USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 ASN : amide:sc= -1.91 X(o=-2.6,f=-2.5) USER MOD Set 1.2: A 107 SER OG : rot -130:sc= -0.714 USER MOD Set 2.1: A 41 MET CE :methyl -156:sc= -0.206 (180deg=-0.745) USER MOD Set 2.2: A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -164:sc= -0.0658 (180deg=-0.399) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 58:sc= 0.283 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.418 X(o=-0.42,f=-0.0013) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -0.0909 K(o=-0.091,f=-2) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 ASN : amide:sc= 0.586 K(o=0.59,f=-3.8!) USER MOD Single : A 26 ASN : amide:sc= -1.7 X(o=-1.7,f=-1.8) USER MOD Single : A 29 SER OG : rot 18:sc= 0.708! USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 CYS SG : rot -38:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -3.93! C(o=-3.9!,f=-4.3!) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN :FLIP amide:sc= -0.043 F(o=-2.9!,f=-0.043) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -87:sc= 0.126 USER MOD Single : A 70 SER OG : rot 180:sc= -1.84! USER MOD Single : A 71 SER OG : rot 70:sc= 1.03 USER MOD Single : A 74 THR OG1 : rot -86:sc= 0.393 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 146:sc= 1.25 (180deg=0.156) USER MOD Single : A 81 SER OG : rot 180:sc= 0.104 USER MOD Single : A 86 GLN : amide:sc= 0.155 X(o=0.15,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 HIS : no HD1:sc= -0.0927 X(o=-0.093,f=-0.29) USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -171:sc= -0.149 (180deg=-0.28) USER MOD Single : A 121 TYR OH : rot 109:sc= 0.124 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.765 30.358 -1.012 1.00 0.00 N ATOM 2 CA MET A 1 -13.150 29.969 -0.772 1.00 0.00 C ATOM 3 C MET A 1 -13.874 29.699 -2.087 1.00 0.00 C ATOM 4 O MET A 1 -14.874 30.345 -2.400 1.00 0.00 O ATOM 5 CB MET A 1 -13.881 31.061 0.011 1.00 0.00 C ATOM 6 CG MET A 1 -13.185 31.450 1.305 1.00 0.00 C ATOM 7 SD MET A 1 -14.078 32.722 2.219 1.00 0.00 S ATOM 8 CE MET A 1 -15.046 31.716 3.342 1.00 0.00 C ATOM 0 H1 MET A 1 -11.223 30.274 -0.129 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.350 29.735 -1.734 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.734 31.343 -1.345 1.00 0.00 H new ATOM 0 HA MET A 1 -13.147 29.051 -0.184 1.00 0.00 H new ATOM 0 HB2 MET A 1 -13.979 31.945 -0.619 1.00 0.00 H new ATOM 0 HB3 MET A 1 -14.890 30.719 0.240 1.00 0.00 H new ATOM 0 HG2 MET A 1 -13.075 30.566 1.934 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.180 31.808 1.079 1.00 0.00 H new ATOM 0 HE1 MET A 1 -15.654 32.361 3.976 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.696 31.054 2.769 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.378 31.120 3.964 1.00 0.00 H new ATOM 18 N ALA A 2 -13.362 28.742 -2.854 1.00 0.00 N ATOM 19 CA ALA A 2 -13.961 28.386 -4.134 1.00 0.00 C ATOM 20 C ALA A 2 -13.262 27.179 -4.751 1.00 0.00 C ATOM 21 O ALA A 2 -12.304 26.650 -4.188 1.00 0.00 O ATOM 22 CB ALA A 2 -13.911 29.571 -5.088 1.00 0.00 C ATOM 0 H ALA A 2 -12.533 28.199 -2.611 1.00 0.00 H new ATOM 0 HA ALA A 2 -15.003 28.119 -3.957 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.362 29.291 -6.040 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.462 30.408 -4.658 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -12.874 29.864 -5.250 1.00 0.00 H new ATOM 28 N TYR A 3 -13.749 26.748 -5.909 1.00 0.00 N ATOM 29 CA TYR A 3 -13.173 25.600 -6.601 1.00 0.00 C ATOM 30 C TYR A 3 -13.626 25.558 -8.057 1.00 0.00 C ATOM 31 O TYR A 3 -14.758 25.920 -8.377 1.00 0.00 O ATOM 32 CB TYR A 3 -13.567 24.302 -5.894 1.00 0.00 C ATOM 33 CG TYR A 3 -15.059 24.060 -5.862 1.00 0.00 C ATOM 34 CD1 TYR A 3 -15.850 24.609 -4.860 1.00 0.00 C ATOM 35 CD2 TYR A 3 -15.678 23.282 -6.832 1.00 0.00 C ATOM 36 CE1 TYR A 3 -17.214 24.389 -4.825 1.00 0.00 C ATOM 37 CE2 TYR A 3 -17.041 23.058 -6.807 1.00 0.00 C ATOM 38 CZ TYR A 3 -17.804 23.614 -5.801 1.00 0.00 C ATOM 39 OH TYR A 3 -19.162 23.393 -5.772 1.00 0.00 O ATOM 0 H TYR A 3 -14.541 27.176 -6.389 1.00 0.00 H new ATOM 0 HA TYR A 3 -12.088 25.702 -6.580 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -13.082 23.464 -6.394 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -13.189 24.325 -4.872 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -15.391 25.218 -4.095 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -15.083 22.844 -7.620 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -17.814 24.821 -4.038 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -17.506 22.452 -7.570 1.00 0.00 H new ATOM 0 HH TYR A 3 -19.418 22.828 -6.531 1.00 0.00 H new ATOM 49 N SER A 4 -12.732 25.113 -8.935 1.00 0.00 N ATOM 50 CA SER A 4 -13.037 25.025 -10.358 1.00 0.00 C ATOM 51 C SER A 4 -11.877 24.400 -11.125 1.00 0.00 C ATOM 52 O SER A 4 -12.081 23.599 -12.037 1.00 0.00 O ATOM 53 CB SER A 4 -13.346 26.414 -10.921 1.00 0.00 C ATOM 54 OG SER A 4 -14.729 26.557 -11.195 1.00 0.00 O ATOM 0 H SER A 4 -11.791 24.808 -8.686 1.00 0.00 H new ATOM 0 HA SER A 4 -13.913 24.388 -10.478 1.00 0.00 H new ATOM 0 HB2 SER A 4 -13.033 27.177 -10.208 1.00 0.00 H new ATOM 0 HB3 SER A 4 -12.773 26.576 -11.834 1.00 0.00 H new ATOM 0 HG SER A 4 -15.243 26.400 -10.375 1.00 0.00 H new ATOM 60 N GLU A 5 -10.657 24.771 -10.747 1.00 0.00 N ATOM 61 CA GLU A 5 -9.463 24.247 -11.400 1.00 0.00 C ATOM 62 C GLU A 5 -9.449 24.612 -12.882 1.00 0.00 C ATOM 63 O GLU A 5 -10.340 25.307 -13.371 1.00 0.00 O ATOM 64 CB GLU A 5 -9.391 22.728 -11.237 1.00 0.00 C ATOM 65 CG GLU A 5 -8.016 22.224 -10.831 1.00 0.00 C ATOM 66 CD GLU A 5 -7.998 20.732 -10.560 1.00 0.00 C ATOM 67 OE1 GLU A 5 -8.898 20.027 -11.064 1.00 0.00 O ATOM 68 OE2 GLU A 5 -7.086 20.269 -9.843 1.00 0.00 O ATOM 0 H GLU A 5 -10.470 25.432 -9.993 1.00 0.00 H new ATOM 0 HA GLU A 5 -8.592 24.698 -10.924 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -10.119 22.417 -10.488 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -9.679 22.256 -12.176 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -7.301 22.455 -11.621 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.687 22.756 -9.938 1.00 0.00 H new ATOM 75 N LYS A 6 -8.431 24.138 -13.592 1.00 0.00 N ATOM 76 CA LYS A 6 -8.298 24.411 -15.018 1.00 0.00 C ATOM 77 C LYS A 6 -7.393 23.383 -15.688 1.00 0.00 C ATOM 78 O LYS A 6 -6.855 22.492 -15.029 1.00 0.00 O ATOM 79 CB LYS A 6 -7.739 25.819 -15.238 1.00 0.00 C ATOM 80 CG LYS A 6 -6.364 26.030 -14.628 1.00 0.00 C ATOM 81 CD LYS A 6 -6.455 26.690 -13.262 1.00 0.00 C ATOM 82 CE LYS A 6 -5.090 27.148 -12.773 1.00 0.00 C ATOM 83 NZ LYS A 6 -5.187 28.364 -11.919 1.00 0.00 N ATOM 0 H LYS A 6 -7.685 23.562 -13.202 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.288 24.344 -15.469 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -7.686 26.017 -16.309 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -8.431 26.546 -14.813 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -5.855 25.071 -14.536 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -5.761 26.649 -15.293 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -7.130 27.544 -13.314 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -6.883 25.989 -12.546 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -4.618 26.344 -12.208 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -4.448 27.356 -13.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -4.236 28.645 -11.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -5.614 29.139 -12.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -5.779 28.159 -11.089 1.00 0.00 H new ATOM 97 N VAL A 7 -7.227 23.512 -17.000 1.00 0.00 N ATOM 98 CA VAL A 7 -6.384 22.596 -17.758 1.00 0.00 C ATOM 99 C VAL A 7 -6.819 21.149 -17.549 1.00 0.00 C ATOM 100 O VAL A 7 -6.164 20.392 -16.832 1.00 0.00 O ATOM 101 CB VAL A 7 -4.902 22.738 -17.362 1.00 0.00 C ATOM 102 CG1 VAL A 7 -4.025 21.882 -18.263 1.00 0.00 C ATOM 103 CG2 VAL A 7 -4.474 24.196 -17.417 1.00 0.00 C ATOM 0 H VAL A 7 -7.666 24.243 -17.560 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.497 22.858 -18.810 1.00 0.00 H new ATOM 0 HB VAL A 7 -4.782 22.386 -16.337 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.982 21.995 -17.969 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -4.318 20.836 -18.169 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.146 22.201 -19.298 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.424 24.278 -17.134 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -4.608 24.577 -18.430 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.082 24.780 -16.727 1.00 0.00 H new ATOM 113 N ILE A 8 -7.926 20.773 -18.180 1.00 0.00 N ATOM 114 CA ILE A 8 -8.447 19.416 -18.065 1.00 0.00 C ATOM 115 C ILE A 8 -7.653 18.447 -18.934 1.00 0.00 C ATOM 116 O ILE A 8 -7.594 17.250 -18.653 1.00 0.00 O ATOM 117 CB ILE A 8 -9.933 19.348 -18.463 1.00 0.00 C ATOM 118 CG1 ILE A 8 -10.503 17.963 -18.154 1.00 0.00 C ATOM 119 CG2 ILE A 8 -10.101 19.678 -19.939 1.00 0.00 C ATOM 120 CD1 ILE A 8 -11.884 18.002 -17.538 1.00 0.00 C ATOM 0 H ILE A 8 -8.480 21.388 -18.776 1.00 0.00 H new ATOM 0 HA ILE A 8 -8.347 19.127 -17.019 1.00 0.00 H new ATOM 0 HB ILE A 8 -10.484 20.086 -17.880 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -10.541 17.381 -19.075 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -9.826 17.443 -17.476 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.157 19.626 -20.206 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -9.727 20.684 -20.132 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.540 18.961 -20.538 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.225 16.985 -17.346 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -11.849 18.556 -16.600 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -12.575 18.493 -18.224 1.00 0.00 H new ATOM 132 N ASP A 9 -7.044 18.972 -19.991 1.00 0.00 N ATOM 133 CA ASP A 9 -6.251 18.154 -20.901 1.00 0.00 C ATOM 134 C ASP A 9 -5.123 17.448 -20.155 1.00 0.00 C ATOM 135 O ASP A 9 -4.759 17.838 -19.045 1.00 0.00 O ATOM 136 CB ASP A 9 -5.674 19.016 -22.026 1.00 0.00 C ATOM 137 CG ASP A 9 -4.473 19.826 -21.577 1.00 0.00 C ATOM 138 OD1 ASP A 9 -3.372 19.246 -21.474 1.00 0.00 O ATOM 139 OD2 ASP A 9 -4.635 21.039 -21.327 1.00 0.00 O ATOM 0 H ASP A 9 -7.084 19.961 -20.239 1.00 0.00 H new ATOM 0 HA ASP A 9 -6.906 17.397 -21.333 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.385 18.375 -22.859 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -6.446 19.691 -22.395 1.00 0.00 H new ATOM 144 N HIS A 10 -4.573 16.407 -20.772 1.00 0.00 N ATOM 145 CA HIS A 10 -3.486 15.646 -20.165 1.00 0.00 C ATOM 146 C HIS A 10 -2.169 15.909 -20.890 1.00 0.00 C ATOM 147 O HIS A 10 -2.126 16.652 -21.870 1.00 0.00 O ATOM 148 CB HIS A 10 -3.806 14.151 -20.190 1.00 0.00 C ATOM 149 CG HIS A 10 -4.932 13.765 -19.281 1.00 0.00 C ATOM 150 ND1 HIS A 10 -4.950 12.587 -18.565 1.00 0.00 N ATOM 151 CD2 HIS A 10 -6.082 14.409 -18.973 1.00 0.00 C ATOM 152 CE1 HIS A 10 -6.063 12.522 -17.856 1.00 0.00 C ATOM 153 NE2 HIS A 10 -6.767 13.616 -18.086 1.00 0.00 N ATOM 0 H HIS A 10 -4.862 16.071 -21.691 1.00 0.00 H new ATOM 0 HA HIS A 10 -3.382 15.970 -19.129 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -4.056 13.858 -21.210 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -2.914 13.592 -19.908 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -6.401 15.368 -19.354 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -6.349 11.713 -17.200 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -7.673 13.836 -17.672 1.00 0.00 H new ATOM 161 N TYR A 11 -1.098 15.295 -20.400 1.00 0.00 N ATOM 162 CA TYR A 11 0.221 15.465 -20.998 1.00 0.00 C ATOM 163 C TYR A 11 1.134 14.295 -20.645 1.00 0.00 C ATOM 164 O TYR A 11 1.239 13.904 -19.483 1.00 0.00 O ATOM 165 CB TYR A 11 0.851 16.778 -20.530 1.00 0.00 C ATOM 166 CG TYR A 11 2.001 17.240 -21.397 1.00 0.00 C ATOM 167 CD1 TYR A 11 3.177 16.505 -21.476 1.00 0.00 C ATOM 168 CD2 TYR A 11 1.910 18.413 -22.137 1.00 0.00 C ATOM 169 CE1 TYR A 11 4.230 16.924 -22.265 1.00 0.00 C ATOM 170 CE2 TYR A 11 2.958 18.839 -22.931 1.00 0.00 C ATOM 171 CZ TYR A 11 4.116 18.092 -22.991 1.00 0.00 C ATOM 172 OH TYR A 11 5.162 18.512 -23.780 1.00 0.00 O ATOM 0 H TYR A 11 -1.117 14.675 -19.590 1.00 0.00 H new ATOM 0 HA TYR A 11 0.100 15.494 -22.081 1.00 0.00 H new ATOM 0 HB2 TYR A 11 0.085 17.553 -20.513 1.00 0.00 H new ATOM 0 HB3 TYR A 11 1.204 16.657 -19.506 1.00 0.00 H new ATOM 0 HD1 TYR A 11 3.269 15.590 -20.910 1.00 0.00 H new ATOM 0 HD2 TYR A 11 1.005 19.001 -22.091 1.00 0.00 H new ATOM 0 HE1 TYR A 11 5.138 16.341 -22.314 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.871 19.752 -23.501 1.00 0.00 H new ATOM 0 HH TYR A 11 4.920 19.351 -24.225 1.00 0.00 H new ATOM 182 N GLU A 12 1.794 13.741 -21.658 1.00 0.00 N ATOM 183 CA GLU A 12 2.699 12.616 -21.455 1.00 0.00 C ATOM 184 C GLU A 12 3.881 12.688 -22.417 1.00 0.00 C ATOM 185 O GLU A 12 3.903 13.513 -23.330 1.00 0.00 O ATOM 186 CB GLU A 12 1.954 11.293 -21.644 1.00 0.00 C ATOM 187 CG GLU A 12 1.317 10.766 -20.370 1.00 0.00 C ATOM 188 CD GLU A 12 1.736 9.343 -20.054 1.00 0.00 C ATOM 189 OE1 GLU A 12 1.152 8.408 -20.639 1.00 0.00 O ATOM 190 OE2 GLU A 12 2.649 9.166 -19.220 1.00 0.00 O ATOM 0 H GLU A 12 1.719 14.053 -22.626 1.00 0.00 H new ATOM 0 HA GLU A 12 3.079 12.668 -20.435 1.00 0.00 H new ATOM 0 HB2 GLU A 12 1.179 11.427 -22.399 1.00 0.00 H new ATOM 0 HB3 GLU A 12 2.649 10.546 -22.029 1.00 0.00 H new ATOM 0 HG2 GLU A 12 1.589 11.414 -19.537 1.00 0.00 H new ATOM 0 HG3 GLU A 12 0.232 10.809 -20.466 1.00 0.00 H new ATOM 197 N ASN A 13 4.864 11.819 -22.204 1.00 0.00 N ATOM 198 CA ASN A 13 6.050 11.784 -23.051 1.00 0.00 C ATOM 199 C ASN A 13 6.690 13.166 -23.148 1.00 0.00 C ATOM 200 O ASN A 13 6.684 13.808 -24.199 1.00 0.00 O ATOM 201 CB ASN A 13 5.690 11.277 -24.449 1.00 0.00 C ATOM 202 CG ASN A 13 6.915 10.902 -25.261 1.00 0.00 C ATOM 203 OD1 ASN A 13 8.048 11.132 -24.838 1.00 0.00 O ATOM 204 ND2 ASN A 13 6.692 10.323 -26.435 1.00 0.00 N ATOM 0 H ASN A 13 4.862 11.130 -21.452 1.00 0.00 H new ATOM 0 HA ASN A 13 6.769 11.101 -22.599 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.036 10.409 -24.361 1.00 0.00 H new ATOM 0 HB3 ASN A 13 5.128 12.047 -24.978 1.00 0.00 H new ATOM 0 HD21 ASN A 13 7.477 10.050 -27.026 1.00 0.00 H new ATOM 0 HD22 ASN A 13 5.736 10.152 -26.746 1.00 0.00 H new ATOM 211 N PRO A 14 7.257 13.636 -22.027 1.00 0.00 N ATOM 212 CA PRO A 14 7.912 14.945 -21.960 1.00 0.00 C ATOM 213 C PRO A 14 9.215 14.982 -22.751 1.00 0.00 C ATOM 214 O PRO A 14 10.093 14.141 -22.558 1.00 0.00 O ATOM 215 CB PRO A 14 8.188 15.127 -20.465 1.00 0.00 C ATOM 216 CG PRO A 14 8.264 13.742 -19.922 1.00 0.00 C ATOM 217 CD PRO A 14 7.301 12.924 -20.738 1.00 0.00 C ATOM 0 HA PRO A 14 7.295 15.733 -22.392 1.00 0.00 H new ATOM 0 HB2 PRO A 14 9.119 15.669 -20.297 1.00 0.00 H new ATOM 0 HB3 PRO A 14 7.395 15.698 -19.983 1.00 0.00 H new ATOM 0 HG2 PRO A 14 9.277 13.347 -20.001 1.00 0.00 H new ATOM 0 HG3 PRO A 14 7.996 13.722 -18.866 1.00 0.00 H new ATOM 0 HD2 PRO A 14 7.647 11.897 -20.858 1.00 0.00 H new ATOM 0 HD3 PRO A 14 6.317 12.877 -20.271 1.00 0.00 H new ATOM 225 N ARG A 15 9.335 15.962 -23.640 1.00 0.00 N ATOM 226 CA ARG A 15 10.531 16.107 -24.461 1.00 0.00 C ATOM 227 C ARG A 15 11.574 16.968 -23.754 1.00 0.00 C ATOM 228 O ARG A 15 12.772 16.837 -24.000 1.00 0.00 O ATOM 229 CB ARG A 15 10.175 16.727 -25.814 1.00 0.00 C ATOM 230 CG ARG A 15 11.310 16.677 -26.824 1.00 0.00 C ATOM 231 CD ARG A 15 10.808 16.924 -28.238 1.00 0.00 C ATOM 232 NE ARG A 15 11.648 16.271 -29.238 1.00 0.00 N ATOM 233 CZ ARG A 15 12.817 16.754 -29.644 1.00 0.00 C ATOM 234 NH1 ARG A 15 13.282 17.887 -29.137 1.00 0.00 N ATOM 235 NH2 ARG A 15 13.524 16.102 -30.559 1.00 0.00 N ATOM 0 H ARG A 15 8.618 16.668 -23.810 1.00 0.00 H new ATOM 0 HA ARG A 15 10.952 15.115 -24.623 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.310 16.207 -26.226 1.00 0.00 H new ATOM 0 HB3 ARG A 15 9.880 17.765 -25.662 1.00 0.00 H new ATOM 0 HG2 ARG A 15 12.060 17.425 -26.567 1.00 0.00 H new ATOM 0 HG3 ARG A 15 11.800 15.704 -26.775 1.00 0.00 H new ATOM 0 HD2 ARG A 15 9.785 16.558 -28.329 1.00 0.00 H new ATOM 0 HD3 ARG A 15 10.781 17.996 -28.431 1.00 0.00 H new ATOM 0 HE ARG A 15 11.319 15.396 -29.647 1.00 0.00 H new ATOM 0 HH11 ARG A 15 12.742 18.390 -28.433 1.00 0.00 H new ATOM 0 HH12 ARG A 15 14.180 18.255 -29.451 1.00 0.00 H new ATOM 0 HH21 ARG A 15 13.170 15.229 -30.951 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.421 16.474 -30.870 1.00 0.00 H new ATOM 249 N ASN A 16 11.109 17.849 -22.874 1.00 0.00 N ATOM 250 CA ASN A 16 12.001 18.732 -22.131 1.00 0.00 C ATOM 251 C ASN A 16 12.711 17.973 -21.014 1.00 0.00 C ATOM 252 O ASN A 16 13.807 18.346 -20.595 1.00 0.00 O ATOM 253 CB ASN A 16 11.217 19.908 -21.546 1.00 0.00 C ATOM 254 CG ASN A 16 10.474 20.694 -22.609 1.00 0.00 C ATOM 255 OD1 ASN A 16 9.245 20.762 -22.601 1.00 0.00 O ATOM 256 ND2 ASN A 16 11.219 21.292 -23.532 1.00 0.00 N ATOM 0 H ASN A 16 10.120 17.970 -22.658 1.00 0.00 H new ATOM 0 HA ASN A 16 12.753 19.113 -22.822 1.00 0.00 H new ATOM 0 HB2 ASN A 16 10.505 19.536 -20.809 1.00 0.00 H new ATOM 0 HB3 ASN A 16 11.903 20.572 -21.020 1.00 0.00 H new ATOM 0 HD21 ASN A 16 10.775 21.834 -24.273 1.00 0.00 H new ATOM 0 HD22 ASN A 16 12.235 21.209 -23.500 1.00 0.00 H new ATOM 263 N VAL A 17 12.079 16.906 -20.536 1.00 0.00 N ATOM 264 CA VAL A 17 12.650 16.094 -19.468 1.00 0.00 C ATOM 265 C VAL A 17 12.744 16.882 -18.167 1.00 0.00 C ATOM 266 O VAL A 17 11.918 16.719 -17.270 1.00 0.00 O ATOM 267 CB VAL A 17 14.052 15.578 -19.845 1.00 0.00 C ATOM 268 CG1 VAL A 17 14.675 14.825 -18.679 1.00 0.00 C ATOM 269 CG2 VAL A 17 13.980 14.696 -21.082 1.00 0.00 C ATOM 0 H VAL A 17 11.171 16.584 -20.871 1.00 0.00 H new ATOM 0 HA VAL A 17 11.983 15.244 -19.326 1.00 0.00 H new ATOM 0 HB VAL A 17 14.686 16.435 -20.074 1.00 0.00 H new ATOM 0 HG11 VAL A 17 15.665 14.468 -18.964 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.763 15.491 -17.821 1.00 0.00 H new ATOM 0 HG13 VAL A 17 14.045 13.976 -18.416 1.00 0.00 H new ATOM 0 HG21 VAL A 17 14.979 14.340 -21.334 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.331 13.843 -20.884 1.00 0.00 H new ATOM 0 HG23 VAL A 17 13.579 15.271 -21.916 1.00 0.00 H new ATOM 279 N GLY A 18 13.756 17.739 -18.072 1.00 0.00 N ATOM 280 CA GLY A 18 13.938 18.541 -16.876 1.00 0.00 C ATOM 281 C GLY A 18 14.703 17.804 -15.794 1.00 0.00 C ATOM 282 O GLY A 18 14.286 17.781 -14.636 1.00 0.00 O ATOM 0 H GLY A 18 14.453 17.892 -18.801 1.00 0.00 H new ATOM 0 HA2 GLY A 18 14.471 19.456 -17.134 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.963 18.838 -16.489 1.00 0.00 H new ATOM 286 N SER A 19 15.824 17.198 -16.172 1.00 0.00 N ATOM 287 CA SER A 19 16.645 16.451 -15.227 1.00 0.00 C ATOM 288 C SER A 19 18.086 16.953 -15.244 1.00 0.00 C ATOM 289 O SER A 19 18.440 17.830 -16.032 1.00 0.00 O ATOM 290 CB SER A 19 16.609 14.958 -15.556 1.00 0.00 C ATOM 291 OG SER A 19 17.187 14.701 -16.824 1.00 0.00 O ATOM 0 H SER A 19 16.184 17.210 -17.126 1.00 0.00 H new ATOM 0 HA SER A 19 16.237 16.605 -14.228 1.00 0.00 H new ATOM 0 HB2 SER A 19 17.146 14.400 -14.788 1.00 0.00 H new ATOM 0 HB3 SER A 19 15.578 14.605 -15.545 1.00 0.00 H new ATOM 0 HG SER A 19 17.153 13.739 -17.010 1.00 0.00 H new ATOM 297 N PHE A 20 18.912 16.390 -14.369 1.00 0.00 N ATOM 298 CA PHE A 20 20.315 16.780 -14.282 1.00 0.00 C ATOM 299 C PHE A 20 21.228 15.604 -14.617 1.00 0.00 C ATOM 300 O PHE A 20 22.344 15.790 -15.103 1.00 0.00 O ATOM 301 CB PHE A 20 20.634 17.305 -12.881 1.00 0.00 C ATOM 302 CG PHE A 20 20.300 16.333 -11.785 1.00 0.00 C ATOM 303 CD1 PHE A 20 19.003 16.225 -11.309 1.00 0.00 C ATOM 304 CD2 PHE A 20 21.282 15.527 -11.233 1.00 0.00 C ATOM 305 CE1 PHE A 20 18.693 15.332 -10.301 1.00 0.00 C ATOM 306 CE2 PHE A 20 20.977 14.632 -10.224 1.00 0.00 C ATOM 307 CZ PHE A 20 19.681 14.534 -9.759 1.00 0.00 C ATOM 0 H PHE A 20 18.635 15.662 -13.710 1.00 0.00 H new ATOM 0 HA PHE A 20 20.492 17.573 -15.009 1.00 0.00 H new ATOM 0 HB2 PHE A 20 21.695 17.551 -12.827 1.00 0.00 H new ATOM 0 HB3 PHE A 20 20.083 18.231 -12.715 1.00 0.00 H new ATOM 0 HD1 PHE A 20 18.226 16.846 -11.730 1.00 0.00 H new ATOM 0 HD2 PHE A 20 22.297 15.598 -11.595 1.00 0.00 H new ATOM 0 HE1 PHE A 20 17.679 15.258 -9.937 1.00 0.00 H new ATOM 0 HE2 PHE A 20 21.752 14.010 -9.800 1.00 0.00 H new ATOM 0 HZ PHE A 20 19.440 13.834 -8.972 1.00 0.00 H new ATOM 317 N ASP A 21 20.746 14.395 -14.353 1.00 0.00 N ATOM 318 CA ASP A 21 21.517 13.188 -14.626 1.00 0.00 C ATOM 319 C ASP A 21 22.707 13.077 -13.678 1.00 0.00 C ATOM 320 O ASP A 21 22.691 12.286 -12.736 1.00 0.00 O ATOM 321 CB ASP A 21 22.003 13.185 -16.077 1.00 0.00 C ATOM 322 CG ASP A 21 21.386 12.066 -16.892 1.00 0.00 C ATOM 323 OD1 ASP A 21 20.156 12.096 -17.104 1.00 0.00 O ATOM 324 OD2 ASP A 21 22.132 11.159 -17.316 1.00 0.00 O ATOM 0 H ASP A 21 19.825 14.225 -13.950 1.00 0.00 H new ATOM 0 HA ASP A 21 20.867 12.328 -14.467 1.00 0.00 H new ATOM 0 HB2 ASP A 21 21.763 14.142 -16.539 1.00 0.00 H new ATOM 0 HB3 ASP A 21 23.088 13.087 -16.093 1.00 0.00 H new ATOM 329 N ASN A 22 23.739 13.875 -13.935 1.00 0.00 N ATOM 330 CA ASN A 22 24.938 13.865 -13.106 1.00 0.00 C ATOM 331 C ASN A 22 24.935 15.039 -12.131 1.00 0.00 C ATOM 332 O ASN A 22 24.865 16.198 -12.540 1.00 0.00 O ATOM 333 CB ASN A 22 26.190 13.919 -13.982 1.00 0.00 C ATOM 334 CG ASN A 22 27.238 12.909 -13.557 1.00 0.00 C ATOM 335 OD1 ASN A 22 27.115 11.716 -13.833 1.00 0.00 O ATOM 336 ND2 ASN A 22 28.277 13.384 -12.879 1.00 0.00 N ATOM 0 H ASN A 22 23.768 14.536 -14.711 1.00 0.00 H new ATOM 0 HA ASN A 22 24.944 12.938 -12.532 1.00 0.00 H new ATOM 0 HB2 ASN A 22 25.912 13.735 -15.020 1.00 0.00 H new ATOM 0 HB3 ASN A 22 26.617 14.921 -13.939 1.00 0.00 H new ATOM 0 HD21 ASN A 22 29.013 12.752 -12.565 1.00 0.00 H new ATOM 0 HD22 ASN A 22 28.338 14.381 -12.672 1.00 0.00 H new ATOM 343 N ASN A 23 25.012 14.731 -10.841 1.00 0.00 N ATOM 344 CA ASN A 23 25.018 15.760 -9.808 1.00 0.00 C ATOM 345 C ASN A 23 26.083 16.814 -10.096 1.00 0.00 C ATOM 346 O ASN A 23 27.025 16.569 -10.850 1.00 0.00 O ATOM 347 CB ASN A 23 25.265 15.132 -8.434 1.00 0.00 C ATOM 348 CG ASN A 23 26.734 14.845 -8.186 1.00 0.00 C ATOM 349 OD1 ASN A 23 27.422 15.613 -7.513 1.00 0.00 O ATOM 350 ND2 ASN A 23 27.220 13.735 -8.729 1.00 0.00 N ATOM 0 H ASN A 23 25.071 13.777 -10.486 1.00 0.00 H new ATOM 0 HA ASN A 23 24.042 16.245 -9.808 1.00 0.00 H new ATOM 0 HB2 ASN A 23 24.892 15.802 -7.659 1.00 0.00 H new ATOM 0 HB3 ASN A 23 24.698 14.205 -8.354 1.00 0.00 H new ATOM 0 HD21 ASN A 23 28.201 13.489 -8.596 1.00 0.00 H new ATOM 0 HD22 ASN A 23 26.612 13.128 -9.279 1.00 0.00 H new ATOM 357 N ASP A 24 25.927 17.986 -9.491 1.00 0.00 N ATOM 358 CA ASP A 24 26.875 19.077 -9.681 1.00 0.00 C ATOM 359 C ASP A 24 27.568 19.430 -8.368 1.00 0.00 C ATOM 360 O ASP A 24 28.073 20.539 -8.201 1.00 0.00 O ATOM 361 CB ASP A 24 26.163 20.308 -10.242 1.00 0.00 C ATOM 362 CG ASP A 24 27.132 21.380 -10.699 1.00 0.00 C ATOM 363 OD1 ASP A 24 28.180 21.025 -11.279 1.00 0.00 O ATOM 364 OD2 ASP A 24 26.843 22.575 -10.478 1.00 0.00 O ATOM 0 H ASP A 24 25.152 18.205 -8.864 1.00 0.00 H new ATOM 0 HA ASP A 24 27.631 18.748 -10.394 1.00 0.00 H new ATOM 0 HB2 ASP A 24 25.534 20.009 -11.081 1.00 0.00 H new ATOM 0 HB3 ASP A 24 25.502 20.721 -9.480 1.00 0.00 H new ATOM 369 N GLU A 25 27.587 18.478 -7.441 1.00 0.00 N ATOM 370 CA GLU A 25 28.217 18.689 -6.143 1.00 0.00 C ATOM 371 C GLU A 25 27.505 19.794 -5.366 1.00 0.00 C ATOM 372 O GLU A 25 28.041 20.330 -4.398 1.00 0.00 O ATOM 373 CB GLU A 25 29.694 19.046 -6.320 1.00 0.00 C ATOM 374 CG GLU A 25 30.419 18.160 -7.319 1.00 0.00 C ATOM 375 CD GLU A 25 31.690 17.560 -6.751 1.00 0.00 C ATOM 376 OE1 GLU A 25 31.594 16.556 -6.014 1.00 0.00 O ATOM 377 OE2 GLU A 25 32.781 18.093 -7.044 1.00 0.00 O ATOM 0 H GLU A 25 27.174 17.554 -7.564 1.00 0.00 H new ATOM 0 HA GLU A 25 28.140 17.762 -5.576 1.00 0.00 H new ATOM 0 HB2 GLU A 25 29.772 20.084 -6.644 1.00 0.00 H new ATOM 0 HB3 GLU A 25 30.194 18.975 -5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 25 29.753 17.358 -7.637 1.00 0.00 H new ATOM 0 HG3 GLU A 25 30.662 18.743 -8.207 1.00 0.00 H new ATOM 384 N ASN A 26 26.294 20.128 -5.800 1.00 0.00 N ATOM 385 CA ASN A 26 25.509 21.169 -5.148 1.00 0.00 C ATOM 386 C ASN A 26 24.058 21.131 -5.618 1.00 0.00 C ATOM 387 O ASN A 26 23.370 22.152 -5.628 1.00 0.00 O ATOM 388 CB ASN A 26 26.113 22.545 -5.430 1.00 0.00 C ATOM 389 CG ASN A 26 26.702 22.643 -6.824 1.00 0.00 C ATOM 390 OD1 ASN A 26 27.907 22.832 -6.989 1.00 0.00 O ATOM 391 ND2 ASN A 26 25.851 22.515 -7.836 1.00 0.00 N ATOM 0 H ASN A 26 25.835 19.693 -6.600 1.00 0.00 H new ATOM 0 HA ASN A 26 25.529 20.985 -4.074 1.00 0.00 H new ATOM 0 HB2 ASN A 26 25.344 23.308 -5.309 1.00 0.00 H new ATOM 0 HB3 ASN A 26 26.890 22.756 -4.695 1.00 0.00 H new ATOM 0 HD21 ASN A 26 26.189 22.572 -8.797 1.00 0.00 H new ATOM 0 HD22 ASN A 26 24.860 22.359 -7.652 1.00 0.00 H new ATOM 398 N VAL A 27 23.598 19.946 -6.008 1.00 0.00 N ATOM 399 CA VAL A 27 22.229 19.774 -6.478 1.00 0.00 C ATOM 400 C VAL A 27 21.351 19.150 -5.399 1.00 0.00 C ATOM 401 O VAL A 27 21.730 18.163 -4.770 1.00 0.00 O ATOM 402 CB VAL A 27 22.175 18.894 -7.740 1.00 0.00 C ATOM 403 CG1 VAL A 27 22.871 17.563 -7.494 1.00 0.00 C ATOM 404 CG2 VAL A 27 20.735 18.678 -8.178 1.00 0.00 C ATOM 0 H VAL A 27 24.154 19.091 -6.008 1.00 0.00 H new ATOM 0 HA VAL A 27 21.851 20.767 -6.720 1.00 0.00 H new ATOM 0 HB VAL A 27 22.702 19.409 -8.543 1.00 0.00 H new ATOM 0 HG11 VAL A 27 22.823 16.955 -8.397 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.914 17.741 -7.232 1.00 0.00 H new ATOM 0 HG13 VAL A 27 22.376 17.039 -6.677 1.00 0.00 H new ATOM 0 HG21 VAL A 27 20.716 18.054 -9.071 1.00 0.00 H new ATOM 0 HG22 VAL A 27 20.182 18.185 -7.379 1.00 0.00 H new ATOM 0 HG23 VAL A 27 20.273 19.641 -8.398 1.00 0.00 H new ATOM 414 N GLY A 28 20.175 19.734 -5.190 1.00 0.00 N ATOM 415 CA GLY A 28 19.261 19.221 -4.186 1.00 0.00 C ATOM 416 C GLY A 28 18.080 18.492 -4.795 1.00 0.00 C ATOM 417 O GLY A 28 17.402 19.021 -5.677 1.00 0.00 O ATOM 0 H GLY A 28 19.839 20.553 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 28 19.799 18.544 -3.522 1.00 0.00 H new ATOM 0 HA3 GLY A 28 18.898 20.047 -3.574 1.00 0.00 H new ATOM 421 N SER A 29 17.833 17.272 -4.327 1.00 0.00 N ATOM 422 CA SER A 29 16.729 16.467 -4.835 1.00 0.00 C ATOM 423 C SER A 29 15.580 16.425 -3.833 1.00 0.00 C ATOM 424 O SER A 29 15.730 15.922 -2.720 1.00 0.00 O ATOM 425 CB SER A 29 17.206 15.046 -5.141 1.00 0.00 C ATOM 426 OG SER A 29 17.403 14.306 -3.949 1.00 0.00 O ATOM 0 H SER A 29 18.383 16.820 -3.597 1.00 0.00 H new ATOM 0 HA SER A 29 16.369 16.928 -5.754 1.00 0.00 H new ATOM 0 HB2 SER A 29 16.473 14.540 -5.769 1.00 0.00 H new ATOM 0 HB3 SER A 29 18.137 15.086 -5.706 1.00 0.00 H new ATOM 0 HG SER A 29 16.928 14.742 -3.211 1.00 0.00 H new ATOM 432 N GLY A 30 14.431 16.958 -4.237 1.00 0.00 N ATOM 433 CA GLY A 30 13.272 16.973 -3.363 1.00 0.00 C ATOM 434 C GLY A 30 12.080 16.259 -3.969 1.00 0.00 C ATOM 435 O GLY A 30 11.500 16.728 -4.948 1.00 0.00 O ATOM 0 H GLY A 30 14.282 17.380 -5.154 1.00 0.00 H new ATOM 0 HA2 GLY A 30 13.530 16.502 -2.414 1.00 0.00 H new ATOM 0 HA3 GLY A 30 13.000 18.005 -3.143 1.00 0.00 H new ATOM 439 N MET A 31 11.715 15.122 -3.388 1.00 0.00 N ATOM 440 CA MET A 31 10.584 14.342 -3.878 1.00 0.00 C ATOM 441 C MET A 31 9.711 13.864 -2.721 1.00 0.00 C ATOM 442 O MET A 31 10.206 13.597 -1.626 1.00 0.00 O ATOM 443 CB MET A 31 11.077 13.143 -4.690 1.00 0.00 C ATOM 444 CG MET A 31 11.366 11.913 -3.844 1.00 0.00 C ATOM 445 SD MET A 31 12.194 10.610 -4.774 1.00 0.00 S ATOM 446 CE MET A 31 10.807 9.554 -5.187 1.00 0.00 C ATOM 0 H MET A 31 12.185 14.720 -2.577 1.00 0.00 H new ATOM 0 HA MET A 31 9.983 14.985 -4.522 1.00 0.00 H new ATOM 0 HB2 MET A 31 10.328 12.890 -5.440 1.00 0.00 H new ATOM 0 HB3 MET A 31 11.983 13.426 -5.227 1.00 0.00 H new ATOM 0 HG2 MET A 31 11.987 12.199 -2.995 1.00 0.00 H new ATOM 0 HG3 MET A 31 10.430 11.527 -3.439 1.00 0.00 H new ATOM 0 HE1 MET A 31 11.160 8.700 -5.765 1.00 0.00 H new ATOM 0 HE2 MET A 31 10.333 9.201 -4.271 1.00 0.00 H new ATOM 0 HE3 MET A 31 10.084 10.117 -5.776 1.00 0.00 H new ATOM 456 N VAL A 32 8.410 13.757 -2.972 1.00 0.00 N ATOM 457 CA VAL A 32 7.469 13.309 -1.952 1.00 0.00 C ATOM 458 C VAL A 32 6.348 12.479 -2.566 1.00 0.00 C ATOM 459 O VAL A 32 5.992 12.660 -3.730 1.00 0.00 O ATOM 460 CB VAL A 32 6.856 14.501 -1.194 1.00 0.00 C ATOM 461 CG1 VAL A 32 7.937 15.287 -0.469 1.00 0.00 C ATOM 462 CG2 VAL A 32 6.082 15.398 -2.148 1.00 0.00 C ATOM 0 H VAL A 32 7.984 13.974 -3.873 1.00 0.00 H new ATOM 0 HA VAL A 32 8.031 12.692 -1.251 1.00 0.00 H new ATOM 0 HB VAL A 32 6.160 14.115 -0.449 1.00 0.00 H new ATOM 0 HG11 VAL A 32 7.484 16.125 0.061 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.442 14.637 0.245 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.660 15.663 -1.192 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.656 16.235 -1.595 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.754 15.776 -2.918 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.280 14.826 -2.616 1.00 0.00 H new ATOM 472 N GLY A 33 5.792 11.567 -1.773 1.00 0.00 N ATOM 473 CA GLY A 33 4.715 10.723 -2.256 1.00 0.00 C ATOM 474 C GLY A 33 3.777 10.289 -1.147 1.00 0.00 C ATOM 475 O GLY A 33 3.958 10.666 0.011 1.00 0.00 O ATOM 0 H GLY A 33 6.068 11.398 -0.806 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.149 11.261 -3.017 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.137 9.841 -2.737 1.00 0.00 H new ATOM 479 N ALA A 34 2.771 9.496 -1.501 1.00 0.00 N ATOM 480 CA ALA A 34 1.801 9.011 -0.527 1.00 0.00 C ATOM 481 C ALA A 34 1.164 7.706 -0.990 1.00 0.00 C ATOM 482 O ALA A 34 0.901 7.501 -2.176 1.00 0.00 O ATOM 483 CB ALA A 34 0.731 10.064 -0.278 1.00 0.00 C ATOM 0 H ALA A 34 2.607 9.176 -2.455 1.00 0.00 H new ATOM 0 HA ALA A 34 2.328 8.816 0.407 1.00 0.00 H new ATOM 0 HB1 ALA A 34 0.013 9.688 0.451 1.00 0.00 H new ATOM 0 HB2 ALA A 34 1.196 10.972 0.105 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.216 10.287 -1.212 1.00 0.00 H new ATOM 489 N PRO A 35 0.909 6.799 -0.035 1.00 0.00 N ATOM 490 CA PRO A 35 0.299 5.497 -0.322 1.00 0.00 C ATOM 491 C PRO A 35 -1.164 5.620 -0.733 1.00 0.00 C ATOM 492 O PRO A 35 -1.585 5.056 -1.743 1.00 0.00 O ATOM 493 CB PRO A 35 0.419 4.748 1.007 1.00 0.00 C ATOM 494 CG PRO A 35 0.480 5.819 2.041 1.00 0.00 C ATOM 495 CD PRO A 35 1.195 6.975 1.398 1.00 0.00 C ATOM 0 HA PRO A 35 0.787 4.994 -1.156 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -0.434 4.090 1.169 1.00 0.00 H new ATOM 0 HB3 PRO A 35 1.312 4.124 1.030 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -0.520 6.109 2.362 1.00 0.00 H new ATOM 0 HG3 PRO A 35 1.012 5.475 2.928 1.00 0.00 H new ATOM 0 HD2 PRO A 35 0.825 7.932 1.767 1.00 0.00 H new ATOM 0 HD3 PRO A 35 2.266 6.948 1.600 1.00 0.00 H new ATOM 503 N ALA A 36 -1.935 6.362 0.056 1.00 0.00 N ATOM 504 CA ALA A 36 -3.351 6.561 -0.228 1.00 0.00 C ATOM 505 C ALA A 36 -3.548 7.563 -1.361 1.00 0.00 C ATOM 506 O ALA A 36 -4.528 7.490 -2.103 1.00 0.00 O ATOM 507 CB ALA A 36 -4.080 7.026 1.024 1.00 0.00 C ATOM 0 H ALA A 36 -1.603 6.835 0.896 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.771 5.606 -0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.136 7.171 0.797 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.976 6.274 1.806 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.650 7.967 1.367 1.00 0.00 H new ATOM 513 N CYS A 37 -2.613 8.498 -1.487 1.00 0.00 N ATOM 514 CA CYS A 37 -2.685 9.516 -2.528 1.00 0.00 C ATOM 515 C CYS A 37 -2.406 8.912 -3.900 1.00 0.00 C ATOM 516 O CYS A 37 -2.779 9.477 -4.927 1.00 0.00 O ATOM 517 CB CYS A 37 -1.690 10.641 -2.241 1.00 0.00 C ATOM 518 SG CYS A 37 -2.125 12.224 -2.999 1.00 0.00 S ATOM 0 H CYS A 37 -1.796 8.572 -0.881 1.00 0.00 H new ATOM 0 HA CYS A 37 -3.695 9.926 -2.530 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -1.612 10.776 -1.162 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.705 10.339 -2.596 1.00 0.00 H new ATOM 0 HG CYS A 37 -2.623 12.017 -4.182 1.00 0.00 H new ATOM 524 N GLY A 38 -1.744 7.758 -3.910 1.00 0.00 N ATOM 525 CA GLY A 38 -1.423 7.097 -5.161 1.00 0.00 C ATOM 526 C GLY A 38 -0.760 8.029 -6.156 1.00 0.00 C ATOM 527 O GLY A 38 -1.192 8.130 -7.304 1.00 0.00 O ATOM 0 H GLY A 38 -1.425 7.270 -3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -0.763 6.253 -4.963 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -2.335 6.692 -5.599 1.00 0.00 H new ATOM 531 N ALA A 39 0.291 8.712 -5.715 1.00 0.00 N ATOM 532 CA ALA A 39 1.014 9.640 -6.575 1.00 0.00 C ATOM 533 C ALA A 39 2.365 10.009 -5.971 1.00 0.00 C ATOM 534 O ALA A 39 2.681 9.620 -4.847 1.00 0.00 O ATOM 535 CB ALA A 39 0.184 10.891 -6.819 1.00 0.00 C ATOM 0 H ALA A 39 0.661 8.640 -4.767 1.00 0.00 H new ATOM 0 HA ALA A 39 1.194 9.146 -7.530 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.737 11.575 -7.463 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.754 10.617 -7.302 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.027 11.379 -5.867 1.00 0.00 H new ATOM 541 N VAL A 40 3.160 10.762 -6.726 1.00 0.00 N ATOM 542 CA VAL A 40 4.477 11.184 -6.264 1.00 0.00 C ATOM 543 C VAL A 40 4.968 12.400 -7.041 1.00 0.00 C ATOM 544 O VAL A 40 4.590 12.606 -8.194 1.00 0.00 O ATOM 545 CB VAL A 40 5.510 10.049 -6.402 1.00 0.00 C ATOM 546 CG1 VAL A 40 5.820 9.785 -7.868 1.00 0.00 C ATOM 547 CG2 VAL A 40 6.778 10.388 -5.633 1.00 0.00 C ATOM 0 H VAL A 40 2.915 11.092 -7.660 1.00 0.00 H new ATOM 0 HA VAL A 40 4.374 11.446 -5.211 1.00 0.00 H new ATOM 0 HB VAL A 40 5.086 9.140 -5.976 1.00 0.00 H new ATOM 0 HG11 VAL A 40 6.551 8.980 -7.946 1.00 0.00 H new ATOM 0 HG12 VAL A 40 4.906 9.496 -8.387 1.00 0.00 H new ATOM 0 HG13 VAL A 40 6.225 10.689 -8.323 1.00 0.00 H new ATOM 0 HG21 VAL A 40 7.497 9.576 -5.741 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.208 11.308 -6.028 1.00 0.00 H new ATOM 0 HG23 VAL A 40 6.539 10.523 -4.578 1.00 0.00 H new ATOM 557 N MET A 41 5.811 13.203 -6.401 1.00 0.00 N ATOM 558 CA MET A 41 6.355 14.399 -7.033 1.00 0.00 C ATOM 559 C MET A 41 7.873 14.447 -6.891 1.00 0.00 C ATOM 560 O MET A 41 8.424 14.043 -5.866 1.00 0.00 O ATOM 561 CB MET A 41 5.734 15.655 -6.417 1.00 0.00 C ATOM 562 CG MET A 41 4.281 15.867 -6.807 1.00 0.00 C ATOM 563 SD MET A 41 4.075 17.167 -8.040 1.00 0.00 S ATOM 564 CE MET A 41 3.569 18.538 -7.005 1.00 0.00 C ATOM 0 H MET A 41 6.132 13.047 -5.445 1.00 0.00 H new ATOM 0 HA MET A 41 6.108 14.363 -8.094 1.00 0.00 H new ATOM 0 HB2 MET A 41 5.805 15.590 -5.331 1.00 0.00 H new ATOM 0 HB3 MET A 41 6.315 16.525 -6.723 1.00 0.00 H new ATOM 0 HG2 MET A 41 3.874 14.934 -7.197 1.00 0.00 H new ATOM 0 HG3 MET A 41 3.703 16.120 -5.918 1.00 0.00 H new ATOM 0 HE1 MET A 41 3.008 19.257 -7.602 1.00 0.00 H new ATOM 0 HE2 MET A 41 2.940 18.169 -6.195 1.00 0.00 H new ATOM 0 HE3 MET A 41 4.451 19.023 -6.587 1.00 0.00 H new ATOM 574 N LYS A 42 8.545 14.942 -7.925 1.00 0.00 N ATOM 575 CA LYS A 42 10.000 15.043 -7.916 1.00 0.00 C ATOM 576 C LYS A 42 10.454 16.392 -8.463 1.00 0.00 C ATOM 577 O LYS A 42 10.048 16.801 -9.552 1.00 0.00 O ATOM 578 CB LYS A 42 10.615 13.911 -8.741 1.00 0.00 C ATOM 579 CG LYS A 42 10.498 12.546 -8.085 1.00 0.00 C ATOM 580 CD LYS A 42 10.926 11.435 -9.030 1.00 0.00 C ATOM 581 CE LYS A 42 12.423 11.474 -9.295 1.00 0.00 C ATOM 582 NZ LYS A 42 12.849 10.392 -10.225 1.00 0.00 N ATOM 0 H LYS A 42 8.105 15.280 -8.781 1.00 0.00 H new ATOM 0 HA LYS A 42 10.340 14.957 -6.884 1.00 0.00 H new ATOM 0 HB2 LYS A 42 10.129 13.879 -9.716 1.00 0.00 H new ATOM 0 HB3 LYS A 42 11.668 14.131 -8.916 1.00 0.00 H new ATOM 0 HG2 LYS A 42 11.115 12.519 -7.187 1.00 0.00 H new ATOM 0 HG3 LYS A 42 9.468 12.380 -7.769 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.656 10.469 -8.603 1.00 0.00 H new ATOM 0 HD3 LYS A 42 10.386 11.529 -9.972 1.00 0.00 H new ATOM 0 HE2 LYS A 42 12.692 12.442 -9.717 1.00 0.00 H new ATOM 0 HE3 LYS A 42 12.962 11.376 -8.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 13.876 10.452 -10.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 12.615 9.467 -9.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 12.354 10.500 -11.133 1.00 0.00 H new ATOM 596 N LEU A 43 11.301 17.079 -7.704 1.00 0.00 N ATOM 597 CA LEU A 43 11.813 18.382 -8.114 1.00 0.00 C ATOM 598 C LEU A 43 13.301 18.504 -7.803 1.00 0.00 C ATOM 599 O LEU A 43 13.803 17.879 -6.869 1.00 0.00 O ATOM 600 CB LEU A 43 11.040 19.499 -7.412 1.00 0.00 C ATOM 601 CG LEU A 43 9.791 20.007 -8.133 1.00 0.00 C ATOM 602 CD1 LEU A 43 8.701 18.946 -8.126 1.00 0.00 C ATOM 603 CD2 LEU A 43 9.290 21.293 -7.492 1.00 0.00 C ATOM 0 H LEU A 43 11.648 16.755 -6.801 1.00 0.00 H new ATOM 0 HA LEU A 43 11.677 18.476 -9.191 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.746 19.145 -6.424 1.00 0.00 H new ATOM 0 HB3 LEU A 43 11.715 20.341 -7.260 1.00 0.00 H new ATOM 0 HG LEU A 43 10.055 20.220 -9.169 1.00 0.00 H new ATOM 0 HD11 LEU A 43 7.820 19.326 -8.644 1.00 0.00 H new ATOM 0 HD12 LEU A 43 9.062 18.051 -8.632 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.439 18.700 -7.097 1.00 0.00 H new ATOM 0 HD21 LEU A 43 8.401 21.640 -8.018 1.00 0.00 H new ATOM 0 HD22 LEU A 43 9.043 21.106 -6.447 1.00 0.00 H new ATOM 0 HD23 LEU A 43 10.067 22.056 -7.551 1.00 0.00 H new ATOM 615 N GLN A 44 14.000 19.315 -8.591 1.00 0.00 N ATOM 616 CA GLN A 44 15.430 19.521 -8.399 1.00 0.00 C ATOM 617 C GLN A 44 15.738 20.990 -8.129 1.00 0.00 C ATOM 618 O GLN A 44 15.007 21.878 -8.568 1.00 0.00 O ATOM 619 CB GLN A 44 16.206 19.042 -9.627 1.00 0.00 C ATOM 620 CG GLN A 44 17.696 18.876 -9.379 1.00 0.00 C ATOM 621 CD GLN A 44 18.540 19.763 -10.274 1.00 0.00 C ATOM 622 OE1 GLN A 44 18.645 19.529 -11.478 1.00 0.00 O ATOM 623 NE2 GLN A 44 19.145 20.790 -9.689 1.00 0.00 N ATOM 0 H GLN A 44 13.599 19.840 -9.368 1.00 0.00 H new ATOM 0 HA GLN A 44 15.741 18.939 -7.532 1.00 0.00 H new ATOM 0 HB2 GLN A 44 15.793 18.089 -9.958 1.00 0.00 H new ATOM 0 HB3 GLN A 44 16.059 19.753 -10.440 1.00 0.00 H new ATOM 0 HG2 GLN A 44 17.915 19.106 -8.336 1.00 0.00 H new ATOM 0 HG3 GLN A 44 17.973 17.834 -9.541 1.00 0.00 H new ATOM 0 HE21 GLN A 44 19.030 20.947 -8.688 1.00 0.00 H new ATOM 0 HE22 GLN A 44 19.724 21.422 -10.241 1.00 0.00 H new ATOM 632 N ILE A 45 16.823 21.239 -7.404 1.00 0.00 N ATOM 633 CA ILE A 45 17.227 22.600 -7.076 1.00 0.00 C ATOM 634 C ILE A 45 18.743 22.754 -7.139 1.00 0.00 C ATOM 635 O ILE A 45 19.479 21.768 -7.130 1.00 0.00 O ATOM 636 CB ILE A 45 16.738 23.011 -5.674 1.00 0.00 C ATOM 637 CG1 ILE A 45 17.318 22.072 -4.614 1.00 0.00 C ATOM 638 CG2 ILE A 45 15.218 23.005 -5.621 1.00 0.00 C ATOM 639 CD1 ILE A 45 17.189 22.602 -3.203 1.00 0.00 C ATOM 0 H ILE A 45 17.438 20.515 -7.032 1.00 0.00 H new ATOM 0 HA ILE A 45 16.767 23.253 -7.818 1.00 0.00 H new ATOM 0 HB ILE A 45 17.085 24.023 -5.465 1.00 0.00 H new ATOM 0 HG12 ILE A 45 16.814 21.108 -4.679 1.00 0.00 H new ATOM 0 HG13 ILE A 45 18.371 21.896 -4.833 1.00 0.00 H new ATOM 0 HG21 ILE A 45 14.888 23.297 -4.624 1.00 0.00 H new ATOM 0 HG22 ILE A 45 14.826 23.709 -6.355 1.00 0.00 H new ATOM 0 HG23 ILE A 45 14.850 22.004 -5.846 1.00 0.00 H new ATOM 0 HD11 ILE A 45 17.621 21.885 -2.504 1.00 0.00 H new ATOM 0 HD12 ILE A 45 17.717 23.552 -3.121 1.00 0.00 H new ATOM 0 HD13 ILE A 45 16.136 22.751 -2.965 1.00 0.00 H new ATOM 651 N LYS A 46 19.203 23.999 -7.202 1.00 0.00 N ATOM 652 CA LYS A 46 20.632 24.285 -7.263 1.00 0.00 C ATOM 653 C LYS A 46 20.986 25.480 -6.384 1.00 0.00 C ATOM 654 O LYS A 46 20.614 26.615 -6.684 1.00 0.00 O ATOM 655 CB LYS A 46 21.056 24.557 -8.708 1.00 0.00 C ATOM 656 CG LYS A 46 22.513 24.228 -8.986 1.00 0.00 C ATOM 657 CD LYS A 46 23.393 25.462 -8.887 1.00 0.00 C ATOM 658 CE LYS A 46 24.779 25.206 -9.458 1.00 0.00 C ATOM 659 NZ LYS A 46 24.917 25.738 -10.842 1.00 0.00 N ATOM 0 H LYS A 46 18.607 24.827 -7.212 1.00 0.00 H new ATOM 0 HA LYS A 46 21.169 23.412 -6.891 1.00 0.00 H new ATOM 0 HB2 LYS A 46 20.426 23.973 -9.379 1.00 0.00 H new ATOM 0 HB3 LYS A 46 20.879 25.608 -8.938 1.00 0.00 H new ATOM 0 HG2 LYS A 46 22.859 23.476 -8.277 1.00 0.00 H new ATOM 0 HG3 LYS A 46 22.605 23.794 -9.981 1.00 0.00 H new ATOM 0 HD2 LYS A 46 22.925 26.288 -9.422 1.00 0.00 H new ATOM 0 HD3 LYS A 46 23.479 25.766 -7.844 1.00 0.00 H new ATOM 0 HE2 LYS A 46 25.528 25.669 -8.815 1.00 0.00 H new ATOM 0 HE3 LYS A 46 24.979 24.134 -9.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 25.876 25.543 -11.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 24.220 25.278 -11.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 24.752 26.765 -10.837 1.00 0.00 H new ATOM 673 N VAL A 47 21.707 25.218 -5.299 1.00 0.00 N ATOM 674 CA VAL A 47 22.114 26.273 -4.378 1.00 0.00 C ATOM 675 C VAL A 47 23.600 26.583 -4.519 1.00 0.00 C ATOM 676 O VAL A 47 24.403 25.699 -4.814 1.00 0.00 O ATOM 677 CB VAL A 47 21.818 25.886 -2.917 1.00 0.00 C ATOM 678 CG1 VAL A 47 22.036 27.077 -1.995 1.00 0.00 C ATOM 679 CG2 VAL A 47 20.400 25.352 -2.784 1.00 0.00 C ATOM 0 H VAL A 47 22.022 24.284 -5.036 1.00 0.00 H new ATOM 0 HA VAL A 47 21.535 27.160 -4.636 1.00 0.00 H new ATOM 0 HB VAL A 47 22.508 25.096 -2.622 1.00 0.00 H new ATOM 0 HG11 VAL A 47 21.822 26.785 -0.967 1.00 0.00 H new ATOM 0 HG12 VAL A 47 23.071 27.410 -2.070 1.00 0.00 H new ATOM 0 HG13 VAL A 47 21.371 27.890 -2.287 1.00 0.00 H new ATOM 0 HG21 VAL A 47 20.208 25.084 -1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 47 19.692 26.119 -3.097 1.00 0.00 H new ATOM 0 HG23 VAL A 47 20.283 24.470 -3.414 1.00 0.00 H new ATOM 689 N ASN A 48 23.958 27.845 -4.306 1.00 0.00 N ATOM 690 CA ASN A 48 25.348 28.273 -4.410 1.00 0.00 C ATOM 691 C ASN A 48 25.975 28.424 -3.027 1.00 0.00 C ATOM 692 O ASN A 48 25.318 28.206 -2.009 1.00 0.00 O ATOM 693 CB ASN A 48 25.441 29.596 -5.172 1.00 0.00 C ATOM 694 CG ASN A 48 24.197 30.447 -5.007 1.00 0.00 C ATOM 695 OD1 ASN A 48 23.925 30.866 -3.777 1.00 0.00 O flip ATOM 696 ND2 ASN A 48 23.488 30.723 -5.975 1.00 0.00 N flip ATOM 0 H ASN A 48 23.305 28.589 -4.060 1.00 0.00 H new ATOM 0 HA ASN A 48 25.898 27.508 -4.957 1.00 0.00 H new ATOM 0 HB2 ASN A 48 26.309 30.154 -4.821 1.00 0.00 H new ATOM 0 HB3 ASN A 48 25.600 29.392 -6.231 1.00 0.00 H new ATOM 0 HD21 ASN A 48 23.735 30.379 -6.903 1.00 0.00 H new ATOM 0 HD22 ASN A 48 22.653 31.295 -5.849 1.00 0.00 H new ATOM 703 N ASP A 49 27.249 28.799 -2.999 1.00 0.00 N ATOM 704 CA ASP A 49 27.965 28.981 -1.742 1.00 0.00 C ATOM 705 C ASP A 49 27.257 30.001 -0.856 1.00 0.00 C ATOM 706 O ASP A 49 27.401 29.982 0.366 1.00 0.00 O ATOM 707 CB ASP A 49 29.403 29.431 -2.009 1.00 0.00 C ATOM 708 CG ASP A 49 30.421 28.377 -1.618 1.00 0.00 C ATOM 709 OD1 ASP A 49 30.465 27.319 -2.281 1.00 0.00 O ATOM 710 OD2 ASP A 49 31.174 28.611 -0.650 1.00 0.00 O ATOM 0 H ASP A 49 27.807 28.983 -3.833 1.00 0.00 H new ATOM 0 HA ASP A 49 27.983 28.024 -1.221 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.516 29.667 -3.067 1.00 0.00 H new ATOM 0 HB3 ASP A 49 29.603 30.348 -1.455 1.00 0.00 H new ATOM 715 N GLU A 50 26.493 30.892 -1.482 1.00 0.00 N ATOM 716 CA GLU A 50 25.764 31.921 -0.750 1.00 0.00 C ATOM 717 C GLU A 50 24.554 31.326 -0.036 1.00 0.00 C ATOM 718 O GLU A 50 24.020 31.918 0.902 1.00 0.00 O ATOM 719 CB GLU A 50 25.315 33.033 -1.700 1.00 0.00 C ATOM 720 CG GLU A 50 26.125 34.311 -1.568 1.00 0.00 C ATOM 721 CD GLU A 50 26.638 34.817 -2.902 1.00 0.00 C ATOM 722 OE1 GLU A 50 25.809 35.054 -3.805 1.00 0.00 O ATOM 723 OE2 GLU A 50 27.869 34.977 -3.042 1.00 0.00 O ATOM 0 H GLU A 50 26.363 30.921 -2.493 1.00 0.00 H new ATOM 0 HA GLU A 50 26.435 32.343 -0.001 1.00 0.00 H new ATOM 0 HB2 GLU A 50 25.385 32.673 -2.726 1.00 0.00 H new ATOM 0 HB3 GLU A 50 24.265 33.257 -1.512 1.00 0.00 H new ATOM 0 HG2 GLU A 50 25.509 35.081 -1.104 1.00 0.00 H new ATOM 0 HG3 GLU A 50 26.969 34.134 -0.902 1.00 0.00 H new ATOM 730 N GLY A 51 24.126 30.151 -0.487 1.00 0.00 N ATOM 731 CA GLY A 51 22.981 29.496 0.119 1.00 0.00 C ATOM 732 C GLY A 51 21.665 29.979 -0.457 1.00 0.00 C ATOM 733 O GLY A 51 20.650 30.012 0.240 1.00 0.00 O ATOM 0 H GLY A 51 24.551 29.641 -1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 51 23.064 28.419 -0.026 1.00 0.00 H new ATOM 0 HA3 GLY A 51 22.991 29.675 1.194 1.00 0.00 H new ATOM 737 N ILE A 52 21.681 30.354 -1.732 1.00 0.00 N ATOM 738 CA ILE A 52 20.479 30.838 -2.400 1.00 0.00 C ATOM 739 C ILE A 52 20.173 30.012 -3.645 1.00 0.00 C ATOM 740 O ILE A 52 21.082 29.579 -4.354 1.00 0.00 O ATOM 741 CB ILE A 52 20.615 32.319 -2.801 1.00 0.00 C ATOM 742 CG1 ILE A 52 20.841 33.186 -1.561 1.00 0.00 C ATOM 743 CG2 ILE A 52 19.378 32.779 -3.557 1.00 0.00 C ATOM 744 CD1 ILE A 52 19.754 33.046 -0.518 1.00 0.00 C ATOM 0 H ILE A 52 22.512 30.332 -2.323 1.00 0.00 H new ATOM 0 HA ILE A 52 19.660 30.737 -1.688 1.00 0.00 H new ATOM 0 HB ILE A 52 21.478 32.425 -3.458 1.00 0.00 H new ATOM 0 HG12 ILE A 52 21.799 32.922 -1.113 1.00 0.00 H new ATOM 0 HG13 ILE A 52 20.908 34.230 -1.866 1.00 0.00 H new ATOM 0 HG21 ILE A 52 19.489 33.827 -3.833 1.00 0.00 H new ATOM 0 HG22 ILE A 52 19.257 32.177 -4.458 1.00 0.00 H new ATOM 0 HG23 ILE A 52 18.499 32.662 -2.922 1.00 0.00 H new ATOM 0 HD11 ILE A 52 19.981 33.689 0.332 1.00 0.00 H new ATOM 0 HD12 ILE A 52 18.796 33.338 -0.949 1.00 0.00 H new ATOM 0 HD13 ILE A 52 19.701 32.010 -0.185 1.00 0.00 H new ATOM 756 N ILE A 53 18.887 29.801 -3.906 1.00 0.00 N ATOM 757 CA ILE A 53 18.461 29.030 -5.067 1.00 0.00 C ATOM 758 C ILE A 53 18.665 29.819 -6.356 1.00 0.00 C ATOM 759 O ILE A 53 18.057 30.871 -6.554 1.00 0.00 O ATOM 760 CB ILE A 53 16.980 28.620 -4.958 1.00 0.00 C ATOM 761 CG1 ILE A 53 16.756 27.763 -3.711 1.00 0.00 C ATOM 762 CG2 ILE A 53 16.545 27.870 -6.209 1.00 0.00 C ATOM 763 CD1 ILE A 53 17.453 26.421 -3.767 1.00 0.00 C ATOM 0 H ILE A 53 18.123 30.153 -3.329 1.00 0.00 H new ATOM 0 HA ILE A 53 19.077 28.131 -5.093 1.00 0.00 H new ATOM 0 HB ILE A 53 16.374 29.522 -4.869 1.00 0.00 H new ATOM 0 HG12 ILE A 53 17.108 28.310 -2.836 1.00 0.00 H new ATOM 0 HG13 ILE A 53 15.686 27.602 -3.578 1.00 0.00 H new ATOM 0 HG21 ILE A 53 15.496 27.587 -6.117 1.00 0.00 H new ATOM 0 HG22 ILE A 53 16.673 28.512 -7.081 1.00 0.00 H new ATOM 0 HG23 ILE A 53 17.154 26.974 -6.326 1.00 0.00 H new ATOM 0 HD11 ILE A 53 17.250 25.867 -2.850 1.00 0.00 H new ATOM 0 HD12 ILE A 53 17.084 25.855 -4.622 1.00 0.00 H new ATOM 0 HD13 ILE A 53 18.528 26.573 -3.869 1.00 0.00 H new ATOM 775 N GLU A 54 19.523 29.303 -7.230 1.00 0.00 N ATOM 776 CA GLU A 54 19.806 29.959 -8.501 1.00 0.00 C ATOM 777 C GLU A 54 19.152 29.209 -9.658 1.00 0.00 C ATOM 778 O GLU A 54 18.855 29.793 -10.701 1.00 0.00 O ATOM 779 CB GLU A 54 21.316 30.053 -8.727 1.00 0.00 C ATOM 780 CG GLU A 54 21.696 30.442 -10.146 1.00 0.00 C ATOM 781 CD GLU A 54 20.960 31.677 -10.629 1.00 0.00 C ATOM 782 OE1 GLU A 54 20.619 32.532 -9.786 1.00 0.00 O ATOM 783 OE2 GLU A 54 20.727 31.788 -11.851 1.00 0.00 O ATOM 0 H GLU A 54 20.034 28.433 -7.081 1.00 0.00 H new ATOM 0 HA GLU A 54 19.389 30.965 -8.462 1.00 0.00 H new ATOM 0 HB2 GLU A 54 21.734 30.784 -8.035 1.00 0.00 H new ATOM 0 HB3 GLU A 54 21.771 29.092 -8.489 1.00 0.00 H new ATOM 0 HG2 GLU A 54 22.770 30.621 -10.194 1.00 0.00 H new ATOM 0 HG3 GLU A 54 21.481 29.610 -10.817 1.00 0.00 H new ATOM 790 N ASP A 55 18.934 27.913 -9.467 1.00 0.00 N ATOM 791 CA ASP A 55 18.315 27.082 -10.494 1.00 0.00 C ATOM 792 C ASP A 55 17.326 26.099 -9.875 1.00 0.00 C ATOM 793 O ASP A 55 17.530 25.618 -8.761 1.00 0.00 O ATOM 794 CB ASP A 55 19.386 26.322 -11.278 1.00 0.00 C ATOM 795 CG ASP A 55 18.979 26.066 -12.715 1.00 0.00 C ATOM 796 OD1 ASP A 55 18.042 25.270 -12.933 1.00 0.00 O ATOM 797 OD2 ASP A 55 19.598 26.661 -13.623 1.00 0.00 O ATOM 0 H ASP A 55 19.176 27.415 -8.611 1.00 0.00 H new ATOM 0 HA ASP A 55 17.771 27.735 -11.176 1.00 0.00 H new ATOM 0 HB2 ASP A 55 20.316 26.891 -11.263 1.00 0.00 H new ATOM 0 HB3 ASP A 55 19.586 25.371 -10.785 1.00 0.00 H new ATOM 802 N ALA A 56 16.255 25.808 -10.604 1.00 0.00 N ATOM 803 CA ALA A 56 15.235 24.882 -10.128 1.00 0.00 C ATOM 804 C ALA A 56 14.684 24.036 -11.270 1.00 0.00 C ATOM 805 O ALA A 56 14.114 24.562 -12.226 1.00 0.00 O ATOM 806 CB ALA A 56 14.110 25.643 -9.442 1.00 0.00 C ATOM 0 H ALA A 56 16.071 26.200 -11.527 1.00 0.00 H new ATOM 0 HA ALA A 56 15.699 24.211 -9.405 1.00 0.00 H new ATOM 0 HB1 ALA A 56 13.355 24.939 -9.092 1.00 0.00 H new ATOM 0 HB2 ALA A 56 14.511 26.198 -8.594 1.00 0.00 H new ATOM 0 HB3 ALA A 56 13.657 26.338 -10.149 1.00 0.00 H new ATOM 812 N ARG A 57 14.858 22.722 -11.165 1.00 0.00 N ATOM 813 CA ARG A 57 14.379 21.804 -12.191 1.00 0.00 C ATOM 814 C ARG A 57 13.243 20.936 -11.658 1.00 0.00 C ATOM 815 O ARG A 57 12.904 20.998 -10.476 1.00 0.00 O ATOM 816 CB ARG A 57 15.524 20.917 -12.686 1.00 0.00 C ATOM 817 CG ARG A 57 16.049 21.309 -14.057 1.00 0.00 C ATOM 818 CD ARG A 57 15.029 21.019 -15.148 1.00 0.00 C ATOM 819 NE ARG A 57 14.204 22.186 -15.450 1.00 0.00 N ATOM 820 CZ ARG A 57 14.623 23.213 -16.181 1.00 0.00 C ATOM 821 NH1 ARG A 57 15.850 23.217 -16.682 1.00 0.00 N ATOM 822 NH2 ARG A 57 13.813 24.238 -16.412 1.00 0.00 N ATOM 0 H ARG A 57 15.327 22.270 -10.380 1.00 0.00 H new ATOM 0 HA ARG A 57 14.000 22.396 -13.024 1.00 0.00 H new ATOM 0 HB2 ARG A 57 16.342 20.960 -11.967 1.00 0.00 H new ATOM 0 HB3 ARG A 57 15.183 19.882 -12.719 1.00 0.00 H new ATOM 0 HG2 ARG A 57 16.298 22.370 -14.063 1.00 0.00 H new ATOM 0 HG3 ARG A 57 16.970 20.764 -14.264 1.00 0.00 H new ATOM 0 HD2 ARG A 57 15.546 20.697 -16.052 1.00 0.00 H new ATOM 0 HD3 ARG A 57 14.389 20.194 -14.836 1.00 0.00 H new ATOM 0 HE ARG A 57 13.254 22.214 -15.079 1.00 0.00 H new ATOM 0 HH11 ARG A 57 16.475 22.430 -16.507 1.00 0.00 H new ATOM 0 HH12 ARG A 57 16.169 24.007 -17.243 1.00 0.00 H new ATOM 0 HH21 ARG A 57 12.868 24.238 -16.028 1.00 0.00 H new ATOM 0 HH22 ARG A 57 14.135 25.026 -16.973 1.00 0.00 H new ATOM 836 N PHE A 58 12.659 20.129 -12.537 1.00 0.00 N ATOM 837 CA PHE A 58 11.560 19.250 -12.154 1.00 0.00 C ATOM 838 C PHE A 58 11.326 18.179 -13.216 1.00 0.00 C ATOM 839 O PHE A 58 11.565 18.402 -14.403 1.00 0.00 O ATOM 840 CB PHE A 58 10.281 20.061 -11.941 1.00 0.00 C ATOM 841 CG PHE A 58 9.802 20.763 -13.180 1.00 0.00 C ATOM 842 CD1 PHE A 58 10.383 21.954 -13.585 1.00 0.00 C ATOM 843 CD2 PHE A 58 8.772 20.232 -13.939 1.00 0.00 C ATOM 844 CE1 PHE A 58 9.945 22.603 -14.725 1.00 0.00 C ATOM 845 CE2 PHE A 58 8.331 20.875 -15.080 1.00 0.00 C ATOM 846 CZ PHE A 58 8.917 22.063 -15.472 1.00 0.00 C ATOM 0 H PHE A 58 12.928 20.065 -13.519 1.00 0.00 H new ATOM 0 HA PHE A 58 11.829 18.758 -11.219 1.00 0.00 H new ATOM 0 HB2 PHE A 58 9.495 19.397 -11.583 1.00 0.00 H new ATOM 0 HB3 PHE A 58 10.455 20.800 -11.159 1.00 0.00 H new ATOM 0 HD1 PHE A 58 11.187 22.380 -13.004 1.00 0.00 H new ATOM 0 HD2 PHE A 58 8.308 19.305 -13.636 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.406 23.531 -15.030 1.00 0.00 H new ATOM 0 HE2 PHE A 58 7.529 20.449 -15.665 1.00 0.00 H new ATOM 0 HZ PHE A 58 8.571 22.569 -16.362 1.00 0.00 H new ATOM 856 N LYS A 59 10.857 17.014 -12.780 1.00 0.00 N ATOM 857 CA LYS A 59 10.589 15.908 -13.691 1.00 0.00 C ATOM 858 C LYS A 59 9.128 15.480 -13.611 1.00 0.00 C ATOM 859 O LYS A 59 8.477 15.642 -12.578 1.00 0.00 O ATOM 860 CB LYS A 59 11.498 14.720 -13.364 1.00 0.00 C ATOM 861 CG LYS A 59 12.973 15.002 -13.593 1.00 0.00 C ATOM 862 CD LYS A 59 13.848 14.185 -12.657 1.00 0.00 C ATOM 863 CE LYS A 59 14.943 15.036 -12.033 1.00 0.00 C ATOM 864 NZ LYS A 59 14.659 15.345 -10.605 1.00 0.00 N ATOM 0 H LYS A 59 10.655 16.812 -11.801 1.00 0.00 H new ATOM 0 HA LYS A 59 10.795 16.247 -14.706 1.00 0.00 H new ATOM 0 HB2 LYS A 59 11.349 14.435 -12.323 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.201 13.867 -13.974 1.00 0.00 H new ATOM 0 HG2 LYS A 59 13.232 14.774 -14.627 1.00 0.00 H new ATOM 0 HG3 LYS A 59 13.169 16.064 -13.442 1.00 0.00 H new ATOM 0 HD2 LYS A 59 13.233 13.748 -11.871 1.00 0.00 H new ATOM 0 HD3 LYS A 59 14.297 13.358 -13.207 1.00 0.00 H new ATOM 0 HE2 LYS A 59 15.897 14.513 -12.109 1.00 0.00 H new ATOM 0 HE3 LYS A 59 15.044 15.966 -12.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.428 15.927 -10.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 13.762 15.866 -10.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 14.588 14.459 -10.065 1.00 0.00 H new ATOM 878 N THR A 60 8.616 14.931 -14.709 1.00 0.00 N ATOM 879 CA THR A 60 7.231 14.479 -14.763 1.00 0.00 C ATOM 880 C THR A 60 7.090 13.069 -14.202 1.00 0.00 C ATOM 881 O THR A 60 7.753 12.138 -14.662 1.00 0.00 O ATOM 882 CB THR A 60 6.689 14.503 -16.205 1.00 0.00 C ATOM 883 OG1 THR A 60 6.947 15.777 -16.805 1.00 0.00 O ATOM 884 CG2 THR A 60 5.194 14.220 -16.225 1.00 0.00 C ATOM 0 H THR A 60 9.140 14.789 -15.573 1.00 0.00 H new ATOM 0 HA THR A 60 6.649 15.169 -14.152 1.00 0.00 H new ATOM 0 HB THR A 60 7.198 13.725 -16.774 1.00 0.00 H new ATOM 0 HG1 THR A 60 6.601 15.783 -17.722 1.00 0.00 H new ATOM 0 HG21 THR A 60 4.833 14.242 -17.253 1.00 0.00 H new ATOM 0 HG22 THR A 60 5.004 13.237 -15.795 1.00 0.00 H new ATOM 0 HG23 THR A 60 4.672 14.978 -15.641 1.00 0.00 H new ATOM 892 N TYR A 61 6.224 12.917 -13.207 1.00 0.00 N ATOM 893 CA TYR A 61 5.998 11.619 -12.582 1.00 0.00 C ATOM 894 C TYR A 61 4.653 11.588 -11.862 1.00 0.00 C ATOM 895 O TYR A 61 4.492 12.182 -10.797 1.00 0.00 O ATOM 896 CB TYR A 61 7.123 11.301 -11.597 1.00 0.00 C ATOM 897 CG TYR A 61 7.648 9.887 -11.712 1.00 0.00 C ATOM 898 CD1 TYR A 61 6.825 8.797 -11.457 1.00 0.00 C ATOM 899 CD2 TYR A 61 8.966 9.642 -12.076 1.00 0.00 C ATOM 900 CE1 TYR A 61 7.300 7.504 -11.560 1.00 0.00 C ATOM 901 CE2 TYR A 61 9.449 8.352 -12.184 1.00 0.00 C ATOM 902 CZ TYR A 61 8.612 7.287 -11.925 1.00 0.00 C ATOM 903 OH TYR A 61 9.090 6.000 -12.030 1.00 0.00 O ATOM 0 H TYR A 61 5.667 13.676 -12.816 1.00 0.00 H new ATOM 0 HA TYR A 61 5.987 10.863 -13.367 1.00 0.00 H new ATOM 0 HB2 TYR A 61 7.944 11.999 -11.759 1.00 0.00 H new ATOM 0 HB3 TYR A 61 6.762 11.464 -10.581 1.00 0.00 H new ATOM 0 HD1 TYR A 61 5.796 8.964 -11.173 1.00 0.00 H new ATOM 0 HD2 TYR A 61 9.624 10.474 -12.278 1.00 0.00 H new ATOM 0 HE1 TYR A 61 6.648 6.668 -11.356 1.00 0.00 H new ATOM 0 HE2 TYR A 61 10.476 8.179 -12.470 1.00 0.00 H new ATOM 0 HH TYR A 61 10.033 6.022 -12.297 1.00 0.00 H new ATOM 913 N GLY A 62 3.688 10.889 -12.453 1.00 0.00 N ATOM 914 CA GLY A 62 2.370 10.792 -11.856 1.00 0.00 C ATOM 915 C GLY A 62 1.262 11.111 -12.840 1.00 0.00 C ATOM 916 O GLY A 62 1.498 11.756 -13.862 1.00 0.00 O ATOM 0 H GLY A 62 3.797 10.388 -13.335 1.00 0.00 H new ATOM 0 HA2 GLY A 62 2.225 9.785 -11.465 1.00 0.00 H new ATOM 0 HA3 GLY A 62 2.307 11.475 -11.009 1.00 0.00 H new ATOM 920 N CYS A 63 0.052 10.657 -12.534 1.00 0.00 N ATOM 921 CA CYS A 63 -1.096 10.896 -13.401 1.00 0.00 C ATOM 922 C CYS A 63 -2.074 11.871 -12.753 1.00 0.00 C ATOM 923 O CYS A 63 -2.098 12.023 -11.532 1.00 0.00 O ATOM 924 CB CYS A 63 -1.806 9.578 -13.717 1.00 0.00 C ATOM 925 SG CYS A 63 -1.297 8.821 -15.278 1.00 0.00 S ATOM 0 H CYS A 63 -0.160 10.121 -11.692 1.00 0.00 H new ATOM 0 HA CYS A 63 -0.733 11.337 -14.329 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.619 8.874 -12.906 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -2.881 9.755 -13.745 1.00 0.00 H new ATOM 0 HG CYS A 63 -1.950 7.711 -15.456 1.00 0.00 H new ATOM 931 N GLY A 64 -2.879 12.531 -13.580 1.00 0.00 N ATOM 932 CA GLY A 64 -3.846 13.486 -13.070 1.00 0.00 C ATOM 933 C GLY A 64 -4.403 14.384 -14.156 1.00 0.00 C ATOM 934 O GLY A 64 -4.971 13.904 -15.137 1.00 0.00 O ATOM 0 H GLY A 64 -2.879 12.421 -14.594 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -4.665 12.949 -12.592 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.376 14.099 -12.302 1.00 0.00 H new ATOM 938 N SER A 65 -4.241 15.692 -13.981 1.00 0.00 N ATOM 939 CA SER A 65 -4.738 16.660 -14.952 1.00 0.00 C ATOM 940 C SER A 65 -3.610 17.562 -15.444 1.00 0.00 C ATOM 941 O SER A 65 -3.467 17.796 -16.644 1.00 0.00 O ATOM 942 CB SER A 65 -5.852 17.508 -14.335 1.00 0.00 C ATOM 943 OG SER A 65 -6.899 17.728 -15.264 1.00 0.00 O ATOM 0 H SER A 65 -3.770 16.105 -13.176 1.00 0.00 H new ATOM 0 HA SER A 65 -5.139 16.111 -15.804 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.246 17.008 -13.450 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.446 18.465 -14.007 1.00 0.00 H new ATOM 0 HG SER A 65 -6.694 18.518 -15.807 1.00 0.00 H new ATOM 949 N ALA A 66 -2.812 18.066 -14.508 1.00 0.00 N ATOM 950 CA ALA A 66 -1.696 18.940 -14.846 1.00 0.00 C ATOM 951 C ALA A 66 -0.659 18.963 -13.728 1.00 0.00 C ATOM 952 O ALA A 66 -0.733 18.176 -12.783 1.00 0.00 O ATOM 953 CB ALA A 66 -2.197 20.348 -15.132 1.00 0.00 C ATOM 0 H ALA A 66 -2.918 17.884 -13.510 1.00 0.00 H new ATOM 0 HA ALA A 66 -1.217 18.547 -15.743 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -1.353 20.990 -15.383 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -2.895 20.323 -15.969 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -2.702 20.741 -14.250 1.00 0.00 H new ATOM 959 N ILE A 67 0.307 19.868 -13.842 1.00 0.00 N ATOM 960 CA ILE A 67 1.358 19.993 -12.840 1.00 0.00 C ATOM 961 C ILE A 67 1.536 21.444 -12.406 1.00 0.00 C ATOM 962 O ILE A 67 2.658 21.929 -12.271 1.00 0.00 O ATOM 963 CB ILE A 67 2.703 19.458 -13.366 1.00 0.00 C ATOM 964 CG1 ILE A 67 3.133 20.235 -14.613 1.00 0.00 C ATOM 965 CG2 ILE A 67 2.600 17.971 -13.671 1.00 0.00 C ATOM 966 CD1 ILE A 67 2.543 19.692 -15.896 1.00 0.00 C ATOM 0 H ILE A 67 0.384 20.525 -14.618 1.00 0.00 H new ATOM 0 HA ILE A 67 1.048 19.396 -11.982 1.00 0.00 H new ATOM 0 HB ILE A 67 3.460 19.598 -12.594 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.839 21.279 -14.500 1.00 0.00 H new ATOM 0 HG13 ILE A 67 4.220 20.216 -14.686 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.559 17.608 -14.042 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.334 17.431 -12.762 1.00 0.00 H new ATOM 0 HG23 ILE A 67 1.833 17.807 -14.428 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.890 20.291 -16.738 1.00 0.00 H new ATOM 0 HD12 ILE A 67 2.858 18.657 -16.032 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.455 19.736 -15.844 1.00 0.00 H new ATOM 978 N ALA A 68 0.419 22.131 -12.188 1.00 0.00 N ATOM 979 CA ALA A 68 0.451 23.526 -11.766 1.00 0.00 C ATOM 980 C ALA A 68 1.081 23.667 -10.384 1.00 0.00 C ATOM 981 O ALA A 68 1.951 24.512 -10.172 1.00 0.00 O ATOM 982 CB ALA A 68 -0.954 24.110 -11.769 1.00 0.00 C ATOM 0 H ALA A 68 -0.519 21.744 -12.297 1.00 0.00 H new ATOM 0 HA ALA A 68 1.065 24.081 -12.475 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -0.916 25.152 -11.452 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -1.370 24.052 -12.775 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.584 23.545 -11.082 1.00 0.00 H new ATOM 988 N SER A 69 0.637 22.835 -9.448 1.00 0.00 N ATOM 989 CA SER A 69 1.155 22.870 -8.086 1.00 0.00 C ATOM 990 C SER A 69 2.671 22.707 -8.077 1.00 0.00 C ATOM 991 O SER A 69 3.357 23.228 -7.197 1.00 0.00 O ATOM 992 CB SER A 69 0.507 21.769 -7.243 1.00 0.00 C ATOM 993 OG SER A 69 0.704 20.495 -7.830 1.00 0.00 O ATOM 0 H SER A 69 -0.081 22.128 -9.608 1.00 0.00 H new ATOM 0 HA SER A 69 0.909 23.840 -7.655 1.00 0.00 H new ATOM 0 HB2 SER A 69 0.930 21.779 -6.238 1.00 0.00 H new ATOM 0 HB3 SER A 69 -0.560 21.965 -7.142 1.00 0.00 H new ATOM 0 HG SER A 69 0.282 19.809 -7.272 1.00 0.00 H new ATOM 999 N SER A 70 3.188 21.980 -9.062 1.00 0.00 N ATOM 1000 CA SER A 70 4.623 21.744 -9.167 1.00 0.00 C ATOM 1001 C SER A 70 5.310 22.892 -9.901 1.00 0.00 C ATOM 1002 O SER A 70 6.344 23.394 -9.461 1.00 0.00 O ATOM 1003 CB SER A 70 4.893 20.425 -9.893 1.00 0.00 C ATOM 1004 OG SER A 70 6.268 20.085 -9.838 1.00 0.00 O ATOM 0 H SER A 70 2.634 21.544 -9.799 1.00 0.00 H new ATOM 0 HA SER A 70 5.031 21.685 -8.158 1.00 0.00 H new ATOM 0 HB2 SER A 70 4.300 19.630 -9.441 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.577 20.507 -10.933 1.00 0.00 H new ATOM 0 HG SER A 70 6.414 19.237 -10.308 1.00 0.00 H new ATOM 1010 N SER A 71 4.727 23.301 -11.023 1.00 0.00 N ATOM 1011 CA SER A 71 5.284 24.387 -11.821 1.00 0.00 C ATOM 1012 C SER A 71 5.265 25.699 -11.043 1.00 0.00 C ATOM 1013 O SER A 71 6.032 26.618 -11.333 1.00 0.00 O ATOM 1014 CB SER A 71 4.500 24.543 -13.126 1.00 0.00 C ATOM 1015 OG SER A 71 4.466 23.325 -13.849 1.00 0.00 O ATOM 0 H SER A 71 3.870 22.897 -11.400 1.00 0.00 H new ATOM 0 HA SER A 71 6.319 24.139 -12.055 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.483 24.868 -12.906 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.957 25.320 -13.738 1.00 0.00 H new ATOM 0 HG SER A 71 3.904 22.678 -13.374 1.00 0.00 H new ATOM 1021 N LEU A 72 4.382 25.779 -10.054 1.00 0.00 N ATOM 1022 CA LEU A 72 4.261 26.979 -9.232 1.00 0.00 C ATOM 1023 C LEU A 72 5.328 27.002 -8.142 1.00 0.00 C ATOM 1024 O LEU A 72 6.038 27.993 -7.975 1.00 0.00 O ATOM 1025 CB LEU A 72 2.869 27.050 -8.601 1.00 0.00 C ATOM 1026 CG LEU A 72 2.713 28.020 -7.429 1.00 0.00 C ATOM 1027 CD1 LEU A 72 1.420 28.811 -7.560 1.00 0.00 C ATOM 1028 CD2 LEU A 72 2.748 27.268 -6.106 1.00 0.00 C ATOM 0 H LEU A 72 3.739 25.028 -9.801 1.00 0.00 H new ATOM 0 HA LEU A 72 4.406 27.847 -9.875 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.155 27.329 -9.375 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.595 26.052 -8.260 1.00 0.00 H new ATOM 0 HG LEU A 72 3.548 28.721 -7.448 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.326 29.496 -6.717 1.00 0.00 H new ATOM 0 HD12 LEU A 72 1.434 29.379 -8.490 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.573 28.125 -7.566 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.636 27.974 -5.283 1.00 0.00 H new ATOM 0 HD22 LEU A 72 1.933 26.544 -6.077 1.00 0.00 H new ATOM 0 HD23 LEU A 72 3.700 26.746 -6.009 1.00 0.00 H new ATOM 1040 N VAL A 73 5.436 25.902 -7.403 1.00 0.00 N ATOM 1041 CA VAL A 73 6.418 25.795 -6.331 1.00 0.00 C ATOM 1042 C VAL A 73 7.838 25.933 -6.871 1.00 0.00 C ATOM 1043 O VAL A 73 8.745 26.366 -6.159 1.00 0.00 O ATOM 1044 CB VAL A 73 6.292 24.453 -5.587 1.00 0.00 C ATOM 1045 CG1 VAL A 73 4.976 24.384 -4.827 1.00 0.00 C ATOM 1046 CG2 VAL A 73 6.417 23.290 -6.560 1.00 0.00 C ATOM 0 H VAL A 73 4.855 25.073 -7.527 1.00 0.00 H new ATOM 0 HA VAL A 73 6.216 26.609 -5.634 1.00 0.00 H new ATOM 0 HB VAL A 73 7.105 24.381 -4.864 1.00 0.00 H new ATOM 0 HG11 VAL A 73 4.905 23.428 -4.308 1.00 0.00 H new ATOM 0 HG12 VAL A 73 4.932 25.196 -4.101 1.00 0.00 H new ATOM 0 HG13 VAL A 73 4.146 24.479 -5.527 1.00 0.00 H new ATOM 0 HG21 VAL A 73 6.326 22.350 -6.017 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.627 23.355 -7.308 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.388 23.331 -7.053 1.00 0.00 H new ATOM 1056 N THR A 74 8.023 25.563 -8.134 1.00 0.00 N ATOM 1057 CA THR A 74 9.332 25.645 -8.770 1.00 0.00 C ATOM 1058 C THR A 74 9.722 27.094 -9.041 1.00 0.00 C ATOM 1059 O THR A 74 10.829 27.520 -8.714 1.00 0.00 O ATOM 1060 CB THR A 74 9.363 24.860 -10.095 1.00 0.00 C ATOM 1061 OG1 THR A 74 8.085 24.931 -10.736 1.00 0.00 O ATOM 1062 CG2 THR A 74 9.736 23.405 -9.853 1.00 0.00 C ATOM 0 H THR A 74 7.283 25.204 -8.737 1.00 0.00 H new ATOM 0 HA THR A 74 10.048 25.203 -8.078 1.00 0.00 H new ATOM 0 HB THR A 74 10.118 25.309 -10.741 1.00 0.00 H new ATOM 0 HG1 THR A 74 7.504 24.224 -10.386 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.751 22.871 -10.803 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.722 23.354 -9.392 1.00 0.00 H new ATOM 0 HG23 THR A 74 9.002 22.946 -9.191 1.00 0.00 H new ATOM 1070 N GLU A 75 8.804 27.846 -9.641 1.00 0.00 N ATOM 1071 CA GLU A 75 9.054 29.248 -9.956 1.00 0.00 C ATOM 1072 C GLU A 75 9.233 30.069 -8.682 1.00 0.00 C ATOM 1073 O GLU A 75 9.812 31.155 -8.707 1.00 0.00 O ATOM 1074 CB GLU A 75 7.903 29.820 -10.786 1.00 0.00 C ATOM 1075 CG GLU A 75 7.618 29.033 -12.054 1.00 0.00 C ATOM 1076 CD GLU A 75 8.487 29.468 -13.218 1.00 0.00 C ATOM 1077 OE1 GLU A 75 9.577 30.022 -12.971 1.00 0.00 O ATOM 1078 OE2 GLU A 75 8.075 29.252 -14.378 1.00 0.00 O ATOM 0 H GLU A 75 7.882 27.509 -9.918 1.00 0.00 H new ATOM 0 HA GLU A 75 9.975 29.304 -10.536 1.00 0.00 H new ATOM 0 HB2 GLU A 75 7.002 29.845 -10.173 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.136 30.851 -11.053 1.00 0.00 H new ATOM 0 HG2 GLU A 75 7.778 27.972 -11.862 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.569 29.153 -12.324 1.00 0.00 H new ATOM 1085 N TRP A 76 8.732 29.541 -7.571 1.00 0.00 N ATOM 1086 CA TRP A 76 8.836 30.225 -6.286 1.00 0.00 C ATOM 1087 C TRP A 76 10.218 30.026 -5.674 1.00 0.00 C ATOM 1088 O TRP A 76 10.844 30.977 -5.207 1.00 0.00 O ATOM 1089 CB TRP A 76 7.760 29.715 -5.326 1.00 0.00 C ATOM 1090 CG TRP A 76 6.669 30.710 -5.073 1.00 0.00 C ATOM 1091 CD1 TRP A 76 5.324 30.473 -5.086 1.00 0.00 C ATOM 1092 CD2 TRP A 76 6.830 32.101 -4.772 1.00 0.00 C ATOM 1093 NE1 TRP A 76 4.640 31.633 -4.811 1.00 0.00 N ATOM 1094 CE2 TRP A 76 5.541 32.645 -4.614 1.00 0.00 C ATOM 1095 CE3 TRP A 76 7.938 32.938 -4.619 1.00 0.00 C ATOM 1096 CZ2 TRP A 76 5.332 33.988 -4.311 1.00 0.00 C ATOM 1097 CZ3 TRP A 76 7.729 34.271 -4.319 1.00 0.00 C ATOM 1098 CH2 TRP A 76 6.435 34.785 -4.167 1.00 0.00 C ATOM 0 H TRP A 76 8.250 28.643 -7.533 1.00 0.00 H new ATOM 0 HA TRP A 76 8.685 31.291 -6.456 1.00 0.00 H new ATOM 0 HB2 TRP A 76 7.323 28.803 -5.733 1.00 0.00 H new ATOM 0 HB3 TRP A 76 8.226 29.449 -4.377 1.00 0.00 H new ATOM 0 HD1 TRP A 76 4.865 29.515 -5.283 1.00 0.00 H new ATOM 0 HE1 TRP A 76 3.625 31.725 -4.762 1.00 0.00 H new ATOM 0 HE3 TRP A 76 8.940 32.551 -4.733 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 4.335 34.386 -4.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 8.578 34.928 -4.200 1.00 0.00 H new ATOM 0 HH2 TRP A 76 6.305 35.831 -3.932 1.00 0.00 H new ATOM 1109 N VAL A 77 10.689 28.783 -5.679 1.00 0.00 N ATOM 1110 CA VAL A 77 11.998 28.459 -5.125 1.00 0.00 C ATOM 1111 C VAL A 77 13.116 29.067 -5.965 1.00 0.00 C ATOM 1112 O VAL A 77 14.179 29.413 -5.448 1.00 0.00 O ATOM 1113 CB VAL A 77 12.209 26.936 -5.034 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.268 26.327 -4.007 1.00 0.00 C ATOM 1115 CG2 VAL A 77 12.014 26.290 -6.397 1.00 0.00 C ATOM 0 H VAL A 77 10.183 27.984 -6.061 1.00 0.00 H new ATOM 0 HA VAL A 77 12.030 28.883 -4.121 1.00 0.00 H new ATOM 0 HB VAL A 77 13.232 26.747 -4.710 1.00 0.00 H new ATOM 0 HG11 VAL A 77 11.432 25.251 -3.957 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.461 26.769 -3.030 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.236 26.524 -4.297 1.00 0.00 H new ATOM 0 HG21 VAL A 77 12.167 25.214 -6.315 1.00 0.00 H new ATOM 0 HG22 VAL A 77 11.002 26.487 -6.752 1.00 0.00 H new ATOM 0 HG23 VAL A 77 12.733 26.706 -7.103 1.00 0.00 H new ATOM 1125 N LYS A 78 12.869 29.195 -7.264 1.00 0.00 N ATOM 1126 CA LYS A 78 13.853 29.763 -8.178 1.00 0.00 C ATOM 1127 C LYS A 78 14.216 31.187 -7.770 1.00 0.00 C ATOM 1128 O LYS A 78 13.513 32.139 -8.108 1.00 0.00 O ATOM 1129 CB LYS A 78 13.315 29.753 -9.610 1.00 0.00 C ATOM 1130 CG LYS A 78 13.915 28.661 -10.478 1.00 0.00 C ATOM 1131 CD LYS A 78 14.338 29.196 -11.836 1.00 0.00 C ATOM 1132 CE LYS A 78 13.142 29.396 -12.753 1.00 0.00 C ATOM 1133 NZ LYS A 78 13.199 30.704 -13.463 1.00 0.00 N ATOM 0 H LYS A 78 11.995 28.913 -7.708 1.00 0.00 H new ATOM 0 HA LYS A 78 14.753 29.150 -8.130 1.00 0.00 H new ATOM 0 HB2 LYS A 78 12.232 29.629 -9.581 1.00 0.00 H new ATOM 0 HB3 LYS A 78 13.513 30.721 -10.070 1.00 0.00 H new ATOM 0 HG2 LYS A 78 14.777 28.226 -9.973 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.187 27.861 -10.612 1.00 0.00 H new ATOM 0 HD2 LYS A 78 14.862 30.143 -11.708 1.00 0.00 H new ATOM 0 HD3 LYS A 78 15.041 28.503 -12.299 1.00 0.00 H new ATOM 0 HE2 LYS A 78 13.105 28.588 -13.483 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.223 29.340 -12.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.366 30.802 -14.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.208 31.477 -12.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.063 30.748 -14.041 1.00 0.00 H new ATOM 1147 N GLY A 79 15.321 31.327 -7.043 1.00 0.00 N ATOM 1148 CA GLY A 79 15.758 32.639 -6.603 1.00 0.00 C ATOM 1149 C GLY A 79 15.586 32.836 -5.110 1.00 0.00 C ATOM 1150 O GLY A 79 16.100 33.799 -4.540 1.00 0.00 O ATOM 0 H GLY A 79 15.921 30.555 -6.751 1.00 0.00 H new ATOM 0 HA2 GLY A 79 16.807 32.777 -6.866 1.00 0.00 H new ATOM 0 HA3 GLY A 79 15.193 33.404 -7.135 1.00 0.00 H new ATOM 1154 N LYS A 80 14.859 31.924 -4.474 1.00 0.00 N ATOM 1155 CA LYS A 80 14.619 32.002 -3.038 1.00 0.00 C ATOM 1156 C LYS A 80 15.738 31.315 -2.261 1.00 0.00 C ATOM 1157 O LYS A 80 16.475 30.497 -2.810 1.00 0.00 O ATOM 1158 CB LYS A 80 13.274 31.360 -2.689 1.00 0.00 C ATOM 1159 CG LYS A 80 12.397 32.228 -1.804 1.00 0.00 C ATOM 1160 CD LYS A 80 11.412 33.045 -2.624 1.00 0.00 C ATOM 1161 CE LYS A 80 10.048 33.109 -1.955 1.00 0.00 C ATOM 1162 NZ LYS A 80 9.311 31.820 -2.075 1.00 0.00 N ATOM 0 H LYS A 80 14.425 31.122 -4.931 1.00 0.00 H new ATOM 0 HA LYS A 80 14.597 33.055 -2.756 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.737 31.137 -3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.454 30.409 -2.187 1.00 0.00 H new ATOM 0 HG2 LYS A 80 11.852 31.598 -1.101 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.023 32.897 -1.214 1.00 0.00 H new ATOM 0 HD2 LYS A 80 11.800 34.055 -2.760 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.311 32.606 -3.617 1.00 0.00 H new ATOM 0 HE2 LYS A 80 10.171 33.360 -0.902 1.00 0.00 H new ATOM 0 HE3 LYS A 80 9.459 33.908 -2.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.738 31.667 -1.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 8.689 31.852 -2.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 9.991 31.040 -2.180 1.00 0.00 H new ATOM 1176 N SER A 81 15.857 31.653 -0.981 1.00 0.00 N ATOM 1177 CA SER A 81 16.888 31.070 -0.129 1.00 0.00 C ATOM 1178 C SER A 81 16.460 29.697 0.379 1.00 0.00 C ATOM 1179 O SER A 81 15.462 29.137 -0.075 1.00 0.00 O ATOM 1180 CB SER A 81 17.185 31.995 1.053 1.00 0.00 C ATOM 1181 OG SER A 81 16.077 32.067 1.935 1.00 0.00 O ATOM 0 H SER A 81 15.253 32.327 -0.511 1.00 0.00 H new ATOM 0 HA SER A 81 17.793 30.951 -0.724 1.00 0.00 H new ATOM 0 HB2 SER A 81 18.060 31.632 1.592 1.00 0.00 H new ATOM 0 HB3 SER A 81 17.428 32.992 0.686 1.00 0.00 H new ATOM 0 HG SER A 81 16.292 32.663 2.683 1.00 0.00 H new ATOM 1187 N LEU A 82 17.223 29.159 1.324 1.00 0.00 N ATOM 1188 CA LEU A 82 16.925 27.851 1.896 1.00 0.00 C ATOM 1189 C LEU A 82 15.808 27.950 2.931 1.00 0.00 C ATOM 1190 O LEU A 82 14.913 27.106 2.976 1.00 0.00 O ATOM 1191 CB LEU A 82 18.179 27.255 2.538 1.00 0.00 C ATOM 1192 CG LEU A 82 19.430 27.219 1.660 1.00 0.00 C ATOM 1193 CD1 LEU A 82 20.672 26.997 2.509 1.00 0.00 C ATOM 1194 CD2 LEU A 82 19.306 26.134 0.600 1.00 0.00 C ATOM 0 H LEU A 82 18.053 29.609 1.710 1.00 0.00 H new ATOM 0 HA LEU A 82 16.591 27.198 1.090 1.00 0.00 H new ATOM 0 HB2 LEU A 82 18.408 27.825 3.438 1.00 0.00 H new ATOM 0 HB3 LEU A 82 17.952 26.237 2.854 1.00 0.00 H new ATOM 0 HG LEU A 82 19.526 28.182 1.158 1.00 0.00 H new ATOM 0 HD11 LEU A 82 21.552 26.974 1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 82 20.770 27.809 3.230 1.00 0.00 H new ATOM 0 HD13 LEU A 82 20.585 26.049 3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 82 20.205 26.123 -0.016 1.00 0.00 H new ATOM 0 HD22 LEU A 82 19.185 25.165 1.084 1.00 0.00 H new ATOM 0 HD23 LEU A 82 18.439 26.336 -0.028 1.00 0.00 H new ATOM 1206 N ASP A 83 15.866 28.988 3.758 1.00 0.00 N ATOM 1207 CA ASP A 83 14.858 29.200 4.790 1.00 0.00 C ATOM 1208 C ASP A 83 13.539 29.659 4.176 1.00 0.00 C ATOM 1209 O ASP A 83 12.468 29.198 4.567 1.00 0.00 O ATOM 1210 CB ASP A 83 15.348 30.232 5.807 1.00 0.00 C ATOM 1211 CG ASP A 83 16.185 29.609 6.907 1.00 0.00 C ATOM 1212 OD1 ASP A 83 16.872 28.604 6.632 1.00 0.00 O ATOM 1213 OD2 ASP A 83 16.151 30.127 8.043 1.00 0.00 O ATOM 0 H ASP A 83 16.600 29.696 3.734 1.00 0.00 H new ATOM 0 HA ASP A 83 14.690 28.251 5.299 1.00 0.00 H new ATOM 0 HB2 ASP A 83 15.936 30.993 5.294 1.00 0.00 H new ATOM 0 HB3 ASP A 83 14.490 30.737 6.250 1.00 0.00 H new ATOM 1218 N GLU A 84 13.627 30.571 3.212 1.00 0.00 N ATOM 1219 CA GLU A 84 12.440 31.093 2.545 1.00 0.00 C ATOM 1220 C GLU A 84 11.607 29.961 1.952 1.00 0.00 C ATOM 1221 O GLU A 84 10.433 29.800 2.284 1.00 0.00 O ATOM 1222 CB GLU A 84 12.838 32.079 1.445 1.00 0.00 C ATOM 1223 CG GLU A 84 13.229 33.451 1.968 1.00 0.00 C ATOM 1224 CD GLU A 84 12.293 34.545 1.492 1.00 0.00 C ATOM 1225 OE1 GLU A 84 11.088 34.264 1.322 1.00 0.00 O ATOM 1226 OE2 GLU A 84 12.766 35.683 1.291 1.00 0.00 O ATOM 0 H GLU A 84 14.507 30.963 2.876 1.00 0.00 H new ATOM 0 HA GLU A 84 11.836 31.614 3.288 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.673 31.663 0.881 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.006 32.189 0.749 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.235 33.432 3.058 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.245 33.682 1.647 1.00 0.00 H new ATOM 1233 N ALA A 85 12.223 29.179 1.071 1.00 0.00 N ATOM 1234 CA ALA A 85 11.540 28.062 0.432 1.00 0.00 C ATOM 1235 C ALA A 85 10.964 27.104 1.470 1.00 0.00 C ATOM 1236 O ALA A 85 9.829 26.647 1.343 1.00 0.00 O ATOM 1237 CB ALA A 85 12.490 27.324 -0.499 1.00 0.00 C ATOM 0 H ALA A 85 13.194 29.299 0.784 1.00 0.00 H new ATOM 0 HA ALA A 85 10.713 28.462 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 85 11.966 26.492 -0.969 1.00 0.00 H new ATOM 0 HB2 ALA A 85 12.850 28.007 -1.268 1.00 0.00 H new ATOM 0 HB3 ALA A 85 13.336 26.943 0.072 1.00 0.00 H new ATOM 1243 N GLN A 86 11.756 26.805 2.495 1.00 0.00 N ATOM 1244 CA GLN A 86 11.324 25.900 3.554 1.00 0.00 C ATOM 1245 C GLN A 86 10.265 26.557 4.433 1.00 0.00 C ATOM 1246 O GLN A 86 9.607 25.891 5.232 1.00 0.00 O ATOM 1247 CB GLN A 86 12.519 25.473 4.408 1.00 0.00 C ATOM 1248 CG GLN A 86 12.438 24.035 4.892 1.00 0.00 C ATOM 1249 CD GLN A 86 12.619 23.913 6.393 1.00 0.00 C ATOM 1250 OE1 GLN A 86 13.579 23.305 6.867 1.00 0.00 O ATOM 1251 NE2 GLN A 86 11.693 24.492 7.149 1.00 0.00 N ATOM 0 H GLN A 86 12.699 27.176 2.615 1.00 0.00 H new ATOM 0 HA GLN A 86 10.886 25.018 3.087 1.00 0.00 H new ATOM 0 HB2 GLN A 86 13.433 25.602 3.829 1.00 0.00 H new ATOM 0 HB3 GLN A 86 12.593 26.134 5.271 1.00 0.00 H new ATOM 0 HG2 GLN A 86 11.472 23.615 4.611 1.00 0.00 H new ATOM 0 HG3 GLN A 86 13.202 23.443 4.388 1.00 0.00 H new ATOM 0 HE21 GLN A 86 10.914 24.986 6.713 1.00 0.00 H new ATOM 0 HE22 GLN A 86 11.761 24.443 8.166 1.00 0.00 H new ATOM 1260 N ALA A 87 10.105 27.867 4.280 1.00 0.00 N ATOM 1261 CA ALA A 87 9.124 28.614 5.059 1.00 0.00 C ATOM 1262 C ALA A 87 7.747 28.557 4.406 1.00 0.00 C ATOM 1263 O ALA A 87 6.729 28.772 5.064 1.00 0.00 O ATOM 1264 CB ALA A 87 9.572 30.058 5.226 1.00 0.00 C ATOM 0 H ALA A 87 10.642 28.434 3.624 1.00 0.00 H new ATOM 0 HA ALA A 87 9.050 28.152 6.044 1.00 0.00 H new ATOM 0 HB1 ALA A 87 8.830 30.604 5.809 1.00 0.00 H new ATOM 0 HB2 ALA A 87 10.531 30.084 5.743 1.00 0.00 H new ATOM 0 HB3 ALA A 87 9.676 30.522 4.245 1.00 0.00 H new ATOM 1270 N ILE A 88 7.723 28.266 3.110 1.00 0.00 N ATOM 1271 CA ILE A 88 6.471 28.181 2.370 1.00 0.00 C ATOM 1272 C ILE A 88 5.475 27.268 3.077 1.00 0.00 C ATOM 1273 O ILE A 88 5.850 26.236 3.634 1.00 0.00 O ATOM 1274 CB ILE A 88 6.697 27.664 0.937 1.00 0.00 C ATOM 1275 CG1 ILE A 88 7.626 28.608 0.171 1.00 0.00 C ATOM 1276 CG2 ILE A 88 5.368 27.515 0.211 1.00 0.00 C ATOM 1277 CD1 ILE A 88 8.142 28.027 -1.127 1.00 0.00 C ATOM 0 H ILE A 88 8.557 28.085 2.551 1.00 0.00 H new ATOM 0 HA ILE A 88 6.064 29.191 2.323 1.00 0.00 H new ATOM 0 HB ILE A 88 7.171 26.684 0.991 1.00 0.00 H new ATOM 0 HG12 ILE A 88 7.094 29.535 -0.042 1.00 0.00 H new ATOM 0 HG13 ILE A 88 8.473 28.866 0.807 1.00 0.00 H new ATOM 0 HG21 ILE A 88 5.545 27.149 -0.800 1.00 0.00 H new ATOM 0 HG22 ILE A 88 4.737 26.807 0.748 1.00 0.00 H new ATOM 0 HG23 ILE A 88 4.868 28.483 0.164 1.00 0.00 H new ATOM 0 HD11 ILE A 88 8.794 28.751 -1.616 1.00 0.00 H new ATOM 0 HD12 ILE A 88 8.703 27.115 -0.920 1.00 0.00 H new ATOM 0 HD13 ILE A 88 7.302 27.795 -1.781 1.00 0.00 H new ATOM 1289 N LYS A 89 4.204 27.653 3.049 1.00 0.00 N ATOM 1290 CA LYS A 89 3.152 26.868 3.684 1.00 0.00 C ATOM 1291 C LYS A 89 2.184 26.312 2.644 1.00 0.00 C ATOM 1292 O LYS A 89 1.757 27.025 1.737 1.00 0.00 O ATOM 1293 CB LYS A 89 2.391 27.724 4.699 1.00 0.00 C ATOM 1294 CG LYS A 89 3.129 27.910 6.013 1.00 0.00 C ATOM 1295 CD LYS A 89 3.876 29.233 6.050 1.00 0.00 C ATOM 1296 CE LYS A 89 4.779 29.329 7.270 1.00 0.00 C ATOM 1297 NZ LYS A 89 4.039 29.802 8.472 1.00 0.00 N ATOM 0 H LYS A 89 3.877 28.505 2.593 1.00 0.00 H new ATOM 0 HA LYS A 89 3.620 26.031 4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.194 28.703 4.261 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.423 27.263 4.898 1.00 0.00 H new ATOM 0 HG2 LYS A 89 2.419 27.869 6.839 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.832 27.090 6.156 1.00 0.00 H new ATOM 0 HD2 LYS A 89 4.473 29.340 5.145 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.161 30.056 6.060 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.218 28.352 7.475 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.603 30.011 7.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 4.689 29.854 9.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 3.641 30.745 8.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.268 29.138 8.689 1.00 0.00 H new ATOM 1311 N ASN A 90 1.842 25.036 2.783 1.00 0.00 N ATOM 1312 CA ASN A 90 0.924 24.385 1.855 1.00 0.00 C ATOM 1313 C ASN A 90 -0.326 25.234 1.642 1.00 0.00 C ATOM 1314 O ASN A 90 -0.882 25.276 0.544 1.00 0.00 O ATOM 1315 CB ASN A 90 0.531 23.002 2.379 1.00 0.00 C ATOM 1316 CG ASN A 90 -0.539 23.073 3.452 1.00 0.00 C ATOM 1317 OD1 ASN A 90 -0.236 23.203 4.638 1.00 0.00 O ATOM 1318 ND2 ASN A 90 -1.798 22.987 3.038 1.00 0.00 N ATOM 0 H ASN A 90 2.186 24.432 3.529 1.00 0.00 H new ATOM 0 HA ASN A 90 1.433 24.272 0.898 1.00 0.00 H new ATOM 0 HB2 ASN A 90 0.171 22.391 1.551 1.00 0.00 H new ATOM 0 HB3 ASN A 90 1.413 22.505 2.782 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -2.561 23.028 3.714 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -2.002 22.880 2.044 1.00 0.00 H new ATOM 1325 N THR A 91 -0.762 25.911 2.699 1.00 0.00 N ATOM 1326 CA THR A 91 -1.946 26.759 2.629 1.00 0.00 C ATOM 1327 C THR A 91 -1.870 27.712 1.441 1.00 0.00 C ATOM 1328 O THR A 91 -2.883 28.013 0.809 1.00 0.00 O ATOM 1329 CB THR A 91 -2.127 27.580 3.920 1.00 0.00 C ATOM 1330 OG1 THR A 91 -3.306 28.387 3.825 1.00 0.00 O ATOM 1331 CG2 THR A 91 -0.917 28.466 4.171 1.00 0.00 C ATOM 0 H THR A 91 -0.313 25.889 3.615 1.00 0.00 H new ATOM 0 HA THR A 91 -2.802 26.096 2.506 1.00 0.00 H new ATOM 0 HB THR A 91 -2.229 26.887 4.755 1.00 0.00 H new ATOM 0 HG1 THR A 91 -3.415 28.905 4.650 1.00 0.00 H new ATOM 0 HG21 THR A 91 -1.067 29.036 5.088 1.00 0.00 H new ATOM 0 HG22 THR A 91 -0.026 27.846 4.272 1.00 0.00 H new ATOM 0 HG23 THR A 91 -0.789 29.152 3.334 1.00 0.00 H new ATOM 1339 N ASP A 92 -0.664 28.182 1.142 1.00 0.00 N ATOM 1340 CA ASP A 92 -0.456 29.100 0.028 1.00 0.00 C ATOM 1341 C ASP A 92 -0.545 28.365 -1.305 1.00 0.00 C ATOM 1342 O ASP A 92 -1.087 28.890 -2.279 1.00 0.00 O ATOM 1343 CB ASP A 92 0.904 29.789 0.155 1.00 0.00 C ATOM 1344 CG ASP A 92 0.790 31.199 0.702 1.00 0.00 C ATOM 1345 OD1 ASP A 92 0.240 32.068 -0.007 1.00 0.00 O ATOM 1346 OD2 ASP A 92 1.251 31.433 1.838 1.00 0.00 O ATOM 0 H ASP A 92 0.184 27.943 1.655 1.00 0.00 H new ATOM 0 HA ASP A 92 -1.242 29.855 0.059 1.00 0.00 H new ATOM 0 HB2 ASP A 92 1.547 29.200 0.809 1.00 0.00 H new ATOM 0 HB3 ASP A 92 1.385 29.819 -0.822 1.00 0.00 H new ATOM 1351 N ILE A 93 -0.010 27.150 -1.342 1.00 0.00 N ATOM 1352 CA ILE A 93 -0.030 26.343 -2.556 1.00 0.00 C ATOM 1353 C ILE A 93 -1.433 25.823 -2.848 1.00 0.00 C ATOM 1354 O ILE A 93 -1.809 25.637 -4.005 1.00 0.00 O ATOM 1355 CB ILE A 93 0.937 25.149 -2.455 1.00 0.00 C ATOM 1356 CG1 ILE A 93 2.383 25.641 -2.370 1.00 0.00 C ATOM 1357 CG2 ILE A 93 0.757 24.219 -3.646 1.00 0.00 C ATOM 1358 CD1 ILE A 93 2.802 26.050 -0.975 1.00 0.00 C ATOM 0 H ILE A 93 0.443 26.702 -0.545 1.00 0.00 H new ATOM 0 HA ILE A 93 0.291 26.992 -3.371 1.00 0.00 H new ATOM 0 HB ILE A 93 0.709 24.592 -1.546 1.00 0.00 H new ATOM 0 HG12 ILE A 93 3.048 24.853 -2.724 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.509 26.490 -3.042 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.448 23.380 -3.560 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -0.267 23.846 -3.665 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.961 24.764 -4.567 1.00 0.00 H new ATOM 0 HD11 ILE A 93 3.838 26.388 -0.991 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.162 26.860 -0.626 1.00 0.00 H new ATOM 0 HD13 ILE A 93 2.708 25.197 -0.302 1.00 0.00 H new ATOM 1370 N ALA A 94 -2.205 25.593 -1.791 1.00 0.00 N ATOM 1371 CA ALA A 94 -3.569 25.099 -1.933 1.00 0.00 C ATOM 1372 C ALA A 94 -4.488 26.178 -2.495 1.00 0.00 C ATOM 1373 O ALA A 94 -5.277 25.921 -3.404 1.00 0.00 O ATOM 1374 CB ALA A 94 -4.092 24.602 -0.594 1.00 0.00 C ATOM 0 H ALA A 94 -1.909 25.741 -0.826 1.00 0.00 H new ATOM 0 HA ALA A 94 -3.556 24.267 -2.637 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.112 24.236 -0.715 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -3.457 23.793 -0.233 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -4.083 25.420 0.126 1.00 0.00 H new ATOM 1380 N GLU A 95 -4.380 27.385 -1.949 1.00 0.00 N ATOM 1381 CA GLU A 95 -5.203 28.502 -2.396 1.00 0.00 C ATOM 1382 C GLU A 95 -4.669 29.083 -3.702 1.00 0.00 C ATOM 1383 O GLU A 95 -5.407 29.712 -4.460 1.00 0.00 O ATOM 1384 CB GLU A 95 -5.252 29.591 -1.322 1.00 0.00 C ATOM 1385 CG GLU A 95 -3.884 30.131 -0.941 1.00 0.00 C ATOM 1386 CD GLU A 95 -3.678 31.566 -1.387 1.00 0.00 C ATOM 1387 OE1 GLU A 95 -4.059 31.891 -2.531 1.00 0.00 O ATOM 1388 OE2 GLU A 95 -3.137 32.363 -0.593 1.00 0.00 O ATOM 0 H GLU A 95 -3.731 27.614 -1.197 1.00 0.00 H new ATOM 0 HA GLU A 95 -6.212 28.129 -2.570 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.872 30.414 -1.679 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.736 29.190 -0.432 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -3.762 30.069 0.140 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.113 29.502 -1.385 1.00 0.00 H new ATOM 1395 N GLU A 96 -3.382 28.868 -3.956 1.00 0.00 N ATOM 1396 CA GLU A 96 -2.749 29.372 -5.169 1.00 0.00 C ATOM 1397 C GLU A 96 -3.412 28.786 -6.412 1.00 0.00 C ATOM 1398 O GLU A 96 -3.726 29.507 -7.361 1.00 0.00 O ATOM 1399 CB GLU A 96 -1.256 29.038 -5.168 1.00 0.00 C ATOM 1400 CG GLU A 96 -0.371 30.205 -4.762 1.00 0.00 C ATOM 1401 CD GLU A 96 -0.085 31.148 -5.914 1.00 0.00 C ATOM 1402 OE1 GLU A 96 -1.028 31.464 -6.670 1.00 0.00 O ATOM 1403 OE2 GLU A 96 1.081 31.569 -6.061 1.00 0.00 O ATOM 0 H GLU A 96 -2.758 28.349 -3.339 1.00 0.00 H new ATOM 0 HA GLU A 96 -2.871 30.455 -5.189 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -1.079 28.205 -4.488 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -0.967 28.703 -6.164 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -0.853 30.758 -3.956 1.00 0.00 H new ATOM 0 HG3 GLU A 96 0.571 29.822 -4.368 1.00 0.00 H new ATOM 1410 N LEU A 97 -3.622 27.474 -6.401 1.00 0.00 N ATOM 1411 CA LEU A 97 -4.247 26.790 -7.527 1.00 0.00 C ATOM 1412 C LEU A 97 -5.699 26.442 -7.215 1.00 0.00 C ATOM 1413 O LEU A 97 -6.470 26.096 -8.109 1.00 0.00 O ATOM 1414 CB LEU A 97 -3.469 25.519 -7.872 1.00 0.00 C ATOM 1415 CG LEU A 97 -2.214 25.711 -8.724 1.00 0.00 C ATOM 1416 CD1 LEU A 97 -2.564 26.366 -10.051 1.00 0.00 C ATOM 1417 CD2 LEU A 97 -1.182 26.540 -7.974 1.00 0.00 C ATOM 0 H LEU A 97 -3.368 26.863 -5.625 1.00 0.00 H new ATOM 0 HA LEU A 97 -4.230 27.463 -8.384 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -3.181 25.030 -6.942 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -4.139 24.838 -8.396 1.00 0.00 H new ATOM 0 HG LEU A 97 -1.784 24.730 -8.929 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.658 26.494 -10.643 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -3.267 25.734 -10.594 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.019 27.340 -9.868 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.296 26.666 -8.596 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -1.602 27.518 -7.738 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -0.908 26.031 -7.050 1.00 0.00 H new ATOM 1429 N GLU A 98 -6.065 26.539 -5.941 1.00 0.00 N ATOM 1430 CA GLU A 98 -7.425 26.235 -5.512 1.00 0.00 C ATOM 1431 C GLU A 98 -7.803 24.803 -5.876 1.00 0.00 C ATOM 1432 O GLU A 98 -8.577 24.570 -6.806 1.00 0.00 O ATOM 1433 CB GLU A 98 -8.414 27.213 -6.149 1.00 0.00 C ATOM 1434 CG GLU A 98 -8.602 28.494 -5.353 1.00 0.00 C ATOM 1435 CD GLU A 98 -9.986 29.090 -5.523 1.00 0.00 C ATOM 1436 OE1 GLU A 98 -10.225 29.751 -6.555 1.00 0.00 O ATOM 1437 OE2 GLU A 98 -10.830 28.893 -4.624 1.00 0.00 O ATOM 0 H GLU A 98 -5.439 26.826 -5.188 1.00 0.00 H new ATOM 0 HA GLU A 98 -7.469 26.339 -4.428 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -8.068 27.466 -7.151 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -9.379 26.719 -6.260 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.426 28.290 -4.297 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.855 29.224 -5.665 1.00 0.00 H new ATOM 1444 N LEU A 99 -7.253 23.846 -5.137 1.00 0.00 N ATOM 1445 CA LEU A 99 -7.531 22.435 -5.381 1.00 0.00 C ATOM 1446 C LEU A 99 -8.903 22.048 -4.838 1.00 0.00 C ATOM 1447 O LEU A 99 -9.334 22.515 -3.783 1.00 0.00 O ATOM 1448 CB LEU A 99 -6.452 21.563 -4.739 1.00 0.00 C ATOM 1449 CG LEU A 99 -5.576 20.759 -5.701 1.00 0.00 C ATOM 1450 CD1 LEU A 99 -4.567 21.666 -6.388 1.00 0.00 C ATOM 1451 CD2 LEU A 99 -4.869 19.632 -4.964 1.00 0.00 C ATOM 0 H LEU A 99 -6.612 24.021 -4.364 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.528 22.271 -6.459 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -5.805 22.204 -4.140 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.936 20.868 -4.053 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.217 20.319 -6.465 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.952 21.077 -7.069 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.094 22.437 -6.950 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -3.930 22.135 -5.638 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.250 19.071 -5.664 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.240 20.050 -4.178 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -5.610 18.967 -4.520 1.00 0.00 H new ATOM 1463 N PRO A 100 -9.606 21.174 -5.573 1.00 0.00 N ATOM 1464 CA PRO A 100 -10.939 20.703 -5.183 1.00 0.00 C ATOM 1465 C PRO A 100 -10.897 19.792 -3.961 1.00 0.00 C ATOM 1466 O PRO A 100 -9.889 19.148 -3.672 1.00 0.00 O ATOM 1467 CB PRO A 100 -11.415 19.927 -6.413 1.00 0.00 C ATOM 1468 CG PRO A 100 -10.163 19.491 -7.093 1.00 0.00 C ATOM 1469 CD PRO A 100 -9.155 20.577 -6.841 1.00 0.00 C ATOM 0 HA PRO A 100 -11.596 21.526 -4.901 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -12.029 19.073 -6.129 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -12.023 20.554 -7.066 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.816 18.537 -6.697 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -10.327 19.352 -8.161 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -8.145 20.176 -6.759 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -9.143 21.309 -7.648 1.00 0.00 H new ATOM 1477 N PRO A 101 -12.017 19.735 -3.226 1.00 0.00 N ATOM 1478 CA PRO A 101 -12.134 18.905 -2.023 1.00 0.00 C ATOM 1479 C PRO A 101 -12.154 17.415 -2.347 1.00 0.00 C ATOM 1480 O PRO A 101 -13.144 16.728 -2.096 1.00 0.00 O ATOM 1481 CB PRO A 101 -13.472 19.339 -1.420 1.00 0.00 C ATOM 1482 CG PRO A 101 -14.257 19.858 -2.575 1.00 0.00 C ATOM 1483 CD PRO A 101 -13.257 20.477 -3.512 1.00 0.00 C ATOM 0 HA PRO A 101 -11.286 19.039 -1.352 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -13.980 18.503 -0.940 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -13.333 20.107 -0.659 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -14.806 19.055 -3.066 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -14.992 20.593 -2.248 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -13.560 20.367 -4.553 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -13.139 21.544 -3.326 1.00 0.00 H new ATOM 1491 N VAL A 102 -11.054 16.921 -2.907 1.00 0.00 N ATOM 1492 CA VAL A 102 -10.945 15.511 -3.264 1.00 0.00 C ATOM 1493 C VAL A 102 -9.598 14.939 -2.838 1.00 0.00 C ATOM 1494 O VAL A 102 -9.506 13.786 -2.415 1.00 0.00 O ATOM 1495 CB VAL A 102 -11.124 15.301 -4.779 1.00 0.00 C ATOM 1496 CG1 VAL A 102 -12.541 15.656 -5.204 1.00 0.00 C ATOM 1497 CG2 VAL A 102 -10.105 16.121 -5.555 1.00 0.00 C ATOM 0 H VAL A 102 -10.226 17.476 -3.123 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.742 14.988 -2.735 1.00 0.00 H new ATOM 0 HB VAL A 102 -10.956 14.248 -5.004 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -12.648 15.501 -6.278 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -13.250 15.021 -4.673 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -12.741 16.701 -4.966 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.246 15.960 -6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -10.239 17.178 -5.326 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.098 15.813 -5.272 1.00 0.00 H new ATOM 1507 N LYS A 103 -8.553 15.752 -2.952 1.00 0.00 N ATOM 1508 CA LYS A 103 -7.209 15.329 -2.578 1.00 0.00 C ATOM 1509 C LYS A 103 -6.349 16.528 -2.190 1.00 0.00 C ATOM 1510 O LYS A 103 -5.266 16.729 -2.739 1.00 0.00 O ATOM 1511 CB LYS A 103 -6.552 14.568 -3.731 1.00 0.00 C ATOM 1512 CG LYS A 103 -5.505 13.564 -3.279 1.00 0.00 C ATOM 1513 CD LYS A 103 -5.826 12.164 -3.774 1.00 0.00 C ATOM 1514 CE LYS A 103 -7.093 11.622 -3.130 1.00 0.00 C ATOM 1515 NZ LYS A 103 -7.207 10.145 -3.287 1.00 0.00 N ATOM 0 H LYS A 103 -8.612 16.709 -3.301 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.290 14.668 -1.715 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -7.323 14.046 -4.297 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -6.088 15.284 -4.410 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -4.526 13.866 -3.650 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.447 13.562 -2.191 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.945 12.178 -4.857 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.991 11.499 -3.554 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -7.099 11.876 -2.070 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -7.963 12.103 -3.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -8.083 9.814 -2.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -7.227 9.904 -4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -6.390 9.684 -2.837 1.00 0.00 H new ATOM 1529 N ILE A 104 -6.839 17.320 -1.242 1.00 0.00 N ATOM 1530 CA ILE A 104 -6.113 18.496 -0.780 1.00 0.00 C ATOM 1531 C ILE A 104 -4.664 18.155 -0.453 1.00 0.00 C ATOM 1532 O ILE A 104 -3.785 19.016 -0.503 1.00 0.00 O ATOM 1533 CB ILE A 104 -6.777 19.115 0.464 1.00 0.00 C ATOM 1534 CG1 ILE A 104 -8.233 19.478 0.165 1.00 0.00 C ATOM 1535 CG2 ILE A 104 -6.003 20.342 0.923 1.00 0.00 C ATOM 1536 CD1 ILE A 104 -8.388 20.479 -0.958 1.00 0.00 C ATOM 0 H ILE A 104 -7.735 17.168 -0.779 1.00 0.00 H new ATOM 0 HA ILE A 104 -6.138 19.221 -1.593 1.00 0.00 H new ATOM 0 HB ILE A 104 -6.764 18.379 1.268 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.780 18.570 -0.090 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.691 19.883 1.068 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -6.485 20.768 1.803 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -4.981 20.056 1.172 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -5.988 21.083 0.123 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -9.446 20.689 -1.115 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -7.869 21.402 -0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -7.960 20.069 -1.873 1.00 0.00 H new ATOM 1548 N HIS A 105 -4.420 16.892 -0.118 1.00 0.00 N ATOM 1549 CA HIS A 105 -3.076 16.435 0.216 1.00 0.00 C ATOM 1550 C HIS A 105 -2.093 16.776 -0.901 1.00 0.00 C ATOM 1551 O HIS A 105 -0.887 16.878 -0.670 1.00 0.00 O ATOM 1552 CB HIS A 105 -3.074 14.927 0.469 1.00 0.00 C ATOM 1553 CG HIS A 105 -3.343 14.559 1.896 1.00 0.00 C ATOM 1554 ND1 HIS A 105 -2.683 15.138 2.959 1.00 0.00 N ATOM 1555 CD2 HIS A 105 -4.208 13.667 2.432 1.00 0.00 C ATOM 1556 CE1 HIS A 105 -3.128 14.615 4.088 1.00 0.00 C ATOM 1557 NE2 HIS A 105 -4.055 13.720 3.795 1.00 0.00 N ATOM 0 H HIS A 105 -5.136 16.167 -0.071 1.00 0.00 H new ATOM 0 HA HIS A 105 -2.760 16.948 1.124 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -3.826 14.459 -0.166 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.108 14.518 0.173 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.892 13.032 1.888 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -2.791 14.875 5.081 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.573 13.160 4.472 1.00 0.00 H new ATOM 1565 N CYS A 106 -2.616 16.951 -2.109 1.00 0.00 N ATOM 1566 CA CYS A 106 -1.785 17.280 -3.262 1.00 0.00 C ATOM 1567 C CYS A 106 -1.115 18.638 -3.080 1.00 0.00 C ATOM 1568 O CYS A 106 -0.116 18.940 -3.732 1.00 0.00 O ATOM 1569 CB CYS A 106 -2.625 17.278 -4.540 1.00 0.00 C ATOM 1570 SG CYS A 106 -2.465 15.772 -5.527 1.00 0.00 S ATOM 0 H CYS A 106 -3.612 16.871 -2.316 1.00 0.00 H new ATOM 0 HA CYS A 106 -1.007 16.521 -3.347 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -3.673 17.415 -4.273 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -2.338 18.133 -5.152 1.00 0.00 H new ATOM 0 HG CYS A 106 -3.214 15.865 -6.585 1.00 0.00 H new ATOM 1576 N SER A 107 -1.674 19.453 -2.192 1.00 0.00 N ATOM 1577 CA SER A 107 -1.135 20.782 -1.929 1.00 0.00 C ATOM 1578 C SER A 107 0.004 20.715 -0.916 1.00 0.00 C ATOM 1579 O SER A 107 0.990 21.446 -1.024 1.00 0.00 O ATOM 1580 CB SER A 107 -2.236 21.710 -1.413 1.00 0.00 C ATOM 1581 OG SER A 107 -2.142 21.884 -0.010 1.00 0.00 O ATOM 0 H SER A 107 -2.500 19.217 -1.642 1.00 0.00 H new ATOM 0 HA SER A 107 -0.744 21.180 -2.865 1.00 0.00 H new ATOM 0 HB2 SER A 107 -2.161 22.678 -1.908 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.212 21.297 -1.667 1.00 0.00 H new ATOM 0 HG SER A 107 -3.019 21.726 0.399 1.00 0.00 H new ATOM 1587 N ILE A 108 -0.139 19.834 0.068 1.00 0.00 N ATOM 1588 CA ILE A 108 0.878 19.670 1.100 1.00 0.00 C ATOM 1589 C ILE A 108 2.135 19.017 0.535 1.00 0.00 C ATOM 1590 O ILE A 108 3.239 19.230 1.038 1.00 0.00 O ATOM 1591 CB ILE A 108 0.356 18.821 2.275 1.00 0.00 C ATOM 1592 CG1 ILE A 108 -0.741 19.575 3.029 1.00 0.00 C ATOM 1593 CG2 ILE A 108 1.497 18.457 3.213 1.00 0.00 C ATOM 1594 CD1 ILE A 108 -2.098 19.492 2.364 1.00 0.00 C ATOM 0 H ILE A 108 -0.949 19.223 0.173 1.00 0.00 H new ATOM 0 HA ILE A 108 1.122 20.668 1.463 1.00 0.00 H new ATOM 0 HB ILE A 108 -0.070 17.900 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -0.816 19.175 4.040 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -0.454 20.622 3.121 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.113 17.857 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.248 17.885 2.668 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.949 19.367 3.606 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.827 20.049 2.953 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -2.039 19.918 1.363 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -2.407 18.449 2.297 1.00 0.00 H new ATOM 1606 N LEU A 109 1.961 18.222 -0.515 1.00 0.00 N ATOM 1607 CA LEU A 109 3.081 17.538 -1.152 1.00 0.00 C ATOM 1608 C LEU A 109 3.914 18.513 -1.979 1.00 0.00 C ATOM 1609 O LEU A 109 5.112 18.308 -2.176 1.00 0.00 O ATOM 1610 CB LEU A 109 2.573 16.402 -2.041 1.00 0.00 C ATOM 1611 CG LEU A 109 2.169 15.115 -1.320 1.00 0.00 C ATOM 1612 CD1 LEU A 109 0.850 14.590 -1.863 1.00 0.00 C ATOM 1613 CD2 LEU A 109 3.261 14.063 -1.456 1.00 0.00 C ATOM 0 H LEU A 109 1.054 18.035 -0.944 1.00 0.00 H new ATOM 0 HA LEU A 109 3.713 17.121 -0.368 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.713 16.765 -2.604 1.00 0.00 H new ATOM 0 HB3 LEU A 109 3.350 16.160 -2.766 1.00 0.00 H new ATOM 0 HG LEU A 109 2.038 15.340 -0.262 1.00 0.00 H new ATOM 0 HD11 LEU A 109 0.579 13.674 -1.338 1.00 0.00 H new ATOM 0 HD12 LEU A 109 0.071 15.338 -1.713 1.00 0.00 H new ATOM 0 HD13 LEU A 109 0.952 14.381 -2.928 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.957 13.154 -0.937 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.424 13.842 -2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 109 4.185 14.439 -1.017 1.00 0.00 H new ATOM 1625 N ALA A 110 3.273 19.573 -2.457 1.00 0.00 N ATOM 1626 CA ALA A 110 3.955 20.581 -3.259 1.00 0.00 C ATOM 1627 C ALA A 110 5.010 21.315 -2.437 1.00 0.00 C ATOM 1628 O ALA A 110 6.126 21.541 -2.903 1.00 0.00 O ATOM 1629 CB ALA A 110 2.950 21.569 -3.833 1.00 0.00 C ATOM 0 H ALA A 110 2.282 19.757 -2.303 1.00 0.00 H new ATOM 0 HA ALA A 110 4.460 20.074 -4.081 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.474 22.316 -4.430 1.00 0.00 H new ATOM 0 HB2 ALA A 110 2.236 21.038 -4.462 1.00 0.00 H new ATOM 0 HB3 ALA A 110 2.419 22.062 -3.019 1.00 0.00 H new ATOM 1635 N GLU A 111 4.647 21.685 -1.213 1.00 0.00 N ATOM 1636 CA GLU A 111 5.563 22.394 -0.327 1.00 0.00 C ATOM 1637 C GLU A 111 6.522 21.423 0.356 1.00 0.00 C ATOM 1638 O GLU A 111 7.603 21.810 0.800 1.00 0.00 O ATOM 1639 CB GLU A 111 4.781 23.182 0.726 1.00 0.00 C ATOM 1640 CG GLU A 111 3.981 22.304 1.673 1.00 0.00 C ATOM 1641 CD GLU A 111 4.300 22.574 3.130 1.00 0.00 C ATOM 1642 OE1 GLU A 111 5.471 22.886 3.434 1.00 0.00 O ATOM 1643 OE2 GLU A 111 3.379 22.474 3.968 1.00 0.00 O ATOM 0 H GLU A 111 3.726 21.506 -0.813 1.00 0.00 H new ATOM 0 HA GLU A 111 6.147 23.089 -0.931 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.478 23.787 1.306 1.00 0.00 H new ATOM 0 HB3 GLU A 111 4.103 23.871 0.223 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.917 22.467 1.502 1.00 0.00 H new ATOM 0 HG3 GLU A 111 4.183 21.257 1.449 1.00 0.00 H new ATOM 1650 N ASP A 112 6.117 20.160 0.436 1.00 0.00 N ATOM 1651 CA ASP A 112 6.939 19.133 1.064 1.00 0.00 C ATOM 1652 C ASP A 112 8.018 18.638 0.106 1.00 0.00 C ATOM 1653 O ASP A 112 9.070 18.162 0.531 1.00 0.00 O ATOM 1654 CB ASP A 112 6.068 17.961 1.520 1.00 0.00 C ATOM 1655 CG ASP A 112 5.310 18.265 2.798 1.00 0.00 C ATOM 1656 OD1 ASP A 112 5.066 19.459 3.072 1.00 0.00 O ATOM 1657 OD2 ASP A 112 4.961 17.310 3.522 1.00 0.00 O ATOM 0 H ASP A 112 5.225 19.823 0.074 1.00 0.00 H new ATOM 0 HA ASP A 112 7.426 19.574 1.934 1.00 0.00 H new ATOM 0 HB2 ASP A 112 5.359 17.711 0.731 1.00 0.00 H new ATOM 0 HB3 ASP A 112 6.696 17.084 1.674 1.00 0.00 H new ATOM 1662 N ALA A 113 7.748 18.753 -1.191 1.00 0.00 N ATOM 1663 CA ALA A 113 8.695 18.319 -2.210 1.00 0.00 C ATOM 1664 C ALA A 113 9.860 19.296 -2.328 1.00 0.00 C ATOM 1665 O ALA A 113 11.019 18.887 -2.406 1.00 0.00 O ATOM 1666 CB ALA A 113 7.994 18.166 -3.551 1.00 0.00 C ATOM 0 H ALA A 113 6.881 19.143 -1.560 1.00 0.00 H new ATOM 0 HA ALA A 113 9.096 17.351 -1.910 1.00 0.00 H new ATOM 0 HB1 ALA A 113 8.713 17.841 -4.303 1.00 0.00 H new ATOM 0 HB2 ALA A 113 7.200 17.424 -3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 113 7.565 19.123 -3.849 1.00 0.00 H new ATOM 1672 N ILE A 114 9.545 20.587 -2.342 1.00 0.00 N ATOM 1673 CA ILE A 114 10.566 21.621 -2.450 1.00 0.00 C ATOM 1674 C ILE A 114 11.506 21.594 -1.250 1.00 0.00 C ATOM 1675 O ILE A 114 12.708 21.828 -1.382 1.00 0.00 O ATOM 1676 CB ILE A 114 9.938 23.022 -2.565 1.00 0.00 C ATOM 1677 CG1 ILE A 114 9.061 23.313 -1.346 1.00 0.00 C ATOM 1678 CG2 ILE A 114 9.127 23.136 -3.847 1.00 0.00 C ATOM 1679 CD1 ILE A 114 8.339 24.640 -1.424 1.00 0.00 C ATOM 0 H ILE A 114 8.591 20.941 -2.280 1.00 0.00 H new ATOM 0 HA ILE A 114 11.133 21.410 -3.357 1.00 0.00 H new ATOM 0 HB ILE A 114 10.739 23.761 -2.598 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.327 22.515 -1.238 1.00 0.00 H new ATOM 0 HG13 ILE A 114 9.682 23.298 -0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.690 24.132 -3.913 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.777 22.967 -4.705 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.332 22.390 -3.842 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.736 24.780 -0.527 1.00 0.00 H new ATOM 0 HD12 ILE A 114 9.068 25.447 -1.501 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.692 24.651 -2.301 1.00 0.00 H new ATOM 1691 N LYS A 115 10.951 21.305 -0.078 1.00 0.00 N ATOM 1692 CA LYS A 115 11.739 21.244 1.148 1.00 0.00 C ATOM 1693 C LYS A 115 12.671 20.037 1.136 1.00 0.00 C ATOM 1694 O LYS A 115 13.814 20.118 1.585 1.00 0.00 O ATOM 1695 CB LYS A 115 10.817 21.178 2.368 1.00 0.00 C ATOM 1696 CG LYS A 115 11.560 21.206 3.693 1.00 0.00 C ATOM 1697 CD LYS A 115 11.935 19.806 4.151 1.00 0.00 C ATOM 1698 CE LYS A 115 13.361 19.757 4.679 1.00 0.00 C ATOM 1699 NZ LYS A 115 13.696 18.422 5.248 1.00 0.00 N ATOM 0 H LYS A 115 9.958 21.109 0.049 1.00 0.00 H new ATOM 0 HA LYS A 115 12.345 22.148 1.207 1.00 0.00 H new ATOM 0 HB2 LYS A 115 10.121 22.016 2.333 1.00 0.00 H new ATOM 0 HB3 LYS A 115 10.221 20.267 2.314 1.00 0.00 H new ATOM 0 HG2 LYS A 115 12.461 21.811 3.593 1.00 0.00 H new ATOM 0 HG3 LYS A 115 10.938 21.683 4.450 1.00 0.00 H new ATOM 0 HD2 LYS A 115 11.246 19.480 4.930 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.829 19.109 3.320 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.055 19.993 3.872 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.491 20.521 5.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.615 18.472 5.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.961 18.140 5.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.746 17.721 4.482 1.00 0.00 H new ATOM 1713 N ALA A 116 12.176 18.917 0.617 1.00 0.00 N ATOM 1714 CA ALA A 116 12.966 17.695 0.544 1.00 0.00 C ATOM 1715 C ALA A 116 14.260 17.923 -0.230 1.00 0.00 C ATOM 1716 O ALA A 116 15.253 17.229 -0.015 1.00 0.00 O ATOM 1717 CB ALA A 116 12.154 16.580 -0.100 1.00 0.00 C ATOM 0 H ALA A 116 11.232 18.832 0.241 1.00 0.00 H new ATOM 0 HA ALA A 116 13.228 17.400 1.560 1.00 0.00 H new ATOM 0 HB1 ALA A 116 12.756 15.673 -0.148 1.00 0.00 H new ATOM 0 HB2 ALA A 116 11.260 16.391 0.494 1.00 0.00 H new ATOM 0 HB3 ALA A 116 11.864 16.877 -1.108 1.00 0.00 H new ATOM 1723 N ALA A 117 14.241 18.900 -1.130 1.00 0.00 N ATOM 1724 CA ALA A 117 15.414 19.221 -1.935 1.00 0.00 C ATOM 1725 C ALA A 117 16.408 20.063 -1.143 1.00 0.00 C ATOM 1726 O ALA A 117 17.621 19.927 -1.308 1.00 0.00 O ATOM 1727 CB ALA A 117 14.999 19.946 -3.206 1.00 0.00 C ATOM 0 H ALA A 117 13.426 19.483 -1.320 1.00 0.00 H new ATOM 0 HA ALA A 117 15.905 18.287 -2.207 1.00 0.00 H new ATOM 0 HB1 ALA A 117 15.884 20.180 -3.797 1.00 0.00 H new ATOM 0 HB2 ALA A 117 14.332 19.309 -3.787 1.00 0.00 H new ATOM 0 HB3 ALA A 117 14.483 20.870 -2.946 1.00 0.00 H new ATOM 1733 N ILE A 118 15.888 20.934 -0.285 1.00 0.00 N ATOM 1734 CA ILE A 118 16.732 21.798 0.532 1.00 0.00 C ATOM 1735 C ILE A 118 17.582 20.981 1.499 1.00 0.00 C ATOM 1736 O ILE A 118 18.710 21.355 1.818 1.00 0.00 O ATOM 1737 CB ILE A 118 15.892 22.810 1.333 1.00 0.00 C ATOM 1738 CG1 ILE A 118 15.062 23.680 0.386 1.00 0.00 C ATOM 1739 CG2 ILE A 118 16.792 23.675 2.202 1.00 0.00 C ATOM 1740 CD1 ILE A 118 14.205 24.702 1.100 1.00 0.00 C ATOM 0 H ILE A 118 14.887 21.060 -0.137 1.00 0.00 H new ATOM 0 HA ILE A 118 17.385 22.340 -0.152 1.00 0.00 H new ATOM 0 HB ILE A 118 15.211 22.261 1.983 1.00 0.00 H new ATOM 0 HG12 ILE A 118 15.732 24.196 -0.301 1.00 0.00 H new ATOM 0 HG13 ILE A 118 14.420 23.037 -0.217 1.00 0.00 H new ATOM 0 HG21 ILE A 118 16.184 24.385 2.762 1.00 0.00 H new ATOM 0 HG22 ILE A 118 17.344 23.042 2.897 1.00 0.00 H new ATOM 0 HG23 ILE A 118 17.495 24.218 1.570 1.00 0.00 H new ATOM 0 HD11 ILE A 118 13.645 25.283 0.367 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.510 24.192 1.767 1.00 0.00 H new ATOM 0 HD13 ILE A 118 14.842 25.369 1.681 1.00 0.00 H new ATOM 1752 N ALA A 119 17.033 19.862 1.961 1.00 0.00 N ATOM 1753 CA ALA A 119 17.742 18.990 2.888 1.00 0.00 C ATOM 1754 C ALA A 119 18.872 18.244 2.186 1.00 0.00 C ATOM 1755 O ALA A 119 20.000 18.200 2.678 1.00 0.00 O ATOM 1756 CB ALA A 119 16.776 18.005 3.530 1.00 0.00 C ATOM 0 H ALA A 119 16.099 19.539 1.708 1.00 0.00 H new ATOM 0 HA ALA A 119 18.182 19.612 3.668 1.00 0.00 H new ATOM 0 HB1 ALA A 119 17.319 17.360 4.220 1.00 0.00 H new ATOM 0 HB2 ALA A 119 16.007 18.552 4.074 1.00 0.00 H new ATOM 0 HB3 ALA A 119 16.309 17.396 2.756 1.00 0.00 H new ATOM 1762 N ASP A 120 18.562 17.660 1.034 1.00 0.00 N ATOM 1763 CA ASP A 120 19.552 16.915 0.264 1.00 0.00 C ATOM 1764 C ASP A 120 20.794 17.764 0.013 1.00 0.00 C ATOM 1765 O ASP A 120 21.911 17.247 -0.034 1.00 0.00 O ATOM 1766 CB ASP A 120 18.954 16.458 -1.068 1.00 0.00 C ATOM 1767 CG ASP A 120 19.557 15.155 -1.556 1.00 0.00 C ATOM 1768 OD1 ASP A 120 19.301 14.109 -0.924 1.00 0.00 O ATOM 1769 OD2 ASP A 120 20.284 15.183 -2.571 1.00 0.00 O ATOM 0 H ASP A 120 17.634 17.688 0.613 1.00 0.00 H new ATOM 0 HA ASP A 120 19.843 16.038 0.843 1.00 0.00 H new ATOM 0 HB2 ASP A 120 17.876 16.337 -0.957 1.00 0.00 H new ATOM 0 HB3 ASP A 120 19.112 17.232 -1.819 1.00 0.00 H new ATOM 1774 N TYR A 121 20.592 19.066 -0.149 1.00 0.00 N ATOM 1775 CA TYR A 121 21.696 19.986 -0.399 1.00 0.00 C ATOM 1776 C TYR A 121 22.636 20.048 0.801 1.00 0.00 C ATOM 1777 O TYR A 121 23.838 19.808 0.678 1.00 0.00 O ATOM 1778 CB TYR A 121 21.162 21.384 -0.714 1.00 0.00 C ATOM 1779 CG TYR A 121 22.234 22.450 -0.743 1.00 0.00 C ATOM 1780 CD1 TYR A 121 23.366 22.303 -1.534 1.00 0.00 C ATOM 1781 CD2 TYR A 121 22.113 23.604 0.021 1.00 0.00 C ATOM 1782 CE1 TYR A 121 24.348 23.274 -1.562 1.00 0.00 C ATOM 1783 CE2 TYR A 121 23.089 24.581 -0.002 1.00 0.00 C ATOM 1784 CZ TYR A 121 24.205 24.412 -0.795 1.00 0.00 C ATOM 1785 OH TYR A 121 25.181 25.382 -0.821 1.00 0.00 O ATOM 0 H TYR A 121 19.674 19.509 -0.112 1.00 0.00 H new ATOM 0 HA TYR A 121 22.256 19.616 -1.258 1.00 0.00 H new ATOM 0 HB2 TYR A 121 20.657 21.362 -1.680 1.00 0.00 H new ATOM 0 HB3 TYR A 121 20.413 21.654 0.031 1.00 0.00 H new ATOM 0 HD1 TYR A 121 23.480 21.415 -2.137 1.00 0.00 H new ATOM 0 HD2 TYR A 121 21.241 23.739 0.644 1.00 0.00 H new ATOM 0 HE1 TYR A 121 25.223 23.143 -2.181 1.00 0.00 H new ATOM 0 HE2 TYR A 121 22.979 25.472 0.598 1.00 0.00 H new ATOM 0 HH TYR A 121 24.844 26.173 -1.291 1.00 0.00 H new ATOM 1795 N LYS A 122 22.080 20.370 1.964 1.00 0.00 N ATOM 1796 CA LYS A 122 22.865 20.462 3.189 1.00 0.00 C ATOM 1797 C LYS A 122 23.579 19.145 3.478 1.00 0.00 C ATOM 1798 O LYS A 122 24.590 19.117 4.180 1.00 0.00 O ATOM 1799 CB LYS A 122 21.966 20.837 4.369 1.00 0.00 C ATOM 1800 CG LYS A 122 21.085 22.045 4.102 1.00 0.00 C ATOM 1801 CD LYS A 122 20.523 22.621 5.391 1.00 0.00 C ATOM 1802 CE LYS A 122 19.331 23.527 5.124 1.00 0.00 C ATOM 1803 NZ LYS A 122 19.302 24.694 6.049 1.00 0.00 N ATOM 0 H LYS A 122 21.087 20.572 2.084 1.00 0.00 H new ATOM 0 HA LYS A 122 23.616 21.240 3.052 1.00 0.00 H new ATOM 0 HB2 LYS A 122 21.334 19.985 4.619 1.00 0.00 H new ATOM 0 HB3 LYS A 122 22.589 21.038 5.240 1.00 0.00 H new ATOM 0 HG2 LYS A 122 21.662 22.810 3.582 1.00 0.00 H new ATOM 0 HG3 LYS A 122 20.266 21.760 3.442 1.00 0.00 H new ATOM 0 HD2 LYS A 122 20.223 21.809 6.053 1.00 0.00 H new ATOM 0 HD3 LYS A 122 21.300 23.184 5.909 1.00 0.00 H new ATOM 0 HE2 LYS A 122 19.368 23.881 4.094 1.00 0.00 H new ATOM 0 HE3 LYS A 122 18.409 22.955 5.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 18.475 25.287 5.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 19.241 24.357 7.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 20.170 25.254 5.928 1.00 0.00 H new ATOM 1817 N SER A 123 23.047 18.056 2.932 1.00 0.00 N ATOM 1818 CA SER A 123 23.631 16.736 3.134 1.00 0.00 C ATOM 1819 C SER A 123 24.791 16.502 2.170 1.00 0.00 C ATOM 1820 O SER A 123 25.662 15.669 2.418 1.00 0.00 O ATOM 1821 CB SER A 123 22.570 15.651 2.945 1.00 0.00 C ATOM 1822 OG SER A 123 22.805 14.552 3.808 1.00 0.00 O ATOM 0 H SER A 123 22.212 18.062 2.346 1.00 0.00 H new ATOM 0 HA SER A 123 24.013 16.687 4.154 1.00 0.00 H new ATOM 0 HB2 SER A 123 21.582 16.066 3.141 1.00 0.00 H new ATOM 0 HB3 SER A 123 22.573 15.311 1.909 1.00 0.00 H new ATOM 0 HG SER A 123 22.112 13.873 3.669 1.00 0.00 H new ATOM 1828 N LYS A 124 24.794 17.245 1.068 1.00 0.00 N ATOM 1829 CA LYS A 124 25.846 17.122 0.065 1.00 0.00 C ATOM 1830 C LYS A 124 27.143 17.756 0.556 1.00 0.00 C ATOM 1831 O LYS A 124 28.233 17.373 0.130 1.00 0.00 O ATOM 1832 CB LYS A 124 25.408 17.779 -1.246 1.00 0.00 C ATOM 1833 CG LYS A 124 25.544 16.872 -2.456 1.00 0.00 C ATOM 1834 CD LYS A 124 24.305 16.014 -2.651 1.00 0.00 C ATOM 1835 CE LYS A 124 24.631 14.724 -3.388 1.00 0.00 C ATOM 1836 NZ LYS A 124 24.473 14.871 -4.862 1.00 0.00 N ATOM 0 H LYS A 124 24.080 17.939 0.847 1.00 0.00 H new ATOM 0 HA LYS A 124 26.025 16.061 -0.110 1.00 0.00 H new ATOM 0 HB2 LYS A 124 24.369 18.095 -1.155 1.00 0.00 H new ATOM 0 HB3 LYS A 124 26.002 18.678 -1.408 1.00 0.00 H new ATOM 0 HG2 LYS A 124 25.714 17.476 -3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 124 26.417 16.230 -2.335 1.00 0.00 H new ATOM 0 HD2 LYS A 124 23.867 15.779 -1.681 1.00 0.00 H new ATOM 0 HD3 LYS A 124 23.557 16.575 -3.211 1.00 0.00 H new ATOM 0 HE2 LYS A 124 25.654 14.425 -3.161 1.00 0.00 H new ATOM 0 HE3 LYS A 124 23.979 13.927 -3.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 24.704 13.970 -5.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 23.490 15.132 -5.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 25.114 15.614 -5.207 1.00 0.00 H new ATOM 1850 N ARG A 125 27.018 18.728 1.455 1.00 0.00 N ATOM 1851 CA ARG A 125 28.181 19.415 2.004 1.00 0.00 C ATOM 1852 C ARG A 125 28.395 19.038 3.467 1.00 0.00 C ATOM 1853 O ARG A 125 29.397 19.413 4.074 1.00 0.00 O ATOM 1854 CB ARG A 125 28.013 20.930 1.875 1.00 0.00 C ATOM 1855 CG ARG A 125 26.850 21.484 2.683 1.00 0.00 C ATOM 1856 CD ARG A 125 27.304 22.581 3.632 1.00 0.00 C ATOM 1857 NE ARG A 125 26.244 23.551 3.895 1.00 0.00 N ATOM 1858 CZ ARG A 125 26.431 24.679 4.570 1.00 0.00 C ATOM 1859 NH1 ARG A 125 27.632 24.979 5.048 1.00 0.00 N ATOM 1860 NH2 ARG A 125 25.417 25.511 4.769 1.00 0.00 N ATOM 0 H ARG A 125 26.123 19.057 1.818 1.00 0.00 H new ATOM 0 HA ARG A 125 29.057 19.104 1.435 1.00 0.00 H new ATOM 0 HB2 ARG A 125 28.933 21.418 2.197 1.00 0.00 H new ATOM 0 HB3 ARG A 125 27.868 21.183 0.825 1.00 0.00 H new ATOM 0 HG2 ARG A 125 26.091 21.877 2.007 1.00 0.00 H new ATOM 0 HG3 ARG A 125 26.384 20.679 3.252 1.00 0.00 H new ATOM 0 HD2 ARG A 125 27.629 22.135 4.572 1.00 0.00 H new ATOM 0 HD3 ARG A 125 28.167 23.094 3.207 1.00 0.00 H new ATOM 0 HE ARG A 125 25.309 23.351 3.541 1.00 0.00 H new ATOM 0 HH11 ARG A 125 28.415 24.342 4.897 1.00 0.00 H new ATOM 0 HH12 ARG A 125 27.773 25.846 5.566 1.00 0.00 H new ATOM 0 HH21 ARG A 125 24.492 25.285 4.403 1.00 0.00 H new ATOM 0 HH22 ARG A 125 25.562 26.377 5.288 1.00 0.00 H new ATOM 1874 N GLU A 126 27.445 18.295 4.026 1.00 0.00 N ATOM 1875 CA GLU A 126 27.529 17.869 5.418 1.00 0.00 C ATOM 1876 C GLU A 126 28.867 17.192 5.700 1.00 0.00 C ATOM 1877 O GLU A 126 29.380 17.248 6.817 1.00 0.00 O ATOM 1878 CB GLU A 126 26.381 16.915 5.754 1.00 0.00 C ATOM 1879 CG GLU A 126 26.558 15.522 5.174 1.00 0.00 C ATOM 1880 CD GLU A 126 27.253 14.575 6.133 1.00 0.00 C ATOM 1881 OE1 GLU A 126 27.766 15.050 7.168 1.00 0.00 O ATOM 1882 OE2 GLU A 126 27.283 13.359 5.849 1.00 0.00 O ATOM 0 H GLU A 126 26.609 17.976 3.537 1.00 0.00 H new ATOM 0 HA GLU A 126 27.450 18.755 6.047 1.00 0.00 H new ATOM 0 HB2 GLU A 126 26.288 16.839 6.837 1.00 0.00 H new ATOM 0 HB3 GLU A 126 25.448 17.338 5.383 1.00 0.00 H new ATOM 0 HG2 GLU A 126 25.582 15.115 4.911 1.00 0.00 H new ATOM 0 HG3 GLU A 126 27.135 15.587 4.252 1.00 0.00 H new ATOM 1889 N ALA A 127 29.426 16.551 4.679 1.00 0.00 N ATOM 1890 CA ALA A 127 30.704 15.864 4.815 1.00 0.00 C ATOM 1891 C ALA A 127 31.648 16.229 3.674 1.00 0.00 C ATOM 1892 O ALA A 127 31.364 15.955 2.508 1.00 0.00 O ATOM 1893 CB ALA A 127 30.491 14.358 4.865 1.00 0.00 C ATOM 0 H ALA A 127 29.013 16.493 3.748 1.00 0.00 H new ATOM 0 HA ALA A 127 31.164 16.186 5.749 1.00 0.00 H new ATOM 0 HB1 ALA A 127 31.454 13.858 4.967 1.00 0.00 H new ATOM 0 HB2 ALA A 127 29.860 14.108 5.718 1.00 0.00 H new ATOM 0 HB3 ALA A 127 30.006 14.028 3.946 1.00 0.00 H new ATOM 1899 N LYS A 128 32.772 16.849 4.018 1.00 0.00 N ATOM 1900 CA LYS A 128 33.759 17.251 3.023 1.00 0.00 C ATOM 1901 C LYS A 128 35.061 17.680 3.691 1.00 0.00 C ATOM 1902 O LYS A 128 36.133 17.360 3.180 1.00 0.00 O ATOM 1903 CB LYS A 128 33.212 18.396 2.166 1.00 0.00 C ATOM 1904 CG LYS A 128 34.203 18.911 1.136 1.00 0.00 C ATOM 1905 CD LYS A 128 33.537 19.848 0.142 1.00 0.00 C ATOM 1906 CE LYS A 128 33.578 21.290 0.623 1.00 0.00 C ATOM 1907 NZ LYS A 128 34.767 22.017 0.098 1.00 0.00 N ATOM 0 H LYS A 128 33.022 17.084 4.979 1.00 0.00 H new ATOM 0 HA LYS A 128 33.965 16.392 2.384 1.00 0.00 H new ATOM 0 HB2 LYS A 128 32.311 18.057 1.654 1.00 0.00 H new ATOM 0 HB3 LYS A 128 32.918 19.218 2.818 1.00 0.00 H new ATOM 0 HG2 LYS A 128 35.016 19.433 1.641 1.00 0.00 H new ATOM 0 HG3 LYS A 128 34.646 18.070 0.604 1.00 0.00 H new ATOM 0 HD2 LYS A 128 34.037 19.771 -0.824 1.00 0.00 H new ATOM 0 HD3 LYS A 128 32.502 19.543 -0.010 1.00 0.00 H new ATOM 0 HE2 LYS A 128 32.670 21.804 0.308 1.00 0.00 H new ATOM 0 HE3 LYS A 128 33.593 21.309 1.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 34.758 22.996 0.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 35.634 21.542 0.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 34.740 22.021 -0.942 1.00 0.00 H new TER 1921 LYS A 128