USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1071 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 Single : A 3 THR OG1 : rot 150:sc= 0.33 USER MOD Single : A 9 SER OG : rot -103:sc= 0.742 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 110:sc= -0.287 USER MOD Single : A 28 ASN : amide:sc= 0.0977 X(o=0.098,f=0) USER MOD Single : A 30 LYS NZ :NH3+ -126:sc= 0.603 (180deg=-0.132) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -99:sc= 0.186 USER MOD Single : A 37 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0255) USER MOD Single : A 39 LYS NZ :NH3+ -143:sc= 0.348 (180deg=0.02) USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.28) USER MOD Single : A 46 LYS NZ :NH3+ 154:sc= 0.895 (180deg=0.345) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0.283 X(o=0.28,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0207 USER MOD Single : A 72 TYR OH : rot 130:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.826 X(o=-0.83,f=-1.2) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0492) USER MOD Single : A 84 MET CE :methyl 141:sc= -0.772 (180deg=-1.24) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 89 GLN : amide:sc= -0.26 X(o=-0.26,f=-0.044) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.59) USER MOD Single : A 100 LYS NZ :NH3+ -168:sc= -0.0523 (180deg=-0.258) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 THR OG1 : rot -110:sc= -0.0356 USER MOD Single : A 111 ASN : amide:sc=-0.00564 X(o=-0.0056,f=0) USER MOD Single : A 116 LYS NZ :NH3+ -177:sc= 0.819 (180deg=0.815) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -125:sc= 0.558 (180deg=0.202) USER MOD Single : A 125 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0223) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 1.131 13.597 -1.137 1.00 12.21 N ATOM 21 CA GLY A 2 1.812 13.060 0.047 1.00 24.35 C ATOM 22 C GLY A 2 1.165 11.791 0.587 1.00 74.42 C ATOM 23 O GLY A 2 0.971 11.653 1.798 1.00 12.14 O ATOM 0 HA2 GLY A 2 2.852 12.852 -0.203 1.00 24.35 H new ATOM 0 HA3 GLY A 2 1.818 13.818 0.830 1.00 24.35 H new ATOM 27 N THR A 3 0.798 10.879 -0.328 1.00 13.55 N ATOM 28 CA THR A 3 0.068 9.643 -0.004 1.00 13.22 C ATOM 29 C THR A 3 0.869 8.407 -0.463 1.00 64.33 C ATOM 30 O THR A 3 1.176 8.280 -1.649 1.00 21.33 O ATOM 31 CB THR A 3 -1.333 9.660 -0.716 1.00 21.42 C ATOM 32 OG1 THR A 3 -2.039 10.873 -0.400 1.00 3.33 O ATOM 33 CG2 THR A 3 -2.201 8.458 -0.319 1.00 73.43 C ATOM 0 H THR A 3 1.002 10.980 -1.322 1.00 13.55 H new ATOM 0 HA THR A 3 -0.070 9.588 1.076 1.00 13.22 H new ATOM 0 HB THR A 3 -1.143 9.603 -1.788 1.00 21.42 H new ATOM 0 HG1 THR A 3 -2.624 11.115 -1.148 1.00 3.33 H new ATOM 0 HG21 THR A 3 -3.159 8.514 -0.836 1.00 73.43 H new ATOM 0 HG22 THR A 3 -1.692 7.535 -0.596 1.00 73.43 H new ATOM 0 HG23 THR A 3 -2.369 8.471 0.758 1.00 73.43 H new ATOM 41 N VAL A 4 1.220 7.517 0.484 1.00 25.11 N ATOM 42 CA VAL A 4 1.881 6.231 0.183 1.00 44.51 C ATOM 43 C VAL A 4 0.938 5.072 0.557 1.00 21.31 C ATOM 44 O VAL A 4 0.724 4.794 1.739 1.00 10.24 O ATOM 45 CB VAL A 4 3.250 6.079 0.960 1.00 3.35 C ATOM 46 CG1 VAL A 4 3.980 4.772 0.566 1.00 43.13 C ATOM 47 CG2 VAL A 4 4.158 7.304 0.728 1.00 24.33 C ATOM 0 H VAL A 4 1.054 7.668 1.479 1.00 25.11 H new ATOM 0 HA VAL A 4 2.102 6.206 -0.884 1.00 44.51 H new ATOM 0 HB VAL A 4 3.019 6.024 2.024 1.00 3.35 H new ATOM 0 HG11 VAL A 4 4.917 4.698 1.118 1.00 43.13 H new ATOM 0 HG12 VAL A 4 3.349 3.916 0.806 1.00 43.13 H new ATOM 0 HG13 VAL A 4 4.189 4.780 -0.504 1.00 43.13 H new ATOM 0 HG21 VAL A 4 5.092 7.173 1.274 1.00 24.33 H new ATOM 0 HG22 VAL A 4 4.370 7.403 -0.337 1.00 24.33 H new ATOM 0 HG23 VAL A 4 3.654 8.203 1.083 1.00 24.33 H new ATOM 57 N VAL A 5 0.359 4.426 -0.464 1.00 71.30 N ATOM 58 CA VAL A 5 -0.491 3.243 -0.294 1.00 14.13 C ATOM 59 C VAL A 5 0.387 1.979 -0.399 1.00 43.10 C ATOM 60 O VAL A 5 0.872 1.647 -1.480 1.00 33.11 O ATOM 61 CB VAL A 5 -1.660 3.207 -1.361 1.00 25.35 C ATOM 62 CG1 VAL A 5 -2.631 2.020 -1.106 1.00 54.40 C ATOM 63 CG2 VAL A 5 -2.420 4.561 -1.397 1.00 61.12 C ATOM 0 H VAL A 5 0.469 4.712 -1.437 1.00 71.30 H new ATOM 0 HA VAL A 5 -0.961 3.284 0.689 1.00 14.13 H new ATOM 0 HB VAL A 5 -1.209 3.050 -2.341 1.00 25.35 H new ATOM 0 HG11 VAL A 5 -3.420 2.028 -1.858 1.00 54.40 H new ATOM 0 HG12 VAL A 5 -2.081 1.081 -1.166 1.00 54.40 H new ATOM 0 HG13 VAL A 5 -3.073 2.118 -0.115 1.00 54.40 H new ATOM 0 HG21 VAL A 5 -3.218 4.511 -2.138 1.00 61.12 H new ATOM 0 HG22 VAL A 5 -2.848 4.764 -0.415 1.00 61.12 H new ATOM 0 HG23 VAL A 5 -1.728 5.360 -1.663 1.00 61.12 H new ATOM 73 N ILE A 6 0.607 1.302 0.742 1.00 31.21 N ATOM 74 CA ILE A 6 1.409 0.071 0.813 1.00 34.32 C ATOM 75 C ILE A 6 0.471 -1.138 0.652 1.00 70.44 C ATOM 76 O ILE A 6 -0.308 -1.460 1.550 1.00 11.22 O ATOM 77 CB ILE A 6 2.200 -0.026 2.180 1.00 44.21 C ATOM 78 CG1 ILE A 6 3.180 1.179 2.346 1.00 24.14 C ATOM 79 CG2 ILE A 6 2.964 -1.376 2.315 1.00 33.22 C ATOM 80 CD1 ILE A 6 4.279 1.252 1.296 1.00 5.45 C ATOM 0 H ILE A 6 0.231 1.596 1.644 1.00 31.21 H new ATOM 0 HA ILE A 6 2.147 0.082 0.011 1.00 34.32 H new ATOM 0 HB ILE A 6 1.462 0.015 2.981 1.00 44.21 H new ATOM 0 HG12 ILE A 6 2.605 2.105 2.316 1.00 24.14 H new ATOM 0 HG13 ILE A 6 3.641 1.122 3.332 1.00 24.14 H new ATOM 0 HG21 ILE A 6 3.493 -1.401 3.268 1.00 33.22 H new ATOM 0 HG22 ILE A 6 2.254 -2.202 2.273 1.00 33.22 H new ATOM 0 HG23 ILE A 6 3.681 -1.472 1.499 1.00 33.22 H new ATOM 0 HD11 ILE A 6 4.911 2.119 1.490 1.00 5.45 H new ATOM 0 HD12 ILE A 6 4.883 0.346 1.338 1.00 5.45 H new ATOM 0 HD13 ILE A 6 3.831 1.344 0.306 1.00 5.45 H new ATOM 92 N VAL A 7 0.527 -1.771 -0.515 1.00 64.45 N ATOM 93 CA VAL A 7 -0.260 -2.970 -0.818 1.00 42.23 C ATOM 94 C VAL A 7 0.621 -4.203 -0.594 1.00 64.04 C ATOM 95 O VAL A 7 1.668 -4.360 -1.226 1.00 21.55 O ATOM 96 CB VAL A 7 -0.808 -2.952 -2.290 1.00 61.03 C ATOM 97 CG1 VAL A 7 -1.565 -4.256 -2.629 1.00 45.13 C ATOM 98 CG2 VAL A 7 -1.694 -1.707 -2.524 1.00 40.31 C ATOM 0 H VAL A 7 1.123 -1.468 -1.285 1.00 64.45 H new ATOM 0 HA VAL A 7 -1.125 -2.998 -0.156 1.00 42.23 H new ATOM 0 HB VAL A 7 0.045 -2.892 -2.966 1.00 61.03 H new ATOM 0 HG11 VAL A 7 -1.930 -4.209 -3.655 1.00 45.13 H new ATOM 0 HG12 VAL A 7 -0.891 -5.106 -2.523 1.00 45.13 H new ATOM 0 HG13 VAL A 7 -2.408 -4.374 -1.949 1.00 45.13 H new ATOM 0 HG21 VAL A 7 -2.065 -1.712 -3.549 1.00 40.31 H new ATOM 0 HG22 VAL A 7 -2.537 -1.725 -1.833 1.00 40.31 H new ATOM 0 HG23 VAL A 7 -1.106 -0.805 -2.355 1.00 40.31 H new ATOM 108 N VAL A 8 0.194 -5.040 0.348 1.00 73.30 N ATOM 109 CA VAL A 8 0.841 -6.303 0.691 1.00 73.45 C ATOM 110 C VAL A 8 -0.106 -7.439 0.307 1.00 35.13 C ATOM 111 O VAL A 8 -1.208 -7.519 0.837 1.00 1.13 O ATOM 112 CB VAL A 8 1.142 -6.362 2.236 1.00 71.40 C ATOM 113 CG1 VAL A 8 1.665 -7.754 2.672 1.00 50.23 C ATOM 114 CG2 VAL A 8 2.108 -5.225 2.653 1.00 13.11 C ATOM 0 H VAL A 8 -0.636 -4.852 0.910 1.00 73.30 H new ATOM 0 HA VAL A 8 1.786 -6.394 0.155 1.00 73.45 H new ATOM 0 HB VAL A 8 0.200 -6.207 2.762 1.00 71.40 H new ATOM 0 HG11 VAL A 8 1.860 -7.750 3.744 1.00 50.23 H new ATOM 0 HG12 VAL A 8 0.917 -8.512 2.442 1.00 50.23 H new ATOM 0 HG13 VAL A 8 2.587 -7.980 2.137 1.00 50.23 H new ATOM 0 HG21 VAL A 8 2.301 -5.286 3.724 1.00 13.11 H new ATOM 0 HG22 VAL A 8 3.047 -5.327 2.109 1.00 13.11 H new ATOM 0 HG23 VAL A 8 1.657 -4.260 2.420 1.00 13.11 H new ATOM 124 N SER A 9 0.309 -8.292 -0.627 1.00 64.54 N ATOM 125 CA SER A 9 -0.453 -9.494 -0.985 1.00 35.45 C ATOM 126 C SER A 9 0.527 -10.632 -1.242 1.00 33.44 C ATOM 127 O SER A 9 1.482 -10.473 -2.018 1.00 72.32 O ATOM 128 CB SER A 9 -1.359 -9.243 -2.216 1.00 61.11 C ATOM 129 OG SER A 9 -2.174 -10.369 -2.500 1.00 40.43 O ATOM 0 H SER A 9 1.174 -8.175 -1.155 1.00 64.54 H new ATOM 0 HA SER A 9 -1.114 -9.762 -0.161 1.00 35.45 H new ATOM 0 HB2 SER A 9 -1.990 -8.373 -2.034 1.00 61.11 H new ATOM 0 HB3 SER A 9 -0.740 -9.012 -3.083 1.00 61.11 H new ATOM 0 HG SER A 9 -1.808 -10.852 -3.270 1.00 40.43 H new ATOM 135 N ARG A 10 0.292 -11.767 -0.560 1.00 62.42 N ATOM 136 CA ARG A 10 1.117 -12.976 -0.685 1.00 54.21 C ATOM 137 C ARG A 10 0.947 -13.579 -2.096 1.00 23.33 C ATOM 138 O ARG A 10 1.889 -14.139 -2.667 1.00 22.34 O ATOM 139 CB ARG A 10 0.721 -13.977 0.434 1.00 71.52 C ATOM 140 CG ARG A 10 1.566 -15.269 0.511 1.00 54.13 C ATOM 141 CD ARG A 10 1.171 -16.158 1.709 1.00 31.40 C ATOM 142 NE ARG A 10 1.967 -17.406 1.770 1.00 75.42 N ATOM 143 CZ ARG A 10 2.290 -18.063 2.900 1.00 3.42 C ATOM 144 NH1 ARG A 10 1.914 -17.608 4.094 1.00 65.34 N ATOM 145 NH2 ARG A 10 2.994 -19.183 2.820 1.00 31.21 N ATOM 0 H ARG A 10 -0.481 -11.869 0.097 1.00 62.42 H new ATOM 0 HA ARG A 10 2.173 -12.734 -0.562 1.00 54.21 H new ATOM 0 HB2 ARG A 10 0.787 -13.465 1.394 1.00 71.52 H new ATOM 0 HB3 ARG A 10 -0.323 -14.256 0.293 1.00 71.52 H new ATOM 0 HG2 ARG A 10 1.446 -15.834 -0.413 1.00 54.13 H new ATOM 0 HG3 ARG A 10 2.621 -15.006 0.589 1.00 54.13 H new ATOM 0 HD2 ARG A 10 1.306 -15.598 2.634 1.00 31.40 H new ATOM 0 HD3 ARG A 10 0.112 -16.408 1.640 1.00 31.40 H new ATOM 0 HE ARG A 10 2.296 -17.798 0.888 1.00 75.42 H new ATOM 0 HH11 ARG A 10 1.371 -16.747 4.164 1.00 65.34 H new ATOM 0 HH12 ARG A 10 2.169 -18.120 4.938 1.00 65.34 H new ATOM 0 HH21 ARG A 10 3.285 -19.538 1.909 1.00 31.21 H new ATOM 0 HH22 ARG A 10 3.245 -19.690 3.669 1.00 31.21 H new ATOM 159 N ASP A 11 -0.272 -13.440 -2.645 1.00 51.21 N ATOM 160 CA ASP A 11 -0.577 -13.775 -4.046 1.00 0.13 C ATOM 161 C ASP A 11 -0.227 -12.565 -4.942 1.00 62.44 C ATOM 162 O ASP A 11 -0.768 -11.470 -4.765 1.00 44.04 O ATOM 163 CB ASP A 11 -2.077 -14.150 -4.193 1.00 62.44 C ATOM 164 CG ASP A 11 -2.508 -14.623 -5.603 1.00 42.33 C ATOM 165 OD1 ASP A 11 -3.721 -14.764 -5.831 1.00 2.11 O ATOM 166 OD2 ASP A 11 -1.654 -14.866 -6.488 1.00 53.25 O ATOM 0 H ASP A 11 -1.077 -13.090 -2.126 1.00 51.21 H new ATOM 0 HA ASP A 11 0.018 -14.634 -4.356 1.00 0.13 H new ATOM 0 HB2 ASP A 11 -2.309 -14.939 -3.477 1.00 62.44 H new ATOM 0 HB3 ASP A 11 -2.679 -13.284 -3.919 1.00 62.44 H new ATOM 171 N GLU A 12 0.670 -12.786 -5.908 1.00 45.30 N ATOM 172 CA GLU A 12 1.200 -11.728 -6.788 1.00 32.10 C ATOM 173 C GLU A 12 0.192 -11.313 -7.879 1.00 73.42 C ATOM 174 O GLU A 12 0.221 -10.159 -8.337 1.00 25.34 O ATOM 175 CB GLU A 12 2.529 -12.200 -7.421 1.00 53.55 C ATOM 176 CG GLU A 12 3.208 -11.170 -8.346 1.00 3.44 C ATOM 177 CD GLU A 12 4.575 -11.634 -8.853 1.00 22.42 C ATOM 178 OE1 GLU A 12 4.627 -12.577 -9.669 1.00 52.32 O ATOM 179 OE2 GLU A 12 5.596 -11.039 -8.459 1.00 0.43 O ATOM 0 H GLU A 12 1.055 -13.710 -6.106 1.00 45.30 H new ATOM 0 HA GLU A 12 1.380 -10.843 -6.177 1.00 32.10 H new ATOM 0 HB2 GLU A 12 3.222 -12.462 -6.622 1.00 53.55 H new ATOM 0 HB3 GLU A 12 2.341 -13.110 -7.991 1.00 53.55 H new ATOM 0 HG2 GLU A 12 2.558 -10.971 -9.198 1.00 3.44 H new ATOM 0 HG3 GLU A 12 3.326 -10.229 -7.809 1.00 3.44 H new ATOM 186 N ARG A 13 -0.711 -12.239 -8.284 1.00 21.21 N ATOM 187 CA ARG A 13 -1.710 -11.956 -9.348 1.00 55.54 C ATOM 188 C ARG A 13 -2.674 -10.832 -8.895 1.00 2.51 C ATOM 189 O ARG A 13 -3.191 -10.066 -9.717 1.00 55.34 O ATOM 190 CB ARG A 13 -2.516 -13.237 -9.747 1.00 53.24 C ATOM 191 CG ARG A 13 -3.789 -13.497 -8.903 1.00 13.04 C ATOM 192 CD ARG A 13 -4.583 -14.746 -9.306 1.00 31.12 C ATOM 193 NE ARG A 13 -5.891 -14.774 -8.619 1.00 64.41 N ATOM 194 CZ ARG A 13 -6.734 -15.817 -8.579 1.00 43.33 C ATOM 195 NH1 ARG A 13 -6.436 -16.960 -9.197 1.00 65.10 N ATOM 196 NH2 ARG A 13 -7.896 -15.693 -7.942 1.00 12.01 N ATOM 0 H ARG A 13 -0.770 -13.180 -7.895 1.00 21.21 H new ATOM 0 HA ARG A 13 -1.164 -11.624 -10.231 1.00 55.54 H new ATOM 0 HB2 ARG A 13 -2.803 -13.156 -10.795 1.00 53.24 H new ATOM 0 HB3 ARG A 13 -1.859 -14.103 -9.663 1.00 53.24 H new ATOM 0 HG2 ARG A 13 -3.501 -13.589 -7.856 1.00 13.04 H new ATOM 0 HG3 ARG A 13 -4.442 -12.628 -8.979 1.00 13.04 H new ATOM 0 HD2 ARG A 13 -4.733 -14.756 -10.386 1.00 31.12 H new ATOM 0 HD3 ARG A 13 -4.015 -15.642 -9.055 1.00 31.12 H new ATOM 0 HE ARG A 13 -6.178 -13.925 -8.132 1.00 64.41 H new ATOM 0 HH11 ARG A 13 -5.558 -17.049 -9.708 1.00 65.10 H new ATOM 0 HH12 ARG A 13 -7.086 -17.745 -9.158 1.00 65.10 H new ATOM 0 HH21 ARG A 13 -8.138 -14.811 -7.490 1.00 12.01 H new ATOM 0 HH22 ARG A 13 -8.544 -16.480 -7.906 1.00 12.01 H new ATOM 210 N ILE A 14 -2.890 -10.760 -7.562 1.00 25.05 N ATOM 211 CA ILE A 14 -3.726 -9.738 -6.930 1.00 11.32 C ATOM 212 C ILE A 14 -3.050 -8.359 -7.053 1.00 44.31 C ATOM 213 O ILE A 14 -3.722 -7.380 -7.320 1.00 75.14 O ATOM 214 CB ILE A 14 -4.027 -10.093 -5.422 1.00 14.21 C ATOM 215 CG1 ILE A 14 -4.809 -11.445 -5.328 1.00 42.55 C ATOM 216 CG2 ILE A 14 -4.798 -8.951 -4.708 1.00 13.54 C ATOM 217 CD1 ILE A 14 -5.139 -11.896 -3.914 1.00 63.45 C ATOM 0 H ILE A 14 -2.482 -11.418 -6.898 1.00 25.05 H new ATOM 0 HA ILE A 14 -4.684 -9.705 -7.449 1.00 11.32 H new ATOM 0 HB ILE A 14 -3.073 -10.207 -4.907 1.00 14.21 H new ATOM 0 HG12 ILE A 14 -5.738 -11.350 -5.890 1.00 42.55 H new ATOM 0 HG13 ILE A 14 -4.220 -12.223 -5.814 1.00 42.55 H new ATOM 0 HG21 ILE A 14 -4.987 -9.232 -3.672 1.00 13.54 H new ATOM 0 HG22 ILE A 14 -4.202 -8.038 -4.734 1.00 13.54 H new ATOM 0 HG23 ILE A 14 -5.747 -8.779 -5.216 1.00 13.54 H new ATOM 0 HD11 ILE A 14 -5.681 -12.841 -3.951 1.00 63.45 H new ATOM 0 HD12 ILE A 14 -4.216 -12.028 -3.350 1.00 63.45 H new ATOM 0 HD13 ILE A 14 -5.757 -11.142 -3.427 1.00 63.45 H new ATOM 229 N LEU A 15 -1.706 -8.316 -6.902 1.00 21.22 N ATOM 230 CA LEU A 15 -0.913 -7.064 -6.991 1.00 63.20 C ATOM 231 C LEU A 15 -1.102 -6.364 -8.355 1.00 44.22 C ATOM 232 O LEU A 15 -1.292 -5.147 -8.412 1.00 41.14 O ATOM 233 CB LEU A 15 0.594 -7.357 -6.761 1.00 23.33 C ATOM 234 CG LEU A 15 0.990 -7.954 -5.374 1.00 41.13 C ATOM 235 CD1 LEU A 15 2.488 -8.314 -5.352 1.00 33.42 C ATOM 236 CD2 LEU A 15 0.624 -6.992 -4.220 1.00 71.12 C ATOM 0 H LEU A 15 -1.141 -9.144 -6.716 1.00 21.22 H new ATOM 0 HA LEU A 15 -1.276 -6.395 -6.211 1.00 63.20 H new ATOM 0 HB2 LEU A 15 0.928 -8.047 -7.536 1.00 23.33 H new ATOM 0 HB3 LEU A 15 1.146 -6.428 -6.901 1.00 23.33 H new ATOM 0 HG LEU A 15 0.418 -8.869 -5.222 1.00 41.13 H new ATOM 0 HD11 LEU A 15 2.748 -8.729 -4.378 1.00 33.42 H new ATOM 0 HD12 LEU A 15 2.697 -9.051 -6.128 1.00 33.42 H new ATOM 0 HD13 LEU A 15 3.080 -7.417 -5.534 1.00 33.42 H new ATOM 0 HD21 LEU A 15 0.913 -7.438 -3.269 1.00 71.12 H new ATOM 0 HD22 LEU A 15 1.151 -6.047 -4.353 1.00 71.12 H new ATOM 0 HD23 LEU A 15 -0.451 -6.811 -4.224 1.00 71.12 H new ATOM 248 N GLU A 16 -1.065 -7.160 -9.444 1.00 22.40 N ATOM 249 CA GLU A 16 -1.194 -6.645 -10.829 1.00 22.12 C ATOM 250 C GLU A 16 -2.673 -6.379 -11.202 1.00 12.31 C ATOM 251 O GLU A 16 -2.954 -5.618 -12.137 1.00 60.44 O ATOM 252 CB GLU A 16 -0.493 -7.604 -11.827 1.00 34.25 C ATOM 253 CG GLU A 16 -1.100 -9.021 -11.911 1.00 54.23 C ATOM 254 CD GLU A 16 -0.142 -10.044 -12.538 1.00 4.40 C ATOM 255 OE1 GLU A 16 -0.120 -10.176 -13.781 1.00 4.43 O ATOM 256 OE2 GLU A 16 0.612 -10.699 -11.786 1.00 61.32 O ATOM 0 H GLU A 16 -0.946 -8.172 -9.392 1.00 22.40 H new ATOM 0 HA GLU A 16 -0.688 -5.681 -10.889 1.00 22.12 H new ATOM 0 HB2 GLU A 16 -0.521 -7.154 -12.819 1.00 34.25 H new ATOM 0 HB3 GLU A 16 0.557 -7.691 -11.546 1.00 34.25 H new ATOM 0 HG2 GLU A 16 -1.374 -9.353 -10.910 1.00 54.23 H new ATOM 0 HG3 GLU A 16 -2.018 -8.984 -12.497 1.00 54.23 H new ATOM 263 N GLU A 17 -3.611 -6.999 -10.460 1.00 73.42 N ATOM 264 CA GLU A 17 -5.051 -6.661 -10.539 1.00 13.23 C ATOM 265 C GLU A 17 -5.331 -5.311 -9.867 1.00 12.13 C ATOM 266 O GLU A 17 -6.120 -4.506 -10.375 1.00 73.23 O ATOM 267 CB GLU A 17 -5.907 -7.778 -9.881 1.00 51.22 C ATOM 268 CG GLU A 17 -6.190 -8.974 -10.801 1.00 51.53 C ATOM 269 CD GLU A 17 -7.192 -8.635 -11.922 1.00 34.45 C ATOM 270 OE1 GLU A 17 -8.408 -8.803 -11.713 1.00 32.50 O ATOM 271 OE2 GLU A 17 -6.774 -8.183 -13.012 1.00 75.31 O ATOM 0 H GLU A 17 -3.398 -7.742 -9.794 1.00 73.42 H new ATOM 0 HA GLU A 17 -5.325 -6.584 -11.591 1.00 13.23 H new ATOM 0 HB2 GLU A 17 -5.395 -8.134 -8.987 1.00 51.22 H new ATOM 0 HB3 GLU A 17 -6.856 -7.350 -9.556 1.00 51.22 H new ATOM 0 HG2 GLU A 17 -5.255 -9.315 -11.245 1.00 51.53 H new ATOM 0 HG3 GLU A 17 -6.581 -9.800 -10.207 1.00 51.53 H new ATOM 278 N LEU A 18 -4.665 -5.078 -8.723 1.00 10.34 N ATOM 279 CA LEU A 18 -4.788 -3.833 -7.956 1.00 54.04 C ATOM 280 C LEU A 18 -4.047 -2.700 -8.668 1.00 3.44 C ATOM 281 O LEU A 18 -4.418 -1.536 -8.523 1.00 24.21 O ATOM 282 CB LEU A 18 -4.272 -4.037 -6.501 1.00 65.22 C ATOM 283 CG LEU A 18 -5.049 -5.108 -5.659 1.00 13.32 C ATOM 284 CD1 LEU A 18 -4.557 -5.174 -4.202 1.00 53.42 C ATOM 285 CD2 LEU A 18 -6.562 -4.873 -5.721 1.00 75.22 C ATOM 0 H LEU A 18 -4.024 -5.753 -8.305 1.00 10.34 H new ATOM 0 HA LEU A 18 -5.840 -3.554 -7.893 1.00 54.04 H new ATOM 0 HB2 LEU A 18 -3.221 -4.324 -6.542 1.00 65.22 H new ATOM 0 HB3 LEU A 18 -4.321 -3.082 -5.978 1.00 65.22 H new ATOM 0 HG LEU A 18 -4.838 -6.078 -6.110 1.00 13.32 H new ATOM 0 HD11 LEU A 18 -5.125 -5.930 -3.660 1.00 53.42 H new ATOM 0 HD12 LEU A 18 -3.499 -5.435 -4.187 1.00 53.42 H new ATOM 0 HD13 LEU A 18 -4.698 -4.204 -3.726 1.00 53.42 H new ATOM 0 HD21 LEU A 18 -7.073 -5.631 -5.128 1.00 75.22 H new ATOM 0 HD22 LEU A 18 -6.793 -3.885 -5.323 1.00 75.22 H new ATOM 0 HD23 LEU A 18 -6.898 -4.935 -6.756 1.00 75.22 H new ATOM 297 N LEU A 19 -3.018 -3.075 -9.461 1.00 33.34 N ATOM 298 CA LEU A 19 -2.313 -2.167 -10.378 1.00 22.32 C ATOM 299 C LEU A 19 -3.301 -1.568 -11.382 1.00 55.42 C ATOM 300 O LEU A 19 -3.349 -0.347 -11.551 1.00 14.21 O ATOM 301 CB LEU A 19 -1.183 -2.931 -11.122 1.00 63.41 C ATOM 302 CG LEU A 19 -0.420 -2.141 -12.235 1.00 51.40 C ATOM 303 CD1 LEU A 19 0.335 -0.931 -11.655 1.00 33.21 C ATOM 304 CD2 LEU A 19 0.516 -3.067 -13.039 1.00 62.44 C ATOM 0 H LEU A 19 -2.654 -4.028 -9.478 1.00 33.34 H new ATOM 0 HA LEU A 19 -1.865 -1.358 -9.802 1.00 22.32 H new ATOM 0 HB2 LEU A 19 -0.456 -3.267 -10.383 1.00 63.41 H new ATOM 0 HB3 LEU A 19 -1.615 -3.824 -11.573 1.00 63.41 H new ATOM 0 HG LEU A 19 -1.165 -1.750 -12.929 1.00 51.40 H new ATOM 0 HD11 LEU A 19 0.853 -0.407 -12.458 1.00 33.21 H new ATOM 0 HD12 LEU A 19 -0.374 -0.254 -11.178 1.00 33.21 H new ATOM 0 HD13 LEU A 19 1.061 -1.274 -10.918 1.00 33.21 H new ATOM 0 HD21 LEU A 19 1.032 -2.487 -13.805 1.00 62.44 H new ATOM 0 HD22 LEU A 19 1.249 -3.515 -12.368 1.00 62.44 H new ATOM 0 HD23 LEU A 19 -0.070 -3.854 -13.513 1.00 62.44 H new ATOM 316 N GLU A 20 -4.114 -2.451 -12.003 1.00 31.14 N ATOM 317 CA GLU A 20 -5.171 -2.047 -12.941 1.00 42.53 C ATOM 318 C GLU A 20 -6.162 -1.072 -12.291 1.00 71.44 C ATOM 319 O GLU A 20 -6.529 -0.075 -12.905 1.00 23.53 O ATOM 320 CB GLU A 20 -5.917 -3.292 -13.501 1.00 72.23 C ATOM 321 CG GLU A 20 -5.113 -4.102 -14.540 1.00 21.05 C ATOM 322 CD GLU A 20 -4.818 -3.286 -15.816 1.00 55.12 C ATOM 323 OE1 GLU A 20 -3.717 -2.708 -15.934 1.00 14.32 O ATOM 324 OE2 GLU A 20 -5.712 -3.187 -16.692 1.00 62.33 O ATOM 0 H GLU A 20 -4.052 -3.460 -11.865 1.00 31.14 H new ATOM 0 HA GLU A 20 -4.691 -1.527 -13.770 1.00 42.53 H new ATOM 0 HB2 GLU A 20 -6.179 -3.948 -12.671 1.00 72.23 H new ATOM 0 HB3 GLU A 20 -6.852 -2.966 -13.957 1.00 72.23 H new ATOM 0 HG2 GLU A 20 -4.173 -4.429 -14.095 1.00 21.05 H new ATOM 0 HG3 GLU A 20 -5.669 -5.001 -14.806 1.00 21.05 H new ATOM 331 N VAL A 21 -6.538 -1.341 -11.027 1.00 34.41 N ATOM 332 CA VAL A 21 -7.498 -0.503 -10.284 1.00 2.43 C ATOM 333 C VAL A 21 -6.934 0.920 -10.061 1.00 4.30 C ATOM 334 O VAL A 21 -7.679 1.898 -10.180 1.00 53.50 O ATOM 335 CB VAL A 21 -7.893 -1.153 -8.909 1.00 24.20 C ATOM 336 CG1 VAL A 21 -8.928 -0.294 -8.140 1.00 0.31 C ATOM 337 CG2 VAL A 21 -8.414 -2.591 -9.109 1.00 60.20 C ATOM 0 H VAL A 21 -6.189 -2.138 -10.495 1.00 34.41 H new ATOM 0 HA VAL A 21 -8.400 -0.430 -10.892 1.00 2.43 H new ATOM 0 HB VAL A 21 -6.990 -1.196 -8.300 1.00 24.20 H new ATOM 0 HG11 VAL A 21 -9.174 -0.779 -7.195 1.00 0.31 H new ATOM 0 HG12 VAL A 21 -8.508 0.692 -7.943 1.00 0.31 H new ATOM 0 HG13 VAL A 21 -9.832 -0.190 -8.740 1.00 0.31 H new ATOM 0 HG21 VAL A 21 -8.681 -3.019 -8.143 1.00 60.20 H new ATOM 0 HG22 VAL A 21 -9.293 -2.573 -9.753 1.00 60.20 H new ATOM 0 HG23 VAL A 21 -7.637 -3.198 -9.573 1.00 60.20 H new ATOM 347 N VAL A 22 -5.611 1.021 -9.777 1.00 51.31 N ATOM 348 CA VAL A 22 -4.935 2.328 -9.604 1.00 2.23 C ATOM 349 C VAL A 22 -4.957 3.124 -10.921 1.00 33.31 C ATOM 350 O VAL A 22 -5.346 4.285 -10.937 1.00 52.22 O ATOM 351 CB VAL A 22 -3.434 2.203 -9.134 1.00 74.43 C ATOM 352 CG1 VAL A 22 -2.803 3.604 -8.928 1.00 52.50 C ATOM 353 CG2 VAL A 22 -3.305 1.356 -7.860 1.00 14.05 C ATOM 0 H VAL A 22 -4.995 0.216 -9.664 1.00 51.31 H new ATOM 0 HA VAL A 22 -5.492 2.843 -8.822 1.00 2.23 H new ATOM 0 HB VAL A 22 -2.887 1.690 -9.925 1.00 74.43 H new ATOM 0 HG11 VAL A 22 -1.768 3.493 -8.604 1.00 52.50 H new ATOM 0 HG12 VAL A 22 -2.832 4.158 -9.866 1.00 52.50 H new ATOM 0 HG13 VAL A 22 -3.365 4.148 -8.168 1.00 52.50 H new ATOM 0 HG21 VAL A 22 -2.256 1.294 -7.569 1.00 14.05 H new ATOM 0 HG22 VAL A 22 -3.878 1.818 -7.056 1.00 14.05 H new ATOM 0 HG23 VAL A 22 -3.689 0.354 -8.049 1.00 14.05 H new ATOM 363 N LEU A 23 -4.552 2.454 -12.017 1.00 51.51 N ATOM 364 CA LEU A 23 -4.376 3.087 -13.342 1.00 20.14 C ATOM 365 C LEU A 23 -5.722 3.550 -13.945 1.00 34.42 C ATOM 366 O LEU A 23 -5.776 4.565 -14.649 1.00 52.40 O ATOM 367 CB LEU A 23 -3.656 2.101 -14.305 1.00 2.23 C ATOM 368 CG LEU A 23 -2.249 1.586 -13.849 1.00 0.22 C ATOM 369 CD1 LEU A 23 -1.699 0.518 -14.823 1.00 11.22 C ATOM 370 CD2 LEU A 23 -1.249 2.750 -13.653 1.00 31.21 C ATOM 0 H LEU A 23 -4.337 1.457 -12.010 1.00 51.51 H new ATOM 0 HA LEU A 23 -3.761 3.977 -13.210 1.00 20.14 H new ATOM 0 HB2 LEU A 23 -4.303 1.237 -14.457 1.00 2.23 H new ATOM 0 HB3 LEU A 23 -3.544 2.589 -15.273 1.00 2.23 H new ATOM 0 HG LEU A 23 -2.376 1.108 -12.878 1.00 0.22 H new ATOM 0 HD11 LEU A 23 -0.721 0.181 -14.479 1.00 11.22 H new ATOM 0 HD12 LEU A 23 -2.384 -0.329 -14.858 1.00 11.22 H new ATOM 0 HD13 LEU A 23 -1.604 0.949 -15.820 1.00 11.22 H new ATOM 0 HD21 LEU A 23 -0.285 2.352 -13.337 1.00 31.21 H new ATOM 0 HD22 LEU A 23 -1.129 3.288 -14.593 1.00 31.21 H new ATOM 0 HD23 LEU A 23 -1.628 3.431 -12.891 1.00 31.21 H new ATOM 382 N LYS A 24 -6.798 2.784 -13.673 1.00 51.40 N ATOM 383 CA LYS A 24 -8.171 3.111 -14.128 1.00 40.22 C ATOM 384 C LYS A 24 -8.769 4.244 -13.269 1.00 62.53 C ATOM 385 O LYS A 24 -9.553 5.057 -13.771 1.00 5.03 O ATOM 386 CB LYS A 24 -9.079 1.845 -14.071 1.00 54.12 C ATOM 387 CG LYS A 24 -8.658 0.713 -15.044 1.00 43.41 C ATOM 388 CD LYS A 24 -9.456 -0.598 -14.821 1.00 21.45 C ATOM 389 CE LYS A 24 -8.913 -1.781 -15.648 1.00 43.34 C ATOM 390 NZ LYS A 24 -9.025 -1.562 -17.116 1.00 44.10 N ATOM 0 H LYS A 24 -6.743 1.921 -13.132 1.00 51.40 H new ATOM 0 HA LYS A 24 -8.120 3.453 -15.162 1.00 40.22 H new ATOM 0 HB2 LYS A 24 -9.074 1.454 -13.054 1.00 54.12 H new ATOM 0 HB3 LYS A 24 -10.105 2.138 -14.295 1.00 54.12 H new ATOM 0 HG2 LYS A 24 -8.801 1.050 -16.071 1.00 43.41 H new ATOM 0 HG3 LYS A 24 -7.594 0.511 -14.921 1.00 43.41 H new ATOM 0 HD2 LYS A 24 -9.428 -0.858 -13.763 1.00 21.45 H new ATOM 0 HD3 LYS A 24 -10.501 -0.430 -15.081 1.00 21.45 H new ATOM 0 HE2 LYS A 24 -7.867 -1.949 -15.390 1.00 43.34 H new ATOM 0 HE3 LYS A 24 -9.457 -2.686 -15.378 1.00 43.34 H new ATOM 0 HZ1 LYS A 24 -8.645 -2.388 -17.620 1.00 44.10 H new ATOM 0 HZ2 LYS A 24 -10.024 -1.429 -17.372 1.00 44.10 H new ATOM 0 HZ3 LYS A 24 -8.484 -0.715 -17.383 1.00 44.10 H new ATOM 404 N SER A 25 -8.386 4.276 -11.977 1.00 24.22 N ATOM 405 CA SER A 25 -8.820 5.319 -11.021 1.00 15.11 C ATOM 406 C SER A 25 -8.166 6.672 -11.355 1.00 63.54 C ATOM 407 O SER A 25 -8.839 7.716 -11.364 1.00 61.54 O ATOM 408 CB SER A 25 -8.456 4.892 -9.576 1.00 5.44 C ATOM 409 OG SER A 25 -8.814 5.883 -8.620 1.00 42.03 O ATOM 0 H SER A 25 -7.766 3.579 -11.565 1.00 24.22 H new ATOM 0 HA SER A 25 -9.901 5.434 -11.100 1.00 15.11 H new ATOM 0 HB2 SER A 25 -8.963 3.957 -9.336 1.00 5.44 H new ATOM 0 HB3 SER A 25 -7.385 4.699 -9.514 1.00 5.44 H new ATOM 0 HG SER A 25 -9.567 5.561 -8.081 1.00 42.03 H new ATOM 415 N ASP A 26 -6.851 6.620 -11.635 1.00 54.31 N ATOM 416 CA ASP A 26 -6.027 7.792 -11.960 1.00 32.54 C ATOM 417 C ASP A 26 -4.628 7.317 -12.435 1.00 4.05 C ATOM 418 O ASP A 26 -3.875 6.728 -11.644 1.00 4.13 O ATOM 419 CB ASP A 26 -5.884 8.746 -10.738 1.00 62.03 C ATOM 420 CG ASP A 26 -5.111 10.031 -11.080 1.00 24.53 C ATOM 421 OD1 ASP A 26 -3.905 10.111 -10.790 1.00 74.22 O ATOM 422 OD2 ASP A 26 -5.710 10.968 -11.654 1.00 15.34 O ATOM 0 H ASP A 26 -6.325 5.746 -11.641 1.00 54.31 H new ATOM 0 HA ASP A 26 -6.519 8.351 -12.756 1.00 32.54 H new ATOM 0 HB2 ASP A 26 -6.875 9.010 -10.369 1.00 62.03 H new ATOM 0 HB3 ASP A 26 -5.372 8.222 -9.930 1.00 62.03 H new ATOM 427 N PRO A 27 -4.244 7.578 -13.726 1.00 23.24 N ATOM 428 CA PRO A 27 -2.944 7.134 -14.288 1.00 34.43 C ATOM 429 C PRO A 27 -1.771 8.079 -13.931 1.00 30.25 C ATOM 430 O PRO A 27 -0.645 7.879 -14.401 1.00 72.33 O ATOM 431 CB PRO A 27 -3.231 7.125 -15.807 1.00 15.44 C ATOM 432 CG PRO A 27 -4.201 8.256 -16.012 1.00 71.05 C ATOM 433 CD PRO A 27 -5.046 8.321 -14.747 1.00 40.23 C ATOM 0 HA PRO A 27 -2.621 6.172 -13.891 1.00 34.43 H new ATOM 0 HB2 PRO A 27 -2.319 7.275 -16.384 1.00 15.44 H new ATOM 0 HB3 PRO A 27 -3.657 6.174 -16.125 1.00 15.44 H new ATOM 0 HG2 PRO A 27 -3.675 9.196 -16.178 1.00 71.05 H new ATOM 0 HG3 PRO A 27 -4.824 8.081 -16.889 1.00 71.05 H new ATOM 0 HD2 PRO A 27 -5.223 9.352 -14.440 1.00 40.23 H new ATOM 0 HD3 PRO A 27 -6.023 7.861 -14.897 1.00 40.23 H new ATOM 441 N ASN A 28 -2.042 9.113 -13.112 1.00 60.22 N ATOM 442 CA ASN A 28 -1.016 10.089 -12.673 1.00 1.51 C ATOM 443 C ASN A 28 -0.462 9.700 -11.290 1.00 21.15 C ATOM 444 O ASN A 28 0.446 10.360 -10.768 1.00 42.44 O ATOM 445 CB ASN A 28 -1.608 11.523 -12.634 1.00 14.14 C ATOM 446 CG ASN A 28 -2.359 11.895 -13.915 1.00 54.54 C ATOM 447 OD1 ASN A 28 -1.768 12.360 -14.892 1.00 74.43 O ATOM 448 ND2 ASN A 28 -3.672 11.704 -13.909 1.00 22.40 N ATOM 0 H ASN A 28 -2.972 9.298 -12.736 1.00 60.22 H new ATOM 0 HA ASN A 28 -0.197 10.074 -13.392 1.00 1.51 H new ATOM 0 HB2 ASN A 28 -2.286 11.607 -11.785 1.00 14.14 H new ATOM 0 HB3 ASN A 28 -0.802 12.239 -12.471 1.00 14.14 H new ATOM 0 HD21 ASN A 28 -4.226 11.944 -14.731 1.00 22.40 H new ATOM 0 HD22 ASN A 28 -4.127 11.317 -13.082 1.00 22.40 H new ATOM 455 N VAL A 29 -1.045 8.646 -10.684 1.00 43.01 N ATOM 456 CA VAL A 29 -0.503 8.021 -9.467 1.00 4.44 C ATOM 457 C VAL A 29 0.701 7.144 -9.860 1.00 53.23 C ATOM 458 O VAL A 29 0.604 6.358 -10.814 1.00 70.44 O ATOM 459 CB VAL A 29 -1.583 7.139 -8.721 1.00 13.13 C ATOM 460 CG1 VAL A 29 -1.007 6.522 -7.420 1.00 43.30 C ATOM 461 CG2 VAL A 29 -2.867 7.951 -8.425 1.00 62.12 C ATOM 0 H VAL A 29 -1.901 8.208 -11.025 1.00 43.01 H new ATOM 0 HA VAL A 29 -0.200 8.811 -8.780 1.00 4.44 H new ATOM 0 HB VAL A 29 -1.852 6.320 -9.389 1.00 13.13 H new ATOM 0 HG11 VAL A 29 -1.774 5.922 -6.931 1.00 43.30 H new ATOM 0 HG12 VAL A 29 -0.153 5.890 -7.664 1.00 43.30 H new ATOM 0 HG13 VAL A 29 -0.688 7.320 -6.749 1.00 43.30 H new ATOM 0 HG21 VAL A 29 -3.589 7.316 -7.912 1.00 62.12 H new ATOM 0 HG22 VAL A 29 -2.620 8.804 -7.793 1.00 62.12 H new ATOM 0 HG23 VAL A 29 -3.297 8.306 -9.362 1.00 62.12 H new ATOM 471 N LYS A 30 1.830 7.306 -9.147 1.00 44.20 N ATOM 472 CA LYS A 30 3.020 6.469 -9.356 1.00 11.53 C ATOM 473 C LYS A 30 2.735 5.048 -8.839 1.00 62.21 C ATOM 474 O LYS A 30 2.150 4.885 -7.774 1.00 62.42 O ATOM 475 CB LYS A 30 4.259 7.080 -8.647 1.00 24.34 C ATOM 476 CG LYS A 30 5.564 6.259 -8.799 1.00 3.22 C ATOM 477 CD LYS A 30 5.994 6.066 -10.273 1.00 40.12 C ATOM 478 CE LYS A 30 7.265 5.212 -10.402 1.00 62.43 C ATOM 479 NZ LYS A 30 8.424 5.819 -9.696 1.00 72.23 N ATOM 0 H LYS A 30 1.941 8.012 -8.419 1.00 44.20 H new ATOM 0 HA LYS A 30 3.244 6.424 -10.422 1.00 11.53 H new ATOM 0 HB2 LYS A 30 4.429 8.082 -9.041 1.00 24.34 H new ATOM 0 HB3 LYS A 30 4.036 7.189 -7.586 1.00 24.34 H new ATOM 0 HG2 LYS A 30 6.366 6.759 -8.256 1.00 3.22 H new ATOM 0 HG3 LYS A 30 5.427 5.282 -8.336 1.00 3.22 H new ATOM 0 HD2 LYS A 30 5.183 5.593 -10.827 1.00 40.12 H new ATOM 0 HD3 LYS A 30 6.166 7.041 -10.730 1.00 40.12 H new ATOM 0 HE2 LYS A 30 7.075 4.218 -9.997 1.00 62.43 H new ATOM 0 HE3 LYS A 30 7.510 5.085 -11.457 1.00 62.43 H new ATOM 0 HZ1 LYS A 30 9.223 5.911 -10.356 1.00 72.23 H new ATOM 0 HZ2 LYS A 30 8.159 6.759 -9.339 1.00 72.23 H new ATOM 0 HZ3 LYS A 30 8.702 5.212 -8.899 1.00 72.23 H new ATOM 493 N THR A 31 3.106 4.034 -9.621 1.00 52.30 N ATOM 494 CA THR A 31 2.921 2.622 -9.247 1.00 22.43 C ATOM 495 C THR A 31 4.249 1.873 -9.368 1.00 40.14 C ATOM 496 O THR A 31 4.988 2.069 -10.336 1.00 43.24 O ATOM 497 CB THR A 31 1.843 1.952 -10.151 1.00 32.21 C ATOM 498 OG1 THR A 31 2.162 2.154 -11.542 1.00 31.51 O ATOM 499 CG2 THR A 31 0.433 2.497 -9.877 1.00 43.21 C ATOM 0 H THR A 31 3.544 4.163 -10.533 1.00 52.30 H new ATOM 0 HA THR A 31 2.579 2.577 -8.213 1.00 22.43 H new ATOM 0 HB THR A 31 1.848 0.888 -9.913 1.00 32.21 H new ATOM 0 HG1 THR A 31 1.479 1.727 -12.100 1.00 31.51 H new ATOM 0 HG21 THR A 31 -0.283 1.999 -10.531 1.00 43.21 H new ATOM 0 HG22 THR A 31 0.166 2.309 -8.837 1.00 43.21 H new ATOM 0 HG23 THR A 31 0.414 3.570 -10.068 1.00 43.21 H new ATOM 507 N VAL A 32 4.550 1.039 -8.356 1.00 65.04 N ATOM 508 CA VAL A 32 5.799 0.254 -8.269 1.00 64.53 C ATOM 509 C VAL A 32 5.465 -1.116 -7.660 1.00 5.20 C ATOM 510 O VAL A 32 4.843 -1.165 -6.605 1.00 75.43 O ATOM 511 CB VAL A 32 6.888 0.963 -7.352 1.00 60.22 C ATOM 512 CG1 VAL A 32 8.194 0.132 -7.260 1.00 44.41 C ATOM 513 CG2 VAL A 32 7.183 2.411 -7.817 1.00 63.44 C ATOM 0 H VAL A 32 3.925 0.888 -7.564 1.00 65.04 H new ATOM 0 HA VAL A 32 6.214 0.161 -9.273 1.00 64.53 H new ATOM 0 HB VAL A 32 6.462 1.021 -6.350 1.00 60.22 H new ATOM 0 HG11 VAL A 32 8.912 0.651 -6.625 1.00 44.41 H new ATOM 0 HG12 VAL A 32 7.973 -0.847 -6.834 1.00 44.41 H new ATOM 0 HG13 VAL A 32 8.616 0.007 -8.257 1.00 44.41 H new ATOM 0 HG21 VAL A 32 7.932 2.858 -7.163 1.00 63.44 H new ATOM 0 HG22 VAL A 32 7.558 2.395 -8.840 1.00 63.44 H new ATOM 0 HG23 VAL A 32 6.267 3.000 -7.775 1.00 63.44 H new ATOM 523 N ARG A 33 5.879 -2.216 -8.312 1.00 54.13 N ATOM 524 CA ARG A 33 5.719 -3.578 -7.765 1.00 73.35 C ATOM 525 C ARG A 33 7.110 -4.167 -7.473 1.00 30.34 C ATOM 526 O ARG A 33 7.761 -4.743 -8.350 1.00 32.04 O ATOM 527 CB ARG A 33 4.899 -4.489 -8.727 1.00 50.42 C ATOM 528 CG ARG A 33 4.667 -5.933 -8.207 1.00 44.33 C ATOM 529 CD ARG A 33 3.682 -6.737 -9.071 1.00 2.33 C ATOM 530 NE ARG A 33 4.060 -6.735 -10.498 1.00 63.15 N ATOM 531 CZ ARG A 33 4.438 -7.806 -11.210 1.00 55.22 C ATOM 532 NH1 ARG A 33 4.520 -9.010 -10.656 1.00 13.34 N ATOM 533 NH2 ARG A 33 4.747 -7.651 -12.485 1.00 5.34 N ATOM 0 H ARG A 33 6.331 -2.189 -9.226 1.00 54.13 H new ATOM 0 HA ARG A 33 5.153 -3.526 -6.835 1.00 73.35 H new ATOM 0 HB2 ARG A 33 3.931 -4.023 -8.911 1.00 50.42 H new ATOM 0 HB3 ARG A 33 5.415 -4.540 -9.686 1.00 50.42 H new ATOM 0 HG2 ARG A 33 5.622 -6.458 -8.172 1.00 44.33 H new ATOM 0 HG3 ARG A 33 4.291 -5.888 -7.185 1.00 44.33 H new ATOM 0 HD2 ARG A 33 3.640 -7.765 -8.710 1.00 2.33 H new ATOM 0 HD3 ARG A 33 2.681 -6.319 -8.962 1.00 2.33 H new ATOM 0 HE ARG A 33 4.031 -5.839 -10.985 1.00 63.15 H new ATOM 0 HH11 ARG A 33 4.293 -9.134 -9.669 1.00 13.34 H new ATOM 0 HH12 ARG A 33 4.810 -9.811 -11.217 1.00 13.34 H new ATOM 0 HH21 ARG A 33 4.696 -6.727 -12.913 1.00 5.34 H new ATOM 0 HH22 ARG A 33 5.037 -8.456 -13.041 1.00 5.34 H new ATOM 547 N THR A 34 7.579 -3.943 -6.242 1.00 65.51 N ATOM 548 CA THR A 34 8.866 -4.465 -5.751 1.00 5.52 C ATOM 549 C THR A 34 8.622 -5.349 -4.517 1.00 0.13 C ATOM 550 O THR A 34 7.890 -4.953 -3.603 1.00 64.31 O ATOM 551 CB THR A 34 9.867 -3.296 -5.424 1.00 51.35 C ATOM 552 OG1 THR A 34 11.066 -3.811 -4.817 1.00 62.24 O ATOM 553 CG2 THR A 34 9.250 -2.214 -4.515 1.00 4.23 C ATOM 0 H THR A 34 7.075 -3.390 -5.549 1.00 65.51 H new ATOM 0 HA THR A 34 9.324 -5.069 -6.534 1.00 5.52 H new ATOM 0 HB THR A 34 10.108 -2.823 -6.376 1.00 51.35 H new ATOM 0 HG1 THR A 34 11.013 -3.701 -3.845 1.00 62.24 H new ATOM 0 HG21 THR A 34 9.988 -1.435 -4.325 1.00 4.23 H new ATOM 0 HG22 THR A 34 8.380 -1.778 -5.007 1.00 4.23 H new ATOM 0 HG23 THR A 34 8.945 -2.663 -3.570 1.00 4.23 H new ATOM 561 N ASP A 35 9.214 -6.557 -4.512 1.00 72.22 N ATOM 562 CA ASP A 35 9.170 -7.482 -3.355 1.00 65.32 C ATOM 563 C ASP A 35 10.309 -7.164 -2.351 1.00 75.41 C ATOM 564 O ASP A 35 10.419 -7.809 -1.305 1.00 22.34 O ATOM 565 CB ASP A 35 9.231 -8.965 -3.832 1.00 12.33 C ATOM 566 CG ASP A 35 10.535 -9.325 -4.569 1.00 42.43 C ATOM 567 OD1 ASP A 35 10.763 -8.787 -5.674 1.00 42.42 O ATOM 568 OD2 ASP A 35 11.327 -10.154 -4.062 1.00 32.43 O ATOM 0 H ASP A 35 9.737 -6.923 -5.307 1.00 72.22 H new ATOM 0 HA ASP A 35 8.222 -7.338 -2.836 1.00 65.32 H new ATOM 0 HB2 ASP A 35 9.120 -9.620 -2.968 1.00 12.33 H new ATOM 0 HB3 ASP A 35 8.385 -9.160 -4.491 1.00 12.33 H new ATOM 573 N ASP A 36 11.151 -6.162 -2.691 1.00 4.53 N ATOM 574 CA ASP A 36 12.213 -5.638 -1.803 1.00 74.33 C ATOM 575 C ASP A 36 11.723 -4.376 -1.064 1.00 10.22 C ATOM 576 O ASP A 36 11.101 -3.503 -1.674 1.00 44.42 O ATOM 577 CB ASP A 36 13.494 -5.306 -2.624 1.00 4.14 C ATOM 578 CG ASP A 36 14.582 -4.563 -1.817 1.00 32.21 C ATOM 579 OD1 ASP A 36 15.108 -3.541 -2.307 1.00 60.23 O ATOM 580 OD2 ASP A 36 14.905 -4.990 -0.683 1.00 52.21 O ATOM 0 H ASP A 36 11.112 -5.691 -3.595 1.00 4.53 H new ATOM 0 HA ASP A 36 12.454 -6.406 -1.068 1.00 74.33 H new ATOM 0 HB2 ASP A 36 13.914 -6.233 -3.013 1.00 4.14 H new ATOM 0 HB3 ASP A 36 13.215 -4.697 -3.484 1.00 4.14 H new ATOM 585 N LYS A 37 12.066 -4.291 0.237 1.00 11.23 N ATOM 586 CA LYS A 37 11.681 -3.176 1.128 1.00 15.40 C ATOM 587 C LYS A 37 12.515 -1.907 0.869 1.00 71.23 C ATOM 588 O LYS A 37 11.999 -0.789 0.979 1.00 44.10 O ATOM 589 CB LYS A 37 11.821 -3.606 2.615 1.00 15.30 C ATOM 590 CG LYS A 37 13.240 -4.038 3.043 1.00 2.34 C ATOM 591 CD LYS A 37 13.338 -4.355 4.552 1.00 45.33 C ATOM 592 CE LYS A 37 14.765 -4.730 4.981 1.00 33.21 C ATOM 593 NZ LYS A 37 15.223 -5.993 4.351 1.00 50.24 N ATOM 0 H LYS A 37 12.626 -5.004 0.705 1.00 11.23 H new ATOM 0 HA LYS A 37 10.640 -2.934 0.911 1.00 15.40 H new ATOM 0 HB2 LYS A 37 11.505 -2.777 3.248 1.00 15.30 H new ATOM 0 HB3 LYS A 37 11.135 -4.431 2.804 1.00 15.30 H new ATOM 0 HG2 LYS A 37 13.535 -4.918 2.471 1.00 2.34 H new ATOM 0 HG3 LYS A 37 13.946 -3.246 2.796 1.00 2.34 H new ATOM 0 HD2 LYS A 37 13.005 -3.489 5.125 1.00 45.33 H new ATOM 0 HD3 LYS A 37 12.662 -5.175 4.793 1.00 45.33 H new ATOM 0 HE2 LYS A 37 15.447 -3.923 4.713 1.00 33.21 H new ATOM 0 HE3 LYS A 37 14.802 -4.832 6.066 1.00 33.21 H new ATOM 0 HZ1 LYS A 37 16.155 -6.253 4.732 1.00 50.24 H new ATOM 0 HZ2 LYS A 37 14.541 -6.751 4.557 1.00 50.24 H new ATOM 0 HZ3 LYS A 37 15.294 -5.862 3.322 1.00 50.24 H new ATOM 607 N GLU A 38 13.799 -2.098 0.513 1.00 62.35 N ATOM 608 CA GLU A 38 14.764 -0.997 0.345 1.00 23.32 C ATOM 609 C GLU A 38 14.417 -0.147 -0.889 1.00 42.22 C ATOM 610 O GLU A 38 14.574 1.084 -0.870 1.00 2.04 O ATOM 611 CB GLU A 38 16.199 -1.574 0.231 1.00 14.30 C ATOM 612 CG GLU A 38 16.641 -2.442 1.427 1.00 51.33 C ATOM 613 CD GLU A 38 16.763 -1.651 2.740 1.00 50.04 C ATOM 614 OE1 GLU A 38 17.815 -1.006 2.954 1.00 41.34 O ATOM 615 OE2 GLU A 38 15.819 -1.666 3.559 1.00 43.12 O ATOM 0 H GLU A 38 14.196 -3.020 0.334 1.00 62.35 H new ATOM 0 HA GLU A 38 14.713 -0.347 1.219 1.00 23.32 H new ATOM 0 HB2 GLU A 38 16.265 -2.172 -0.678 1.00 14.30 H new ATOM 0 HB3 GLU A 38 16.901 -0.747 0.120 1.00 14.30 H new ATOM 0 HG2 GLU A 38 15.924 -3.252 1.564 1.00 51.33 H new ATOM 0 HG3 GLU A 38 17.602 -2.902 1.198 1.00 51.33 H new ATOM 622 N LYS A 39 13.919 -0.829 -1.943 1.00 20.51 N ATOM 623 CA LYS A 39 13.497 -0.190 -3.193 1.00 2.50 C ATOM 624 C LYS A 39 12.252 0.688 -2.965 1.00 31.43 C ATOM 625 O LYS A 39 12.155 1.791 -3.528 1.00 44.21 O ATOM 626 CB LYS A 39 13.225 -1.255 -4.296 1.00 30.05 C ATOM 627 CG LYS A 39 12.940 -0.658 -5.700 1.00 12.30 C ATOM 628 CD LYS A 39 14.102 0.243 -6.199 1.00 24.41 C ATOM 629 CE LYS A 39 13.777 0.989 -7.500 1.00 11.44 C ATOM 630 NZ LYS A 39 14.811 2.018 -7.804 1.00 53.12 N ATOM 0 H LYS A 39 13.801 -1.842 -1.943 1.00 20.51 H new ATOM 0 HA LYS A 39 14.309 0.452 -3.535 1.00 2.50 H new ATOM 0 HB2 LYS A 39 14.086 -1.919 -4.364 1.00 30.05 H new ATOM 0 HB3 LYS A 39 12.374 -1.866 -3.994 1.00 30.05 H new ATOM 0 HG2 LYS A 39 12.779 -1.468 -6.412 1.00 12.30 H new ATOM 0 HG3 LYS A 39 12.019 -0.075 -5.666 1.00 12.30 H new ATOM 0 HD2 LYS A 39 14.348 0.969 -5.424 1.00 24.41 H new ATOM 0 HD3 LYS A 39 14.989 -0.372 -6.353 1.00 24.41 H new ATOM 0 HE2 LYS A 39 13.714 0.278 -8.324 1.00 11.44 H new ATOM 0 HE3 LYS A 39 12.800 1.465 -7.415 1.00 11.44 H new ATOM 0 HZ1 LYS A 39 14.355 2.856 -8.219 1.00 53.12 H new ATOM 0 HZ2 LYS A 39 15.300 2.288 -6.927 1.00 53.12 H new ATOM 0 HZ3 LYS A 39 15.500 1.629 -8.479 1.00 53.12 H new ATOM 644 N VAL A 40 11.323 0.196 -2.107 1.00 1.34 N ATOM 645 CA VAL A 40 10.109 0.938 -1.720 1.00 3.51 C ATOM 646 C VAL A 40 10.492 2.315 -1.154 1.00 3.25 C ATOM 647 O VAL A 40 9.953 3.331 -1.571 1.00 22.32 O ATOM 648 CB VAL A 40 9.259 0.183 -0.626 1.00 40.45 C ATOM 649 CG1 VAL A 40 7.956 0.947 -0.306 1.00 42.24 C ATOM 650 CG2 VAL A 40 8.963 -1.277 -1.024 1.00 45.34 C ATOM 0 H VAL A 40 11.399 -0.722 -1.669 1.00 1.34 H new ATOM 0 HA VAL A 40 9.506 1.035 -2.623 1.00 3.51 H new ATOM 0 HB VAL A 40 9.864 0.151 0.280 1.00 40.45 H new ATOM 0 HG11 VAL A 40 7.391 0.403 0.451 1.00 42.24 H new ATOM 0 HG12 VAL A 40 8.200 1.941 0.068 1.00 42.24 H new ATOM 0 HG13 VAL A 40 7.356 1.037 -1.211 1.00 42.24 H new ATOM 0 HG21 VAL A 40 8.376 -1.756 -0.240 1.00 45.34 H new ATOM 0 HG22 VAL A 40 8.402 -1.293 -1.959 1.00 45.34 H new ATOM 0 HG23 VAL A 40 9.901 -1.816 -1.155 1.00 45.34 H new ATOM 660 N LYS A 41 11.479 2.296 -0.239 1.00 21.13 N ATOM 661 CA LYS A 41 11.945 3.480 0.513 1.00 40.11 C ATOM 662 C LYS A 41 12.449 4.601 -0.411 1.00 34.30 C ATOM 663 O LYS A 41 12.201 5.786 -0.148 1.00 21.01 O ATOM 664 CB LYS A 41 13.050 3.044 1.504 1.00 22.13 C ATOM 665 CG LYS A 41 12.547 2.047 2.563 1.00 52.20 C ATOM 666 CD LYS A 41 13.673 1.505 3.459 1.00 50.33 C ATOM 667 CE LYS A 41 13.147 0.557 4.537 1.00 4.23 C ATOM 668 NZ LYS A 41 14.237 0.030 5.402 1.00 71.30 N ATOM 0 H LYS A 41 11.985 1.444 0.004 1.00 21.13 H new ATOM 0 HA LYS A 41 11.097 3.893 1.060 1.00 40.11 H new ATOM 0 HB2 LYS A 41 13.871 2.592 0.948 1.00 22.13 H new ATOM 0 HB3 LYS A 41 13.451 3.926 2.004 1.00 22.13 H new ATOM 0 HG2 LYS A 41 11.797 2.534 3.186 1.00 52.20 H new ATOM 0 HG3 LYS A 41 12.054 1.213 2.064 1.00 52.20 H new ATOM 0 HD2 LYS A 41 14.405 0.982 2.843 1.00 50.33 H new ATOM 0 HD3 LYS A 41 14.192 2.339 3.932 1.00 50.33 H new ATOM 0 HE2 LYS A 41 12.417 1.081 5.154 1.00 4.23 H new ATOM 0 HE3 LYS A 41 12.626 -0.275 4.064 1.00 4.23 H new ATOM 0 HZ1 LYS A 41 13.839 -0.634 6.096 1.00 71.30 H new ATOM 0 HZ2 LYS A 41 14.939 -0.463 4.814 1.00 71.30 H new ATOM 0 HZ3 LYS A 41 14.696 0.819 5.901 1.00 71.30 H new ATOM 682 N GLU A 42 13.157 4.198 -1.486 1.00 22.14 N ATOM 683 CA GLU A 42 13.598 5.109 -2.562 1.00 32.54 C ATOM 684 C GLU A 42 12.387 5.781 -3.211 1.00 22.11 C ATOM 685 O GLU A 42 12.309 7.011 -3.299 1.00 61.35 O ATOM 686 CB GLU A 42 14.374 4.319 -3.648 1.00 61.45 C ATOM 687 CG GLU A 42 15.667 3.643 -3.157 1.00 51.32 C ATOM 688 CD GLU A 42 16.258 2.664 -4.185 1.00 72.01 C ATOM 689 OE1 GLU A 42 16.428 3.056 -5.363 1.00 41.15 O ATOM 690 OE2 GLU A 42 16.549 1.501 -3.825 1.00 51.23 O ATOM 0 H GLU A 42 13.440 3.229 -1.633 1.00 22.14 H new ATOM 0 HA GLU A 42 14.249 5.866 -2.125 1.00 32.54 H new ATOM 0 HB2 GLU A 42 13.716 3.555 -4.061 1.00 61.45 H new ATOM 0 HB3 GLU A 42 14.623 4.999 -4.463 1.00 61.45 H new ATOM 0 HG2 GLU A 42 16.407 4.410 -2.926 1.00 51.32 H new ATOM 0 HG3 GLU A 42 15.462 3.108 -2.230 1.00 51.32 H new ATOM 697 N GLU A 43 11.425 4.930 -3.615 1.00 31.44 N ATOM 698 CA GLU A 43 10.236 5.343 -4.368 1.00 40.40 C ATOM 699 C GLU A 43 9.302 6.259 -3.550 1.00 31.52 C ATOM 700 O GLU A 43 8.634 7.129 -4.128 1.00 40.30 O ATOM 701 CB GLU A 43 9.476 4.093 -4.878 1.00 73.34 C ATOM 702 CG GLU A 43 10.300 3.180 -5.806 1.00 21.31 C ATOM 703 CD GLU A 43 10.920 3.920 -7.007 1.00 64.21 C ATOM 704 OE1 GLU A 43 12.158 3.882 -7.179 1.00 32.04 O ATOM 705 OE2 GLU A 43 10.167 4.560 -7.780 1.00 33.22 O ATOM 0 H GLU A 43 11.456 3.929 -3.424 1.00 31.44 H new ATOM 0 HA GLU A 43 10.576 5.933 -5.219 1.00 40.40 H new ATOM 0 HB2 GLU A 43 9.142 3.511 -4.019 1.00 73.34 H new ATOM 0 HB3 GLU A 43 8.582 4.419 -5.410 1.00 73.34 H new ATOM 0 HG2 GLU A 43 11.097 2.712 -5.228 1.00 21.31 H new ATOM 0 HG3 GLU A 43 9.660 2.378 -6.175 1.00 21.31 H new ATOM 712 N ILE A 44 9.277 6.065 -2.213 1.00 31.31 N ATOM 713 CA ILE A 44 8.501 6.909 -1.285 1.00 73.21 C ATOM 714 C ILE A 44 9.016 8.366 -1.354 1.00 74.34 C ATOM 715 O ILE A 44 8.222 9.309 -1.450 1.00 51.15 O ATOM 716 CB ILE A 44 8.574 6.364 0.206 1.00 0.31 C ATOM 717 CG1 ILE A 44 7.970 4.924 0.306 1.00 12.02 C ATOM 718 CG2 ILE A 44 7.865 7.319 1.194 1.00 53.20 C ATOM 719 CD1 ILE A 44 8.022 4.291 1.692 1.00 51.35 C ATOM 0 H ILE A 44 9.795 5.318 -1.749 1.00 31.31 H new ATOM 0 HA ILE A 44 7.455 6.878 -1.591 1.00 73.21 H new ATOM 0 HB ILE A 44 9.627 6.316 0.484 1.00 0.31 H new ATOM 0 HG12 ILE A 44 6.931 4.960 -0.020 1.00 12.02 H new ATOM 0 HG13 ILE A 44 8.501 4.276 -0.392 1.00 12.02 H new ATOM 0 HG21 ILE A 44 7.935 6.915 2.204 1.00 53.20 H new ATOM 0 HG22 ILE A 44 8.344 8.298 1.161 1.00 53.20 H new ATOM 0 HG23 ILE A 44 6.816 7.419 0.915 1.00 53.20 H new ATOM 0 HD11 ILE A 44 7.579 3.296 1.654 1.00 51.35 H new ATOM 0 HD12 ILE A 44 9.059 4.215 2.018 1.00 51.35 H new ATOM 0 HD13 ILE A 44 7.465 4.910 2.396 1.00 51.35 H new ATOM 731 N GLU A 45 10.363 8.509 -1.374 1.00 1.12 N ATOM 732 CA GLU A 45 11.043 9.820 -1.460 1.00 33.31 C ATOM 733 C GLU A 45 10.826 10.479 -2.833 1.00 70.02 C ATOM 734 O GLU A 45 10.551 11.673 -2.910 1.00 73.22 O ATOM 735 CB GLU A 45 12.561 9.671 -1.216 1.00 32.01 C ATOM 736 CG GLU A 45 12.938 9.035 0.127 1.00 73.14 C ATOM 737 CD GLU A 45 14.454 8.908 0.290 1.00 41.43 C ATOM 738 OE1 GLU A 45 15.029 7.911 -0.191 1.00 60.03 O ATOM 739 OE2 GLU A 45 15.081 9.813 0.890 1.00 14.34 O ATOM 0 H GLU A 45 11.006 7.719 -1.331 1.00 1.12 H new ATOM 0 HA GLU A 45 10.607 10.453 -0.687 1.00 33.31 H new ATOM 0 HB2 GLU A 45 12.986 9.069 -2.019 1.00 32.01 H new ATOM 0 HB3 GLU A 45 13.023 10.656 -1.278 1.00 32.01 H new ATOM 0 HG2 GLU A 45 12.534 9.638 0.941 1.00 73.14 H new ATOM 0 HG3 GLU A 45 12.480 8.049 0.203 1.00 73.14 H new ATOM 746 N LYS A 46 10.952 9.676 -3.905 1.00 51.33 N ATOM 747 CA LYS A 46 10.866 10.154 -5.303 1.00 3.14 C ATOM 748 C LYS A 46 9.467 10.717 -5.624 1.00 11.24 C ATOM 749 O LYS A 46 9.338 11.733 -6.328 1.00 24.12 O ATOM 750 CB LYS A 46 11.226 8.995 -6.261 1.00 10.34 C ATOM 751 CG LYS A 46 12.694 8.517 -6.155 1.00 1.14 C ATOM 752 CD LYS A 46 12.947 7.191 -6.907 1.00 55.20 C ATOM 753 CE LYS A 46 12.627 7.258 -8.413 1.00 64.44 C ATOM 754 NZ LYS A 46 12.886 5.957 -9.086 1.00 12.12 N ATOM 0 H LYS A 46 11.117 8.672 -3.829 1.00 51.33 H new ATOM 0 HA LYS A 46 11.577 10.969 -5.438 1.00 3.14 H new ATOM 0 HB2 LYS A 46 10.566 8.152 -6.058 1.00 10.34 H new ATOM 0 HB3 LYS A 46 11.032 9.312 -7.286 1.00 10.34 H new ATOM 0 HG2 LYS A 46 13.352 9.288 -6.555 1.00 1.14 H new ATOM 0 HG3 LYS A 46 12.955 8.389 -5.104 1.00 1.14 H new ATOM 0 HD2 LYS A 46 13.991 6.906 -6.780 1.00 55.20 H new ATOM 0 HD3 LYS A 46 12.344 6.405 -6.452 1.00 55.20 H new ATOM 0 HE2 LYS A 46 11.583 7.539 -8.552 1.00 64.44 H new ATOM 0 HE3 LYS A 46 13.231 8.036 -8.880 1.00 64.44 H new ATOM 0 HZ1 LYS A 46 12.285 5.877 -9.931 1.00 12.12 H new ATOM 0 HZ2 LYS A 46 13.886 5.904 -9.366 1.00 12.12 H new ATOM 0 HZ3 LYS A 46 12.668 5.178 -8.432 1.00 12.12 H new ATOM 768 N ALA A 47 8.429 10.056 -5.078 1.00 24.15 N ATOM 769 CA ALA A 47 7.034 10.511 -5.196 1.00 14.12 C ATOM 770 C ALA A 47 6.779 11.711 -4.266 1.00 61.51 C ATOM 771 O ALA A 47 6.015 12.611 -4.614 1.00 74.23 O ATOM 772 CB ALA A 47 6.071 9.358 -4.889 1.00 21.33 C ATOM 0 H ALA A 47 8.535 9.193 -4.544 1.00 24.15 H new ATOM 0 HA ALA A 47 6.856 10.837 -6.221 1.00 14.12 H new ATOM 0 HB1 ALA A 47 5.043 9.709 -4.980 1.00 21.33 H new ATOM 0 HB2 ALA A 47 6.241 8.545 -5.594 1.00 21.33 H new ATOM 0 HB3 ALA A 47 6.244 9.000 -3.874 1.00 21.33 H new ATOM 778 N ARG A 48 7.466 11.715 -3.099 1.00 23.40 N ATOM 779 CA ARG A 48 7.381 12.795 -2.090 1.00 43.11 C ATOM 780 C ARG A 48 7.894 14.134 -2.646 1.00 24.20 C ATOM 781 O ARG A 48 7.278 15.172 -2.402 1.00 45.25 O ATOM 782 CB ARG A 48 8.192 12.401 -0.826 1.00 64.32 C ATOM 783 CG ARG A 48 8.193 13.442 0.315 1.00 12.33 C ATOM 784 CD ARG A 48 9.008 12.981 1.534 1.00 0.53 C ATOM 785 NE ARG A 48 9.088 14.034 2.556 1.00 74.34 N ATOM 786 CZ ARG A 48 9.967 14.081 3.566 1.00 60.43 C ATOM 787 NH1 ARG A 48 10.879 13.121 3.723 1.00 21.43 N ATOM 788 NH2 ARG A 48 9.916 15.094 4.418 1.00 2.41 N ATOM 0 H ARG A 48 8.100 10.962 -2.830 1.00 23.40 H new ATOM 0 HA ARG A 48 6.331 12.924 -1.827 1.00 43.11 H new ATOM 0 HB2 ARG A 48 7.794 11.463 -0.438 1.00 64.32 H new ATOM 0 HB3 ARG A 48 9.224 12.211 -1.122 1.00 64.32 H new ATOM 0 HG2 ARG A 48 8.601 14.382 -0.056 1.00 12.33 H new ATOM 0 HG3 ARG A 48 7.166 13.640 0.623 1.00 12.33 H new ATOM 0 HD2 ARG A 48 8.551 12.090 1.963 1.00 0.53 H new ATOM 0 HD3 ARG A 48 10.013 12.702 1.217 1.00 0.53 H new ATOM 0 HE ARG A 48 8.414 14.797 2.491 1.00 74.34 H new ATOM 0 HH11 ARG A 48 10.913 12.338 3.070 1.00 21.43 H new ATOM 0 HH12 ARG A 48 11.542 13.169 4.496 1.00 21.43 H new ATOM 0 HH21 ARG A 48 9.214 15.825 4.300 1.00 2.41 H new ATOM 0 HH22 ARG A 48 10.579 15.143 5.192 1.00 2.41 H new ATOM 802 N LYS A 49 9.008 14.088 -3.415 1.00 53.34 N ATOM 803 CA LYS A 49 9.640 15.295 -3.998 1.00 33.31 C ATOM 804 C LYS A 49 8.667 16.023 -4.936 1.00 14.21 C ATOM 805 O LYS A 49 8.543 17.248 -4.901 1.00 1.44 O ATOM 806 CB LYS A 49 10.936 14.926 -4.780 1.00 52.32 C ATOM 807 CG LYS A 49 12.068 14.297 -3.937 1.00 62.14 C ATOM 808 CD LYS A 49 12.576 15.210 -2.794 1.00 32.44 C ATOM 809 CE LYS A 49 13.187 16.533 -3.294 1.00 4.33 C ATOM 810 NZ LYS A 49 13.630 17.394 -2.164 1.00 44.10 N ATOM 0 H LYS A 49 9.491 13.220 -3.647 1.00 53.34 H new ATOM 0 HA LYS A 49 9.902 15.957 -3.173 1.00 33.31 H new ATOM 0 HB2 LYS A 49 10.672 14.231 -5.578 1.00 52.32 H new ATOM 0 HB3 LYS A 49 11.320 15.828 -5.257 1.00 52.32 H new ATOM 0 HG2 LYS A 49 11.712 13.359 -3.510 1.00 62.14 H new ATOM 0 HG3 LYS A 49 12.904 14.052 -4.593 1.00 62.14 H new ATOM 0 HD2 LYS A 49 11.748 15.432 -2.121 1.00 32.44 H new ATOM 0 HD3 LYS A 49 13.323 14.670 -2.212 1.00 32.44 H new ATOM 0 HE2 LYS A 49 14.036 16.320 -3.944 1.00 4.33 H new ATOM 0 HE3 LYS A 49 12.452 17.070 -3.895 1.00 4.33 H new ATOM 0 HZ1 LYS A 49 14.036 18.276 -2.538 1.00 44.10 H new ATOM 0 HZ2 LYS A 49 12.815 17.618 -1.558 1.00 44.10 H new ATOM 0 HZ3 LYS A 49 14.349 16.891 -1.606 1.00 44.10 H new ATOM 824 N GLN A 50 7.977 15.229 -5.762 1.00 51.43 N ATOM 825 CA GLN A 50 6.964 15.719 -6.715 1.00 53.23 C ATOM 826 C GLN A 50 5.620 15.966 -6.003 1.00 5.22 C ATOM 827 O GLN A 50 4.736 16.642 -6.540 1.00 44.54 O ATOM 828 CB GLN A 50 6.803 14.679 -7.855 1.00 33.23 C ATOM 829 CG GLN A 50 8.121 14.357 -8.588 1.00 15.11 C ATOM 830 CD GLN A 50 7.980 13.239 -9.623 1.00 71.32 C ATOM 831 OE1 GLN A 50 7.685 13.483 -10.792 1.00 11.44 O ATOM 832 NE2 GLN A 50 8.176 12.004 -9.198 1.00 31.42 N ATOM 0 H GLN A 50 8.104 14.217 -5.791 1.00 51.43 H new ATOM 0 HA GLN A 50 7.290 16.670 -7.137 1.00 53.23 H new ATOM 0 HB2 GLN A 50 6.394 13.758 -7.440 1.00 33.23 H new ATOM 0 HB3 GLN A 50 6.078 15.053 -8.577 1.00 33.23 H new ATOM 0 HG2 GLN A 50 8.483 15.258 -9.084 1.00 15.11 H new ATOM 0 HG3 GLN A 50 8.876 14.071 -7.855 1.00 15.11 H new ATOM 0 HE21 GLN A 50 8.420 11.833 -8.222 1.00 31.42 H new ATOM 0 HE22 GLN A 50 8.084 11.221 -9.845 1.00 31.42 H new ATOM 841 N GLY A 51 5.477 15.387 -4.791 1.00 20.13 N ATOM 842 CA GLY A 51 4.254 15.489 -3.994 1.00 64.32 C ATOM 843 C GLY A 51 3.165 14.526 -4.452 1.00 20.40 C ATOM 844 O GLY A 51 2.089 14.491 -3.859 1.00 61.43 O ATOM 0 H GLY A 51 6.212 14.837 -4.345 1.00 20.13 H new ATOM 0 HA2 GLY A 51 4.490 15.291 -2.948 1.00 64.32 H new ATOM 0 HA3 GLY A 51 3.875 16.510 -4.048 1.00 64.32 H new ATOM 848 N ARG A 52 3.453 13.742 -5.514 1.00 32.11 N ATOM 849 CA ARG A 52 2.478 12.840 -6.138 1.00 25.34 C ATOM 850 C ARG A 52 2.255 11.593 -5.250 1.00 13.41 C ATOM 851 O ARG A 52 3.159 11.195 -4.492 1.00 72.13 O ATOM 852 CB ARG A 52 2.948 12.436 -7.572 1.00 1.34 C ATOM 853 CG ARG A 52 4.241 11.590 -7.634 1.00 4.20 C ATOM 854 CD ARG A 52 4.694 11.290 -9.076 1.00 4.22 C ATOM 855 NE ARG A 52 3.668 10.578 -9.873 1.00 20.22 N ATOM 856 CZ ARG A 52 3.920 9.842 -10.974 1.00 0.44 C ATOM 857 NH1 ARG A 52 5.159 9.694 -11.435 1.00 14.15 N ATOM 858 NH2 ARG A 52 2.919 9.248 -11.603 1.00 10.40 N ATOM 0 H ARG A 52 4.371 13.722 -5.958 1.00 32.11 H new ATOM 0 HA ARG A 52 1.526 13.362 -6.232 1.00 25.34 H new ATOM 0 HB2 ARG A 52 2.146 11.878 -8.055 1.00 1.34 H new ATOM 0 HB3 ARG A 52 3.100 13.344 -8.155 1.00 1.34 H new ATOM 0 HG2 ARG A 52 5.039 12.116 -7.110 1.00 4.20 H new ATOM 0 HG3 ARG A 52 4.080 10.650 -7.106 1.00 4.20 H new ATOM 0 HD2 ARG A 52 4.946 12.227 -9.573 1.00 4.22 H new ATOM 0 HD3 ARG A 52 5.603 10.690 -9.047 1.00 4.22 H new ATOM 0 HE ARG A 52 2.698 10.650 -9.566 1.00 20.22 H new ATOM 0 HH11 ARG A 52 5.939 10.141 -10.954 1.00 14.15 H new ATOM 0 HH12 ARG A 52 5.329 9.133 -12.270 1.00 14.15 H new ATOM 0 HH21 ARG A 52 1.966 9.349 -11.254 1.00 10.40 H new ATOM 0 HH22 ARG A 52 3.100 8.689 -12.437 1.00 10.40 H new ATOM 872 N PRO A 53 1.035 10.979 -5.296 1.00 74.41 N ATOM 873 CA PRO A 53 0.763 9.727 -4.573 1.00 62.31 C ATOM 874 C PRO A 53 1.461 8.532 -5.240 1.00 44.54 C ATOM 875 O PRO A 53 1.822 8.585 -6.428 1.00 43.23 O ATOM 876 CB PRO A 53 -0.775 9.599 -4.641 1.00 4.21 C ATOM 877 CG PRO A 53 -1.151 10.309 -5.908 1.00 50.04 C ATOM 878 CD PRO A 53 -0.171 11.455 -6.040 1.00 34.21 C ATOM 0 HA PRO A 53 1.139 9.737 -3.550 1.00 62.31 H new ATOM 0 HB2 PRO A 53 -1.087 8.555 -4.663 1.00 4.21 H new ATOM 0 HB3 PRO A 53 -1.251 10.055 -3.773 1.00 4.21 H new ATOM 0 HG2 PRO A 53 -1.088 9.639 -6.766 1.00 50.04 H new ATOM 0 HG3 PRO A 53 -2.177 10.674 -5.863 1.00 50.04 H new ATOM 0 HD2 PRO A 53 0.060 11.666 -7.084 1.00 34.21 H new ATOM 0 HD3 PRO A 53 -0.570 12.374 -5.610 1.00 34.21 H new ATOM 886 N ILE A 54 1.633 7.461 -4.469 1.00 32.34 N ATOM 887 CA ILE A 54 2.317 6.259 -4.928 1.00 33.45 C ATOM 888 C ILE A 54 1.688 5.025 -4.277 1.00 52.31 C ATOM 889 O ILE A 54 1.352 5.041 -3.096 1.00 64.14 O ATOM 890 CB ILE A 54 3.861 6.338 -4.643 1.00 74.11 C ATOM 891 CG1 ILE A 54 4.607 5.106 -5.237 1.00 13.31 C ATOM 892 CG2 ILE A 54 4.169 6.516 -3.133 1.00 70.44 C ATOM 893 CD1 ILE A 54 6.113 5.225 -5.218 1.00 41.31 C ATOM 0 H ILE A 54 1.300 7.404 -3.506 1.00 32.34 H new ATOM 0 HA ILE A 54 2.198 6.178 -6.008 1.00 33.45 H new ATOM 0 HB ILE A 54 4.235 7.229 -5.147 1.00 74.11 H new ATOM 0 HG12 ILE A 54 4.317 4.216 -4.678 1.00 13.31 H new ATOM 0 HG13 ILE A 54 4.278 4.958 -6.266 1.00 13.31 H new ATOM 0 HG21 ILE A 54 5.248 6.565 -2.985 1.00 70.44 H new ATOM 0 HG22 ILE A 54 3.711 7.438 -2.774 1.00 70.44 H new ATOM 0 HG23 ILE A 54 3.765 5.670 -2.577 1.00 70.44 H new ATOM 0 HD11 ILE A 54 6.554 4.326 -5.649 1.00 41.31 H new ATOM 0 HD12 ILE A 54 6.417 6.094 -5.802 1.00 41.31 H new ATOM 0 HD13 ILE A 54 6.456 5.341 -4.190 1.00 41.31 H new ATOM 905 N VAL A 55 1.496 3.975 -5.083 1.00 2.50 N ATOM 906 CA VAL A 55 0.969 2.693 -4.633 1.00 10.31 C ATOM 907 C VAL A 55 2.043 1.630 -4.899 1.00 2.35 C ATOM 908 O VAL A 55 2.427 1.391 -6.054 1.00 41.44 O ATOM 909 CB VAL A 55 -0.380 2.319 -5.356 1.00 2.34 C ATOM 910 CG1 VAL A 55 -0.973 1.018 -4.773 1.00 45.31 C ATOM 911 CG2 VAL A 55 -1.404 3.479 -5.270 1.00 13.44 C ATOM 0 H VAL A 55 1.707 3.998 -6.081 1.00 2.50 H new ATOM 0 HA VAL A 55 0.737 2.750 -3.570 1.00 10.31 H new ATOM 0 HB VAL A 55 -0.157 2.150 -6.409 1.00 2.34 H new ATOM 0 HG11 VAL A 55 -1.904 0.780 -5.288 1.00 45.31 H new ATOM 0 HG12 VAL A 55 -0.264 0.202 -4.910 1.00 45.31 H new ATOM 0 HG13 VAL A 55 -1.171 1.153 -3.710 1.00 45.31 H new ATOM 0 HG21 VAL A 55 -2.324 3.190 -5.778 1.00 13.44 H new ATOM 0 HG22 VAL A 55 -1.620 3.697 -4.224 1.00 13.44 H new ATOM 0 HG23 VAL A 55 -0.989 4.367 -5.747 1.00 13.44 H new ATOM 921 N ILE A 56 2.545 1.041 -3.814 1.00 3.32 N ATOM 922 CA ILE A 56 3.579 0.011 -3.846 1.00 35.52 C ATOM 923 C ILE A 56 2.901 -1.364 -3.738 1.00 4.03 C ATOM 924 O ILE A 56 1.941 -1.513 -2.995 1.00 20.34 O ATOM 925 CB ILE A 56 4.595 0.199 -2.661 1.00 74.33 C ATOM 926 CG1 ILE A 56 5.217 1.638 -2.663 1.00 72.34 C ATOM 927 CG2 ILE A 56 5.707 -0.878 -2.713 1.00 60.44 C ATOM 928 CD1 ILE A 56 6.213 1.910 -3.779 1.00 74.33 C ATOM 0 H ILE A 56 2.237 1.272 -2.870 1.00 3.32 H new ATOM 0 HA ILE A 56 4.135 0.088 -4.780 1.00 35.52 H new ATOM 0 HB ILE A 56 4.042 0.077 -1.730 1.00 74.33 H new ATOM 0 HG12 ILE A 56 4.409 2.366 -2.733 1.00 72.34 H new ATOM 0 HG13 ILE A 56 5.713 1.804 -1.707 1.00 72.34 H new ATOM 0 HG21 ILE A 56 6.398 -0.728 -1.884 1.00 60.44 H new ATOM 0 HG22 ILE A 56 5.258 -1.868 -2.637 1.00 60.44 H new ATOM 0 HG23 ILE A 56 6.248 -0.797 -3.656 1.00 60.44 H new ATOM 0 HD11 ILE A 56 6.586 2.931 -3.693 1.00 74.33 H new ATOM 0 HD12 ILE A 56 7.046 1.212 -3.701 1.00 74.33 H new ATOM 0 HD13 ILE A 56 5.722 1.783 -4.744 1.00 74.33 H new ATOM 940 N PHE A 57 3.410 -2.350 -4.480 1.00 53.23 N ATOM 941 CA PHE A 57 2.871 -3.716 -4.508 1.00 22.14 C ATOM 942 C PHE A 57 4.001 -4.677 -4.123 1.00 2.54 C ATOM 943 O PHE A 57 4.977 -4.816 -4.865 1.00 1.42 O ATOM 944 CB PHE A 57 2.330 -4.048 -5.922 1.00 75.32 C ATOM 945 CG PHE A 57 1.286 -3.065 -6.448 1.00 43.42 C ATOM 946 CD1 PHE A 57 -0.045 -3.158 -6.044 1.00 25.31 C ATOM 947 CD2 PHE A 57 1.638 -2.049 -7.344 1.00 42.42 C ATOM 948 CE1 PHE A 57 -0.985 -2.268 -6.515 1.00 31.43 C ATOM 949 CE2 PHE A 57 0.694 -1.162 -7.812 1.00 15.44 C ATOM 950 CZ PHE A 57 -0.617 -1.274 -7.398 1.00 33.13 C ATOM 0 H PHE A 57 4.219 -2.223 -5.088 1.00 53.23 H new ATOM 0 HA PHE A 57 2.044 -3.813 -3.805 1.00 22.14 H new ATOM 0 HB2 PHE A 57 3.167 -4.077 -6.620 1.00 75.32 H new ATOM 0 HB3 PHE A 57 1.894 -5.047 -5.905 1.00 75.32 H new ATOM 0 HD1 PHE A 57 -0.342 -3.935 -5.355 1.00 25.31 H new ATOM 0 HD2 PHE A 57 2.663 -1.959 -7.673 1.00 42.42 H new ATOM 0 HE1 PHE A 57 -2.012 -2.349 -6.192 1.00 31.43 H new ATOM 0 HE2 PHE A 57 0.979 -0.381 -8.501 1.00 15.44 H new ATOM 0 HZ PHE A 57 -1.358 -0.581 -7.767 1.00 33.13 H new ATOM 960 N ILE A 58 3.886 -5.304 -2.946 1.00 22.44 N ATOM 961 CA ILE A 58 4.941 -6.176 -2.395 1.00 15.44 C ATOM 962 C ILE A 58 4.390 -7.601 -2.221 1.00 71.04 C ATOM 963 O ILE A 58 3.380 -7.805 -1.531 1.00 63.20 O ATOM 964 CB ILE A 58 5.486 -5.644 -1.011 1.00 32.25 C ATOM 965 CG1 ILE A 58 5.652 -4.091 -1.030 1.00 33.42 C ATOM 966 CG2 ILE A 58 6.835 -6.332 -0.661 1.00 51.22 C ATOM 967 CD1 ILE A 58 5.951 -3.469 0.319 1.00 34.24 C ATOM 0 H ILE A 58 3.064 -5.224 -2.348 1.00 22.44 H new ATOM 0 HA ILE A 58 5.773 -6.177 -3.099 1.00 15.44 H new ATOM 0 HB ILE A 58 4.756 -5.893 -0.241 1.00 32.25 H new ATOM 0 HG12 ILE A 58 6.456 -3.834 -1.720 1.00 33.42 H new ATOM 0 HG13 ILE A 58 4.739 -3.647 -1.425 1.00 33.42 H new ATOM 0 HG21 ILE A 58 7.198 -5.955 0.295 1.00 51.22 H new ATOM 0 HG22 ILE A 58 6.687 -7.410 -0.594 1.00 51.22 H new ATOM 0 HG23 ILE A 58 7.567 -6.114 -1.439 1.00 51.22 H new ATOM 0 HD11 ILE A 58 6.050 -2.389 0.208 1.00 34.24 H new ATOM 0 HD12 ILE A 58 5.137 -3.690 1.010 1.00 34.24 H new ATOM 0 HD13 ILE A 58 6.881 -3.880 0.711 1.00 34.24 H new ATOM 979 N ARG A 59 5.062 -8.568 -2.865 1.00 24.11 N ATOM 980 CA ARG A 59 4.685 -9.983 -2.826 1.00 64.01 C ATOM 981 C ARG A 59 5.200 -10.622 -1.534 1.00 34.34 C ATOM 982 O ARG A 59 6.417 -10.667 -1.315 1.00 23.43 O ATOM 983 CB ARG A 59 5.272 -10.724 -4.058 1.00 24.10 C ATOM 984 CG ARG A 59 4.864 -12.217 -4.165 1.00 13.34 C ATOM 985 CD ARG A 59 5.648 -12.960 -5.263 1.00 33.25 C ATOM 986 NE ARG A 59 7.098 -13.002 -4.963 1.00 20.30 N ATOM 987 CZ ARG A 59 8.083 -12.604 -5.786 1.00 35.44 C ATOM 988 NH1 ARG A 59 7.815 -12.118 -6.994 1.00 21.53 N ATOM 989 NH2 ARG A 59 9.342 -12.705 -5.392 1.00 42.15 N ATOM 0 H ARG A 59 5.890 -8.384 -3.432 1.00 24.11 H new ATOM 0 HA ARG A 59 3.598 -10.063 -2.853 1.00 64.01 H new ATOM 0 HB2 ARG A 59 4.953 -10.207 -4.963 1.00 24.10 H new ATOM 0 HB3 ARG A 59 6.359 -10.659 -4.021 1.00 24.10 H new ATOM 0 HG2 ARG A 59 5.033 -12.707 -3.206 1.00 13.34 H new ATOM 0 HG3 ARG A 59 3.796 -12.286 -4.374 1.00 13.34 H new ATOM 0 HD2 ARG A 59 5.266 -13.976 -5.359 1.00 33.25 H new ATOM 0 HD3 ARG A 59 5.488 -12.467 -6.222 1.00 33.25 H new ATOM 0 HE ARG A 59 7.373 -13.365 -4.051 1.00 20.30 H new ATOM 0 HH11 ARG A 59 6.848 -12.042 -7.310 1.00 21.53 H new ATOM 0 HH12 ARG A 59 8.576 -11.821 -7.605 1.00 21.53 H new ATOM 0 HH21 ARG A 59 9.559 -13.083 -4.470 1.00 42.15 H new ATOM 0 HH22 ARG A 59 10.096 -12.405 -6.011 1.00 42.15 H new ATOM 1003 N GLY A 60 4.262 -11.075 -0.680 1.00 64.55 N ATOM 1004 CA GLY A 60 4.597 -11.818 0.535 1.00 73.44 C ATOM 1005 C GLY A 60 5.392 -11.013 1.552 1.00 51.41 C ATOM 1006 O GLY A 60 6.302 -11.554 2.199 1.00 31.33 O ATOM 0 H GLY A 60 3.261 -10.934 -0.817 1.00 64.55 H new ATOM 0 HA2 GLY A 60 3.675 -12.165 1.002 1.00 73.44 H new ATOM 0 HA3 GLY A 60 5.169 -12.704 0.261 1.00 73.44 H new ATOM 1010 N ALA A 61 5.072 -9.706 1.666 1.00 11.33 N ATOM 1011 CA ALA A 61 5.675 -8.829 2.675 1.00 22.44 C ATOM 1012 C ALA A 61 5.173 -9.245 4.058 1.00 61.31 C ATOM 1013 O ALA A 61 4.024 -8.979 4.422 1.00 60.25 O ATOM 1014 CB ALA A 61 5.346 -7.357 2.398 1.00 5.53 C ATOM 0 H ALA A 61 4.394 -9.239 1.064 1.00 11.33 H new ATOM 0 HA ALA A 61 6.759 -8.931 2.634 1.00 22.44 H new ATOM 0 HB1 ALA A 61 5.806 -6.731 3.162 1.00 5.53 H new ATOM 0 HB2 ALA A 61 5.732 -7.076 1.418 1.00 5.53 H new ATOM 0 HB3 ALA A 61 4.265 -7.216 2.416 1.00 5.53 H new ATOM 1020 N THR A 62 6.030 -9.949 4.792 1.00 3.14 N ATOM 1021 CA THR A 62 5.723 -10.421 6.146 1.00 75.21 C ATOM 1022 C THR A 62 5.822 -9.248 7.154 1.00 30.43 C ATOM 1023 O THR A 62 6.275 -8.156 6.785 1.00 71.40 O ATOM 1024 CB THR A 62 6.656 -11.615 6.531 1.00 45.20 C ATOM 1025 OG1 THR A 62 6.317 -12.108 7.826 1.00 62.33 O ATOM 1026 CG2 THR A 62 8.145 -11.239 6.492 1.00 42.42 C ATOM 0 H THR A 62 6.961 -10.211 4.467 1.00 3.14 H new ATOM 0 HA THR A 62 4.699 -10.792 6.177 1.00 75.21 H new ATOM 0 HB THR A 62 6.498 -12.393 5.784 1.00 45.20 H new ATOM 0 HG1 THR A 62 6.906 -12.856 8.056 1.00 62.33 H new ATOM 0 HG21 THR A 62 8.746 -12.105 6.768 1.00 42.42 H new ATOM 0 HG22 THR A 62 8.413 -10.917 5.486 1.00 42.42 H new ATOM 0 HG23 THR A 62 8.334 -10.428 7.195 1.00 42.42 H new ATOM 1034 N GLU A 63 5.412 -9.502 8.418 1.00 72.33 N ATOM 1035 CA GLU A 63 5.218 -8.470 9.466 1.00 1.40 C ATOM 1036 C GLU A 63 6.457 -7.563 9.624 1.00 2.35 C ATOM 1037 O GLU A 63 6.317 -6.336 9.655 1.00 63.33 O ATOM 1038 CB GLU A 63 4.835 -9.176 10.807 1.00 34.13 C ATOM 1039 CG GLU A 63 4.223 -8.282 11.926 1.00 42.14 C ATOM 1040 CD GLU A 63 5.235 -7.404 12.691 1.00 31.13 C ATOM 1041 OE1 GLU A 63 6.244 -7.943 13.193 1.00 0.12 O ATOM 1042 OE2 GLU A 63 5.005 -6.187 12.827 1.00 43.14 O ATOM 0 H GLU A 63 5.203 -10.445 8.745 1.00 72.33 H new ATOM 0 HA GLU A 63 4.405 -7.809 9.166 1.00 1.40 H new ATOM 0 HB2 GLU A 63 4.124 -9.970 10.581 1.00 34.13 H new ATOM 0 HB3 GLU A 63 5.730 -9.654 11.206 1.00 34.13 H new ATOM 0 HG2 GLU A 63 3.469 -7.634 11.480 1.00 42.14 H new ATOM 0 HG3 GLU A 63 3.709 -8.924 12.642 1.00 42.14 H new ATOM 1049 N GLU A 64 7.658 -8.189 9.657 1.00 52.40 N ATOM 1050 CA GLU A 64 8.945 -7.483 9.833 1.00 52.33 C ATOM 1051 C GLU A 64 9.219 -6.479 8.687 1.00 24.42 C ATOM 1052 O GLU A 64 9.759 -5.396 8.922 1.00 44.24 O ATOM 1053 CB GLU A 64 10.121 -8.498 9.956 1.00 23.24 C ATOM 1054 CG GLU A 64 10.373 -9.361 8.698 1.00 21.52 C ATOM 1055 CD GLU A 64 11.524 -10.364 8.862 1.00 74.54 C ATOM 1056 OE1 GLU A 64 11.258 -11.557 9.153 1.00 74.15 O ATOM 1057 OE2 GLU A 64 12.697 -9.962 8.707 1.00 42.01 O ATOM 0 H GLU A 64 7.759 -9.200 9.562 1.00 52.40 H new ATOM 0 HA GLU A 64 8.872 -6.913 10.759 1.00 52.33 H new ATOM 0 HB2 GLU A 64 11.033 -7.948 10.190 1.00 23.24 H new ATOM 0 HB3 GLU A 64 9.923 -9.160 10.799 1.00 23.24 H new ATOM 0 HG2 GLU A 64 9.461 -9.904 8.452 1.00 21.52 H new ATOM 0 HG3 GLU A 64 10.591 -8.705 7.855 1.00 21.52 H new ATOM 1064 N VAL A 65 8.814 -6.847 7.460 1.00 2.33 N ATOM 1065 CA VAL A 65 9.030 -6.027 6.258 1.00 50.02 C ATOM 1066 C VAL A 65 8.097 -4.804 6.280 1.00 62.24 C ATOM 1067 O VAL A 65 8.550 -3.658 6.141 1.00 44.13 O ATOM 1068 CB VAL A 65 8.780 -6.865 4.941 1.00 40.03 C ATOM 1069 CG1 VAL A 65 9.027 -6.020 3.668 1.00 44.44 C ATOM 1070 CG2 VAL A 65 9.631 -8.159 4.927 1.00 61.32 C ATOM 0 H VAL A 65 8.327 -7.724 7.274 1.00 2.33 H new ATOM 0 HA VAL A 65 10.068 -5.694 6.260 1.00 50.02 H new ATOM 0 HB VAL A 65 7.730 -7.156 4.939 1.00 40.03 H new ATOM 0 HG11 VAL A 65 8.845 -6.632 2.784 1.00 44.44 H new ATOM 0 HG12 VAL A 65 8.352 -5.164 3.663 1.00 44.44 H new ATOM 0 HG13 VAL A 65 10.059 -5.668 3.659 1.00 44.44 H new ATOM 0 HG21 VAL A 65 9.436 -8.713 4.009 1.00 61.32 H new ATOM 0 HG22 VAL A 65 10.688 -7.900 4.977 1.00 61.32 H new ATOM 0 HG23 VAL A 65 9.368 -8.777 5.786 1.00 61.32 H new ATOM 1080 N VAL A 66 6.796 -5.069 6.515 1.00 51.32 N ATOM 1081 CA VAL A 66 5.739 -4.052 6.401 1.00 32.32 C ATOM 1082 C VAL A 66 5.918 -2.951 7.457 1.00 52.42 C ATOM 1083 O VAL A 66 5.949 -1.774 7.110 1.00 44.10 O ATOM 1084 CB VAL A 66 4.303 -4.678 6.523 1.00 35.13 C ATOM 1085 CG1 VAL A 66 3.200 -3.633 6.200 1.00 42.55 C ATOM 1086 CG2 VAL A 66 4.163 -5.928 5.628 1.00 61.14 C ATOM 0 H VAL A 66 6.453 -5.990 6.788 1.00 51.32 H new ATOM 0 HA VAL A 66 5.832 -3.613 5.408 1.00 32.32 H new ATOM 0 HB VAL A 66 4.168 -4.991 7.558 1.00 35.13 H new ATOM 0 HG11 VAL A 66 2.219 -4.099 6.294 1.00 42.55 H new ATOM 0 HG12 VAL A 66 3.274 -2.799 6.898 1.00 42.55 H new ATOM 0 HG13 VAL A 66 3.332 -3.267 5.182 1.00 42.55 H new ATOM 0 HG21 VAL A 66 3.159 -6.340 5.733 1.00 61.14 H new ATOM 0 HG22 VAL A 66 4.335 -5.652 4.588 1.00 61.14 H new ATOM 0 HG23 VAL A 66 4.896 -6.676 5.931 1.00 61.14 H new ATOM 1096 N ARG A 67 6.098 -3.362 8.735 1.00 60.24 N ATOM 1097 CA ARG A 67 6.280 -2.429 9.881 1.00 34.30 C ATOM 1098 C ARG A 67 7.461 -1.451 9.641 1.00 42.22 C ATOM 1099 O ARG A 67 7.395 -0.278 10.011 1.00 44.11 O ATOM 1100 CB ARG A 67 6.509 -3.230 11.201 1.00 41.41 C ATOM 1101 CG ARG A 67 7.828 -4.040 11.243 1.00 63.12 C ATOM 1102 CD ARG A 67 8.040 -4.807 12.555 1.00 41.02 C ATOM 1103 NE ARG A 67 8.245 -3.909 13.706 1.00 25.55 N ATOM 1104 CZ ARG A 67 7.545 -3.944 14.844 1.00 30.24 C ATOM 1105 NH1 ARG A 67 6.568 -4.833 15.010 1.00 73.34 N ATOM 1106 NH2 ARG A 67 7.827 -3.084 15.814 1.00 51.35 N ATOM 0 H ARG A 67 6.122 -4.346 9.004 1.00 60.24 H new ATOM 0 HA ARG A 67 5.369 -1.838 9.972 1.00 34.30 H new ATOM 0 HB2 ARG A 67 6.499 -2.534 12.039 1.00 41.41 H new ATOM 0 HB3 ARG A 67 5.673 -3.914 11.345 1.00 41.41 H new ATOM 0 HG2 ARG A 67 7.836 -4.747 10.414 1.00 63.12 H new ATOM 0 HG3 ARG A 67 8.666 -3.360 11.090 1.00 63.12 H new ATOM 0 HD2 ARG A 67 7.175 -5.443 12.744 1.00 41.02 H new ATOM 0 HD3 ARG A 67 8.903 -5.464 12.453 1.00 41.02 H new ATOM 0 HE ARG A 67 8.979 -3.205 13.628 1.00 25.55 H new ATOM 0 HH11 ARG A 67 6.349 -5.495 14.265 1.00 73.34 H new ATOM 0 HH12 ARG A 67 6.039 -4.853 15.882 1.00 73.34 H new ATOM 0 HH21 ARG A 67 8.574 -2.401 15.689 1.00 51.35 H new ATOM 0 HH22 ARG A 67 7.296 -3.106 16.685 1.00 51.35 H new ATOM 1120 N ASP A 68 8.503 -1.977 8.973 1.00 51.12 N ATOM 1121 CA ASP A 68 9.775 -1.289 8.693 1.00 72.10 C ATOM 1122 C ASP A 68 9.597 -0.210 7.600 1.00 44.01 C ATOM 1123 O ASP A 68 10.160 0.890 7.690 1.00 50.33 O ATOM 1124 CB ASP A 68 10.815 -2.368 8.272 1.00 25.41 C ATOM 1125 CG ASP A 68 12.130 -1.801 7.731 1.00 62.43 C ATOM 1126 OD1 ASP A 68 12.360 -1.868 6.511 1.00 63.22 O ATOM 1127 OD2 ASP A 68 12.943 -1.289 8.527 1.00 64.24 O ATOM 0 H ASP A 68 8.481 -2.926 8.600 1.00 51.12 H new ATOM 0 HA ASP A 68 10.126 -0.766 9.583 1.00 72.10 H new ATOM 0 HB2 ASP A 68 11.033 -3.001 9.133 1.00 25.41 H new ATOM 0 HB3 ASP A 68 10.369 -3.008 7.511 1.00 25.41 H new ATOM 1132 N ILE A 69 8.806 -0.546 6.574 1.00 74.41 N ATOM 1133 CA ILE A 69 8.490 0.363 5.456 1.00 24.20 C ATOM 1134 C ILE A 69 7.511 1.473 5.892 1.00 53.42 C ATOM 1135 O ILE A 69 7.687 2.650 5.540 1.00 12.14 O ATOM 1136 CB ILE A 69 7.867 -0.449 4.267 1.00 74.33 C ATOM 1137 CG1 ILE A 69 8.885 -1.503 3.736 1.00 23.04 C ATOM 1138 CG2 ILE A 69 7.378 0.482 3.131 1.00 75.14 C ATOM 1139 CD1 ILE A 69 8.310 -2.456 2.712 1.00 61.20 C ATOM 0 H ILE A 69 8.363 -1.461 6.492 1.00 74.41 H new ATOM 0 HA ILE A 69 9.419 0.834 5.135 1.00 24.20 H new ATOM 0 HB ILE A 69 6.991 -0.977 4.645 1.00 74.33 H new ATOM 0 HG12 ILE A 69 9.734 -0.982 3.295 1.00 23.04 H new ATOM 0 HG13 ILE A 69 9.268 -2.079 4.578 1.00 23.04 H new ATOM 0 HG21 ILE A 69 6.953 -0.118 2.326 1.00 75.14 H new ATOM 0 HG22 ILE A 69 6.618 1.160 3.518 1.00 75.14 H new ATOM 0 HG23 ILE A 69 8.218 1.060 2.747 1.00 75.14 H new ATOM 0 HD11 ILE A 69 9.082 -3.157 2.393 1.00 61.20 H new ATOM 0 HD12 ILE A 69 7.480 -3.007 3.154 1.00 61.20 H new ATOM 0 HD13 ILE A 69 7.954 -1.892 1.850 1.00 61.20 H new ATOM 1151 N VAL A 70 6.486 1.074 6.658 1.00 2.21 N ATOM 1152 CA VAL A 70 5.397 1.965 7.080 1.00 53.43 C ATOM 1153 C VAL A 70 5.921 3.062 8.025 1.00 33.45 C ATOM 1154 O VAL A 70 5.578 4.238 7.848 1.00 25.03 O ATOM 1155 CB VAL A 70 4.222 1.143 7.736 1.00 2.22 C ATOM 1156 CG1 VAL A 70 3.145 2.058 8.360 1.00 41.21 C ATOM 1157 CG2 VAL A 70 3.583 0.188 6.696 1.00 21.22 C ATOM 0 H VAL A 70 6.389 0.119 7.004 1.00 2.21 H new ATOM 0 HA VAL A 70 4.996 2.460 6.195 1.00 53.43 H new ATOM 0 HB VAL A 70 4.654 0.554 8.545 1.00 2.22 H new ATOM 0 HG11 VAL A 70 2.357 1.446 8.799 1.00 41.21 H new ATOM 0 HG12 VAL A 70 3.598 2.677 9.135 1.00 41.21 H new ATOM 0 HG13 VAL A 70 2.719 2.698 7.587 1.00 41.21 H new ATOM 0 HG21 VAL A 70 2.774 -0.372 7.165 1.00 21.22 H new ATOM 0 HG22 VAL A 70 3.187 0.769 5.863 1.00 21.22 H new ATOM 0 HG23 VAL A 70 4.338 -0.506 6.327 1.00 21.22 H new ATOM 1167 N GLU A 71 6.805 2.677 8.982 1.00 52.23 N ATOM 1168 CA GLU A 71 7.418 3.640 9.922 1.00 4.53 C ATOM 1169 C GLU A 71 8.299 4.649 9.168 1.00 60.42 C ATOM 1170 O GLU A 71 8.358 5.816 9.547 1.00 62.21 O ATOM 1171 CB GLU A 71 8.201 2.916 11.064 1.00 10.24 C ATOM 1172 CG GLU A 71 9.451 2.080 10.651 1.00 60.43 C ATOM 1173 CD GLU A 71 10.800 2.839 10.719 1.00 13.50 C ATOM 1174 OE1 GLU A 71 11.335 3.004 11.836 1.00 1.15 O ATOM 1175 OE2 GLU A 71 11.337 3.247 9.669 1.00 32.21 O ATOM 0 H GLU A 71 7.105 1.712 9.119 1.00 52.23 H new ATOM 0 HA GLU A 71 6.615 4.198 10.403 1.00 4.53 H new ATOM 0 HB2 GLU A 71 8.521 3.669 11.784 1.00 10.24 H new ATOM 0 HB3 GLU A 71 7.507 2.254 11.582 1.00 10.24 H new ATOM 0 HG2 GLU A 71 9.512 1.203 11.296 1.00 60.43 H new ATOM 0 HG3 GLU A 71 9.307 1.718 9.633 1.00 60.43 H new ATOM 1182 N TYR A 72 8.935 4.184 8.069 1.00 4.05 N ATOM 1183 CA TYR A 72 9.772 5.022 7.191 1.00 74.14 C ATOM 1184 C TYR A 72 8.918 6.081 6.473 1.00 35.04 C ATOM 1185 O TYR A 72 9.295 7.250 6.416 1.00 1.01 O ATOM 1186 CB TYR A 72 10.518 4.135 6.157 1.00 2.14 C ATOM 1187 CG TYR A 72 11.489 4.901 5.239 1.00 62.32 C ATOM 1188 CD1 TYR A 72 12.822 5.106 5.610 1.00 51.22 C ATOM 1189 CD2 TYR A 72 11.071 5.424 4.002 1.00 23.34 C ATOM 1190 CE1 TYR A 72 13.695 5.792 4.786 1.00 35.43 C ATOM 1191 CE2 TYR A 72 11.943 6.111 3.184 1.00 35.13 C ATOM 1192 CZ TYR A 72 13.254 6.291 3.579 1.00 10.41 C ATOM 1193 OH TYR A 72 14.134 6.960 2.760 1.00 21.21 O ATOM 0 H TYR A 72 8.879 3.211 7.768 1.00 4.05 H new ATOM 0 HA TYR A 72 10.508 5.539 7.806 1.00 74.14 H new ATOM 0 HB2 TYR A 72 11.075 3.366 6.692 1.00 2.14 H new ATOM 0 HB3 TYR A 72 9.781 3.623 5.538 1.00 2.14 H new ATOM 0 HD1 TYR A 72 13.175 4.722 6.556 1.00 51.22 H new ATOM 0 HD2 TYR A 72 10.047 5.285 3.687 1.00 23.34 H new ATOM 0 HE1 TYR A 72 14.722 5.937 5.088 1.00 35.43 H new ATOM 0 HE2 TYR A 72 11.602 6.507 2.239 1.00 35.13 H new ATOM 0 HH TYR A 72 14.082 6.592 1.853 1.00 21.21 H new ATOM 1203 N ALA A 73 7.767 5.650 5.929 1.00 22.13 N ATOM 1204 CA ALA A 73 6.826 6.540 5.224 1.00 63.24 C ATOM 1205 C ALA A 73 6.180 7.565 6.188 1.00 11.43 C ATOM 1206 O ALA A 73 5.736 8.639 5.762 1.00 32.11 O ATOM 1207 CB ALA A 73 5.769 5.701 4.493 1.00 20.15 C ATOM 0 H ALA A 73 7.462 4.677 5.965 1.00 22.13 H new ATOM 0 HA ALA A 73 7.380 7.118 4.484 1.00 63.24 H new ATOM 0 HB1 ALA A 73 5.075 6.362 3.973 1.00 20.15 H new ATOM 0 HB2 ALA A 73 6.259 5.048 3.770 1.00 20.15 H new ATOM 0 HB3 ALA A 73 5.221 5.096 5.216 1.00 20.15 H new ATOM 1213 N GLN A 74 6.144 7.216 7.494 1.00 63.01 N ATOM 1214 CA GLN A 74 5.712 8.135 8.571 1.00 30.44 C ATOM 1215 C GLN A 74 6.849 9.104 8.963 1.00 13.43 C ATOM 1216 O GLN A 74 6.584 10.229 9.400 1.00 31.54 O ATOM 1217 CB GLN A 74 5.235 7.332 9.806 1.00 52.24 C ATOM 1218 CG GLN A 74 4.007 6.441 9.537 1.00 3.25 C ATOM 1219 CD GLN A 74 3.596 5.603 10.743 1.00 61.14 C ATOM 1220 OE1 GLN A 74 4.080 4.485 10.936 1.00 72.54 O ATOM 1221 NE2 GLN A 74 2.695 6.121 11.562 1.00 21.13 N ATOM 0 H GLN A 74 6.413 6.291 7.830 1.00 63.01 H new ATOM 0 HA GLN A 74 4.878 8.728 8.196 1.00 30.44 H new ATOM 0 HB2 GLN A 74 6.055 6.706 10.159 1.00 52.24 H new ATOM 0 HB3 GLN A 74 4.997 8.029 10.610 1.00 52.24 H new ATOM 0 HG2 GLN A 74 3.169 7.070 9.237 1.00 3.25 H new ATOM 0 HG3 GLN A 74 4.224 5.778 8.699 1.00 3.25 H new ATOM 0 HE21 GLN A 74 2.312 7.048 11.378 1.00 21.13 H new ATOM 0 HE22 GLN A 74 2.384 5.593 12.377 1.00 21.13 H new ATOM 1230 N LYS A 75 8.116 8.653 8.805 1.00 62.33 N ATOM 1231 CA LYS A 75 9.317 9.517 8.968 1.00 22.33 C ATOM 1232 C LYS A 75 9.368 10.575 7.848 1.00 13.25 C ATOM 1233 O LYS A 75 9.934 11.659 8.031 1.00 74.10 O ATOM 1234 CB LYS A 75 10.619 8.663 8.958 1.00 34.41 C ATOM 1235 CG LYS A 75 10.782 7.716 10.171 1.00 41.05 C ATOM 1236 CD LYS A 75 11.978 6.742 10.031 1.00 53.12 C ATOM 1237 CE LYS A 75 13.336 7.456 9.914 1.00 44.45 C ATOM 1238 NZ LYS A 75 13.608 8.330 11.089 1.00 20.11 N ATOM 0 H LYS A 75 8.337 7.687 8.563 1.00 62.33 H new ATOM 0 HA LYS A 75 9.246 10.023 9.931 1.00 22.33 H new ATOM 0 HB2 LYS A 75 10.640 8.068 8.045 1.00 34.41 H new ATOM 0 HB3 LYS A 75 11.477 9.334 8.921 1.00 34.41 H new ATOM 0 HG2 LYS A 75 10.912 8.312 11.074 1.00 41.05 H new ATOM 0 HG3 LYS A 75 9.866 7.139 10.299 1.00 41.05 H new ATOM 0 HD2 LYS A 75 11.999 6.077 10.894 1.00 53.12 H new ATOM 0 HD3 LYS A 75 11.827 6.117 9.151 1.00 53.12 H new ATOM 0 HE2 LYS A 75 14.129 6.714 9.822 1.00 44.45 H new ATOM 0 HE3 LYS A 75 13.353 8.056 9.004 1.00 44.45 H new ATOM 0 HZ1 LYS A 75 14.578 8.699 11.030 1.00 20.11 H new ATOM 0 HZ2 LYS A 75 12.936 9.123 11.095 1.00 20.11 H new ATOM 0 HZ3 LYS A 75 13.500 7.779 11.964 1.00 20.11 H new ATOM 1252 N GLU A 76 8.777 10.232 6.685 1.00 62.41 N ATOM 1253 CA GLU A 76 8.619 11.154 5.545 1.00 74.14 C ATOM 1254 C GLU A 76 7.490 12.179 5.802 1.00 73.51 C ATOM 1255 O GLU A 76 7.406 13.204 5.115 1.00 12.42 O ATOM 1256 CB GLU A 76 8.314 10.358 4.246 1.00 15.44 C ATOM 1257 CG GLU A 76 9.326 9.256 3.887 1.00 53.12 C ATOM 1258 CD GLU A 76 10.765 9.760 3.728 1.00 44.31 C ATOM 1259 OE1 GLU A 76 11.075 10.398 2.700 1.00 64.31 O ATOM 1260 OE2 GLU A 76 11.589 9.522 4.632 1.00 54.33 O ATOM 0 H GLU A 76 8.395 9.303 6.511 1.00 62.41 H new ATOM 0 HA GLU A 76 9.557 11.697 5.427 1.00 74.14 H new ATOM 0 HB2 GLU A 76 7.328 9.903 4.343 1.00 15.44 H new ATOM 0 HB3 GLU A 76 8.260 11.061 3.415 1.00 15.44 H new ATOM 0 HG2 GLU A 76 9.304 8.490 4.662 1.00 53.12 H new ATOM 0 HG3 GLU A 76 9.014 8.779 2.958 1.00 53.12 H new ATOM 1267 N GLY A 77 6.621 11.876 6.785 1.00 53.14 N ATOM 1268 CA GLY A 77 5.460 12.710 7.095 1.00 3.14 C ATOM 1269 C GLY A 77 4.353 12.568 6.059 1.00 3.12 C ATOM 1270 O GLY A 77 3.574 13.500 5.841 1.00 23.30 O ATOM 0 H GLY A 77 6.709 11.051 7.379 1.00 53.14 H new ATOM 0 HA2 GLY A 77 5.072 12.439 8.077 1.00 3.14 H new ATOM 0 HA3 GLY A 77 5.770 13.754 7.152 1.00 3.14 H new ATOM 1274 N LEU A 78 4.310 11.393 5.398 1.00 2.22 N ATOM 1275 CA LEU A 78 3.321 11.084 4.348 1.00 44.31 C ATOM 1276 C LEU A 78 2.244 10.153 4.909 1.00 30.21 C ATOM 1277 O LEU A 78 2.552 9.267 5.708 1.00 61.01 O ATOM 1278 CB LEU A 78 4.015 10.427 3.120 1.00 55.04 C ATOM 1279 CG LEU A 78 5.210 11.221 2.504 1.00 41.10 C ATOM 1280 CD1 LEU A 78 5.791 10.495 1.278 1.00 64.25 C ATOM 1281 CD2 LEU A 78 4.824 12.678 2.170 1.00 53.25 C ATOM 0 H LEU A 78 4.963 10.630 5.579 1.00 2.22 H new ATOM 0 HA LEU A 78 2.854 12.013 4.021 1.00 44.31 H new ATOM 0 HB2 LEU A 78 4.373 9.441 3.415 1.00 55.04 H new ATOM 0 HB3 LEU A 78 3.266 10.275 2.343 1.00 55.04 H new ATOM 0 HG LEU A 78 5.992 11.266 3.262 1.00 41.10 H new ATOM 0 HD11 LEU A 78 6.621 11.073 0.872 1.00 64.25 H new ATOM 0 HD12 LEU A 78 6.147 9.508 1.574 1.00 64.25 H new ATOM 0 HD13 LEU A 78 5.017 10.389 0.518 1.00 64.25 H new ATOM 0 HD21 LEU A 78 5.684 13.194 1.744 1.00 53.25 H new ATOM 0 HD22 LEU A 78 4.006 12.682 1.450 1.00 53.25 H new ATOM 0 HD23 LEU A 78 4.509 13.189 3.080 1.00 53.25 H new ATOM 1293 N ARG A 79 0.997 10.368 4.471 1.00 22.44 N ATOM 1294 CA ARG A 79 -0.164 9.581 4.899 1.00 21.01 C ATOM 1295 C ARG A 79 -0.056 8.148 4.338 1.00 60.21 C ATOM 1296 O ARG A 79 -0.101 7.952 3.117 1.00 61.41 O ATOM 1297 CB ARG A 79 -1.456 10.280 4.396 1.00 21.43 C ATOM 1298 CG ARG A 79 -2.772 9.583 4.802 1.00 22.55 C ATOM 1299 CD ARG A 79 -4.018 10.284 4.234 1.00 52.21 C ATOM 1300 NE ARG A 79 -3.997 10.377 2.754 1.00 55.04 N ATOM 1301 CZ ARG A 79 -5.085 10.456 1.962 1.00 2.22 C ATOM 1302 NH1 ARG A 79 -6.316 10.448 2.479 1.00 13.51 N ATOM 1303 NH2 ARG A 79 -4.930 10.573 0.652 1.00 33.11 N ATOM 0 H ARG A 79 0.764 11.102 3.802 1.00 22.44 H new ATOM 0 HA ARG A 79 -0.197 9.517 5.987 1.00 21.01 H new ATOM 0 HB2 ARG A 79 -1.471 11.301 4.776 1.00 21.43 H new ATOM 0 HB3 ARG A 79 -1.417 10.345 3.309 1.00 21.43 H new ATOM 0 HG2 ARG A 79 -2.752 8.550 4.455 1.00 22.55 H new ATOM 0 HG3 ARG A 79 -2.842 9.553 5.889 1.00 22.55 H new ATOM 0 HD2 ARG A 79 -4.910 9.741 4.547 1.00 52.21 H new ATOM 0 HD3 ARG A 79 -4.090 11.286 4.656 1.00 52.21 H new ATOM 0 HE ARG A 79 -3.085 10.382 2.298 1.00 55.04 H new ATOM 0 HH11 ARG A 79 -6.445 10.381 3.489 1.00 13.51 H new ATOM 0 HH12 ARG A 79 -7.128 10.509 1.864 1.00 13.51 H new ATOM 0 HH21 ARG A 79 -3.993 10.603 0.250 1.00 33.11 H new ATOM 0 HH22 ARG A 79 -5.748 10.633 0.045 1.00 33.11 H new ATOM 1317 N VAL A 80 0.111 7.160 5.237 1.00 43.44 N ATOM 1318 CA VAL A 80 0.342 5.752 4.857 1.00 3.32 C ATOM 1319 C VAL A 80 -0.976 4.956 4.939 1.00 14.20 C ATOM 1320 O VAL A 80 -1.595 4.861 6.003 1.00 23.52 O ATOM 1321 CB VAL A 80 1.430 5.061 5.768 1.00 20.25 C ATOM 1322 CG1 VAL A 80 1.886 3.708 5.162 1.00 21.04 C ATOM 1323 CG2 VAL A 80 2.629 6.000 6.022 1.00 72.32 C ATOM 0 H VAL A 80 0.090 7.314 6.245 1.00 43.44 H new ATOM 0 HA VAL A 80 0.714 5.753 3.832 1.00 3.32 H new ATOM 0 HB VAL A 80 0.971 4.852 6.734 1.00 20.25 H new ATOM 0 HG11 VAL A 80 2.636 3.253 5.810 1.00 21.04 H new ATOM 0 HG12 VAL A 80 1.029 3.041 5.075 1.00 21.04 H new ATOM 0 HG13 VAL A 80 2.315 3.878 4.174 1.00 21.04 H new ATOM 0 HG21 VAL A 80 3.360 5.494 6.653 1.00 72.32 H new ATOM 0 HG22 VAL A 80 3.091 6.265 5.071 1.00 72.32 H new ATOM 0 HG23 VAL A 80 2.283 6.905 6.522 1.00 72.32 H new ATOM 1333 N LEU A 81 -1.405 4.419 3.795 1.00 21.41 N ATOM 1334 CA LEU A 81 -2.617 3.593 3.665 1.00 73.31 C ATOM 1335 C LEU A 81 -2.196 2.160 3.319 1.00 20.51 C ATOM 1336 O LEU A 81 -1.741 1.922 2.210 1.00 2.10 O ATOM 1337 CB LEU A 81 -3.534 4.147 2.524 1.00 15.23 C ATOM 1338 CG LEU A 81 -4.210 5.545 2.733 1.00 31.14 C ATOM 1339 CD1 LEU A 81 -4.979 5.607 4.058 1.00 43.43 C ATOM 1340 CD2 LEU A 81 -3.202 6.698 2.613 1.00 24.12 C ATOM 0 H LEU A 81 -0.912 4.546 2.911 1.00 21.41 H new ATOM 0 HA LEU A 81 -3.171 3.614 4.603 1.00 73.31 H new ATOM 0 HB2 LEU A 81 -2.938 4.198 1.613 1.00 15.23 H new ATOM 0 HB3 LEU A 81 -4.325 3.417 2.348 1.00 15.23 H new ATOM 0 HG LEU A 81 -4.933 5.670 1.927 1.00 31.14 H new ATOM 0 HD11 LEU A 81 -5.434 6.591 4.169 1.00 43.43 H new ATOM 0 HD12 LEU A 81 -5.758 4.844 4.063 1.00 43.43 H new ATOM 0 HD13 LEU A 81 -4.292 5.430 4.886 1.00 43.43 H new ATOM 0 HD21 LEU A 81 -3.715 7.647 2.765 1.00 24.12 H new ATOM 0 HD22 LEU A 81 -2.424 6.581 3.368 1.00 24.12 H new ATOM 0 HD23 LEU A 81 -2.750 6.685 1.621 1.00 24.12 H new ATOM 1352 N VAL A 82 -2.350 1.198 4.239 1.00 72.32 N ATOM 1353 CA VAL A 82 -1.881 -0.186 3.994 1.00 62.10 C ATOM 1354 C VAL A 82 -3.079 -1.124 3.781 1.00 70.35 C ATOM 1355 O VAL A 82 -3.945 -1.235 4.653 1.00 25.11 O ATOM 1356 CB VAL A 82 -0.968 -0.724 5.162 1.00 71.31 C ATOM 1357 CG1 VAL A 82 -0.384 -2.127 4.838 1.00 10.01 C ATOM 1358 CG2 VAL A 82 0.148 0.295 5.497 1.00 71.43 C ATOM 0 H VAL A 82 -2.788 1.342 5.149 1.00 72.32 H new ATOM 0 HA VAL A 82 -1.272 -0.165 3.090 1.00 62.10 H new ATOM 0 HB VAL A 82 -1.594 -0.841 6.047 1.00 71.31 H new ATOM 0 HG11 VAL A 82 0.239 -2.462 5.667 1.00 10.01 H new ATOM 0 HG12 VAL A 82 -1.199 -2.835 4.688 1.00 10.01 H new ATOM 0 HG13 VAL A 82 0.219 -2.070 3.932 1.00 10.01 H new ATOM 0 HG21 VAL A 82 0.767 -0.095 6.305 1.00 71.43 H new ATOM 0 HG22 VAL A 82 0.766 0.461 4.615 1.00 71.43 H new ATOM 0 HG23 VAL A 82 -0.302 1.238 5.807 1.00 71.43 H new ATOM 1368 N ILE A 83 -3.127 -1.770 2.598 1.00 41.02 N ATOM 1369 CA ILE A 83 -4.120 -2.807 2.270 1.00 33.41 C ATOM 1370 C ILE A 83 -3.392 -4.150 2.177 1.00 62.24 C ATOM 1371 O ILE A 83 -2.504 -4.317 1.338 1.00 52.24 O ATOM 1372 CB ILE A 83 -4.855 -2.536 0.901 1.00 12.41 C ATOM 1373 CG1 ILE A 83 -5.492 -1.122 0.894 1.00 22.14 C ATOM 1374 CG2 ILE A 83 -5.928 -3.627 0.617 1.00 5.22 C ATOM 1375 CD1 ILE A 83 -6.183 -0.746 -0.402 1.00 10.03 C ATOM 0 H ILE A 83 -2.471 -1.583 1.839 1.00 41.02 H new ATOM 0 HA ILE A 83 -4.878 -2.805 3.053 1.00 33.41 H new ATOM 0 HB ILE A 83 -4.113 -2.582 0.104 1.00 12.41 H new ATOM 0 HG12 ILE A 83 -6.215 -1.060 1.707 1.00 22.14 H new ATOM 0 HG13 ILE A 83 -4.715 -0.387 1.102 1.00 22.14 H new ATOM 0 HG21 ILE A 83 -6.419 -3.416 -0.333 1.00 5.22 H new ATOM 0 HG22 ILE A 83 -5.449 -4.605 0.568 1.00 5.22 H new ATOM 0 HG23 ILE A 83 -6.669 -3.626 1.417 1.00 5.22 H new ATOM 0 HD11 ILE A 83 -6.598 0.258 -0.315 1.00 10.03 H new ATOM 0 HD12 ILE A 83 -5.462 -0.771 -1.219 1.00 10.03 H new ATOM 0 HD13 ILE A 83 -6.986 -1.454 -0.605 1.00 10.03 H new ATOM 1387 N MET A 84 -3.762 -5.088 3.043 1.00 34.14 N ATOM 1388 CA MET A 84 -3.192 -6.439 3.072 1.00 40.33 C ATOM 1389 C MET A 84 -4.262 -7.432 2.593 1.00 53.43 C ATOM 1390 O MET A 84 -5.304 -7.574 3.227 1.00 70.43 O ATOM 1391 CB MET A 84 -2.698 -6.741 4.510 1.00 74.35 C ATOM 1392 CG MET A 84 -1.424 -5.974 4.913 1.00 51.13 C ATOM 1393 SD MET A 84 -1.172 -5.893 6.700 1.00 24.25 S ATOM 1394 CE MET A 84 -2.345 -4.619 7.172 1.00 30.41 C ATOM 0 H MET A 84 -4.475 -4.933 3.756 1.00 34.14 H new ATOM 0 HA MET A 84 -2.334 -6.529 2.405 1.00 40.33 H new ATOM 0 HB2 MET A 84 -3.493 -6.498 5.214 1.00 74.35 H new ATOM 0 HB3 MET A 84 -2.509 -7.811 4.600 1.00 74.35 H new ATOM 0 HG2 MET A 84 -0.560 -6.453 4.453 1.00 51.13 H new ATOM 0 HG3 MET A 84 -1.477 -4.961 4.515 1.00 51.13 H new ATOM 0 HE1 MET A 84 -2.818 -4.891 8.116 1.00 30.41 H new ATOM 0 HE2 MET A 84 -1.823 -3.669 7.288 1.00 30.41 H new ATOM 0 HE3 MET A 84 -3.107 -4.522 6.399 1.00 30.41 H new ATOM 1404 N VAL A 85 -3.990 -8.097 1.456 1.00 51.01 N ATOM 1405 CA VAL A 85 -4.940 -8.991 0.774 1.00 41.02 C ATOM 1406 C VAL A 85 -4.358 -10.404 0.680 1.00 52.40 C ATOM 1407 O VAL A 85 -3.202 -10.554 0.275 1.00 62.01 O ATOM 1408 CB VAL A 85 -5.246 -8.527 -0.698 1.00 73.40 C ATOM 1409 CG1 VAL A 85 -6.365 -9.404 -1.322 1.00 1.43 C ATOM 1410 CG2 VAL A 85 -5.573 -7.018 -0.767 1.00 23.04 C ATOM 0 H VAL A 85 -3.091 -8.027 0.979 1.00 51.01 H new ATOM 0 HA VAL A 85 -5.857 -8.968 1.363 1.00 41.02 H new ATOM 0 HB VAL A 85 -4.345 -8.669 -1.295 1.00 73.40 H new ATOM 0 HG11 VAL A 85 -6.564 -9.070 -2.340 1.00 1.43 H new ATOM 0 HG12 VAL A 85 -6.044 -10.446 -1.338 1.00 1.43 H new ATOM 0 HG13 VAL A 85 -7.273 -9.313 -0.726 1.00 1.43 H new ATOM 0 HG21 VAL A 85 -5.778 -6.737 -1.800 1.00 23.04 H new ATOM 0 HG22 VAL A 85 -6.448 -6.807 -0.153 1.00 23.04 H new ATOM 0 HG23 VAL A 85 -4.723 -6.444 -0.397 1.00 23.04 H new ATOM 1420 N ASP A 86 -5.169 -11.404 1.080 1.00 21.14 N ATOM 1421 CA ASP A 86 -4.937 -12.836 0.794 1.00 34.33 C ATOM 1422 C ASP A 86 -6.030 -13.673 1.493 1.00 52.42 C ATOM 1423 O ASP A 86 -6.836 -13.140 2.272 1.00 25.31 O ATOM 1424 CB ASP A 86 -3.513 -13.331 1.245 1.00 13.31 C ATOM 1425 CG ASP A 86 -3.032 -14.542 0.425 1.00 52.40 C ATOM 1426 OD1 ASP A 86 -2.450 -14.342 -0.669 1.00 53.02 O ATOM 1427 OD2 ASP A 86 -3.269 -15.690 0.841 1.00 5.43 O ATOM 0 H ASP A 86 -6.018 -11.237 1.620 1.00 21.14 H new ATOM 0 HA ASP A 86 -4.983 -12.966 -0.287 1.00 34.33 H new ATOM 0 HB2 ASP A 86 -2.797 -12.516 1.140 1.00 13.31 H new ATOM 0 HB3 ASP A 86 -3.541 -13.598 2.302 1.00 13.31 H new ATOM 1432 N GLN A 87 -6.050 -14.990 1.210 1.00 53.32 N ATOM 1433 CA GLN A 87 -6.884 -15.969 1.942 1.00 64.41 C ATOM 1434 C GLN A 87 -6.213 -16.301 3.299 1.00 5.40 C ATOM 1435 O GLN A 87 -6.838 -16.885 4.185 1.00 42.12 O ATOM 1436 CB GLN A 87 -7.084 -17.261 1.089 1.00 63.41 C ATOM 1437 CG GLN A 87 -7.262 -17.021 -0.434 1.00 35.31 C ATOM 1438 CD GLN A 87 -8.382 -16.034 -0.815 1.00 73.20 C ATOM 1439 OE1 GLN A 87 -9.409 -15.924 -0.146 1.00 61.40 O ATOM 1440 NE2 GLN A 87 -8.187 -15.308 -1.910 1.00 10.43 N ATOM 0 H GLN A 87 -5.489 -15.407 0.467 1.00 53.32 H new ATOM 0 HA GLN A 87 -7.868 -15.538 2.129 1.00 64.41 H new ATOM 0 HB2 GLN A 87 -6.225 -17.915 1.240 1.00 63.41 H new ATOM 0 HB3 GLN A 87 -7.959 -17.793 1.462 1.00 63.41 H new ATOM 0 HG2 GLN A 87 -6.320 -16.652 -0.840 1.00 35.31 H new ATOM 0 HG3 GLN A 87 -7.463 -17.978 -0.916 1.00 35.31 H new ATOM 0 HE21 GLN A 87 -7.327 -15.417 -2.448 1.00 10.43 H new ATOM 0 HE22 GLN A 87 -8.897 -14.641 -2.213 1.00 10.43 H new ATOM 1449 N ASP A 88 -4.918 -15.918 3.420 1.00 14.43 N ATOM 1450 CA ASP A 88 -4.136 -15.950 4.668 1.00 61.12 C ATOM 1451 C ASP A 88 -4.292 -14.594 5.400 1.00 53.13 C ATOM 1452 O ASP A 88 -3.330 -14.046 5.940 1.00 74.44 O ATOM 1453 CB ASP A 88 -2.633 -16.247 4.342 1.00 73.42 C ATOM 1454 CG ASP A 88 -2.390 -17.651 3.752 1.00 30.30 C ATOM 1455 OD1 ASP A 88 -2.687 -18.649 4.444 1.00 73.32 O ATOM 1456 OD2 ASP A 88 -1.881 -17.771 2.617 1.00 43.54 O ATOM 0 H ASP A 88 -4.379 -15.570 2.627 1.00 14.43 H new ATOM 0 HA ASP A 88 -4.503 -16.742 5.320 1.00 61.12 H new ATOM 0 HB2 ASP A 88 -2.269 -15.499 3.638 1.00 73.42 H new ATOM 0 HB3 ASP A 88 -2.045 -16.139 5.253 1.00 73.42 H new ATOM 1461 N GLN A 89 -5.551 -14.108 5.442 1.00 0.22 N ATOM 1462 CA GLN A 89 -5.942 -12.800 6.002 1.00 74.34 C ATOM 1463 C GLN A 89 -5.567 -12.679 7.495 1.00 42.21 C ATOM 1464 O GLN A 89 -5.273 -11.579 7.958 1.00 35.43 O ATOM 1465 CB GLN A 89 -7.474 -12.599 5.755 1.00 22.24 C ATOM 1466 CG GLN A 89 -8.082 -11.207 6.124 1.00 53.52 C ATOM 1467 CD GLN A 89 -8.607 -11.093 7.567 1.00 32.13 C ATOM 1468 OE1 GLN A 89 -9.751 -11.446 7.844 1.00 1.21 O ATOM 1469 NE2 GLN A 89 -7.805 -10.576 8.485 1.00 41.22 N ATOM 0 H GLN A 89 -6.346 -14.632 5.076 1.00 0.22 H new ATOM 0 HA GLN A 89 -5.391 -12.005 5.500 1.00 74.34 H new ATOM 0 HB2 GLN A 89 -7.673 -12.785 4.700 1.00 22.24 H new ATOM 0 HB3 GLN A 89 -8.010 -13.362 6.320 1.00 22.24 H new ATOM 0 HG2 GLN A 89 -7.322 -10.441 5.967 1.00 53.52 H new ATOM 0 HG3 GLN A 89 -8.900 -10.990 5.437 1.00 53.52 H new ATOM 0 HE21 GLN A 89 -6.859 -10.290 8.233 1.00 41.22 H new ATOM 0 HE22 GLN A 89 -8.133 -10.464 9.444 1.00 41.22 H new ATOM 1478 N GLU A 90 -5.550 -13.817 8.225 1.00 40.34 N ATOM 1479 CA GLU A 90 -5.192 -13.857 9.662 1.00 74.21 C ATOM 1480 C GLU A 90 -3.689 -13.562 9.881 1.00 40.53 C ATOM 1481 O GLU A 90 -3.326 -12.851 10.822 1.00 14.54 O ATOM 1482 CB GLU A 90 -5.584 -15.218 10.294 1.00 13.23 C ATOM 1483 CG GLU A 90 -7.102 -15.485 10.293 1.00 2.23 C ATOM 1484 CD GLU A 90 -7.503 -16.751 11.060 1.00 11.00 C ATOM 1485 OE1 GLU A 90 -7.651 -17.828 10.438 1.00 32.50 O ATOM 1486 OE2 GLU A 90 -7.669 -16.681 12.298 1.00 34.01 O ATOM 0 H GLU A 90 -5.783 -14.731 7.837 1.00 40.34 H new ATOM 0 HA GLU A 90 -5.759 -13.072 10.163 1.00 74.21 H new ATOM 0 HB2 GLU A 90 -5.082 -16.019 9.751 1.00 13.23 H new ATOM 0 HB3 GLU A 90 -5.218 -15.251 11.320 1.00 13.23 H new ATOM 0 HG2 GLU A 90 -7.614 -14.628 10.731 1.00 2.23 H new ATOM 0 HG3 GLU A 90 -7.447 -15.570 9.262 1.00 2.23 H new ATOM 1493 N GLU A 91 -2.836 -14.093 8.987 1.00 31.33 N ATOM 1494 CA GLU A 91 -1.380 -13.798 8.955 1.00 12.22 C ATOM 1495 C GLU A 91 -1.157 -12.283 8.771 1.00 13.21 C ATOM 1496 O GLU A 91 -0.291 -11.670 9.413 1.00 40.52 O ATOM 1497 CB GLU A 91 -0.722 -14.601 7.797 1.00 33.24 C ATOM 1498 CG GLU A 91 0.764 -14.277 7.506 1.00 55.20 C ATOM 1499 CD GLU A 91 1.363 -15.143 6.384 1.00 61.33 C ATOM 1500 OE1 GLU A 91 2.361 -15.864 6.625 1.00 3.43 O ATOM 1501 OE2 GLU A 91 0.825 -15.121 5.252 1.00 54.41 O ATOM 0 H GLU A 91 -3.133 -14.743 8.259 1.00 31.33 H new ATOM 0 HA GLU A 91 -0.919 -14.097 9.897 1.00 12.22 H new ATOM 0 HB2 GLU A 91 -0.804 -15.664 8.026 1.00 33.24 H new ATOM 0 HB3 GLU A 91 -1.297 -14.426 6.887 1.00 33.24 H new ATOM 0 HG2 GLU A 91 0.853 -13.226 7.232 1.00 55.20 H new ATOM 0 HG3 GLU A 91 1.346 -14.420 8.417 1.00 55.20 H new ATOM 1508 N LEU A 92 -2.015 -11.700 7.922 1.00 12.23 N ATOM 1509 CA LEU A 92 -2.023 -10.267 7.617 1.00 4.22 C ATOM 1510 C LEU A 92 -2.652 -9.454 8.763 1.00 34.55 C ATOM 1511 O LEU A 92 -2.331 -8.286 8.929 1.00 74.55 O ATOM 1512 CB LEU A 92 -2.819 -10.035 6.318 1.00 24.51 C ATOM 1513 CG LEU A 92 -2.357 -10.861 5.081 1.00 42.20 C ATOM 1514 CD1 LEU A 92 -3.378 -10.736 3.944 1.00 1.13 C ATOM 1515 CD2 LEU A 92 -0.936 -10.449 4.628 1.00 34.40 C ATOM 0 H LEU A 92 -2.734 -12.222 7.421 1.00 12.23 H new ATOM 0 HA LEU A 92 -0.993 -9.932 7.494 1.00 4.22 H new ATOM 0 HB2 LEU A 92 -3.867 -10.262 6.512 1.00 24.51 H new ATOM 0 HB3 LEU A 92 -2.764 -8.976 6.065 1.00 24.51 H new ATOM 0 HG LEU A 92 -2.304 -11.911 5.368 1.00 42.20 H new ATOM 0 HD11 LEU A 92 -3.041 -11.319 3.087 1.00 1.13 H new ATOM 0 HD12 LEU A 92 -4.345 -11.111 4.280 1.00 1.13 H new ATOM 0 HD13 LEU A 92 -3.475 -9.689 3.656 1.00 1.13 H new ATOM 0 HD21 LEU A 92 -0.643 -11.044 3.763 1.00 34.40 H new ATOM 0 HD22 LEU A 92 -0.932 -9.392 4.360 1.00 34.40 H new ATOM 0 HD23 LEU A 92 -0.231 -10.620 5.441 1.00 34.40 H new ATOM 1527 N GLU A 93 -3.569 -10.092 9.528 1.00 40.53 N ATOM 1528 CA GLU A 93 -4.284 -9.451 10.656 1.00 23.22 C ATOM 1529 C GLU A 93 -3.319 -9.160 11.818 1.00 42.51 C ATOM 1530 O GLU A 93 -3.531 -8.220 12.594 1.00 31.22 O ATOM 1531 CB GLU A 93 -5.455 -10.344 11.155 1.00 1.15 C ATOM 1532 CG GLU A 93 -6.337 -9.688 12.248 1.00 45.14 C ATOM 1533 CD GLU A 93 -7.296 -10.669 12.938 1.00 11.01 C ATOM 1534 OE1 GLU A 93 -6.924 -11.242 13.982 1.00 60.30 O ATOM 1535 OE2 GLU A 93 -8.419 -10.878 12.439 1.00 42.31 O ATOM 0 H GLU A 93 -3.834 -11.066 9.380 1.00 40.53 H new ATOM 0 HA GLU A 93 -4.695 -8.509 10.293 1.00 23.22 H new ATOM 0 HB2 GLU A 93 -6.085 -10.605 10.305 1.00 1.15 H new ATOM 0 HB3 GLU A 93 -5.045 -11.275 11.546 1.00 1.15 H new ATOM 0 HG2 GLU A 93 -5.691 -9.235 13.000 1.00 45.14 H new ATOM 0 HG3 GLU A 93 -6.917 -8.882 11.799 1.00 45.14 H new ATOM 1542 N ARG A 94 -2.255 -9.974 11.927 1.00 24.15 N ATOM 1543 CA ARG A 94 -1.212 -9.772 12.941 1.00 12.32 C ATOM 1544 C ARG A 94 -0.331 -8.558 12.557 1.00 21.43 C ATOM 1545 O ARG A 94 0.065 -7.768 13.420 1.00 72.41 O ATOM 1546 CB ARG A 94 -0.356 -11.052 13.114 1.00 43.21 C ATOM 1547 CG ARG A 94 0.557 -11.037 14.366 1.00 14.03 C ATOM 1548 CD ARG A 94 -0.252 -10.919 15.680 1.00 13.24 C ATOM 1549 NE ARG A 94 0.617 -10.845 16.868 1.00 15.44 N ATOM 1550 CZ ARG A 94 0.250 -10.356 18.066 1.00 63.11 C ATOM 1551 NH1 ARG A 94 -0.981 -9.874 18.264 1.00 22.32 N ATOM 1552 NH2 ARG A 94 1.125 -10.344 19.060 1.00 61.41 N ATOM 0 H ARG A 94 -2.097 -10.780 11.322 1.00 24.15 H new ATOM 0 HA ARG A 94 -1.688 -9.564 13.899 1.00 12.32 H new ATOM 0 HB2 ARG A 94 -1.019 -11.915 13.171 1.00 43.21 H new ATOM 0 HB3 ARG A 94 0.264 -11.185 12.227 1.00 43.21 H new ATOM 0 HG2 ARG A 94 1.153 -11.949 14.389 1.00 14.03 H new ATOM 0 HG3 ARG A 94 1.254 -10.202 14.295 1.00 14.03 H new ATOM 0 HD2 ARG A 94 -0.882 -10.030 15.638 1.00 13.24 H new ATOM 0 HD3 ARG A 94 -0.918 -11.777 15.772 1.00 13.24 H new ATOM 0 HE ARG A 94 1.572 -11.192 16.774 1.00 15.44 H new ATOM 0 HH11 ARG A 94 -1.657 -9.874 17.501 1.00 22.32 H new ATOM 0 HH12 ARG A 94 -1.244 -9.507 19.179 1.00 22.32 H new ATOM 0 HH21 ARG A 94 2.068 -10.704 18.914 1.00 61.41 H new ATOM 0 HH22 ARG A 94 0.856 -9.975 19.972 1.00 61.41 H new ATOM 1566 N ILE A 95 -0.056 -8.415 11.240 1.00 62.22 N ATOM 1567 CA ILE A 95 0.632 -7.232 10.675 1.00 30.20 C ATOM 1568 C ILE A 95 -0.233 -5.968 10.918 1.00 41.41 C ATOM 1569 O ILE A 95 0.261 -4.912 11.344 1.00 21.24 O ATOM 1570 CB ILE A 95 0.890 -7.392 9.126 1.00 74.01 C ATOM 1571 CG1 ILE A 95 1.521 -8.786 8.788 1.00 1.14 C ATOM 1572 CG2 ILE A 95 1.776 -6.237 8.609 1.00 52.24 C ATOM 1573 CD1 ILE A 95 1.761 -9.044 7.302 1.00 11.12 C ATOM 0 H ILE A 95 -0.304 -9.115 10.541 1.00 62.22 H new ATOM 0 HA ILE A 95 1.597 -7.136 11.173 1.00 30.20 H new ATOM 0 HB ILE A 95 -0.072 -7.344 8.616 1.00 74.01 H new ATOM 0 HG12 ILE A 95 2.471 -8.875 9.315 1.00 1.14 H new ATOM 0 HG13 ILE A 95 0.867 -9.567 9.176 1.00 1.14 H new ATOM 0 HG21 ILE A 95 1.946 -6.360 7.539 1.00 52.24 H new ATOM 0 HG22 ILE A 95 1.276 -5.286 8.790 1.00 52.24 H new ATOM 0 HG23 ILE A 95 2.732 -6.250 9.132 1.00 52.24 H new ATOM 0 HD11 ILE A 95 2.199 -10.033 7.171 1.00 11.12 H new ATOM 0 HD12 ILE A 95 0.813 -8.993 6.766 1.00 11.12 H new ATOM 0 HD13 ILE A 95 2.442 -8.290 6.907 1.00 11.12 H new ATOM 1585 N TYR A 96 -1.550 -6.149 10.667 1.00 71.44 N ATOM 1586 CA TYR A 96 -2.602 -5.144 10.871 1.00 24.35 C ATOM 1587 C TYR A 96 -2.583 -4.614 12.301 1.00 52.30 C ATOM 1588 O TYR A 96 -2.633 -3.411 12.495 1.00 20.12 O ATOM 1589 CB TYR A 96 -3.981 -5.780 10.545 1.00 54.54 C ATOM 1590 CG TYR A 96 -5.221 -4.946 10.901 1.00 5.24 C ATOM 1591 CD1 TYR A 96 -5.713 -3.981 10.029 1.00 53.01 C ATOM 1592 CD2 TYR A 96 -5.903 -5.131 12.117 1.00 34.44 C ATOM 1593 CE1 TYR A 96 -6.832 -3.240 10.346 1.00 33.32 C ATOM 1594 CE2 TYR A 96 -7.022 -4.385 12.434 1.00 53.11 C ATOM 1595 CZ TYR A 96 -7.479 -3.438 11.545 1.00 52.32 C ATOM 1596 OH TYR A 96 -8.598 -2.690 11.841 1.00 15.44 O ATOM 0 H TYR A 96 -1.915 -7.030 10.305 1.00 71.44 H new ATOM 0 HA TYR A 96 -2.422 -4.300 10.205 1.00 24.35 H new ATOM 0 HB2 TYR A 96 -4.012 -5.999 9.478 1.00 54.54 H new ATOM 0 HB3 TYR A 96 -4.049 -6.734 11.068 1.00 54.54 H new ATOM 0 HD1 TYR A 96 -5.211 -3.809 9.088 1.00 53.01 H new ATOM 0 HD2 TYR A 96 -5.545 -5.871 12.817 1.00 34.44 H new ATOM 0 HE1 TYR A 96 -7.202 -2.501 9.651 1.00 33.32 H new ATOM 0 HE2 TYR A 96 -7.534 -4.543 13.372 1.00 53.11 H new ATOM 0 HH TYR A 96 -8.940 -2.948 12.722 1.00 15.44 H new ATOM 1606 N GLU A 97 -2.486 -5.545 13.278 1.00 64.33 N ATOM 1607 CA GLU A 97 -2.532 -5.224 14.712 1.00 4.33 C ATOM 1608 C GLU A 97 -1.404 -4.254 15.107 1.00 34.44 C ATOM 1609 O GLU A 97 -1.621 -3.317 15.887 1.00 50.34 O ATOM 1610 CB GLU A 97 -2.419 -6.517 15.561 1.00 74.31 C ATOM 1611 CG GLU A 97 -2.611 -6.298 17.084 1.00 23.30 C ATOM 1612 CD GLU A 97 -4.034 -5.819 17.448 1.00 23.35 C ATOM 1613 OE1 GLU A 97 -4.909 -6.675 17.702 1.00 23.33 O ATOM 1614 OE2 GLU A 97 -4.286 -4.592 17.470 1.00 53.40 O ATOM 0 H GLU A 97 -2.374 -6.541 13.087 1.00 64.33 H new ATOM 0 HA GLU A 97 -3.489 -4.741 14.908 1.00 4.33 H new ATOM 0 HB2 GLU A 97 -3.163 -7.233 15.212 1.00 74.31 H new ATOM 0 HB3 GLU A 97 -1.440 -6.965 15.391 1.00 74.31 H new ATOM 0 HG2 GLU A 97 -2.401 -7.230 17.609 1.00 23.30 H new ATOM 0 HG3 GLU A 97 -1.885 -5.564 17.435 1.00 23.30 H new ATOM 1621 N GLN A 98 -0.207 -4.503 14.538 1.00 72.30 N ATOM 1622 CA GLN A 98 0.989 -3.685 14.778 1.00 24.51 C ATOM 1623 C GLN A 98 0.779 -2.248 14.273 1.00 72.14 C ATOM 1624 O GLN A 98 0.923 -1.285 15.032 1.00 55.42 O ATOM 1625 CB GLN A 98 2.223 -4.322 14.074 1.00 75.45 C ATOM 1626 CG GLN A 98 3.526 -3.494 14.189 1.00 13.23 C ATOM 1627 CD GLN A 98 3.991 -3.256 15.631 1.00 34.33 C ATOM 1628 OE1 GLN A 98 3.763 -4.072 16.527 1.00 13.11 O ATOM 1629 NE2 GLN A 98 4.672 -2.153 15.866 1.00 34.13 N ATOM 0 H GLN A 98 -0.047 -5.281 13.898 1.00 72.30 H new ATOM 0 HA GLN A 98 1.169 -3.649 15.852 1.00 24.51 H new ATOM 0 HB2 GLN A 98 2.397 -5.311 14.498 1.00 75.45 H new ATOM 0 HB3 GLN A 98 1.990 -4.465 13.019 1.00 75.45 H new ATOM 0 HG2 GLN A 98 4.318 -4.006 13.643 1.00 13.23 H new ATOM 0 HG3 GLN A 98 3.375 -2.530 13.703 1.00 13.23 H new ATOM 0 HE21 GLN A 98 4.849 -1.492 15.110 1.00 34.13 H new ATOM 0 HE22 GLN A 98 5.022 -1.960 16.804 1.00 34.13 H new ATOM 1638 N LEU A 99 0.396 -2.140 12.989 1.00 22.53 N ATOM 1639 CA LEU A 99 0.237 -0.846 12.298 1.00 73.21 C ATOM 1640 C LEU A 99 -0.953 -0.038 12.876 1.00 71.51 C ATOM 1641 O LEU A 99 -0.903 1.193 12.953 1.00 41.04 O ATOM 1642 CB LEU A 99 0.035 -1.097 10.786 1.00 71.31 C ATOM 1643 CG LEU A 99 1.087 -2.021 10.088 1.00 52.32 C ATOM 1644 CD1 LEU A 99 0.701 -2.299 8.619 1.00 63.30 C ATOM 1645 CD2 LEU A 99 2.516 -1.448 10.206 1.00 70.24 C ATOM 0 H LEU A 99 0.188 -2.946 12.400 1.00 22.53 H new ATOM 0 HA LEU A 99 1.139 -0.255 12.454 1.00 73.21 H new ATOM 0 HB2 LEU A 99 -0.953 -1.534 10.641 1.00 71.31 H new ATOM 0 HB3 LEU A 99 0.035 -0.133 10.277 1.00 71.31 H new ATOM 0 HG LEU A 99 1.083 -2.977 10.612 1.00 52.32 H new ATOM 0 HD11 LEU A 99 1.451 -2.944 8.161 1.00 63.30 H new ATOM 0 HD12 LEU A 99 -0.270 -2.792 8.585 1.00 63.30 H new ATOM 0 HD13 LEU A 99 0.649 -1.358 8.072 1.00 63.30 H new ATOM 0 HD21 LEU A 99 3.219 -2.117 9.709 1.00 70.24 H new ATOM 0 HD22 LEU A 99 2.555 -0.466 9.734 1.00 70.24 H new ATOM 0 HD23 LEU A 99 2.785 -1.355 11.258 1.00 70.24 H new ATOM 1657 N LYS A 100 -1.994 -0.771 13.308 1.00 12.41 N ATOM 1658 CA LYS A 100 -3.214 -0.205 13.925 1.00 23.11 C ATOM 1659 C LYS A 100 -2.833 0.432 15.274 1.00 13.22 C ATOM 1660 O LYS A 100 -3.311 1.517 15.620 1.00 55.13 O ATOM 1661 CB LYS A 100 -4.291 -1.341 14.093 1.00 74.32 C ATOM 1662 CG LYS A 100 -5.738 -0.902 14.470 1.00 54.24 C ATOM 1663 CD LYS A 100 -5.925 -0.559 15.969 1.00 41.11 C ATOM 1664 CE LYS A 100 -7.357 -0.117 16.300 1.00 12.52 C ATOM 1665 NZ LYS A 100 -7.821 0.988 15.416 1.00 43.42 N ATOM 0 H LYS A 100 -2.015 -1.788 13.239 1.00 12.41 H new ATOM 0 HA LYS A 100 -3.648 0.568 13.291 1.00 23.11 H new ATOM 0 HB2 LYS A 100 -4.340 -1.900 13.159 1.00 74.32 H new ATOM 0 HB3 LYS A 100 -3.937 -2.031 14.859 1.00 74.32 H new ATOM 0 HG2 LYS A 100 -6.009 -0.032 13.873 1.00 54.24 H new ATOM 0 HG3 LYS A 100 -6.430 -1.701 14.202 1.00 54.24 H new ATOM 0 HD2 LYS A 100 -5.669 -1.430 16.572 1.00 41.11 H new ATOM 0 HD3 LYS A 100 -5.231 0.235 16.246 1.00 41.11 H new ATOM 0 HE2 LYS A 100 -8.031 -0.968 16.200 1.00 12.52 H new ATOM 0 HE3 LYS A 100 -7.405 0.207 17.340 1.00 12.52 H new ATOM 0 HZ1 LYS A 100 -8.701 1.391 15.797 1.00 43.42 H new ATOM 0 HZ2 LYS A 100 -7.091 1.728 15.373 1.00 43.42 H new ATOM 0 HZ3 LYS A 100 -7.996 0.618 14.460 1.00 43.42 H new ATOM 1679 N LYS A 101 -1.950 -0.267 16.012 1.00 2.13 N ATOM 1680 CA LYS A 101 -1.417 0.192 17.307 1.00 14.13 C ATOM 1681 C LYS A 101 -0.622 1.508 17.150 1.00 23.34 C ATOM 1682 O LYS A 101 -0.741 2.408 17.987 1.00 20.44 O ATOM 1683 CB LYS A 101 -0.533 -0.918 17.933 1.00 30.34 C ATOM 1684 CG LYS A 101 -0.021 -0.612 19.360 1.00 32.15 C ATOM 1685 CD LYS A 101 0.906 -1.723 19.907 1.00 43.11 C ATOM 1686 CE LYS A 101 0.226 -3.099 19.983 1.00 53.35 C ATOM 1687 NZ LYS A 101 1.143 -4.138 20.510 1.00 64.04 N ATOM 0 H LYS A 101 -1.584 -1.174 15.723 1.00 2.13 H new ATOM 0 HA LYS A 101 -2.254 0.395 17.975 1.00 14.13 H new ATOM 0 HB2 LYS A 101 -1.104 -1.846 17.958 1.00 30.34 H new ATOM 0 HB3 LYS A 101 0.325 -1.089 17.283 1.00 30.34 H new ATOM 0 HG2 LYS A 101 0.517 0.336 19.354 1.00 32.15 H new ATOM 0 HG3 LYS A 101 -0.872 -0.491 20.030 1.00 32.15 H new ATOM 0 HD2 LYS A 101 1.788 -1.796 19.271 1.00 43.11 H new ATOM 0 HD3 LYS A 101 1.252 -1.441 20.901 1.00 43.11 H new ATOM 0 HE2 LYS A 101 -0.655 -3.034 20.621 1.00 53.35 H new ATOM 0 HE3 LYS A 101 -0.120 -3.389 18.991 1.00 53.35 H new ATOM 0 HZ1 LYS A 101 0.648 -5.052 20.546 1.00 64.04 H new ATOM 0 HZ2 LYS A 101 1.972 -4.218 19.887 1.00 64.04 H new ATOM 0 HZ3 LYS A 101 1.453 -3.874 21.467 1.00 64.04 H new ATOM 1701 N ASP A 102 0.159 1.618 16.053 1.00 61.41 N ATOM 1702 CA ASP A 102 0.896 2.863 15.701 1.00 10.22 C ATOM 1703 C ASP A 102 -0.063 4.007 15.304 1.00 13.41 C ATOM 1704 O ASP A 102 0.332 5.180 15.307 1.00 25.23 O ATOM 1705 CB ASP A 102 1.900 2.603 14.543 1.00 21.13 C ATOM 1706 CG ASP A 102 3.102 1.750 14.970 1.00 51.11 C ATOM 1707 OD1 ASP A 102 4.034 2.301 15.593 1.00 21.24 O ATOM 1708 OD2 ASP A 102 3.132 0.537 14.677 1.00 21.04 O ATOM 0 H ASP A 102 0.299 0.857 15.389 1.00 61.41 H new ATOM 0 HA ASP A 102 1.443 3.169 16.593 1.00 10.22 H new ATOM 0 HB2 ASP A 102 1.381 2.105 13.725 1.00 21.13 H new ATOM 0 HB3 ASP A 102 2.258 3.558 14.159 1.00 21.13 H new ATOM 1713 N GLY A 103 -1.312 3.651 14.958 1.00 13.02 N ATOM 1714 CA GLY A 103 -2.322 4.624 14.538 1.00 41.23 C ATOM 1715 C GLY A 103 -2.234 4.948 13.058 1.00 25.40 C ATOM 1716 O GLY A 103 -2.600 6.048 12.636 1.00 42.25 O ATOM 0 H GLY A 103 -1.643 2.686 14.963 1.00 13.02 H new ATOM 0 HA2 GLY A 103 -3.314 4.233 14.763 1.00 41.23 H new ATOM 0 HA3 GLY A 103 -2.202 5.541 15.115 1.00 41.23 H new ATOM 1720 N VAL A 104 -1.713 3.988 12.282 1.00 33.41 N ATOM 1721 CA VAL A 104 -1.660 4.064 10.814 1.00 51.31 C ATOM 1722 C VAL A 104 -3.018 3.603 10.263 1.00 5.12 C ATOM 1723 O VAL A 104 -3.614 2.658 10.815 1.00 13.43 O ATOM 1724 CB VAL A 104 -0.511 3.150 10.230 1.00 11.24 C ATOM 1725 CG1 VAL A 104 -0.308 3.382 8.714 1.00 12.32 C ATOM 1726 CG2 VAL A 104 0.809 3.341 11.010 1.00 54.25 C ATOM 0 H VAL A 104 -1.313 3.129 12.658 1.00 33.41 H new ATOM 0 HA VAL A 104 -1.447 5.091 10.516 1.00 51.31 H new ATOM 0 HB VAL A 104 -0.825 2.114 10.358 1.00 11.24 H new ATOM 0 HG11 VAL A 104 0.490 2.735 8.351 1.00 12.32 H new ATOM 0 HG12 VAL A 104 -1.232 3.151 8.184 1.00 12.32 H new ATOM 0 HG13 VAL A 104 -0.039 4.424 8.538 1.00 12.32 H new ATOM 0 HG21 VAL A 104 1.580 2.699 10.584 1.00 54.25 H new ATOM 0 HG22 VAL A 104 1.125 4.382 10.941 1.00 54.25 H new ATOM 0 HG23 VAL A 104 0.655 3.078 12.056 1.00 54.25 H new ATOM 1736 N ASP A 105 -3.510 4.257 9.190 1.00 71.34 N ATOM 1737 CA ASP A 105 -4.803 3.895 8.598 1.00 52.11 C ATOM 1738 C ASP A 105 -4.604 2.631 7.747 1.00 22.43 C ATOM 1739 O ASP A 105 -4.067 2.685 6.628 1.00 23.22 O ATOM 1740 CB ASP A 105 -5.350 5.063 7.739 1.00 2.32 C ATOM 1741 CG ASP A 105 -6.849 4.961 7.430 1.00 13.13 C ATOM 1742 OD1 ASP A 105 -7.258 5.266 6.292 1.00 73.42 O ATOM 1743 OD2 ASP A 105 -7.633 4.562 8.316 1.00 73.23 O ATOM 0 H ASP A 105 -3.033 5.029 8.724 1.00 71.34 H new ATOM 0 HA ASP A 105 -5.534 3.697 9.382 1.00 52.11 H new ATOM 0 HB2 ASP A 105 -5.160 6.002 8.258 1.00 2.32 H new ATOM 0 HB3 ASP A 105 -4.798 5.100 6.800 1.00 2.32 H new ATOM 1748 N VAL A 106 -5.032 1.489 8.305 1.00 2.23 N ATOM 1749 CA VAL A 106 -4.731 0.152 7.758 1.00 23.10 C ATOM 1750 C VAL A 106 -5.970 -0.741 7.755 1.00 53.11 C ATOM 1751 O VAL A 106 -6.911 -0.525 8.528 1.00 74.24 O ATOM 1752 CB VAL A 106 -3.561 -0.561 8.541 1.00 70.45 C ATOM 1753 CG1 VAL A 106 -2.246 0.226 8.397 1.00 74.44 C ATOM 1754 CG2 VAL A 106 -3.906 -0.783 10.039 1.00 41.11 C ATOM 0 H VAL A 106 -5.599 1.464 9.152 1.00 2.23 H new ATOM 0 HA VAL A 106 -4.405 0.307 6.729 1.00 23.10 H new ATOM 0 HB VAL A 106 -3.430 -1.545 8.091 1.00 70.45 H new ATOM 0 HG11 VAL A 106 -1.454 -0.285 8.945 1.00 74.44 H new ATOM 0 HG12 VAL A 106 -1.974 0.291 7.343 1.00 74.44 H new ATOM 0 HG13 VAL A 106 -2.377 1.230 8.800 1.00 74.44 H new ATOM 0 HG21 VAL A 106 -3.071 -1.277 10.536 1.00 41.11 H new ATOM 0 HG22 VAL A 106 -4.094 0.179 10.515 1.00 41.11 H new ATOM 0 HG23 VAL A 106 -4.796 -1.408 10.119 1.00 41.11 H new ATOM 1764 N ARG A 107 -5.958 -1.723 6.841 1.00 51.42 N ATOM 1765 CA ARG A 107 -7.034 -2.701 6.666 1.00 75.44 C ATOM 1766 C ARG A 107 -6.479 -4.007 6.091 1.00 63.22 C ATOM 1767 O ARG A 107 -5.420 -4.037 5.443 1.00 45.03 O ATOM 1768 CB ARG A 107 -8.183 -2.169 5.758 1.00 74.33 C ATOM 1769 CG ARG A 107 -7.768 -1.661 4.350 1.00 11.42 C ATOM 1770 CD ARG A 107 -7.142 -0.263 4.393 1.00 75.35 C ATOM 1771 NE ARG A 107 -8.015 0.677 5.119 1.00 32.23 N ATOM 1772 CZ ARG A 107 -7.733 1.944 5.424 1.00 11.10 C ATOM 1773 NH1 ARG A 107 -6.582 2.507 5.068 1.00 5.24 N ATOM 1774 NH2 ARG A 107 -8.618 2.647 6.109 1.00 64.33 N ATOM 0 H ARG A 107 -5.183 -1.859 6.192 1.00 51.42 H new ATOM 0 HA ARG A 107 -7.457 -2.885 7.653 1.00 75.44 H new ATOM 0 HB2 ARG A 107 -8.916 -2.966 5.632 1.00 74.33 H new ATOM 0 HB3 ARG A 107 -8.684 -1.355 6.282 1.00 74.33 H new ATOM 0 HG2 ARG A 107 -7.058 -2.361 3.909 1.00 11.42 H new ATOM 0 HG3 ARG A 107 -8.643 -1.644 3.701 1.00 11.42 H new ATOM 0 HD2 ARG A 107 -6.167 -0.310 4.878 1.00 75.35 H new ATOM 0 HD3 ARG A 107 -6.975 0.098 3.378 1.00 75.35 H new ATOM 0 HE ARG A 107 -8.924 0.324 5.417 1.00 32.23 H new ATOM 0 HH11 ARG A 107 -5.889 1.967 4.549 1.00 5.24 H new ATOM 0 HH12 ARG A 107 -6.392 3.478 5.314 1.00 5.24 H new ATOM 0 HH21 ARG A 107 -9.499 2.219 6.395 1.00 64.33 H new ATOM 0 HH22 ARG A 107 -8.420 3.618 6.352 1.00 64.33 H new ATOM 1788 N VAL A 108 -7.225 -5.079 6.352 1.00 3.41 N ATOM 1789 CA VAL A 108 -6.980 -6.423 5.819 1.00 15.33 C ATOM 1790 C VAL A 108 -8.254 -6.917 5.131 1.00 42.01 C ATOM 1791 O VAL A 108 -9.368 -6.560 5.546 1.00 4.32 O ATOM 1792 CB VAL A 108 -6.559 -7.437 6.955 1.00 3.34 C ATOM 1793 CG1 VAL A 108 -5.098 -7.218 7.377 1.00 51.55 C ATOM 1794 CG2 VAL A 108 -7.500 -7.327 8.184 1.00 21.42 C ATOM 0 H VAL A 108 -8.043 -5.037 6.959 1.00 3.41 H new ATOM 0 HA VAL A 108 -6.156 -6.369 5.108 1.00 15.33 H new ATOM 0 HB VAL A 108 -6.651 -8.443 6.546 1.00 3.34 H new ATOM 0 HG11 VAL A 108 -4.835 -7.929 8.160 1.00 51.55 H new ATOM 0 HG12 VAL A 108 -4.445 -7.367 6.517 1.00 51.55 H new ATOM 0 HG13 VAL A 108 -4.976 -6.202 7.754 1.00 51.55 H new ATOM 0 HG21 VAL A 108 -7.185 -8.037 8.948 1.00 21.42 H new ATOM 0 HG22 VAL A 108 -7.455 -6.315 8.588 1.00 21.42 H new ATOM 0 HG23 VAL A 108 -8.523 -7.551 7.880 1.00 21.42 H new ATOM 1804 N THR A 109 -8.094 -7.716 4.070 1.00 54.23 N ATOM 1805 CA THR A 109 -9.223 -8.310 3.363 1.00 34.04 C ATOM 1806 C THR A 109 -8.851 -9.681 2.788 1.00 54.12 C ATOM 1807 O THR A 109 -7.673 -10.009 2.586 1.00 40.34 O ATOM 1808 CB THR A 109 -9.759 -7.380 2.206 1.00 40.24 C ATOM 1809 OG1 THR A 109 -11.067 -7.812 1.795 1.00 34.41 O ATOM 1810 CG2 THR A 109 -8.841 -7.358 0.970 1.00 54.33 C ATOM 0 H THR A 109 -7.184 -7.965 3.683 1.00 54.23 H new ATOM 0 HA THR A 109 -10.020 -8.430 4.097 1.00 34.04 H new ATOM 0 HB THR A 109 -9.789 -6.370 2.616 1.00 40.24 H new ATOM 0 HG1 THR A 109 -11.016 -8.203 0.898 1.00 34.41 H new ATOM 0 HG21 THR A 109 -9.267 -6.700 0.212 1.00 54.33 H new ATOM 0 HG22 THR A 109 -7.855 -6.992 1.256 1.00 54.33 H new ATOM 0 HG23 THR A 109 -8.751 -8.366 0.566 1.00 54.33 H new ATOM 1818 N ASP A 110 -9.897 -10.455 2.547 1.00 23.54 N ATOM 1819 CA ASP A 110 -9.859 -11.694 1.781 1.00 74.15 C ATOM 1820 C ASP A 110 -10.618 -11.457 0.467 1.00 4.05 C ATOM 1821 O ASP A 110 -11.546 -10.633 0.431 1.00 41.31 O ATOM 1822 CB ASP A 110 -10.484 -12.856 2.605 1.00 1.13 C ATOM 1823 CG ASP A 110 -11.877 -12.514 3.185 1.00 21.12 C ATOM 1824 OD1 ASP A 110 -11.942 -11.810 4.212 1.00 4.13 O ATOM 1825 OD2 ASP A 110 -12.905 -12.925 2.619 1.00 63.01 O ATOM 0 H ASP A 110 -10.831 -10.231 2.891 1.00 23.54 H new ATOM 0 HA ASP A 110 -8.831 -11.981 1.558 1.00 74.15 H new ATOM 0 HB2 ASP A 110 -10.569 -13.738 1.970 1.00 1.13 H new ATOM 0 HB3 ASP A 110 -9.811 -13.115 3.422 1.00 1.13 H new ATOM 1830 N ASN A 111 -10.149 -12.143 -0.595 1.00 51.50 N ATOM 1831 CA ASN A 111 -10.739 -12.167 -1.967 1.00 41.01 C ATOM 1832 C ASN A 111 -10.159 -11.030 -2.824 1.00 64.13 C ATOM 1833 O ASN A 111 -10.017 -9.896 -2.359 1.00 10.42 O ATOM 1834 CB ASN A 111 -12.309 -12.149 -2.018 1.00 62.42 C ATOM 1835 CG ASN A 111 -12.956 -13.419 -1.453 1.00 63.10 C ATOM 1836 OD1 ASN A 111 -13.182 -14.392 -2.173 1.00 30.33 O ATOM 1837 ND2 ASN A 111 -13.274 -13.420 -0.171 1.00 12.23 N ATOM 0 H ASN A 111 -9.313 -12.723 -0.527 1.00 51.50 H new ATOM 0 HA ASN A 111 -10.453 -13.134 -2.381 1.00 41.01 H new ATOM 0 HB2 ASN A 111 -12.672 -11.287 -1.459 1.00 62.42 H new ATOM 0 HB3 ASN A 111 -12.629 -12.017 -3.052 1.00 62.42 H new ATOM 0 HD21 ASN A 111 -13.717 -14.240 0.244 1.00 12.23 H new ATOM 0 HD22 ASN A 111 -13.076 -12.601 0.404 1.00 12.23 H new ATOM 1844 N GLU A 112 -9.839 -11.377 -4.080 1.00 61.13 N ATOM 1845 CA GLU A 112 -9.240 -10.471 -5.073 1.00 73.02 C ATOM 1846 C GLU A 112 -10.247 -9.410 -5.538 1.00 24.41 C ATOM 1847 O GLU A 112 -9.902 -8.232 -5.622 1.00 61.33 O ATOM 1848 CB GLU A 112 -8.744 -11.302 -6.278 1.00 40.34 C ATOM 1849 CG GLU A 112 -8.096 -10.489 -7.419 1.00 44.32 C ATOM 1850 CD GLU A 112 -7.810 -11.357 -8.648 1.00 61.22 C ATOM 1851 OE1 GLU A 112 -8.723 -11.524 -9.488 1.00 21.45 O ATOM 1852 OE2 GLU A 112 -6.689 -11.883 -8.775 1.00 25.42 O ATOM 0 H GLU A 112 -9.993 -12.318 -4.442 1.00 61.13 H new ATOM 0 HA GLU A 112 -8.401 -9.949 -4.612 1.00 73.02 H new ATOM 0 HB2 GLU A 112 -8.021 -12.034 -5.920 1.00 40.34 H new ATOM 0 HB3 GLU A 112 -9.587 -11.860 -6.685 1.00 40.34 H new ATOM 0 HG2 GLU A 112 -8.756 -9.668 -7.700 1.00 44.32 H new ATOM 0 HG3 GLU A 112 -7.166 -10.044 -7.065 1.00 44.32 H new ATOM 1859 N ASP A 113 -11.500 -9.838 -5.807 1.00 52.03 N ATOM 1860 CA ASP A 113 -12.583 -8.940 -6.275 1.00 3.24 C ATOM 1861 C ASP A 113 -12.881 -7.879 -5.204 1.00 13.22 C ATOM 1862 O ASP A 113 -13.056 -6.700 -5.516 1.00 25.41 O ATOM 1863 CB ASP A 113 -13.875 -9.743 -6.616 1.00 10.33 C ATOM 1864 CG ASP A 113 -14.514 -10.430 -5.387 1.00 70.14 C ATOM 1865 OD1 ASP A 113 -15.516 -9.919 -4.834 1.00 3.02 O ATOM 1866 OD2 ASP A 113 -13.983 -11.468 -4.946 1.00 32.21 O ATOM 0 H ASP A 113 -11.790 -10.811 -5.707 1.00 52.03 H new ATOM 0 HA ASP A 113 -12.247 -8.446 -7.187 1.00 3.24 H new ATOM 0 HB2 ASP A 113 -14.604 -9.069 -7.066 1.00 10.33 H new ATOM 0 HB3 ASP A 113 -13.637 -10.500 -7.363 1.00 10.33 H new ATOM 1871 N GLU A 114 -12.884 -8.340 -3.935 1.00 31.12 N ATOM 1872 CA GLU A 114 -13.115 -7.514 -2.750 1.00 23.22 C ATOM 1873 C GLU A 114 -11.962 -6.516 -2.559 1.00 51.44 C ATOM 1874 O GLU A 114 -12.190 -5.348 -2.240 1.00 11.11 O ATOM 1875 CB GLU A 114 -13.262 -8.436 -1.512 1.00 22.33 C ATOM 1876 CG GLU A 114 -13.555 -7.712 -0.180 1.00 33.02 C ATOM 1877 CD GLU A 114 -14.844 -6.872 -0.191 1.00 0.12 C ATOM 1878 OE1 GLU A 114 -15.925 -7.427 -0.482 1.00 34.25 O ATOM 1879 OE2 GLU A 114 -14.784 -5.663 0.109 1.00 21.42 O ATOM 0 H GLU A 114 -12.721 -9.321 -3.710 1.00 31.12 H new ATOM 0 HA GLU A 114 -14.032 -6.939 -2.877 1.00 23.22 H new ATOM 0 HB2 GLU A 114 -14.065 -9.148 -1.703 1.00 22.33 H new ATOM 0 HB3 GLU A 114 -12.344 -9.013 -1.398 1.00 22.33 H new ATOM 0 HG2 GLU A 114 -13.624 -8.453 0.616 1.00 33.02 H new ATOM 0 HG3 GLU A 114 -12.713 -7.063 0.061 1.00 33.02 H new ATOM 1886 N ALA A 115 -10.732 -7.005 -2.795 1.00 32.11 N ATOM 1887 CA ALA A 115 -9.504 -6.204 -2.722 1.00 73.51 C ATOM 1888 C ALA A 115 -9.547 -5.024 -3.687 1.00 3.22 C ATOM 1889 O ALA A 115 -9.142 -3.923 -3.335 1.00 75.45 O ATOM 1890 CB ALA A 115 -8.304 -7.078 -3.055 1.00 22.43 C ATOM 0 H ALA A 115 -10.564 -7.980 -3.045 1.00 32.11 H new ATOM 0 HA ALA A 115 -9.418 -5.814 -1.708 1.00 73.51 H new ATOM 0 HB1 ALA A 115 -7.393 -6.482 -3.000 1.00 22.43 H new ATOM 0 HB2 ALA A 115 -8.243 -7.900 -2.341 1.00 22.43 H new ATOM 0 HB3 ALA A 115 -8.415 -7.480 -4.062 1.00 22.43 H new ATOM 1896 N LYS A 116 -10.048 -5.297 -4.906 1.00 33.33 N ATOM 1897 CA LYS A 116 -10.141 -4.316 -5.998 1.00 4.25 C ATOM 1898 C LYS A 116 -11.155 -3.209 -5.684 1.00 42.34 C ATOM 1899 O LYS A 116 -11.044 -2.097 -6.213 1.00 72.24 O ATOM 1900 CB LYS A 116 -10.492 -5.051 -7.318 1.00 34.51 C ATOM 1901 CG LYS A 116 -9.370 -6.008 -7.805 1.00 25.35 C ATOM 1902 CD LYS A 116 -9.791 -6.873 -9.009 1.00 31.01 C ATOM 1903 CE LYS A 116 -10.106 -6.044 -10.264 1.00 11.24 C ATOM 1904 NZ LYS A 116 -10.607 -6.897 -11.371 1.00 61.55 N ATOM 0 H LYS A 116 -10.404 -6.218 -5.161 1.00 33.33 H new ATOM 0 HA LYS A 116 -9.175 -3.825 -6.111 1.00 4.25 H new ATOM 0 HB2 LYS A 116 -11.410 -5.621 -7.175 1.00 34.51 H new ATOM 0 HB3 LYS A 116 -10.693 -4.313 -8.094 1.00 34.51 H new ATOM 0 HG2 LYS A 116 -8.493 -5.421 -8.077 1.00 25.35 H new ATOM 0 HG3 LYS A 116 -9.075 -6.660 -6.983 1.00 25.35 H new ATOM 0 HD2 LYS A 116 -8.993 -7.580 -9.238 1.00 31.01 H new ATOM 0 HD3 LYS A 116 -10.669 -7.460 -8.738 1.00 31.01 H new ATOM 0 HE2 LYS A 116 -10.851 -5.286 -10.022 1.00 11.24 H new ATOM 0 HE3 LYS A 116 -9.208 -5.517 -10.588 1.00 11.24 H new ATOM 0 HZ1 LYS A 116 -10.761 -6.312 -12.217 1.00 61.55 H new ATOM 0 HZ2 LYS A 116 -9.907 -7.636 -11.584 1.00 61.55 H new ATOM 0 HZ3 LYS A 116 -11.504 -7.341 -11.089 1.00 61.55 H new ATOM 1918 N LYS A 117 -12.132 -3.520 -4.808 1.00 13.41 N ATOM 1919 CA LYS A 117 -13.104 -2.531 -4.326 1.00 33.01 C ATOM 1920 C LYS A 117 -12.421 -1.618 -3.295 1.00 11.14 C ATOM 1921 O LYS A 117 -12.457 -0.397 -3.435 1.00 33.31 O ATOM 1922 CB LYS A 117 -14.355 -3.228 -3.709 1.00 41.04 C ATOM 1923 CG LYS A 117 -14.997 -4.318 -4.599 1.00 5.54 C ATOM 1924 CD LYS A 117 -15.301 -3.857 -6.050 1.00 4.42 C ATOM 1925 CE LYS A 117 -15.852 -5.001 -6.926 1.00 63.43 C ATOM 1926 NZ LYS A 117 -16.009 -4.582 -8.347 1.00 52.30 N ATOM 0 H LYS A 117 -12.265 -4.454 -4.421 1.00 13.41 H new ATOM 0 HA LYS A 117 -13.451 -1.931 -5.167 1.00 33.01 H new ATOM 0 HB2 LYS A 117 -14.070 -3.677 -2.758 1.00 41.04 H new ATOM 0 HB3 LYS A 117 -15.106 -2.468 -3.491 1.00 41.04 H new ATOM 0 HG2 LYS A 117 -14.331 -5.180 -4.636 1.00 5.54 H new ATOM 0 HG3 LYS A 117 -15.925 -4.651 -4.134 1.00 5.54 H new ATOM 0 HD2 LYS A 117 -16.023 -3.041 -6.026 1.00 4.42 H new ATOM 0 HD3 LYS A 117 -14.391 -3.463 -6.502 1.00 4.42 H new ATOM 0 HE2 LYS A 117 -15.179 -5.857 -6.871 1.00 63.43 H new ATOM 0 HE3 LYS A 117 -16.816 -5.327 -6.534 1.00 63.43 H new ATOM 0 HZ1 LYS A 117 -16.381 -5.377 -8.904 1.00 52.30 H new ATOM 0 HZ2 LYS A 117 -16.670 -3.781 -8.402 1.00 52.30 H new ATOM 0 HZ3 LYS A 117 -15.085 -4.295 -8.728 1.00 52.30 H new ATOM 1940 N ARG A 118 -11.728 -2.244 -2.307 1.00 62.13 N ATOM 1941 CA ARG A 118 -11.075 -1.526 -1.177 1.00 61.11 C ATOM 1942 C ARG A 118 -9.876 -0.687 -1.655 1.00 63.43 C ATOM 1943 O ARG A 118 -9.541 0.344 -1.048 1.00 31.10 O ATOM 1944 CB ARG A 118 -10.615 -2.528 -0.071 1.00 44.40 C ATOM 1945 CG ARG A 118 -11.697 -3.536 0.377 1.00 51.44 C ATOM 1946 CD ARG A 118 -13.021 -2.874 0.803 1.00 54.31 C ATOM 1947 NE ARG A 118 -12.910 -2.163 2.090 1.00 51.14 N ATOM 1948 CZ ARG A 118 -13.693 -1.147 2.482 1.00 72.32 C ATOM 1949 NH1 ARG A 118 -14.660 -0.680 1.698 1.00 31.54 N ATOM 1950 NH2 ARG A 118 -13.535 -0.633 3.690 1.00 75.11 N ATOM 0 H ARG A 118 -11.606 -3.256 -2.270 1.00 62.13 H new ATOM 0 HA ARG A 118 -11.818 -0.849 -0.755 1.00 61.11 H new ATOM 0 HB2 ARG A 118 -9.751 -3.082 -0.438 1.00 44.40 H new ATOM 0 HB3 ARG A 118 -10.284 -1.961 0.799 1.00 44.40 H new ATOM 0 HG2 ARG A 118 -11.894 -4.230 -0.440 1.00 51.44 H new ATOM 0 HG3 ARG A 118 -11.311 -4.124 1.209 1.00 51.44 H new ATOM 0 HD2 ARG A 118 -13.338 -2.173 0.031 1.00 54.31 H new ATOM 0 HD3 ARG A 118 -13.796 -3.636 0.879 1.00 54.31 H new ATOM 0 HE ARG A 118 -12.180 -2.468 2.733 1.00 51.14 H new ATOM 0 HH11 ARG A 118 -14.817 -1.095 0.780 1.00 31.54 H new ATOM 0 HH12 ARG A 118 -15.245 0.093 2.015 1.00 31.54 H new ATOM 0 HH21 ARG A 118 -12.822 -1.009 4.315 1.00 75.11 H new ATOM 0 HH22 ARG A 118 -14.126 0.140 3.997 1.00 75.11 H new ATOM 1964 N LEU A 119 -9.249 -1.153 -2.752 1.00 41.14 N ATOM 1965 CA LEU A 119 -8.126 -0.473 -3.407 1.00 55.34 C ATOM 1966 C LEU A 119 -8.629 0.858 -3.969 1.00 34.20 C ATOM 1967 O LEU A 119 -8.021 1.914 -3.745 1.00 42.45 O ATOM 1968 CB LEU A 119 -7.527 -1.391 -4.532 1.00 65.21 C ATOM 1969 CG LEU A 119 -6.067 -1.087 -5.033 1.00 11.23 C ATOM 1970 CD1 LEU A 119 -5.950 0.243 -5.795 1.00 11.52 C ATOM 1971 CD2 LEU A 119 -5.055 -1.152 -3.869 1.00 3.42 C ATOM 0 H LEU A 119 -9.515 -2.024 -3.211 1.00 41.14 H new ATOM 0 HA LEU A 119 -7.327 -0.274 -2.693 1.00 55.34 H new ATOM 0 HB2 LEU A 119 -7.549 -2.419 -4.171 1.00 65.21 H new ATOM 0 HB3 LEU A 119 -8.193 -1.341 -5.393 1.00 65.21 H new ATOM 0 HG LEU A 119 -5.823 -1.870 -5.750 1.00 11.23 H new ATOM 0 HD11 LEU A 119 -4.918 0.391 -6.112 1.00 11.52 H new ATOM 0 HD12 LEU A 119 -6.599 0.219 -6.671 1.00 11.52 H new ATOM 0 HD13 LEU A 119 -6.250 1.063 -5.143 1.00 11.52 H new ATOM 0 HD21 LEU A 119 -4.054 -0.938 -4.244 1.00 3.42 H new ATOM 0 HD22 LEU A 119 -5.324 -0.416 -3.112 1.00 3.42 H new ATOM 0 HD23 LEU A 119 -5.071 -2.149 -3.428 1.00 3.42 H new ATOM 1983 N LYS A 120 -9.779 0.777 -4.663 1.00 31.15 N ATOM 1984 CA LYS A 120 -10.429 1.937 -5.261 1.00 12.43 C ATOM 1985 C LYS A 120 -10.911 2.909 -4.174 1.00 44.43 C ATOM 1986 O LYS A 120 -10.795 4.110 -4.356 1.00 32.42 O ATOM 1987 CB LYS A 120 -11.614 1.498 -6.146 1.00 43.53 C ATOM 1988 CG LYS A 120 -12.265 2.657 -6.942 1.00 32.42 C ATOM 1989 CD LYS A 120 -13.511 2.219 -7.745 1.00 44.33 C ATOM 1990 CE LYS A 120 -14.627 1.637 -6.848 1.00 13.40 C ATOM 1991 NZ LYS A 120 -15.079 2.592 -5.797 1.00 40.35 N ATOM 0 H LYS A 120 -10.277 -0.099 -4.820 1.00 31.15 H new ATOM 0 HA LYS A 120 -9.699 2.451 -5.886 1.00 12.43 H new ATOM 0 HB2 LYS A 120 -11.269 0.737 -6.847 1.00 43.53 H new ATOM 0 HB3 LYS A 120 -12.372 1.032 -5.517 1.00 43.53 H new ATOM 0 HG2 LYS A 120 -12.547 3.451 -6.250 1.00 32.42 H new ATOM 0 HG3 LYS A 120 -11.529 3.078 -7.627 1.00 32.42 H new ATOM 0 HD2 LYS A 120 -13.902 3.075 -8.295 1.00 44.33 H new ATOM 0 HD3 LYS A 120 -13.218 1.472 -8.483 1.00 44.33 H new ATOM 0 HE2 LYS A 120 -15.478 1.358 -7.469 1.00 13.40 H new ATOM 0 HE3 LYS A 120 -14.266 0.725 -6.373 1.00 13.40 H new ATOM 0 HZ1 LYS A 120 -14.998 2.143 -4.862 1.00 40.35 H new ATOM 0 HZ2 LYS A 120 -14.485 3.445 -5.824 1.00 40.35 H new ATOM 0 HZ3 LYS A 120 -16.070 2.855 -5.970 1.00 40.35 H new ATOM 2005 N GLU A 121 -11.413 2.364 -3.033 1.00 63.24 N ATOM 2006 CA GLU A 121 -11.939 3.181 -1.915 1.00 14.50 C ATOM 2007 C GLU A 121 -10.891 4.184 -1.401 1.00 12.22 C ATOM 2008 O GLU A 121 -11.199 5.364 -1.190 1.00 3.23 O ATOM 2009 CB GLU A 121 -12.444 2.291 -0.743 1.00 5.20 C ATOM 2010 CG GLU A 121 -13.639 1.375 -1.086 1.00 52.20 C ATOM 2011 CD GLU A 121 -14.830 2.124 -1.717 1.00 71.22 C ATOM 2012 OE1 GLU A 121 -15.032 2.030 -2.949 1.00 30.33 O ATOM 2013 OE2 GLU A 121 -15.558 2.827 -0.983 1.00 10.55 O ATOM 0 H GLU A 121 -11.463 1.359 -2.867 1.00 63.24 H new ATOM 0 HA GLU A 121 -12.785 3.742 -2.311 1.00 14.50 H new ATOM 0 HB2 GLU A 121 -11.618 1.670 -0.396 1.00 5.20 H new ATOM 0 HB3 GLU A 121 -12.728 2.937 0.088 1.00 5.20 H new ATOM 0 HG2 GLU A 121 -13.305 0.597 -1.773 1.00 52.20 H new ATOM 0 HG3 GLU A 121 -13.975 0.875 -0.178 1.00 52.20 H new ATOM 2020 N LEU A 122 -9.641 3.708 -1.238 1.00 73.13 N ATOM 2021 CA LEU A 122 -8.529 4.552 -0.771 1.00 34.44 C ATOM 2022 C LEU A 122 -8.003 5.448 -1.895 1.00 2.32 C ATOM 2023 O LEU A 122 -7.596 6.574 -1.630 1.00 31.34 O ATOM 2024 CB LEU A 122 -7.383 3.702 -0.182 1.00 43.30 C ATOM 2025 CG LEU A 122 -7.759 2.832 1.056 1.00 74.14 C ATOM 2026 CD1 LEU A 122 -6.508 2.195 1.658 1.00 11.32 C ATOM 2027 CD2 LEU A 122 -8.525 3.647 2.123 1.00 3.45 C ATOM 0 H LEU A 122 -9.378 2.740 -1.424 1.00 73.13 H new ATOM 0 HA LEU A 122 -8.920 5.189 0.022 1.00 34.44 H new ATOM 0 HB2 LEU A 122 -7.003 3.045 -0.964 1.00 43.30 H new ATOM 0 HB3 LEU A 122 -6.567 4.368 0.099 1.00 43.30 H new ATOM 0 HG LEU A 122 -8.427 2.042 0.713 1.00 74.14 H new ATOM 0 HD11 LEU A 122 -6.787 1.591 2.521 1.00 11.32 H new ATOM 0 HD12 LEU A 122 -6.027 1.562 0.912 1.00 11.32 H new ATOM 0 HD13 LEU A 122 -5.816 2.977 1.971 1.00 11.32 H new ATOM 0 HD21 LEU A 122 -8.767 3.003 2.968 1.00 3.45 H new ATOM 0 HD22 LEU A 122 -7.903 4.475 2.464 1.00 3.45 H new ATOM 0 HD23 LEU A 122 -9.445 4.039 1.690 1.00 3.45 H new ATOM 2039 N LEU A 123 -8.029 4.937 -3.142 1.00 21.14 N ATOM 2040 CA LEU A 123 -7.640 5.705 -4.348 1.00 71.01 C ATOM 2041 C LEU A 123 -8.546 6.936 -4.540 1.00 61.02 C ATOM 2042 O LEU A 123 -8.094 7.981 -5.017 1.00 1.33 O ATOM 2043 CB LEU A 123 -7.642 4.780 -5.622 1.00 41.32 C ATOM 2044 CG LEU A 123 -6.240 4.500 -6.260 1.00 41.21 C ATOM 2045 CD1 LEU A 123 -5.608 5.796 -6.828 1.00 33.25 C ATOM 2046 CD2 LEU A 123 -5.295 3.807 -5.246 1.00 32.15 C ATOM 0 H LEU A 123 -8.320 3.981 -3.344 1.00 21.14 H new ATOM 0 HA LEU A 123 -6.623 6.071 -4.205 1.00 71.01 H new ATOM 0 HB2 LEU A 123 -8.096 3.826 -5.355 1.00 41.32 H new ATOM 0 HB3 LEU A 123 -8.280 5.236 -6.379 1.00 41.32 H new ATOM 0 HG LEU A 123 -6.387 3.817 -7.096 1.00 41.21 H new ATOM 0 HD11 LEU A 123 -4.636 5.566 -7.263 1.00 33.25 H new ATOM 0 HD12 LEU A 123 -6.260 6.213 -7.596 1.00 33.25 H new ATOM 0 HD13 LEU A 123 -5.483 6.522 -6.025 1.00 33.25 H new ATOM 0 HD21 LEU A 123 -4.328 3.624 -5.716 1.00 32.15 H new ATOM 0 HD22 LEU A 123 -5.160 4.450 -4.376 1.00 32.15 H new ATOM 0 HD23 LEU A 123 -5.731 2.859 -4.932 1.00 32.15 H new ATOM 2058 N GLU A 124 -9.815 6.793 -4.128 1.00 3.54 N ATOM 2059 CA GLU A 124 -10.797 7.886 -4.117 1.00 71.05 C ATOM 2060 C GLU A 124 -10.446 8.891 -3.011 1.00 0.12 C ATOM 2061 O GLU A 124 -10.477 10.091 -3.239 1.00 73.01 O ATOM 2062 CB GLU A 124 -12.223 7.312 -3.924 1.00 72.31 C ATOM 2063 CG GLU A 124 -12.709 6.450 -5.111 1.00 41.23 C ATOM 2064 CD GLU A 124 -14.027 5.724 -4.826 1.00 34.31 C ATOM 2065 OE1 GLU A 124 -13.995 4.659 -4.192 1.00 14.01 O ATOM 2066 OE2 GLU A 124 -15.103 6.212 -5.234 1.00 12.45 O ATOM 0 H GLU A 124 -10.191 5.907 -3.790 1.00 3.54 H new ATOM 0 HA GLU A 124 -10.770 8.410 -5.072 1.00 71.05 H new ATOM 0 HB2 GLU A 124 -12.243 6.709 -3.016 1.00 72.31 H new ATOM 0 HB3 GLU A 124 -12.920 8.136 -3.775 1.00 72.31 H new ATOM 0 HG2 GLU A 124 -12.834 7.086 -5.987 1.00 41.23 H new ATOM 0 HG3 GLU A 124 -11.942 5.715 -5.357 1.00 41.23 H new ATOM 2073 N LYS A 125 -10.051 8.368 -1.828 1.00 75.41 N ATOM 2074 CA LYS A 125 -9.619 9.193 -0.670 1.00 74.24 C ATOM 2075 C LYS A 125 -8.294 9.935 -0.946 1.00 51.40 C ATOM 2076 O LYS A 125 -7.962 10.898 -0.250 1.00 23.23 O ATOM 2077 CB LYS A 125 -9.505 8.306 0.600 1.00 51.15 C ATOM 2078 CG LYS A 125 -10.851 7.693 1.045 1.00 75.41 C ATOM 2079 CD LYS A 125 -10.699 6.685 2.202 1.00 2.33 C ATOM 2080 CE LYS A 125 -12.044 6.087 2.654 1.00 23.40 C ATOM 2081 NZ LYS A 125 -12.921 7.108 3.285 1.00 73.22 N ATOM 0 H LYS A 125 -10.022 7.365 -1.647 1.00 75.41 H new ATOM 0 HA LYS A 125 -10.378 9.957 -0.504 1.00 74.24 H new ATOM 0 HB2 LYS A 125 -8.794 7.502 0.410 1.00 51.15 H new ATOM 0 HB3 LYS A 125 -9.099 8.904 1.416 1.00 51.15 H new ATOM 0 HG2 LYS A 125 -11.524 8.493 1.353 1.00 75.41 H new ATOM 0 HG3 LYS A 125 -11.316 7.195 0.195 1.00 75.41 H new ATOM 0 HD2 LYS A 125 -10.035 5.879 1.890 1.00 2.33 H new ATOM 0 HD3 LYS A 125 -10.224 7.180 3.049 1.00 2.33 H new ATOM 0 HE2 LYS A 125 -12.554 5.651 1.795 1.00 23.40 H new ATOM 0 HE3 LYS A 125 -11.862 5.278 3.361 1.00 23.40 H new ATOM 0 HZ1 LYS A 125 -13.780 6.650 3.651 1.00 73.22 H new ATOM 0 HZ2 LYS A 125 -12.413 7.566 4.068 1.00 73.22 H new ATOM 0 HZ3 LYS A 125 -13.185 7.824 2.578 1.00 73.22 H new ATOM 2095 N VAL A 126 -7.536 9.464 -1.953 1.00 24.33 N ATOM 2096 CA VAL A 126 -6.383 10.204 -2.497 1.00 64.34 C ATOM 2097 C VAL A 126 -6.902 11.414 -3.307 1.00 45.42 C ATOM 2098 O VAL A 126 -6.444 12.548 -3.133 1.00 5.03 O ATOM 2099 CB VAL A 126 -5.485 9.299 -3.426 1.00 71.04 C ATOM 2100 CG1 VAL A 126 -4.294 10.098 -4.001 1.00 54.34 C ATOM 2101 CG2 VAL A 126 -5.003 8.030 -2.686 1.00 52.33 C ATOM 0 H VAL A 126 -7.703 8.567 -2.409 1.00 24.33 H new ATOM 0 HA VAL A 126 -5.766 10.533 -1.661 1.00 64.34 H new ATOM 0 HB VAL A 126 -6.103 8.974 -4.263 1.00 71.04 H new ATOM 0 HG11 VAL A 126 -3.693 9.448 -4.637 1.00 54.34 H new ATOM 0 HG12 VAL A 126 -4.668 10.936 -4.589 1.00 54.34 H new ATOM 0 HG13 VAL A 126 -3.679 10.474 -3.183 1.00 54.34 H new ATOM 0 HG21 VAL A 126 -4.387 7.430 -3.356 1.00 52.33 H new ATOM 0 HG22 VAL A 126 -4.416 8.318 -1.814 1.00 52.33 H new ATOM 0 HG23 VAL A 126 -5.866 7.446 -2.366 1.00 52.33 H new