USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 836 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -174:sc= 0 (180deg=-0.0279) USER MOD Single : A 2 SER OG : rot 47:sc= 0.167 USER MOD Single : A 3 SER OG : rot -12:sc= 0.285! USER MOD Single : A 5 SER OG : rot -60:sc= 0.24 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= -0.0019 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.2) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 22 ASN : amide:sc= -0.957 K(o=-0.96,f=-0.048) USER MOD Single : A 25 CYS SG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0.122 USER MOD Single : A 33 GLN : amide:sc= -0.0137 X(o=-0.014,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 SER OG : rot 27:sc= 0.0681 USER MOD Single : A 43 HIS : no HD1:sc= -0.0397 X(o=-0.04,f=-0.25) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -156:sc= -0.421 (180deg=-0.524) USER MOD Single : A 61 SER OG : rot -170:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -120:sc= 0.389 (180deg=-0.33) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 GLN : amide:sc= -0.0955 X(o=-0.096,f=-0.16) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.860 -5.444 -7.310 1.00 0.00 N ATOM 2 CA GLY A 1 2.028 -4.978 -5.946 1.00 0.00 C ATOM 3 C GLY A 1 1.217 -3.731 -5.655 1.00 0.00 C ATOM 4 O GLY A 1 0.615 -3.608 -4.588 1.00 0.00 O ATOM 0 H1 GLY A 1 2.352 -6.352 -7.430 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.848 -5.570 -7.512 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.260 -4.744 -7.968 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.733 -5.769 -5.256 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.083 -4.773 -5.763 1.00 0.00 H new ATOM 8 N SER A 2 1.201 -2.802 -6.606 1.00 0.00 N ATOM 9 CA SER A 2 0.463 -1.555 -6.444 1.00 0.00 C ATOM 10 C SER A 2 0.080 -0.971 -7.800 1.00 0.00 C ATOM 11 O SER A 2 0.907 -0.368 -8.485 1.00 0.00 O ATOM 12 CB SER A 2 1.296 -0.542 -5.657 1.00 0.00 C ATOM 13 OG SER A 2 2.624 -0.483 -6.148 1.00 0.00 O ATOM 0 H SER A 2 1.691 -2.890 -7.496 1.00 0.00 H new ATOM 0 HA SER A 2 -0.450 -1.772 -5.890 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.836 0.444 -5.725 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.307 -0.816 -4.602 1.00 0.00 H new ATOM 0 HG SER A 2 2.609 -0.422 -7.126 1.00 0.00 H new ATOM 19 N SER A 3 -1.180 -1.154 -8.182 1.00 0.00 N ATOM 20 CA SER A 3 -1.673 -0.648 -9.458 1.00 0.00 C ATOM 21 C SER A 3 -3.182 -0.842 -9.572 1.00 0.00 C ATOM 22 O SER A 3 -3.694 -1.945 -9.387 1.00 0.00 O ATOM 23 CB SER A 3 -0.968 -1.355 -10.617 1.00 0.00 C ATOM 24 OG SER A 3 -1.680 -2.513 -11.017 1.00 0.00 O ATOM 0 H SER A 3 -1.878 -1.649 -7.626 1.00 0.00 H new ATOM 0 HA SER A 3 -1.456 0.419 -9.506 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.875 -0.672 -11.461 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.043 -1.631 -10.318 1.00 0.00 H new ATOM 0 HG SER A 3 -2.360 -2.728 -10.344 1.00 0.00 H new ATOM 30 N GLY A 4 -3.890 0.242 -9.878 1.00 0.00 N ATOM 31 CA GLY A 4 -5.333 0.172 -10.011 1.00 0.00 C ATOM 32 C GLY A 4 -5.772 -0.079 -11.441 1.00 0.00 C ATOM 33 O GLY A 4 -5.576 -1.170 -11.975 1.00 0.00 O ATOM 0 H GLY A 4 -3.489 1.167 -10.036 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -5.716 -0.624 -9.372 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.773 1.104 -9.657 1.00 0.00 H new ATOM 37 N SER A 5 -6.369 0.934 -12.061 1.00 0.00 N ATOM 38 CA SER A 5 -6.842 0.816 -13.435 1.00 0.00 C ATOM 39 C SER A 5 -6.537 2.086 -14.225 1.00 0.00 C ATOM 40 O SER A 5 -7.424 2.673 -14.845 1.00 0.00 O ATOM 41 CB SER A 5 -8.346 0.538 -13.457 1.00 0.00 C ATOM 42 OG SER A 5 -8.788 0.226 -14.767 1.00 0.00 O ATOM 0 H SER A 5 -6.536 1.845 -11.634 1.00 0.00 H new ATOM 0 HA SER A 5 -6.319 -0.018 -13.903 1.00 0.00 H new ATOM 0 HB2 SER A 5 -8.576 -0.289 -12.786 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.886 1.409 -13.086 1.00 0.00 H new ATOM 0 HG SER A 5 -8.599 0.980 -15.364 1.00 0.00 H new ATOM 48 N SER A 6 -5.275 2.503 -14.197 1.00 0.00 N ATOM 49 CA SER A 6 -4.852 3.705 -14.907 1.00 0.00 C ATOM 50 C SER A 6 -3.556 3.455 -15.673 1.00 0.00 C ATOM 51 O SER A 6 -2.476 3.398 -15.087 1.00 0.00 O ATOM 52 CB SER A 6 -4.662 4.863 -13.925 1.00 0.00 C ATOM 53 OG SER A 6 -4.125 4.406 -12.695 1.00 0.00 O ATOM 0 H SER A 6 -4.528 2.027 -13.691 1.00 0.00 H new ATOM 0 HA SER A 6 -5.632 3.969 -15.622 1.00 0.00 H new ATOM 0 HB2 SER A 6 -3.997 5.608 -14.361 1.00 0.00 H new ATOM 0 HB3 SER A 6 -5.619 5.354 -13.748 1.00 0.00 H new ATOM 0 HG SER A 6 -4.011 5.165 -12.086 1.00 0.00 H new ATOM 59 N GLY A 7 -3.673 3.308 -16.989 1.00 0.00 N ATOM 60 CA GLY A 7 -2.505 3.066 -17.816 1.00 0.00 C ATOM 61 C GLY A 7 -2.813 3.162 -19.297 1.00 0.00 C ATOM 62 O GLY A 7 -3.800 3.779 -19.695 1.00 0.00 O ATOM 0 H GLY A 7 -4.556 3.352 -17.498 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.728 3.787 -17.562 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.106 2.076 -17.595 1.00 0.00 H new ATOM 66 N LYS A 8 -1.964 2.550 -20.116 1.00 0.00 N ATOM 67 CA LYS A 8 -2.149 2.568 -21.562 1.00 0.00 C ATOM 68 C LYS A 8 -2.216 3.999 -22.085 1.00 0.00 C ATOM 69 O LYS A 8 -3.300 4.547 -22.286 1.00 0.00 O ATOM 70 CB LYS A 8 -3.426 1.815 -21.944 1.00 0.00 C ATOM 71 CG LYS A 8 -3.386 0.336 -21.598 1.00 0.00 C ATOM 72 CD LYS A 8 -3.373 -0.528 -22.848 1.00 0.00 C ATOM 73 CE LYS A 8 -2.403 -1.692 -22.711 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.991 -2.814 -21.927 1.00 0.00 N ATOM 0 H LYS A 8 -1.141 2.035 -19.803 1.00 0.00 H new ATOM 0 HA LYS A 8 -1.292 2.073 -22.018 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -4.275 2.275 -21.438 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -3.596 1.925 -23.015 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -2.500 0.125 -20.999 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -4.252 0.081 -20.987 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -4.376 -0.909 -23.038 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -3.094 0.080 -23.709 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.122 -2.049 -23.702 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.490 -1.349 -22.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.300 -3.588 -21.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -3.236 -2.480 -20.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -3.848 -3.159 -22.404 1.00 0.00 H new ATOM 88 N TYR A 9 -1.051 4.599 -22.302 1.00 0.00 N ATOM 89 CA TYR A 9 -0.977 5.968 -22.800 1.00 0.00 C ATOM 90 C TYR A 9 -0.614 5.990 -24.282 1.00 0.00 C ATOM 91 O TYR A 9 -1.458 6.263 -25.137 1.00 0.00 O ATOM 92 CB TYR A 9 0.050 6.769 -22.000 1.00 0.00 C ATOM 93 CG TYR A 9 -0.551 7.552 -20.854 1.00 0.00 C ATOM 94 CD1 TYR A 9 -1.325 6.921 -19.888 1.00 0.00 C ATOM 95 CD2 TYR A 9 -0.345 8.921 -20.738 1.00 0.00 C ATOM 96 CE1 TYR A 9 -1.877 7.632 -18.840 1.00 0.00 C ATOM 97 CE2 TYR A 9 -0.892 9.639 -19.693 1.00 0.00 C ATOM 98 CZ TYR A 9 -1.657 8.990 -18.746 1.00 0.00 C ATOM 99 OH TYR A 9 -2.205 9.703 -17.704 1.00 0.00 O ATOM 0 H TYR A 9 -0.145 4.159 -22.141 1.00 0.00 H new ATOM 0 HA TYR A 9 -1.959 6.425 -22.678 1.00 0.00 H new ATOM 0 HB2 TYR A 9 0.804 6.087 -21.607 1.00 0.00 H new ATOM 0 HB3 TYR A 9 0.563 7.459 -22.671 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -1.498 5.857 -19.958 1.00 0.00 H new ATOM 0 HD2 TYR A 9 0.253 9.432 -21.478 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -2.478 7.127 -18.098 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -0.722 10.703 -19.617 1.00 0.00 H new ATOM 0 HH TYR A 9 -1.953 10.647 -17.785 1.00 0.00 H new ATOM 109 N THR A 10 0.648 5.699 -24.580 1.00 0.00 N ATOM 110 CA THR A 10 1.126 5.685 -25.957 1.00 0.00 C ATOM 111 C THR A 10 2.125 4.556 -26.181 1.00 0.00 C ATOM 112 O THR A 10 3.107 4.720 -26.904 1.00 0.00 O ATOM 113 CB THR A 10 1.787 7.024 -26.336 1.00 0.00 C ATOM 114 OG1 THR A 10 1.110 8.106 -25.687 1.00 0.00 O ATOM 115 CG2 THR A 10 1.761 7.233 -27.842 1.00 0.00 C ATOM 0 H THR A 10 1.359 5.469 -23.885 1.00 0.00 H new ATOM 0 HA THR A 10 0.255 5.526 -26.592 1.00 0.00 H new ATOM 0 HB THR A 10 2.826 6.997 -26.007 1.00 0.00 H new ATOM 0 HG1 THR A 10 1.537 8.953 -25.932 1.00 0.00 H new ATOM 0 HG21 THR A 10 2.233 8.185 -28.085 1.00 0.00 H new ATOM 0 HG22 THR A 10 2.303 6.424 -28.331 1.00 0.00 H new ATOM 0 HG23 THR A 10 0.728 7.241 -28.190 1.00 0.00 H new ATOM 123 N GLN A 11 1.867 3.411 -25.557 1.00 0.00 N ATOM 124 CA GLN A 11 2.745 2.255 -25.690 1.00 0.00 C ATOM 125 C GLN A 11 4.159 2.589 -25.226 1.00 0.00 C ATOM 126 O GLN A 11 5.047 2.837 -26.040 1.00 0.00 O ATOM 127 CB GLN A 11 2.773 1.773 -27.141 1.00 0.00 C ATOM 128 CG GLN A 11 1.689 0.757 -27.466 1.00 0.00 C ATOM 129 CD GLN A 11 1.895 0.094 -28.813 1.00 0.00 C ATOM 130 OE1 GLN A 11 1.330 0.519 -29.821 1.00 0.00 O ATOM 131 NE2 GLN A 11 2.710 -0.955 -28.838 1.00 0.00 N ATOM 0 H GLN A 11 1.058 3.259 -24.955 1.00 0.00 H new ATOM 0 HA GLN A 11 2.353 1.459 -25.058 1.00 0.00 H new ATOM 0 HB2 GLN A 11 2.664 2.632 -27.803 1.00 0.00 H new ATOM 0 HB3 GLN A 11 3.747 1.331 -27.350 1.00 0.00 H new ATOM 0 HG2 GLN A 11 1.668 -0.007 -26.689 1.00 0.00 H new ATOM 0 HG3 GLN A 11 0.718 1.251 -27.454 1.00 0.00 H new ATOM 0 HE21 GLN A 11 3.158 -1.274 -27.979 1.00 0.00 H new ATOM 0 HE22 GLN A 11 2.888 -1.442 -29.717 1.00 0.00 H new ATOM 140 N ASN A 12 4.360 2.594 -23.912 1.00 0.00 N ATOM 141 CA ASN A 12 5.666 2.898 -23.339 1.00 0.00 C ATOM 142 C ASN A 12 6.749 2.019 -23.957 1.00 0.00 C ATOM 143 O ASN A 12 6.453 1.045 -24.647 1.00 0.00 O ATOM 144 CB ASN A 12 5.639 2.703 -21.822 1.00 0.00 C ATOM 145 CG ASN A 12 4.862 1.467 -21.412 1.00 0.00 C ATOM 146 OD1 ASN A 12 5.370 0.348 -21.486 1.00 0.00 O ATOM 147 ND2 ASN A 12 3.623 1.664 -20.976 1.00 0.00 N ATOM 0 H ASN A 12 3.635 2.391 -23.224 1.00 0.00 H new ATOM 0 HA ASN A 12 5.898 3.940 -23.560 1.00 0.00 H new ATOM 0 HB2 ASN A 12 6.661 2.627 -21.450 1.00 0.00 H new ATOM 0 HB3 ASN A 12 5.194 3.581 -21.353 1.00 0.00 H new ATOM 0 HD21 ASN A 12 3.052 0.870 -20.686 1.00 0.00 H new ATOM 0 HD22 ASN A 12 3.242 2.609 -20.931 1.00 0.00 H new ATOM 154 N ASN A 13 8.005 2.371 -23.702 1.00 0.00 N ATOM 155 CA ASN A 13 9.133 1.615 -24.233 1.00 0.00 C ATOM 156 C ASN A 13 9.763 0.744 -23.150 1.00 0.00 C ATOM 157 O ASN A 13 10.357 -0.294 -23.440 1.00 0.00 O ATOM 158 CB ASN A 13 10.183 2.564 -24.814 1.00 0.00 C ATOM 159 CG ASN A 13 10.174 2.578 -26.330 1.00 0.00 C ATOM 160 OD1 ASN A 13 9.353 3.253 -26.951 1.00 0.00 O ATOM 161 ND2 ASN A 13 11.090 1.830 -26.934 1.00 0.00 N ATOM 0 H ASN A 13 8.267 3.175 -23.131 1.00 0.00 H new ATOM 0 HA ASN A 13 8.761 0.966 -25.026 1.00 0.00 H new ATOM 0 HB2 ASN A 13 10.002 3.573 -24.443 1.00 0.00 H new ATOM 0 HB3 ASN A 13 11.171 2.268 -24.462 1.00 0.00 H new ATOM 0 HD21 ASN A 13 11.133 1.799 -27.953 1.00 0.00 H new ATOM 0 HD22 ASN A 13 11.751 1.286 -26.379 1.00 0.00 H new ATOM 168 N PHE A 14 9.627 1.175 -21.900 1.00 0.00 N ATOM 169 CA PHE A 14 10.182 0.436 -20.772 1.00 0.00 C ATOM 170 C PHE A 14 9.103 -0.391 -20.079 1.00 0.00 C ATOM 171 O PHE A 14 7.937 0.002 -20.037 1.00 0.00 O ATOM 172 CB PHE A 14 10.825 1.398 -19.771 1.00 0.00 C ATOM 173 CG PHE A 14 12.073 2.055 -20.287 1.00 0.00 C ATOM 174 CD1 PHE A 14 12.005 3.013 -21.285 1.00 0.00 C ATOM 175 CD2 PHE A 14 13.314 1.715 -19.773 1.00 0.00 C ATOM 176 CE1 PHE A 14 13.152 3.619 -21.763 1.00 0.00 C ATOM 177 CE2 PHE A 14 14.464 2.318 -20.246 1.00 0.00 C ATOM 178 CZ PHE A 14 14.383 3.272 -21.242 1.00 0.00 C ATOM 0 H PHE A 14 9.137 2.032 -21.643 1.00 0.00 H new ATOM 0 HA PHE A 14 10.945 -0.242 -21.155 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.102 2.169 -19.504 1.00 0.00 H new ATOM 0 HB3 PHE A 14 11.062 0.853 -18.857 1.00 0.00 H new ATOM 0 HD1 PHE A 14 11.045 3.290 -21.695 1.00 0.00 H new ATOM 0 HD2 PHE A 14 13.383 0.970 -18.994 1.00 0.00 H new ATOM 0 HE1 PHE A 14 13.085 4.363 -22.543 1.00 0.00 H new ATOM 0 HE2 PHE A 14 15.425 2.044 -19.837 1.00 0.00 H new ATOM 0 HZ PHE A 14 15.280 3.745 -21.612 1.00 0.00 H new ATOM 188 N ILE A 15 9.501 -1.538 -19.539 1.00 0.00 N ATOM 189 CA ILE A 15 8.569 -2.421 -18.848 1.00 0.00 C ATOM 190 C ILE A 15 8.925 -2.549 -17.371 1.00 0.00 C ATOM 191 O ILE A 15 10.100 -2.557 -17.002 1.00 0.00 O ATOM 192 CB ILE A 15 8.546 -3.824 -19.483 1.00 0.00 C ATOM 193 CG1 ILE A 15 7.526 -4.713 -18.769 1.00 0.00 C ATOM 194 CG2 ILE A 15 9.931 -4.450 -19.432 1.00 0.00 C ATOM 195 CD1 ILE A 15 7.392 -6.090 -19.381 1.00 0.00 C ATOM 0 H ILE A 15 10.462 -1.878 -19.567 1.00 0.00 H new ATOM 0 HA ILE A 15 7.580 -1.972 -18.943 1.00 0.00 H new ATOM 0 HB ILE A 15 8.250 -3.730 -20.528 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.815 -4.816 -17.723 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.553 -4.221 -18.784 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.899 -5.441 -19.884 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.634 -3.823 -19.981 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.254 -4.535 -18.394 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.652 -6.665 -18.824 1.00 0.00 H new ATOM 0 HD12 ILE A 15 7.073 -5.997 -20.419 1.00 0.00 H new ATOM 0 HD13 ILE A 15 8.354 -6.601 -19.341 1.00 0.00 H new ATOM 207 N THR A 16 7.902 -2.650 -16.528 1.00 0.00 N ATOM 208 CA THR A 16 8.107 -2.779 -15.090 1.00 0.00 C ATOM 209 C THR A 16 8.741 -4.121 -14.743 1.00 0.00 C ATOM 210 O THR A 16 8.752 -5.043 -15.558 1.00 0.00 O ATOM 211 CB THR A 16 6.781 -2.635 -14.319 1.00 0.00 C ATOM 212 OG1 THR A 16 5.710 -2.370 -15.232 1.00 0.00 O ATOM 213 CG2 THR A 16 6.870 -1.515 -13.294 1.00 0.00 C ATOM 0 H THR A 16 6.923 -2.645 -16.816 1.00 0.00 H new ATOM 0 HA THR A 16 8.781 -1.975 -14.793 1.00 0.00 H new ATOM 0 HB THR A 16 6.587 -3.571 -13.795 1.00 0.00 H new ATOM 0 HG1 THR A 16 4.870 -2.282 -14.734 1.00 0.00 H new ATOM 0 HG21 THR A 16 5.922 -1.432 -12.762 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.667 -1.735 -12.583 1.00 0.00 H new ATOM 0 HG23 THR A 16 7.085 -0.574 -13.801 1.00 0.00 H new ATOM 221 N GLY A 17 9.268 -4.224 -13.527 1.00 0.00 N ATOM 222 CA GLY A 17 9.896 -5.458 -13.093 1.00 0.00 C ATOM 223 C GLY A 17 8.894 -6.575 -12.878 1.00 0.00 C ATOM 224 O GLY A 17 8.876 -7.555 -13.622 1.00 0.00 O ATOM 0 H GLY A 17 9.271 -3.475 -12.835 1.00 0.00 H new ATOM 0 HA2 GLY A 17 10.629 -5.770 -13.837 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.440 -5.279 -12.166 1.00 0.00 H new ATOM 228 N VAL A 18 8.057 -6.427 -11.855 1.00 0.00 N ATOM 229 CA VAL A 18 7.047 -7.432 -11.543 1.00 0.00 C ATOM 230 C VAL A 18 6.210 -7.770 -12.772 1.00 0.00 C ATOM 231 O VAL A 18 5.723 -8.892 -12.914 1.00 0.00 O ATOM 232 CB VAL A 18 6.113 -6.956 -10.415 1.00 0.00 C ATOM 233 CG1 VAL A 18 5.327 -5.730 -10.853 1.00 0.00 C ATOM 234 CG2 VAL A 18 5.176 -8.077 -9.992 1.00 0.00 C ATOM 0 H VAL A 18 8.059 -5.622 -11.229 1.00 0.00 H new ATOM 0 HA VAL A 18 7.579 -8.324 -11.213 1.00 0.00 H new ATOM 0 HB VAL A 18 6.723 -6.678 -9.555 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.673 -5.409 -10.043 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.018 -4.925 -11.103 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.726 -5.977 -11.728 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.523 -7.724 -9.194 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.572 -8.388 -10.845 1.00 0.00 H new ATOM 0 HG23 VAL A 18 5.761 -8.924 -9.634 1.00 0.00 H new ATOM 244 N ARG A 19 6.048 -6.793 -13.658 1.00 0.00 N ATOM 245 CA ARG A 19 5.270 -6.987 -14.875 1.00 0.00 C ATOM 246 C ARG A 19 5.934 -8.014 -15.788 1.00 0.00 C ATOM 247 O ARG A 19 5.257 -8.805 -16.444 1.00 0.00 O ATOM 248 CB ARG A 19 5.106 -5.659 -15.618 1.00 0.00 C ATOM 249 CG ARG A 19 3.752 -5.004 -15.403 1.00 0.00 C ATOM 250 CD ARG A 19 2.642 -5.778 -16.096 1.00 0.00 C ATOM 251 NE ARG A 19 1.767 -6.453 -15.141 1.00 0.00 N ATOM 252 CZ ARG A 19 0.833 -5.828 -14.431 1.00 0.00 C ATOM 253 NH1 ARG A 19 0.655 -4.522 -14.568 1.00 0.00 N ATOM 254 NH2 ARG A 19 0.076 -6.511 -13.582 1.00 0.00 N ATOM 0 H ARG A 19 6.445 -5.859 -13.556 1.00 0.00 H new ATOM 0 HA ARG A 19 4.286 -7.361 -14.591 1.00 0.00 H new ATOM 0 HB2 ARG A 19 5.888 -4.972 -15.294 1.00 0.00 H new ATOM 0 HB3 ARG A 19 5.253 -5.829 -16.685 1.00 0.00 H new ATOM 0 HG2 ARG A 19 3.542 -4.942 -14.335 1.00 0.00 H new ATOM 0 HG3 ARG A 19 3.776 -3.983 -15.783 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.052 -5.096 -16.709 1.00 0.00 H new ATOM 0 HD3 ARG A 19 3.080 -6.514 -16.770 1.00 0.00 H new ATOM 0 HE ARG A 19 1.879 -7.459 -15.012 1.00 0.00 H new ATOM 0 HH11 ARG A 19 1.235 -3.994 -15.220 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.062 -4.045 -14.022 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.211 -7.516 -13.474 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -0.640 -6.031 -13.038 1.00 0.00 H new ATOM 268 N ALA A 20 7.262 -7.995 -15.823 1.00 0.00 N ATOM 269 CA ALA A 20 8.017 -8.925 -16.653 1.00 0.00 C ATOM 270 C ALA A 20 8.134 -10.290 -15.982 1.00 0.00 C ATOM 271 O ALA A 20 8.234 -11.316 -16.655 1.00 0.00 O ATOM 272 CB ALA A 20 9.399 -8.363 -16.953 1.00 0.00 C ATOM 0 H ALA A 20 7.837 -7.346 -15.286 1.00 0.00 H new ATOM 0 HA ALA A 20 7.478 -9.055 -17.591 1.00 0.00 H new ATOM 0 HB1 ALA A 20 9.952 -9.068 -17.574 1.00 0.00 H new ATOM 0 HB2 ALA A 20 9.299 -7.415 -17.482 1.00 0.00 H new ATOM 0 HB3 ALA A 20 9.937 -8.203 -16.019 1.00 0.00 H new ATOM 278 N ILE A 21 8.120 -10.293 -14.654 1.00 0.00 N ATOM 279 CA ILE A 21 8.224 -11.532 -13.893 1.00 0.00 C ATOM 280 C ILE A 21 6.930 -12.336 -13.971 1.00 0.00 C ATOM 281 O ILE A 21 6.936 -13.557 -13.825 1.00 0.00 O ATOM 282 CB ILE A 21 8.556 -11.259 -12.414 1.00 0.00 C ATOM 283 CG1 ILE A 21 9.848 -10.447 -12.301 1.00 0.00 C ATOM 284 CG2 ILE A 21 8.678 -12.567 -11.648 1.00 0.00 C ATOM 285 CD1 ILE A 21 10.153 -9.990 -10.891 1.00 0.00 C ATOM 0 H ILE A 21 8.038 -9.452 -14.083 1.00 0.00 H new ATOM 0 HA ILE A 21 9.035 -12.108 -14.339 1.00 0.00 H new ATOM 0 HB ILE A 21 7.744 -10.679 -11.976 1.00 0.00 H new ATOM 0 HG12 ILE A 21 10.679 -11.049 -12.667 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.777 -9.574 -12.950 1.00 0.00 H new ATOM 0 HG21 ILE A 21 8.913 -12.357 -10.605 1.00 0.00 H new ATOM 0 HG22 ILE A 21 7.735 -13.112 -11.705 1.00 0.00 H new ATOM 0 HG23 ILE A 21 9.473 -13.171 -12.084 1.00 0.00 H new ATOM 0 HD11 ILE A 21 11.082 -9.421 -10.886 1.00 0.00 H new ATOM 0 HD12 ILE A 21 9.340 -9.361 -10.529 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.257 -10.859 -10.241 1.00 0.00 H new ATOM 297 N ASN A 22 5.822 -11.640 -14.206 1.00 0.00 N ATOM 298 CA ASN A 22 4.519 -12.289 -14.305 1.00 0.00 C ATOM 299 C ASN A 22 4.198 -12.645 -15.754 1.00 0.00 C ATOM 300 O ASN A 22 3.440 -13.576 -16.021 1.00 0.00 O ATOM 301 CB ASN A 22 3.428 -11.379 -13.738 1.00 0.00 C ATOM 302 CG ASN A 22 3.198 -11.606 -12.257 1.00 0.00 C ATOM 303 OD1 ASN A 22 2.801 -12.694 -11.839 1.00 0.00 O ATOM 304 ND2 ASN A 22 3.447 -10.578 -11.455 1.00 0.00 N ATOM 0 H ASN A 22 5.800 -10.628 -14.331 1.00 0.00 H new ATOM 0 HA ASN A 22 4.554 -13.209 -13.722 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.704 -10.338 -13.905 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.497 -11.552 -14.278 1.00 0.00 H new ATOM 0 HD21 ASN A 22 3.311 -10.672 -10.449 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.775 -9.694 -11.845 1.00 0.00 H new ATOM 311 N GLU A 23 4.782 -11.896 -16.685 1.00 0.00 N ATOM 312 CA GLU A 23 4.557 -12.133 -18.106 1.00 0.00 C ATOM 313 C GLU A 23 5.546 -13.161 -18.649 1.00 0.00 C ATOM 314 O GLU A 23 5.152 -14.217 -19.145 1.00 0.00 O ATOM 315 CB GLU A 23 4.683 -10.825 -18.890 1.00 0.00 C ATOM 316 CG GLU A 23 3.410 -9.996 -18.898 1.00 0.00 C ATOM 317 CD GLU A 23 2.955 -9.637 -20.299 1.00 0.00 C ATOM 318 OE1 GLU A 23 2.656 -10.563 -21.081 1.00 0.00 O ATOM 319 OE2 GLU A 23 2.900 -8.430 -20.613 1.00 0.00 O ATOM 0 H GLU A 23 5.413 -11.121 -16.481 1.00 0.00 H new ATOM 0 HA GLU A 23 3.547 -12.525 -18.227 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.491 -10.231 -18.462 1.00 0.00 H new ATOM 0 HB3 GLU A 23 4.965 -11.053 -19.918 1.00 0.00 H new ATOM 0 HG2 GLU A 23 2.618 -10.549 -18.394 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.573 -9.082 -18.328 1.00 0.00 H new ATOM 326 N PHE A 24 6.833 -12.844 -18.552 1.00 0.00 N ATOM 327 CA PHE A 24 7.879 -13.738 -19.035 1.00 0.00 C ATOM 328 C PHE A 24 8.049 -14.931 -18.099 1.00 0.00 C ATOM 329 O PHE A 24 8.655 -15.939 -18.464 1.00 0.00 O ATOM 330 CB PHE A 24 9.204 -12.984 -19.165 1.00 0.00 C ATOM 331 CG PHE A 24 9.167 -11.877 -20.179 1.00 0.00 C ATOM 332 CD1 PHE A 24 8.589 -10.657 -19.871 1.00 0.00 C ATOM 333 CD2 PHE A 24 9.709 -12.058 -21.441 1.00 0.00 C ATOM 334 CE1 PHE A 24 8.553 -9.636 -20.802 1.00 0.00 C ATOM 335 CE2 PHE A 24 9.677 -11.041 -22.376 1.00 0.00 C ATOM 336 CZ PHE A 24 9.097 -9.828 -22.057 1.00 0.00 C ATOM 0 H PHE A 24 7.177 -11.975 -18.143 1.00 0.00 H new ATOM 0 HA PHE A 24 7.582 -14.108 -20.016 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.473 -12.568 -18.194 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.989 -13.689 -19.438 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.161 -10.501 -18.892 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.162 -13.005 -21.697 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.100 -8.689 -20.548 1.00 0.00 H new ATOM 0 HE2 PHE A 24 10.105 -11.194 -23.356 1.00 0.00 H new ATOM 0 HZ PHE A 24 9.069 -9.032 -22.787 1.00 0.00 H new ATOM 346 N CYS A 25 7.511 -14.809 -16.890 1.00 0.00 N ATOM 347 CA CYS A 25 7.604 -15.876 -15.900 1.00 0.00 C ATOM 348 C CYS A 25 9.061 -16.207 -15.593 1.00 0.00 C ATOM 349 O CYS A 25 9.521 -17.323 -15.838 1.00 0.00 O ATOM 350 CB CYS A 25 6.879 -17.126 -16.397 1.00 0.00 C ATOM 351 SG CYS A 25 5.097 -17.116 -16.092 1.00 0.00 S ATOM 0 H CYS A 25 7.006 -13.982 -16.572 1.00 0.00 H new ATOM 0 HA CYS A 25 7.128 -15.529 -14.983 1.00 0.00 H new ATOM 0 HB2 CYS A 25 7.053 -17.232 -17.468 1.00 0.00 H new ATOM 0 HB3 CYS A 25 7.314 -18.001 -15.915 1.00 0.00 H new ATOM 0 HG CYS A 25 4.572 -18.214 -16.550 1.00 0.00 H new ATOM 357 N LEU A 26 9.784 -15.230 -15.056 1.00 0.00 N ATOM 358 CA LEU A 26 11.190 -15.416 -14.716 1.00 0.00 C ATOM 359 C LEU A 26 11.395 -15.380 -13.205 1.00 0.00 C ATOM 360 O LEU A 26 10.433 -15.329 -12.438 1.00 0.00 O ATOM 361 CB LEU A 26 12.044 -14.337 -15.384 1.00 0.00 C ATOM 362 CG LEU A 26 11.825 -14.141 -16.885 1.00 0.00 C ATOM 363 CD1 LEU A 26 12.122 -12.704 -17.284 1.00 0.00 C ATOM 364 CD2 LEU A 26 12.689 -15.108 -17.681 1.00 0.00 C ATOM 0 H LEU A 26 9.419 -14.301 -14.847 1.00 0.00 H new ATOM 0 HA LEU A 26 11.500 -16.395 -15.083 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.853 -13.388 -14.882 1.00 0.00 H new ATOM 0 HB3 LEU A 26 13.094 -14.579 -15.219 1.00 0.00 H new ATOM 0 HG LEU A 26 10.779 -14.350 -17.111 1.00 0.00 H new ATOM 0 HD11 LEU A 26 11.961 -12.583 -18.355 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.460 -12.031 -16.739 1.00 0.00 H new ATOM 0 HD13 LEU A 26 13.158 -12.467 -17.044 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.520 -14.954 -18.747 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.740 -14.931 -17.451 1.00 0.00 H new ATOM 0 HD23 LEU A 26 12.427 -16.132 -17.416 1.00 0.00 H new ATOM 376 N LYS A 27 12.655 -15.405 -12.783 1.00 0.00 N ATOM 377 CA LYS A 27 12.988 -15.371 -11.364 1.00 0.00 C ATOM 378 C LYS A 27 13.417 -13.971 -10.939 1.00 0.00 C ATOM 379 O LYS A 27 13.980 -13.216 -11.732 1.00 0.00 O ATOM 380 CB LYS A 27 14.103 -16.373 -11.057 1.00 0.00 C ATOM 381 CG LYS A 27 13.646 -17.553 -10.216 1.00 0.00 C ATOM 382 CD LYS A 27 14.114 -18.873 -10.806 1.00 0.00 C ATOM 383 CE LYS A 27 13.055 -19.486 -11.709 1.00 0.00 C ATOM 384 NZ LYS A 27 13.644 -20.449 -12.680 1.00 0.00 N ATOM 0 H LYS A 27 13.463 -15.449 -13.404 1.00 0.00 H new ATOM 0 HA LYS A 27 12.096 -15.645 -10.800 1.00 0.00 H new ATOM 0 HB2 LYS A 27 14.515 -16.744 -11.995 1.00 0.00 H new ATOM 0 HB3 LYS A 27 14.910 -15.858 -10.536 1.00 0.00 H new ATOM 0 HG2 LYS A 27 14.032 -17.449 -9.202 1.00 0.00 H new ATOM 0 HG3 LYS A 27 12.558 -17.551 -10.145 1.00 0.00 H new ATOM 0 HD2 LYS A 27 15.031 -18.714 -11.374 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.354 -19.568 -10.001 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.309 -19.996 -11.099 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.537 -18.694 -12.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 12.890 -20.845 -13.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.338 -19.958 -13.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 14.116 -21.218 -12.163 1.00 0.00 H new ATOM 398 N SER A 28 13.149 -13.630 -9.682 1.00 0.00 N ATOM 399 CA SER A 28 13.506 -12.319 -9.153 1.00 0.00 C ATOM 400 C SER A 28 15.013 -12.093 -9.234 1.00 0.00 C ATOM 401 O SER A 28 15.477 -10.956 -9.322 1.00 0.00 O ATOM 402 CB SER A 28 13.036 -12.186 -7.703 1.00 0.00 C ATOM 403 OG SER A 28 11.787 -11.521 -7.631 1.00 0.00 O ATOM 0 H SER A 28 12.686 -14.244 -9.011 1.00 0.00 H new ATOM 0 HA SER A 28 13.009 -11.562 -9.759 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.951 -13.175 -7.253 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.779 -11.635 -7.126 1.00 0.00 H new ATOM 0 HG SER A 28 11.508 -11.450 -6.694 1.00 0.00 H new ATOM 409 N SER A 29 15.771 -13.184 -9.203 1.00 0.00 N ATOM 410 CA SER A 29 17.226 -13.105 -9.268 1.00 0.00 C ATOM 411 C SER A 29 17.691 -12.830 -10.695 1.00 0.00 C ATOM 412 O SER A 29 18.759 -12.256 -10.911 1.00 0.00 O ATOM 413 CB SER A 29 17.852 -14.405 -8.758 1.00 0.00 C ATOM 414 OG SER A 29 16.905 -15.459 -8.753 1.00 0.00 O ATOM 0 H SER A 29 15.402 -14.133 -9.133 1.00 0.00 H new ATOM 0 HA SER A 29 17.549 -12.280 -8.633 1.00 0.00 H new ATOM 0 HB2 SER A 29 18.699 -14.676 -9.388 1.00 0.00 H new ATOM 0 HB3 SER A 29 18.239 -14.255 -7.750 1.00 0.00 H new ATOM 0 HG SER A 29 17.330 -16.279 -8.425 1.00 0.00 H new ATOM 420 N ASP A 30 16.882 -13.243 -11.664 1.00 0.00 N ATOM 421 CA ASP A 30 17.209 -13.041 -13.071 1.00 0.00 C ATOM 422 C ASP A 30 17.020 -11.580 -13.468 1.00 0.00 C ATOM 423 O ASP A 30 17.885 -10.983 -14.111 1.00 0.00 O ATOM 424 CB ASP A 30 16.340 -13.939 -13.953 1.00 0.00 C ATOM 425 CG ASP A 30 16.989 -15.281 -14.230 1.00 0.00 C ATOM 426 OD1 ASP A 30 18.182 -15.299 -14.598 1.00 0.00 O ATOM 427 OD2 ASP A 30 16.303 -16.313 -14.077 1.00 0.00 O ATOM 0 H ASP A 30 15.995 -13.720 -11.501 1.00 0.00 H new ATOM 0 HA ASP A 30 18.256 -13.306 -13.217 1.00 0.00 H new ATOM 0 HB2 ASP A 30 15.377 -14.098 -13.468 1.00 0.00 H new ATOM 0 HB3 ASP A 30 16.141 -13.433 -14.898 1.00 0.00 H new ATOM 432 N LEU A 31 15.884 -11.010 -13.082 1.00 0.00 N ATOM 433 CA LEU A 31 15.580 -9.618 -13.399 1.00 0.00 C ATOM 434 C LEU A 31 16.671 -8.690 -12.873 1.00 0.00 C ATOM 435 O LEU A 31 17.221 -7.880 -13.618 1.00 0.00 O ATOM 436 CB LEU A 31 14.228 -9.223 -12.804 1.00 0.00 C ATOM 437 CG LEU A 31 13.001 -9.532 -13.662 1.00 0.00 C ATOM 438 CD1 LEU A 31 12.956 -8.619 -14.878 1.00 0.00 C ATOM 439 CD2 LEU A 31 13.004 -10.993 -14.090 1.00 0.00 C ATOM 0 H LEU A 31 15.158 -11.489 -12.549 1.00 0.00 H new ATOM 0 HA LEU A 31 15.535 -9.519 -14.484 1.00 0.00 H new ATOM 0 HB2 LEU A 31 14.113 -9.730 -11.846 1.00 0.00 H new ATOM 0 HB3 LEU A 31 14.243 -8.153 -12.599 1.00 0.00 H new ATOM 0 HG LEU A 31 12.108 -9.351 -13.064 1.00 0.00 H new ATOM 0 HD11 LEU A 31 12.076 -8.854 -15.477 1.00 0.00 H new ATOM 0 HD12 LEU A 31 12.906 -7.580 -14.551 1.00 0.00 H new ATOM 0 HD13 LEU A 31 13.854 -8.768 -15.478 1.00 0.00 H new ATOM 0 HD21 LEU A 31 12.124 -11.195 -14.700 1.00 0.00 H new ATOM 0 HD22 LEU A 31 13.903 -11.200 -14.671 1.00 0.00 H new ATOM 0 HD23 LEU A 31 12.988 -11.631 -13.206 1.00 0.00 H new ATOM 451 N GLU A 32 16.978 -8.815 -11.586 1.00 0.00 N ATOM 452 CA GLU A 32 18.004 -7.988 -10.962 1.00 0.00 C ATOM 453 C GLU A 32 19.340 -8.141 -11.684 1.00 0.00 C ATOM 454 O GLU A 32 20.160 -7.224 -11.693 1.00 0.00 O ATOM 455 CB GLU A 32 18.163 -8.360 -9.487 1.00 0.00 C ATOM 456 CG GLU A 32 18.584 -9.803 -9.265 1.00 0.00 C ATOM 457 CD GLU A 32 18.992 -10.078 -7.830 1.00 0.00 C ATOM 458 OE1 GLU A 32 18.578 -9.309 -6.938 1.00 0.00 O ATOM 459 OE2 GLU A 32 19.725 -11.062 -7.601 1.00 0.00 O ATOM 0 H GLU A 32 16.531 -9.481 -10.955 1.00 0.00 H new ATOM 0 HA GLU A 32 17.689 -6.947 -11.034 1.00 0.00 H new ATOM 0 HB2 GLU A 32 18.902 -7.701 -9.032 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.219 -8.183 -8.972 1.00 0.00 H new ATOM 0 HG2 GLU A 32 17.761 -10.464 -9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.416 -10.041 -9.927 1.00 0.00 H new ATOM 466 N GLN A 33 19.550 -9.307 -12.287 1.00 0.00 N ATOM 467 CA GLN A 33 20.786 -9.581 -13.009 1.00 0.00 C ATOM 468 C GLN A 33 20.937 -8.645 -14.204 1.00 0.00 C ATOM 469 O GLN A 33 22.051 -8.332 -14.625 1.00 0.00 O ATOM 470 CB GLN A 33 20.815 -11.036 -13.479 1.00 0.00 C ATOM 471 CG GLN A 33 22.213 -11.630 -13.534 1.00 0.00 C ATOM 472 CD GLN A 33 22.358 -12.864 -12.665 1.00 0.00 C ATOM 473 OE1 GLN A 33 23.157 -12.888 -11.729 1.00 0.00 O ATOM 474 NE2 GLN A 33 21.584 -13.898 -12.972 1.00 0.00 N ATOM 0 H GLN A 33 18.880 -10.076 -12.290 1.00 0.00 H new ATOM 0 HA GLN A 33 21.620 -9.410 -12.329 1.00 0.00 H new ATOM 0 HB2 GLN A 33 20.200 -11.638 -12.810 1.00 0.00 H new ATOM 0 HB3 GLN A 33 20.364 -11.098 -14.469 1.00 0.00 H new ATOM 0 HG2 GLN A 33 22.454 -11.886 -14.566 1.00 0.00 H new ATOM 0 HG3 GLN A 33 22.936 -10.879 -13.215 1.00 0.00 H new ATOM 0 HE21 GLN A 33 20.935 -13.834 -13.757 1.00 0.00 H new ATOM 0 HE22 GLN A 33 21.638 -14.756 -12.423 1.00 0.00 H new ATOM 483 N LEU A 34 19.809 -8.202 -14.748 1.00 0.00 N ATOM 484 CA LEU A 34 19.815 -7.302 -15.896 1.00 0.00 C ATOM 485 C LEU A 34 20.298 -5.912 -15.496 1.00 0.00 C ATOM 486 O LEU A 34 20.591 -5.659 -14.327 1.00 0.00 O ATOM 487 CB LEU A 34 18.415 -7.212 -16.506 1.00 0.00 C ATOM 488 CG LEU A 34 17.761 -8.541 -16.886 1.00 0.00 C ATOM 489 CD1 LEU A 34 16.299 -8.332 -17.250 1.00 0.00 C ATOM 490 CD2 LEU A 34 18.511 -9.195 -18.037 1.00 0.00 C ATOM 0 H LEU A 34 18.879 -8.451 -14.413 1.00 0.00 H new ATOM 0 HA LEU A 34 20.503 -7.706 -16.639 1.00 0.00 H new ATOM 0 HB2 LEU A 34 17.764 -6.699 -15.798 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.469 -6.588 -17.398 1.00 0.00 H new ATOM 0 HG LEU A 34 17.808 -9.206 -16.024 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.850 -9.289 -17.518 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.769 -7.908 -16.397 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.229 -7.649 -18.097 1.00 0.00 H new ATOM 0 HD21 LEU A 34 18.031 -10.140 -18.294 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.497 -8.533 -18.903 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.543 -9.381 -17.740 1.00 0.00 H new ATOM 502 N ARG A 35 20.377 -5.014 -16.472 1.00 0.00 N ATOM 503 CA ARG A 35 20.823 -3.649 -16.221 1.00 0.00 C ATOM 504 C ARG A 35 19.783 -2.876 -15.416 1.00 0.00 C ATOM 505 O ARG A 35 18.752 -2.463 -15.947 1.00 0.00 O ATOM 506 CB ARG A 35 21.099 -2.929 -17.542 1.00 0.00 C ATOM 507 CG ARG A 35 21.940 -1.673 -17.387 1.00 0.00 C ATOM 508 CD ARG A 35 22.394 -1.136 -18.735 1.00 0.00 C ATOM 509 NE ARG A 35 22.251 0.315 -18.824 1.00 0.00 N ATOM 510 CZ ARG A 35 22.510 1.013 -19.923 1.00 0.00 C ATOM 511 NH1 ARG A 35 22.923 0.397 -21.022 1.00 0.00 N ATOM 512 NH2 ARG A 35 22.355 2.331 -19.926 1.00 0.00 N ATOM 0 H ARG A 35 20.138 -5.207 -17.445 1.00 0.00 H new ATOM 0 HA ARG A 35 21.745 -3.696 -15.641 1.00 0.00 H new ATOM 0 HB2 ARG A 35 21.607 -3.615 -18.220 1.00 0.00 H new ATOM 0 HB3 ARG A 35 20.149 -2.665 -18.007 1.00 0.00 H new ATOM 0 HG2 ARG A 35 21.363 -0.909 -16.866 1.00 0.00 H new ATOM 0 HG3 ARG A 35 22.811 -1.891 -16.769 1.00 0.00 H new ATOM 0 HD2 ARG A 35 23.436 -1.408 -18.901 1.00 0.00 H new ATOM 0 HD3 ARG A 35 21.812 -1.607 -19.527 1.00 0.00 H new ATOM 0 HE ARG A 35 21.935 0.820 -17.996 1.00 0.00 H new ATOM 0 HH11 ARG A 35 23.042 -0.616 -21.025 1.00 0.00 H new ATOM 0 HH12 ARG A 35 23.121 0.936 -21.865 1.00 0.00 H new ATOM 0 HH21 ARG A 35 22.036 2.809 -19.083 1.00 0.00 H new ATOM 0 HH22 ARG A 35 22.554 2.866 -20.771 1.00 0.00 H new ATOM 526 N LYS A 36 20.059 -2.685 -14.131 1.00 0.00 N ATOM 527 CA LYS A 36 19.149 -1.962 -13.251 1.00 0.00 C ATOM 528 C LYS A 36 18.995 -0.512 -13.700 1.00 0.00 C ATOM 529 O LYS A 36 19.800 0.347 -13.340 1.00 0.00 O ATOM 530 CB LYS A 36 19.657 -2.008 -11.808 1.00 0.00 C ATOM 531 CG LYS A 36 19.423 -3.344 -11.124 1.00 0.00 C ATOM 532 CD LYS A 36 19.129 -3.169 -9.644 1.00 0.00 C ATOM 533 CE LYS A 36 20.188 -3.839 -8.782 1.00 0.00 C ATOM 534 NZ LYS A 36 20.024 -3.503 -7.340 1.00 0.00 N ATOM 0 H LYS A 36 20.907 -3.021 -13.675 1.00 0.00 H new ATOM 0 HA LYS A 36 18.174 -2.446 -13.302 1.00 0.00 H new ATOM 0 HB2 LYS A 36 20.724 -1.787 -11.800 1.00 0.00 H new ATOM 0 HB3 LYS A 36 19.165 -1.224 -11.233 1.00 0.00 H new ATOM 0 HG2 LYS A 36 18.590 -3.858 -11.603 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.302 -3.977 -11.249 1.00 0.00 H new ATOM 0 HD2 LYS A 36 19.082 -2.107 -9.404 1.00 0.00 H new ATOM 0 HD3 LYS A 36 18.151 -3.591 -9.414 1.00 0.00 H new ATOM 0 HE2 LYS A 36 20.131 -4.920 -8.912 1.00 0.00 H new ATOM 0 HE3 LYS A 36 21.178 -3.529 -9.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.765 -3.979 -6.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 20.103 -2.474 -7.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 19.089 -3.821 -7.013 1.00 0.00 H new ATOM 548 N ILE A 37 17.957 -0.248 -14.486 1.00 0.00 N ATOM 549 CA ILE A 37 17.698 1.098 -14.981 1.00 0.00 C ATOM 550 C ILE A 37 17.297 2.034 -13.846 1.00 0.00 C ATOM 551 O ILE A 37 16.306 1.798 -13.154 1.00 0.00 O ATOM 552 CB ILE A 37 16.589 1.101 -16.050 1.00 0.00 C ATOM 553 CG1 ILE A 37 16.878 0.045 -17.119 1.00 0.00 C ATOM 554 CG2 ILE A 37 16.463 2.480 -16.680 1.00 0.00 C ATOM 555 CD1 ILE A 37 18.205 0.240 -17.817 1.00 0.00 C ATOM 0 H ILE A 37 17.282 -0.948 -14.794 1.00 0.00 H new ATOM 0 HA ILE A 37 18.626 1.453 -15.430 1.00 0.00 H new ATOM 0 HB ILE A 37 15.642 0.855 -15.570 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.861 -0.942 -16.657 1.00 0.00 H new ATOM 0 HG13 ILE A 37 16.080 0.063 -17.861 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.675 2.465 -17.433 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.215 3.211 -15.910 1.00 0.00 H new ATOM 0 HG23 ILE A 37 17.408 2.754 -17.149 1.00 0.00 H new ATOM 0 HD11 ILE A 37 18.343 -0.544 -18.561 1.00 0.00 H new ATOM 0 HD12 ILE A 37 18.218 1.213 -18.308 1.00 0.00 H new ATOM 0 HD13 ILE A 37 19.011 0.192 -17.085 1.00 0.00 H new ATOM 567 N ARG A 38 18.072 3.098 -13.661 1.00 0.00 N ATOM 568 CA ARG A 38 17.797 4.070 -12.610 1.00 0.00 C ATOM 569 C ARG A 38 17.179 5.338 -13.191 1.00 0.00 C ATOM 570 O ARG A 38 16.694 6.198 -12.455 1.00 0.00 O ATOM 571 CB ARG A 38 19.083 4.415 -11.857 1.00 0.00 C ATOM 572 CG ARG A 38 19.131 3.854 -10.445 1.00 0.00 C ATOM 573 CD ARG A 38 18.077 4.493 -9.555 1.00 0.00 C ATOM 574 NE ARG A 38 18.174 4.031 -8.173 1.00 0.00 N ATOM 575 CZ ARG A 38 19.137 4.406 -7.339 1.00 0.00 C ATOM 576 NH1 ARG A 38 20.081 5.245 -7.745 1.00 0.00 N ATOM 577 NH2 ARG A 38 19.158 3.943 -6.096 1.00 0.00 N ATOM 0 H ARG A 38 18.895 3.309 -14.225 1.00 0.00 H new ATOM 0 HA ARG A 38 17.085 3.625 -11.915 1.00 0.00 H new ATOM 0 HB2 ARG A 38 19.936 4.035 -12.419 1.00 0.00 H new ATOM 0 HB3 ARG A 38 19.188 5.499 -11.812 1.00 0.00 H new ATOM 0 HG2 ARG A 38 18.977 2.775 -10.476 1.00 0.00 H new ATOM 0 HG3 ARG A 38 20.120 4.023 -10.019 1.00 0.00 H new ATOM 0 HD2 ARG A 38 18.187 5.577 -9.583 1.00 0.00 H new ATOM 0 HD3 ARG A 38 17.085 4.263 -9.945 1.00 0.00 H new ATOM 0 HE ARG A 38 17.463 3.385 -7.830 1.00 0.00 H new ATOM 0 HH11 ARG A 38 20.068 5.604 -8.700 1.00 0.00 H new ATOM 0 HH12 ARG A 38 20.820 5.531 -7.102 1.00 0.00 H new ATOM 0 HH21 ARG A 38 18.434 3.298 -5.780 1.00 0.00 H new ATOM 0 HH22 ARG A 38 19.898 4.232 -5.457 1.00 0.00 H new ATOM 591 N ARG A 39 17.200 5.448 -14.515 1.00 0.00 N ATOM 592 CA ARG A 39 16.644 6.612 -15.195 1.00 0.00 C ATOM 593 C ARG A 39 17.281 7.899 -14.679 1.00 0.00 C ATOM 594 O ARG A 39 16.819 8.483 -13.699 1.00 0.00 O ATOM 595 CB ARG A 39 15.128 6.667 -14.998 1.00 0.00 C ATOM 596 CG ARG A 39 14.354 5.810 -15.987 1.00 0.00 C ATOM 597 CD ARG A 39 13.030 5.343 -15.402 1.00 0.00 C ATOM 598 NE ARG A 39 11.921 5.541 -16.331 1.00 0.00 N ATOM 599 CZ ARG A 39 10.658 5.253 -16.040 1.00 0.00 C ATOM 600 NH1 ARG A 39 10.345 4.757 -14.851 1.00 0.00 N ATOM 601 NH2 ARG A 39 9.704 5.463 -16.938 1.00 0.00 N ATOM 0 H ARG A 39 17.596 4.745 -15.139 1.00 0.00 H new ATOM 0 HA ARG A 39 16.863 6.519 -16.259 1.00 0.00 H new ATOM 0 HB2 ARG A 39 14.890 6.343 -13.985 1.00 0.00 H new ATOM 0 HB3 ARG A 39 14.796 7.701 -15.088 1.00 0.00 H new ATOM 0 HG2 ARG A 39 14.170 6.380 -16.898 1.00 0.00 H new ATOM 0 HG3 ARG A 39 14.954 4.945 -16.268 1.00 0.00 H new ATOM 0 HD2 ARG A 39 13.101 4.287 -15.142 1.00 0.00 H new ATOM 0 HD3 ARG A 39 12.830 5.886 -14.478 1.00 0.00 H new ATOM 0 HE ARG A 39 12.128 5.922 -17.254 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.075 4.596 -14.157 1.00 0.00 H new ATOM 0 HH12 ARG A 39 9.374 4.537 -14.630 1.00 0.00 H new ATOM 0 HH21 ARG A 39 9.941 5.846 -17.853 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.734 5.241 -16.713 1.00 0.00 H new ATOM 615 N ARG A 40 18.346 8.334 -15.345 1.00 0.00 N ATOM 616 CA ARG A 40 19.048 9.550 -14.954 1.00 0.00 C ATOM 617 C ARG A 40 19.582 9.435 -13.529 1.00 0.00 C ATOM 618 O ARG A 40 19.327 8.449 -12.838 1.00 0.00 O ATOM 619 CB ARG A 40 18.117 10.759 -15.064 1.00 0.00 C ATOM 620 CG ARG A 40 18.272 11.530 -16.365 1.00 0.00 C ATOM 621 CD ARG A 40 17.320 11.016 -17.433 1.00 0.00 C ATOM 622 NE ARG A 40 17.119 11.991 -18.503 1.00 0.00 N ATOM 623 CZ ARG A 40 16.184 11.873 -19.439 1.00 0.00 C ATOM 624 NH1 ARG A 40 15.368 10.828 -19.437 1.00 0.00 N ATOM 625 NH2 ARG A 40 16.064 12.802 -20.379 1.00 0.00 N ATOM 0 H ARG A 40 18.741 7.862 -16.158 1.00 0.00 H new ATOM 0 HA ARG A 40 19.892 9.686 -15.631 1.00 0.00 H new ATOM 0 HB2 ARG A 40 17.085 10.422 -14.972 1.00 0.00 H new ATOM 0 HB3 ARG A 40 18.308 11.432 -14.228 1.00 0.00 H new ATOM 0 HG2 ARG A 40 18.083 12.589 -16.187 1.00 0.00 H new ATOM 0 HG3 ARG A 40 19.299 11.445 -16.720 1.00 0.00 H new ATOM 0 HD2 ARG A 40 17.714 10.091 -17.855 1.00 0.00 H new ATOM 0 HD3 ARG A 40 16.360 10.775 -16.977 1.00 0.00 H new ATOM 0 HE ARG A 40 17.730 12.807 -18.533 1.00 0.00 H new ATOM 0 HH11 ARG A 40 15.457 10.112 -18.716 1.00 0.00 H new ATOM 0 HH12 ARG A 40 14.651 10.740 -20.157 1.00 0.00 H new ATOM 0 HH21 ARG A 40 16.690 13.607 -20.383 1.00 0.00 H new ATOM 0 HH22 ARG A 40 15.346 12.711 -21.097 1.00 0.00 H new ATOM 639 N SER A 41 20.326 10.448 -13.097 1.00 0.00 N ATOM 640 CA SER A 41 20.900 10.459 -11.757 1.00 0.00 C ATOM 641 C SER A 41 20.985 11.882 -11.214 1.00 0.00 C ATOM 642 O SER A 41 22.062 12.467 -11.102 1.00 0.00 O ATOM 643 CB SER A 41 22.291 9.821 -11.770 1.00 0.00 C ATOM 644 OG SER A 41 22.212 8.421 -11.572 1.00 0.00 O ATOM 0 H SER A 41 20.545 11.272 -13.656 1.00 0.00 H new ATOM 0 HA SER A 41 20.248 9.878 -11.104 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.781 10.030 -12.721 1.00 0.00 H new ATOM 0 HB3 SER A 41 22.907 10.268 -10.989 1.00 0.00 H new ATOM 0 HG SER A 41 21.346 8.093 -11.894 1.00 0.00 H new ATOM 650 N PRO A 42 19.822 12.452 -10.866 1.00 0.00 N ATOM 651 CA PRO A 42 19.737 13.813 -10.328 1.00 0.00 C ATOM 652 C PRO A 42 20.321 13.918 -8.923 1.00 0.00 C ATOM 653 O PRO A 42 20.885 12.956 -8.401 1.00 0.00 O ATOM 654 CB PRO A 42 18.233 14.092 -10.304 1.00 0.00 C ATOM 655 CG PRO A 42 17.599 12.747 -10.213 1.00 0.00 C ATOM 656 CD PRO A 42 18.500 11.812 -10.972 1.00 0.00 C ATOM 0 HA PRO A 42 20.306 14.524 -10.926 1.00 0.00 H new ATOM 0 HB2 PRO A 42 17.960 14.717 -9.453 1.00 0.00 H new ATOM 0 HB3 PRO A 42 17.914 14.620 -11.203 1.00 0.00 H new ATOM 0 HG2 PRO A 42 17.497 12.433 -9.174 1.00 0.00 H new ATOM 0 HG3 PRO A 42 16.597 12.758 -10.642 1.00 0.00 H new ATOM 0 HD2 PRO A 42 18.501 10.813 -10.536 1.00 0.00 H new ATOM 0 HD3 PRO A 42 18.187 11.707 -12.011 1.00 0.00 H new ATOM 664 N HIS A 43 20.181 15.092 -8.315 1.00 0.00 N ATOM 665 CA HIS A 43 20.693 15.322 -6.969 1.00 0.00 C ATOM 666 C HIS A 43 19.553 15.386 -5.957 1.00 0.00 C ATOM 667 O HIS A 43 19.447 16.341 -5.188 1.00 0.00 O ATOM 668 CB HIS A 43 21.505 16.617 -6.924 1.00 0.00 C ATOM 669 CG HIS A 43 22.626 16.587 -5.932 1.00 0.00 C ATOM 670 ND1 HIS A 43 22.667 15.710 -4.868 1.00 0.00 N ATOM 671 CD2 HIS A 43 23.754 17.331 -5.848 1.00 0.00 C ATOM 672 CE1 HIS A 43 23.770 15.918 -4.171 1.00 0.00 C ATOM 673 NE2 HIS A 43 24.447 16.896 -4.745 1.00 0.00 N ATOM 0 H HIS A 43 19.717 15.898 -8.733 1.00 0.00 H new ATOM 0 HA HIS A 43 21.341 14.486 -6.706 1.00 0.00 H new ATOM 0 HB2 HIS A 43 21.913 16.815 -7.915 1.00 0.00 H new ATOM 0 HB3 HIS A 43 20.839 17.445 -6.682 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.053 18.120 -6.523 1.00 0.00 H new ATOM 0 HE1 HIS A 43 24.067 15.380 -3.283 1.00 0.00 H new ATOM 0 HE2 HIS A 43 25.340 17.268 -4.421 1.00 0.00 H new ATOM 681 N GLU A 44 18.703 14.364 -5.965 1.00 0.00 N ATOM 682 CA GLU A 44 17.570 14.307 -5.049 1.00 0.00 C ATOM 683 C GLU A 44 17.202 12.861 -4.728 1.00 0.00 C ATOM 684 O GLU A 44 17.477 12.367 -3.635 1.00 0.00 O ATOM 685 CB GLU A 44 16.363 15.031 -5.648 1.00 0.00 C ATOM 686 CG GLU A 44 16.430 16.543 -5.510 1.00 0.00 C ATOM 687 CD GLU A 44 15.165 17.229 -5.989 1.00 0.00 C ATOM 688 OE1 GLU A 44 14.649 16.841 -7.058 1.00 0.00 O ATOM 689 OE2 GLU A 44 14.692 18.153 -5.295 1.00 0.00 O ATOM 0 H GLU A 44 18.777 13.565 -6.595 1.00 0.00 H new ATOM 0 HA GLU A 44 17.859 14.804 -4.123 1.00 0.00 H new ATOM 0 HB2 GLU A 44 16.283 14.774 -6.704 1.00 0.00 H new ATOM 0 HB3 GLU A 44 15.456 14.670 -5.163 1.00 0.00 H new ATOM 0 HG2 GLU A 44 16.606 16.801 -4.466 1.00 0.00 H new ATOM 0 HG3 GLU A 44 17.280 16.919 -6.079 1.00 0.00 H new ATOM 696 N ASP A 45 16.578 12.189 -5.690 1.00 0.00 N ATOM 697 CA ASP A 45 16.172 10.800 -5.511 1.00 0.00 C ATOM 698 C ASP A 45 15.223 10.659 -4.325 1.00 0.00 C ATOM 699 O ASP A 45 15.641 10.320 -3.218 1.00 0.00 O ATOM 700 CB ASP A 45 17.399 9.910 -5.307 1.00 0.00 C ATOM 701 CG ASP A 45 17.152 8.476 -5.734 1.00 0.00 C ATOM 702 OD1 ASP A 45 15.989 8.141 -6.044 1.00 0.00 O ATOM 703 OD2 ASP A 45 18.121 7.690 -5.760 1.00 0.00 O ATOM 0 H ASP A 45 16.343 12.584 -6.601 1.00 0.00 H new ATOM 0 HA ASP A 45 15.648 10.482 -6.412 1.00 0.00 H new ATOM 0 HB2 ASP A 45 18.237 10.316 -5.874 1.00 0.00 H new ATOM 0 HB3 ASP A 45 17.687 9.929 -4.256 1.00 0.00 H new ATOM 708 N THR A 46 13.942 10.923 -4.564 1.00 0.00 N ATOM 709 CA THR A 46 12.934 10.828 -3.516 1.00 0.00 C ATOM 710 C THR A 46 12.104 9.558 -3.665 1.00 0.00 C ATOM 711 O THR A 46 11.630 8.996 -2.678 1.00 0.00 O ATOM 712 CB THR A 46 11.993 12.047 -3.529 1.00 0.00 C ATOM 713 OG1 THR A 46 11.004 11.914 -2.502 1.00 0.00 O ATOM 714 CG2 THR A 46 11.311 12.190 -4.882 1.00 0.00 C ATOM 0 H THR A 46 13.578 11.204 -5.475 1.00 0.00 H new ATOM 0 HA THR A 46 13.468 10.801 -2.566 1.00 0.00 H new ATOM 0 HB THR A 46 12.589 12.940 -3.344 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.411 12.694 -2.516 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.651 13.058 -4.867 1.00 0.00 H new ATOM 0 HG22 THR A 46 12.065 12.321 -5.658 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.727 11.294 -5.092 1.00 0.00 H new ATOM 722 N GLU A 47 11.932 9.111 -4.905 1.00 0.00 N ATOM 723 CA GLU A 47 11.158 7.907 -5.182 1.00 0.00 C ATOM 724 C GLU A 47 12.047 6.810 -5.760 1.00 0.00 C ATOM 725 O GLU A 47 12.656 6.981 -6.816 1.00 0.00 O ATOM 726 CB GLU A 47 10.017 8.219 -6.153 1.00 0.00 C ATOM 727 CG GLU A 47 8.939 7.148 -6.189 1.00 0.00 C ATOM 728 CD GLU A 47 7.584 7.670 -5.752 1.00 0.00 C ATOM 729 OE1 GLU A 47 7.181 8.749 -6.234 1.00 0.00 O ATOM 730 OE2 GLU A 47 6.927 7.000 -4.928 1.00 0.00 O ATOM 0 H GLU A 47 12.318 9.564 -5.733 1.00 0.00 H new ATOM 0 HA GLU A 47 10.737 7.552 -4.241 1.00 0.00 H new ATOM 0 HB2 GLU A 47 9.563 9.170 -5.874 1.00 0.00 H new ATOM 0 HB3 GLU A 47 10.428 8.343 -7.155 1.00 0.00 H new ATOM 0 HG2 GLU A 47 8.862 6.749 -7.201 1.00 0.00 H new ATOM 0 HG3 GLU A 47 9.232 6.321 -5.542 1.00 0.00 H new ATOM 737 N SER A 48 12.116 5.682 -5.060 1.00 0.00 N ATOM 738 CA SER A 48 12.934 4.558 -5.500 1.00 0.00 C ATOM 739 C SER A 48 12.252 3.803 -6.638 1.00 0.00 C ATOM 740 O SER A 48 11.240 3.133 -6.435 1.00 0.00 O ATOM 741 CB SER A 48 13.203 3.607 -4.332 1.00 0.00 C ATOM 742 OG SER A 48 13.976 4.241 -3.327 1.00 0.00 O ATOM 0 H SER A 48 11.615 5.522 -4.186 1.00 0.00 H new ATOM 0 HA SER A 48 13.883 4.952 -5.865 1.00 0.00 H new ATOM 0 HB2 SER A 48 12.257 3.269 -3.909 1.00 0.00 H new ATOM 0 HB3 SER A 48 13.726 2.721 -4.693 1.00 0.00 H new ATOM 0 HG SER A 48 14.133 3.614 -2.591 1.00 0.00 H new ATOM 748 N PHE A 49 12.815 3.918 -7.836 1.00 0.00 N ATOM 749 CA PHE A 49 12.263 3.248 -9.008 1.00 0.00 C ATOM 750 C PHE A 49 13.350 2.490 -9.764 1.00 0.00 C ATOM 751 O PHE A 49 14.520 2.872 -9.743 1.00 0.00 O ATOM 752 CB PHE A 49 11.595 4.265 -9.935 1.00 0.00 C ATOM 753 CG PHE A 49 10.118 4.047 -10.100 1.00 0.00 C ATOM 754 CD1 PHE A 49 9.223 4.533 -9.160 1.00 0.00 C ATOM 755 CD2 PHE A 49 9.624 3.356 -11.195 1.00 0.00 C ATOM 756 CE1 PHE A 49 7.864 4.332 -9.308 1.00 0.00 C ATOM 757 CE2 PHE A 49 8.265 3.153 -11.349 1.00 0.00 C ATOM 758 CZ PHE A 49 7.384 3.643 -10.405 1.00 0.00 C ATOM 0 H PHE A 49 13.653 4.469 -8.021 1.00 0.00 H new ATOM 0 HA PHE A 49 11.516 2.531 -8.668 1.00 0.00 H new ATOM 0 HB2 PHE A 49 11.764 5.268 -9.543 1.00 0.00 H new ATOM 0 HB3 PHE A 49 12.072 4.220 -10.914 1.00 0.00 H new ATOM 0 HD1 PHE A 49 9.592 5.075 -8.302 1.00 0.00 H new ATOM 0 HD2 PHE A 49 10.308 2.972 -11.937 1.00 0.00 H new ATOM 0 HE1 PHE A 49 7.177 4.713 -8.567 1.00 0.00 H new ATOM 0 HE2 PHE A 49 7.893 2.612 -12.206 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.322 3.488 -10.524 1.00 0.00 H new ATOM 768 N THR A 50 12.955 1.411 -10.433 1.00 0.00 N ATOM 769 CA THR A 50 13.894 0.597 -11.195 1.00 0.00 C ATOM 770 C THR A 50 13.170 -0.248 -12.236 1.00 0.00 C ATOM 771 O THR A 50 12.401 -1.148 -11.895 1.00 0.00 O ATOM 772 CB THR A 50 14.709 -0.331 -10.274 1.00 0.00 C ATOM 773 OG1 THR A 50 14.415 -0.041 -8.903 1.00 0.00 O ATOM 774 CG2 THR A 50 16.200 -0.167 -10.524 1.00 0.00 C ATOM 0 H THR A 50 11.990 1.081 -10.462 1.00 0.00 H new ATOM 0 HA THR A 50 14.573 1.285 -11.698 1.00 0.00 H new ATOM 0 HB THR A 50 14.431 -1.362 -10.495 1.00 0.00 H new ATOM 0 HG1 THR A 50 14.936 -0.636 -8.324 1.00 0.00 H new ATOM 0 HG21 THR A 50 16.755 -0.832 -9.862 1.00 0.00 H new ATOM 0 HG22 THR A 50 16.425 -0.416 -11.561 1.00 0.00 H new ATOM 0 HG23 THR A 50 16.490 0.865 -10.328 1.00 0.00 H new ATOM 782 N VAL A 51 13.420 0.046 -13.508 1.00 0.00 N ATOM 783 CA VAL A 51 12.793 -0.689 -14.600 1.00 0.00 C ATOM 784 C VAL A 51 13.821 -1.508 -15.373 1.00 0.00 C ATOM 785 O VAL A 51 15.006 -1.510 -15.040 1.00 0.00 O ATOM 786 CB VAL A 51 12.072 0.261 -15.575 1.00 0.00 C ATOM 787 CG1 VAL A 51 10.812 0.825 -14.937 1.00 0.00 C ATOM 788 CG2 VAL A 51 13.004 1.380 -16.014 1.00 0.00 C ATOM 0 H VAL A 51 14.052 0.788 -13.808 1.00 0.00 H new ATOM 0 HA VAL A 51 12.061 -1.360 -14.150 1.00 0.00 H new ATOM 0 HB VAL A 51 11.780 -0.306 -16.459 1.00 0.00 H new ATOM 0 HG11 VAL A 51 10.316 1.494 -15.640 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.139 0.008 -14.677 1.00 0.00 H new ATOM 0 HG13 VAL A 51 11.077 1.378 -14.036 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.479 2.042 -16.703 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.328 1.947 -15.141 1.00 0.00 H new ATOM 0 HG23 VAL A 51 13.874 0.954 -16.513 1.00 0.00 H new ATOM 798 N TYR A 52 13.359 -2.202 -16.407 1.00 0.00 N ATOM 799 CA TYR A 52 14.238 -3.027 -17.227 1.00 0.00 C ATOM 800 C TYR A 52 13.966 -2.804 -18.712 1.00 0.00 C ATOM 801 O TYR A 52 12.910 -2.298 -19.093 1.00 0.00 O ATOM 802 CB TYR A 52 14.055 -4.506 -16.880 1.00 0.00 C ATOM 803 CG TYR A 52 14.232 -4.809 -15.409 1.00 0.00 C ATOM 804 CD1 TYR A 52 15.416 -4.496 -14.753 1.00 0.00 C ATOM 805 CD2 TYR A 52 13.215 -5.407 -14.676 1.00 0.00 C ATOM 806 CE1 TYR A 52 15.583 -4.772 -13.410 1.00 0.00 C ATOM 807 CE2 TYR A 52 13.372 -5.685 -13.332 1.00 0.00 C ATOM 808 CZ TYR A 52 14.558 -5.366 -12.704 1.00 0.00 C ATOM 809 OH TYR A 52 14.719 -5.641 -11.365 1.00 0.00 O ATOM 0 H TYR A 52 12.381 -2.210 -16.697 1.00 0.00 H new ATOM 0 HA TYR A 52 15.267 -2.736 -17.017 1.00 0.00 H new ATOM 0 HB2 TYR A 52 13.059 -4.823 -17.190 1.00 0.00 H new ATOM 0 HB3 TYR A 52 14.770 -5.096 -17.453 1.00 0.00 H new ATOM 0 HD1 TYR A 52 16.220 -4.029 -15.303 1.00 0.00 H new ATOM 0 HD2 TYR A 52 12.286 -5.659 -15.165 1.00 0.00 H new ATOM 0 HE1 TYR A 52 16.511 -4.524 -12.916 1.00 0.00 H new ATOM 0 HE2 TYR A 52 12.571 -6.149 -12.776 1.00 0.00 H new ATOM 0 HH TYR A 52 13.904 -6.058 -11.016 1.00 0.00 H new ATOM 819 N LEU A 53 14.926 -3.188 -19.546 1.00 0.00 N ATOM 820 CA LEU A 53 14.791 -3.031 -20.991 1.00 0.00 C ATOM 821 C LEU A 53 13.962 -4.165 -21.586 1.00 0.00 C ATOM 822 O LEU A 53 14.220 -5.340 -21.323 1.00 0.00 O ATOM 823 CB LEU A 53 16.171 -2.992 -21.650 1.00 0.00 C ATOM 824 CG LEU A 53 16.475 -1.757 -22.498 1.00 0.00 C ATOM 825 CD1 LEU A 53 15.446 -1.605 -23.608 1.00 0.00 C ATOM 826 CD2 LEU A 53 16.512 -0.509 -21.628 1.00 0.00 C ATOM 0 H LEU A 53 15.805 -3.610 -19.248 1.00 0.00 H new ATOM 0 HA LEU A 53 14.276 -2.090 -21.184 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.927 -3.066 -20.868 1.00 0.00 H new ATOM 0 HB3 LEU A 53 16.276 -3.875 -22.280 1.00 0.00 H new ATOM 0 HG LEU A 53 17.456 -1.886 -22.955 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.679 -0.721 -24.201 1.00 0.00 H new ATOM 0 HD12 LEU A 53 15.468 -2.487 -24.248 1.00 0.00 H new ATOM 0 HD13 LEU A 53 14.453 -1.498 -23.171 1.00 0.00 H new ATOM 0 HD21 LEU A 53 16.730 0.361 -22.248 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.545 -0.375 -21.142 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.287 -0.617 -20.870 1.00 0.00 H new ATOM 838 N ARG A 54 12.968 -3.804 -22.391 1.00 0.00 N ATOM 839 CA ARG A 54 12.102 -4.791 -23.025 1.00 0.00 C ATOM 840 C ARG A 54 12.924 -5.827 -23.786 1.00 0.00 C ATOM 841 O ARG A 54 12.537 -6.991 -23.886 1.00 0.00 O ATOM 842 CB ARG A 54 11.121 -4.104 -23.976 1.00 0.00 C ATOM 843 CG ARG A 54 9.767 -4.789 -24.054 1.00 0.00 C ATOM 844 CD ARG A 54 9.734 -5.835 -25.157 1.00 0.00 C ATOM 845 NE ARG A 54 9.071 -5.341 -26.361 1.00 0.00 N ATOM 846 CZ ARG A 54 8.622 -6.131 -27.330 1.00 0.00 C ATOM 847 NH1 ARG A 54 8.764 -7.446 -27.237 1.00 0.00 N ATOM 848 NH2 ARG A 54 8.029 -5.606 -28.394 1.00 0.00 N ATOM 0 H ARG A 54 12.742 -2.836 -22.620 1.00 0.00 H new ATOM 0 HA ARG A 54 11.541 -5.302 -22.242 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.979 -3.072 -23.654 1.00 0.00 H new ATOM 0 HB3 ARG A 54 11.559 -4.069 -24.973 1.00 0.00 H new ATOM 0 HG2 ARG A 54 9.541 -5.260 -23.097 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.991 -4.045 -24.234 1.00 0.00 H new ATOM 0 HD2 ARG A 54 10.753 -6.136 -25.402 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.217 -6.725 -24.798 1.00 0.00 H new ATOM 0 HE ARG A 54 8.946 -4.334 -26.463 1.00 0.00 H new ATOM 0 HH11 ARG A 54 9.219 -7.853 -26.420 1.00 0.00 H new ATOM 0 HH12 ARG A 54 8.418 -8.050 -27.982 1.00 0.00 H new ATOM 0 HH21 ARG A 54 7.917 -4.595 -28.469 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.685 -6.213 -29.138 1.00 0.00 H new ATOM 862 N SER A 55 14.061 -5.394 -24.323 1.00 0.00 N ATOM 863 CA SER A 55 14.936 -6.283 -25.079 1.00 0.00 C ATOM 864 C SER A 55 15.698 -7.219 -24.145 1.00 0.00 C ATOM 865 O SER A 55 15.941 -8.380 -24.476 1.00 0.00 O ATOM 866 CB SER A 55 15.922 -5.468 -25.919 1.00 0.00 C ATOM 867 OG SER A 55 15.379 -5.166 -27.192 1.00 0.00 O ATOM 0 H SER A 55 14.397 -4.434 -24.249 1.00 0.00 H new ATOM 0 HA SER A 55 14.316 -6.886 -25.742 1.00 0.00 H new ATOM 0 HB2 SER A 55 16.171 -4.544 -25.398 1.00 0.00 H new ATOM 0 HB3 SER A 55 16.850 -6.026 -26.039 1.00 0.00 H new ATOM 0 HG SER A 55 16.027 -4.643 -27.709 1.00 0.00 H new ATOM 873 N ASP A 56 16.072 -6.705 -22.979 1.00 0.00 N ATOM 874 CA ASP A 56 16.805 -7.494 -21.996 1.00 0.00 C ATOM 875 C ASP A 56 15.953 -8.651 -21.482 1.00 0.00 C ATOM 876 O ASP A 56 16.348 -9.814 -21.571 1.00 0.00 O ATOM 877 CB ASP A 56 17.245 -6.611 -20.827 1.00 0.00 C ATOM 878 CG ASP A 56 18.701 -6.200 -20.929 1.00 0.00 C ATOM 879 OD1 ASP A 56 19.574 -7.090 -20.869 1.00 0.00 O ATOM 880 OD2 ASP A 56 18.967 -4.987 -21.068 1.00 0.00 O ATOM 0 H ASP A 56 15.880 -5.746 -22.691 1.00 0.00 H new ATOM 0 HA ASP A 56 17.689 -7.906 -22.484 1.00 0.00 H new ATOM 0 HB2 ASP A 56 16.620 -5.719 -20.794 1.00 0.00 H new ATOM 0 HB3 ASP A 56 17.086 -7.146 -19.891 1.00 0.00 H new ATOM 885 N VAL A 57 14.782 -8.324 -20.944 1.00 0.00 N ATOM 886 CA VAL A 57 13.874 -9.335 -20.417 1.00 0.00 C ATOM 887 C VAL A 57 13.577 -10.405 -21.460 1.00 0.00 C ATOM 888 O VAL A 57 13.458 -11.586 -21.135 1.00 0.00 O ATOM 889 CB VAL A 57 12.547 -8.708 -19.948 1.00 0.00 C ATOM 890 CG1 VAL A 57 11.646 -9.766 -19.330 1.00 0.00 C ATOM 891 CG2 VAL A 57 12.810 -7.578 -18.964 1.00 0.00 C ATOM 0 H VAL A 57 14.440 -7.366 -20.862 1.00 0.00 H new ATOM 0 HA VAL A 57 14.373 -9.793 -19.563 1.00 0.00 H new ATOM 0 HB VAL A 57 12.035 -8.291 -20.815 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.714 -9.305 -19.005 1.00 0.00 H new ATOM 0 HG12 VAL A 57 11.431 -10.537 -20.069 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.147 -10.215 -18.473 1.00 0.00 H new ATOM 0 HG21 VAL A 57 11.862 -7.147 -18.643 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.343 -7.967 -18.097 1.00 0.00 H new ATOM 0 HG23 VAL A 57 13.414 -6.809 -19.446 1.00 0.00 H new ATOM 901 N GLU A 58 13.460 -9.984 -22.716 1.00 0.00 N ATOM 902 CA GLU A 58 13.177 -10.908 -23.808 1.00 0.00 C ATOM 903 C GLU A 58 14.206 -12.033 -23.849 1.00 0.00 C ATOM 904 O GLU A 58 13.859 -13.210 -23.759 1.00 0.00 O ATOM 905 CB GLU A 58 13.164 -10.164 -25.145 1.00 0.00 C ATOM 906 CG GLU A 58 12.833 -11.052 -26.332 1.00 0.00 C ATOM 907 CD GLU A 58 12.368 -10.262 -27.540 1.00 0.00 C ATOM 908 OE1 GLU A 58 11.617 -9.282 -27.356 1.00 0.00 O ATOM 909 OE2 GLU A 58 12.757 -10.624 -28.671 1.00 0.00 O ATOM 0 H GLU A 58 13.557 -9.010 -23.002 1.00 0.00 H new ATOM 0 HA GLU A 58 12.194 -11.345 -23.634 1.00 0.00 H new ATOM 0 HB2 GLU A 58 12.436 -9.354 -25.094 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.140 -9.706 -25.306 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.713 -11.635 -26.601 1.00 0.00 H new ATOM 0 HG3 GLU A 58 12.056 -11.761 -26.045 1.00 0.00 H new ATOM 916 N ALA A 59 15.475 -11.662 -23.987 1.00 0.00 N ATOM 917 CA ALA A 59 16.556 -12.638 -24.039 1.00 0.00 C ATOM 918 C ALA A 59 16.638 -13.436 -22.742 1.00 0.00 C ATOM 919 O ALA A 59 16.903 -14.638 -22.756 1.00 0.00 O ATOM 920 CB ALA A 59 17.881 -11.945 -24.320 1.00 0.00 C ATOM 0 H ALA A 59 15.779 -10.692 -24.065 1.00 0.00 H new ATOM 0 HA ALA A 59 16.344 -13.334 -24.850 1.00 0.00 H new ATOM 0 HB1 ALA A 59 18.679 -12.687 -24.356 1.00 0.00 H new ATOM 0 HB2 ALA A 59 17.824 -11.426 -25.277 1.00 0.00 H new ATOM 0 HB3 ALA A 59 18.090 -11.225 -23.529 1.00 0.00 H new ATOM 926 N LYS A 60 16.411 -12.759 -21.622 1.00 0.00 N ATOM 927 CA LYS A 60 16.458 -13.404 -20.315 1.00 0.00 C ATOM 928 C LYS A 60 15.504 -14.593 -20.260 1.00 0.00 C ATOM 929 O LYS A 60 15.713 -15.533 -19.493 1.00 0.00 O ATOM 930 CB LYS A 60 16.104 -12.400 -19.215 1.00 0.00 C ATOM 931 CG LYS A 60 16.011 -13.021 -17.832 1.00 0.00 C ATOM 932 CD LYS A 60 17.329 -13.655 -17.416 1.00 0.00 C ATOM 933 CE LYS A 60 18.418 -12.608 -17.236 1.00 0.00 C ATOM 934 NZ LYS A 60 19.274 -12.485 -18.449 1.00 0.00 N ATOM 0 H LYS A 60 16.192 -11.763 -21.593 1.00 0.00 H new ATOM 0 HA LYS A 60 17.473 -13.768 -20.153 1.00 0.00 H new ATOM 0 HB2 LYS A 60 16.855 -11.610 -19.200 1.00 0.00 H new ATOM 0 HB3 LYS A 60 15.151 -11.929 -19.457 1.00 0.00 H new ATOM 0 HG2 LYS A 60 15.729 -12.257 -17.107 1.00 0.00 H new ATOM 0 HG3 LYS A 60 15.224 -13.775 -17.823 1.00 0.00 H new ATOM 0 HD2 LYS A 60 17.192 -14.203 -16.484 1.00 0.00 H new ATOM 0 HD3 LYS A 60 17.640 -14.379 -18.169 1.00 0.00 H new ATOM 0 HE2 LYS A 60 17.962 -11.643 -17.014 1.00 0.00 H new ATOM 0 HE3 LYS A 60 19.038 -12.872 -16.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 20.203 -12.102 -18.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 19.398 -13.422 -18.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 18.819 -11.845 -19.131 1.00 0.00 H new ATOM 948 N SER A 61 14.458 -14.545 -21.078 1.00 0.00 N ATOM 949 CA SER A 61 13.471 -15.617 -21.120 1.00 0.00 C ATOM 950 C SER A 61 13.942 -16.754 -22.022 1.00 0.00 C ATOM 951 O SER A 61 13.548 -17.907 -21.844 1.00 0.00 O ATOM 952 CB SER A 61 12.126 -15.082 -21.615 1.00 0.00 C ATOM 953 OG SER A 61 11.489 -16.015 -22.470 1.00 0.00 O ATOM 0 H SER A 61 14.272 -13.775 -21.721 1.00 0.00 H new ATOM 0 HA SER A 61 13.349 -16.005 -20.109 1.00 0.00 H new ATOM 0 HB2 SER A 61 11.481 -14.866 -20.763 1.00 0.00 H new ATOM 0 HB3 SER A 61 12.278 -14.142 -22.146 1.00 0.00 H new ATOM 0 HG SER A 61 10.714 -15.592 -22.896 1.00 0.00 H new ATOM 959 N LEU A 62 14.787 -16.420 -22.991 1.00 0.00 N ATOM 960 CA LEU A 62 15.314 -17.412 -23.922 1.00 0.00 C ATOM 961 C LEU A 62 16.473 -18.182 -23.299 1.00 0.00 C ATOM 962 O LEU A 62 16.656 -19.370 -23.566 1.00 0.00 O ATOM 963 CB LEU A 62 15.772 -16.734 -25.214 1.00 0.00 C ATOM 964 CG LEU A 62 14.789 -15.743 -25.838 1.00 0.00 C ATOM 965 CD1 LEU A 62 15.318 -15.231 -27.169 1.00 0.00 C ATOM 966 CD2 LEU A 62 13.423 -16.390 -26.019 1.00 0.00 C ATOM 0 H LEU A 62 15.122 -15.470 -23.153 1.00 0.00 H new ATOM 0 HA LEU A 62 14.516 -18.118 -24.153 1.00 0.00 H new ATOM 0 HB2 LEU A 62 16.707 -16.210 -25.014 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.991 -17.509 -25.949 1.00 0.00 H new ATOM 0 HG LEU A 62 14.681 -14.894 -25.163 1.00 0.00 H new ATOM 0 HD11 LEU A 62 14.605 -14.527 -27.598 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.273 -14.730 -27.012 1.00 0.00 H new ATOM 0 HD13 LEU A 62 15.456 -16.069 -27.852 1.00 0.00 H new ATOM 0 HD21 LEU A 62 12.736 -15.671 -26.464 1.00 0.00 H new ATOM 0 HD22 LEU A 62 13.515 -17.257 -26.673 1.00 0.00 H new ATOM 0 HD23 LEU A 62 13.039 -16.706 -25.049 1.00 0.00 H new ATOM 978 N GLU A 63 17.253 -17.498 -22.467 1.00 0.00 N ATOM 979 CA GLU A 63 18.394 -18.120 -21.806 1.00 0.00 C ATOM 980 C GLU A 63 17.934 -19.047 -20.684 1.00 0.00 C ATOM 981 O GLU A 63 18.636 -19.988 -20.314 1.00 0.00 O ATOM 982 CB GLU A 63 19.332 -17.049 -21.245 1.00 0.00 C ATOM 983 CG GLU A 63 18.798 -16.365 -19.998 1.00 0.00 C ATOM 984 CD GLU A 63 19.450 -16.876 -18.728 1.00 0.00 C ATOM 985 OE1 GLU A 63 19.999 -17.998 -18.751 1.00 0.00 O ATOM 986 OE2 GLU A 63 19.411 -16.154 -17.709 1.00 0.00 O ATOM 0 H GLU A 63 17.115 -16.514 -22.235 1.00 0.00 H new ATOM 0 HA GLU A 63 18.932 -18.713 -22.546 1.00 0.00 H new ATOM 0 HB2 GLU A 63 20.295 -17.506 -21.015 1.00 0.00 H new ATOM 0 HB3 GLU A 63 19.512 -16.297 -22.013 1.00 0.00 H new ATOM 0 HG2 GLU A 63 18.962 -15.290 -20.079 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.721 -16.519 -19.936 1.00 0.00 H new ATOM 993 N VAL A 64 16.749 -18.773 -20.146 1.00 0.00 N ATOM 994 CA VAL A 64 16.194 -19.581 -19.067 1.00 0.00 C ATOM 995 C VAL A 64 15.357 -20.730 -19.616 1.00 0.00 C ATOM 996 O VAL A 64 15.771 -21.889 -19.574 1.00 0.00 O ATOM 997 CB VAL A 64 15.324 -18.732 -18.120 1.00 0.00 C ATOM 998 CG1 VAL A 64 14.710 -19.603 -17.035 1.00 0.00 C ATOM 999 CG2 VAL A 64 16.144 -17.605 -17.511 1.00 0.00 C ATOM 0 H VAL A 64 16.155 -17.997 -20.440 1.00 0.00 H new ATOM 0 HA VAL A 64 17.038 -19.985 -18.508 1.00 0.00 H new ATOM 0 HB VAL A 64 14.513 -18.289 -18.698 1.00 0.00 H new ATOM 0 HG11 VAL A 64 14.099 -18.986 -16.376 1.00 0.00 H new ATOM 0 HG12 VAL A 64 14.087 -20.371 -17.494 1.00 0.00 H new ATOM 0 HG13 VAL A 64 15.503 -20.077 -16.457 1.00 0.00 H new ATOM 0 HG21 VAL A 64 15.514 -17.015 -16.845 1.00 0.00 H new ATOM 0 HG22 VAL A 64 16.976 -18.025 -16.946 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.530 -16.966 -18.305 1.00 0.00 H new ATOM 1009 N TRP A 65 14.177 -20.401 -20.131 1.00 0.00 N ATOM 1010 CA TRP A 65 13.281 -21.407 -20.689 1.00 0.00 C ATOM 1011 C TRP A 65 13.936 -22.131 -21.859 1.00 0.00 C ATOM 1012 O TRP A 65 13.597 -23.274 -22.163 1.00 0.00 O ATOM 1013 CB TRP A 65 11.973 -20.757 -21.144 1.00 0.00 C ATOM 1014 CG TRP A 65 11.005 -20.521 -20.024 1.00 0.00 C ATOM 1015 CD1 TRP A 65 10.857 -19.375 -19.297 1.00 0.00 C ATOM 1016 CD2 TRP A 65 10.054 -21.456 -19.502 1.00 0.00 C ATOM 1017 NE1 TRP A 65 9.871 -19.540 -18.354 1.00 0.00 N ATOM 1018 CE2 TRP A 65 9.362 -20.808 -18.460 1.00 0.00 C ATOM 1019 CE3 TRP A 65 9.719 -22.776 -19.814 1.00 0.00 C ATOM 1020 CZ2 TRP A 65 8.357 -21.437 -17.731 1.00 0.00 C ATOM 1021 CZ3 TRP A 65 8.721 -23.399 -19.089 1.00 0.00 C ATOM 1022 CH2 TRP A 65 8.049 -22.730 -18.058 1.00 0.00 C ATOM 0 H TRP A 65 13.819 -19.447 -20.174 1.00 0.00 H new ATOM 0 HA TRP A 65 13.065 -22.138 -19.909 1.00 0.00 H new ATOM 0 HB2 TRP A 65 12.197 -19.806 -21.627 1.00 0.00 H new ATOM 0 HB3 TRP A 65 11.502 -21.392 -21.894 1.00 0.00 H new ATOM 0 HD1 TRP A 65 11.431 -18.471 -19.442 1.00 0.00 H new ATOM 0 HE1 TRP A 65 9.567 -18.833 -17.684 1.00 0.00 H new ATOM 0 HE3 TRP A 65 10.231 -23.300 -20.608 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 7.838 -20.923 -16.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 8.455 -24.419 -19.321 1.00 0.00 H new ATOM 0 HH2 TRP A 65 7.273 -23.244 -17.511 1.00 0.00 H new ATOM 1033 N GLY A 66 14.879 -21.459 -22.513 1.00 0.00 N ATOM 1034 CA GLY A 66 15.567 -22.056 -23.643 1.00 0.00 C ATOM 1035 C GLY A 66 15.168 -21.427 -24.963 1.00 0.00 C ATOM 1036 O GLY A 66 16.018 -21.147 -25.808 1.00 0.00 O ATOM 0 H GLY A 66 15.179 -20.512 -22.280 1.00 0.00 H new ATOM 0 HA2 GLY A 66 16.643 -21.952 -23.505 1.00 0.00 H new ATOM 0 HA3 GLY A 66 15.351 -23.124 -23.673 1.00 0.00 H new ATOM 1040 N SER A 67 13.869 -21.206 -25.143 1.00 0.00 N ATOM 1041 CA SER A 67 13.358 -20.612 -26.373 1.00 0.00 C ATOM 1042 C SER A 67 12.074 -19.832 -26.106 1.00 0.00 C ATOM 1043 O SER A 67 11.397 -20.028 -25.096 1.00 0.00 O ATOM 1044 CB SER A 67 13.100 -21.697 -27.420 1.00 0.00 C ATOM 1045 OG SER A 67 12.805 -22.940 -26.805 1.00 0.00 O ATOM 0 H SER A 67 13.152 -21.429 -24.453 1.00 0.00 H new ATOM 0 HA SER A 67 14.110 -19.921 -26.754 1.00 0.00 H new ATOM 0 HB2 SER A 67 12.270 -21.399 -28.061 1.00 0.00 H new ATOM 0 HB3 SER A 67 13.975 -21.804 -28.061 1.00 0.00 H new ATOM 0 HG SER A 67 12.642 -23.616 -27.495 1.00 0.00 H new ATOM 1051 N PRO A 68 11.730 -18.926 -27.033 1.00 0.00 N ATOM 1052 CA PRO A 68 10.526 -18.097 -26.921 1.00 0.00 C ATOM 1053 C PRO A 68 9.247 -18.908 -27.098 1.00 0.00 C ATOM 1054 O PRO A 68 8.162 -18.460 -26.728 1.00 0.00 O ATOM 1055 CB PRO A 68 10.682 -17.089 -28.062 1.00 0.00 C ATOM 1056 CG PRO A 68 11.553 -17.775 -29.058 1.00 0.00 C ATOM 1057 CD PRO A 68 12.491 -18.640 -28.261 1.00 0.00 C ATOM 0 HA PRO A 68 10.438 -17.637 -25.937 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.716 -16.828 -28.494 1.00 0.00 H new ATOM 0 HB3 PRO A 68 11.136 -16.162 -27.712 1.00 0.00 H new ATOM 0 HG2 PRO A 68 10.960 -18.375 -29.748 1.00 0.00 H new ATOM 0 HG3 PRO A 68 12.104 -17.051 -29.658 1.00 0.00 H new ATOM 0 HD2 PRO A 68 12.748 -19.554 -28.797 1.00 0.00 H new ATOM 0 HD3 PRO A 68 13.426 -18.124 -28.043 1.00 0.00 H new ATOM 1065 N GLU A 69 9.382 -20.102 -27.666 1.00 0.00 N ATOM 1066 CA GLU A 69 8.235 -20.974 -27.891 1.00 0.00 C ATOM 1067 C GLU A 69 7.752 -21.588 -26.580 1.00 0.00 C ATOM 1068 O GLU A 69 6.566 -21.870 -26.415 1.00 0.00 O ATOM 1069 CB GLU A 69 8.596 -22.082 -28.883 1.00 0.00 C ATOM 1070 CG GLU A 69 7.478 -22.416 -29.856 1.00 0.00 C ATOM 1071 CD GLU A 69 7.338 -21.386 -30.960 1.00 0.00 C ATOM 1072 OE1 GLU A 69 7.444 -20.178 -30.662 1.00 0.00 O ATOM 1073 OE2 GLU A 69 7.123 -21.789 -32.122 1.00 0.00 O ATOM 0 H GLU A 69 10.273 -20.487 -27.979 1.00 0.00 H new ATOM 0 HA GLU A 69 7.429 -20.371 -28.308 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.479 -21.780 -29.447 1.00 0.00 H new ATOM 0 HB3 GLU A 69 8.864 -22.981 -28.328 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.667 -23.394 -30.299 1.00 0.00 H new ATOM 0 HG3 GLU A 69 6.537 -22.489 -29.311 1.00 0.00 H new ATOM 1080 N ALA A 70 8.680 -21.791 -25.652 1.00 0.00 N ATOM 1081 CA ALA A 70 8.350 -22.370 -24.355 1.00 0.00 C ATOM 1082 C ALA A 70 7.437 -21.444 -23.558 1.00 0.00 C ATOM 1083 O ALA A 70 6.450 -21.887 -22.967 1.00 0.00 O ATOM 1084 CB ALA A 70 9.619 -22.666 -23.570 1.00 0.00 C ATOM 0 H ALA A 70 9.667 -21.563 -25.773 1.00 0.00 H new ATOM 0 HA ALA A 70 7.817 -23.305 -24.527 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.357 -23.098 -22.604 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.236 -23.371 -24.127 1.00 0.00 H new ATOM 0 HB3 ALA A 70 10.175 -21.741 -23.415 1.00 0.00 H new ATOM 1090 N LEU A 71 7.771 -20.159 -23.544 1.00 0.00 N ATOM 1091 CA LEU A 71 6.981 -19.170 -22.819 1.00 0.00 C ATOM 1092 C LEU A 71 5.675 -18.875 -23.549 1.00 0.00 C ATOM 1093 O LEU A 71 4.643 -18.635 -22.923 1.00 0.00 O ATOM 1094 CB LEU A 71 7.782 -17.879 -22.640 1.00 0.00 C ATOM 1095 CG LEU A 71 7.024 -16.698 -22.033 1.00 0.00 C ATOM 1096 CD1 LEU A 71 6.773 -16.930 -20.551 1.00 0.00 C ATOM 1097 CD2 LEU A 71 7.794 -15.403 -22.249 1.00 0.00 C ATOM 0 H LEU A 71 8.584 -19.777 -24.027 1.00 0.00 H new ATOM 0 HA LEU A 71 6.742 -19.581 -21.838 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.644 -18.095 -22.009 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.167 -17.576 -23.614 1.00 0.00 H new ATOM 0 HG LEU A 71 6.060 -16.613 -22.535 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.233 -16.079 -20.136 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.180 -17.835 -20.420 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.726 -17.042 -20.034 1.00 0.00 H new ATOM 0 HD21 LEU A 71 7.240 -14.573 -21.811 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.772 -15.478 -21.774 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.922 -15.230 -23.317 1.00 0.00 H new ATOM 1109 N ALA A 72 5.727 -18.896 -24.876 1.00 0.00 N ATOM 1110 CA ALA A 72 4.547 -18.634 -25.692 1.00 0.00 C ATOM 1111 C ALA A 72 3.411 -19.586 -25.334 1.00 0.00 C ATOM 1112 O ALA A 72 2.236 -19.247 -25.478 1.00 0.00 O ATOM 1113 CB ALA A 72 4.891 -18.752 -27.169 1.00 0.00 C ATOM 0 H ALA A 72 6.574 -19.092 -25.410 1.00 0.00 H new ATOM 0 HA ALA A 72 4.212 -17.617 -25.488 1.00 0.00 H new ATOM 0 HB1 ALA A 72 4.001 -18.554 -27.767 1.00 0.00 H new ATOM 0 HB2 ALA A 72 5.666 -18.028 -27.421 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.253 -19.759 -27.379 1.00 0.00 H new ATOM 1119 N ARG A 73 3.768 -20.778 -24.867 1.00 0.00 N ATOM 1120 CA ARG A 73 2.777 -21.779 -24.490 1.00 0.00 C ATOM 1121 C ARG A 73 1.917 -21.283 -23.331 1.00 0.00 C ATOM 1122 O ARG A 73 0.697 -21.442 -23.339 1.00 0.00 O ATOM 1123 CB ARG A 73 3.466 -23.089 -24.104 1.00 0.00 C ATOM 1124 CG ARG A 73 4.406 -23.621 -25.174 1.00 0.00 C ATOM 1125 CD ARG A 73 4.034 -25.036 -25.589 1.00 0.00 C ATOM 1126 NE ARG A 73 4.687 -25.430 -26.834 1.00 0.00 N ATOM 1127 CZ ARG A 73 4.814 -26.692 -27.230 1.00 0.00 C ATOM 1128 NH1 ARG A 73 4.334 -27.676 -26.482 1.00 0.00 N ATOM 1129 NH2 ARG A 73 5.421 -26.971 -28.376 1.00 0.00 N ATOM 0 H ARG A 73 4.736 -21.074 -24.741 1.00 0.00 H new ATOM 0 HA ARG A 73 2.131 -21.956 -25.350 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.027 -22.937 -23.182 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.706 -23.841 -23.893 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.376 -22.966 -26.044 1.00 0.00 H new ATOM 0 HG3 ARG A 73 5.430 -23.608 -24.800 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.313 -25.731 -24.797 1.00 0.00 H new ATOM 0 HD3 ARG A 73 2.953 -25.106 -25.709 1.00 0.00 H new ATOM 0 HE ARG A 73 5.066 -24.696 -27.433 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.866 -27.465 -25.601 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.433 -28.644 -26.788 1.00 0.00 H new ATOM 0 HH21 ARG A 73 5.791 -26.216 -28.954 1.00 0.00 H new ATOM 0 HH22 ARG A 73 5.518 -27.940 -28.679 1.00 0.00 H new ATOM 1143 N GLU A 74 2.563 -20.683 -22.336 1.00 0.00 N ATOM 1144 CA GLU A 74 1.857 -20.166 -21.170 1.00 0.00 C ATOM 1145 C GLU A 74 1.181 -18.836 -21.489 1.00 0.00 C ATOM 1146 O GLU A 74 0.155 -18.491 -20.902 1.00 0.00 O ATOM 1147 CB GLU A 74 2.823 -19.992 -19.996 1.00 0.00 C ATOM 1148 CG GLU A 74 2.865 -21.187 -19.060 1.00 0.00 C ATOM 1149 CD GLU A 74 2.012 -20.989 -17.822 1.00 0.00 C ATOM 1150 OE1 GLU A 74 0.779 -20.851 -17.966 1.00 0.00 O ATOM 1151 OE2 GLU A 74 2.577 -20.972 -16.709 1.00 0.00 O ATOM 0 H GLU A 74 3.573 -20.543 -22.314 1.00 0.00 H new ATOM 0 HA GLU A 74 1.088 -20.887 -20.894 1.00 0.00 H new ATOM 0 HB2 GLU A 74 3.825 -19.810 -20.385 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.536 -19.107 -19.429 1.00 0.00 H new ATOM 0 HG2 GLU A 74 2.524 -22.074 -19.594 1.00 0.00 H new ATOM 0 HG3 GLU A 74 3.896 -21.373 -18.760 1.00 0.00 H new ATOM 1158 N LYS A 75 1.765 -18.091 -22.422 1.00 0.00 N ATOM 1159 CA LYS A 75 1.221 -16.799 -22.821 1.00 0.00 C ATOM 1160 C LYS A 75 -0.113 -16.968 -23.540 1.00 0.00 C ATOM 1161 O LYS A 75 -1.033 -16.170 -23.361 1.00 0.00 O ATOM 1162 CB LYS A 75 2.211 -16.063 -23.727 1.00 0.00 C ATOM 1163 CG LYS A 75 3.590 -15.898 -23.113 1.00 0.00 C ATOM 1164 CD LYS A 75 3.867 -14.450 -22.746 1.00 0.00 C ATOM 1165 CE LYS A 75 3.069 -14.022 -21.523 1.00 0.00 C ATOM 1166 NZ LYS A 75 1.812 -13.318 -21.900 1.00 0.00 N ATOM 0 H LYS A 75 2.616 -18.361 -22.916 1.00 0.00 H new ATOM 0 HA LYS A 75 1.055 -16.209 -21.919 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.304 -16.607 -24.667 1.00 0.00 H new ATOM 0 HB3 LYS A 75 1.809 -15.079 -23.966 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.670 -16.522 -22.223 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.346 -16.247 -23.816 1.00 0.00 H new ATOM 0 HD2 LYS A 75 4.932 -14.320 -22.551 1.00 0.00 H new ATOM 0 HD3 LYS A 75 3.617 -13.806 -23.589 1.00 0.00 H new ATOM 0 HE2 LYS A 75 2.828 -14.898 -20.922 1.00 0.00 H new ATOM 0 HE3 LYS A 75 3.680 -13.367 -20.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.821 -12.356 -21.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.741 -13.265 -22.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 0.995 -13.840 -21.523 1.00 0.00 H new ATOM 1180 N LYS A 76 -0.213 -18.014 -24.353 1.00 0.00 N ATOM 1181 CA LYS A 76 -1.436 -18.291 -25.098 1.00 0.00 C ATOM 1182 C LYS A 76 -2.489 -18.929 -24.197 1.00 0.00 C ATOM 1183 O LYS A 76 -3.689 -18.730 -24.390 1.00 0.00 O ATOM 1184 CB LYS A 76 -1.138 -19.212 -26.284 1.00 0.00 C ATOM 1185 CG LYS A 76 -2.361 -19.539 -27.122 1.00 0.00 C ATOM 1186 CD LYS A 76 -1.986 -19.831 -28.565 1.00 0.00 C ATOM 1187 CE LYS A 76 -1.475 -21.254 -28.731 1.00 0.00 C ATOM 1188 NZ LYS A 76 -2.255 -22.008 -29.751 1.00 0.00 N ATOM 0 H LYS A 76 0.539 -18.685 -24.513 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.827 -17.344 -25.471 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -0.388 -18.741 -26.919 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.704 -20.140 -25.912 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.875 -20.401 -26.697 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.060 -18.703 -27.089 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.854 -19.678 -29.206 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -1.220 -19.128 -28.893 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -0.425 -21.231 -29.021 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.530 -21.774 -27.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.876 -22.973 -29.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.253 -22.052 -29.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.182 -21.526 -30.670 1.00 0.00 H new ATOM 1202 N LEU A 77 -2.032 -19.695 -23.213 1.00 0.00 N ATOM 1203 CA LEU A 77 -2.935 -20.362 -22.281 1.00 0.00 C ATOM 1204 C LEU A 77 -3.570 -19.357 -21.325 1.00 0.00 C ATOM 1205 O LEU A 77 -4.789 -19.334 -21.153 1.00 0.00 O ATOM 1206 CB LEU A 77 -2.182 -21.431 -21.487 1.00 0.00 C ATOM 1207 CG LEU A 77 -1.840 -22.713 -22.247 1.00 0.00 C ATOM 1208 CD1 LEU A 77 -0.859 -23.560 -21.450 1.00 0.00 C ATOM 1209 CD2 LEU A 77 -3.103 -23.505 -22.554 1.00 0.00 C ATOM 0 H LEU A 77 -1.042 -19.870 -23.040 1.00 0.00 H new ATOM 0 HA LEU A 77 -3.727 -20.838 -22.859 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -1.255 -20.994 -21.116 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.780 -21.697 -20.616 1.00 0.00 H new ATOM 0 HG LEU A 77 -1.369 -22.438 -23.191 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -0.627 -24.468 -22.006 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.057 -22.994 -21.281 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.303 -23.825 -20.491 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -2.840 -24.414 -23.095 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.602 -23.769 -21.622 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -3.772 -22.900 -23.165 1.00 0.00 H new ATOM 1221 N ARG A 78 -2.737 -18.525 -20.709 1.00 0.00 N ATOM 1222 CA ARG A 78 -3.217 -17.517 -19.772 1.00 0.00 C ATOM 1223 C ARG A 78 -4.095 -16.490 -20.481 1.00 0.00 C ATOM 1224 O ARG A 78 -4.991 -15.900 -19.877 1.00 0.00 O ATOM 1225 CB ARG A 78 -2.038 -16.816 -19.096 1.00 0.00 C ATOM 1226 CG ARG A 78 -1.281 -15.872 -20.016 1.00 0.00 C ATOM 1227 CD ARG A 78 -1.728 -14.431 -19.826 1.00 0.00 C ATOM 1228 NE ARG A 78 -0.683 -13.609 -19.222 1.00 0.00 N ATOM 1229 CZ ARG A 78 -0.841 -12.325 -18.920 1.00 0.00 C ATOM 1230 NH1 ARG A 78 -1.995 -11.720 -19.165 1.00 0.00 N ATOM 1231 NH2 ARG A 78 0.157 -11.644 -18.371 1.00 0.00 N ATOM 0 H ARG A 78 -1.726 -18.529 -20.842 1.00 0.00 H new ATOM 0 HA ARG A 78 -3.816 -18.019 -19.012 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -2.404 -16.255 -18.236 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -1.348 -17.569 -18.715 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -0.212 -15.951 -19.820 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -1.438 -16.169 -21.053 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -2.009 -14.009 -20.791 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.617 -14.407 -19.196 1.00 0.00 H new ATOM 0 HE ARG A 78 0.217 -14.044 -19.021 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.764 -12.241 -19.586 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -2.113 -10.734 -18.932 1.00 0.00 H new ATOM 0 HH21 ARG A 78 1.046 -12.106 -18.181 1.00 0.00 H new ATOM 0 HH22 ARG A 78 0.035 -10.658 -18.139 1.00 0.00 H new ATOM 1245 N LYS A 79 -3.831 -16.281 -21.766 1.00 0.00 N ATOM 1246 CA LYS A 79 -4.596 -15.326 -22.559 1.00 0.00 C ATOM 1247 C LYS A 79 -5.999 -15.854 -22.842 1.00 0.00 C ATOM 1248 O LYS A 79 -6.992 -15.241 -22.453 1.00 0.00 O ATOM 1249 CB LYS A 79 -3.875 -15.033 -23.877 1.00 0.00 C ATOM 1250 CG LYS A 79 -4.567 -13.981 -24.727 1.00 0.00 C ATOM 1251 CD LYS A 79 -4.591 -14.378 -26.194 1.00 0.00 C ATOM 1252 CE LYS A 79 -4.810 -13.172 -27.094 1.00 0.00 C ATOM 1253 NZ LYS A 79 -3.736 -13.041 -28.118 1.00 0.00 N ATOM 0 H LYS A 79 -3.093 -16.760 -22.281 1.00 0.00 H new ATOM 0 HA LYS A 79 -4.683 -14.403 -21.986 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -2.859 -14.703 -23.660 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -3.794 -15.956 -24.451 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -5.587 -13.837 -24.371 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.053 -13.026 -24.616 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -3.651 -14.863 -26.456 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -5.384 -15.107 -26.362 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.776 -13.260 -27.591 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.845 -12.267 -26.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.922 -12.207 -28.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -2.817 -12.931 -27.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.719 -13.893 -28.714 1.00 0.00 H new ATOM 1267 N GLU A 80 -6.071 -16.996 -23.519 1.00 0.00 N ATOM 1268 CA GLU A 80 -7.353 -17.606 -23.852 1.00 0.00 C ATOM 1269 C GLU A 80 -8.190 -17.833 -22.597 1.00 0.00 C ATOM 1270 O GLU A 80 -9.419 -17.863 -22.654 1.00 0.00 O ATOM 1271 CB GLU A 80 -7.138 -18.933 -24.582 1.00 0.00 C ATOM 1272 CG GLU A 80 -6.327 -18.801 -25.860 1.00 0.00 C ATOM 1273 CD GLU A 80 -7.190 -18.842 -27.106 1.00 0.00 C ATOM 1274 OE1 GLU A 80 -7.954 -19.817 -27.266 1.00 0.00 O ATOM 1275 OE2 GLU A 80 -7.102 -17.900 -27.920 1.00 0.00 O ATOM 0 H GLU A 80 -5.258 -17.517 -23.847 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.892 -16.922 -24.508 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.633 -19.629 -23.912 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.109 -19.368 -24.821 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.772 -17.863 -25.838 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.593 -19.605 -25.905 1.00 0.00 H new ATOM 1282 N ALA A 81 -7.515 -17.993 -21.464 1.00 0.00 N ATOM 1283 CA ALA A 81 -8.195 -18.217 -20.194 1.00 0.00 C ATOM 1284 C ALA A 81 -9.187 -17.097 -19.898 1.00 0.00 C ATOM 1285 O ALA A 81 -10.393 -17.327 -19.827 1.00 0.00 O ATOM 1286 CB ALA A 81 -7.181 -18.338 -19.066 1.00 0.00 C ATOM 0 H ALA A 81 -6.497 -17.972 -21.399 1.00 0.00 H new ATOM 0 HA ALA A 81 -8.752 -19.151 -20.268 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -7.703 -18.505 -18.124 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -6.514 -19.177 -19.265 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -6.599 -17.419 -19.000 1.00 0.00 H new ATOM 1292 N GLU A 82 -8.669 -15.884 -19.726 1.00 0.00 N ATOM 1293 CA GLU A 82 -9.511 -14.729 -19.436 1.00 0.00 C ATOM 1294 C GLU A 82 -10.623 -14.593 -20.472 1.00 0.00 C ATOM 1295 O GLU A 82 -11.759 -14.256 -20.137 1.00 0.00 O ATOM 1296 CB GLU A 82 -8.669 -13.452 -19.405 1.00 0.00 C ATOM 1297 CG GLU A 82 -7.611 -13.446 -18.314 1.00 0.00 C ATOM 1298 CD GLU A 82 -6.619 -12.310 -18.469 1.00 0.00 C ATOM 1299 OE1 GLU A 82 -6.232 -12.013 -19.618 1.00 0.00 O ATOM 1300 OE2 GLU A 82 -6.231 -11.717 -17.440 1.00 0.00 O ATOM 0 H GLU A 82 -7.672 -15.676 -19.782 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.966 -14.880 -18.457 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -8.182 -13.324 -20.372 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -9.328 -12.596 -19.265 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -8.098 -13.368 -17.342 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -7.075 -14.395 -18.327 1.00 0.00 H new ATOM 1307 N ILE A 83 -10.288 -14.857 -21.730 1.00 0.00 N ATOM 1308 CA ILE A 83 -11.258 -14.765 -22.814 1.00 0.00 C ATOM 1309 C ILE A 83 -12.387 -15.772 -22.628 1.00 0.00 C ATOM 1310 O ILE A 83 -13.562 -15.437 -22.779 1.00 0.00 O ATOM 1311 CB ILE A 83 -10.595 -15.001 -24.184 1.00 0.00 C ATOM 1312 CG1 ILE A 83 -9.405 -14.057 -24.368 1.00 0.00 C ATOM 1313 CG2 ILE A 83 -11.608 -14.809 -25.303 1.00 0.00 C ATOM 1314 CD1 ILE A 83 -8.632 -14.302 -25.645 1.00 0.00 C ATOM 0 H ILE A 83 -9.352 -15.136 -22.024 1.00 0.00 H new ATOM 0 HA ILE A 83 -11.667 -13.755 -22.787 1.00 0.00 H new ATOM 0 HB ILE A 83 -10.230 -16.027 -24.223 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.764 -13.028 -24.362 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -8.731 -14.165 -23.518 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -11.124 -14.979 -26.265 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -12.427 -15.518 -25.178 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -12.000 -13.792 -25.269 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -7.803 -13.597 -25.709 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -8.243 -15.320 -25.645 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -9.292 -14.165 -26.502 1.00 0.00 H new ATOM 1326 N GLU A 84 -12.023 -17.007 -22.298 1.00 0.00 N ATOM 1327 CA GLU A 84 -13.007 -18.063 -22.090 1.00 0.00 C ATOM 1328 C GLU A 84 -13.911 -17.739 -20.904 1.00 0.00 C ATOM 1329 O GLU A 84 -15.053 -18.196 -20.837 1.00 0.00 O ATOM 1330 CB GLU A 84 -12.307 -19.405 -21.860 1.00 0.00 C ATOM 1331 CG GLU A 84 -11.481 -19.871 -23.047 1.00 0.00 C ATOM 1332 CD GLU A 84 -11.978 -21.182 -23.625 1.00 0.00 C ATOM 1333 OE1 GLU A 84 -12.840 -21.142 -24.527 1.00 0.00 O ATOM 1334 OE2 GLU A 84 -11.504 -22.246 -23.176 1.00 0.00 O ATOM 0 H GLU A 84 -11.055 -17.301 -22.169 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.623 -18.131 -22.986 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.659 -19.323 -20.987 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.057 -20.162 -21.630 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.502 -19.105 -23.822 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -10.442 -19.985 -22.739 1.00 0.00 H new ATOM 1341 N TYR A 85 -13.392 -16.949 -19.971 1.00 0.00 N ATOM 1342 CA TYR A 85 -14.150 -16.566 -18.786 1.00 0.00 C ATOM 1343 C TYR A 85 -15.130 -15.441 -19.106 1.00 0.00 C ATOM 1344 O TYR A 85 -16.344 -15.608 -18.986 1.00 0.00 O ATOM 1345 CB TYR A 85 -13.202 -16.128 -17.668 1.00 0.00 C ATOM 1346 CG TYR A 85 -13.914 -15.668 -16.416 1.00 0.00 C ATOM 1347 CD1 TYR A 85 -14.564 -16.576 -15.589 1.00 0.00 C ATOM 1348 CD2 TYR A 85 -13.938 -14.325 -16.061 1.00 0.00 C ATOM 1349 CE1 TYR A 85 -15.216 -16.159 -14.445 1.00 0.00 C ATOM 1350 CE2 TYR A 85 -14.587 -13.900 -14.918 1.00 0.00 C ATOM 1351 CZ TYR A 85 -15.224 -14.821 -14.113 1.00 0.00 C ATOM 1352 OH TYR A 85 -15.873 -14.401 -12.974 1.00 0.00 O ATOM 0 H TYR A 85 -12.449 -16.561 -20.012 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.718 -17.435 -18.453 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.542 -16.958 -17.416 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -12.570 -15.319 -18.035 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -14.559 -17.625 -15.845 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.441 -13.601 -16.689 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -15.717 -16.878 -13.814 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.596 -12.852 -14.656 1.00 0.00 H new ATOM 0 HH TYR A 85 -15.782 -13.429 -12.885 1.00 0.00 H new ATOM 1362 N ARG A 86 -14.594 -14.296 -19.514 1.00 0.00 N ATOM 1363 CA ARG A 86 -15.419 -13.143 -19.852 1.00 0.00 C ATOM 1364 C ARG A 86 -16.445 -13.504 -20.922 1.00 0.00 C ATOM 1365 O ARG A 86 -17.504 -12.883 -21.014 1.00 0.00 O ATOM 1366 CB ARG A 86 -14.544 -11.987 -20.339 1.00 0.00 C ATOM 1367 CG ARG A 86 -13.618 -12.364 -21.484 1.00 0.00 C ATOM 1368 CD ARG A 86 -13.820 -11.455 -22.686 1.00 0.00 C ATOM 1369 NE ARG A 86 -12.831 -10.382 -22.733 1.00 0.00 N ATOM 1370 CZ ARG A 86 -12.987 -9.268 -23.440 1.00 0.00 C ATOM 1371 NH1 ARG A 86 -14.088 -9.083 -24.155 1.00 0.00 N ATOM 1372 NH2 ARG A 86 -12.042 -8.337 -23.432 1.00 0.00 N ATOM 0 H ARG A 86 -13.591 -14.142 -19.619 1.00 0.00 H new ATOM 0 HA ARG A 86 -15.951 -12.833 -18.953 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -15.186 -11.166 -20.658 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -13.946 -11.619 -19.505 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -12.582 -12.303 -21.151 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -13.799 -13.399 -21.774 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -13.759 -12.045 -23.601 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -14.821 -11.024 -22.651 1.00 0.00 H new ATOM 0 HE ARG A 86 -11.973 -10.494 -22.193 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -14.817 -9.796 -24.163 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -14.206 -8.227 -24.697 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -11.194 -8.476 -22.882 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -12.163 -7.482 -23.975 1.00 0.00 H new ATOM 1386 N GLU A 87 -16.124 -14.511 -21.728 1.00 0.00 N ATOM 1387 CA GLU A 87 -17.017 -14.952 -22.792 1.00 0.00 C ATOM 1388 C GLU A 87 -18.362 -15.398 -22.224 1.00 0.00 C ATOM 1389 O GLU A 87 -19.417 -14.949 -22.673 1.00 0.00 O ATOM 1390 CB GLU A 87 -16.380 -16.098 -23.581 1.00 0.00 C ATOM 1391 CG GLU A 87 -15.813 -15.670 -24.925 1.00 0.00 C ATOM 1392 CD GLU A 87 -16.786 -15.895 -26.066 1.00 0.00 C ATOM 1393 OE1 GLU A 87 -17.740 -15.100 -26.198 1.00 0.00 O ATOM 1394 OE2 GLU A 87 -16.593 -16.866 -26.827 1.00 0.00 O ATOM 0 H GLU A 87 -15.252 -15.037 -21.664 1.00 0.00 H new ATOM 0 HA GLU A 87 -17.186 -14.109 -23.462 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -15.582 -16.540 -22.984 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -17.126 -16.876 -23.742 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -15.546 -14.614 -24.883 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -14.895 -16.224 -25.121 1.00 0.00 H new ATOM 1401 N ARG A 88 -18.315 -16.284 -21.234 1.00 0.00 N ATOM 1402 CA ARG A 88 -19.528 -16.792 -20.605 1.00 0.00 C ATOM 1403 C ARG A 88 -20.173 -15.724 -19.726 1.00 0.00 C ATOM 1404 O ARG A 88 -21.383 -15.741 -19.498 1.00 0.00 O ATOM 1405 CB ARG A 88 -19.213 -18.034 -19.770 1.00 0.00 C ATOM 1406 CG ARG A 88 -18.243 -17.771 -18.629 1.00 0.00 C ATOM 1407 CD ARG A 88 -18.309 -18.867 -17.578 1.00 0.00 C ATOM 1408 NE ARG A 88 -16.983 -19.368 -17.226 1.00 0.00 N ATOM 1409 CZ ARG A 88 -16.770 -20.297 -16.301 1.00 0.00 C ATOM 1410 NH1 ARG A 88 -17.790 -20.824 -15.638 1.00 0.00 N ATOM 1411 NH2 ARG A 88 -15.534 -20.702 -16.037 1.00 0.00 N ATOM 0 H ARG A 88 -17.450 -16.665 -20.851 1.00 0.00 H new ATOM 0 HA ARG A 88 -20.231 -17.062 -21.393 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -20.142 -18.432 -19.362 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -18.796 -18.803 -20.421 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -17.228 -17.702 -19.021 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -18.473 -16.810 -18.169 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -18.801 -18.483 -16.684 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -18.920 -19.689 -17.950 1.00 0.00 H new ATOM 0 HE ARG A 88 -16.176 -18.983 -17.718 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -18.742 -20.516 -15.838 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -17.623 -21.537 -14.928 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -14.746 -20.300 -16.545 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -15.372 -21.416 -15.326 1.00 0.00 H new ATOM 1425 N LEU A 89 -19.357 -14.798 -19.236 1.00 0.00 N ATOM 1426 CA LEU A 89 -19.847 -13.722 -18.381 1.00 0.00 C ATOM 1427 C LEU A 89 -20.960 -12.941 -19.072 1.00 0.00 C ATOM 1428 O LEU A 89 -21.939 -12.543 -18.440 1.00 0.00 O ATOM 1429 CB LEU A 89 -18.702 -12.778 -18.008 1.00 0.00 C ATOM 1430 CG LEU A 89 -18.063 -13.007 -16.638 1.00 0.00 C ATOM 1431 CD1 LEU A 89 -19.102 -12.874 -15.535 1.00 0.00 C ATOM 1432 CD2 LEU A 89 -17.396 -14.373 -16.582 1.00 0.00 C ATOM 0 H LEU A 89 -18.353 -14.770 -19.416 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.252 -14.169 -17.473 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.925 -12.863 -18.768 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -19.074 -11.754 -18.046 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.299 -12.245 -16.483 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -18.629 -13.040 -14.567 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.534 -11.874 -15.561 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -19.889 -13.613 -15.686 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -16.947 -14.518 -15.600 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -18.141 -15.149 -16.759 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -16.622 -14.432 -17.347 1.00 0.00 H new ATOM 1444 N PHE A 90 -20.805 -12.727 -20.375 1.00 0.00 N ATOM 1445 CA PHE A 90 -21.797 -11.995 -21.153 1.00 0.00 C ATOM 1446 C PHE A 90 -23.085 -12.803 -21.289 1.00 0.00 C ATOM 1447 O PHE A 90 -24.182 -12.243 -21.308 1.00 0.00 O ATOM 1448 CB PHE A 90 -21.243 -11.660 -22.539 1.00 0.00 C ATOM 1449 CG PHE A 90 -20.890 -10.210 -22.709 1.00 0.00 C ATOM 1450 CD1 PHE A 90 -19.627 -9.748 -22.375 1.00 0.00 C ATOM 1451 CD2 PHE A 90 -21.820 -9.310 -23.203 1.00 0.00 C ATOM 1452 CE1 PHE A 90 -19.299 -8.414 -22.530 1.00 0.00 C ATOM 1453 CE2 PHE A 90 -21.498 -7.975 -23.360 1.00 0.00 C ATOM 1454 CZ PHE A 90 -20.236 -7.527 -23.024 1.00 0.00 C ATOM 0 H PHE A 90 -20.002 -13.050 -20.914 1.00 0.00 H new ATOM 0 HA PHE A 90 -22.024 -11.068 -20.626 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -20.356 -12.266 -22.723 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -21.980 -11.937 -23.293 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -18.891 -10.438 -21.989 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -22.808 -9.655 -23.469 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -18.312 -8.066 -22.265 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -22.233 -7.283 -23.745 1.00 0.00 H new ATOM 0 HZ PHE A 90 -19.982 -6.485 -23.147 1.00 0.00 H new ATOM 1464 N ARG A 91 -22.943 -14.120 -21.384 1.00 0.00 N ATOM 1465 CA ARG A 91 -24.094 -15.005 -21.520 1.00 0.00 C ATOM 1466 C ARG A 91 -24.857 -15.111 -20.203 1.00 0.00 C ATOM 1467 O ARG A 91 -26.059 -15.372 -20.191 1.00 0.00 O ATOM 1468 CB ARG A 91 -23.644 -16.395 -21.974 1.00 0.00 C ATOM 1469 CG ARG A 91 -23.473 -16.518 -23.480 1.00 0.00 C ATOM 1470 CD ARG A 91 -22.182 -17.240 -23.836 1.00 0.00 C ATOM 1471 NE ARG A 91 -21.623 -16.767 -25.100 1.00 0.00 N ATOM 1472 CZ ARG A 91 -20.628 -17.376 -25.736 1.00 0.00 C ATOM 1473 NH1 ARG A 91 -20.087 -18.475 -25.229 1.00 0.00 N ATOM 1474 NH2 ARG A 91 -20.173 -16.885 -26.882 1.00 0.00 N ATOM 0 H ARG A 91 -22.042 -14.599 -21.369 1.00 0.00 H new ATOM 0 HA ARG A 91 -24.759 -14.582 -22.272 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -22.699 -16.638 -21.488 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -24.374 -17.132 -21.638 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -24.321 -17.058 -23.901 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -23.472 -15.525 -23.930 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -21.453 -17.093 -23.039 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -22.372 -18.311 -23.901 1.00 0.00 H new ATOM 0 HE ARG A 91 -22.018 -15.924 -25.517 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -20.435 -18.855 -24.349 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -19.323 -18.940 -25.719 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -20.587 -16.040 -27.275 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -19.409 -17.353 -27.370 1.00 0.00 H new ATOM 1488 N ASN A 92 -24.150 -14.906 -19.097 1.00 0.00 N ATOM 1489 CA ASN A 92 -24.761 -14.980 -17.775 1.00 0.00 C ATOM 1490 C ASN A 92 -25.424 -13.656 -17.408 1.00 0.00 C ATOM 1491 O ASN A 92 -26.593 -13.622 -17.026 1.00 0.00 O ATOM 1492 CB ASN A 92 -23.710 -15.345 -16.724 1.00 0.00 C ATOM 1493 CG ASN A 92 -24.332 -15.766 -15.407 1.00 0.00 C ATOM 1494 OD1 ASN A 92 -24.859 -16.871 -15.282 1.00 0.00 O ATOM 1495 ND2 ASN A 92 -24.272 -14.884 -14.416 1.00 0.00 N ATOM 0 H ASN A 92 -23.154 -14.687 -19.090 1.00 0.00 H new ATOM 0 HA ASN A 92 -25.526 -15.756 -17.799 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -23.086 -16.154 -17.103 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -23.055 -14.490 -16.557 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -24.673 -15.111 -13.506 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -23.825 -13.979 -14.565 1.00 0.00 H new ATOM 1502 N GLN A 93 -24.669 -12.568 -17.527 1.00 0.00 N ATOM 1503 CA GLN A 93 -25.184 -11.242 -17.208 1.00 0.00 C ATOM 1504 C GLN A 93 -26.051 -10.707 -18.343 1.00 0.00 C ATOM 1505 O GLN A 93 -25.817 -11.011 -19.513 1.00 0.00 O ATOM 1506 CB GLN A 93 -24.030 -10.276 -16.933 1.00 0.00 C ATOM 1507 CG GLN A 93 -23.827 -9.976 -15.457 1.00 0.00 C ATOM 1508 CD GLN A 93 -24.983 -9.203 -14.853 1.00 0.00 C ATOM 1509 OE1 GLN A 93 -25.408 -8.181 -15.391 1.00 0.00 O ATOM 1510 NE2 GLN A 93 -25.498 -9.689 -13.730 1.00 0.00 N ATOM 0 H GLN A 93 -23.699 -12.579 -17.842 1.00 0.00 H new ATOM 0 HA GLN A 93 -25.800 -11.325 -16.313 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -23.110 -10.697 -17.340 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -24.215 -9.342 -17.463 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -23.699 -10.913 -14.914 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -22.907 -9.405 -15.330 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -25.114 -10.540 -13.319 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -26.278 -9.212 -13.278 1.00 0.00 H new ATOM 1519 N LYS A 94 -27.052 -9.909 -17.990 1.00 0.00 N ATOM 1520 CA LYS A 94 -27.955 -9.330 -18.978 1.00 0.00 C ATOM 1521 C LYS A 94 -28.389 -7.928 -18.563 1.00 0.00 C ATOM 1522 O LYS A 94 -28.998 -7.744 -17.508 1.00 0.00 O ATOM 1523 CB LYS A 94 -29.184 -10.223 -19.162 1.00 0.00 C ATOM 1524 CG LYS A 94 -29.143 -11.061 -20.428 1.00 0.00 C ATOM 1525 CD LYS A 94 -30.537 -11.303 -20.982 1.00 0.00 C ATOM 1526 CE LYS A 94 -30.486 -11.862 -22.396 1.00 0.00 C ATOM 1527 NZ LYS A 94 -30.329 -10.785 -23.412 1.00 0.00 N ATOM 0 H LYS A 94 -27.259 -9.648 -17.026 1.00 0.00 H new ATOM 0 HA LYS A 94 -27.420 -9.260 -19.925 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -29.274 -10.885 -18.301 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -30.077 -9.599 -19.178 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -28.534 -10.557 -21.179 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -28.663 -12.017 -20.217 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -31.072 -11.998 -20.334 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -31.098 -10.368 -20.979 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -29.656 -12.564 -22.479 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -31.399 -12.422 -22.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -30.298 -11.206 -24.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -31.134 -10.129 -23.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -29.445 -10.267 -23.235 1.00 0.00 H new ATOM 1541 N ILE A 95 -28.074 -6.944 -19.398 1.00 0.00 N ATOM 1542 CA ILE A 95 -28.435 -5.560 -19.118 1.00 0.00 C ATOM 1543 C ILE A 95 -29.941 -5.351 -19.229 1.00 0.00 C ATOM 1544 O ILE A 95 -30.510 -4.483 -18.565 1.00 0.00 O ATOM 1545 CB ILE A 95 -27.721 -4.587 -20.075 1.00 0.00 C ATOM 1546 CG1 ILE A 95 -27.951 -3.141 -19.632 1.00 0.00 C ATOM 1547 CG2 ILE A 95 -28.209 -4.795 -21.501 1.00 0.00 C ATOM 1548 CD1 ILE A 95 -26.695 -2.449 -19.152 1.00 0.00 C ATOM 0 H ILE A 95 -27.569 -7.079 -20.274 1.00 0.00 H new ATOM 0 HA ILE A 95 -28.116 -5.352 -18.097 1.00 0.00 H new ATOM 0 HB ILE A 95 -26.650 -4.790 -20.045 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -28.371 -2.577 -20.465 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -28.691 -3.128 -18.832 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -27.696 -4.101 -22.166 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -27.998 -5.818 -21.812 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -29.283 -4.615 -21.548 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -26.933 -1.428 -18.854 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -26.285 -2.990 -18.299 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -25.960 -2.430 -19.957 1.00 0.00 H new ATOM 1560 N LEU A 96 -30.583 -6.153 -20.071 1.00 0.00 N ATOM 1561 CA LEU A 96 -32.026 -6.058 -20.269 1.00 0.00 C ATOM 1562 C LEU A 96 -32.413 -4.683 -20.804 1.00 0.00 C ATOM 1563 O LEU A 96 -31.579 -3.781 -20.886 1.00 0.00 O ATOM 1564 CB LEU A 96 -32.759 -6.332 -18.955 1.00 0.00 C ATOM 1565 CG LEU A 96 -33.666 -7.563 -18.936 1.00 0.00 C ATOM 1566 CD1 LEU A 96 -32.967 -8.730 -18.256 1.00 0.00 C ATOM 1567 CD2 LEU A 96 -34.981 -7.247 -18.238 1.00 0.00 C ATOM 0 H LEU A 96 -30.128 -6.876 -20.628 1.00 0.00 H new ATOM 0 HA LEU A 96 -32.318 -6.808 -21.004 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -32.017 -6.440 -18.164 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -33.362 -5.458 -18.709 1.00 0.00 H new ATOM 0 HG LEU A 96 -33.884 -7.846 -19.966 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -33.627 -9.597 -18.252 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -32.053 -8.973 -18.798 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -32.719 -8.458 -17.230 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -35.613 -8.135 -18.234 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -34.783 -6.938 -17.212 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -35.490 -6.441 -18.768 1.00 0.00 H new ATOM 1579 N ARG A 97 -33.683 -4.530 -21.164 1.00 0.00 N ATOM 1580 CA ARG A 97 -34.181 -3.265 -21.690 1.00 0.00 C ATOM 1581 C ARG A 97 -33.325 -2.788 -22.860 1.00 0.00 C ATOM 1582 O ARG A 97 -33.135 -1.588 -23.054 1.00 0.00 O ATOM 1583 CB ARG A 97 -34.197 -2.202 -20.590 1.00 0.00 C ATOM 1584 CG ARG A 97 -35.181 -1.073 -20.849 1.00 0.00 C ATOM 1585 CD ARG A 97 -34.514 0.288 -20.719 1.00 0.00 C ATOM 1586 NE ARG A 97 -35.431 1.300 -20.204 1.00 0.00 N ATOM 1587 CZ ARG A 97 -35.075 2.556 -19.954 1.00 0.00 C ATOM 1588 NH1 ARG A 97 -33.829 2.950 -20.171 1.00 0.00 N ATOM 1589 NH2 ARG A 97 -35.968 3.419 -19.486 1.00 0.00 N ATOM 0 H ARG A 97 -34.386 -5.266 -21.101 1.00 0.00 H new ATOM 0 HA ARG A 97 -35.198 -3.424 -22.047 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -34.444 -2.677 -19.641 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -33.196 -1.784 -20.486 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -35.603 -1.179 -21.848 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -36.010 -1.142 -20.144 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -33.653 0.208 -20.055 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -34.138 0.602 -21.693 1.00 0.00 H new ATOM 0 HE ARG A 97 -36.398 1.029 -20.026 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -33.140 2.289 -20.531 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -33.558 3.914 -19.978 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -36.928 3.119 -19.318 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -35.694 4.383 -19.294 1.00 0.00 H new ATOM 1603 N GLU A 98 -32.812 -3.738 -23.637 1.00 0.00 N ATOM 1604 CA GLU A 98 -31.976 -3.414 -24.787 1.00 0.00 C ATOM 1605 C GLU A 98 -32.831 -3.011 -25.985 1.00 0.00 C ATOM 1606 O GLU A 98 -34.052 -2.898 -25.880 1.00 0.00 O ATOM 1607 CB GLU A 98 -31.092 -4.607 -25.155 1.00 0.00 C ATOM 1608 CG GLU A 98 -31.875 -5.824 -25.620 1.00 0.00 C ATOM 1609 CD GLU A 98 -31.040 -7.090 -25.622 1.00 0.00 C ATOM 1610 OE1 GLU A 98 -30.188 -7.236 -26.522 1.00 0.00 O ATOM 1611 OE2 GLU A 98 -31.239 -7.933 -24.723 1.00 0.00 O ATOM 0 H GLU A 98 -32.961 -4.736 -23.491 1.00 0.00 H new ATOM 0 HA GLU A 98 -31.341 -2.571 -24.516 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -30.401 -4.307 -25.943 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -30.489 -4.882 -24.290 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -32.740 -5.965 -24.971 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -32.257 -5.643 -26.625 1.00 0.00 H new ATOM 1618 N TYR A 99 -32.180 -2.795 -27.122 1.00 0.00 N ATOM 1619 CA TYR A 99 -32.879 -2.402 -28.340 1.00 0.00 C ATOM 1620 C TYR A 99 -33.659 -3.576 -28.924 1.00 0.00 C ATOM 1621 O TYR A 99 -33.493 -4.719 -28.498 1.00 0.00 O ATOM 1622 CB TYR A 99 -31.885 -1.870 -29.374 1.00 0.00 C ATOM 1623 CG TYR A 99 -31.013 -0.749 -28.856 1.00 0.00 C ATOM 1624 CD1 TYR A 99 -29.808 -1.018 -28.220 1.00 0.00 C ATOM 1625 CD2 TYR A 99 -31.396 0.579 -29.001 1.00 0.00 C ATOM 1626 CE1 TYR A 99 -29.008 0.003 -27.744 1.00 0.00 C ATOM 1627 CE2 TYR A 99 -30.601 1.606 -28.530 1.00 0.00 C ATOM 1628 CZ TYR A 99 -29.409 1.314 -27.902 1.00 0.00 C ATOM 1629 OH TYR A 99 -28.616 2.334 -27.429 1.00 0.00 O ATOM 0 H TYR A 99 -31.169 -2.885 -27.226 1.00 0.00 H new ATOM 0 HA TYR A 99 -33.585 -1.612 -28.085 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -31.248 -2.689 -29.708 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -32.435 -1.517 -30.246 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -29.491 -2.043 -28.095 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -32.330 0.812 -29.490 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -28.074 -0.224 -27.251 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -30.912 2.633 -28.653 1.00 0.00 H new ATOM 0 HH TYR A 99 -29.042 3.195 -27.622 1.00 0.00 H new ATOM 1639 N ARG A 100 -34.510 -3.284 -29.903 1.00 0.00 N ATOM 1640 CA ARG A 100 -35.316 -4.314 -30.546 1.00 0.00 C ATOM 1641 C ARG A 100 -34.768 -4.649 -31.930 1.00 0.00 C ATOM 1642 O ARG A 100 -33.904 -3.945 -32.453 1.00 0.00 O ATOM 1643 CB ARG A 100 -36.771 -3.856 -30.659 1.00 0.00 C ATOM 1644 CG ARG A 100 -37.710 -4.563 -29.695 1.00 0.00 C ATOM 1645 CD ARG A 100 -38.934 -5.112 -30.411 1.00 0.00 C ATOM 1646 NE ARG A 100 -40.069 -4.197 -30.334 1.00 0.00 N ATOM 1647 CZ ARG A 100 -41.172 -4.331 -31.062 1.00 0.00 C ATOM 1648 NH1 ARG A 100 -41.288 -5.337 -31.917 1.00 0.00 N ATOM 1649 NH2 ARG A 100 -42.162 -3.457 -30.935 1.00 0.00 N ATOM 0 H ARG A 100 -34.659 -2.343 -30.268 1.00 0.00 H new ATOM 0 HA ARG A 100 -35.271 -5.212 -29.930 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -36.820 -2.782 -30.478 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -37.117 -4.024 -31.679 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -37.180 -5.378 -29.201 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -38.024 -3.868 -28.916 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -38.689 -5.299 -31.457 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -39.211 -6.071 -29.973 1.00 0.00 H new ATOM 0 HE ARG A 100 -40.012 -3.412 -29.686 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -40.529 -6.011 -32.017 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -42.136 -5.437 -32.475 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -42.076 -2.681 -30.278 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -43.009 -3.561 -31.494 1.00 0.00 H new ATOM 1663 N ASP A 101 -35.275 -5.727 -32.517 1.00 0.00 N ATOM 1664 CA ASP A 101 -34.837 -6.155 -33.840 1.00 0.00 C ATOM 1665 C ASP A 101 -35.621 -7.380 -34.302 1.00 0.00 C ATOM 1666 O ASP A 101 -36.522 -7.851 -33.607 1.00 0.00 O ATOM 1667 CB ASP A 101 -33.340 -6.468 -33.829 1.00 0.00 C ATOM 1668 CG ASP A 101 -32.873 -7.112 -35.119 1.00 0.00 C ATOM 1669 OD1 ASP A 101 -32.592 -6.372 -36.085 1.00 0.00 O ATOM 1670 OD2 ASP A 101 -32.788 -8.357 -35.163 1.00 0.00 O ATOM 0 H ASP A 101 -35.990 -6.321 -32.097 1.00 0.00 H new ATOM 0 HA ASP A 101 -35.025 -5.340 -34.539 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -32.781 -5.547 -33.663 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -33.117 -7.132 -32.994 1.00 0.00 H new TER 1675 ASP A 101