152 -16.834 1.076 6.018 1.00 4.40 H new ATOM 0 HE2 PHE A 152 -13.559 3.385 7.469 1.00 5.41 H new ATOM 0 HZ PHE A 152 -15.548 2.000 7.905 1.00 5.37 H new ATOM 2426 N ASP A 153 -15.488 4.406 -0.258 1.00 1.04 N ATOM 2427 CA ASP A 153 -15.105 5.052 -1.513 1.00 1.18 C ATOM 2428 C ASP A 153 -14.535 6.436 -1.229 1.00 1.01 C ATOM 2429 O ASP A 153 -14.384 7.266 -2.125 1.00 1.40 O ATOM 2430 CB ASP A 153 -16.316 5.179 -2.435 1.00 1.46 C ATOM 2431 CG ASP A 153 -17.501 5.839 -1.757 1.00 2.05 C ATOM 2432 OD1 ASP A 153 -18.005 5.280 -0.760 1.00 2.54 O ATOM 2433 OD2 ASP A 153 -17.926 6.917 -2.223 1.00 2.52 O ATOM 0 H ASP A 153 -16.495 4.298 -0.134 1.00 1.04 H new ATOM 0 HA ASP A 153 -14.348 4.440 -2.003 1.00 1.18 H new ATOM 0 HB2 ASP A 153 -16.038 5.758 -3.316 1.00 1.46 H new ATOM 0 HB3 ASP A 153 -16.608 4.188 -2.784 1.00 1.46 H new ATOM 2438 N LYS A 154 -14.252 6.663 0.044 1.00 0.68 N ATOM 2439 CA LYS A 154 -13.719 7.914 0.542 1.00 0.59 C ATOM 2440 C LYS A 154 -12.420 8.321 -0.148 1.00 0.52 C ATOM 2441 O LYS A 154 -12.096 7.851 -1.237 1.00 0.67 O ATOM 2442 CB LYS A 154 -13.464 7.755 2.035 1.00 0.63 C ATOM 2443 CG LYS A 154 -14.648 7.178 2.786 1.00 0.79 C ATOM 2444 CD LYS A 154 -14.465 7.286 4.294 1.00 0.93 C ATOM 2445 CE LYS A 154 -13.259 6.486 4.776 1.00 0.94 C ATOM 2446 NZ LYS A 154 -13.052 6.625 6.244 1.00 1.77 N ATOM 0 H LYS A 154 -14.391 5.964 0.774 1.00 0.68 H new ATOM 0 HA LYS A 154 -14.447 8.699 0.336 1.00 0.59 H new ATOM 0 HB2 LYS A 154 -12.599 7.109 2.182 1.00 0.63 H new ATOM 0 HB3 LYS A 154 -13.212 8.727 2.459 1.00 0.63 H new ATOM 0 HG2 LYS A 154 -15.557 7.703 2.491 1.00 0.79 H new ATOM 0 HG3 LYS A 154 -14.780 6.132 2.509 1.00 0.79 H new ATOM 0 HD2 LYS A 154 -14.341 8.333 4.571 1.00 0.93 H new ATOM 0 HD3 LYS A 154 -15.364 6.927 4.796 1.00 0.93 H new ATOM 0 HE2 LYS A 154 -13.398 5.434 4.527 1.00 0.94 H new ATOM 0 HE3 LYS A 154 -12.366 6.823 4.250 1.00 0.94 H new ATOM 0 HZ1 LYS A 154 -12.135 6.211 6.506 1.00 1.77 H new ATOM 0 HZ2 LYS A 154 -13.063 7.632 6.502 1.00 1.77 H new ATOM 0 HZ3 LYS A 154 -13.813 6.129 6.750 1.00 1.77 H new ATOM 2460 N LEU A 155 -11.682 9.198 0.522 1.00 0.55 N ATOM 2461 CA LEU A 155 -10.405 9.694 0.028 1.00 0.57 C ATOM 2462 C LEU A 155 -10.559 10.472 -1.271 1.00 0.51 C ATOM 2463 O LEU A 155 -10.332 9.937 -2.357 1.00 0.61 O ATOM 2464 CB LEU A 155 -9.412 8.546 -0.175 1.00 0.67 C ATOM 2465 CG LEU A 155 -9.160 7.648 1.039 1.00 0.81 C ATOM 2466 CD1 LEU A 155 -7.761 7.069 0.963 1.00 1.81 C ATOM 2467 CD2 LEU A 155 -9.357 8.408 2.347 1.00 1.95 C ATOM 0 H LEU A 155 -11.954 9.586 1.425 1.00 0.55 H new ATOM 0 HA LEU A 155 -10.018 10.374 0.787 1.00 0.57 H new ATOM 0 HB2 LEU A 155 -9.772 7.923 -0.994 1.00 0.67 H new ATOM 0 HB3 LEU A 155 -8.459 8.969 -0.492 1.00 0.67 H new ATOM 0 HG LEU A 155 -9.887 6.836 1.023 1.00 0.81 H new ATOM 0 HD11 LEU A 155 -7.584 6.430 1.828 1.00 1.81 H new ATOM 0 HD12 LEU A 155 -7.660 6.481 0.051 1.00 1.81 H new ATOM 0 HD13 LEU A 155 -7.032 7.879 0.955 1.00 1.81 H new ATOM 0 HD21 LEU A 155 -9.170 7.740 3.188 1.00 1.95 H new ATOM 0 HD22 LEU A 155 -8.662 9.247 2.389 1.00 1.95 H new ATOM 0 HD23 LEU A 155 -10.380 8.781 2.401 1.00 1.95 H new ATOM 2479 N ASN A 156 -10.917 11.745 -1.156 1.00 0.54 N ATOM 2480 CA ASN A 156 -11.061 12.597 -2.329 1.00 0.54 C ATOM 2481 C ASN A 156 -9.684 12.878 -2.918 1.00 0.53 C ATOM 2482 O ASN A 156 -8.742 13.170 -2.182 1.00 0.75 O ATOM 2483 CB ASN A 156 -11.763 13.910 -1.959 1.00 0.63 C ATOM 2484 CG ASN A 156 -10.948 14.771 -1.011 1.00 1.07 C ATOM 2485 OD1 ASN A 156 -9.882 15.273 -1.369 1.00 2.09 O ATOM 2486 ND2 ASN A 156 -11.444 14.945 0.208 1.00 1.34 N ATOM 0 H ASN A 156 -11.112 12.208 -0.268 1.00 0.54 H new ATOM 0 HA ASN A 156 -11.674 12.085 -3.071 1.00 0.54 H new ATOM 0 HB2 ASN A 156 -11.968 14.475 -2.868 1.00 0.63 H new ATOM 0 HB3 ASN A 156 -12.725 13.684 -1.500 1.00 0.63 H new ATOM 0 HD21 ASN A 156 -10.938 15.512 0.888 1.00 1.34 H new ATOM 0 HD22 ASN A 156 -12.331 14.511 0.464 1.00 1.34 H new ATOM 2493 N LYS A 157 -9.557 12.769 -4.239 1.00 0.46 N ATOM 2494 CA LYS A 157 -8.272 12.997 -4.897 1.00 0.46 C ATOM 2495 C LYS A 157 -7.624 14.292 -4.425 1.00 0.48 C ATOM 2496 O LYS A 157 -8.062 15.385 -4.785 1.00 0.64 O ATOM 2497 CB LYS A 157 -8.432 13.028 -6.413 1.00 0.54 C ATOM 2498 CG LYS A 157 -8.898 11.709 -7.007 1.00 0.60 C ATOM 2499 CD LYS A 157 -9.059 11.797 -8.519 1.00 1.33 C ATOM 2500 CE LYS A 157 -10.110 12.821 -8.915 1.00 1.77 C ATOM 2501 NZ LYS A 157 -11.445 12.504 -8.335 1.00 2.30 N ATOM 0 H LYS A 157 -10.321 12.526 -4.870 1.00 0.46 H new ATOM 0 HA LYS A 157 -7.622 12.166 -4.625 1.00 0.46 H new ATOM 0 HB2 LYS A 157 -9.146 13.808 -6.678 1.00 0.54 H new ATOM 0 HB3 LYS A 157 -7.479 13.302 -6.864 1.00 0.54 H new ATOM 0 HG2 LYS A 157 -8.180 10.926 -6.763 1.00 0.60 H new ATOM 0 HG3 LYS A 157 -9.848 11.422 -6.556 1.00 0.60 H new ATOM 0 HD2 LYS A 157 -8.104 12.063 -8.972 1.00 1.33 H new ATOM 0 HD3 LYS A 157 -9.337 10.819 -8.913 1.00 1.33 H new ATOM 0 HE2 LYS A 157 -9.796 13.810 -8.582 1.00 1.77 H new ATOM 0 HE3 LYS A 157 -10.187 12.860 -10.002 1.00 1.77 H new ATOM 0 HZ1 LYS A 157 -12.167 13.111 -8.773 1.00 2.30 H new ATOM 0 HZ2 LYS A 157 -11.674 11.506 -8.517 1.00 2.30 H new ATOM 0 HZ3 LYS A 157 -11.427 12.673 -7.309 1.00 2.30 H new ATOM 2515 N TRP A 158 -6.572 14.139 -3.622 1.00 0.45 N ATOM 2516 CA TRP A 158 -5.815 15.266 -3.070 1.00 0.54 C ATOM 2517 C TRP A 158 -6.693 16.503 -2.881 1.00 0.75 C ATOM 2518 O TRP A 158 -6.674 17.385 -3.767 1.00 1.21 O ATOM 2519 CB TRP A 158 -4.620 15.595 -3.968 1.00 0.62 C ATOM 2520 CG TRP A 158 -3.750 16.692 -3.430 1.00 0.71 C ATOM 2521 CD1 TRP A 158 -3.352 17.819 -4.089 1.00 0.98 C ATOM 2522 CD2 TRP A 158 -3.165 16.762 -2.124 1.00 0.72 C ATOM 2523 NE1 TRP A 158 -2.559 18.590 -3.272 1.00 1.04 N ATOM 2524 CE2 TRP A 158 -2.429 17.961 -2.059 1.00 0.89 C ATOM 2525 CE3 TRP A 158 -3.194 15.930 -1.001 1.00 0.81 C ATOM 2526 CZ2 TRP A 158 -1.731 18.346 -0.919 1.00 1.01 C ATOM 2527 CZ3 TRP A 158 -2.499 16.314 0.130 1.00 1.03 C ATOM 2528 CH2 TRP A 158 -1.775 17.513 0.164 1.00 1.07 C ATOM 2529 OXT TRP A 158 -7.393 16.578 -1.849 1.00 1.47 O ATOM 0 H TRP A 158 -6.218 13.227 -3.334 1.00 0.45 H new ATOM 0 HA TRP A 158 -5.452 14.967 -2.087 1.00 0.54 H new ATOM 0 HB2 TRP A 158 -4.017 14.696 -4.101 1.00 0.62 H new ATOM 0 HB3 TRP A 158 -4.985 15.882 -4.954 1.00 0.62 H new ATOM 0 HD1 TRP A 158 -3.621 18.069 -5.105 1.00 0.98 H new ATOM 0 HE1 TRP A 158 -2.137 19.483 -3.526 1.00 1.04 H new ATOM 0 HE3 TRP A 158 -3.749 15.004 -1.017 1.00 0.81 H new ATOM 0 HZ2 TRP A 158 -1.174 19.271 -0.891 1.00 1.01 H new ATOM 0 HZ3 TRP A 158 -2.514 15.679 1.003 1.00 1.03 H new ATOM 0 HH2 TRP A 158 -1.241 17.784 1.063 1.00 1.07 H new TER 2540 TRP A 158