USER MOD reduce.3.24.130724 H: found=0, std=0, add=1213, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1209 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 GLN : amide:sc= 0.175 K(o=0.31,f=-0.47) USER MOD Set 1.2: A 144 LYS NZ :NH3+ -149:sc= 0.14 (180deg=-0.168) USER MOD Set 2.1: A 32 LYS NZ :NH3+ -124:sc= 1.09 (180deg=-0.111) USER MOD Set 2.2: A 112 GLN : amide:sc= 0.897 K(o=2,f=-1.9) USER MOD Set 3.1: A 74 GLN : amide:sc= -0.0168 K(o=-0.017,f=-0.83) USER MOD Set 3.2: A 98 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 55 THR OG1 : rot 163:sc= 1.37 USER MOD Set 4.2: A 58 LYS NZ :NH3+ -175:sc= 1.93 (180deg=1.88) USER MOD Set 5.1: A 40 THR OG1 : rot 126:sc= 0.412 USER MOD Set 5.2: A 123 TYR OH : rot 180:sc= 0.379 USER MOD Set 6.1: A 6 THR OG1 : rot 157:sc= 0.717 USER MOD Set 6.2: A 8 GLN : amide:sc= 0.637 K(o=1.4,f=0.19) USER MOD Single : A 1 GLY N :NH3+ -134:sc= -0.329 (180deg=-1.94!) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0572 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 160:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot -6:sc= 1.06 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 42:sc= 1.23 USER MOD Single : A 27 GLN : amide:sc= 0.893 K(o=0.89,f=-9.9!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -37:sc= 0.809 USER MOD Single : A 36 LYS NZ :NH3+ -154:sc= 0.871 (180deg=-0.493!) USER MOD Single : A 37 THR OG1 : rot 99:sc= 1.06 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.00989 USER MOD Single : A 56 LYS NZ :NH3+ -177:sc= 0.0487 (180deg=0.0467) USER MOD Single : A 64 SER OG : rot 180:sc= -0.0343 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 146:sc= -0.115 (180deg=-2.86!) USER MOD Single : A 68 LYS NZ :NH3+ 154:sc= -0.177 (180deg=-1.1) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 30:sc= 0 USER MOD Single : A 82 SER OG : rot 170:sc= 1.16 USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= 1.25 (180deg=1.16) USER MOD Single : A 85 THR OG1 : rot -24:sc= 0.123 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.612 X(o=-0.61,f=-1.1) USER MOD Single : A 92 LYS NZ :NH3+ 165:sc= -0.0114 (180deg=-0.192) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 174:sc= 0.785 (180deg=0.761) USER MOD Single : A 118 TYR OH : rot 180:sc= -0.351 USER MOD Single : A 122 CYS SG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 180:sc=0.000793 USER MOD Single : A 127 TYR OH : rot 151:sc= -0.777 USER MOD Single : A 129 TYR OH : rot 121:sc= 1.27 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.62) USER MOD Single : A 139 THR OG1 : rot -130:sc= -0.016 USER MOD Single : A 142 ASN : amide:sc= 0.973 K(o=0.97,f=0) USER MOD Single : A 147 ASN : amide:sc= 0.351 K(o=0.35,f=-6.5!) USER MOD Single : A 151 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.00842) USER MOD Single : A 154 HIS : no HE2:sc= -1.55 K(o=-1.6,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -33.605 -21.514 -2.716 1.00 55.13 N ATOM 2 CA GLY A 1 -34.054 -20.388 -3.550 1.00 42.30 C ATOM 3 C GLY A 1 -32.834 -19.837 -4.253 1.00 44.32 C ATOM 4 O GLY A 1 -32.373 -20.470 -5.194 1.00 75.14 O ATOM 0 H1 GLY A 1 -34.249 -22.320 -2.845 1.00 55.13 H new ATOM 0 H2 GLY A 1 -32.642 -21.791 -2.996 1.00 55.13 H new ATOM 0 H3 GLY A 1 -33.606 -21.227 -1.716 1.00 55.13 H new ATOM 0 HA2 GLY A 1 -34.799 -20.719 -4.274 1.00 42.30 H new ATOM 0 HA3 GLY A 1 -34.525 -19.619 -2.937 1.00 42.30 H new ATOM 8 N ASP A 2 -32.272 -18.744 -3.727 1.00 2.34 N ATOM 9 CA ASP A 2 -30.817 -18.522 -3.649 1.00 32.35 C ATOM 10 C ASP A 2 -30.181 -18.182 -5.004 1.00 22.43 C ATOM 11 O ASP A 2 -28.956 -18.095 -5.117 1.00 41.51 O ATOM 12 CB ASP A 2 -30.079 -19.688 -2.927 1.00 14.23 C ATOM 13 CG ASP A 2 -30.933 -20.503 -1.944 1.00 1.54 C ATOM 14 OD1 ASP A 2 -31.785 -19.912 -1.237 1.00 72.11 O ATOM 15 OD2 ASP A 2 -31.009 -21.742 -2.090 1.00 15.52 O ATOM 0 H ASP A 2 -32.819 -17.976 -3.337 1.00 2.34 H new ATOM 0 HA ASP A 2 -30.687 -17.634 -3.030 1.00 32.35 H new ATOM 0 HB2 ASP A 2 -29.680 -20.365 -3.682 1.00 14.23 H new ATOM 0 HB3 ASP A 2 -29.227 -19.276 -2.386 1.00 14.23 H new ATOM 20 N SER A 3 -31.012 -17.996 -6.029 1.00 34.04 N ATOM 21 CA SER A 3 -30.649 -17.697 -7.396 1.00 4.51 C ATOM 22 C SER A 3 -29.962 -16.334 -7.524 1.00 73.00 C ATOM 23 O SER A 3 -29.864 -15.561 -6.571 1.00 2.55 O ATOM 24 CB SER A 3 -31.931 -17.785 -8.248 1.00 34.23 C ATOM 25 OG SER A 3 -33.051 -17.161 -7.630 1.00 42.14 O ATOM 0 H SER A 3 -32.023 -18.056 -5.908 1.00 34.04 H new ATOM 0 HA SER A 3 -29.916 -18.420 -7.754 1.00 4.51 H new ATOM 0 HB2 SER A 3 -31.750 -17.319 -9.216 1.00 34.23 H new ATOM 0 HB3 SER A 3 -32.164 -18.833 -8.437 1.00 34.23 H new ATOM 0 HG SER A 3 -33.835 -17.245 -8.213 1.00 42.14 H new ATOM 31 N GLU A 4 -29.548 -16.043 -8.758 1.00 22.41 N ATOM 32 CA GLU A 4 -29.115 -14.736 -9.224 1.00 53.42 C ATOM 33 C GLU A 4 -27.820 -14.287 -8.529 1.00 23.11 C ATOM 34 O GLU A 4 -27.190 -15.033 -7.771 1.00 41.31 O ATOM 35 CB GLU A 4 -30.289 -13.731 -9.168 1.00 74.14 C ATOM 36 CG GLU A 4 -31.439 -14.168 -10.096 1.00 44.41 C ATOM 37 CD GLU A 4 -32.746 -13.464 -9.749 1.00 2.51 C ATOM 38 OE1 GLU A 4 -32.957 -12.345 -10.265 1.00 35.33 O ATOM 39 OE2 GLU A 4 -33.518 -14.091 -8.983 1.00 0.35 O ATOM 0 H GLU A 4 -29.506 -16.751 -9.491 1.00 22.41 H new ATOM 0 HA GLU A 4 -28.836 -14.792 -10.276 1.00 53.42 H new ATOM 0 HB2 GLU A 4 -30.654 -13.651 -8.144 1.00 74.14 H new ATOM 0 HB3 GLU A 4 -29.938 -12.741 -9.460 1.00 74.14 H new ATOM 0 HG2 GLU A 4 -31.173 -13.951 -11.131 1.00 44.41 H new ATOM 0 HG3 GLU A 4 -31.576 -15.247 -10.021 1.00 44.41 H new ATOM 46 N LEU A 5 -27.354 -13.089 -8.879 1.00 60.14 N ATOM 47 CA LEU A 5 -25.983 -12.634 -8.682 1.00 52.51 C ATOM 48 C LEU A 5 -25.931 -11.556 -7.600 1.00 55.31 C ATOM 49 O LEU A 5 -25.309 -10.511 -7.782 1.00 13.45 O ATOM 50 CB LEU A 5 -25.311 -12.238 -10.014 1.00 23.05 C ATOM 51 CG LEU A 5 -26.002 -11.142 -10.854 1.00 11.22 C ATOM 52 CD1 LEU A 5 -24.971 -10.469 -11.768 1.00 13.14 C ATOM 53 CD2 LEU A 5 -27.108 -11.727 -11.744 1.00 52.41 C ATOM 0 H LEU A 5 -27.944 -12.385 -9.323 1.00 60.14 H new ATOM 0 HA LEU A 5 -25.381 -13.464 -8.312 1.00 52.51 H new ATOM 0 HB2 LEU A 5 -24.296 -11.906 -9.795 1.00 23.05 H new ATOM 0 HB3 LEU A 5 -25.228 -13.134 -10.630 1.00 23.05 H new ATOM 0 HG LEU A 5 -26.441 -10.426 -10.160 1.00 11.22 H new ATOM 0 HD11 LEU A 5 -25.460 -9.696 -12.360 1.00 13.14 H new ATOM 0 HD12 LEU A 5 -24.186 -10.019 -11.161 1.00 13.14 H new ATOM 0 HD13 LEU A 5 -24.534 -11.213 -12.433 1.00 13.14 H new ATOM 0 HD21 LEU A 5 -27.572 -10.927 -12.321 1.00 52.41 H new ATOM 0 HD22 LEU A 5 -26.677 -12.462 -12.424 1.00 52.41 H new ATOM 0 HD23 LEU A 5 -27.861 -12.208 -11.120 1.00 52.41 H new ATOM 65 N THR A 6 -26.595 -11.826 -6.476 1.00 74.43 N ATOM 66 CA THR A 6 -26.828 -10.899 -5.376 1.00 41.32 C ATOM 67 C THR A 6 -27.511 -9.615 -5.876 1.00 40.14 C ATOM 68 O THR A 6 -28.088 -9.592 -6.964 1.00 61.24 O ATOM 69 CB THR A 6 -25.574 -10.710 -4.481 1.00 4.54 C ATOM 70 OG1 THR A 6 -24.654 -9.730 -4.924 1.00 3.51 O ATOM 71 CG2 THR A 6 -24.792 -12.007 -4.246 1.00 60.00 C ATOM 0 H THR A 6 -27.004 -12.744 -6.303 1.00 74.43 H new ATOM 0 HA THR A 6 -27.547 -11.339 -4.685 1.00 41.32 H new ATOM 0 HB THR A 6 -26.020 -10.361 -3.549 1.00 4.54 H new ATOM 0 HG1 THR A 6 -24.123 -9.412 -4.164 1.00 3.51 H new ATOM 0 HG21 THR A 6 -23.929 -11.802 -3.613 1.00 60.00 H new ATOM 0 HG22 THR A 6 -25.436 -12.737 -3.756 1.00 60.00 H new ATOM 0 HG23 THR A 6 -24.454 -12.406 -5.202 1.00 60.00 H new ATOM 79 N THR A 7 -27.536 -8.572 -5.048 1.00 42.23 N ATOM 80 CA THR A 7 -28.269 -7.335 -5.300 1.00 0.45 C ATOM 81 C THR A 7 -27.366 -6.103 -5.093 1.00 53.31 C ATOM 82 O THR A 7 -27.845 -4.970 -5.001 1.00 33.23 O ATOM 83 CB THR A 7 -29.544 -7.360 -4.426 1.00 54.54 C ATOM 84 OG1 THR A 7 -29.250 -7.689 -3.076 1.00 32.02 O ATOM 85 CG2 THR A 7 -30.546 -8.412 -4.929 1.00 60.11 C ATOM 0 H THR A 7 -27.033 -8.565 -4.160 1.00 42.23 H new ATOM 0 HA THR A 7 -28.583 -7.258 -6.341 1.00 0.45 H new ATOM 0 HB THR A 7 -29.967 -6.358 -4.491 1.00 54.54 H new ATOM 0 HG1 THR A 7 -30.079 -7.694 -2.553 1.00 32.02 H new ATOM 0 HG21 THR A 7 -31.431 -8.404 -4.293 1.00 60.11 H new ATOM 0 HG22 THR A 7 -30.834 -8.180 -5.954 1.00 60.11 H new ATOM 0 HG23 THR A 7 -30.084 -9.399 -4.896 1.00 60.11 H new ATOM 93 N GLN A 8 -26.053 -6.323 -4.991 1.00 60.44 N ATOM 94 CA GLN A 8 -25.078 -5.357 -4.500 1.00 14.22 C ATOM 95 C GLN A 8 -24.625 -4.400 -5.614 1.00 22.31 C ATOM 96 O GLN A 8 -24.453 -4.787 -6.772 1.00 31.33 O ATOM 97 CB GLN A 8 -23.888 -6.137 -3.905 1.00 44.12 C ATOM 98 CG GLN A 8 -24.267 -6.854 -2.593 1.00 14.12 C ATOM 99 CD GLN A 8 -23.223 -7.889 -2.175 1.00 41.43 C ATOM 100 OE1 GLN A 8 -23.393 -9.086 -2.403 1.00 12.34 O ATOM 101 NE2 GLN A 8 -22.101 -7.473 -1.609 1.00 20.45 N ATOM 0 H GLN A 8 -25.629 -7.211 -5.258 1.00 60.44 H new ATOM 0 HA GLN A 8 -25.532 -4.734 -3.729 1.00 14.22 H new ATOM 0 HB2 GLN A 8 -23.536 -6.870 -4.630 1.00 44.12 H new ATOM 0 HB3 GLN A 8 -23.062 -5.451 -3.718 1.00 44.12 H new ATOM 0 HG2 GLN A 8 -24.382 -6.116 -1.799 1.00 14.12 H new ATOM 0 HG3 GLN A 8 -25.233 -7.344 -2.715 1.00 14.12 H new ATOM 0 HE21 GLN A 8 -21.962 -6.480 -1.421 1.00 20.45 H new ATOM 0 HE22 GLN A 8 -21.375 -8.145 -1.361 1.00 20.45 H new ATOM 110 N ASP A 9 -24.354 -3.145 -5.248 1.00 15.21 N ATOM 111 CA ASP A 9 -23.726 -2.110 -6.093 1.00 72.01 C ATOM 112 C ASP A 9 -22.202 -2.103 -6.003 1.00 60.22 C ATOM 113 O ASP A 9 -21.539 -1.212 -6.548 1.00 34.12 O ATOM 114 CB ASP A 9 -24.260 -0.710 -5.746 1.00 61.23 C ATOM 115 CG ASP A 9 -23.835 -0.243 -4.350 1.00 2.42 C ATOM 116 OD1 ASP A 9 -24.359 -0.829 -3.369 1.00 73.10 O ATOM 117 OD2 ASP A 9 -22.998 0.683 -4.226 1.00 21.11 O ATOM 0 H ASP A 9 -24.574 -2.801 -4.313 1.00 15.21 H new ATOM 0 HA ASP A 9 -23.996 -2.366 -7.118 1.00 72.01 H new ATOM 0 HB2 ASP A 9 -23.903 0.004 -6.488 1.00 61.23 H new ATOM 0 HB3 ASP A 9 -25.348 -0.716 -5.807 1.00 61.23 H new ATOM 122 N GLY A 10 -21.652 -3.093 -5.315 1.00 75.10 N ATOM 123 CA GLY A 10 -20.302 -3.131 -4.814 1.00 40.30 C ATOM 124 C GLY A 10 -20.383 -3.123 -3.293 1.00 22.04 C ATOM 125 O GLY A 10 -21.344 -2.630 -2.695 1.00 55.14 O ATOM 0 H GLY A 10 -22.175 -3.938 -5.082 1.00 75.10 H new ATOM 0 HA2 GLY A 10 -19.786 -4.024 -5.167 1.00 40.30 H new ATOM 0 HA3 GLY A 10 -19.735 -2.272 -5.173 1.00 40.30 H new ATOM 129 N GLU A 11 -19.350 -3.653 -2.669 1.00 51.31 N ATOM 130 CA GLU A 11 -19.052 -3.543 -1.252 1.00 52.12 C ATOM 131 C GLU A 11 -18.977 -2.054 -0.887 1.00 74.41 C ATOM 132 O GLU A 11 -18.426 -1.247 -1.654 1.00 1.33 O ATOM 133 CB GLU A 11 -17.695 -4.223 -1.020 1.00 11.31 C ATOM 134 CG GLU A 11 -17.354 -4.538 0.412 1.00 3.55 C ATOM 135 CD GLU A 11 -16.336 -5.666 0.495 1.00 75.30 C ATOM 136 OE1 GLU A 11 -16.708 -6.834 0.274 1.00 14.51 O ATOM 137 OE2 GLU A 11 -15.136 -5.378 0.737 1.00 72.43 O ATOM 0 H GLU A 11 -18.653 -4.206 -3.167 1.00 51.31 H new ATOM 0 HA GLU A 11 -19.816 -4.017 -0.636 1.00 52.12 H new ATOM 0 HB2 GLU A 11 -17.673 -5.151 -1.591 1.00 11.31 H new ATOM 0 HB3 GLU A 11 -16.914 -3.580 -1.426 1.00 11.31 H new ATOM 0 HG2 GLU A 11 -16.956 -3.648 0.899 1.00 3.55 H new ATOM 0 HG3 GLU A 11 -18.258 -4.819 0.952 1.00 3.55 H new ATOM 144 N ASP A 12 -19.505 -1.691 0.281 1.00 40.24 N ATOM 145 CA ASP A 12 -19.483 -0.312 0.770 1.00 52.43 C ATOM 146 C ASP A 12 -18.034 0.171 0.909 1.00 72.21 C ATOM 147 O ASP A 12 -17.120 -0.640 1.108 1.00 41.52 O ATOM 148 CB ASP A 12 -20.181 -0.237 2.127 1.00 74.41 C ATOM 149 CG ASP A 12 -20.539 1.198 2.504 1.00 63.44 C ATOM 150 OD1 ASP A 12 -19.671 1.856 3.123 1.00 21.41 O ATOM 151 OD2 ASP A 12 -21.653 1.653 2.166 1.00 1.11 O ATOM 0 H ASP A 12 -19.961 -2.346 0.917 1.00 40.24 H new ATOM 0 HA ASP A 12 -20.005 0.327 0.058 1.00 52.43 H new ATOM 0 HB2 ASP A 12 -21.087 -0.843 2.103 1.00 74.41 H new ATOM 0 HB3 ASP A 12 -19.533 -0.663 2.893 1.00 74.41 H new ATOM 156 N PHE A 13 -17.799 1.484 0.852 1.00 21.15 N ATOM 157 CA PHE A 13 -16.460 2.020 1.070 1.00 64.43 C ATOM 158 C PHE A 13 -15.962 1.678 2.474 1.00 35.42 C ATOM 159 O PHE A 13 -14.784 1.365 2.646 1.00 62.41 O ATOM 160 CB PHE A 13 -16.397 3.528 0.820 1.00 74.21 C ATOM 161 CG PHE A 13 -17.302 4.354 1.703 1.00 73.20 C ATOM 162 CD1 PHE A 13 -16.892 4.745 2.993 1.00 22.05 C ATOM 163 CD2 PHE A 13 -18.593 4.670 1.252 1.00 24.33 C ATOM 164 CE1 PHE A 13 -17.787 5.412 3.846 1.00 32.43 C ATOM 165 CE2 PHE A 13 -19.478 5.341 2.102 1.00 71.10 C ATOM 166 CZ PHE A 13 -19.084 5.709 3.398 1.00 74.04 C ATOM 0 H PHE A 13 -18.513 2.187 0.659 1.00 21.15 H new ATOM 0 HA PHE A 13 -15.799 1.547 0.344 1.00 64.43 H new ATOM 0 HB2 PHE A 13 -15.370 3.863 0.962 1.00 74.21 H new ATOM 0 HB3 PHE A 13 -16.654 3.721 -0.222 1.00 74.21 H new ATOM 0 HD1 PHE A 13 -15.887 4.531 3.327 1.00 22.05 H new ATOM 0 HD2 PHE A 13 -18.901 4.396 0.254 1.00 24.33 H new ATOM 0 HE1 PHE A 13 -17.479 5.695 4.842 1.00 32.43 H new ATOM 0 HE2 PHE A 13 -20.474 5.578 1.758 1.00 71.10 H new ATOM 0 HZ PHE A 13 -19.778 6.220 4.050 1.00 74.04 H new ATOM 176 N LYS A 14 -16.834 1.727 3.483 1.00 34.02 N ATOM 177 CA LYS A 14 -16.455 1.415 4.849 1.00 73.01 C ATOM 178 C LYS A 14 -16.308 -0.089 4.987 1.00 40.11 C ATOM 179 O LYS A 14 -15.341 -0.493 5.618 1.00 22.01 O ATOM 180 CB LYS A 14 -17.481 1.985 5.837 1.00 3.13 C ATOM 181 CG LYS A 14 -17.002 1.997 7.299 1.00 64.23 C ATOM 182 CD LYS A 14 -15.778 2.899 7.533 1.00 65.33 C ATOM 183 CE LYS A 14 -15.635 3.318 9.002 1.00 22.05 C ATOM 184 NZ LYS A 14 -15.339 2.194 9.917 1.00 11.14 N ATOM 0 H LYS A 14 -17.815 1.983 3.370 1.00 34.02 H new ATOM 0 HA LYS A 14 -15.498 1.880 5.086 1.00 73.01 H new ATOM 0 HB2 LYS A 14 -17.730 3.003 5.539 1.00 3.13 H new ATOM 0 HB3 LYS A 14 -18.398 1.400 5.771 1.00 3.13 H new ATOM 0 HG2 LYS A 14 -17.819 2.332 7.938 1.00 64.23 H new ATOM 0 HG3 LYS A 14 -16.757 0.979 7.602 1.00 64.23 H new ATOM 0 HD2 LYS A 14 -14.877 2.373 7.218 1.00 65.33 H new ATOM 0 HD3 LYS A 14 -15.861 3.790 6.910 1.00 65.33 H new ATOM 0 HE2 LYS A 14 -14.840 4.059 9.083 1.00 22.05 H new ATOM 0 HE3 LYS A 14 -16.557 3.803 9.323 1.00 22.05 H new ATOM 0 HZ1 LYS A 14 -15.256 2.551 10.890 1.00 11.14 H new ATOM 0 HZ2 LYS A 14 -16.108 1.495 9.869 1.00 11.14 H new ATOM 0 HZ3 LYS A 14 -14.444 1.744 9.636 1.00 11.14 H new ATOM 198 N SER A 15 -17.181 -0.894 4.364 1.00 53.51 N ATOM 199 CA SER A 15 -17.113 -2.355 4.379 1.00 73.14 C ATOM 200 C SER A 15 -15.692 -2.816 4.073 1.00 24.35 C ATOM 201 O SER A 15 -15.088 -3.548 4.868 1.00 13.54 O ATOM 202 CB SER A 15 -18.082 -2.972 3.354 1.00 35.01 C ATOM 203 OG SER A 15 -18.195 -4.373 3.505 1.00 42.22 O ATOM 0 H SER A 15 -17.969 -0.536 3.825 1.00 53.51 H new ATOM 0 HA SER A 15 -17.404 -2.691 5.374 1.00 73.14 H new ATOM 0 HB2 SER A 15 -19.065 -2.515 3.465 1.00 35.01 H new ATOM 0 HB3 SER A 15 -17.736 -2.743 2.346 1.00 35.01 H new ATOM 0 HG SER A 15 -19.023 -4.682 3.082 1.00 42.22 H new ATOM 209 N PHE A 16 -15.156 -2.387 2.924 1.00 43.14 N ATOM 210 CA PHE A 16 -13.856 -2.869 2.501 1.00 64.30 C ATOM 211 C PHE A 16 -12.748 -2.315 3.386 1.00 54.51 C ATOM 212 O PHE A 16 -11.794 -3.044 3.645 1.00 62.02 O ATOM 213 CB PHE A 16 -13.579 -2.577 1.023 1.00 23.22 C ATOM 214 CG PHE A 16 -12.860 -1.282 0.701 1.00 54.11 C ATOM 215 CD1 PHE A 16 -11.452 -1.224 0.708 1.00 52.12 C ATOM 216 CD2 PHE A 16 -13.600 -0.144 0.356 1.00 32.23 C ATOM 217 CE1 PHE A 16 -10.789 -0.041 0.346 1.00 40.52 C ATOM 218 CE2 PHE A 16 -12.939 1.034 -0.033 1.00 54.43 C ATOM 219 CZ PHE A 16 -11.533 1.085 -0.039 1.00 14.13 C ATOM 0 H PHE A 16 -15.598 -1.722 2.290 1.00 43.14 H new ATOM 0 HA PHE A 16 -13.870 -3.953 2.613 1.00 64.30 H new ATOM 0 HB2 PHE A 16 -12.990 -3.401 0.619 1.00 23.22 H new ATOM 0 HB3 PHE A 16 -14.532 -2.576 0.493 1.00 23.22 H new ATOM 0 HD1 PHE A 16 -10.880 -2.094 0.993 1.00 52.12 H new ATOM 0 HD2 PHE A 16 -14.679 -0.172 0.389 1.00 32.23 H new ATOM 0 HE1 PHE A 16 -9.710 0.003 0.364 1.00 40.52 H new ATOM 0 HE2 PHE A 16 -13.511 1.901 -0.328 1.00 54.43 H new ATOM 0 HZ PHE A 16 -11.026 1.990 -0.340 1.00 14.13 H new ATOM 229 N LEU A 17 -12.840 -1.049 3.816 1.00 35.25 N ATOM 230 CA LEU A 17 -11.778 -0.391 4.579 1.00 54.43 C ATOM 231 C LEU A 17 -11.669 -1.053 5.953 1.00 42.51 C ATOM 232 O LEU A 17 -10.581 -1.416 6.391 1.00 21.52 O ATOM 233 CB LEU A 17 -12.081 1.116 4.672 1.00 2.33 C ATOM 234 CG LEU A 17 -10.887 2.083 4.808 1.00 22.31 C ATOM 235 CD1 LEU A 17 -10.090 1.908 6.101 1.00 21.14 C ATOM 236 CD2 LEU A 17 -9.945 2.026 3.599 1.00 71.10 C ATOM 0 H LEU A 17 -13.652 -0.456 3.644 1.00 35.25 H new ATOM 0 HA LEU A 17 -10.814 -0.500 4.083 1.00 54.43 H new ATOM 0 HB2 LEU A 17 -12.642 1.400 3.782 1.00 2.33 H new ATOM 0 HB3 LEU A 17 -12.738 1.273 5.527 1.00 2.33 H new ATOM 0 HG LEU A 17 -11.346 3.071 4.847 1.00 22.31 H new ATOM 0 HD11 LEU A 17 -9.268 2.624 6.121 1.00 21.14 H new ATOM 0 HD12 LEU A 17 -10.743 2.080 6.957 1.00 21.14 H new ATOM 0 HD13 LEU A 17 -9.690 0.895 6.148 1.00 21.14 H new ATOM 0 HD21 LEU A 17 -9.122 2.726 3.746 1.00 71.10 H new ATOM 0 HD22 LEU A 17 -9.549 1.016 3.494 1.00 71.10 H new ATOM 0 HD23 LEU A 17 -10.494 2.296 2.697 1.00 71.10 H new ATOM 248 N ASP A 18 -12.816 -1.308 6.581 1.00 4.52 N ATOM 249 CA ASP A 18 -12.979 -2.135 7.768 1.00 33.51 C ATOM 250 C ASP A 18 -12.251 -3.466 7.582 1.00 52.22 C ATOM 251 O ASP A 18 -11.226 -3.667 8.234 1.00 41.02 O ATOM 252 CB ASP A 18 -14.476 -2.297 8.074 1.00 42.42 C ATOM 253 CG ASP A 18 -14.811 -3.466 8.998 1.00 11.34 C ATOM 254 OD1 ASP A 18 -14.032 -3.793 9.914 1.00 70.32 O ATOM 255 OD2 ASP A 18 -15.879 -4.088 8.764 1.00 3.43 O ATOM 0 H ASP A 18 -13.702 -0.921 6.255 1.00 4.52 H new ATOM 0 HA ASP A 18 -12.525 -1.655 8.635 1.00 33.51 H new ATOM 0 HB2 ASP A 18 -14.843 -1.376 8.527 1.00 42.42 H new ATOM 0 HB3 ASP A 18 -15.014 -2.427 7.135 1.00 42.42 H new ATOM 260 N LYS A 19 -12.697 -4.348 6.676 1.00 2.15 N ATOM 261 CA LYS A 19 -12.094 -5.674 6.555 1.00 21.42 C ATOM 262 C LYS A 19 -10.615 -5.626 6.176 1.00 12.21 C ATOM 263 O LYS A 19 -9.855 -6.450 6.687 1.00 41.42 O ATOM 264 CB LYS A 19 -12.875 -6.555 5.573 1.00 31.11 C ATOM 265 CG LYS A 19 -13.832 -7.519 6.296 1.00 21.02 C ATOM 266 CD LYS A 19 -14.073 -8.760 5.427 1.00 71.14 C ATOM 267 CE LYS A 19 -15.103 -9.740 5.993 1.00 1.21 C ATOM 268 NZ LYS A 19 -14.722 -10.248 7.326 1.00 14.34 N ATOM 0 H LYS A 19 -13.463 -4.167 6.027 1.00 2.15 H new ATOM 0 HA LYS A 19 -12.151 -6.122 7.547 1.00 21.42 H new ATOM 0 HB2 LYS A 19 -13.444 -5.922 4.893 1.00 31.11 H new ATOM 0 HB3 LYS A 19 -12.175 -7.128 4.965 1.00 31.11 H new ATOM 0 HG2 LYS A 19 -13.410 -7.813 7.257 1.00 21.02 H new ATOM 0 HG3 LYS A 19 -14.778 -7.019 6.503 1.00 21.02 H new ATOM 0 HD2 LYS A 19 -14.401 -8.438 4.439 1.00 71.14 H new ATOM 0 HD3 LYS A 19 -13.127 -9.284 5.293 1.00 71.14 H new ATOM 0 HE2 LYS A 19 -16.073 -9.246 6.059 1.00 1.21 H new ATOM 0 HE3 LYS A 19 -15.218 -10.579 5.307 1.00 1.21 H new ATOM 0 HZ1 LYS A 19 -15.450 -10.908 7.667 1.00 14.34 H new ATOM 0 HZ2 LYS A 19 -13.810 -10.743 7.261 1.00 14.34 H new ATOM 0 HZ3 LYS A 19 -14.638 -9.452 7.990 1.00 14.34 H new ATOM 282 N PHE A 20 -10.192 -4.676 5.341 1.00 54.32 N ATOM 283 CA PHE A 20 -8.790 -4.368 5.072 1.00 42.10 C ATOM 284 C PHE A 20 -8.030 -4.249 6.390 1.00 74.32 C ATOM 285 O PHE A 20 -7.092 -5.012 6.623 1.00 21.23 O ATOM 286 CB PHE A 20 -8.704 -3.113 4.182 1.00 23.42 C ATOM 287 CG PHE A 20 -7.437 -2.282 4.269 1.00 75.44 C ATOM 288 CD1 PHE A 20 -6.176 -2.839 4.012 1.00 74.23 C ATOM 289 CD2 PHE A 20 -7.531 -0.924 4.621 1.00 24.21 C ATOM 290 CE1 PHE A 20 -5.023 -2.038 4.097 1.00 51.23 C ATOM 291 CE2 PHE A 20 -6.383 -0.123 4.723 1.00 23.55 C ATOM 292 CZ PHE A 20 -5.125 -0.683 4.457 1.00 43.34 C ATOM 0 H PHE A 20 -10.836 -4.083 4.818 1.00 54.32 H new ATOM 0 HA PHE A 20 -8.310 -5.173 4.516 1.00 42.10 H new ATOM 0 HB2 PHE A 20 -8.832 -3.425 3.146 1.00 23.42 H new ATOM 0 HB3 PHE A 20 -9.548 -2.468 4.427 1.00 23.42 H new ATOM 0 HD1 PHE A 20 -6.090 -3.883 3.749 1.00 74.23 H new ATOM 0 HD2 PHE A 20 -8.501 -0.491 4.816 1.00 24.21 H new ATOM 0 HE1 PHE A 20 -4.054 -2.466 3.885 1.00 51.23 H new ATOM 0 HE2 PHE A 20 -6.468 0.916 5.004 1.00 23.55 H new ATOM 0 HZ PHE A 20 -4.236 -0.074 4.529 1.00 43.34 H new ATOM 302 N THR A 21 -8.474 -3.352 7.269 1.00 64.31 N ATOM 303 CA THR A 21 -7.807 -3.092 8.540 1.00 11.13 C ATOM 304 C THR A 21 -8.042 -4.187 9.602 1.00 2.42 C ATOM 305 O THR A 21 -7.464 -4.114 10.690 1.00 33.51 O ATOM 306 CB THR A 21 -8.237 -1.709 9.056 1.00 43.24 C ATOM 307 OG1 THR A 21 -9.643 -1.618 9.260 1.00 2.35 O ATOM 308 CG2 THR A 21 -7.795 -0.621 8.069 1.00 12.23 C ATOM 0 H THR A 21 -9.308 -2.785 7.118 1.00 64.31 H new ATOM 0 HA THR A 21 -6.733 -3.106 8.356 1.00 11.13 H new ATOM 0 HB THR A 21 -7.752 -1.563 10.021 1.00 43.24 H new ATOM 0 HG1 THR A 21 -10.074 -2.437 8.939 1.00 2.35 H new ATOM 0 HG21 THR A 21 -8.103 0.356 8.442 1.00 12.23 H new ATOM 0 HG22 THR A 21 -6.710 -0.643 7.965 1.00 12.23 H new ATOM 0 HG23 THR A 21 -8.257 -0.801 7.098 1.00 12.23 H new ATOM 316 N SER A 22 -8.889 -5.185 9.338 1.00 64.42 N ATOM 317 CA SER A 22 -9.463 -6.072 10.350 1.00 70.24 C ATOM 318 C SER A 22 -9.179 -7.548 10.032 1.00 31.35 C ATOM 319 O SER A 22 -9.747 -8.442 10.663 1.00 61.11 O ATOM 320 CB SER A 22 -10.954 -5.712 10.468 1.00 51.24 C ATOM 321 OG SER A 22 -11.608 -6.168 11.641 1.00 24.53 O ATOM 0 H SER A 22 -9.201 -5.403 8.392 1.00 64.42 H new ATOM 0 HA SER A 22 -8.998 -5.929 11.325 1.00 70.24 H new ATOM 0 HB2 SER A 22 -11.052 -4.627 10.419 1.00 51.24 H new ATOM 0 HB3 SER A 22 -11.476 -6.119 9.602 1.00 51.24 H new ATOM 0 HG SER A 22 -12.547 -5.888 11.622 1.00 24.53 H new ATOM 327 N SER A 23 -8.306 -7.839 9.065 1.00 0.01 N ATOM 328 CA SER A 23 -7.790 -9.179 8.836 1.00 43.03 C ATOM 329 C SER A 23 -6.438 -9.065 8.137 1.00 23.43 C ATOM 330 O SER A 23 -6.193 -8.093 7.419 1.00 71.50 O ATOM 331 CB SER A 23 -8.801 -9.962 7.983 1.00 12.15 C ATOM 332 OG SER A 23 -8.708 -11.364 8.140 1.00 53.33 O ATOM 0 H SER A 23 -7.938 -7.142 8.417 1.00 0.01 H new ATOM 0 HA SER A 23 -7.651 -9.714 9.776 1.00 43.03 H new ATOM 0 HB2 SER A 23 -9.810 -9.642 8.244 1.00 12.15 H new ATOM 0 HB3 SER A 23 -8.649 -9.711 6.933 1.00 12.15 H new ATOM 0 HG SER A 23 -8.588 -11.580 9.088 1.00 53.33 H new ATOM 338 N ALA A 24 -5.577 -10.066 8.294 1.00 54.11 N ATOM 339 CA ALA A 24 -4.302 -10.209 7.617 1.00 40.31 C ATOM 340 C ALA A 24 -4.508 -11.031 6.357 1.00 23.31 C ATOM 341 O ALA A 24 -4.224 -10.565 5.253 1.00 63.40 O ATOM 342 CB ALA A 24 -3.294 -10.884 8.557 1.00 52.22 C ATOM 0 H ALA A 24 -5.765 -10.839 8.933 1.00 54.11 H new ATOM 0 HA ALA A 24 -3.906 -9.232 7.341 1.00 40.31 H new ATOM 0 HB1 ALA A 24 -2.336 -10.991 8.047 1.00 52.22 H new ATOM 0 HB2 ALA A 24 -3.164 -10.273 9.450 1.00 52.22 H new ATOM 0 HB3 ALA A 24 -3.665 -11.868 8.842 1.00 52.22 H new ATOM 348 N ALA A 25 -5.032 -12.253 6.499 1.00 13.32 N ATOM 349 CA ALA A 25 -5.082 -13.197 5.390 1.00 32.32 C ATOM 350 C ALA A 25 -5.924 -12.676 4.220 1.00 61.40 C ATOM 351 O ALA A 25 -5.686 -13.079 3.080 1.00 74.33 O ATOM 352 CB ALA A 25 -5.617 -14.549 5.866 1.00 24.41 C ATOM 0 H ALA A 25 -5.425 -12.606 7.371 1.00 13.32 H new ATOM 0 HA ALA A 25 -4.062 -13.320 5.026 1.00 32.32 H new ATOM 0 HB1 ALA A 25 -5.649 -15.244 5.027 1.00 24.41 H new ATOM 0 HB2 ALA A 25 -4.963 -14.947 6.642 1.00 24.41 H new ATOM 0 HB3 ALA A 25 -6.622 -14.421 6.269 1.00 24.41 H new ATOM 358 N PHE A 26 -6.880 -11.775 4.467 1.00 2.04 N ATOM 359 CA PHE A 26 -7.751 -11.261 3.420 1.00 21.02 C ATOM 360 C PHE A 26 -7.074 -10.203 2.548 1.00 35.34 C ATOM 361 O PHE A 26 -7.451 -10.054 1.386 1.00 53.40 O ATOM 362 CB PHE A 26 -9.061 -10.750 4.020 1.00 31.45 C ATOM 363 CG PHE A 26 -10.097 -11.849 4.097 1.00 13.33 C ATOM 364 CD1 PHE A 26 -10.115 -12.736 5.190 1.00 63.00 C ATOM 365 CD2 PHE A 26 -10.975 -12.050 3.016 1.00 41.44 C ATOM 366 CE1 PHE A 26 -11.009 -13.820 5.199 1.00 23.33 C ATOM 367 CE2 PHE A 26 -11.858 -13.140 3.020 1.00 31.42 C ATOM 368 CZ PHE A 26 -11.872 -14.028 4.108 1.00 55.31 C ATOM 0 H PHE A 26 -7.066 -11.388 5.392 1.00 2.04 H new ATOM 0 HA PHE A 26 -7.978 -12.092 2.752 1.00 21.02 H new ATOM 0 HB2 PHE A 26 -8.875 -10.352 5.018 1.00 31.45 H new ATOM 0 HB3 PHE A 26 -9.444 -9.928 3.415 1.00 31.45 H new ATOM 0 HD1 PHE A 26 -9.442 -12.583 6.021 1.00 63.00 H new ATOM 0 HD2 PHE A 26 -10.969 -11.364 2.182 1.00 41.44 H new ATOM 0 HE1 PHE A 26 -11.033 -14.493 6.043 1.00 23.33 H new ATOM 0 HE2 PHE A 26 -12.527 -13.296 2.187 1.00 31.42 H new ATOM 0 HZ PHE A 26 -12.546 -14.872 4.107 1.00 55.31 H new ATOM 378 N GLN A 27 -6.048 -9.514 3.054 1.00 4.15 N ATOM 379 CA GLN A 27 -5.455 -8.360 2.388 1.00 71.23 C ATOM 380 C GLN A 27 -4.838 -8.706 1.018 1.00 13.31 C ATOM 381 O GLN A 27 -4.665 -7.818 0.181 1.00 64.31 O ATOM 382 CB GLN A 27 -4.457 -7.708 3.361 1.00 34.11 C ATOM 383 CG GLN A 27 -4.164 -6.257 2.963 1.00 42.12 C ATOM 384 CD GLN A 27 -3.292 -5.521 3.975 1.00 42.12 C ATOM 385 OE1 GLN A 27 -2.084 -5.418 3.780 1.00 44.21 O ATOM 386 NE2 GLN A 27 -3.896 -4.957 5.009 1.00 54.42 N ATOM 0 H GLN A 27 -5.605 -9.746 3.943 1.00 4.15 H new ATOM 0 HA GLN A 27 -6.236 -7.640 2.144 1.00 71.23 H new ATOM 0 HB2 GLN A 27 -4.860 -7.736 4.373 1.00 34.11 H new ATOM 0 HB3 GLN A 27 -3.529 -8.280 3.372 1.00 34.11 H new ATOM 0 HG2 GLN A 27 -3.670 -6.246 1.991 1.00 42.12 H new ATOM 0 HG3 GLN A 27 -5.106 -5.721 2.847 1.00 42.12 H new ATOM 0 HE21 GLN A 27 -4.902 -5.067 5.134 1.00 54.42 H new ATOM 0 HE22 GLN A 27 -3.355 -4.412 5.681 1.00 54.42 H new ATOM 395 N TYR A 28 -4.559 -9.990 0.772 1.00 53.42 N ATOM 396 CA TYR A 28 -3.928 -10.519 -0.431 1.00 40.53 C ATOM 397 C TYR A 28 -4.969 -10.666 -1.551 1.00 74.10 C ATOM 398 O TYR A 28 -4.774 -10.192 -2.672 1.00 60.23 O ATOM 399 CB TYR A 28 -3.281 -11.873 -0.099 1.00 35.14 C ATOM 400 CG TYR A 28 -2.208 -11.847 0.984 1.00 51.13 C ATOM 401 CD1 TYR A 28 -2.564 -11.882 2.351 1.00 12.42 C ATOM 402 CD2 TYR A 28 -0.846 -11.740 0.630 1.00 74.32 C ATOM 403 CE1 TYR A 28 -1.574 -11.966 3.345 1.00 52.42 C ATOM 404 CE2 TYR A 28 0.149 -11.784 1.626 1.00 42.03 C ATOM 405 CZ TYR A 28 -0.210 -11.960 2.982 1.00 42.32 C ATOM 406 OH TYR A 28 0.749 -12.096 3.936 1.00 62.30 O ATOM 0 H TYR A 28 -4.781 -10.723 1.445 1.00 53.42 H new ATOM 0 HA TYR A 28 -3.157 -9.832 -0.780 1.00 40.53 H new ATOM 0 HB2 TYR A 28 -4.066 -12.564 0.210 1.00 35.14 H new ATOM 0 HB3 TYR A 28 -2.841 -12.278 -1.011 1.00 35.14 H new ATOM 0 HD1 TYR A 28 -3.605 -11.844 2.634 1.00 12.42 H new ATOM 0 HD2 TYR A 28 -0.566 -11.624 -0.407 1.00 74.32 H new ATOM 0 HE1 TYR A 28 -1.856 -12.035 4.385 1.00 52.42 H new ATOM 0 HE2 TYR A 28 1.189 -11.683 1.353 1.00 42.03 H new ATOM 0 HH TYR A 28 1.634 -12.072 3.516 1.00 62.30 H new ATOM 416 N THR A 29 -6.124 -11.271 -1.253 1.00 1.21 N ATOM 417 CA THR A 29 -7.203 -11.583 -2.197 1.00 24.21 C ATOM 418 C THR A 29 -8.042 -10.336 -2.548 1.00 72.42 C ATOM 419 O THR A 29 -9.254 -10.432 -2.764 1.00 53.32 O ATOM 420 CB THR A 29 -8.026 -12.773 -1.644 1.00 55.32 C ATOM 421 OG1 THR A 29 -9.106 -13.107 -2.500 1.00 55.31 O ATOM 422 CG2 THR A 29 -8.586 -12.551 -0.233 1.00 54.14 C ATOM 0 H THR A 29 -6.342 -11.570 -0.303 1.00 1.21 H new ATOM 0 HA THR A 29 -6.783 -11.895 -3.153 1.00 24.21 H new ATOM 0 HB THR A 29 -7.307 -13.591 -1.594 1.00 55.32 H new ATOM 0 HG1 THR A 29 -9.481 -12.289 -2.888 1.00 55.31 H new ATOM 0 HG21 THR A 29 -9.149 -13.431 0.078 1.00 54.14 H new ATOM 0 HG22 THR A 29 -7.764 -12.382 0.462 1.00 54.14 H new ATOM 0 HG23 THR A 29 -9.244 -11.682 -0.235 1.00 54.14 H new ATOM 430 N ARG A 30 -7.447 -9.143 -2.566 1.00 64.10 N ATOM 431 CA ARG A 30 -8.140 -7.881 -2.819 1.00 53.53 C ATOM 432 C ARG A 30 -7.206 -6.874 -3.489 1.00 75.20 C ATOM 433 O ARG A 30 -7.327 -5.672 -3.282 1.00 60.01 O ATOM 434 CB ARG A 30 -8.740 -7.363 -1.499 1.00 1.44 C ATOM 435 CG ARG A 30 -7.653 -6.983 -0.482 1.00 44.32 C ATOM 436 CD ARG A 30 -7.729 -5.518 -0.060 1.00 61.33 C ATOM 437 NE ARG A 30 -6.421 -5.016 0.394 1.00 21.01 N ATOM 438 CZ ARG A 30 -6.208 -3.754 0.782 1.00 3.53 C ATOM 439 NH1 ARG A 30 -7.227 -2.901 0.815 1.00 21.32 N ATOM 440 NH2 ARG A 30 -4.985 -3.344 1.115 1.00 73.34 N ATOM 0 H ARG A 30 -6.447 -9.025 -2.401 1.00 64.10 H new ATOM 0 HA ARG A 30 -8.962 -8.037 -3.518 1.00 53.53 H new ATOM 0 HB2 ARG A 30 -9.366 -6.494 -1.702 1.00 1.44 H new ATOM 0 HB3 ARG A 30 -9.386 -8.128 -1.070 1.00 1.44 H new ATOM 0 HG2 ARG A 30 -7.749 -7.617 0.400 1.00 44.32 H new ATOM 0 HG3 ARG A 30 -6.672 -7.183 -0.913 1.00 44.32 H new ATOM 0 HD2 ARG A 30 -8.080 -4.915 -0.898 1.00 61.33 H new ATOM 0 HD3 ARG A 30 -8.460 -5.407 0.741 1.00 61.33 H new ATOM 0 HE ARG A 30 -5.635 -5.666 0.414 1.00 21.01 H new ATOM 0 HH11 ARG A 30 -8.161 -3.211 0.546 1.00 21.32 H new ATOM 0 HH12 ARG A 30 -7.075 -1.936 1.109 1.00 21.32 H new ATOM 0 HH21 ARG A 30 -4.201 -3.995 1.075 1.00 73.34 H new ATOM 0 HH22 ARG A 30 -4.833 -2.379 1.410 1.00 73.34 H new ATOM 454 N VAL A 31 -6.213 -7.335 -4.237 1.00 4.41 N ATOM 455 CA VAL A 31 -5.275 -6.503 -4.965 1.00 52.42 C ATOM 456 C VAL A 31 -4.988 -7.131 -6.316 1.00 22.01 C ATOM 457 O VAL A 31 -4.773 -8.342 -6.403 1.00 32.45 O ATOM 458 CB VAL A 31 -4.067 -6.201 -4.073 1.00 22.35 C ATOM 459 CG1 VAL A 31 -3.505 -7.370 -3.279 1.00 40.11 C ATOM 460 CG2 VAL A 31 -2.948 -5.540 -4.891 1.00 53.44 C ATOM 0 H VAL A 31 -6.035 -8.332 -4.355 1.00 4.41 H new ATOM 0 HA VAL A 31 -5.685 -5.522 -5.206 1.00 52.42 H new ATOM 0 HB VAL A 31 -4.461 -5.520 -3.319 1.00 22.35 H new ATOM 0 HG11 VAL A 31 -2.654 -7.032 -2.687 1.00 40.11 H new ATOM 0 HG12 VAL A 31 -4.275 -7.763 -2.616 1.00 40.11 H new ATOM 0 HG13 VAL A 31 -3.182 -8.154 -3.964 1.00 40.11 H new ATOM 0 HG21 VAL A 31 -2.097 -5.332 -4.242 1.00 53.44 H new ATOM 0 HG22 VAL A 31 -2.638 -6.211 -5.692 1.00 53.44 H new ATOM 0 HG23 VAL A 31 -3.313 -4.607 -5.320 1.00 53.44 H new ATOM 470 N LYS A 32 -5.104 -6.321 -7.370 1.00 23.34 N ATOM 471 CA LYS A 32 -4.864 -6.768 -8.733 1.00 41.43 C ATOM 472 C LYS A 32 -3.360 -6.784 -8.952 1.00 72.24 C ATOM 473 O LYS A 32 -2.629 -6.111 -8.230 1.00 74.22 O ATOM 474 CB LYS A 32 -5.536 -5.802 -9.723 1.00 73.03 C ATOM 475 CG LYS A 32 -7.042 -6.041 -9.908 1.00 40.32 C ATOM 476 CD LYS A 32 -7.342 -7.384 -10.595 1.00 63.01 C ATOM 477 CE LYS A 32 -8.646 -7.389 -11.401 1.00 31.12 C ATOM 478 NZ LYS A 32 -8.602 -6.506 -12.588 1.00 61.04 N ATOM 0 H LYS A 32 -5.367 -5.338 -7.297 1.00 23.34 H new ATOM 0 HA LYS A 32 -5.281 -7.762 -8.894 1.00 41.43 H new ATOM 0 HB2 LYS A 32 -5.381 -4.780 -9.378 1.00 73.03 H new ATOM 0 HB3 LYS A 32 -5.043 -5.890 -10.691 1.00 73.03 H new ATOM 0 HG2 LYS A 32 -7.533 -6.016 -8.935 1.00 40.32 H new ATOM 0 HG3 LYS A 32 -7.466 -5.230 -10.500 1.00 40.32 H new ATOM 0 HD2 LYS A 32 -6.515 -7.635 -11.259 1.00 63.01 H new ATOM 0 HD3 LYS A 32 -7.391 -8.166 -9.837 1.00 63.01 H new ATOM 0 HE2 LYS A 32 -8.863 -8.408 -11.722 1.00 31.12 H new ATOM 0 HE3 LYS A 32 -9.466 -7.077 -10.754 1.00 31.12 H new ATOM 0 HZ1 LYS A 32 -9.386 -5.824 -12.543 1.00 61.04 H new ATOM 0 HZ2 LYS A 32 -7.697 -5.993 -12.606 1.00 61.04 H new ATOM 0 HZ3 LYS A 32 -8.692 -7.080 -13.451 1.00 61.04 H new ATOM 492 N PHE A 33 -2.907 -7.514 -9.966 1.00 35.03 N ATOM 493 CA PHE A 33 -1.531 -7.460 -10.431 1.00 74.34 C ATOM 494 C PHE A 33 -1.556 -7.539 -11.959 1.00 4.12 C ATOM 495 O PHE A 33 -2.408 -8.257 -12.500 1.00 62.42 O ATOM 496 CB PHE A 33 -0.694 -8.579 -9.796 1.00 64.40 C ATOM 497 CG PHE A 33 -0.294 -8.262 -8.372 1.00 43.40 C ATOM 498 CD1 PHE A 33 0.797 -7.406 -8.143 1.00 0.14 C ATOM 499 CD2 PHE A 33 -1.054 -8.732 -7.284 1.00 72.40 C ATOM 500 CE1 PHE A 33 1.127 -7.010 -6.841 1.00 72.24 C ATOM 501 CE2 PHE A 33 -0.746 -8.306 -5.980 1.00 3.51 C ATOM 502 CZ PHE A 33 0.321 -7.414 -5.767 1.00 13.51 C ATOM 0 H PHE A 33 -3.492 -8.164 -10.491 1.00 35.03 H new ATOM 0 HA PHE A 33 -1.055 -6.527 -10.129 1.00 74.34 H new ATOM 0 HB2 PHE A 33 -1.263 -9.509 -9.812 1.00 64.40 H new ATOM 0 HB3 PHE A 33 0.202 -8.743 -10.394 1.00 64.40 H new ATOM 0 HD1 PHE A 33 1.385 -7.051 -8.977 1.00 0.14 H new ATOM 0 HD2 PHE A 33 -1.871 -9.418 -7.451 1.00 72.40 H new ATOM 0 HE1 PHE A 33 1.998 -6.396 -6.665 1.00 72.24 H new ATOM 0 HE2 PHE A 33 -1.328 -8.663 -5.143 1.00 3.51 H new ATOM 0 HZ PHE A 33 0.520 -7.039 -4.774 1.00 13.51 H new ATOM 512 N PRO A 34 -0.636 -6.855 -12.666 1.00 22.32 N ATOM 513 CA PRO A 34 0.490 -6.074 -12.140 1.00 22.44 C ATOM 514 C PRO A 34 0.070 -4.763 -11.462 1.00 4.21 C ATOM 515 O PRO A 34 -1.109 -4.403 -11.497 1.00 41.43 O ATOM 516 CB PRO A 34 1.359 -5.789 -13.364 1.00 24.31 C ATOM 517 CG PRO A 34 0.355 -5.725 -14.511 1.00 34.15 C ATOM 518 CD PRO A 34 -0.652 -6.801 -14.119 1.00 12.13 C ATOM 0 HA PRO A 34 1.005 -6.629 -11.356 1.00 22.44 H new ATOM 0 HB2 PRO A 34 1.906 -4.852 -13.258 1.00 24.31 H new ATOM 0 HB3 PRO A 34 2.099 -6.574 -13.522 1.00 24.31 H new ATOM 0 HG2 PRO A 34 -0.110 -4.742 -14.591 1.00 34.15 H new ATOM 0 HG3 PRO A 34 0.822 -5.936 -15.473 1.00 34.15 H new ATOM 0 HD2 PRO A 34 -1.648 -6.557 -14.489 1.00 12.13 H new ATOM 0 HD3 PRO A 34 -0.380 -7.765 -14.548 1.00 12.13 H new ATOM 526 N LEU A 35 1.029 -4.063 -10.839 1.00 35.42 N ATOM 527 CA LEU A 35 0.825 -2.728 -10.276 1.00 3.12 C ATOM 528 C LEU A 35 1.539 -1.677 -11.122 1.00 13.22 C ATOM 529 O LEU A 35 2.301 -2.003 -12.037 1.00 32.03 O ATOM 530 CB LEU A 35 1.346 -2.657 -8.834 1.00 75.11 C ATOM 531 CG LEU A 35 0.735 -3.695 -7.887 1.00 33.23 C ATOM 532 CD1 LEU A 35 1.432 -3.575 -6.549 1.00 60.10 C ATOM 533 CD2 LEU A 35 -0.770 -3.583 -7.677 1.00 43.34 C ATOM 0 H LEU A 35 1.978 -4.415 -10.712 1.00 35.42 H new ATOM 0 HA LEU A 35 -0.246 -2.527 -10.277 1.00 3.12 H new ATOM 0 HB2 LEU A 35 2.428 -2.786 -8.845 1.00 75.11 H new ATOM 0 HB3 LEU A 35 1.148 -1.661 -8.438 1.00 75.11 H new ATOM 0 HG LEU A 35 0.885 -4.666 -8.359 1.00 33.23 H new ATOM 0 HD11 LEU A 35 1.015 -4.305 -5.855 1.00 60.10 H new ATOM 0 HD12 LEU A 35 2.498 -3.763 -6.676 1.00 60.10 H new ATOM 0 HD13 LEU A 35 1.286 -2.571 -6.151 1.00 60.10 H new ATOM 0 HD21 LEU A 35 -1.101 -4.363 -6.991 1.00 43.34 H new ATOM 0 HD22 LEU A 35 -1.007 -2.606 -7.257 1.00 43.34 H new ATOM 0 HD23 LEU A 35 -1.280 -3.700 -8.633 1.00 43.34 H new ATOM 545 N LYS A 36 1.294 -0.412 -10.781 1.00 41.50 N ATOM 546 CA LYS A 36 1.845 0.748 -11.490 1.00 2.31 C ATOM 547 C LYS A 36 3.265 1.087 -11.028 1.00 41.14 C ATOM 548 O LYS A 36 4.178 1.218 -11.848 1.00 33.22 O ATOM 549 CB LYS A 36 0.893 1.961 -11.393 1.00 31.41 C ATOM 550 CG LYS A 36 0.282 2.228 -10.007 1.00 11.52 C ATOM 551 CD LYS A 36 -0.521 3.530 -9.944 1.00 22.22 C ATOM 552 CE LYS A 36 -1.783 3.457 -10.802 1.00 61.14 C ATOM 553 NZ LYS A 36 -2.528 4.729 -10.768 1.00 54.51 N ATOM 0 H LYS A 36 0.698 -0.158 -9.993 1.00 41.50 H new ATOM 0 HA LYS A 36 1.925 0.480 -12.543 1.00 2.31 H new ATOM 0 HB2 LYS A 36 1.438 2.852 -11.706 1.00 31.41 H new ATOM 0 HB3 LYS A 36 0.080 1.818 -12.105 1.00 31.41 H new ATOM 0 HG2 LYS A 36 -0.367 1.395 -9.736 1.00 11.52 H new ATOM 0 HG3 LYS A 36 1.080 2.265 -9.266 1.00 11.52 H new ATOM 0 HD2 LYS A 36 -0.795 3.739 -8.910 1.00 22.22 H new ATOM 0 HD3 LYS A 36 0.102 4.358 -10.282 1.00 22.22 H new ATOM 0 HE2 LYS A 36 -1.513 3.219 -11.831 1.00 61.14 H new ATOM 0 HE3 LYS A 36 -2.422 2.649 -10.445 1.00 61.14 H new ATOM 0 HZ1 LYS A 36 -3.534 4.547 -10.959 1.00 54.51 H new ATOM 0 HZ2 LYS A 36 -2.427 5.165 -9.829 1.00 54.51 H new ATOM 0 HZ3 LYS A 36 -2.149 5.373 -11.492 1.00 54.51 H new ATOM 567 N THR A 37 3.450 1.235 -9.721 1.00 61.04 N ATOM 568 CA THR A 37 4.637 1.751 -9.052 1.00 2.42 C ATOM 569 C THR A 37 5.475 0.569 -8.552 1.00 20.32 C ATOM 570 O THR A 37 5.085 -0.025 -7.546 1.00 15.22 O ATOM 571 CB THR A 37 4.262 2.742 -7.935 1.00 24.13 C ATOM 572 OG1 THR A 37 3.043 3.401 -8.209 1.00 75.01 O ATOM 573 CG2 THR A 37 5.323 3.825 -7.808 1.00 75.14 C ATOM 0 H THR A 37 2.722 0.979 -9.054 1.00 61.04 H new ATOM 0 HA THR A 37 5.244 2.322 -9.755 1.00 2.42 H new ATOM 0 HB THR A 37 4.177 2.157 -7.020 1.00 24.13 H new ATOM 0 HG1 THR A 37 2.316 2.960 -7.722 1.00 75.01 H new ATOM 0 HG21 THR A 37 5.043 4.517 -7.014 1.00 75.14 H new ATOM 0 HG22 THR A 37 6.283 3.368 -7.569 1.00 75.14 H new ATOM 0 HG23 THR A 37 5.404 4.367 -8.750 1.00 75.14 H new ATOM 581 N PRO A 38 6.407 0.008 -9.345 1.00 12.55 N ATOM 582 CA PRO A 38 7.152 -1.191 -8.972 1.00 12.24 C ATOM 583 C PRO A 38 8.033 -0.952 -7.734 1.00 63.34 C ATOM 584 O PRO A 38 8.016 0.116 -7.134 1.00 71.13 O ATOM 585 CB PRO A 38 7.989 -1.516 -10.215 1.00 43.41 C ATOM 586 CG PRO A 38 8.344 -0.126 -10.735 1.00 44.20 C ATOM 587 CD PRO A 38 7.062 0.659 -10.471 1.00 53.42 C ATOM 0 HA PRO A 38 6.496 -2.015 -8.690 1.00 12.24 H new ATOM 0 HB2 PRO A 38 8.877 -2.097 -9.968 1.00 43.41 H new ATOM 0 HB3 PRO A 38 7.424 -2.093 -10.947 1.00 43.41 H new ATOM 0 HG2 PRO A 38 9.197 0.300 -10.207 1.00 44.20 H new ATOM 0 HG3 PRO A 38 8.600 -0.142 -11.794 1.00 44.20 H new ATOM 0 HD2 PRO A 38 7.285 1.701 -10.241 1.00 53.42 H new ATOM 0 HD3 PRO A 38 6.417 0.657 -11.350 1.00 53.42 H new ATOM 595 N ILE A 39 8.832 -1.955 -7.365 1.00 63.13 N ATOM 596 CA ILE A 39 9.951 -1.753 -6.449 1.00 14.22 C ATOM 597 C ILE A 39 10.915 -0.792 -7.133 1.00 60.04 C ATOM 598 O ILE A 39 11.172 -0.989 -8.327 1.00 11.23 O ATOM 599 CB ILE A 39 10.684 -3.090 -6.188 1.00 71.21 C ATOM 600 CG1 ILE A 39 9.748 -4.285 -5.906 1.00 51.24 C ATOM 601 CG2 ILE A 39 11.759 -2.942 -5.097 1.00 64.10 C ATOM 602 CD1 ILE A 39 8.697 -4.041 -4.830 1.00 60.54 C ATOM 0 H ILE A 39 8.723 -2.916 -7.688 1.00 63.13 H new ATOM 0 HA ILE A 39 9.594 -1.363 -5.496 1.00 14.22 H new ATOM 0 HB ILE A 39 11.180 -3.332 -7.128 1.00 71.21 H new ATOM 0 HG12 ILE A 39 9.242 -4.557 -6.832 1.00 51.24 H new ATOM 0 HG13 ILE A 39 10.355 -5.141 -5.612 1.00 51.24 H new ATOM 0 HG21 ILE A 39 12.253 -3.901 -4.940 1.00 64.10 H new ATOM 0 HG22 ILE A 39 12.495 -2.201 -5.410 1.00 64.10 H new ATOM 0 HG23 ILE A 39 11.291 -2.619 -4.167 1.00 64.10 H new ATOM 0 HD11 ILE A 39 8.090 -4.937 -4.705 1.00 60.54 H new ATOM 0 HD12 ILE A 39 9.190 -3.802 -3.888 1.00 60.54 H new ATOM 0 HD13 ILE A 39 8.059 -3.209 -5.127 1.00 60.54 H new ATOM 614 N THR A 40 11.536 0.105 -6.373 1.00 71.40 N ATOM 615 CA THR A 40 12.687 0.868 -6.825 1.00 64.21 C ATOM 616 C THR A 40 13.753 0.719 -5.744 1.00 24.14 C ATOM 617 O THR A 40 13.461 0.858 -4.557 1.00 32.41 O ATOM 618 CB THR A 40 12.312 2.341 -7.082 1.00 51.34 C ATOM 619 OG1 THR A 40 11.003 2.469 -7.604 1.00 3.13 O ATOM 620 CG2 THR A 40 13.276 2.961 -8.098 1.00 0.14 C ATOM 0 H THR A 40 11.249 0.322 -5.418 1.00 71.40 H new ATOM 0 HA THR A 40 13.063 0.496 -7.778 1.00 64.21 H new ATOM 0 HB THR A 40 12.370 2.852 -6.121 1.00 51.34 H new ATOM 0 HG1 THR A 40 10.489 3.092 -7.049 1.00 3.13 H new ATOM 0 HG21 THR A 40 13.002 4.001 -8.272 1.00 0.14 H new ATOM 0 HG22 THR A 40 14.293 2.914 -7.710 1.00 0.14 H new ATOM 0 HG23 THR A 40 13.220 2.409 -9.036 1.00 0.14 H new ATOM 628 N LEU A 41 14.981 0.375 -6.116 1.00 0.04 N ATOM 629 CA LEU A 41 16.119 0.471 -5.212 1.00 41.13 C ATOM 630 C LEU A 41 17.303 1.034 -5.982 1.00 54.44 C ATOM 631 O LEU A 41 17.371 0.913 -7.211 1.00 62.23 O ATOM 632 CB LEU A 41 16.450 -0.850 -4.500 1.00 75.41 C ATOM 633 CG LEU A 41 16.305 -2.146 -5.314 1.00 0.11 C ATOM 634 CD1 LEU A 41 17.331 -2.210 -6.442 1.00 73.22 C ATOM 635 CD2 LEU A 41 16.450 -3.337 -4.366 1.00 22.11 C ATOM 0 H LEU A 41 15.214 0.025 -7.045 1.00 0.04 H new ATOM 0 HA LEU A 41 15.859 1.150 -4.400 1.00 41.13 H new ATOM 0 HB2 LEU A 41 17.477 -0.791 -4.140 1.00 75.41 H new ATOM 0 HB3 LEU A 41 15.809 -0.930 -3.622 1.00 75.41 H new ATOM 0 HG LEU A 41 15.321 -2.171 -5.783 1.00 0.11 H new ATOM 0 HD11 LEU A 41 17.202 -3.138 -6.999 1.00 73.22 H new ATOM 0 HD12 LEU A 41 17.188 -1.362 -7.112 1.00 73.22 H new ATOM 0 HD13 LEU A 41 18.336 -2.175 -6.022 1.00 73.22 H new ATOM 0 HD21 LEU A 41 16.349 -4.265 -4.929 1.00 22.11 H new ATOM 0 HD22 LEU A 41 17.430 -3.306 -3.890 1.00 22.11 H new ATOM 0 HD23 LEU A 41 15.674 -3.290 -3.602 1.00 22.11 H new ATOM 647 N LEU A 42 18.243 1.627 -5.253 1.00 31.21 N ATOM 648 CA LEU A 42 19.503 2.063 -5.816 1.00 15.34 C ATOM 649 C LEU A 42 20.398 0.852 -6.008 1.00 55.45 C ATOM 650 O LEU A 42 20.652 0.080 -5.079 1.00 72.43 O ATOM 651 CB LEU A 42 20.194 3.103 -4.921 1.00 12.13 C ATOM 652 CG LEU A 42 20.047 4.555 -5.404 1.00 1.23 C ATOM 653 CD1 LEU A 42 20.660 4.717 -6.797 1.00 20.54 C ATOM 654 CD2 LEU A 42 18.594 5.043 -5.398 1.00 23.52 C ATOM 0 H LEU A 42 18.147 1.816 -4.255 1.00 31.21 H new ATOM 0 HA LEU A 42 19.311 2.542 -6.776 1.00 15.34 H new ATOM 0 HB2 LEU A 42 19.786 3.025 -3.913 1.00 12.13 H new ATOM 0 HB3 LEU A 42 21.255 2.860 -4.855 1.00 12.13 H new ATOM 0 HG LEU A 42 20.589 5.179 -4.694 1.00 1.23 H new ATOM 0 HD11 LEU A 42 20.548 5.750 -7.126 1.00 20.54 H new ATOM 0 HD12 LEU A 42 21.719 4.460 -6.761 1.00 20.54 H new ATOM 0 HD13 LEU A 42 20.150 4.056 -7.498 1.00 20.54 H new ATOM 0 HD21 LEU A 42 18.555 6.074 -5.749 1.00 23.52 H new ATOM 0 HD22 LEU A 42 17.996 4.413 -6.056 1.00 23.52 H new ATOM 0 HD23 LEU A 42 18.196 4.989 -4.385 1.00 23.52 H new ATOM 666 N ALA A 43 20.897 0.720 -7.230 1.00 71.42 N ATOM 667 CA ALA A 43 21.934 -0.213 -7.612 1.00 22.30 C ATOM 668 C ALA A 43 23.228 0.039 -6.838 1.00 74.42 C ATOM 669 O ALA A 43 23.412 1.084 -6.212 1.00 54.41 O ATOM 670 CB ALA A 43 22.221 -0.033 -9.100 1.00 24.32 C ATOM 0 H ALA A 43 20.572 1.288 -8.012 1.00 71.42 H new ATOM 0 HA ALA A 43 21.589 -1.223 -7.389 1.00 22.30 H new ATOM 0 HB1 ALA A 43 23.002 -0.729 -9.407 1.00 24.32 H new ATOM 0 HB2 ALA A 43 21.314 -0.230 -9.672 1.00 24.32 H new ATOM 0 HB3 ALA A 43 22.553 0.989 -9.286 1.00 24.32 H new ATOM 676 N ASP A 44 24.181 -0.875 -7.002 1.00 34.42 N ATOM 677 CA ASP A 44 25.525 -0.788 -6.439 1.00 53.24 C ATOM 678 C ASP A 44 26.281 0.435 -6.983 1.00 2.32 C ATOM 679 O ASP A 44 27.134 0.980 -6.281 1.00 13.10 O ATOM 680 CB ASP A 44 26.285 -2.085 -6.755 1.00 14.41 C ATOM 681 CG ASP A 44 25.874 -3.255 -5.865 1.00 22.31 C ATOM 682 OD1 ASP A 44 26.093 -3.174 -4.638 1.00 0.22 O ATOM 683 OD2 ASP A 44 25.364 -4.265 -6.406 1.00 73.21 O ATOM 0 H ASP A 44 24.034 -1.724 -7.548 1.00 34.42 H new ATOM 0 HA ASP A 44 25.450 -0.664 -5.359 1.00 53.24 H new ATOM 0 HB2 ASP A 44 26.115 -2.353 -7.798 1.00 14.41 H new ATOM 0 HB3 ASP A 44 27.355 -1.909 -6.641 1.00 14.41 H new ATOM 688 N ASP A 45 25.940 0.919 -8.187 1.00 40.24 N ATOM 689 CA ASP A 45 26.533 2.127 -8.794 1.00 35.21 C ATOM 690 C ASP A 45 26.004 3.430 -8.176 1.00 75.14 C ATOM 691 O ASP A 45 26.531 4.507 -8.450 1.00 44.24 O ATOM 692 CB ASP A 45 26.351 2.155 -10.310 1.00 4.23 C ATOM 693 CG ASP A 45 27.213 1.149 -11.075 1.00 40.35 C ATOM 694 OD1 ASP A 45 28.354 0.847 -10.653 1.00 60.34 O ATOM 695 OD2 ASP A 45 26.726 0.580 -12.082 1.00 34.23 O ATOM 0 H ASP A 45 25.235 0.478 -8.777 1.00 40.24 H new ATOM 0 HA ASP A 45 27.599 2.067 -8.573 1.00 35.21 H new ATOM 0 HB2 ASP A 45 25.303 1.964 -10.540 1.00 4.23 H new ATOM 0 HB3 ASP A 45 26.579 3.158 -10.671 1.00 4.23 H new ATOM 700 N GLY A 46 24.956 3.360 -7.350 1.00 33.30 N ATOM 701 CA GLY A 46 24.489 4.480 -6.542 1.00 15.14 C ATOM 702 C GLY A 46 23.757 5.587 -7.304 1.00 31.55 C ATOM 703 O GLY A 46 23.318 6.534 -6.656 1.00 62.21 O ATOM 0 H GLY A 46 24.404 2.511 -7.225 1.00 33.30 H new ATOM 0 HA2 GLY A 46 23.824 4.095 -5.769 1.00 15.14 H new ATOM 0 HA3 GLY A 46 25.347 4.920 -6.033 1.00 15.14 H new ATOM 707 N GLU A 47 23.557 5.445 -8.619 1.00 31.23 N ATOM 708 CA GLU A 47 22.826 6.387 -9.471 1.00 64.52 C ATOM 709 C GLU A 47 21.750 5.697 -10.323 1.00 75.34 C ATOM 710 O GLU A 47 21.226 6.295 -11.264 1.00 21.21 O ATOM 711 CB GLU A 47 23.814 7.149 -10.368 1.00 44.31 C ATOM 712 CG GLU A 47 24.624 6.219 -11.288 1.00 60.42 C ATOM 713 CD GLU A 47 25.230 6.966 -12.472 1.00 62.24 C ATOM 714 OE1 GLU A 47 25.858 8.031 -12.256 1.00 64.13 O ATOM 715 OE2 GLU A 47 25.063 6.511 -13.631 1.00 1.35 O ATOM 0 H GLU A 47 23.913 4.642 -9.137 1.00 31.23 H new ATOM 0 HA GLU A 47 22.307 7.088 -8.816 1.00 64.52 H new ATOM 0 HB2 GLU A 47 23.265 7.867 -10.977 1.00 44.31 H new ATOM 0 HB3 GLU A 47 24.499 7.720 -9.742 1.00 44.31 H new ATOM 0 HG2 GLU A 47 25.420 5.745 -10.713 1.00 60.42 H new ATOM 0 HG3 GLU A 47 23.978 5.422 -11.656 1.00 60.42 H new ATOM 722 N THR A 48 21.468 4.417 -10.080 1.00 62.20 N ATOM 723 CA THR A 48 20.676 3.583 -10.973 1.00 23.42 C ATOM 724 C THR A 48 19.512 2.995 -10.190 1.00 54.33 C ATOM 725 O THR A 48 19.687 2.111 -9.357 1.00 31.54 O ATOM 726 CB THR A 48 21.582 2.533 -11.631 1.00 14.12 C ATOM 727 OG1 THR A 48 22.654 3.166 -12.290 1.00 71.14 O ATOM 728 CG2 THR A 48 20.846 1.638 -12.625 1.00 75.34 C ATOM 0 H THR A 48 21.789 3.927 -9.245 1.00 62.20 H new ATOM 0 HA THR A 48 20.246 4.164 -11.789 1.00 23.42 H new ATOM 0 HB THR A 48 21.945 1.895 -10.826 1.00 14.12 H new ATOM 0 HG1 THR A 48 23.228 2.489 -12.706 1.00 71.14 H new ATOM 0 HG21 THR A 48 21.544 0.919 -13.053 1.00 75.34 H new ATOM 0 HG22 THR A 48 20.046 1.105 -12.111 1.00 75.34 H new ATOM 0 HG23 THR A 48 20.422 2.250 -13.421 1.00 75.34 H new ATOM 736 N GLU A 49 18.323 3.521 -10.456 1.00 61.41 N ATOM 737 CA GLU A 49 17.044 2.987 -10.022 1.00 15.43 C ATOM 738 C GLU A 49 16.844 1.646 -10.740 1.00 11.42 C ATOM 739 O GLU A 49 16.446 1.633 -11.909 1.00 52.33 O ATOM 740 CB GLU A 49 15.919 3.963 -10.426 1.00 2.31 C ATOM 741 CG GLU A 49 15.931 5.343 -9.748 1.00 60.32 C ATOM 742 CD GLU A 49 15.044 6.332 -10.515 1.00 64.40 C ATOM 743 OE1 GLU A 49 13.867 6.020 -10.802 1.00 60.04 O ATOM 744 OE2 GLU A 49 15.522 7.426 -10.908 1.00 40.10 O ATOM 0 H GLU A 49 18.223 4.373 -11.007 1.00 61.41 H new ATOM 0 HA GLU A 49 17.022 2.854 -8.940 1.00 15.43 H new ATOM 0 HB2 GLU A 49 15.968 4.112 -11.505 1.00 2.31 H new ATOM 0 HB3 GLU A 49 14.962 3.487 -10.214 1.00 2.31 H new ATOM 0 HG2 GLU A 49 15.578 5.252 -8.721 1.00 60.32 H new ATOM 0 HG3 GLU A 49 16.952 5.722 -9.702 1.00 60.32 H new ATOM 751 N LYS A 50 17.143 0.511 -10.104 1.00 73.33 N ATOM 752 CA LYS A 50 16.753 -0.790 -10.654 1.00 14.34 C ATOM 753 C LYS A 50 15.394 -1.163 -10.079 1.00 62.02 C ATOM 754 O LYS A 50 15.110 -0.902 -8.908 1.00 60.12 O ATOM 755 CB LYS A 50 17.794 -1.882 -10.375 1.00 72.53 C ATOM 756 CG LYS A 50 19.119 -1.663 -11.130 1.00 32.13 C ATOM 757 CD LYS A 50 19.890 -2.987 -11.304 1.00 14.01 C ATOM 758 CE LYS A 50 21.417 -2.894 -11.213 1.00 42.31 C ATOM 759 NZ LYS A 50 22.030 -1.949 -12.170 1.00 63.42 N ATOM 0 H LYS A 50 17.648 0.465 -9.219 1.00 73.33 H new ATOM 0 HA LYS A 50 16.693 -0.710 -11.739 1.00 14.34 H new ATOM 0 HB2 LYS A 50 17.995 -1.919 -9.304 1.00 72.53 H new ATOM 0 HB3 LYS A 50 17.379 -2.850 -10.655 1.00 72.53 H new ATOM 0 HG2 LYS A 50 18.915 -1.227 -12.108 1.00 32.13 H new ATOM 0 HG3 LYS A 50 19.737 -0.949 -10.585 1.00 32.13 H new ATOM 0 HD2 LYS A 50 19.543 -3.688 -10.545 1.00 14.01 H new ATOM 0 HD3 LYS A 50 19.629 -3.411 -12.274 1.00 14.01 H new ATOM 0 HE2 LYS A 50 21.691 -2.596 -10.201 1.00 42.31 H new ATOM 0 HE3 LYS A 50 21.840 -3.885 -11.379 1.00 42.31 H new ATOM 0 HZ1 LYS A 50 23.062 -1.946 -12.042 1.00 63.42 H new ATOM 0 HZ2 LYS A 50 21.802 -2.242 -13.141 1.00 63.42 H new ATOM 0 HZ3 LYS A 50 21.658 -0.993 -12.000 1.00 63.42 H new ATOM 773 N THR A 51 14.569 -1.808 -10.895 1.00 40.42 N ATOM 774 CA THR A 51 13.272 -2.311 -10.481 1.00 35.34 C ATOM 775 C THR A 51 13.392 -3.785 -10.086 1.00 35.22 C ATOM 776 O THR A 51 14.348 -4.465 -10.466 1.00 13.12 O ATOM 777 CB THR A 51 12.251 -2.056 -11.604 1.00 52.21 C ATOM 778 OG1 THR A 51 12.759 -2.474 -12.864 1.00 35.32 O ATOM 779 CG2 THR A 51 11.921 -0.566 -11.707 1.00 32.42 C ATOM 0 H THR A 51 14.788 -1.997 -11.873 1.00 40.42 H new ATOM 0 HA THR A 51 12.912 -1.785 -9.597 1.00 35.34 H new ATOM 0 HB THR A 51 11.357 -2.627 -11.355 1.00 52.21 H new ATOM 0 HG1 THR A 51 12.090 -2.302 -13.560 1.00 35.32 H new ATOM 0 HG21 THR A 51 11.198 -0.408 -12.507 1.00 32.42 H new ATOM 0 HG22 THR A 51 11.499 -0.221 -10.763 1.00 32.42 H new ATOM 0 HG23 THR A 51 12.831 -0.006 -11.925 1.00 32.42 H new ATOM 787 N PHE A 52 12.427 -4.296 -9.321 1.00 32.33 N ATOM 788 CA PHE A 52 12.337 -5.686 -8.862 1.00 64.25 C ATOM 789 C PHE A 52 10.854 -6.117 -8.907 1.00 64.01 C ATOM 790 O PHE A 52 9.972 -5.260 -9.051 1.00 75.03 O ATOM 791 CB PHE A 52 12.956 -5.815 -7.449 1.00 51.31 C ATOM 792 CG PHE A 52 14.402 -6.293 -7.393 1.00 3.03 C ATOM 793 CD1 PHE A 52 15.460 -5.408 -7.680 1.00 3.40 C ATOM 794 CD2 PHE A 52 14.706 -7.607 -6.978 1.00 72.13 C ATOM 795 CE1 PHE A 52 16.797 -5.829 -7.553 1.00 71.41 C ATOM 796 CE2 PHE A 52 16.043 -8.018 -6.830 1.00 31.53 C ATOM 797 CZ PHE A 52 17.091 -7.124 -7.097 1.00 0.00 C ATOM 0 H PHE A 52 11.649 -3.727 -8.988 1.00 32.33 H new ATOM 0 HA PHE A 52 12.905 -6.352 -9.512 1.00 64.25 H new ATOM 0 HB2 PHE A 52 12.896 -4.844 -6.958 1.00 51.31 H new ATOM 0 HB3 PHE A 52 12.344 -6.504 -6.868 1.00 51.31 H new ATOM 0 HD1 PHE A 52 15.244 -4.399 -8.000 1.00 3.40 H new ATOM 0 HD2 PHE A 52 13.906 -8.303 -6.772 1.00 72.13 H new ATOM 0 HE1 PHE A 52 17.600 -5.153 -7.807 1.00 71.41 H new ATOM 0 HE2 PHE A 52 16.264 -9.025 -6.510 1.00 31.53 H new ATOM 0 HZ PHE A 52 18.117 -7.430 -6.953 1.00 0.00 H new ATOM 807 N PRO A 53 10.535 -7.422 -8.823 1.00 71.45 N ATOM 808 CA PRO A 53 9.166 -7.917 -8.947 1.00 20.13 C ATOM 809 C PRO A 53 8.333 -7.604 -7.696 1.00 21.24 C ATOM 810 O PRO A 53 8.758 -7.913 -6.580 1.00 20.30 O ATOM 811 CB PRO A 53 9.309 -9.428 -9.178 1.00 33.12 C ATOM 812 CG PRO A 53 10.633 -9.789 -8.516 1.00 74.04 C ATOM 813 CD PRO A 53 11.468 -8.539 -8.776 1.00 1.22 C ATOM 0 HA PRO A 53 8.633 -7.434 -9.766 1.00 20.13 H new ATOM 0 HB2 PRO A 53 8.480 -9.978 -8.734 1.00 33.12 H new ATOM 0 HB3 PRO A 53 9.318 -9.668 -10.241 1.00 33.12 H new ATOM 0 HG2 PRO A 53 10.516 -9.987 -7.451 1.00 74.04 H new ATOM 0 HG3 PRO A 53 11.081 -10.679 -8.958 1.00 74.04 H new ATOM 0 HD2 PRO A 53 12.207 -8.395 -7.988 1.00 1.22 H new ATOM 0 HD3 PRO A 53 12.016 -8.627 -9.714 1.00 1.22 H new ATOM 821 N PHE A 54 7.134 -7.045 -7.890 1.00 72.01 N ATOM 822 CA PHE A 54 6.099 -6.735 -6.889 1.00 61.32 C ATOM 823 C PHE A 54 5.290 -7.994 -6.500 1.00 35.03 C ATOM 824 O PHE A 54 4.061 -7.997 -6.406 1.00 15.53 O ATOM 825 CB PHE A 54 5.242 -5.566 -7.425 1.00 15.42 C ATOM 826 CG PHE A 54 4.912 -5.629 -8.902 1.00 44.40 C ATOM 827 CD1 PHE A 54 4.028 -6.608 -9.383 1.00 4.41 C ATOM 828 CD2 PHE A 54 5.532 -4.741 -9.799 1.00 41.22 C ATOM 829 CE1 PHE A 54 3.781 -6.711 -10.761 1.00 40.12 C ATOM 830 CE2 PHE A 54 5.267 -4.829 -11.176 1.00 73.30 C ATOM 831 CZ PHE A 54 4.404 -5.827 -11.659 1.00 42.22 C ATOM 0 H PHE A 54 6.835 -6.774 -8.827 1.00 72.01 H new ATOM 0 HA PHE A 54 6.552 -6.411 -5.952 1.00 61.32 H new ATOM 0 HB2 PHE A 54 4.309 -5.533 -6.862 1.00 15.42 H new ATOM 0 HB3 PHE A 54 5.767 -4.632 -7.226 1.00 15.42 H new ATOM 0 HD1 PHE A 54 3.539 -7.281 -8.694 1.00 4.41 H new ATOM 0 HD2 PHE A 54 6.214 -3.990 -9.429 1.00 41.22 H new ATOM 0 HE1 PHE A 54 3.110 -7.472 -11.132 1.00 40.12 H new ATOM 0 HE2 PHE A 54 5.725 -4.131 -11.861 1.00 73.30 H new ATOM 0 HZ PHE A 54 4.219 -5.915 -12.719 1.00 42.22 H new ATOM 841 N THR A 55 5.982 -9.109 -6.311 1.00 15.41 N ATOM 842 CA THR A 55 5.446 -10.388 -5.866 1.00 14.30 C ATOM 843 C THR A 55 4.891 -10.302 -4.436 1.00 21.03 C ATOM 844 O THR A 55 5.314 -9.441 -3.653 1.00 11.52 O ATOM 845 CB THR A 55 6.579 -11.426 -5.985 1.00 75.01 C ATOM 846 OG1 THR A 55 7.824 -10.827 -5.666 1.00 32.03 O ATOM 847 CG2 THR A 55 6.653 -11.948 -7.419 1.00 73.14 C ATOM 0 H THR A 55 6.988 -9.147 -6.473 1.00 15.41 H new ATOM 0 HA THR A 55 4.602 -10.684 -6.489 1.00 14.30 H new ATOM 0 HB THR A 55 6.372 -12.244 -5.295 1.00 75.01 H new ATOM 0 HG1 THR A 55 8.485 -11.526 -5.480 1.00 32.03 H new ATOM 0 HG21 THR A 55 7.455 -12.681 -7.498 1.00 73.14 H new ATOM 0 HG22 THR A 55 5.705 -12.417 -7.685 1.00 73.14 H new ATOM 0 HG23 THR A 55 6.851 -11.119 -8.098 1.00 73.14 H new ATOM 855 N LYS A 56 4.026 -11.264 -4.062 1.00 44.34 N ATOM 856 CA LYS A 56 3.488 -11.478 -2.706 1.00 34.32 C ATOM 857 C LYS A 56 4.567 -11.502 -1.625 1.00 54.35 C ATOM 858 O LYS A 56 4.264 -11.230 -0.471 1.00 2.11 O ATOM 859 CB LYS A 56 2.686 -12.793 -2.646 1.00 51.51 C ATOM 860 CG LYS A 56 1.169 -12.625 -2.823 1.00 1.21 C ATOM 861 CD LYS A 56 0.717 -12.210 -4.227 1.00 61.02 C ATOM 862 CE LYS A 56 -0.800 -12.412 -4.337 1.00 1.13 C ATOM 863 NZ LYS A 56 -1.348 -11.934 -5.619 1.00 64.44 N ATOM 0 H LYS A 56 3.666 -11.946 -4.730 1.00 44.34 H new ATOM 0 HA LYS A 56 2.839 -10.626 -2.502 1.00 34.32 H new ATOM 0 HB2 LYS A 56 3.057 -13.465 -3.420 1.00 51.51 H new ATOM 0 HB3 LYS A 56 2.876 -13.276 -1.687 1.00 51.51 H new ATOM 0 HG2 LYS A 56 0.683 -13.566 -2.566 1.00 1.21 H new ATOM 0 HG3 LYS A 56 0.817 -11.879 -2.110 1.00 1.21 H new ATOM 0 HD2 LYS A 56 0.974 -11.167 -4.413 1.00 61.02 H new ATOM 0 HD3 LYS A 56 1.233 -12.805 -4.981 1.00 61.02 H new ATOM 0 HE2 LYS A 56 -1.030 -13.471 -4.221 1.00 1.13 H new ATOM 0 HE3 LYS A 56 -1.292 -11.887 -3.518 1.00 1.13 H new ATOM 0 HZ1 LYS A 56 -2.382 -12.048 -5.619 1.00 64.44 H new ATOM 0 HZ2 LYS A 56 -1.111 -10.929 -5.745 1.00 64.44 H new ATOM 0 HZ3 LYS A 56 -0.939 -12.487 -6.399 1.00 64.44 H new ATOM 877 N GLU A 57 5.817 -11.813 -2.001 1.00 64.43 N ATOM 878 CA GLU A 57 7.001 -11.703 -1.165 1.00 23.10 C ATOM 879 C GLU A 57 6.984 -10.371 -0.408 1.00 54.23 C ATOM 880 O GLU A 57 6.803 -10.334 0.797 1.00 11.22 O ATOM 881 CB GLU A 57 8.252 -11.800 -2.046 1.00 44.45 C ATOM 882 CG GLU A 57 8.471 -13.152 -2.736 1.00 4.10 C ATOM 883 CD GLU A 57 9.675 -13.094 -3.684 1.00 21.23 C ATOM 884 OE1 GLU A 57 9.710 -12.196 -4.558 1.00 62.12 O ATOM 885 OE2 GLU A 57 10.579 -13.956 -3.597 1.00 33.51 O ATOM 0 H GLU A 57 6.029 -12.161 -2.936 1.00 64.43 H new ATOM 0 HA GLU A 57 7.012 -12.514 -0.437 1.00 23.10 H new ATOM 0 HB2 GLU A 57 8.197 -11.026 -2.811 1.00 44.45 H new ATOM 0 HB3 GLU A 57 9.125 -11.580 -1.432 1.00 44.45 H new ATOM 0 HG2 GLU A 57 8.631 -13.926 -1.985 1.00 4.10 H new ATOM 0 HG3 GLU A 57 7.577 -13.429 -3.294 1.00 4.10 H new ATOM 892 N LYS A 58 7.091 -9.245 -1.139 1.00 0.01 N ATOM 893 CA LYS A 58 7.142 -7.916 -0.543 1.00 12.31 C ATOM 894 C LYS A 58 5.747 -7.300 -0.542 1.00 74.14 C ATOM 895 O LYS A 58 5.503 -6.263 -1.163 1.00 44.30 O ATOM 896 CB LYS A 58 8.221 -7.052 -1.211 1.00 40.40 C ATOM 897 CG LYS A 58 8.095 -6.866 -2.717 1.00 61.41 C ATOM 898 CD LYS A 58 9.377 -7.327 -3.417 1.00 20.51 C ATOM 899 CE LYS A 58 9.385 -8.857 -3.495 1.00 52.04 C ATOM 900 NZ LYS A 58 10.213 -9.389 -4.590 1.00 71.52 N ATOM 0 H LYS A 58 7.144 -9.242 -2.158 1.00 0.01 H new ATOM 0 HA LYS A 58 7.448 -7.984 0.501 1.00 12.31 H new ATOM 0 HB2 LYS A 58 8.211 -6.068 -0.742 1.00 40.40 H new ATOM 0 HB3 LYS A 58 9.194 -7.496 -1.001 1.00 40.40 H new ATOM 0 HG2 LYS A 58 7.243 -7.435 -3.091 1.00 61.41 H new ATOM 0 HG3 LYS A 58 7.904 -5.818 -2.946 1.00 61.41 H new ATOM 0 HD2 LYS A 58 9.433 -6.899 -4.418 1.00 20.51 H new ATOM 0 HD3 LYS A 58 10.251 -6.974 -2.870 1.00 20.51 H new ATOM 0 HE2 LYS A 58 9.748 -9.258 -2.549 1.00 52.04 H new ATOM 0 HE3 LYS A 58 8.362 -9.211 -3.620 1.00 52.04 H new ATOM 0 HZ1 LYS A 58 10.105 -10.422 -4.636 1.00 71.52 H new ATOM 0 HZ2 LYS A 58 9.909 -8.969 -5.491 1.00 71.52 H new ATOM 0 HZ3 LYS A 58 11.211 -9.152 -4.417 1.00 71.52 H new ATOM 914 N TRP A 59 4.827 -7.984 0.126 1.00 41.30 N ATOM 915 CA TRP A 59 3.545 -7.457 0.564 1.00 60.44 C ATOM 916 C TRP A 59 3.566 -7.418 2.095 1.00 2.05 C ATOM 917 O TRP A 59 3.293 -8.452 2.712 1.00 33.14 O ATOM 918 CB TRP A 59 2.335 -8.212 0.005 1.00 60.31 C ATOM 919 CG TRP A 59 1.058 -7.480 0.298 1.00 33.41 C ATOM 920 CD1 TRP A 59 0.467 -7.425 1.513 1.00 21.55 C ATOM 921 CD2 TRP A 59 0.308 -6.549 -0.547 1.00 35.15 C ATOM 922 NE1 TRP A 59 -0.599 -6.550 1.476 1.00 24.33 N ATOM 923 CE2 TRP A 59 -0.776 -6.024 0.221 1.00 44.53 C ATOM 924 CE3 TRP A 59 0.471 -6.027 -1.850 1.00 20.25 C ATOM 925 CZ2 TRP A 59 -1.679 -5.087 -0.291 1.00 13.34 C ATOM 926 CZ3 TRP A 59 -0.413 -5.053 -2.358 1.00 44.13 C ATOM 927 CH2 TRP A 59 -1.499 -4.610 -1.592 1.00 74.12 C ATOM 0 H TRP A 59 4.961 -8.961 0.387 1.00 41.30 H new ATOM 0 HA TRP A 59 3.417 -6.453 0.161 1.00 60.44 H new ATOM 0 HB2 TRP A 59 2.447 -8.338 -1.072 1.00 60.31 H new ATOM 0 HB3 TRP A 59 2.293 -9.211 0.440 1.00 60.31 H new ATOM 0 HD1 TRP A 59 0.782 -7.983 2.382 1.00 21.55 H new ATOM 0 HE1 TRP A 59 -1.183 -6.322 2.281 1.00 24.33 H new ATOM 0 HE3 TRP A 59 1.285 -6.379 -2.466 1.00 20.25 H new ATOM 0 HZ2 TRP A 59 -2.504 -4.737 0.311 1.00 13.34 H new ATOM 0 HZ3 TRP A 59 -0.252 -4.645 -3.345 1.00 44.13 H new ATOM 0 HH2 TRP A 59 -2.198 -3.899 -2.007 1.00 74.12 H new ATOM 938 N PRO A 60 4.055 -6.339 2.728 1.00 61.50 N ATOM 939 CA PRO A 60 3.883 -6.161 4.160 1.00 15.44 C ATOM 940 C PRO A 60 2.386 -5.985 4.453 1.00 60.24 C ATOM 941 O PRO A 60 1.626 -5.532 3.591 1.00 24.31 O ATOM 942 CB PRO A 60 4.689 -4.910 4.511 1.00 21.31 C ATOM 943 CG PRO A 60 4.552 -4.065 3.252 1.00 15.13 C ATOM 944 CD PRO A 60 4.490 -5.094 2.120 1.00 20.43 C ATOM 0 HA PRO A 60 4.228 -7.009 4.751 1.00 15.44 H new ATOM 0 HB2 PRO A 60 4.287 -4.401 5.387 1.00 21.31 H new ATOM 0 HB3 PRO A 60 5.730 -5.146 4.730 1.00 21.31 H new ATOM 0 HG2 PRO A 60 3.653 -3.449 3.281 1.00 15.13 H new ATOM 0 HG3 PRO A 60 5.398 -3.389 3.131 1.00 15.13 H new ATOM 0 HD2 PRO A 60 3.795 -4.776 1.343 1.00 20.43 H new ATOM 0 HD3 PRO A 60 5.465 -5.212 1.647 1.00 20.43 H new ATOM 952 N LEU A 61 1.942 -6.363 5.646 1.00 75.44 N ATOM 953 CA LEU A 61 0.568 -6.133 6.077 1.00 31.12 C ATOM 954 C LEU A 61 0.462 -4.658 6.466 1.00 72.50 C ATOM 955 O LEU A 61 1.219 -4.203 7.320 1.00 0.22 O ATOM 956 CB LEU A 61 0.211 -7.086 7.231 1.00 21.33 C ATOM 957 CG LEU A 61 0.072 -8.551 6.757 1.00 15.23 C ATOM 958 CD1 LEU A 61 0.082 -9.528 7.935 1.00 31.35 C ATOM 959 CD2 LEU A 61 -1.205 -8.767 5.936 1.00 31.53 C ATOM 0 H LEU A 61 2.522 -6.836 6.340 1.00 75.44 H new ATOM 0 HA LEU A 61 -0.149 -6.343 5.284 1.00 31.12 H new ATOM 0 HB2 LEU A 61 0.981 -7.026 8.000 1.00 21.33 H new ATOM 0 HB3 LEU A 61 -0.724 -6.764 7.690 1.00 21.33 H new ATOM 0 HG LEU A 61 0.936 -8.749 6.122 1.00 15.23 H new ATOM 0 HD11 LEU A 61 -0.018 -10.548 7.563 1.00 31.35 H new ATOM 0 HD12 LEU A 61 1.021 -9.431 8.480 1.00 31.35 H new ATOM 0 HD13 LEU A 61 -0.750 -9.302 8.602 1.00 31.35 H new ATOM 0 HD21 LEU A 61 -1.264 -9.809 5.623 1.00 31.53 H new ATOM 0 HD22 LEU A 61 -2.075 -8.521 6.545 1.00 31.53 H new ATOM 0 HD23 LEU A 61 -1.185 -8.124 5.056 1.00 31.53 H new ATOM 971 N LEU A 62 -0.393 -3.896 5.775 1.00 4.13 N ATOM 972 CA LEU A 62 -0.715 -2.507 6.132 1.00 43.03 C ATOM 973 C LEU A 62 -1.604 -2.478 7.374 1.00 33.35 C ATOM 974 O LEU A 62 -2.106 -3.529 7.783 1.00 71.34 O ATOM 975 CB LEU A 62 -1.408 -1.785 4.955 1.00 35.44 C ATOM 976 CG LEU A 62 -0.540 -0.659 4.373 1.00 51.30 C ATOM 977 CD1 LEU A 62 0.643 -1.243 3.605 1.00 33.22 C ATOM 978 CD2 LEU A 62 -1.362 0.213 3.419 1.00 20.55 C ATOM 0 H LEU A 62 -0.886 -4.227 4.946 1.00 4.13 H new ATOM 0 HA LEU A 62 0.214 -1.982 6.352 1.00 43.03 H new ATOM 0 HB2 LEU A 62 -1.636 -2.508 4.171 1.00 35.44 H new ATOM 0 HB3 LEU A 62 -2.358 -1.371 5.293 1.00 35.44 H new ATOM 0 HG LEU A 62 -0.177 -0.052 5.203 1.00 51.30 H new ATOM 0 HD11 LEU A 62 1.249 -0.433 3.199 1.00 33.22 H new ATOM 0 HD12 LEU A 62 1.251 -1.848 4.278 1.00 33.22 H new ATOM 0 HD13 LEU A 62 0.276 -1.866 2.789 1.00 33.22 H new ATOM 0 HD21 LEU A 62 -0.731 1.006 3.016 1.00 20.55 H new ATOM 0 HD22 LEU A 62 -1.741 -0.400 2.601 1.00 20.55 H new ATOM 0 HD23 LEU A 62 -2.199 0.655 3.960 1.00 20.55 H new ATOM 990 N ASP A 63 -1.881 -1.288 7.913 1.00 24.13 N ATOM 991 CA ASP A 63 -2.597 -1.067 9.174 1.00 45.12 C ATOM 992 C ASP A 63 -3.641 0.041 9.007 1.00 73.52 C ATOM 993 O ASP A 63 -3.623 0.774 8.015 1.00 52.10 O ATOM 994 CB ASP A 63 -1.630 -0.652 10.293 1.00 24.15 C ATOM 995 CG ASP A 63 -0.494 -1.634 10.553 1.00 70.23 C ATOM 996 OD1 ASP A 63 0.532 -1.547 9.845 1.00 1.43 O ATOM 997 OD2 ASP A 63 -0.584 -2.438 11.511 1.00 52.42 O ATOM 0 H ASP A 63 -1.601 -0.415 7.465 1.00 24.13 H new ATOM 0 HA ASP A 63 -3.082 -2.006 9.441 1.00 45.12 H new ATOM 0 HB2 ASP A 63 -1.202 0.319 10.043 1.00 24.15 H new ATOM 0 HB3 ASP A 63 -2.197 -0.522 11.215 1.00 24.15 H new ATOM 1002 N SER A 64 -4.533 0.199 9.994 1.00 22.55 N ATOM 1003 CA SER A 64 -5.522 1.275 10.035 1.00 65.42 C ATOM 1004 C SER A 64 -4.839 2.616 10.290 1.00 53.24 C ATOM 1005 O SER A 64 -5.153 3.597 9.614 1.00 63.50 O ATOM 1006 CB SER A 64 -6.598 0.990 11.102 1.00 45.10 C ATOM 1007 OG SER A 64 -7.899 1.407 10.711 1.00 25.41 O ATOM 0 H SER A 64 -4.585 -0.428 10.796 1.00 22.55 H new ATOM 0 HA SER A 64 -6.019 1.324 9.066 1.00 65.42 H new ATOM 0 HB2 SER A 64 -6.615 -0.079 11.315 1.00 45.10 H new ATOM 0 HB3 SER A 64 -6.325 1.495 12.028 1.00 45.10 H new ATOM 0 HG SER A 64 -8.537 1.199 11.425 1.00 25.41 H new ATOM 1013 N GLU A 65 -3.927 2.674 11.260 1.00 13.03 N ATOM 1014 CA GLU A 65 -3.331 3.918 11.743 1.00 5.24 C ATOM 1015 C GLU A 65 -2.429 4.587 10.691 1.00 25.42 C ATOM 1016 O GLU A 65 -2.127 5.776 10.813 1.00 34.25 O ATOM 1017 CB GLU A 65 -2.628 3.660 13.084 1.00 63.41 C ATOM 1018 CG GLU A 65 -3.605 3.217 14.200 1.00 50.30 C ATOM 1019 CD GLU A 65 -4.245 4.366 14.990 1.00 31.32 C ATOM 1020 OE1 GLU A 65 -3.530 5.266 15.487 1.00 14.23 O ATOM 1021 OE2 GLU A 65 -5.487 4.378 15.170 1.00 54.12 O ATOM 0 H GLU A 65 -3.576 1.845 11.739 1.00 13.03 H new ATOM 0 HA GLU A 65 -4.123 4.646 11.919 1.00 5.24 H new ATOM 0 HB2 GLU A 65 -1.867 2.891 12.948 1.00 63.41 H new ATOM 0 HB3 GLU A 65 -2.112 4.567 13.399 1.00 63.41 H new ATOM 0 HG2 GLU A 65 -4.397 2.617 13.752 1.00 50.30 H new ATOM 0 HG3 GLU A 65 -3.070 2.570 14.896 1.00 50.30 H new ATOM 1028 N THR A 66 -2.083 3.856 9.630 1.00 14.45 N ATOM 1029 CA THR A 66 -1.325 4.282 8.460 1.00 32.31 C ATOM 1030 C THR A 66 -2.237 4.800 7.337 1.00 13.21 C ATOM 1031 O THR A 66 -1.762 5.121 6.243 1.00 54.11 O ATOM 1032 CB THR A 66 -0.500 3.055 8.004 1.00 73.41 C ATOM 1033 OG1 THR A 66 0.077 2.419 9.130 1.00 31.14 O ATOM 1034 CG2 THR A 66 0.625 3.361 7.011 1.00 62.13 C ATOM 0 H THR A 66 -2.348 2.873 9.565 1.00 14.45 H new ATOM 0 HA THR A 66 -0.675 5.120 8.710 1.00 32.31 H new ATOM 0 HB THR A 66 -1.215 2.416 7.485 1.00 73.41 H new ATOM 0 HG1 THR A 66 0.597 1.642 8.836 1.00 31.14 H new ATOM 0 HG21 THR A 66 1.144 2.438 6.753 1.00 62.13 H new ATOM 0 HG22 THR A 66 0.203 3.805 6.109 1.00 62.13 H new ATOM 0 HG23 THR A 66 1.330 4.059 7.463 1.00 62.13 H new ATOM 1042 N MET A 67 -3.553 4.868 7.556 1.00 12.21 N ATOM 1043 CA MET A 67 -4.521 5.170 6.505 1.00 2.02 C ATOM 1044 C MET A 67 -5.443 6.318 6.930 1.00 31.32 C ATOM 1045 O MET A 67 -6.635 6.332 6.625 1.00 53.10 O ATOM 1046 CB MET A 67 -5.222 3.856 6.069 1.00 5.04 C ATOM 1047 CG MET A 67 -4.971 3.519 4.588 1.00 50.14 C ATOM 1048 SD MET A 67 -6.383 3.627 3.448 1.00 50.21 S ATOM 1049 CE MET A 67 -6.950 5.304 3.815 1.00 14.15 C ATOM 0 H MET A 67 -3.976 4.714 8.471 1.00 12.21 H new ATOM 0 HA MET A 67 -4.032 5.551 5.609 1.00 2.02 H new ATOM 0 HB2 MET A 67 -4.866 3.034 6.691 1.00 5.04 H new ATOM 0 HB3 MET A 67 -6.295 3.945 6.242 1.00 5.04 H new ATOM 0 HG2 MET A 67 -4.191 4.185 4.220 1.00 50.14 H new ATOM 0 HG3 MET A 67 -4.575 2.505 4.537 1.00 50.14 H new ATOM 0 HE1 MET A 67 -7.343 5.762 2.907 1.00 14.15 H new ATOM 0 HE2 MET A 67 -7.734 5.266 4.571 1.00 14.15 H new ATOM 0 HE3 MET A 67 -6.115 5.897 4.188 1.00 14.15 H new ATOM 1059 N LYS A 68 -4.919 7.284 7.694 1.00 53.23 N ATOM 1060 CA LYS A 68 -5.748 8.298 8.389 1.00 64.34 C ATOM 1061 C LYS A 68 -5.284 9.712 8.108 1.00 62.13 C ATOM 1062 O LYS A 68 -5.669 10.650 8.821 1.00 2.32 O ATOM 1063 CB LYS A 68 -5.675 8.036 9.900 1.00 71.13 C ATOM 1064 CG LYS A 68 -5.713 6.548 10.198 1.00 51.02 C ATOM 1065 CD LYS A 68 -6.344 6.086 11.507 1.00 11.21 C ATOM 1066 CE LYS A 68 -5.798 6.713 12.802 1.00 24.42 C ATOM 1067 NZ LYS A 68 -6.206 8.121 12.996 1.00 24.25 N ATOM 0 H LYS A 68 -3.917 7.392 7.852 1.00 53.23 H new ATOM 0 HA LYS A 68 -6.770 8.209 8.020 1.00 64.34 H new ATOM 0 HB2 LYS A 68 -4.759 8.468 10.303 1.00 71.13 H new ATOM 0 HB3 LYS A 68 -6.508 8.532 10.399 1.00 71.13 H new ATOM 0 HG2 LYS A 68 -6.246 6.060 9.382 1.00 51.02 H new ATOM 0 HG3 LYS A 68 -4.688 6.179 10.175 1.00 51.02 H new ATOM 0 HD2 LYS A 68 -7.414 6.287 11.457 1.00 11.21 H new ATOM 0 HD3 LYS A 68 -6.226 5.005 11.578 1.00 11.21 H new ATOM 0 HE2 LYS A 68 -6.140 6.124 13.653 1.00 24.42 H new ATOM 0 HE3 LYS A 68 -4.709 6.657 12.792 1.00 24.42 H new ATOM 0 HZ1 LYS A 68 -6.205 8.346 14.011 1.00 24.25 H new ATOM 0 HZ2 LYS A 68 -5.538 8.747 12.502 1.00 24.25 H new ATOM 0 HZ3 LYS A 68 -7.162 8.262 12.611 1.00 24.25 H new ATOM 1081 N GLU A 69 -4.598 9.825 6.992 1.00 73.14 N ATOM 1082 CA GLU A 69 -3.749 10.886 6.482 1.00 53.20 C ATOM 1083 C GLU A 69 -2.799 11.457 7.553 1.00 41.10 C ATOM 1084 O GLU A 69 -3.063 11.411 8.755 1.00 53.11 O ATOM 1085 CB GLU A 69 -4.663 11.947 5.894 1.00 21.43 C ATOM 1086 CG GLU A 69 -5.515 11.564 4.667 1.00 23.11 C ATOM 1087 CD GLU A 69 -6.085 12.803 3.977 1.00 21.35 C ATOM 1088 OE1 GLU A 69 -6.631 13.696 4.673 1.00 53.43 O ATOM 1089 OE2 GLU A 69 -5.996 12.866 2.737 1.00 43.23 O ATOM 0 H GLU A 69 -4.627 9.059 6.320 1.00 73.14 H new ATOM 0 HA GLU A 69 -3.084 10.492 5.714 1.00 53.20 H new ATOM 0 HB2 GLU A 69 -5.340 12.279 6.681 1.00 21.43 H new ATOM 0 HB3 GLU A 69 -4.048 12.804 5.620 1.00 21.43 H new ATOM 0 HG2 GLU A 69 -4.906 11.000 3.961 1.00 23.11 H new ATOM 0 HG3 GLU A 69 -6.330 10.911 4.978 1.00 23.11 H new ATOM 1096 N GLU A 70 -1.680 12.056 7.127 1.00 22.11 N ATOM 1097 CA GLU A 70 -0.787 12.767 8.027 1.00 34.42 C ATOM 1098 C GLU A 70 -0.149 13.956 7.298 1.00 65.33 C ATOM 1099 O GLU A 70 -0.177 14.032 6.057 1.00 12.14 O ATOM 1100 CB GLU A 70 0.184 11.769 8.710 1.00 45.43 C ATOM 1101 CG GLU A 70 1.575 11.551 8.088 1.00 71.41 C ATOM 1102 CD GLU A 70 1.993 10.071 7.932 1.00 22.34 C ATOM 1103 OE1 GLU A 70 1.617 9.441 6.910 1.00 33.21 O ATOM 1104 OE2 GLU A 70 2.732 9.526 8.790 1.00 25.52 O ATOM 0 H GLU A 70 -1.377 12.057 6.153 1.00 22.11 H new ATOM 0 HA GLU A 70 -1.330 13.220 8.857 1.00 34.42 H new ATOM 0 HB2 GLU A 70 0.330 12.100 9.738 1.00 45.43 H new ATOM 0 HB3 GLU A 70 -0.314 10.800 8.754 1.00 45.43 H new ATOM 0 HG2 GLU A 70 1.597 12.025 7.107 1.00 71.41 H new ATOM 0 HG3 GLU A 70 2.316 12.060 8.704 1.00 71.41 H new ATOM 1111 N ARG A 71 0.407 14.896 8.043 1.00 64.23 N ATOM 1112 CA ARG A 71 1.284 15.960 7.565 1.00 63.40 C ATOM 1113 C ARG A 71 2.236 16.231 8.718 1.00 51.14 C ATOM 1114 O ARG A 71 1.861 16.924 9.667 1.00 2.15 O ATOM 1115 CB ARG A 71 0.487 17.211 7.154 1.00 44.20 C ATOM 1116 CG ARG A 71 1.422 18.215 6.455 1.00 61.42 C ATOM 1117 CD ARG A 71 0.753 19.566 6.178 1.00 45.40 C ATOM 1118 NE ARG A 71 -0.420 19.424 5.303 1.00 32.52 N ATOM 1119 CZ ARG A 71 -0.510 19.692 3.997 1.00 33.13 C ATOM 1120 NH1 ARG A 71 0.489 20.222 3.315 1.00 25.35 N ATOM 1121 NH2 ARG A 71 -1.636 19.450 3.352 1.00 73.40 N ATOM 0 H ARG A 71 0.253 14.943 9.050 1.00 64.23 H new ATOM 0 HA ARG A 71 1.825 15.672 6.664 1.00 63.40 H new ATOM 0 HB2 ARG A 71 -0.328 16.932 6.486 1.00 44.20 H new ATOM 0 HB3 ARG A 71 0.035 17.671 8.033 1.00 44.20 H new ATOM 0 HG2 ARG A 71 2.304 18.373 7.075 1.00 61.42 H new ATOM 0 HG3 ARG A 71 1.767 17.787 5.514 1.00 61.42 H new ATOM 0 HD2 ARG A 71 0.450 20.022 7.121 1.00 45.40 H new ATOM 0 HD3 ARG A 71 1.473 20.240 5.714 1.00 45.40 H new ATOM 0 HE ARG A 71 -1.270 19.078 5.748 1.00 32.52 H new ATOM 0 HH11 ARG A 71 1.368 20.441 3.785 1.00 25.35 H new ATOM 0 HH12 ARG A 71 0.382 20.412 2.319 1.00 25.35 H new ATOM 0 HH21 ARG A 71 -2.435 19.059 3.851 1.00 73.40 H new ATOM 0 HH22 ARG A 71 -1.707 19.654 2.355 1.00 73.40 H new ATOM 1135 N ILE A 72 3.414 15.609 8.714 1.00 13.13 N ATOM 1136 CA ILE A 72 4.473 15.973 9.649 1.00 10.43 C ATOM 1137 C ILE A 72 5.150 17.189 9.021 1.00 24.12 C ATOM 1138 O ILE A 72 5.395 17.187 7.814 1.00 72.50 O ATOM 1139 CB ILE A 72 5.443 14.791 9.864 1.00 34.23 C ATOM 1140 CG1 ILE A 72 4.692 13.500 10.287 1.00 10.42 C ATOM 1141 CG2 ILE A 72 6.528 15.106 10.898 1.00 34.15 C ATOM 1142 CD1 ILE A 72 4.794 12.431 9.210 1.00 64.34 C ATOM 0 H ILE A 72 3.657 14.852 8.075 1.00 13.13 H new ATOM 0 HA ILE A 72 4.096 16.211 10.644 1.00 10.43 H new ATOM 0 HB ILE A 72 5.924 14.625 8.900 1.00 34.23 H new ATOM 0 HG12 ILE A 72 5.109 13.122 11.220 1.00 10.42 H new ATOM 0 HG13 ILE A 72 3.644 13.731 10.477 1.00 10.42 H new ATOM 0 HG21 ILE A 72 7.184 14.243 11.012 1.00 34.15 H new ATOM 0 HG22 ILE A 72 7.112 15.963 10.563 1.00 34.15 H new ATOM 0 HG23 ILE A 72 6.062 15.337 11.856 1.00 34.15 H new ATOM 0 HD11 ILE A 72 4.259 11.538 9.532 1.00 64.34 H new ATOM 0 HD12 ILE A 72 4.354 12.803 8.285 1.00 64.34 H new ATOM 0 HD13 ILE A 72 5.842 12.185 9.040 1.00 64.34 H new ATOM 1154 N THR A 73 5.453 18.218 9.807 1.00 64.32 N ATOM 1155 CA THR A 73 6.094 19.423 9.305 1.00 25.31 C ATOM 1156 C THR A 73 7.425 19.543 10.041 1.00 62.44 C ATOM 1157 O THR A 73 7.473 19.577 11.271 1.00 21.14 O ATOM 1158 CB THR A 73 5.121 20.618 9.401 1.00 61.30 C ATOM 1159 OG1 THR A 73 5.418 21.631 8.457 1.00 70.52 O ATOM 1160 CG2 THR A 73 4.997 21.277 10.773 1.00 25.24 C ATOM 0 H THR A 73 5.260 18.237 10.808 1.00 64.32 H new ATOM 0 HA THR A 73 6.331 19.394 8.242 1.00 25.31 H new ATOM 0 HB THR A 73 4.162 20.147 9.187 1.00 61.30 H new ATOM 0 HG1 THR A 73 4.777 22.366 8.553 1.00 70.52 H new ATOM 0 HG21 THR A 73 4.287 22.102 10.717 1.00 25.24 H new ATOM 0 HG22 THR A 73 4.645 20.544 11.498 1.00 25.24 H new ATOM 0 HG23 THR A 73 5.970 21.656 11.084 1.00 25.24 H new ATOM 1168 N GLN A 74 8.521 19.514 9.293 1.00 30.41 N ATOM 1169 CA GLN A 74 9.873 19.631 9.793 1.00 33.22 C ATOM 1170 C GLN A 74 10.553 20.736 9.013 1.00 1.44 C ATOM 1171 O GLN A 74 10.195 21.028 7.871 1.00 51.21 O ATOM 1172 CB GLN A 74 10.643 18.314 9.621 1.00 61.31 C ATOM 1173 CG GLN A 74 9.804 17.052 9.855 1.00 24.54 C ATOM 1174 CD GLN A 74 10.579 15.764 9.564 1.00 14.33 C ATOM 1175 OE1 GLN A 74 11.794 15.774 9.393 1.00 73.52 O ATOM 1176 NE2 GLN A 74 9.899 14.632 9.470 1.00 21.55 N ATOM 0 H GLN A 74 8.484 19.403 8.280 1.00 30.41 H new ATOM 0 HA GLN A 74 9.856 19.860 10.859 1.00 33.22 H new ATOM 0 HB2 GLN A 74 11.056 18.278 8.613 1.00 61.31 H new ATOM 0 HB3 GLN A 74 11.486 18.308 10.312 1.00 61.31 H new ATOM 0 HG2 GLN A 74 9.458 17.037 10.889 1.00 24.54 H new ATOM 0 HG3 GLN A 74 8.917 17.088 9.223 1.00 24.54 H new ATOM 0 HE21 GLN A 74 8.889 14.630 9.613 1.00 21.55 H new ATOM 0 HE22 GLN A 74 10.385 13.762 9.254 1.00 21.55 H new ATOM 1185 N GLU A 75 11.572 21.300 9.640 1.00 54.34 N ATOM 1186 CA GLU A 75 12.437 22.330 9.087 1.00 74.44 C ATOM 1187 C GLU A 75 13.894 21.824 9.041 1.00 34.51 C ATOM 1188 O GLU A 75 14.741 22.394 8.348 1.00 71.32 O ATOM 1189 CB GLU A 75 12.230 23.626 9.874 1.00 50.44 C ATOM 1190 CG GLU A 75 10.764 24.095 9.872 1.00 44.31 C ATOM 1191 CD GLU A 75 10.583 25.584 9.593 1.00 63.42 C ATOM 1192 OE1 GLU A 75 11.291 26.407 10.219 1.00 10.45 O ATOM 1193 OE2 GLU A 75 9.659 25.939 8.824 1.00 1.25 O ATOM 0 H GLU A 75 11.831 21.041 10.592 1.00 54.34 H new ATOM 0 HA GLU A 75 12.181 22.557 8.052 1.00 74.44 H new ATOM 0 HB2 GLU A 75 12.558 23.478 10.903 1.00 50.44 H new ATOM 0 HB3 GLU A 75 12.858 24.409 9.449 1.00 50.44 H new ATOM 0 HG2 GLU A 75 10.214 23.527 9.122 1.00 44.31 H new ATOM 0 HG3 GLU A 75 10.318 23.861 10.839 1.00 44.31 H new ATOM 1200 N GLU A 76 14.151 20.684 9.696 1.00 65.12 N ATOM 1201 CA GLU A 76 15.395 19.914 9.660 1.00 54.21 C ATOM 1202 C GLU A 76 15.324 18.749 8.639 1.00 45.22 C ATOM 1203 O GLU A 76 16.305 18.033 8.427 1.00 33.55 O ATOM 1204 CB GLU A 76 15.863 19.613 11.097 1.00 54.12 C ATOM 1205 CG GLU A 76 15.369 18.247 11.476 1.00 71.44 C ATOM 1206 CD GLU A 76 15.816 17.741 12.849 1.00 13.42 C ATOM 1207 OE1 GLU A 76 17.028 17.493 13.032 1.00 52.32 O ATOM 1208 OE2 GLU A 76 14.963 17.444 13.714 1.00 2.23 O ATOM 0 H GLU A 76 13.452 20.251 10.300 1.00 65.12 H new ATOM 0 HA GLU A 76 16.217 20.498 9.245 1.00 54.21 H new ATOM 0 HB2 GLU A 76 16.950 19.654 11.159 1.00 54.12 H new ATOM 0 HB3 GLU A 76 15.476 20.362 11.787 1.00 54.12 H new ATOM 0 HG2 GLU A 76 14.279 18.253 11.448 1.00 71.44 H new ATOM 0 HG3 GLU A 76 15.703 17.536 10.720 1.00 71.44 H new ATOM 1215 N GLY A 77 14.185 18.527 7.984 1.00 50.44 N ATOM 1216 CA GLY A 77 13.972 17.373 7.119 1.00 64.10 C ATOM 1217 C GLY A 77 13.152 17.776 5.914 1.00 30.51 C ATOM 1218 O GLY A 77 13.727 18.102 4.876 1.00 3.02 O ATOM 0 H GLY A 77 13.379 19.150 8.041 1.00 50.44 H new ATOM 0 HA2 GLY A 77 14.931 16.967 6.798 1.00 64.10 H new ATOM 0 HA3 GLY A 77 13.460 16.584 7.670 1.00 64.10 H new ATOM 1222 N GLY A 78 11.830 17.772 6.062 1.00 3.25 N ATOM 1223 CA GLY A 78 10.905 18.246 5.056 1.00 53.04 C ATOM 1224 C GLY A 78 9.487 18.185 5.611 1.00 24.35 C ATOM 1225 O GLY A 78 9.269 17.888 6.791 1.00 64.53 O ATOM 0 H GLY A 78 11.370 17.430 6.906 1.00 3.25 H new ATOM 0 HA2 GLY A 78 11.153 19.268 4.770 1.00 53.04 H new ATOM 0 HA3 GLY A 78 10.983 17.635 4.156 1.00 53.04 H new ATOM 1229 N ILE A 79 8.511 18.448 4.754 1.00 4.35 N ATOM 1230 CA ILE A 79 7.104 18.300 5.057 1.00 31.13 C ATOM 1231 C ILE A 79 6.697 16.929 4.526 1.00 51.01 C ATOM 1232 O ILE A 79 6.496 16.795 3.322 1.00 54.10 O ATOM 1233 CB ILE A 79 6.313 19.467 4.426 1.00 63.11 C ATOM 1234 CG1 ILE A 79 6.843 20.867 4.816 1.00 63.23 C ATOM 1235 CG2 ILE A 79 4.808 19.367 4.734 1.00 72.40 C ATOM 1236 CD1 ILE A 79 6.223 21.963 3.943 1.00 54.00 C ATOM 0 H ILE A 79 8.686 18.779 3.805 1.00 4.35 H new ATOM 0 HA ILE A 79 6.890 18.345 6.125 1.00 31.13 H new ATOM 0 HB ILE A 79 6.466 19.362 3.352 1.00 63.11 H new ATOM 0 HG12 ILE A 79 6.618 21.064 5.864 1.00 63.23 H new ATOM 0 HG13 ILE A 79 7.928 20.888 4.714 1.00 63.23 H new ATOM 0 HG21 ILE A 79 4.286 20.206 4.273 1.00 72.40 H new ATOM 0 HG22 ILE A 79 4.416 18.432 4.334 1.00 72.40 H new ATOM 0 HG23 ILE A 79 4.655 19.393 5.813 1.00 72.40 H new ATOM 0 HD11 ILE A 79 6.617 22.934 4.244 1.00 54.00 H new ATOM 0 HD12 ILE A 79 6.470 21.779 2.898 1.00 54.00 H new ATOM 0 HD13 ILE A 79 5.140 21.957 4.066 1.00 54.00 H new ATOM 1248 N TYR A 80 6.620 15.920 5.397 1.00 32.45 N ATOM 1249 CA TYR A 80 6.128 14.594 5.041 1.00 41.11 C ATOM 1250 C TYR A 80 4.604 14.693 4.948 1.00 62.54 C ATOM 1251 O TYR A 80 3.900 14.585 5.957 1.00 43.40 O ATOM 1252 CB TYR A 80 6.588 13.558 6.075 1.00 4.31 C ATOM 1253 CG TYR A 80 6.373 12.109 5.674 1.00 73.51 C ATOM 1254 CD1 TYR A 80 5.150 11.460 5.937 1.00 43.24 C ATOM 1255 CD2 TYR A 80 7.400 11.397 5.029 1.00 44.01 C ATOM 1256 CE1 TYR A 80 4.978 10.105 5.601 1.00 50.00 C ATOM 1257 CE2 TYR A 80 7.225 10.048 4.664 1.00 4.13 C ATOM 1258 CZ TYR A 80 6.029 9.370 5.005 1.00 72.42 C ATOM 1259 OH TYR A 80 5.860 8.042 4.733 1.00 74.14 O ATOM 0 H TYR A 80 6.900 16.004 6.374 1.00 32.45 H new ATOM 0 HA TYR A 80 6.529 14.261 4.084 1.00 41.11 H new ATOM 0 HB2 TYR A 80 7.649 13.711 6.272 1.00 4.31 H new ATOM 0 HB3 TYR A 80 6.060 13.742 7.011 1.00 4.31 H new ATOM 0 HD1 TYR A 80 4.341 12.006 6.399 1.00 43.24 H new ATOM 0 HD2 TYR A 80 8.335 11.891 4.811 1.00 44.01 H new ATOM 0 HE1 TYR A 80 4.033 9.621 5.800 1.00 50.00 H new ATOM 0 HE2 TYR A 80 8.003 9.530 4.124 1.00 4.13 H new ATOM 0 HH TYR A 80 4.914 7.864 4.547 1.00 74.14 H new ATOM 1269 N VAL A 81 4.087 14.997 3.762 1.00 50.02 N ATOM 1270 CA VAL A 81 2.659 15.077 3.488 1.00 31.42 C ATOM 1271 C VAL A 81 2.165 13.657 3.171 1.00 51.10 C ATOM 1272 O VAL A 81 2.929 12.860 2.629 1.00 22.24 O ATOM 1273 CB VAL A 81 2.436 16.053 2.316 1.00 50.00 C ATOM 1274 CG1 VAL A 81 0.944 16.201 2.029 1.00 3.24 C ATOM 1275 CG2 VAL A 81 2.982 17.450 2.612 1.00 50.00 C ATOM 0 H VAL A 81 4.664 15.199 2.946 1.00 50.02 H new ATOM 0 HA VAL A 81 2.096 15.456 4.341 1.00 31.42 H new ATOM 0 HB VAL A 81 2.966 15.632 1.462 1.00 50.00 H new ATOM 0 HG11 VAL A 81 0.800 16.893 1.199 1.00 3.24 H new ATOM 0 HG12 VAL A 81 0.526 15.229 1.768 1.00 3.24 H new ATOM 0 HG13 VAL A 81 0.440 16.587 2.915 1.00 3.24 H new ATOM 0 HG21 VAL A 81 2.801 18.100 1.756 1.00 50.00 H new ATOM 0 HG22 VAL A 81 2.481 17.858 3.490 1.00 50.00 H new ATOM 0 HG23 VAL A 81 4.054 17.389 2.801 1.00 50.00 H new ATOM 1285 N SER A 82 0.916 13.310 3.497 1.00 3.32 N ATOM 1286 CA SER A 82 0.378 11.965 3.330 1.00 23.51 C ATOM 1287 C SER A 82 -1.148 12.073 3.227 1.00 61.43 C ATOM 1288 O SER A 82 -1.830 12.219 4.244 1.00 3.11 O ATOM 1289 CB SER A 82 0.848 11.160 4.551 1.00 45.41 C ATOM 1290 OG SER A 82 0.686 9.761 4.484 1.00 72.53 O ATOM 0 H SER A 82 0.244 13.969 3.890 1.00 3.32 H new ATOM 0 HA SER A 82 0.722 11.462 2.426 1.00 23.51 H new ATOM 0 HB2 SER A 82 1.904 11.373 4.714 1.00 45.41 H new ATOM 0 HB3 SER A 82 0.311 11.524 5.427 1.00 45.41 H new ATOM 0 HG SER A 82 1.153 9.341 5.236 1.00 72.53 H new ATOM 1296 N LYS A 83 -1.694 12.110 2.004 1.00 41.21 N ATOM 1297 CA LYS A 83 -3.100 12.458 1.759 1.00 62.14 C ATOM 1298 C LYS A 83 -3.633 11.825 0.474 1.00 31.31 C ATOM 1299 O LYS A 83 -2.885 11.248 -0.316 1.00 11.35 O ATOM 1300 CB LYS A 83 -3.308 13.996 1.774 1.00 54.33 C ATOM 1301 CG LYS A 83 -2.113 14.842 1.367 1.00 41.01 C ATOM 1302 CD LYS A 83 -1.667 14.506 -0.063 1.00 1.12 C ATOM 1303 CE LYS A 83 -1.043 15.756 -0.655 1.00 51.51 C ATOM 1304 NZ LYS A 83 -1.076 15.734 -2.125 1.00 64.02 N ATOM 0 H LYS A 83 -1.171 11.899 1.154 1.00 41.21 H new ATOM 0 HA LYS A 83 -3.685 12.039 2.578 1.00 62.14 H new ATOM 0 HB2 LYS A 83 -4.138 14.235 1.110 1.00 54.33 H new ATOM 0 HB3 LYS A 83 -3.609 14.291 2.779 1.00 54.33 H new ATOM 0 HG2 LYS A 83 -2.371 15.899 1.433 1.00 41.01 H new ATOM 0 HG3 LYS A 83 -1.289 14.671 2.059 1.00 41.01 H new ATOM 0 HD2 LYS A 83 -0.949 13.686 -0.057 1.00 1.12 H new ATOM 0 HD3 LYS A 83 -2.517 14.182 -0.663 1.00 1.12 H new ATOM 0 HE2 LYS A 83 -1.575 16.636 -0.292 1.00 51.51 H new ATOM 0 HE3 LYS A 83 -0.011 15.844 -0.315 1.00 51.51 H new ATOM 0 HZ1 LYS A 83 -0.456 16.481 -2.497 1.00 64.02 H new ATOM 0 HZ2 LYS A 83 -0.746 14.808 -2.466 1.00 64.02 H new ATOM 0 HZ3 LYS A 83 -2.049 15.897 -2.453 1.00 64.02 H new ATOM 1318 N PHE A 84 -4.938 11.912 0.222 1.00 50.30 N ATOM 1319 CA PHE A 84 -5.455 11.560 -1.096 1.00 45.31 C ATOM 1320 C PHE A 84 -5.050 12.640 -2.107 1.00 34.32 C ATOM 1321 O PHE A 84 -4.952 13.820 -1.766 1.00 12.11 O ATOM 1322 CB PHE A 84 -6.971 11.336 -1.064 1.00 73.42 C ATOM 1323 CG PHE A 84 -7.820 12.520 -0.637 1.00 61.03 C ATOM 1324 CD1 PHE A 84 -8.306 13.439 -1.588 1.00 45.42 C ATOM 1325 CD2 PHE A 84 -8.144 12.692 0.721 1.00 62.33 C ATOM 1326 CE1 PHE A 84 -9.098 14.527 -1.179 1.00 3.31 C ATOM 1327 CE2 PHE A 84 -8.943 13.774 1.130 1.00 73.40 C ATOM 1328 CZ PHE A 84 -9.417 14.696 0.180 1.00 34.23 C ATOM 0 H PHE A 84 -5.641 12.216 0.896 1.00 50.30 H new ATOM 0 HA PHE A 84 -5.016 10.613 -1.410 1.00 45.31 H new ATOM 0 HB2 PHE A 84 -7.292 11.027 -2.059 1.00 73.42 H new ATOM 0 HB3 PHE A 84 -7.179 10.505 -0.390 1.00 73.42 H new ATOM 0 HD1 PHE A 84 -8.070 13.308 -2.634 1.00 45.42 H new ATOM 0 HD2 PHE A 84 -7.777 11.989 1.454 1.00 62.33 H new ATOM 0 HE1 PHE A 84 -9.462 15.234 -1.910 1.00 3.31 H new ATOM 0 HE2 PHE A 84 -9.193 13.897 2.174 1.00 73.40 H new ATOM 0 HZ PHE A 84 -10.025 15.532 0.493 1.00 34.23 H new ATOM 1338 N THR A 85 -4.871 12.244 -3.369 1.00 32.33 N ATOM 1339 CA THR A 85 -4.610 13.137 -4.506 1.00 51.22 C ATOM 1340 C THR A 85 -5.784 13.145 -5.509 1.00 1.44 C ATOM 1341 O THR A 85 -5.808 13.969 -6.423 1.00 33.43 O ATOM 1342 CB THR A 85 -3.236 12.785 -5.118 1.00 61.22 C ATOM 1343 OG1 THR A 85 -2.865 13.607 -6.200 1.00 51.52 O ATOM 1344 CG2 THR A 85 -3.171 11.339 -5.596 1.00 55.40 C ATOM 0 H THR A 85 -4.904 11.261 -3.639 1.00 32.33 H new ATOM 0 HA THR A 85 -4.550 14.171 -4.167 1.00 51.22 H new ATOM 0 HB THR A 85 -2.538 12.949 -4.297 1.00 61.22 H new ATOM 0 HG1 THR A 85 -3.669 13.982 -6.617 1.00 51.52 H new ATOM 0 HG21 THR A 85 -2.186 11.139 -6.018 1.00 55.40 H new ATOM 0 HG22 THR A 85 -3.348 10.669 -4.754 1.00 55.40 H new ATOM 0 HG23 THR A 85 -3.933 11.173 -6.358 1.00 55.40 H new ATOM 1352 N LEU A 86 -6.780 12.268 -5.332 1.00 12.13 N ATOM 1353 CA LEU A 86 -8.032 12.242 -6.085 1.00 20.02 C ATOM 1354 C LEU A 86 -9.085 11.637 -5.161 1.00 35.45 C ATOM 1355 O LEU A 86 -8.765 10.791 -4.317 1.00 20.34 O ATOM 1356 CB LEU A 86 -7.831 11.443 -7.391 1.00 4.21 C ATOM 1357 CG LEU A 86 -9.060 11.089 -8.257 1.00 1.45 C ATOM 1358 CD1 LEU A 86 -9.710 9.774 -7.802 1.00 3.54 C ATOM 1359 CD2 LEU A 86 -10.041 12.256 -8.440 1.00 73.22 C ATOM 0 H LEU A 86 -6.730 11.529 -4.631 1.00 12.13 H new ATOM 0 HA LEU A 86 -8.361 13.235 -6.390 1.00 20.02 H new ATOM 0 HB2 LEU A 86 -7.140 12.008 -8.017 1.00 4.21 H new ATOM 0 HB3 LEU A 86 -7.334 10.509 -7.130 1.00 4.21 H new ATOM 0 HG LEU A 86 -8.695 10.907 -9.268 1.00 1.45 H new ATOM 0 HD11 LEU A 86 -10.571 9.556 -8.434 1.00 3.54 H new ATOM 0 HD12 LEU A 86 -8.986 8.963 -7.883 1.00 3.54 H new ATOM 0 HD13 LEU A 86 -10.034 9.868 -6.766 1.00 3.54 H new ATOM 0 HD21 LEU A 86 -10.879 11.934 -9.059 1.00 73.22 H new ATOM 0 HD22 LEU A 86 -10.411 12.576 -7.466 1.00 73.22 H new ATOM 0 HD23 LEU A 86 -9.530 13.088 -8.925 1.00 73.22 H new ATOM 1371 N ASN A 87 -10.336 12.075 -5.304 1.00 64.02 N ATOM 1372 CA ASN A 87 -11.486 11.587 -4.559 1.00 3.21 C ATOM 1373 C ASN A 87 -12.683 11.388 -5.492 1.00 15.11 C ATOM 1374 O ASN A 87 -13.420 12.342 -5.759 1.00 73.34 O ATOM 1375 CB ASN A 87 -11.816 12.561 -3.417 1.00 74.30 C ATOM 1376 CG ASN A 87 -12.930 11.960 -2.583 1.00 25.05 C ATOM 1377 OD1 ASN A 87 -12.701 10.991 -1.864 1.00 1.35 O ATOM 1378 ND2 ASN A 87 -14.145 12.461 -2.687 1.00 11.53 N ATOM 0 H ASN A 87 -10.581 12.808 -5.969 1.00 64.02 H new ATOM 0 HA ASN A 87 -11.248 10.617 -4.122 1.00 3.21 H new ATOM 0 HB2 ASN A 87 -10.934 12.737 -2.801 1.00 74.30 H new ATOM 0 HB3 ASN A 87 -12.122 13.527 -3.819 1.00 74.30 H new ATOM 0 HD21 ASN A 87 -14.915 12.043 -2.165 1.00 11.53 H new ATOM 0 HD22 ASN A 87 -14.315 13.266 -3.290 1.00 11.53 H new ATOM 1385 N GLU A 88 -12.890 10.169 -5.987 1.00 62.21 N ATOM 1386 CA GLU A 88 -14.003 9.750 -6.836 1.00 63.10 C ATOM 1387 C GLU A 88 -14.878 8.711 -6.101 1.00 44.34 C ATOM 1388 O GLU A 88 -14.452 8.115 -5.110 1.00 33.03 O ATOM 1389 CB GLU A 88 -13.396 9.127 -8.096 1.00 1.31 C ATOM 1390 CG GLU A 88 -12.968 10.117 -9.170 1.00 74.44 C ATOM 1391 CD GLU A 88 -14.125 10.559 -10.056 1.00 73.00 C ATOM 1392 OE1 GLU A 88 -14.607 9.733 -10.865 1.00 32.14 O ATOM 1393 OE2 GLU A 88 -14.523 11.741 -9.993 1.00 3.23 O ATOM 0 H GLU A 88 -12.246 9.402 -5.794 1.00 62.21 H new ATOM 0 HA GLU A 88 -14.637 10.600 -7.087 1.00 63.10 H new ATOM 0 HB2 GLU A 88 -12.529 8.533 -7.806 1.00 1.31 H new ATOM 0 HB3 GLU A 88 -14.123 8.440 -8.528 1.00 1.31 H new ATOM 0 HG2 GLU A 88 -12.524 10.992 -8.696 1.00 74.44 H new ATOM 0 HG3 GLU A 88 -12.194 9.663 -9.789 1.00 74.44 H new ATOM 1400 N PRO A 89 -16.099 8.440 -6.593 1.00 12.15 N ATOM 1401 CA PRO A 89 -17.036 7.515 -5.957 1.00 24.34 C ATOM 1402 C PRO A 89 -16.597 6.055 -6.011 1.00 53.21 C ATOM 1403 O PRO A 89 -16.915 5.282 -5.107 1.00 63.30 O ATOM 1404 CB PRO A 89 -18.352 7.697 -6.705 1.00 1.11 C ATOM 1405 CG PRO A 89 -17.984 8.339 -8.034 1.00 24.21 C ATOM 1406 CD PRO A 89 -16.732 9.131 -7.703 1.00 40.33 C ATOM 0 HA PRO A 89 -17.108 7.742 -4.893 1.00 24.34 H new ATOM 0 HB2 PRO A 89 -18.851 6.740 -6.857 1.00 1.11 H new ATOM 0 HB3 PRO A 89 -19.039 8.329 -6.142 1.00 1.11 H new ATOM 0 HG2 PRO A 89 -17.795 7.591 -8.804 1.00 24.21 H new ATOM 0 HG3 PRO A 89 -18.782 8.983 -8.404 1.00 24.21 H new ATOM 0 HD2 PRO A 89 -16.064 9.181 -8.563 1.00 40.33 H new ATOM 0 HD3 PRO A 89 -16.980 10.157 -7.432 1.00 40.33 H new ATOM 1414 N LYS A 90 -15.941 5.668 -7.101 1.00 13.21 N ATOM 1415 CA LYS A 90 -15.434 4.308 -7.343 1.00 64.21 C ATOM 1416 C LYS A 90 -13.896 4.209 -7.360 1.00 75.31 C ATOM 1417 O LYS A 90 -13.385 3.103 -7.466 1.00 63.24 O ATOM 1418 CB LYS A 90 -16.024 3.727 -8.642 1.00 60.40 C ATOM 1419 CG LYS A 90 -17.532 3.422 -8.649 1.00 54.20 C ATOM 1420 CD LYS A 90 -18.020 2.425 -7.586 1.00 12.31 C ATOM 1421 CE LYS A 90 -18.579 3.088 -6.318 1.00 35.22 C ATOM 1422 NZ LYS A 90 -19.853 2.468 -5.875 1.00 13.12 N ATOM 0 H LYS A 90 -15.738 6.308 -7.869 1.00 13.21 H new ATOM 0 HA LYS A 90 -15.767 3.713 -6.493 1.00 64.21 H new ATOM 0 HB2 LYS A 90 -15.816 4.427 -9.451 1.00 60.40 H new ATOM 0 HB3 LYS A 90 -15.491 2.805 -8.873 1.00 60.40 H new ATOM 0 HG2 LYS A 90 -18.073 4.359 -8.516 1.00 54.20 H new ATOM 0 HG3 LYS A 90 -17.800 3.035 -9.632 1.00 54.20 H new ATOM 0 HD2 LYS A 90 -18.792 1.792 -8.023 1.00 12.31 H new ATOM 0 HD3 LYS A 90 -17.193 1.772 -7.308 1.00 12.31 H new ATOM 0 HE2 LYS A 90 -17.843 3.014 -5.517 1.00 35.22 H new ATOM 0 HE3 LYS A 90 -18.740 4.150 -6.506 1.00 35.22 H new ATOM 0 HZ1 LYS A 90 -20.192 2.947 -5.017 1.00 13.12 H new ATOM 0 HZ2 LYS A 90 -20.564 2.561 -6.628 1.00 13.12 H new ATOM 0 HZ3 LYS A 90 -19.696 1.461 -5.670 1.00 13.12 H new ATOM 1436 N HIS A 91 -13.153 5.305 -7.198 1.00 74.33 N ATOM 1437 CA HIS A 91 -11.701 5.401 -7.346 1.00 71.34 C ATOM 1438 C HIS A 91 -11.131 6.289 -6.231 1.00 72.24 C ATOM 1439 O HIS A 91 -11.687 7.352 -5.954 1.00 35.43 O ATOM 1440 CB HIS A 91 -11.398 5.972 -8.745 1.00 33.24 C ATOM 1441 CG HIS A 91 -9.939 6.096 -9.064 1.00 44.13 C ATOM 1442 ND1 HIS A 91 -9.347 7.073 -9.834 1.00 55.54 N ATOM 1443 CD2 HIS A 91 -8.970 5.212 -8.696 1.00 64.43 C ATOM 1444 CE1 HIS A 91 -8.038 6.793 -9.902 1.00 15.31 C ATOM 1445 NE2 HIS A 91 -7.763 5.659 -9.233 1.00 43.33 N ATOM 0 H HIS A 91 -13.573 6.200 -6.946 1.00 74.33 H new ATOM 0 HA HIS A 91 -11.230 4.422 -7.257 1.00 71.34 H new ATOM 0 HB2 HIS A 91 -11.867 5.334 -9.493 1.00 33.24 H new ATOM 0 HB3 HIS A 91 -11.860 6.955 -8.830 1.00 33.24 H new ATOM 0 HD2 HIS A 91 -9.111 4.325 -8.096 1.00 64.43 H new ATOM 0 HE1 HIS A 91 -7.306 7.394 -10.421 1.00 15.31 H new ATOM 0 HE2 HIS A 91 -6.851 5.213 -9.137 1.00 43.33 H new ATOM 1453 N LYS A 92 -10.082 5.851 -5.519 1.00 51.33 N ATOM 1454 CA LYS A 92 -9.712 6.489 -4.251 1.00 20.23 C ATOM 1455 C LYS A 92 -8.219 6.284 -3.954 1.00 3.22 C ATOM 1456 O LYS A 92 -7.785 5.150 -3.746 1.00 55.53 O ATOM 1457 CB LYS A 92 -10.641 5.910 -3.157 1.00 33.44 C ATOM 1458 CG LYS A 92 -11.087 6.943 -2.114 1.00 35.01 C ATOM 1459 CD LYS A 92 -10.035 7.146 -1.018 1.00 74.33 C ATOM 1460 CE LYS A 92 -10.592 7.953 0.161 1.00 45.13 C ATOM 1461 NZ LYS A 92 -11.598 7.189 0.925 1.00 3.34 N ATOM 0 H LYS A 92 -9.485 5.071 -5.795 1.00 51.33 H new ATOM 0 HA LYS A 92 -9.849 7.570 -4.292 1.00 20.23 H new ATOM 0 HB2 LYS A 92 -11.524 5.482 -3.632 1.00 33.44 H new ATOM 0 HB3 LYS A 92 -10.125 5.094 -2.650 1.00 33.44 H new ATOM 0 HG2 LYS A 92 -11.284 7.895 -2.608 1.00 35.01 H new ATOM 0 HG3 LYS A 92 -12.024 6.619 -1.661 1.00 35.01 H new ATOM 0 HD2 LYS A 92 -9.688 6.176 -0.663 1.00 74.33 H new ATOM 0 HD3 LYS A 92 -9.170 7.661 -1.435 1.00 74.33 H new ATOM 0 HE2 LYS A 92 -9.775 8.240 0.823 1.00 45.13 H new ATOM 0 HE3 LYS A 92 -11.041 8.875 -0.210 1.00 45.13 H new ATOM 0 HZ1 LYS A 92 -11.763 7.652 1.842 1.00 3.34 H new ATOM 0 HZ2 LYS A 92 -12.489 7.155 0.389 1.00 3.34 H new ATOM 0 HZ3 LYS A 92 -11.252 6.221 1.083 1.00 3.34 H new ATOM 1475 N ILE A 93 -7.417 7.357 -3.957 1.00 31.34 N ATOM 1476 CA ILE A 93 -5.951 7.288 -3.831 1.00 64.30 C ATOM 1477 C ILE A 93 -5.507 7.474 -2.370 1.00 4.51 C ATOM 1478 O ILE A 93 -6.298 7.902 -1.525 1.00 15.42 O ATOM 1479 CB ILE A 93 -5.272 8.324 -4.772 1.00 52.40 C ATOM 1480 CG1 ILE A 93 -5.900 8.410 -6.179 1.00 73.02 C ATOM 1481 CG2 ILE A 93 -3.750 8.100 -4.927 1.00 31.33 C ATOM 1482 CD1 ILE A 93 -5.778 7.152 -7.036 1.00 4.44 C ATOM 0 H ILE A 93 -7.770 8.310 -4.048 1.00 31.34 H new ATOM 0 HA ILE A 93 -5.629 6.294 -4.140 1.00 64.30 H new ATOM 0 HB ILE A 93 -5.449 9.271 -4.262 1.00 52.40 H new ATOM 0 HG12 ILE A 93 -6.957 8.653 -6.071 1.00 73.02 H new ATOM 0 HG13 ILE A 93 -5.436 9.238 -6.714 1.00 73.02 H new ATOM 0 HG21 ILE A 93 -3.337 8.856 -5.596 1.00 31.33 H new ATOM 0 HG22 ILE A 93 -3.270 8.177 -3.952 1.00 31.33 H new ATOM 0 HG23 ILE A 93 -3.569 7.109 -5.343 1.00 31.33 H new ATOM 0 HD11 ILE A 93 -6.252 7.323 -8.002 1.00 4.44 H new ATOM 0 HD12 ILE A 93 -4.725 6.914 -7.186 1.00 4.44 H new ATOM 0 HD13 ILE A 93 -6.270 6.320 -6.532 1.00 4.44 H new ATOM 1494 N PHE A 94 -4.233 7.192 -2.072 1.00 31.42 N ATOM 1495 CA PHE A 94 -3.503 7.595 -0.876 1.00 12.21 C ATOM 1496 C PHE A 94 -2.022 7.744 -1.272 1.00 43.50 C ATOM 1497 O PHE A 94 -1.368 6.743 -1.562 1.00 62.02 O ATOM 1498 CB PHE A 94 -3.709 6.534 0.220 1.00 20.35 C ATOM 1499 CG PHE A 94 -3.519 7.042 1.635 1.00 45.10 C ATOM 1500 CD1 PHE A 94 -4.550 7.768 2.264 1.00 70.03 C ATOM 1501 CD2 PHE A 94 -2.339 6.750 2.345 1.00 33.12 C ATOM 1502 CE1 PHE A 94 -4.415 8.173 3.603 1.00 54.12 C ATOM 1503 CE2 PHE A 94 -2.202 7.169 3.679 1.00 3.24 C ATOM 1504 CZ PHE A 94 -3.240 7.871 4.311 1.00 30.22 C ATOM 0 H PHE A 94 -3.652 6.641 -2.704 1.00 31.42 H new ATOM 0 HA PHE A 94 -3.860 8.544 -0.477 1.00 12.21 H new ATOM 0 HB2 PHE A 94 -4.715 6.125 0.127 1.00 20.35 H new ATOM 0 HB3 PHE A 94 -3.014 5.712 0.047 1.00 20.35 H new ATOM 0 HD1 PHE A 94 -5.447 8.014 1.715 1.00 70.03 H new ATOM 0 HD2 PHE A 94 -1.540 6.205 1.865 1.00 33.12 H new ATOM 0 HE1 PHE A 94 -5.214 8.716 4.087 1.00 54.12 H new ATOM 0 HE2 PHE A 94 -1.294 6.950 4.221 1.00 3.24 H new ATOM 0 HZ PHE A 94 -3.135 8.179 5.341 1.00 30.22 H new ATOM 1514 N GLU A 95 -1.493 8.967 -1.365 1.00 44.22 N ATOM 1515 CA GLU A 95 -0.093 9.216 -1.728 1.00 11.21 C ATOM 1516 C GLU A 95 0.579 10.059 -0.650 1.00 44.40 C ATOM 1517 O GLU A 95 -0.057 10.905 -0.017 1.00 22.43 O ATOM 1518 CB GLU A 95 -0.001 9.821 -3.139 1.00 52.13 C ATOM 1519 CG GLU A 95 -0.451 11.286 -3.287 1.00 2.35 C ATOM 1520 CD GLU A 95 0.619 12.337 -2.957 1.00 63.22 C ATOM 1521 OE1 GLU A 95 1.765 12.188 -3.437 1.00 32.11 O ATOM 1522 OE2 GLU A 95 0.288 13.388 -2.361 1.00 63.42 O ATOM 0 H GLU A 95 -2.027 9.818 -1.190 1.00 44.22 H new ATOM 0 HA GLU A 95 0.456 8.275 -1.773 1.00 11.21 H new ATOM 0 HB2 GLU A 95 1.033 9.746 -3.476 1.00 52.13 H new ATOM 0 HB3 GLU A 95 -0.601 9.210 -3.813 1.00 52.13 H new ATOM 0 HG2 GLU A 95 -0.788 11.444 -4.312 1.00 2.35 H new ATOM 0 HG3 GLU A 95 -1.312 11.452 -2.639 1.00 2.35 H new ATOM 1529 N ALA A 96 1.868 9.819 -0.439 1.00 42.42 N ATOM 1530 CA ALA A 96 2.672 10.507 0.543 1.00 12.43 C ATOM 1531 C ALA A 96 4.082 10.650 -0.006 1.00 30.13 C ATOM 1532 O ALA A 96 4.589 9.722 -0.646 1.00 2.34 O ATOM 1533 CB ALA A 96 2.698 9.683 1.836 1.00 72.13 C ATOM 0 H ALA A 96 2.390 9.119 -0.966 1.00 42.42 H new ATOM 0 HA ALA A 96 2.257 11.492 0.755 1.00 12.43 H new ATOM 0 HB1 ALA A 96 3.304 10.197 2.583 1.00 72.13 H new ATOM 0 HB2 ALA A 96 1.682 9.564 2.212 1.00 72.13 H new ATOM 0 HB3 ALA A 96 3.127 8.702 1.633 1.00 72.13 H new ATOM 1539 N GLY A 97 4.726 11.749 0.353 1.00 10.12 N ATOM 1540 CA GLY A 97 6.149 11.984 0.220 1.00 50.14 C ATOM 1541 C GLY A 97 6.522 13.267 0.934 1.00 34.32 C ATOM 1542 O GLY A 97 5.658 14.020 1.399 1.00 14.13 O ATOM 0 H GLY A 97 4.239 12.544 0.768 1.00 10.12 H new ATOM 0 HA2 GLY A 97 6.707 11.147 0.640 1.00 50.14 H new ATOM 0 HA3 GLY A 97 6.420 12.051 -0.834 1.00 50.14 H new ATOM 1546 N TYR A 98 7.822 13.540 0.984 1.00 1.33 N ATOM 1547 CA TYR A 98 8.286 14.867 1.336 1.00 73.22 C ATOM 1548 C TYR A 98 7.871 15.835 0.237 1.00 53.12 C ATOM 1549 O TYR A 98 7.964 15.506 -0.948 1.00 44.14 O ATOM 1550 CB TYR A 98 9.794 14.867 1.592 1.00 30.14 C ATOM 1551 CG TYR A 98 10.116 14.371 2.984 1.00 21.55 C ATOM 1552 CD1 TYR A 98 9.743 15.162 4.082 1.00 52.13 C ATOM 1553 CD2 TYR A 98 10.694 13.109 3.201 1.00 34.55 C ATOM 1554 CE1 TYR A 98 9.936 14.718 5.399 1.00 2.35 C ATOM 1555 CE2 TYR A 98 10.882 12.647 4.515 1.00 23.24 C ATOM 1556 CZ TYR A 98 10.501 13.442 5.619 1.00 21.42 C ATOM 1557 OH TYR A 98 10.623 12.960 6.885 1.00 30.43 O ATOM 0 H TYR A 98 8.561 12.865 0.787 1.00 1.33 H new ATOM 0 HA TYR A 98 7.826 15.194 2.269 1.00 73.22 H new ATOM 0 HB2 TYR A 98 10.290 14.235 0.855 1.00 30.14 H new ATOM 0 HB3 TYR A 98 10.187 15.876 1.463 1.00 30.14 H new ATOM 0 HD1 TYR A 98 9.299 16.131 3.910 1.00 52.13 H new ATOM 0 HD2 TYR A 98 10.992 12.497 2.363 1.00 34.55 H new ATOM 0 HE1 TYR A 98 9.656 15.344 6.234 1.00 2.35 H new ATOM 0 HE2 TYR A 98 11.322 11.675 4.682 1.00 23.24 H new ATOM 0 HH TYR A 98 11.030 12.069 6.858 1.00 30.43 H new ATOM 1567 N GLU A 99 7.434 17.037 0.613 1.00 14.32 N ATOM 1568 CA GLU A 99 6.958 18.039 -0.342 1.00 32.21 C ATOM 1569 C GLU A 99 8.089 18.506 -1.288 1.00 63.23 C ATOM 1570 O GLU A 99 7.835 19.110 -2.337 1.00 64.42 O ATOM 1571 CB GLU A 99 6.308 19.195 0.442 1.00 42.11 C ATOM 1572 CG GLU A 99 5.087 19.787 -0.270 1.00 25.34 C ATOM 1573 CD GLU A 99 4.646 21.125 0.326 1.00 74.21 C ATOM 1574 OE1 GLU A 99 5.176 22.179 -0.105 1.00 42.34 O ATOM 1575 OE2 GLU A 99 3.719 21.149 1.169 1.00 51.23 O ATOM 0 H GLU A 99 7.400 17.343 1.585 1.00 14.32 H new ATOM 0 HA GLU A 99 6.203 17.602 -0.996 1.00 32.21 H new ATOM 0 HB2 GLU A 99 6.009 18.836 1.427 1.00 42.11 H new ATOM 0 HB3 GLU A 99 7.047 19.981 0.600 1.00 42.11 H new ATOM 0 HG2 GLU A 99 5.319 19.923 -1.326 1.00 25.34 H new ATOM 0 HG3 GLU A 99 4.260 19.079 -0.214 1.00 25.34 H new ATOM 1582 N GLU A 100 9.344 18.201 -0.941 1.00 74.30 N ATOM 1583 CA GLU A 100 10.554 18.492 -1.704 1.00 72.13 C ATOM 1584 C GLU A 100 11.395 17.228 -1.941 1.00 25.22 C ATOM 1585 O GLU A 100 12.608 17.330 -2.110 1.00 51.10 O ATOM 1586 CB GLU A 100 11.349 19.629 -1.033 1.00 1.02 C ATOM 1587 CG GLU A 100 10.536 20.924 -0.895 1.00 74.50 C ATOM 1588 CD GLU A 100 11.341 22.058 -0.269 1.00 44.22 C ATOM 1589 OE1 GLU A 100 11.335 22.183 0.977 1.00 62.22 O ATOM 1590 OE2 GLU A 100 11.904 22.896 -1.018 1.00 4.32 O ATOM 0 H GLU A 100 9.550 17.716 -0.068 1.00 74.30 H new ATOM 0 HA GLU A 100 10.265 18.842 -2.695 1.00 72.13 H new ATOM 0 HB2 GLU A 100 11.676 19.304 -0.045 1.00 1.02 H new ATOM 0 HB3 GLU A 100 12.248 19.830 -1.616 1.00 1.02 H new ATOM 0 HG2 GLU A 100 10.183 21.234 -1.879 1.00 74.50 H new ATOM 0 HG3 GLU A 100 9.653 20.731 -0.286 1.00 74.50 H new ATOM 1597 N SER A 101 10.794 16.034 -1.964 1.00 52.04 N ATOM 1598 CA SER A 101 11.476 14.825 -2.411 1.00 24.52 C ATOM 1599 C SER A 101 10.494 13.915 -3.155 1.00 41.10 C ATOM 1600 O SER A 101 9.385 14.325 -3.510 1.00 44.12 O ATOM 1601 CB SER A 101 12.155 14.131 -1.217 1.00 44.01 C ATOM 1602 OG SER A 101 13.353 13.498 -1.620 1.00 1.03 O ATOM 0 H SER A 101 9.828 15.883 -1.675 1.00 52.04 H new ATOM 0 HA SER A 101 12.266 15.081 -3.117 1.00 24.52 H new ATOM 0 HB2 SER A 101 12.369 14.863 -0.439 1.00 44.01 H new ATOM 0 HB3 SER A 101 11.477 13.395 -0.785 1.00 44.01 H new ATOM 0 HG SER A 101 13.770 13.064 -0.846 1.00 1.03 H new ATOM 1608 N GLU A 102 10.926 12.689 -3.448 1.00 65.13 N ATOM 1609 CA GLU A 102 10.035 11.659 -3.959 1.00 43.03 C ATOM 1610 C GLU A 102 9.095 11.145 -2.857 1.00 33.51 C ATOM 1611 O GLU A 102 9.273 11.409 -1.662 1.00 4.45 O ATOM 1612 CB GLU A 102 10.805 10.547 -4.663 1.00 71.41 C ATOM 1613 CG GLU A 102 11.341 10.947 -6.059 1.00 1.44 C ATOM 1614 CD GLU A 102 11.420 9.782 -7.061 1.00 52.52 C ATOM 1615 OE1 GLU A 102 10.481 8.954 -7.094 1.00 33.34 O ATOM 1616 OE2 GLU A 102 12.348 9.742 -7.906 1.00 44.33 O ATOM 0 H GLU A 102 11.894 12.388 -3.338 1.00 65.13 H new ATOM 0 HA GLU A 102 9.398 12.106 -4.722 1.00 43.03 H new ATOM 0 HB2 GLU A 102 11.643 10.244 -4.035 1.00 71.41 H new ATOM 0 HB3 GLU A 102 10.155 9.678 -4.769 1.00 71.41 H new ATOM 0 HG2 GLU A 102 10.699 11.725 -6.473 1.00 1.44 H new ATOM 0 HG3 GLU A 102 12.334 11.381 -5.944 1.00 1.44 H new ATOM 1623 N VAL A 103 8.084 10.387 -3.288 1.00 1.32 N ATOM 1624 CA VAL A 103 7.122 9.702 -2.436 1.00 42.02 C ATOM 1625 C VAL A 103 7.804 8.714 -1.486 1.00 12.02 C ATOM 1626 O VAL A 103 8.948 8.312 -1.701 1.00 12.15 O ATOM 1627 CB VAL A 103 6.071 8.985 -3.301 1.00 0.25 C ATOM 1628 CG1 VAL A 103 5.075 9.953 -3.942 1.00 35.13 C ATOM 1629 CG2 VAL A 103 6.724 8.137 -4.389 1.00 73.20 C ATOM 0 H VAL A 103 7.910 10.230 -4.281 1.00 1.32 H new ATOM 0 HA VAL A 103 6.627 10.452 -1.819 1.00 42.02 H new ATOM 0 HB VAL A 103 5.521 8.336 -2.620 1.00 0.25 H new ATOM 0 HG11 VAL A 103 4.357 9.393 -4.541 1.00 35.13 H new ATOM 0 HG12 VAL A 103 4.547 10.502 -3.162 1.00 35.13 H new ATOM 0 HG13 VAL A 103 5.610 10.656 -4.581 1.00 35.13 H new ATOM 0 HG21 VAL A 103 5.951 7.646 -4.980 1.00 73.20 H new ATOM 0 HG22 VAL A 103 7.325 8.776 -5.036 1.00 73.20 H new ATOM 0 HG23 VAL A 103 7.363 7.383 -3.929 1.00 73.20 H new ATOM 1639 N ASP A 104 7.062 8.264 -0.473 1.00 22.33 N ATOM 1640 CA ASP A 104 7.510 7.268 0.505 1.00 65.31 C ATOM 1641 C ASP A 104 6.395 6.308 0.930 1.00 72.21 C ATOM 1642 O ASP A 104 6.593 5.458 1.801 1.00 10.24 O ATOM 1643 CB ASP A 104 8.092 7.987 1.727 1.00 50.33 C ATOM 1644 CG ASP A 104 9.402 7.362 2.202 1.00 13.23 C ATOM 1645 OD1 ASP A 104 10.353 7.299 1.392 1.00 45.34 O ATOM 1646 OD2 ASP A 104 9.530 7.096 3.421 1.00 53.04 O ATOM 0 H ASP A 104 6.110 8.589 -0.305 1.00 22.33 H new ATOM 0 HA ASP A 104 8.276 6.657 0.027 1.00 65.31 H new ATOM 0 HB2 ASP A 104 8.261 9.036 1.482 1.00 50.33 H new ATOM 0 HB3 ASP A 104 7.366 7.963 2.539 1.00 50.33 H new ATOM 1651 N LEU A 105 5.206 6.448 0.334 1.00 11.13 N ATOM 1652 CA LEU A 105 4.024 5.614 0.555 1.00 21.53 C ATOM 1653 C LEU A 105 3.047 5.963 -0.561 1.00 52.14 C ATOM 1654 O LEU A 105 2.626 7.113 -0.670 1.00 4.31 O ATOM 1655 CB LEU A 105 3.423 5.876 1.957 1.00 50.13 C ATOM 1656 CG LEU A 105 2.010 5.318 2.227 1.00 34.24 C ATOM 1657 CD1 LEU A 105 1.985 3.791 2.340 1.00 73.20 C ATOM 1658 CD2 LEU A 105 1.473 5.889 3.546 1.00 21.54 C ATOM 0 H LEU A 105 5.035 7.185 -0.351 1.00 11.13 H new ATOM 0 HA LEU A 105 4.267 4.552 0.530 1.00 21.53 H new ATOM 0 HB2 LEU A 105 4.101 5.457 2.700 1.00 50.13 H new ATOM 0 HB3 LEU A 105 3.399 6.954 2.120 1.00 50.13 H new ATOM 0 HG LEU A 105 1.394 5.613 1.377 1.00 34.24 H new ATOM 0 HD11 LEU A 105 0.965 3.457 2.530 1.00 73.20 H new ATOM 0 HD12 LEU A 105 2.343 3.351 1.409 1.00 73.20 H new ATOM 0 HD13 LEU A 105 2.629 3.476 3.161 1.00 73.20 H new ATOM 0 HD21 LEU A 105 0.475 5.493 3.734 1.00 21.54 H new ATOM 0 HD22 LEU A 105 2.136 5.604 4.363 1.00 21.54 H new ATOM 0 HD23 LEU A 105 1.426 6.976 3.479 1.00 21.54 H new ATOM 1670 N ARG A 106 2.697 5.008 -1.423 1.00 73.32 N ATOM 1671 CA ARG A 106 1.640 5.183 -2.415 1.00 34.41 C ATOM 1672 C ARG A 106 0.802 3.921 -2.460 1.00 2.43 C ATOM 1673 O ARG A 106 1.334 2.811 -2.504 1.00 33.33 O ATOM 1674 CB ARG A 106 2.170 5.554 -3.812 1.00 35.43 C ATOM 1675 CG ARG A 106 2.766 6.965 -3.876 1.00 2.34 C ATOM 1676 CD ARG A 106 2.651 7.571 -5.280 1.00 73.42 C ATOM 1677 NE ARG A 106 3.737 7.178 -6.194 1.00 31.12 N ATOM 1678 CZ ARG A 106 3.820 7.553 -7.476 1.00 44.54 C ATOM 1679 NH1 ARG A 106 2.864 8.301 -8.019 1.00 52.14 N ATOM 1680 NH2 ARG A 106 4.861 7.179 -8.207 1.00 1.32 N ATOM 0 H ARG A 106 3.140 4.090 -1.452 1.00 73.32 H new ATOM 0 HA ARG A 106 1.027 6.030 -2.108 1.00 34.41 H new ATOM 0 HB2 ARG A 106 2.930 4.832 -4.109 1.00 35.43 H new ATOM 0 HB3 ARG A 106 1.357 5.477 -4.534 1.00 35.43 H new ATOM 0 HG2 ARG A 106 2.254 7.608 -3.160 1.00 2.34 H new ATOM 0 HG3 ARG A 106 3.815 6.930 -3.580 1.00 2.34 H new ATOM 0 HD2 ARG A 106 1.698 7.273 -5.716 1.00 73.42 H new ATOM 0 HD3 ARG A 106 2.637 8.658 -5.195 1.00 73.42 H new ATOM 0 HE ARG A 106 4.476 6.579 -5.825 1.00 31.12 H new ATOM 0 HH11 ARG A 106 2.063 8.591 -7.458 1.00 52.14 H new ATOM 0 HH12 ARG A 106 2.932 8.584 -8.997 1.00 52.14 H new ATOM 0 HH21 ARG A 106 5.596 6.607 -7.792 1.00 1.32 H new ATOM 0 HH22 ARG A 106 4.926 7.464 -9.184 1.00 1.32 H new ATOM 1694 N VAL A 107 -0.510 4.090 -2.376 1.00 34.23 N ATOM 1695 CA VAL A 107 -1.509 3.040 -2.470 1.00 23.11 C ATOM 1696 C VAL A 107 -2.713 3.680 -3.171 1.00 20.22 C ATOM 1697 O VAL A 107 -2.846 4.906 -3.219 1.00 54.20 O ATOM 1698 CB VAL A 107 -1.863 2.501 -1.059 1.00 2.22 C ATOM 1699 CG1 VAL A 107 -2.623 1.171 -1.154 1.00 44.54 C ATOM 1700 CG2 VAL A 107 -0.642 2.216 -0.171 1.00 23.32 C ATOM 0 H VAL A 107 -0.925 5.011 -2.233 1.00 34.23 H new ATOM 0 HA VAL A 107 -1.154 2.177 -3.033 1.00 23.11 H new ATOM 0 HB VAL A 107 -2.460 3.298 -0.614 1.00 2.22 H new ATOM 0 HG11 VAL A 107 -2.859 0.815 -0.151 1.00 44.54 H new ATOM 0 HG12 VAL A 107 -3.547 1.319 -1.714 1.00 44.54 H new ATOM 0 HG13 VAL A 107 -2.004 0.434 -1.665 1.00 44.54 H new ATOM 0 HG21 VAL A 107 -0.975 1.843 0.797 1.00 23.32 H new ATOM 0 HG22 VAL A 107 -0.010 1.468 -0.650 1.00 23.32 H new ATOM 0 HG23 VAL A 107 -0.073 3.135 -0.029 1.00 23.32 H new ATOM 1710 N GLU A 108 -3.610 2.890 -3.747 1.00 15.24 N ATOM 1711 CA GLU A 108 -4.866 3.357 -4.285 1.00 1.33 C ATOM 1712 C GLU A 108 -5.780 2.160 -4.502 1.00 40.31 C ATOM 1713 O GLU A 108 -5.315 1.016 -4.578 1.00 64.44 O ATOM 1714 CB GLU A 108 -4.644 4.115 -5.593 1.00 42.11 C ATOM 1715 CG GLU A 108 -3.541 3.579 -6.496 1.00 20.12 C ATOM 1716 CD GLU A 108 -3.578 4.243 -7.860 1.00 51.24 C ATOM 1717 OE1 GLU A 108 -4.306 3.744 -8.744 1.00 62.01 O ATOM 1718 OE2 GLU A 108 -2.865 5.246 -8.089 1.00 63.42 O ATOM 0 H GLU A 108 -3.474 1.885 -3.852 1.00 15.24 H new ATOM 0 HA GLU A 108 -5.332 4.047 -3.581 1.00 1.33 H new ATOM 0 HB2 GLU A 108 -5.579 4.113 -6.154 1.00 42.11 H new ATOM 0 HB3 GLU A 108 -4.418 5.154 -5.354 1.00 42.11 H new ATOM 0 HG2 GLU A 108 -2.570 3.751 -6.031 1.00 20.12 H new ATOM 0 HG3 GLU A 108 -3.653 2.501 -6.610 1.00 20.12 H new ATOM 1725 N PHE A 109 -7.080 2.439 -4.583 1.00 43.50 N ATOM 1726 CA PHE A 109 -8.143 1.456 -4.631 1.00 13.43 C ATOM 1727 C PHE A 109 -9.120 1.888 -5.718 1.00 42.53 C ATOM 1728 O PHE A 109 -9.413 3.081 -5.859 1.00 20.21 O ATOM 1729 CB PHE A 109 -8.856 1.395 -3.262 1.00 62.04 C ATOM 1730 CG PHE A 109 -7.931 1.509 -2.059 1.00 14.11 C ATOM 1731 CD1 PHE A 109 -6.934 0.542 -1.852 1.00 73.11 C ATOM 1732 CD2 PHE A 109 -7.995 2.629 -1.207 1.00 35.02 C ATOM 1733 CE1 PHE A 109 -5.997 0.695 -0.816 1.00 60.03 C ATOM 1734 CE2 PHE A 109 -7.060 2.782 -0.168 1.00 74.22 C ATOM 1735 CZ PHE A 109 -6.047 1.826 0.017 1.00 12.41 C ATOM 0 H PHE A 109 -7.428 3.397 -4.618 1.00 43.50 H new ATOM 0 HA PHE A 109 -7.747 0.465 -4.852 1.00 13.43 H new ATOM 0 HB2 PHE A 109 -9.592 2.197 -3.215 1.00 62.04 H new ATOM 0 HB3 PHE A 109 -9.404 0.455 -3.194 1.00 62.04 H new ATOM 0 HD1 PHE A 109 -6.887 -0.325 -2.494 1.00 73.11 H new ATOM 0 HD2 PHE A 109 -8.765 3.373 -1.352 1.00 35.02 H new ATOM 0 HE1 PHE A 109 -5.238 -0.057 -0.660 1.00 60.03 H new ATOM 0 HE2 PHE A 109 -7.121 3.637 0.490 1.00 74.22 H new ATOM 0 HZ PHE A 109 -5.310 1.960 0.795 1.00 12.41 H new ATOM 1745 N GLU A 110 -9.673 0.923 -6.444 1.00 20.25 N ATOM 1746 CA GLU A 110 -10.697 1.170 -7.448 1.00 33.32 C ATOM 1747 C GLU A 110 -11.674 -0.003 -7.426 1.00 23.21 C ATOM 1748 O GLU A 110 -11.398 -1.037 -6.795 1.00 35.22 O ATOM 1749 CB GLU A 110 -10.041 1.389 -8.828 1.00 31.05 C ATOM 1750 CG GLU A 110 -10.751 2.441 -9.696 1.00 24.12 C ATOM 1751 CD GLU A 110 -11.780 1.869 -10.662 1.00 71.12 C ATOM 1752 OE1 GLU A 110 -11.384 1.422 -11.758 1.00 1.35 O ATOM 1753 OE2 GLU A 110 -12.995 1.910 -10.364 1.00 3.35 O ATOM 0 H GLU A 110 -9.420 -0.061 -6.350 1.00 20.25 H new ATOM 0 HA GLU A 110 -11.256 2.080 -7.231 1.00 33.32 H new ATOM 0 HB2 GLU A 110 -9.004 1.692 -8.682 1.00 31.05 H new ATOM 0 HB3 GLU A 110 -10.023 0.441 -9.365 1.00 31.05 H new ATOM 0 HG2 GLU A 110 -11.245 3.160 -9.043 1.00 24.12 H new ATOM 0 HG3 GLU A 110 -10.001 2.990 -10.266 1.00 24.12 H new ATOM 1760 N LEU A 111 -12.820 0.162 -8.084 1.00 15.14 N ATOM 1761 CA LEU A 111 -13.829 -0.882 -8.173 1.00 73.44 C ATOM 1762 C LEU A 111 -13.742 -1.659 -9.488 1.00 31.02 C ATOM 1763 O LEU A 111 -13.881 -1.094 -10.565 1.00 23.31 O ATOM 1764 CB LEU A 111 -15.226 -0.271 -7.970 1.00 52.40 C ATOM 1765 CG LEU A 111 -16.175 -1.377 -7.496 1.00 1.13 C ATOM 1766 CD1 LEU A 111 -15.958 -1.676 -6.025 1.00 22.12 C ATOM 1767 CD2 LEU A 111 -17.657 -1.055 -7.626 1.00 21.35 C ATOM 0 H LEU A 111 -13.071 1.024 -8.569 1.00 15.14 H new ATOM 0 HA LEU A 111 -13.641 -1.605 -7.379 1.00 73.44 H new ATOM 0 HB2 LEU A 111 -15.185 0.533 -7.236 1.00 52.40 H new ATOM 0 HB3 LEU A 111 -15.588 0.166 -8.901 1.00 52.40 H new ATOM 0 HG LEU A 111 -15.935 -2.215 -8.151 1.00 1.13 H new ATOM 0 HD11 LEU A 111 -16.642 -2.464 -5.709 1.00 22.12 H new ATOM 0 HD12 LEU A 111 -14.930 -2.003 -5.868 1.00 22.12 H new ATOM 0 HD13 LEU A 111 -16.146 -0.776 -5.439 1.00 22.12 H new ATOM 0 HD21 LEU A 111 -18.246 -1.898 -7.265 1.00 21.35 H new ATOM 0 HD22 LEU A 111 -17.890 -0.170 -7.034 1.00 21.35 H new ATOM 0 HD23 LEU A 111 -17.898 -0.866 -8.672 1.00 21.35 H new ATOM 1779 N GLN A 112 -13.567 -2.978 -9.421 1.00 3.33 N ATOM 1780 CA GLN A 112 -13.698 -3.888 -10.569 1.00 53.51 C ATOM 1781 C GLN A 112 -15.183 -4.115 -10.898 1.00 43.52 C ATOM 1782 O GLN A 112 -16.053 -3.426 -10.351 1.00 41.30 O ATOM 1783 CB GLN A 112 -12.990 -5.209 -10.273 1.00 52.40 C ATOM 1784 CG GLN A 112 -11.528 -5.037 -9.853 1.00 12.12 C ATOM 1785 CD GLN A 112 -10.683 -4.378 -10.938 1.00 14.42 C ATOM 1786 OE1 GLN A 112 -10.779 -4.742 -12.102 1.00 41.30 O ATOM 1787 NE2 GLN A 112 -9.785 -3.470 -10.613 1.00 62.00 N ATOM 0 H GLN A 112 -13.326 -3.458 -8.554 1.00 3.33 H new ATOM 0 HA GLN A 112 -13.224 -3.437 -11.441 1.00 53.51 H new ATOM 0 HB2 GLN A 112 -13.528 -5.731 -9.482 1.00 52.40 H new ATOM 0 HB3 GLN A 112 -13.033 -5.842 -11.159 1.00 52.40 H new ATOM 0 HG2 GLN A 112 -11.482 -4.435 -8.946 1.00 12.12 H new ATOM 0 HG3 GLN A 112 -11.106 -6.012 -9.610 1.00 12.12 H new ATOM 0 HE21 GLN A 112 -9.699 -3.161 -9.645 1.00 62.00 H new ATOM 0 HE22 GLN A 112 -9.176 -3.076 -11.330 1.00 62.00 H new ATOM 1796 N ALA A 113 -15.492 -5.089 -11.754 1.00 21.25 N ATOM 1797 CA ALA A 113 -16.840 -5.564 -12.057 1.00 41.30 C ATOM 1798 C ALA A 113 -17.280 -6.740 -11.165 1.00 1.33 C ATOM 1799 O ALA A 113 -18.410 -7.212 -11.307 1.00 2.53 O ATOM 1800 CB ALA A 113 -16.860 -5.989 -13.526 1.00 15.41 C ATOM 0 H ALA A 113 -14.776 -5.591 -12.279 1.00 21.25 H new ATOM 0 HA ALA A 113 -17.544 -4.756 -11.861 1.00 41.30 H new ATOM 0 HB1 ALA A 113 -17.855 -6.350 -13.787 1.00 15.41 H new ATOM 0 HB2 ALA A 113 -16.607 -5.136 -14.155 1.00 15.41 H new ATOM 0 HB3 ALA A 113 -16.132 -6.785 -13.685 1.00 15.41 H new ATOM 1806 N ASP A 114 -16.406 -7.259 -10.294 1.00 40.50 N ATOM 1807 CA ASP A 114 -16.672 -8.449 -9.464 1.00 62.43 C ATOM 1808 C ASP A 114 -17.583 -8.145 -8.265 1.00 12.31 C ATOM 1809 O ASP A 114 -18.219 -9.062 -7.739 1.00 63.32 O ATOM 1810 CB ASP A 114 -15.334 -9.108 -9.042 1.00 20.21 C ATOM 1811 CG ASP A 114 -15.231 -9.546 -7.568 1.00 3.11 C ATOM 1812 OD1 ASP A 114 -15.270 -8.673 -6.674 1.00 20.32 O ATOM 1813 OD2 ASP A 114 -14.992 -10.739 -7.290 1.00 20.11 O ATOM 0 H ASP A 114 -15.479 -6.861 -10.141 1.00 40.50 H new ATOM 0 HA ASP A 114 -17.228 -9.165 -10.069 1.00 62.43 H new ATOM 0 HB2 ASP A 114 -15.168 -9.982 -9.672 1.00 20.21 H new ATOM 0 HB3 ASP A 114 -14.526 -8.407 -9.249 1.00 20.21 H new ATOM 1818 N GLY A 115 -17.667 -6.880 -7.845 1.00 52.31 N ATOM 1819 CA GLY A 115 -18.494 -6.416 -6.738 1.00 75.02 C ATOM 1820 C GLY A 115 -17.733 -6.106 -5.443 1.00 71.04 C ATOM 1821 O GLY A 115 -18.388 -5.954 -4.411 1.00 2.34 O ATOM 0 H GLY A 115 -17.140 -6.126 -8.286 1.00 52.31 H new ATOM 0 HA2 GLY A 115 -19.025 -5.518 -7.053 1.00 75.02 H new ATOM 0 HA3 GLY A 115 -19.248 -7.174 -6.526 1.00 75.02 H new ATOM 1825 N LYS A 116 -16.395 -5.996 -5.443 1.00 31.23 N ATOM 1826 CA LYS A 116 -15.634 -5.573 -4.258 1.00 14.24 C ATOM 1827 C LYS A 116 -14.552 -4.557 -4.664 1.00 33.31 C ATOM 1828 O LYS A 116 -14.396 -4.265 -5.854 1.00 60.34 O ATOM 1829 CB LYS A 116 -15.087 -6.814 -3.524 1.00 75.41 C ATOM 1830 CG LYS A 116 -13.651 -7.245 -3.777 1.00 32.34 C ATOM 1831 CD LYS A 116 -13.543 -8.772 -3.632 1.00 15.12 C ATOM 1832 CE LYS A 116 -12.101 -9.212 -3.397 1.00 73.22 C ATOM 1833 NZ LYS A 116 -11.912 -9.734 -2.036 1.00 72.03 N ATOM 0 H LYS A 116 -15.815 -6.196 -6.258 1.00 31.23 H new ATOM 0 HA LYS A 116 -16.280 -5.056 -3.548 1.00 14.24 H new ATOM 0 HB2 LYS A 116 -15.194 -6.637 -2.454 1.00 75.41 H new ATOM 0 HB3 LYS A 116 -15.733 -7.656 -3.774 1.00 75.41 H new ATOM 0 HG2 LYS A 116 -13.339 -6.941 -4.776 1.00 32.34 H new ATOM 0 HG3 LYS A 116 -12.982 -6.753 -3.070 1.00 32.34 H new ATOM 0 HD2 LYS A 116 -14.166 -9.104 -2.801 1.00 15.12 H new ATOM 0 HD3 LYS A 116 -13.929 -9.252 -4.531 1.00 15.12 H new ATOM 0 HE2 LYS A 116 -11.831 -9.979 -4.123 1.00 73.22 H new ATOM 0 HE3 LYS A 116 -11.431 -8.368 -3.560 1.00 73.22 H new ATOM 0 HZ1 LYS A 116 -10.950 -10.117 -1.942 1.00 72.03 H new ATOM 0 HZ2 LYS A 116 -12.048 -8.966 -1.348 1.00 72.03 H new ATOM 0 HZ3 LYS A 116 -12.604 -10.488 -1.854 1.00 72.03 H new ATOM 1847 N TRP A 117 -13.803 -3.997 -3.713 1.00 12.35 N ATOM 1848 CA TRP A 117 -12.708 -3.068 -4.000 1.00 42.31 C ATOM 1849 C TRP A 117 -11.398 -3.840 -4.129 1.00 61.01 C ATOM 1850 O TRP A 117 -11.130 -4.733 -3.318 1.00 53.14 O ATOM 1851 CB TRP A 117 -12.593 -2.030 -2.876 1.00 61.21 C ATOM 1852 CG TRP A 117 -13.708 -1.036 -2.820 1.00 75.01 C ATOM 1853 CD1 TRP A 117 -14.908 -1.225 -2.231 1.00 1.44 C ATOM 1854 CD2 TRP A 117 -13.742 0.317 -3.359 1.00 74.04 C ATOM 1855 NE1 TRP A 117 -15.716 -0.126 -2.446 1.00 32.03 N ATOM 1856 CE2 TRP A 117 -15.048 0.855 -3.153 1.00 32.23 C ATOM 1857 CE3 TRP A 117 -12.800 1.140 -4.010 1.00 2.11 C ATOM 1858 CZ2 TRP A 117 -15.410 2.127 -3.620 1.00 3.52 C ATOM 1859 CZ3 TRP A 117 -13.132 2.444 -4.418 1.00 4.15 C ATOM 1860 CH2 TRP A 117 -14.436 2.934 -4.234 1.00 32.33 C ATOM 0 H TRP A 117 -13.939 -4.175 -2.718 1.00 12.35 H new ATOM 0 HA TRP A 117 -12.914 -2.553 -4.938 1.00 42.31 H new ATOM 0 HB2 TRP A 117 -12.544 -2.554 -1.921 1.00 61.21 H new ATOM 0 HB3 TRP A 117 -11.652 -1.492 -2.993 1.00 61.21 H new ATOM 0 HD1 TRP A 117 -15.194 -2.105 -1.674 1.00 1.44 H new ATOM 0 HE1 TRP A 117 -16.681 -0.049 -2.124 1.00 32.03 H new ATOM 0 HE3 TRP A 117 -11.806 0.762 -4.199 1.00 2.11 H new ATOM 0 HZ2 TRP A 117 -16.424 2.482 -3.509 1.00 3.52 H new ATOM 0 HZ3 TRP A 117 -12.381 3.072 -4.875 1.00 4.15 H new ATOM 0 HH2 TRP A 117 -14.690 3.930 -4.564 1.00 32.33 H new ATOM 1871 N TYR A 118 -10.547 -3.449 -5.082 1.00 21.21 N ATOM 1872 CA TYR A 118 -9.221 -4.032 -5.265 1.00 52.20 C ATOM 1873 C TYR A 118 -8.161 -2.931 -5.178 1.00 32.25 C ATOM 1874 O TYR A 118 -8.415 -1.802 -5.609 1.00 41.51 O ATOM 1875 CB TYR A 118 -9.157 -4.808 -6.592 1.00 40.50 C ATOM 1876 CG TYR A 118 -9.549 -6.273 -6.471 1.00 43.22 C ATOM 1877 CD1 TYR A 118 -10.890 -6.662 -6.312 1.00 35.15 C ATOM 1878 CD2 TYR A 118 -8.553 -7.259 -6.517 1.00 62.01 C ATOM 1879 CE1 TYR A 118 -11.238 -8.025 -6.162 1.00 15.53 C ATOM 1880 CE2 TYR A 118 -8.874 -8.615 -6.363 1.00 72.00 C ATOM 1881 CZ TYR A 118 -10.220 -9.012 -6.194 1.00 55.42 C ATOM 1882 OH TYR A 118 -10.489 -10.339 -6.047 1.00 64.14 O ATOM 0 H TYR A 118 -10.764 -2.712 -5.753 1.00 21.21 H new ATOM 0 HA TYR A 118 -9.018 -4.750 -4.470 1.00 52.20 H new ATOM 0 HB2 TYR A 118 -9.814 -4.325 -7.316 1.00 40.50 H new ATOM 0 HB3 TYR A 118 -8.144 -4.745 -6.989 1.00 40.50 H new ATOM 0 HD1 TYR A 118 -11.665 -5.910 -6.304 1.00 35.15 H new ATOM 0 HD2 TYR A 118 -7.524 -6.970 -6.673 1.00 62.01 H new ATOM 0 HE1 TYR A 118 -12.270 -8.312 -6.024 1.00 15.53 H new ATOM 0 HE2 TYR A 118 -8.091 -9.358 -6.374 1.00 72.00 H new ATOM 0 HH TYR A 118 -9.654 -10.850 -6.100 1.00 64.14 H new ATOM 1892 N VAL A 119 -6.980 -3.225 -4.614 1.00 3.14 N ATOM 1893 CA VAL A 119 -5.831 -2.317 -4.692 1.00 75.01 C ATOM 1894 C VAL A 119 -5.225 -2.451 -6.097 1.00 14.55 C ATOM 1895 O VAL A 119 -5.305 -3.525 -6.696 1.00 33.33 O ATOM 1896 CB VAL A 119 -4.786 -2.676 -3.613 1.00 33.23 C ATOM 1897 CG1 VAL A 119 -3.646 -1.673 -3.447 1.00 31.03 C ATOM 1898 CG2 VAL A 119 -5.366 -2.936 -2.222 1.00 72.40 C ATOM 0 H VAL A 119 -6.798 -4.086 -4.099 1.00 3.14 H new ATOM 0 HA VAL A 119 -6.146 -1.289 -4.514 1.00 75.01 H new ATOM 0 HB VAL A 119 -4.387 -3.603 -4.025 1.00 33.23 H new ATOM 0 HG11 VAL A 119 -2.969 -2.018 -2.666 1.00 31.03 H new ATOM 0 HG12 VAL A 119 -3.101 -1.583 -4.387 1.00 31.03 H new ATOM 0 HG13 VAL A 119 -4.054 -0.701 -3.170 1.00 31.03 H new ATOM 0 HG21 VAL A 119 -4.559 -3.180 -1.531 1.00 72.40 H new ATOM 0 HG22 VAL A 119 -5.886 -2.044 -1.872 1.00 72.40 H new ATOM 0 HG23 VAL A 119 -6.067 -3.769 -2.270 1.00 72.40 H new ATOM 1908 N VAL A 120 -4.563 -1.399 -6.578 1.00 60.40 N ATOM 1909 CA VAL A 120 -3.870 -1.350 -7.877 1.00 60.11 C ATOM 1910 C VAL A 120 -2.500 -0.658 -7.772 1.00 53.31 C ATOM 1911 O VAL A 120 -1.892 -0.323 -8.788 1.00 41.34 O ATOM 1912 CB VAL A 120 -4.777 -0.720 -8.966 1.00 72.02 C ATOM 1913 CG1 VAL A 120 -5.719 -1.776 -9.556 1.00 21.43 C ATOM 1914 CG2 VAL A 120 -5.607 0.460 -8.456 1.00 34.13 C ATOM 0 H VAL A 120 -4.488 -0.524 -6.060 1.00 60.40 H new ATOM 0 HA VAL A 120 -3.665 -2.375 -8.186 1.00 60.11 H new ATOM 0 HB VAL A 120 -4.103 -0.338 -9.733 1.00 72.02 H new ATOM 0 HG11 VAL A 120 -6.348 -1.317 -10.318 1.00 21.43 H new ATOM 0 HG12 VAL A 120 -5.132 -2.577 -10.004 1.00 21.43 H new ATOM 0 HG13 VAL A 120 -6.348 -2.185 -8.765 1.00 21.43 H new ATOM 0 HG21 VAL A 120 -6.218 0.853 -9.268 1.00 34.13 H new ATOM 0 HG22 VAL A 120 -6.253 0.126 -7.644 1.00 34.13 H new ATOM 0 HG23 VAL A 120 -4.941 1.242 -8.091 1.00 34.13 H new ATOM 1924 N ASP A 121 -1.982 -0.472 -6.556 1.00 2.35 N ATOM 1925 CA ASP A 121 -0.687 0.173 -6.294 1.00 12.51 C ATOM 1926 C ASP A 121 -0.117 -0.256 -4.939 1.00 40.22 C ATOM 1927 O ASP A 121 -0.886 -0.455 -3.998 1.00 74.21 O ATOM 1928 CB ASP A 121 -0.888 1.689 -6.278 1.00 44.30 C ATOM 1929 CG ASP A 121 0.411 2.487 -6.313 1.00 62.00 C ATOM 1930 OD1 ASP A 121 1.445 1.929 -6.739 1.00 73.21 O ATOM 1931 OD2 ASP A 121 0.341 3.703 -6.014 1.00 63.41 O ATOM 0 H ASP A 121 -2.459 -0.771 -5.705 1.00 2.35 H new ATOM 0 HA ASP A 121 0.011 -0.124 -7.076 1.00 12.51 H new ATOM 0 HB2 ASP A 121 -1.500 1.973 -7.134 1.00 44.30 H new ATOM 0 HB3 ASP A 121 -1.446 1.962 -5.382 1.00 44.30 H new ATOM 1936 N CYS A 122 1.205 -0.409 -4.822 1.00 55.24 N ATOM 1937 CA CYS A 122 1.899 -0.747 -3.581 1.00 12.22 C ATOM 1938 C CYS A 122 3.297 -0.121 -3.621 1.00 15.12 C ATOM 1939 O CYS A 122 4.173 -0.672 -4.293 1.00 43.40 O ATOM 1940 CB CYS A 122 1.966 -2.281 -3.447 1.00 13.15 C ATOM 1941 SG CYS A 122 2.811 -2.836 -1.940 1.00 42.44 S ATOM 0 H CYS A 122 1.839 -0.297 -5.613 1.00 55.24 H new ATOM 0 HA CYS A 122 1.369 -0.355 -2.713 1.00 12.22 H new ATOM 0 HB2 CYS A 122 0.953 -2.684 -3.456 1.00 13.15 H new ATOM 0 HB3 CYS A 122 2.480 -2.692 -4.316 1.00 13.15 H new ATOM 0 HG CYS A 122 2.823 -4.135 -1.903 1.00 42.44 H new ATOM 1947 N TYR A 123 3.499 1.003 -2.930 1.00 12.11 N ATOM 1948 CA TYR A 123 4.778 1.688 -2.743 1.00 34.42 C ATOM 1949 C TYR A 123 4.884 2.096 -1.260 1.00 40.01 C ATOM 1950 O TYR A 123 3.860 2.423 -0.647 1.00 75.10 O ATOM 1951 CB TYR A 123 4.825 2.910 -3.677 1.00 32.31 C ATOM 1952 CG TYR A 123 6.197 3.323 -4.175 1.00 60.12 C ATOM 1953 CD1 TYR A 123 6.874 2.526 -5.121 1.00 73.01 C ATOM 1954 CD2 TYR A 123 6.810 4.498 -3.693 1.00 35.43 C ATOM 1955 CE1 TYR A 123 8.158 2.894 -5.565 1.00 41.43 C ATOM 1956 CE2 TYR A 123 8.080 4.887 -4.157 1.00 23.31 C ATOM 1957 CZ TYR A 123 8.762 4.080 -5.098 1.00 51.43 C ATOM 1958 OH TYR A 123 9.992 4.414 -5.567 1.00 64.14 O ATOM 0 H TYR A 123 2.732 1.485 -2.461 1.00 12.11 H new ATOM 0 HA TYR A 123 5.622 1.045 -2.990 1.00 34.42 H new ATOM 0 HB2 TYR A 123 4.195 2.704 -4.542 1.00 32.31 H new ATOM 0 HB3 TYR A 123 4.381 3.757 -3.154 1.00 32.31 H new ATOM 0 HD1 TYR A 123 6.406 1.632 -5.506 1.00 73.01 H new ATOM 0 HD2 TYR A 123 6.299 5.105 -2.960 1.00 35.43 H new ATOM 0 HE1 TYR A 123 8.684 2.264 -6.267 1.00 41.43 H new ATOM 0 HE2 TYR A 123 8.533 5.799 -3.796 1.00 23.31 H new ATOM 0 HH TYR A 123 10.281 5.256 -5.157 1.00 64.14 H new ATOM 1968 N THR A 124 6.072 2.067 -0.660 1.00 51.14 N ATOM 1969 CA THR A 124 6.362 2.351 0.743 1.00 20.13 C ATOM 1970 C THR A 124 7.881 2.457 0.902 1.00 20.51 C ATOM 1971 O THR A 124 8.643 1.829 0.159 1.00 41.20 O ATOM 1972 CB THR A 124 5.763 1.257 1.665 1.00 14.33 C ATOM 1973 OG1 THR A 124 6.270 1.345 2.982 1.00 21.35 O ATOM 1974 CG2 THR A 124 6.033 -0.170 1.184 1.00 52.00 C ATOM 0 H THR A 124 6.917 1.827 -1.179 1.00 51.14 H new ATOM 0 HA THR A 124 5.900 3.292 1.040 1.00 20.13 H new ATOM 0 HB THR A 124 4.690 1.449 1.639 1.00 14.33 H new ATOM 0 HG1 THR A 124 5.869 0.642 3.534 1.00 21.35 H new ATOM 0 HG21 THR A 124 5.584 -0.879 1.879 1.00 52.00 H new ATOM 0 HG22 THR A 124 5.599 -0.308 0.194 1.00 52.00 H new ATOM 0 HG23 THR A 124 7.109 -0.340 1.136 1.00 52.00 H new ATOM 1982 N GLY A 125 8.351 3.203 1.904 1.00 53.42 N ATOM 1983 CA GLY A 125 9.760 3.270 2.275 1.00 41.44 C ATOM 1984 C GLY A 125 10.400 1.889 2.484 1.00 60.44 C ATOM 1985 O GLY A 125 11.615 1.750 2.347 1.00 13.25 O ATOM 0 H GLY A 125 7.751 3.786 2.488 1.00 53.42 H new ATOM 0 HA2 GLY A 125 10.308 3.803 1.498 1.00 41.44 H new ATOM 0 HA3 GLY A 125 9.860 3.851 3.192 1.00 41.44 H new ATOM 1989 N TRP A 126 9.613 0.832 2.746 1.00 74.12 N ATOM 1990 CA TRP A 126 10.146 -0.523 2.797 1.00 23.43 C ATOM 1991 C TRP A 126 10.864 -0.935 1.507 1.00 22.23 C ATOM 1992 O TRP A 126 11.857 -1.665 1.590 1.00 33.42 O ATOM 1993 CB TRP A 126 9.078 -1.561 3.101 1.00 61.51 C ATOM 1994 CG TRP A 126 8.789 -1.822 4.542 1.00 31.22 C ATOM 1995 CD1 TRP A 126 7.551 -2.025 5.031 1.00 14.43 C ATOM 1996 CD2 TRP A 126 9.703 -1.977 5.679 1.00 51.44 C ATOM 1997 NE1 TRP A 126 7.637 -2.371 6.360 1.00 0.14 N ATOM 1998 CE2 TRP A 126 8.934 -2.356 6.819 1.00 64.14 C ATOM 1999 CE3 TRP A 126 11.097 -1.845 5.875 1.00 51.10 C ATOM 2000 CZ2 TRP A 126 9.520 -2.638 8.062 1.00 2.13 C ATOM 2001 CZ3 TRP A 126 11.683 -2.076 7.128 1.00 52.01 C ATOM 2002 CH2 TRP A 126 10.902 -2.484 8.218 1.00 51.40 C ATOM 0 H TRP A 126 8.611 0.898 2.924 1.00 74.12 H new ATOM 0 HA TRP A 126 10.869 -0.497 3.612 1.00 23.43 H new ATOM 0 HB2 TRP A 126 8.152 -1.248 2.619 1.00 61.51 H new ATOM 0 HB3 TRP A 126 9.376 -2.502 2.638 1.00 61.51 H new ATOM 0 HD1 TRP A 126 6.634 -1.931 4.468 1.00 14.43 H new ATOM 0 HE1 TRP A 126 6.832 -2.611 6.938 1.00 0.14 H new ATOM 0 HE3 TRP A 126 11.723 -1.560 5.043 1.00 51.10 H new ATOM 0 HZ2 TRP A 126 8.911 -2.970 8.890 1.00 2.13 H new ATOM 0 HZ3 TRP A 126 12.747 -1.938 7.254 1.00 52.01 H new ATOM 0 HH2 TRP A 126 11.365 -2.679 9.174 1.00 51.40 H new ATOM 2013 N TYR A 127 10.361 -0.534 0.331 1.00 53.31 N ATOM 2014 CA TYR A 127 10.852 -1.016 -0.961 1.00 54.00 C ATOM 2015 C TYR A 127 11.045 0.115 -1.984 1.00 34.32 C ATOM 2016 O TYR A 127 11.097 -0.168 -3.186 1.00 2.01 O ATOM 2017 CB TYR A 127 9.993 -2.164 -1.537 1.00 20.34 C ATOM 2018 CG TYR A 127 9.386 -3.107 -0.525 1.00 31.45 C ATOM 2019 CD1 TYR A 127 10.164 -4.136 0.025 1.00 2.24 C ATOM 2020 CD2 TYR A 127 8.064 -2.929 -0.095 1.00 33.51 C ATOM 2021 CE1 TYR A 127 9.665 -4.923 1.079 1.00 40.22 C ATOM 2022 CE2 TYR A 127 7.540 -3.719 0.929 1.00 4.44 C ATOM 2023 CZ TYR A 127 8.346 -4.705 1.532 1.00 53.21 C ATOM 2024 OH TYR A 127 7.843 -5.465 2.530 1.00 51.24 O ATOM 0 H TYR A 127 9.598 0.138 0.253 1.00 53.31 H new ATOM 0 HA TYR A 127 11.840 -1.431 -0.760 1.00 54.00 H new ATOM 0 HB2 TYR A 127 9.187 -1.728 -2.127 1.00 20.34 H new ATOM 0 HB3 TYR A 127 10.611 -2.745 -2.222 1.00 20.34 H new ATOM 0 HD1 TYR A 127 11.154 -4.326 -0.363 1.00 2.24 H new ATOM 0 HD2 TYR A 127 7.446 -2.175 -0.560 1.00 33.51 H new ATOM 0 HE1 TYR A 127 10.282 -5.683 1.535 1.00 40.22 H new ATOM 0 HE2 TYR A 127 6.521 -3.575 1.258 1.00 4.44 H new ATOM 0 HH TYR A 127 7.171 -4.952 3.025 1.00 51.24 H new ATOM 2034 N GLY A 128 11.205 1.359 -1.533 1.00 0.24 N ATOM 2035 CA GLY A 128 11.579 2.513 -2.341 1.00 4.02 C ATOM 2036 C GLY A 128 12.563 3.360 -1.539 1.00 71.10 C ATOM 2037 O GLY A 128 12.337 3.554 -0.345 1.00 61.42 O ATOM 0 H GLY A 128 11.071 1.597 -0.550 1.00 0.24 H new ATOM 0 HA2 GLY A 128 12.032 2.190 -3.278 1.00 4.02 H new ATOM 0 HA3 GLY A 128 10.696 3.098 -2.599 1.00 4.02 H new ATOM 2041 N TYR A 129 13.636 3.836 -2.180 1.00 4.44 N ATOM 2042 CA TYR A 129 14.484 4.962 -1.764 1.00 73.34 C ATOM 2043 C TYR A 129 14.874 4.986 -0.267 1.00 55.22 C ATOM 2044 O TYR A 129 14.853 6.037 0.376 1.00 11.32 O ATOM 2045 CB TYR A 129 13.886 6.303 -2.223 1.00 61.41 C ATOM 2046 CG TYR A 129 14.005 6.689 -3.692 1.00 23.22 C ATOM 2047 CD1 TYR A 129 13.531 5.850 -4.717 1.00 54.12 C ATOM 2048 CD2 TYR A 129 14.546 7.947 -4.031 1.00 35.52 C ATOM 2049 CE1 TYR A 129 13.606 6.255 -6.063 1.00 53.14 C ATOM 2050 CE2 TYR A 129 14.608 8.366 -5.371 1.00 13.34 C ATOM 2051 CZ TYR A 129 14.142 7.518 -6.397 1.00 40.22 C ATOM 2052 OH TYR A 129 14.164 7.934 -7.692 1.00 3.24 O ATOM 0 H TYR A 129 13.956 3.422 -3.055 1.00 4.44 H new ATOM 0 HA TYR A 129 15.432 4.801 -2.277 1.00 73.34 H new ATOM 0 HB2 TYR A 129 12.827 6.298 -1.967 1.00 61.41 H new ATOM 0 HB3 TYR A 129 14.353 7.093 -1.634 1.00 61.41 H new ATOM 0 HD1 TYR A 129 13.107 4.888 -4.469 1.00 54.12 H new ATOM 0 HD2 TYR A 129 14.917 8.596 -3.251 1.00 35.52 H new ATOM 0 HE1 TYR A 129 13.252 5.597 -6.843 1.00 53.14 H new ATOM 0 HE2 TYR A 129 15.012 9.337 -5.615 1.00 13.34 H new ATOM 0 HH TYR A 129 13.654 8.767 -7.777 1.00 3.24 H new ATOM 2062 N ASP A 130 15.295 3.855 0.291 1.00 42.00 N ATOM 2063 CA ASP A 130 15.887 3.800 1.639 1.00 60.24 C ATOM 2064 C ASP A 130 16.968 2.732 1.750 1.00 43.23 C ATOM 2065 O ASP A 130 17.991 2.968 2.393 1.00 71.40 O ATOM 2066 CB ASP A 130 14.826 3.596 2.732 1.00 10.23 C ATOM 2067 CG ASP A 130 15.401 3.641 4.158 1.00 32.24 C ATOM 2068 OD1 ASP A 130 16.450 4.280 4.411 1.00 13.24 O ATOM 2069 OD2 ASP A 130 14.795 3.005 5.050 1.00 24.24 O ATOM 0 H ASP A 130 15.239 2.948 -0.171 1.00 42.00 H new ATOM 0 HA ASP A 130 16.354 4.772 1.799 1.00 60.24 H new ATOM 0 HB2 ASP A 130 14.060 4.365 2.633 1.00 10.23 H new ATOM 0 HB3 ASP A 130 14.335 2.635 2.576 1.00 10.23 H new ATOM 2074 N LEU A 131 16.820 1.577 1.094 1.00 55.03 N ATOM 2075 CA LEU A 131 17.826 0.514 1.164 1.00 4.32 C ATOM 2076 C LEU A 131 18.457 0.269 -0.214 1.00 13.20 C ATOM 2077 O LEU A 131 17.818 0.546 -1.239 1.00 64.42 O ATOM 2078 CB LEU A 131 17.209 -0.770 1.741 1.00 0.31 C ATOM 2079 CG LEU A 131 17.112 -0.870 3.281 1.00 64.14 C ATOM 2080 CD1 LEU A 131 18.467 -0.818 4.000 1.00 71.25 C ATOM 2081 CD2 LEU A 131 16.178 0.165 3.910 1.00 64.53 C ATOM 0 H LEU A 131 16.014 1.355 0.509 1.00 55.03 H new ATOM 0 HA LEU A 131 18.624 0.832 1.836 1.00 4.32 H new ATOM 0 HB2 LEU A 131 16.205 -0.878 1.330 1.00 0.31 H new ATOM 0 HB3 LEU A 131 17.793 -1.618 1.382 1.00 0.31 H new ATOM 0 HG LEU A 131 16.684 -1.861 3.430 1.00 64.14 H new ATOM 0 HD11 LEU A 131 18.311 -0.894 5.076 1.00 71.25 H new ATOM 0 HD12 LEU A 131 19.089 -1.647 3.664 1.00 71.25 H new ATOM 0 HD13 LEU A 131 18.964 0.125 3.771 1.00 71.25 H new ATOM 0 HD21 LEU A 131 16.163 0.031 4.992 1.00 64.53 H new ATOM 0 HD22 LEU A 131 16.534 1.168 3.673 1.00 64.53 H new ATOM 0 HD23 LEU A 131 15.171 0.035 3.514 1.00 64.53 H new ATOM 2093 N PRO A 132 19.704 -0.241 -0.259 1.00 13.12 N ATOM 2094 CA PRO A 132 20.382 -0.605 -1.495 1.00 20.43 C ATOM 2095 C PRO A 132 19.963 -1.986 -2.008 1.00 32.24 C ATOM 2096 O PRO A 132 19.428 -2.825 -1.277 1.00 40.11 O ATOM 2097 CB PRO A 132 21.873 -0.626 -1.134 1.00 42.04 C ATOM 2098 CG PRO A 132 21.883 -1.030 0.336 1.00 20.23 C ATOM 2099 CD PRO A 132 20.619 -0.368 0.872 1.00 73.21 C ATOM 0 HA PRO A 132 20.136 0.100 -2.289 1.00 20.43 H new ATOM 0 HB2 PRO A 132 22.424 -1.338 -1.749 1.00 42.04 H new ATOM 0 HB3 PRO A 132 22.335 0.350 -1.284 1.00 42.04 H new ATOM 0 HG2 PRO A 132 21.857 -2.113 0.459 1.00 20.23 H new ATOM 0 HG3 PRO A 132 22.776 -0.673 0.848 1.00 20.23 H new ATOM 0 HD2 PRO A 132 20.174 -0.968 1.665 1.00 73.21 H new ATOM 0 HD3 PRO A 132 20.845 0.609 1.300 1.00 73.21 H new ATOM 2107 N ILE A 133 20.359 -2.268 -3.251 1.00 1.24 N ATOM 2108 CA ILE A 133 20.151 -3.518 -3.980 1.00 43.31 C ATOM 2109 C ILE A 133 20.634 -4.792 -3.264 1.00 71.43 C ATOM 2110 O ILE A 133 20.269 -5.896 -3.676 1.00 71.11 O ATOM 2111 CB ILE A 133 20.756 -3.350 -5.391 1.00 75.31 C ATOM 2112 CG1 ILE A 133 20.247 -4.441 -6.352 1.00 1.11 C ATOM 2113 CG2 ILE A 133 22.289 -3.277 -5.364 1.00 61.35 C ATOM 2114 CD1 ILE A 133 20.285 -3.997 -7.817 1.00 32.43 C ATOM 0 H ILE A 133 20.867 -1.583 -3.811 1.00 1.24 H new ATOM 0 HA ILE A 133 19.077 -3.690 -4.044 1.00 43.31 H new ATOM 0 HB ILE A 133 20.411 -2.390 -5.775 1.00 75.31 H new ATOM 0 HG12 ILE A 133 20.854 -5.338 -6.232 1.00 1.11 H new ATOM 0 HG13 ILE A 133 19.225 -4.709 -6.083 1.00 1.11 H new ATOM 0 HG21 ILE A 133 22.666 -3.159 -6.380 1.00 61.35 H new ATOM 0 HG22 ILE A 133 22.602 -2.426 -4.760 1.00 61.35 H new ATOM 0 HG23 ILE A 133 22.689 -4.195 -4.933 1.00 61.35 H new ATOM 0 HD11 ILE A 133 19.916 -4.803 -8.451 1.00 32.43 H new ATOM 0 HD12 ILE A 133 19.656 -3.116 -7.947 1.00 32.43 H new ATOM 0 HD13 ILE A 133 21.310 -3.755 -8.097 1.00 32.43 H new ATOM 2126 N GLY A 134 21.458 -4.687 -2.224 1.00 73.21 N ATOM 2127 CA GLY A 134 21.947 -5.837 -1.471 1.00 63.14 C ATOM 2128 C GLY A 134 21.079 -6.148 -0.257 1.00 61.22 C ATOM 2129 O GLY A 134 21.032 -7.307 0.170 1.00 41.42 O ATOM 0 H GLY A 134 21.807 -3.793 -1.878 1.00 73.21 H new ATOM 0 HA2 GLY A 134 21.979 -6.709 -2.124 1.00 63.14 H new ATOM 0 HA3 GLY A 134 22.969 -5.646 -1.144 1.00 63.14 H new ATOM 2133 N GLU A 135 20.372 -5.153 0.284 1.00 31.54 N ATOM 2134 CA GLU A 135 19.640 -5.276 1.541 1.00 53.33 C ATOM 2135 C GLU A 135 18.159 -5.568 1.325 1.00 14.32 C ATOM 2136 O GLU A 135 17.495 -5.960 2.277 1.00 4.03 O ATOM 2137 CB GLU A 135 19.814 -4.002 2.360 1.00 22.22 C ATOM 2138 CG GLU A 135 21.199 -3.942 3.008 1.00 72.42 C ATOM 2139 CD GLU A 135 21.353 -4.807 4.267 1.00 34.42 C ATOM 2140 OE1 GLU A 135 21.549 -6.040 4.161 1.00 73.52 O ATOM 2141 OE2 GLU A 135 21.357 -4.234 5.382 1.00 21.40 O ATOM 0 H GLU A 135 20.293 -4.231 -0.145 1.00 31.54 H new ATOM 0 HA GLU A 135 20.055 -6.125 2.084 1.00 53.33 H new ATOM 0 HB2 GLU A 135 19.673 -3.132 1.718 1.00 22.22 H new ATOM 0 HB3 GLU A 135 19.046 -3.956 3.133 1.00 22.22 H new ATOM 0 HG2 GLU A 135 21.943 -4.255 2.275 1.00 72.42 H new ATOM 0 HG3 GLU A 135 21.421 -2.906 3.265 1.00 72.42 H new ATOM 2148 N LEU A 136 17.646 -5.493 0.090 1.00 20.22 N ATOM 2149 CA LEU A 136 16.268 -5.855 -0.265 1.00 15.32 C ATOM 2150 C LEU A 136 15.870 -7.174 0.397 1.00 31.14 C ATOM 2151 O LEU A 136 14.877 -7.286 1.112 1.00 63.45 O ATOM 2152 CB LEU A 136 16.174 -5.978 -1.798 1.00 62.13 C ATOM 2153 CG LEU A 136 14.834 -6.545 -2.311 1.00 61.25 C ATOM 2154 CD1 LEU A 136 13.640 -5.658 -1.962 1.00 62.12 C ATOM 2155 CD2 LEU A 136 14.871 -6.743 -3.825 1.00 20.20 C ATOM 0 H LEU A 136 18.191 -5.171 -0.709 1.00 20.22 H new ATOM 0 HA LEU A 136 15.584 -5.084 0.090 1.00 15.32 H new ATOM 0 HB2 LEU A 136 16.331 -4.994 -2.240 1.00 62.13 H new ATOM 0 HB3 LEU A 136 16.984 -6.618 -2.149 1.00 62.13 H new ATOM 0 HG LEU A 136 14.704 -7.503 -1.807 1.00 61.25 H new ATOM 0 HD11 LEU A 136 12.726 -6.109 -2.349 1.00 62.12 H new ATOM 0 HD12 LEU A 136 13.565 -5.558 -0.879 1.00 62.12 H new ATOM 0 HD13 LEU A 136 13.776 -4.673 -2.408 1.00 62.12 H new ATOM 0 HD21 LEU A 136 13.915 -7.144 -4.163 1.00 20.20 H new ATOM 0 HD22 LEU A 136 15.056 -5.786 -4.313 1.00 20.20 H new ATOM 0 HD23 LEU A 136 15.668 -7.441 -4.081 1.00 20.20 H new ATOM 2167 N LYS A 137 16.686 -8.198 0.168 1.00 53.43 N ATOM 2168 CA LYS A 137 16.532 -9.528 0.741 1.00 23.50 C ATOM 2169 C LYS A 137 16.409 -9.455 2.266 1.00 32.13 C ATOM 2170 O LYS A 137 15.532 -10.100 2.839 1.00 20.12 O ATOM 2171 CB LYS A 137 17.750 -10.364 0.330 1.00 72.34 C ATOM 2172 CG LYS A 137 17.856 -10.636 -1.181 1.00 33.44 C ATOM 2173 CD LYS A 137 17.101 -11.890 -1.619 1.00 74.12 C ATOM 2174 CE LYS A 137 17.771 -13.117 -0.989 1.00 1.22 C ATOM 2175 NZ LYS A 137 17.897 -14.220 -1.948 1.00 15.22 N ATOM 0 H LYS A 137 17.500 -8.121 -0.442 1.00 53.43 H new ATOM 0 HA LYS A 137 15.618 -9.991 0.369 1.00 23.50 H new ATOM 0 HB2 LYS A 137 18.654 -9.852 0.659 1.00 72.34 H new ATOM 0 HB3 LYS A 137 17.715 -11.318 0.857 1.00 72.34 H new ATOM 0 HG2 LYS A 137 17.468 -9.776 -1.727 1.00 33.44 H new ATOM 0 HG3 LYS A 137 18.907 -10.738 -1.453 1.00 33.44 H new ATOM 0 HD2 LYS A 137 16.058 -11.829 -1.309 1.00 74.12 H new ATOM 0 HD3 LYS A 137 17.107 -11.973 -2.706 1.00 74.12 H new ATOM 0 HE2 LYS A 137 18.759 -12.842 -0.619 1.00 1.22 H new ATOM 0 HE3 LYS A 137 17.189 -13.448 -0.129 1.00 1.22 H new ATOM 0 HZ1 LYS A 137 18.354 -15.032 -1.486 1.00 15.22 H new ATOM 0 HZ2 LYS A 137 16.953 -14.499 -2.282 1.00 15.22 H new ATOM 0 HZ3 LYS A 137 18.474 -13.912 -2.757 1.00 15.22 H new ATOM 2189 N GLN A 138 17.268 -8.683 2.929 1.00 15.33 N ATOM 2190 CA GLN A 138 17.299 -8.583 4.377 1.00 52.43 C ATOM 2191 C GLN A 138 16.110 -7.807 4.934 1.00 14.20 C ATOM 2192 O GLN A 138 15.553 -8.195 5.957 1.00 55.11 O ATOM 2193 CB GLN A 138 18.633 -7.963 4.829 1.00 15.23 C ATOM 2194 CG GLN A 138 18.950 -8.305 6.289 1.00 55.21 C ATOM 2195 CD GLN A 138 18.938 -9.812 6.537 1.00 71.51 C ATOM 2196 OE1 GLN A 138 19.375 -10.605 5.697 1.00 11.02 O ATOM 2197 NE2 GLN A 138 18.409 -10.236 7.665 1.00 34.33 N ATOM 0 H GLN A 138 17.968 -8.104 2.465 1.00 15.33 H new ATOM 0 HA GLN A 138 17.220 -9.592 4.782 1.00 52.43 H new ATOM 0 HB2 GLN A 138 19.438 -8.323 4.188 1.00 15.23 H new ATOM 0 HB3 GLN A 138 18.590 -6.880 4.710 1.00 15.23 H new ATOM 0 HG2 GLN A 138 19.928 -7.902 6.552 1.00 55.21 H new ATOM 0 HG3 GLN A 138 18.221 -7.824 6.941 1.00 55.21 H new ATOM 0 HE21 GLN A 138 18.054 -9.565 8.346 1.00 34.33 H new ATOM 0 HE22 GLN A 138 18.354 -11.236 7.858 1.00 34.33 H new ATOM 2206 N THR A 139 15.670 -6.741 4.283 1.00 74.23 N ATOM 2207 CA THR A 139 14.479 -6.033 4.712 1.00 1.31 C ATOM 2208 C THR A 139 13.241 -6.915 4.498 1.00 11.04 C ATOM 2209 O THR A 139 12.350 -6.911 5.339 1.00 75.21 O ATOM 2210 CB THR A 139 14.442 -4.688 3.990 1.00 23.41 C ATOM 2211 OG1 THR A 139 15.586 -3.941 4.359 1.00 0.12 O ATOM 2212 CG2 THR A 139 13.175 -3.890 4.298 1.00 3.20 C ATOM 0 H THR A 139 16.121 -6.349 3.456 1.00 74.23 H new ATOM 0 HA THR A 139 14.490 -5.819 5.781 1.00 1.31 H new ATOM 0 HB THR A 139 14.438 -4.882 2.917 1.00 23.41 H new ATOM 0 HG1 THR A 139 15.314 -3.041 4.635 1.00 0.12 H new ATOM 0 HG21 THR A 139 13.201 -2.943 3.759 1.00 3.20 H new ATOM 0 HG22 THR A 139 12.301 -4.461 3.986 1.00 3.20 H new ATOM 0 HG23 THR A 139 13.119 -3.696 5.369 1.00 3.20 H new ATOM 2220 N ILE A 140 13.201 -7.766 3.468 1.00 73.41 N ATOM 2221 CA ILE A 140 12.126 -8.745 3.310 1.00 34.34 C ATOM 2222 C ILE A 140 12.197 -9.759 4.467 1.00 12.11 C ATOM 2223 O ILE A 140 11.148 -10.179 4.958 1.00 23.50 O ATOM 2224 CB ILE A 140 12.145 -9.387 1.898 1.00 63.32 C ATOM 2225 CG1 ILE A 140 11.821 -8.343 0.799 1.00 32.20 C ATOM 2226 CG2 ILE A 140 11.104 -10.519 1.796 1.00 44.21 C ATOM 2227 CD1 ILE A 140 12.175 -8.804 -0.624 1.00 75.44 C ATOM 0 H ILE A 140 13.904 -7.795 2.730 1.00 73.41 H new ATOM 0 HA ILE A 140 11.156 -8.252 3.372 1.00 34.34 H new ATOM 0 HB ILE A 140 13.149 -9.782 1.747 1.00 63.32 H new ATOM 0 HG12 ILE A 140 10.758 -8.106 0.839 1.00 32.20 H new ATOM 0 HG13 ILE A 140 12.361 -7.422 1.017 1.00 32.20 H new ATOM 0 HG21 ILE A 140 11.136 -10.954 0.797 1.00 44.21 H new ATOM 0 HG22 ILE A 140 11.330 -11.289 2.534 1.00 44.21 H new ATOM 0 HG23 ILE A 140 10.109 -10.116 1.985 1.00 44.21 H new ATOM 0 HD11 ILE A 140 11.919 -8.019 -1.335 1.00 75.44 H new ATOM 0 HD12 ILE A 140 13.243 -9.013 -0.684 1.00 75.44 H new ATOM 0 HD13 ILE A 140 11.615 -9.708 -0.864 1.00 75.44 H new ATOM 2239 N GLN A 141 13.395 -10.137 4.939 1.00 64.43 N ATOM 2240 CA GLN A 141 13.553 -10.945 6.152 1.00 14.10 C ATOM 2241 C GLN A 141 12.886 -10.274 7.341 1.00 23.12 C ATOM 2242 O GLN A 141 12.060 -10.892 8.010 1.00 73.44 O ATOM 2243 CB GLN A 141 15.007 -11.349 6.428 1.00 73.54 C ATOM 2244 CG GLN A 141 15.620 -12.188 5.292 1.00 12.20 C ATOM 2245 CD GLN A 141 15.854 -13.648 5.669 1.00 74.55 C ATOM 2246 OE1 GLN A 141 15.091 -14.243 6.424 1.00 44.42 O ATOM 2247 NE2 GLN A 141 16.844 -14.278 5.069 1.00 64.45 N ATOM 0 H GLN A 141 14.277 -9.891 4.490 1.00 64.43 H new ATOM 0 HA GLN A 141 13.035 -11.888 5.978 1.00 14.10 H new ATOM 0 HB2 GLN A 141 15.607 -10.451 6.574 1.00 73.54 H new ATOM 0 HB3 GLN A 141 15.051 -11.917 7.357 1.00 73.54 H new ATOM 0 HG2 GLN A 141 14.961 -12.146 4.425 1.00 12.20 H new ATOM 0 HG3 GLN A 141 16.569 -11.742 4.993 1.00 12.20 H new ATOM 0 HE21 GLN A 141 17.469 -13.768 4.445 1.00 64.45 H new ATOM 0 HE22 GLN A 141 16.985 -15.275 5.229 1.00 64.45 H new ATOM 2256 N ASN A 142 13.195 -8.999 7.530 1.00 23.34 N ATOM 2257 CA ASN A 142 12.681 -8.201 8.641 1.00 41.23 C ATOM 2258 C ASN A 142 11.157 -8.045 8.570 1.00 4.04 C ATOM 2259 O ASN A 142 10.468 -8.222 9.569 1.00 35.40 O ATOM 2260 CB ASN A 142 13.385 -6.840 8.664 1.00 22.51 C ATOM 2261 CG ASN A 142 14.735 -6.899 9.360 1.00 51.22 C ATOM 2262 OD1 ASN A 142 14.848 -6.609 10.549 1.00 72.51 O ATOM 2263 ND2 ASN A 142 15.793 -7.268 8.659 1.00 24.53 N ATOM 0 H ASN A 142 13.817 -8.481 6.910 1.00 23.34 H new ATOM 0 HA ASN A 142 12.896 -8.724 9.573 1.00 41.23 H new ATOM 0 HB2 ASN A 142 13.521 -6.487 7.642 1.00 22.51 H new ATOM 0 HB3 ASN A 142 12.749 -6.113 9.170 1.00 22.51 H new ATOM 0 HD21 ASN A 142 16.709 -7.313 9.104 1.00 24.53 H new ATOM 0 HD22 ASN A 142 15.693 -7.508 7.673 1.00 24.53 H new ATOM 2270 N VAL A 143 10.596 -7.799 7.386 1.00 20.52 N ATOM 2271 CA VAL A 143 9.159 -7.588 7.197 1.00 41.41 C ATOM 2272 C VAL A 143 8.346 -8.807 7.636 1.00 73.52 C ATOM 2273 O VAL A 143 7.211 -8.667 8.094 1.00 54.45 O ATOM 2274 CB VAL A 143 8.906 -7.215 5.722 1.00 2.01 C ATOM 2275 CG1 VAL A 143 7.426 -7.339 5.320 1.00 23.42 C ATOM 2276 CG2 VAL A 143 9.375 -5.773 5.458 1.00 2.02 C ATOM 0 H VAL A 143 11.132 -7.740 6.520 1.00 20.52 H new ATOM 0 HA VAL A 143 8.824 -6.767 7.831 1.00 41.41 H new ATOM 0 HB VAL A 143 9.474 -7.923 5.119 1.00 2.01 H new ATOM 0 HG11 VAL A 143 7.309 -7.064 4.272 1.00 23.42 H new ATOM 0 HG12 VAL A 143 7.095 -8.367 5.464 1.00 23.42 H new ATOM 0 HG13 VAL A 143 6.824 -6.674 5.939 1.00 23.42 H new ATOM 0 HG21 VAL A 143 9.193 -5.517 4.414 1.00 2.02 H new ATOM 0 HG22 VAL A 143 8.824 -5.087 6.101 1.00 2.02 H new ATOM 0 HG23 VAL A 143 10.441 -5.692 5.671 1.00 2.02 H new ATOM 2286 N LYS A 144 8.894 -10.018 7.501 1.00 31.22 N ATOM 2287 CA LYS A 144 8.196 -11.223 7.939 1.00 32.53 C ATOM 2288 C LYS A 144 7.939 -11.182 9.444 1.00 62.21 C ATOM 2289 O LYS A 144 6.944 -11.743 9.892 1.00 40.12 O ATOM 2290 CB LYS A 144 9.010 -12.459 7.544 1.00 74.44 C ATOM 2291 CG LYS A 144 8.897 -12.717 6.037 1.00 11.02 C ATOM 2292 CD LYS A 144 9.837 -13.815 5.523 1.00 2.14 C ATOM 2293 CE LYS A 144 11.280 -13.351 5.701 1.00 20.13 C ATOM 2294 NZ LYS A 144 12.275 -14.102 4.919 1.00 21.20 N ATOM 0 H LYS A 144 9.814 -10.186 7.094 1.00 31.22 H new ATOM 0 HA LYS A 144 7.225 -11.275 7.446 1.00 32.53 H new ATOM 0 HB2 LYS A 144 10.055 -12.316 7.817 1.00 74.44 H new ATOM 0 HB3 LYS A 144 8.653 -13.329 8.096 1.00 74.44 H new ATOM 0 HG2 LYS A 144 7.869 -12.993 5.801 1.00 11.02 H new ATOM 0 HG3 LYS A 144 9.109 -11.791 5.503 1.00 11.02 H new ATOM 0 HD2 LYS A 144 9.669 -14.742 6.070 1.00 2.14 H new ATOM 0 HD3 LYS A 144 9.635 -14.024 4.472 1.00 2.14 H new ATOM 0 HE2 LYS A 144 11.344 -12.298 5.427 1.00 20.13 H new ATOM 0 HE3 LYS A 144 11.541 -13.422 6.757 1.00 20.13 H new ATOM 0 HZ1 LYS A 144 13.178 -14.121 5.434 1.00 21.20 H new ATOM 0 HZ2 LYS A 144 11.939 -15.075 4.773 1.00 21.20 H new ATOM 0 HZ3 LYS A 144 12.412 -13.641 3.997 1.00 21.20 H new ATOM 2308 N GLU A 145 8.820 -10.537 10.203 1.00 53.03 N ATOM 2309 CA GLU A 145 8.760 -10.417 11.647 1.00 61.42 C ATOM 2310 C GLU A 145 7.682 -9.387 11.988 1.00 64.13 C ATOM 2311 O GLU A 145 6.775 -9.704 12.753 1.00 11.03 O ATOM 2312 CB GLU A 145 10.160 -10.063 12.194 1.00 53.35 C ATOM 2313 CG GLU A 145 11.231 -11.005 11.597 1.00 14.12 C ATOM 2314 CD GLU A 145 12.674 -10.699 11.988 1.00 33.30 C ATOM 2315 OE1 GLU A 145 13.048 -9.512 12.123 1.00 0.03 O ATOM 2316 OE2 GLU A 145 13.476 -11.662 12.019 1.00 15.33 O ATOM 0 H GLU A 145 9.631 -10.064 9.805 1.00 53.03 H new ATOM 0 HA GLU A 145 8.482 -11.356 12.126 1.00 61.42 H new ATOM 0 HB2 GLU A 145 10.401 -9.028 11.950 1.00 53.35 H new ATOM 0 HB3 GLU A 145 10.163 -10.143 13.281 1.00 53.35 H new ATOM 0 HG2 GLU A 145 11.000 -12.026 11.901 1.00 14.12 H new ATOM 0 HG3 GLU A 145 11.153 -10.971 10.510 1.00 14.12 H new ATOM 2323 N GLU A 146 7.689 -8.211 11.347 1.00 21.13 N ATOM 2324 CA GLU A 146 6.632 -7.207 11.505 1.00 42.02 C ATOM 2325 C GLU A 146 5.254 -7.827 11.220 1.00 10.21 C ATOM 2326 O GLU A 146 4.349 -7.786 12.054 1.00 5.44 O ATOM 2327 CB GLU A 146 6.870 -6.034 10.549 1.00 41.20 C ATOM 2328 CG GLU A 146 8.230 -5.343 10.619 1.00 24.21 C ATOM 2329 CD GLU A 146 8.446 -4.462 11.859 1.00 74.52 C ATOM 2330 OE1 GLU A 146 7.912 -3.317 11.863 1.00 13.11 O ATOM 2331 OE2 GLU A 146 9.195 -4.864 12.771 1.00 33.11 O ATOM 0 H GLU A 146 8.429 -7.930 10.704 1.00 21.13 H new ATOM 0 HA GLU A 146 6.654 -6.846 12.533 1.00 42.02 H new ATOM 0 HB2 GLU A 146 6.726 -6.394 9.530 1.00 41.20 H new ATOM 0 HB3 GLU A 146 6.100 -5.285 10.735 1.00 41.20 H new ATOM 0 HG2 GLU A 146 9.010 -6.104 10.592 1.00 24.21 H new ATOM 0 HG3 GLU A 146 8.355 -4.728 9.728 1.00 24.21 H new ATOM 2338 N ASN A 147 5.107 -8.471 10.056 1.00 32.25 N ATOM 2339 CA ASN A 147 3.853 -9.087 9.620 1.00 15.44 C ATOM 2340 C ASN A 147 3.372 -10.151 10.606 1.00 44.40 C ATOM 2341 O ASN A 147 2.175 -10.442 10.675 1.00 35.21 O ATOM 2342 CB ASN A 147 4.025 -9.791 8.264 1.00 24.53 C ATOM 2343 CG ASN A 147 4.215 -8.874 7.068 1.00 74.24 C ATOM 2344 OD1 ASN A 147 4.034 -7.663 7.122 1.00 61.20 O ATOM 2345 ND2 ASN A 147 4.540 -9.468 5.931 1.00 51.40 N ATOM 0 H ASN A 147 5.866 -8.579 9.384 1.00 32.25 H new ATOM 0 HA ASN A 147 3.129 -8.275 9.552 1.00 15.44 H new ATOM 0 HB2 ASN A 147 4.885 -10.458 8.328 1.00 24.53 H new ATOM 0 HB3 ASN A 147 3.149 -10.415 8.085 1.00 24.53 H new ATOM 0 HD21 ASN A 147 4.644 -8.917 5.079 1.00 51.40 H new ATOM 0 HD22 ASN A 147 4.686 -10.477 5.906 1.00 51.40 H new ATOM 2352 N ALA A 148 4.296 -10.794 11.322 1.00 64.12 N ATOM 2353 CA ALA A 148 3.959 -11.855 12.248 1.00 44.41 C ATOM 2354 C ALA A 148 3.504 -11.319 13.609 1.00 44.44 C ATOM 2355 O ALA A 148 2.914 -12.087 14.373 1.00 41.03 O ATOM 2356 CB ALA A 148 5.154 -12.801 12.405 1.00 63.34 C ATOM 0 H ALA A 148 5.294 -10.588 11.270 1.00 64.12 H new ATOM 0 HA ALA A 148 3.114 -12.404 11.833 1.00 44.41 H new ATOM 0 HB1 ALA A 148 4.898 -13.598 13.102 1.00 63.34 H new ATOM 0 HB2 ALA A 148 5.406 -13.233 11.436 1.00 63.34 H new ATOM 0 HB3 ALA A 148 6.010 -12.245 12.788 1.00 63.34 H new ATOM 2362 N ALA A 149 3.750 -10.038 13.908 1.00 51.33 N ATOM 2363 CA ALA A 149 3.066 -9.310 14.967 1.00 12.43 C ATOM 2364 C ALA A 149 1.643 -9.016 14.498 1.00 33.34 C ATOM 2365 O ALA A 149 0.697 -9.427 15.162 1.00 2.25 O ATOM 2366 CB ALA A 149 3.825 -8.022 15.321 1.00 74.11 C ATOM 0 H ALA A 149 4.441 -9.476 13.410 1.00 51.33 H new ATOM 0 HA ALA A 149 3.030 -9.910 15.876 1.00 12.43 H new ATOM 0 HB1 ALA A 149 3.296 -7.494 16.114 1.00 74.11 H new ATOM 0 HB2 ALA A 149 4.830 -8.273 15.660 1.00 74.11 H new ATOM 0 HB3 ALA A 149 3.888 -7.383 14.440 1.00 74.11 H new ATOM 2372 N PHE A 150 1.476 -8.395 13.319 1.00 33.24 N ATOM 2373 CA PHE A 150 0.166 -8.020 12.771 1.00 5.13 C ATOM 2374 C PHE A 150 -0.855 -9.151 12.910 1.00 4.04 C ATOM 2375 O PHE A 150 -1.973 -8.951 13.391 1.00 32.44 O ATOM 2376 CB PHE A 150 0.271 -7.629 11.285 1.00 64.24 C ATOM 2377 CG PHE A 150 -1.012 -7.017 10.770 1.00 51.10 C ATOM 2378 CD1 PHE A 150 -2.095 -7.848 10.435 1.00 53.21 C ATOM 2379 CD2 PHE A 150 -1.171 -5.622 10.741 1.00 42.10 C ATOM 2380 CE1 PHE A 150 -3.346 -7.298 10.126 1.00 40.44 C ATOM 2381 CE2 PHE A 150 -2.427 -5.069 10.447 1.00 30.35 C ATOM 2382 CZ PHE A 150 -3.520 -5.907 10.167 1.00 1.34 C ATOM 0 H PHE A 150 2.256 -8.137 12.715 1.00 33.24 H new ATOM 0 HA PHE A 150 -0.173 -7.162 13.351 1.00 5.13 H new ATOM 0 HB2 PHE A 150 1.089 -6.921 11.153 1.00 64.24 H new ATOM 0 HB3 PHE A 150 0.515 -8.512 10.694 1.00 64.24 H new ATOM 0 HD1 PHE A 150 -1.962 -8.920 10.416 1.00 53.21 H new ATOM 0 HD2 PHE A 150 -0.329 -4.977 10.944 1.00 42.10 H new ATOM 0 HE1 PHE A 150 -4.171 -7.941 9.858 1.00 40.44 H new ATOM 0 HE2 PHE A 150 -2.554 -3.997 10.436 1.00 30.35 H new ATOM 0 HZ PHE A 150 -4.495 -5.479 9.983 1.00 1.34 H new ATOM 2392 N LYS A 151 -0.478 -10.341 12.433 1.00 31.55 N ATOM 2393 CA LYS A 151 -1.369 -11.492 12.380 1.00 72.30 C ATOM 2394 C LYS A 151 -1.839 -11.958 13.760 1.00 1.12 C ATOM 2395 O LYS A 151 -2.823 -12.680 13.838 1.00 14.21 O ATOM 2396 CB LYS A 151 -0.714 -12.609 11.562 1.00 62.40 C ATOM 2397 CG LYS A 151 0.081 -13.551 12.475 1.00 4.25 C ATOM 2398 CD LYS A 151 1.120 -14.470 11.835 1.00 64.33 C ATOM 2399 CE LYS A 151 0.689 -14.882 10.448 1.00 14.01 C ATOM 2400 NZ LYS A 151 -0.482 -15.785 10.478 1.00 44.44 N ATOM 0 H LYS A 151 0.458 -10.528 12.073 1.00 31.55 H new ATOM 0 HA LYS A 151 -2.285 -11.187 11.874 1.00 72.30 H new ATOM 0 HB2 LYS A 151 -1.479 -13.172 11.027 1.00 62.40 H new ATOM 0 HB3 LYS A 151 -0.052 -12.177 10.811 1.00 62.40 H new ATOM 0 HG2 LYS A 151 0.591 -12.941 13.220 1.00 4.25 H new ATOM 0 HG3 LYS A 151 -0.633 -14.177 13.010 1.00 4.25 H new ATOM 0 HD2 LYS A 151 2.082 -13.960 11.785 1.00 64.33 H new ATOM 0 HD3 LYS A 151 1.260 -15.355 12.455 1.00 64.33 H new ATOM 0 HE2 LYS A 151 0.447 -13.994 9.864 1.00 14.01 H new ATOM 0 HE3 LYS A 151 1.517 -15.379 9.943 1.00 14.01 H new ATOM 0 HZ1 LYS A 151 -0.404 -16.480 9.708 1.00 44.44 H new ATOM 0 HZ2 LYS A 151 -0.514 -16.282 11.391 1.00 44.44 H new ATOM 0 HZ3 LYS A 151 -1.352 -15.229 10.356 1.00 44.44 H new ATOM 2414 N GLU A 152 -1.105 -11.632 14.819 1.00 43.40 N ATOM 2415 CA GLU A 152 -1.426 -12.057 16.168 1.00 13.04 C ATOM 2416 C GLU A 152 -2.653 -11.280 16.656 1.00 62.11 C ATOM 2417 O GLU A 152 -3.547 -11.837 17.289 1.00 41.13 O ATOM 2418 CB GLU A 152 -0.177 -11.853 17.041 1.00 50.22 C ATOM 2419 CG GLU A 152 -0.117 -12.877 18.182 1.00 31.43 C ATOM 2420 CD GLU A 152 -0.634 -12.341 19.514 1.00 53.13 C ATOM 2421 OE1 GLU A 152 0.127 -11.650 20.220 1.00 2.31 O ATOM 2422 OE2 GLU A 152 -1.788 -12.655 19.884 1.00 52.40 O ATOM 0 H GLU A 152 -0.263 -11.059 14.759 1.00 43.40 H new ATOM 0 HA GLU A 152 -1.690 -13.113 16.218 1.00 13.04 H new ATOM 0 HB2 GLU A 152 0.718 -11.940 16.425 1.00 50.22 H new ATOM 0 HB3 GLU A 152 -0.182 -10.845 17.455 1.00 50.22 H new ATOM 0 HG2 GLU A 152 -0.700 -13.754 17.902 1.00 31.43 H new ATOM 0 HG3 GLU A 152 0.914 -13.207 18.309 1.00 31.43 H new ATOM 2429 N ILE A 153 -2.718 -9.997 16.303 1.00 30.42 N ATOM 2430 CA ILE A 153 -3.728 -9.042 16.730 1.00 42.44 C ATOM 2431 C ILE A 153 -4.998 -9.217 15.885 1.00 71.54 C ATOM 2432 O ILE A 153 -6.114 -9.280 16.413 1.00 73.44 O ATOM 2433 CB ILE A 153 -3.172 -7.609 16.561 1.00 10.42 C ATOM 2434 CG1 ILE A 153 -1.699 -7.424 17.005 1.00 64.53 C ATOM 2435 CG2 ILE A 153 -4.080 -6.605 17.293 1.00 14.34 C ATOM 2436 CD1 ILE A 153 -1.100 -6.076 16.602 1.00 73.40 C ATOM 0 H ILE A 153 -2.029 -9.578 15.678 1.00 30.42 H new ATOM 0 HA ILE A 153 -3.977 -9.213 17.777 1.00 42.44 H new ATOM 0 HB ILE A 153 -3.173 -7.418 15.488 1.00 10.42 H new ATOM 0 HG12 ILE A 153 -1.640 -7.529 18.088 1.00 64.53 H new ATOM 0 HG13 ILE A 153 -1.096 -8.223 16.574 1.00 64.53 H new ATOM 0 HG21 ILE A 153 -3.682 -5.598 17.170 1.00 14.34 H new ATOM 0 HG22 ILE A 153 -5.086 -6.652 16.875 1.00 14.34 H new ATOM 0 HG23 ILE A 153 -4.116 -6.853 18.354 1.00 14.34 H new ATOM 0 HD11 ILE A 153 -0.067 -6.019 16.947 1.00 73.40 H new ATOM 0 HD12 ILE A 153 -1.126 -5.976 15.517 1.00 73.40 H new ATOM 0 HD13 ILE A 153 -1.679 -5.271 17.055 1.00 73.40 H new ATOM 2448 N HIS A 154 -4.842 -9.236 14.556 1.00 73.42 N ATOM 2449 CA HIS A 154 -5.945 -9.169 13.598 1.00 24.11 C ATOM 2450 C HIS A 154 -5.664 -10.055 12.370 1.00 34.12 C ATOM 2451 O HIS A 154 -5.336 -9.547 11.298 1.00 34.13 O ATOM 2452 CB HIS A 154 -6.336 -7.705 13.287 1.00 2.24 C ATOM 2453 CG HIS A 154 -5.271 -6.649 13.499 1.00 62.30 C ATOM 2454 ND1 HIS A 154 -3.965 -6.673 13.055 1.00 32.21 N ATOM 2455 CD2 HIS A 154 -5.426 -5.504 14.235 1.00 62.33 C ATOM 2456 CE1 HIS A 154 -3.357 -5.561 13.501 1.00 32.44 C ATOM 2457 NE2 HIS A 154 -4.209 -4.824 14.230 1.00 74.10 N ATOM 0 H HIS A 154 -3.927 -9.300 14.111 1.00 73.42 H new ATOM 0 HA HIS A 154 -6.841 -9.595 14.048 1.00 24.11 H new ATOM 0 HB2 HIS A 154 -6.661 -7.655 12.248 1.00 2.24 H new ATOM 0 HB3 HIS A 154 -7.197 -7.446 13.903 1.00 2.24 H new ATOM 0 HD1 HIS A 154 -3.537 -7.405 12.488 1.00 32.21 H new ATOM 0 HD2 HIS A 154 -6.331 -5.185 14.731 1.00 62.33 H new ATOM 0 HE1 HIS A 154 -2.329 -5.298 13.301 1.00 32.44 H new ATOM 2465 N PRO A 155 -5.761 -11.388 12.514 1.00 63.41 N ATOM 2466 CA PRO A 155 -5.501 -12.341 11.440 1.00 55.33 C ATOM 2467 C PRO A 155 -6.556 -12.307 10.336 1.00 23.45 C ATOM 2468 O PRO A 155 -7.743 -11.994 10.577 1.00 73.13 O ATOM 2469 CB PRO A 155 -5.431 -13.716 12.102 1.00 33.32 C ATOM 2470 CG PRO A 155 -6.192 -13.552 13.416 1.00 71.20 C ATOM 2471 CD PRO A 155 -6.024 -12.079 13.770 1.00 52.31 C ATOM 0 HA PRO A 155 -4.569 -12.087 10.935 1.00 55.33 H new ATOM 0 HB2 PRO A 155 -5.886 -14.482 11.474 1.00 33.32 H new ATOM 0 HB3 PRO A 155 -4.399 -14.019 12.277 1.00 33.32 H new ATOM 0 HG2 PRO A 155 -7.243 -13.816 13.302 1.00 71.20 H new ATOM 0 HG3 PRO A 155 -5.784 -14.197 14.195 1.00 71.20 H new ATOM 0 HD2 PRO A 155 -6.922 -11.689 14.249 1.00 52.31 H new ATOM 0 HD3 PRO A 155 -5.202 -11.938 14.472 1.00 52.31 H new TER 2479 PRO A 155