USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 921 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 62 ASN :FLIP amide:sc= -2.46 F(o=-6.3!,f=-2.6) USER MOD Set 1.2: A 64 HIS :FLIP no HD1:sc= -0.132 F(o=-5.4,f=-2.6) USER MOD Set 2.1: A 27 GLN : amide:sc= -0.275 X(o=-0.46,f=-0.19) USER MOD Set 2.2: A 61 HIS : no HD1:sc= -0.188 X(o=-0.46,f=-0.26) USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.0755 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 47:sc= 0.883 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ -159:sc= -0.0144 (180deg=-0.571) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS :FLIP no HE2:sc= -2.54 F(o=-3.3!,f=-2.5) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 21:sc= 1.03 USER MOD Single : A 57 SER OG : rot -103:sc= 1.22 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -1.84 K(o=-1.8,f=-3.5!) USER MOD Single : A 68 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.7) USER MOD Single : A 70 LYS NZ :NH3+ -136:sc= -0.295 (180deg=-1.72!) USER MOD Single : A 78 ASN : amide:sc= -1.7 K(o=-1.7,f=-2.4!) USER MOD Single : A 80 GLN :FLIP amide:sc= -0.259 F(o=-0.82,f=-0.26) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 HIS : no HD1:sc= -0.581 X(o=-0.58,f=-0.29) USER MOD Single : A 93 ASN : amide:sc= 1.07 K(o=1.1,f=-0.19) USER MOD Single : A 96 GLN : amide:sc= 0.688 K(o=0.69,f=0) USER MOD Single : A 99 HIS : no HE2:sc= -2.08 K(o=-2.1,f=-2.8!) USER MOD Single : A 101 THR OG1 : rot -170:sc= -0.0293 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 36:sc= 0.964 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 38:sc= 0.367 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc=-0.000243 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 39:sc= 0.249 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.840 16.609 -28.884 1.00 0.00 N ATOM 2 CA GLY A 1 -5.841 17.312 -28.103 1.00 0.00 C ATOM 3 C GLY A 1 -6.262 16.539 -26.869 1.00 0.00 C ATOM 4 O GLY A 1 -5.611 15.567 -26.485 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.985 17.196 -28.961 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.603 15.711 -28.417 1.00 0.00 H new ATOM 0 H3 GLY A 1 -5.214 16.416 -29.835 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.447 18.283 -27.803 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.716 17.501 -28.725 1.00 0.00 H new ATOM 8 N SER A 2 -7.352 16.973 -26.245 1.00 0.00 N ATOM 9 CA SER A 2 -7.856 16.318 -25.043 1.00 0.00 C ATOM 10 C SER A 2 -8.835 15.204 -25.401 1.00 0.00 C ATOM 11 O SER A 2 -9.281 15.098 -26.543 1.00 0.00 O ATOM 12 CB SER A 2 -8.538 17.338 -24.129 1.00 0.00 C ATOM 13 OG SER A 2 -9.747 17.806 -24.700 1.00 0.00 O ATOM 0 H SER A 2 -7.903 17.775 -26.551 1.00 0.00 H new ATOM 0 HA SER A 2 -7.009 15.878 -24.516 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.742 16.883 -23.160 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.867 18.178 -23.952 1.00 0.00 H new ATOM 0 HG SER A 2 -10.164 18.455 -24.096 1.00 0.00 H new ATOM 19 N SER A 3 -9.164 14.375 -24.416 1.00 0.00 N ATOM 20 CA SER A 3 -10.087 13.265 -24.626 1.00 0.00 C ATOM 21 C SER A 3 -11.289 13.375 -23.693 1.00 0.00 C ATOM 22 O SER A 3 -11.281 14.153 -22.740 1.00 0.00 O ATOM 23 CB SER A 3 -9.373 11.931 -24.403 1.00 0.00 C ATOM 24 OG SER A 3 -8.701 11.509 -25.577 1.00 0.00 O ATOM 0 H SER A 3 -8.805 14.451 -23.464 1.00 0.00 H new ATOM 0 HA SER A 3 -10.443 13.310 -25.655 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.658 12.030 -23.587 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.097 11.173 -24.102 1.00 0.00 H new ATOM 0 HG SER A 3 -8.251 10.655 -25.407 1.00 0.00 H new ATOM 30 N GLY A 4 -12.323 12.587 -23.975 1.00 0.00 N ATOM 31 CA GLY A 4 -13.519 12.610 -23.153 1.00 0.00 C ATOM 32 C GLY A 4 -14.511 11.533 -23.544 1.00 0.00 C ATOM 33 O GLY A 4 -15.291 11.707 -24.479 1.00 0.00 O ATOM 0 H GLY A 4 -12.353 11.934 -24.758 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.240 12.481 -22.107 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.996 13.587 -23.237 1.00 0.00 H new ATOM 37 N SER A 5 -14.481 10.414 -22.826 1.00 0.00 N ATOM 38 CA SER A 5 -15.381 9.302 -23.106 1.00 0.00 C ATOM 39 C SER A 5 -15.534 8.406 -21.880 1.00 0.00 C ATOM 40 O SER A 5 -14.570 8.152 -21.158 1.00 0.00 O ATOM 41 CB SER A 5 -14.861 8.483 -24.288 1.00 0.00 C ATOM 42 OG SER A 5 -15.744 7.419 -24.599 1.00 0.00 O ATOM 0 H SER A 5 -13.843 10.254 -22.046 1.00 0.00 H new ATOM 0 HA SER A 5 -16.358 9.712 -23.360 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.744 9.129 -25.158 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.875 8.084 -24.052 1.00 0.00 H new ATOM 0 HG SER A 5 -15.390 6.912 -25.359 1.00 0.00 H new ATOM 48 N SER A 6 -16.754 7.929 -21.652 1.00 0.00 N ATOM 49 CA SER A 6 -17.036 7.065 -20.512 1.00 0.00 C ATOM 50 C SER A 6 -17.469 5.677 -20.977 1.00 0.00 C ATOM 51 O SER A 6 -18.328 5.542 -21.847 1.00 0.00 O ATOM 52 CB SER A 6 -18.125 7.683 -19.633 1.00 0.00 C ATOM 53 OG SER A 6 -18.409 6.857 -18.518 1.00 0.00 O ATOM 0 H SER A 6 -17.562 8.126 -22.242 1.00 0.00 H new ATOM 0 HA SER A 6 -16.121 6.965 -19.928 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.805 8.666 -19.289 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.031 7.830 -20.221 1.00 0.00 H new ATOM 0 HG SER A 6 -19.107 7.274 -17.971 1.00 0.00 H new ATOM 59 N GLY A 7 -16.866 4.648 -20.389 1.00 0.00 N ATOM 60 CA GLY A 7 -17.201 3.284 -20.755 1.00 0.00 C ATOM 61 C GLY A 7 -15.985 2.379 -20.794 1.00 0.00 C ATOM 62 O GLY A 7 -14.941 2.707 -20.233 1.00 0.00 O ATOM 0 H GLY A 7 -16.152 4.735 -19.666 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.923 2.887 -20.042 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -17.684 3.281 -21.732 1.00 0.00 H new ATOM 66 N GLY A 8 -16.122 1.235 -21.458 1.00 0.00 N ATOM 67 CA GLY A 8 -15.019 0.297 -21.554 1.00 0.00 C ATOM 68 C GLY A 8 -15.337 -1.039 -20.911 1.00 0.00 C ATOM 69 O GLY A 8 -16.459 -1.267 -20.460 1.00 0.00 O ATOM 0 H GLY A 8 -16.977 0.941 -21.931 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -14.769 0.141 -22.603 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -14.138 0.726 -21.076 1.00 0.00 H new ATOM 73 N SER A 9 -14.347 -1.925 -20.872 1.00 0.00 N ATOM 74 CA SER A 9 -14.528 -3.248 -20.285 1.00 0.00 C ATOM 75 C SER A 9 -13.674 -3.408 -19.031 1.00 0.00 C ATOM 76 O SER A 9 -12.962 -2.487 -18.630 1.00 0.00 O ATOM 77 CB SER A 9 -14.170 -4.333 -21.302 1.00 0.00 C ATOM 78 OG SER A 9 -15.234 -4.549 -22.213 1.00 0.00 O ATOM 0 H SER A 9 -13.412 -1.751 -21.240 1.00 0.00 H new ATOM 0 HA SER A 9 -15.576 -3.354 -20.005 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.273 -4.042 -21.848 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.939 -5.262 -20.781 1.00 0.00 H new ATOM 0 HG SER A 9 -14.980 -5.246 -22.854 1.00 0.00 H new ATOM 84 N ASP A 10 -13.750 -4.583 -18.417 1.00 0.00 N ATOM 85 CA ASP A 10 -12.984 -4.866 -17.209 1.00 0.00 C ATOM 86 C ASP A 10 -11.576 -5.339 -17.557 1.00 0.00 C ATOM 87 O ASP A 10 -11.074 -6.304 -16.980 1.00 0.00 O ATOM 88 CB ASP A 10 -13.696 -5.923 -16.363 1.00 0.00 C ATOM 89 CG ASP A 10 -13.031 -6.131 -15.017 1.00 0.00 C ATOM 90 OD1 ASP A 10 -13.198 -5.265 -14.133 1.00 0.00 O ATOM 91 OD2 ASP A 10 -12.343 -7.160 -14.848 1.00 0.00 O ATOM 0 H ASP A 10 -14.335 -5.356 -18.736 1.00 0.00 H new ATOM 0 HA ASP A 10 -12.906 -3.944 -16.633 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -14.733 -5.624 -16.210 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -13.713 -6.868 -16.906 1.00 0.00 H new ATOM 96 N SER A 11 -10.945 -4.655 -18.506 1.00 0.00 N ATOM 97 CA SER A 11 -9.597 -5.009 -18.935 1.00 0.00 C ATOM 98 C SER A 11 -8.551 -4.271 -18.104 1.00 0.00 C ATOM 99 O SER A 11 -7.707 -4.891 -17.457 1.00 0.00 O ATOM 100 CB SER A 11 -9.408 -4.682 -20.418 1.00 0.00 C ATOM 101 OG SER A 11 -8.097 -5.003 -20.848 1.00 0.00 O ATOM 0 H SER A 11 -11.345 -3.853 -18.992 1.00 0.00 H new ATOM 0 HA SER A 11 -9.465 -6.081 -18.786 1.00 0.00 H new ATOM 0 HB2 SER A 11 -10.135 -5.237 -21.011 1.00 0.00 H new ATOM 0 HB3 SER A 11 -9.600 -3.623 -20.587 1.00 0.00 H new ATOM 0 HG SER A 11 -8.002 -4.786 -21.799 1.00 0.00 H new ATOM 107 N SER A 12 -8.614 -2.944 -18.127 1.00 0.00 N ATOM 108 CA SER A 12 -7.671 -2.121 -17.379 1.00 0.00 C ATOM 109 C SER A 12 -8.380 -1.362 -16.261 1.00 0.00 C ATOM 110 O SER A 12 -8.736 -0.193 -16.417 1.00 0.00 O ATOM 111 CB SER A 12 -6.969 -1.135 -18.315 1.00 0.00 C ATOM 112 OG SER A 12 -7.902 -0.265 -18.932 1.00 0.00 O ATOM 0 H SER A 12 -9.308 -2.416 -18.655 1.00 0.00 H new ATOM 0 HA SER A 12 -6.927 -2.780 -16.932 1.00 0.00 H new ATOM 0 HB2 SER A 12 -6.240 -0.552 -17.753 1.00 0.00 H new ATOM 0 HB3 SER A 12 -6.418 -1.683 -19.079 1.00 0.00 H new ATOM 0 HG SER A 12 -8.522 0.082 -18.257 1.00 0.00 H new ATOM 118 N LEU A 13 -8.582 -2.035 -15.134 1.00 0.00 N ATOM 119 CA LEU A 13 -9.249 -1.426 -13.988 1.00 0.00 C ATOM 120 C LEU A 13 -8.290 -0.526 -13.215 1.00 0.00 C ATOM 121 O LEU A 13 -8.712 0.403 -12.527 1.00 0.00 O ATOM 122 CB LEU A 13 -9.808 -2.509 -13.064 1.00 0.00 C ATOM 123 CG LEU A 13 -10.886 -3.412 -13.663 1.00 0.00 C ATOM 124 CD1 LEU A 13 -12.146 -2.614 -13.963 1.00 0.00 C ATOM 125 CD2 LEU A 13 -10.371 -4.093 -14.923 1.00 0.00 C ATOM 0 H LEU A 13 -8.294 -3.003 -14.989 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.071 -0.815 -14.360 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.981 -3.136 -12.731 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -10.219 -2.026 -12.178 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.134 -4.182 -12.933 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -12.902 -3.274 -14.389 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.526 -2.174 -13.041 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.914 -1.821 -14.674 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.151 -4.732 -15.336 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.094 -3.337 -15.658 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.498 -4.698 -14.679 1.00 0.00 H new ATOM 137 N PHE A 14 -6.997 -0.808 -13.335 1.00 0.00 N ATOM 138 CA PHE A 14 -5.977 -0.024 -12.648 1.00 0.00 C ATOM 139 C PHE A 14 -5.232 0.877 -13.629 1.00 0.00 C ATOM 140 O PHE A 14 -5.426 0.787 -14.841 1.00 0.00 O ATOM 141 CB PHE A 14 -4.988 -0.947 -11.934 1.00 0.00 C ATOM 142 CG PHE A 14 -5.649 -2.071 -11.189 1.00 0.00 C ATOM 143 CD1 PHE A 14 -5.922 -3.274 -11.821 1.00 0.00 C ATOM 144 CD2 PHE A 14 -5.996 -1.926 -9.855 1.00 0.00 C ATOM 145 CE1 PHE A 14 -6.530 -4.309 -11.138 1.00 0.00 C ATOM 146 CE2 PHE A 14 -6.605 -2.959 -9.167 1.00 0.00 C ATOM 147 CZ PHE A 14 -6.871 -4.152 -9.809 1.00 0.00 C ATOM 0 H PHE A 14 -6.631 -1.573 -13.901 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.474 0.605 -11.909 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -4.298 -1.364 -12.667 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.393 -0.359 -11.235 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.656 -3.404 -12.860 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -5.788 -0.996 -9.347 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -6.739 -5.241 -11.643 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -6.872 -2.833 -8.128 1.00 0.00 H new ATOM 0 HZ PHE A 14 -7.345 -4.961 -9.273 1.00 0.00 H new ATOM 157 N GLU A 15 -4.379 1.746 -13.095 1.00 0.00 N ATOM 158 CA GLU A 15 -3.606 2.664 -13.923 1.00 0.00 C ATOM 159 C GLU A 15 -2.155 2.729 -13.454 1.00 0.00 C ATOM 160 O GLU A 15 -1.880 2.978 -12.279 1.00 0.00 O ATOM 161 CB GLU A 15 -4.227 4.062 -13.890 1.00 0.00 C ATOM 162 CG GLU A 15 -4.615 4.523 -12.495 1.00 0.00 C ATOM 163 CD GLU A 15 -4.671 6.034 -12.375 1.00 0.00 C ATOM 164 OE1 GLU A 15 -3.650 6.691 -12.664 1.00 0.00 O ATOM 165 OE2 GLU A 15 -5.739 6.558 -11.992 1.00 0.00 O ATOM 0 H GLU A 15 -4.206 1.833 -12.094 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.623 2.291 -14.947 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.520 4.774 -14.315 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -5.112 4.072 -14.526 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.588 4.105 -12.236 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.897 4.131 -11.774 1.00 0.00 H new ATOM 172 N THR A 16 -1.229 2.502 -14.380 1.00 0.00 N ATOM 173 CA THR A 16 0.193 2.533 -14.063 1.00 0.00 C ATOM 174 C THR A 16 0.800 3.893 -14.390 1.00 0.00 C ATOM 175 O THR A 16 0.520 4.472 -15.440 1.00 0.00 O ATOM 176 CB THR A 16 0.964 1.442 -14.830 1.00 0.00 C ATOM 177 OG1 THR A 16 0.248 0.203 -14.770 1.00 0.00 O ATOM 178 CG2 THR A 16 2.358 1.256 -14.251 1.00 0.00 C ATOM 0 H THR A 16 -1.439 2.295 -15.356 1.00 0.00 H new ATOM 0 HA THR A 16 0.282 2.346 -12.993 1.00 0.00 H new ATOM 0 HB THR A 16 1.059 1.757 -15.869 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.743 -0.485 -15.261 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.883 0.481 -14.809 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.910 2.193 -14.324 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.281 0.961 -13.205 1.00 0.00 H new ATOM 186 N TYR A 17 1.633 4.397 -13.486 1.00 0.00 N ATOM 187 CA TYR A 17 2.279 5.690 -13.679 1.00 0.00 C ATOM 188 C TYR A 17 3.733 5.647 -13.219 1.00 0.00 C ATOM 189 O TYR A 17 4.064 4.991 -12.233 1.00 0.00 O ATOM 190 CB TYR A 17 1.523 6.779 -12.916 1.00 0.00 C ATOM 191 CG TYR A 17 1.337 6.472 -11.447 1.00 0.00 C ATOM 192 CD1 TYR A 17 0.324 5.624 -11.017 1.00 0.00 C ATOM 193 CD2 TYR A 17 2.175 7.030 -10.489 1.00 0.00 C ATOM 194 CE1 TYR A 17 0.150 5.340 -9.677 1.00 0.00 C ATOM 195 CE2 TYR A 17 2.009 6.751 -9.146 1.00 0.00 C ATOM 196 CZ TYR A 17 0.995 5.906 -8.745 1.00 0.00 C ATOM 197 OH TYR A 17 0.826 5.627 -7.408 1.00 0.00 O ATOM 0 H TYR A 17 1.877 3.930 -12.613 1.00 0.00 H new ATOM 0 HA TYR A 17 2.261 5.922 -14.744 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.061 7.721 -13.016 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.545 6.920 -13.376 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.339 5.179 -11.744 1.00 0.00 H new ATOM 0 HD2 TYR A 17 2.969 7.693 -10.799 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.643 4.679 -9.360 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.670 7.192 -8.414 1.00 0.00 H new ATOM 0 HH TYR A 17 1.504 6.105 -6.886 1.00 0.00 H new ATOM 207 N ASN A 18 4.596 6.351 -13.943 1.00 0.00 N ATOM 208 CA ASN A 18 6.016 6.395 -13.611 1.00 0.00 C ATOM 209 C ASN A 18 6.342 7.630 -12.778 1.00 0.00 C ATOM 210 O ASN A 18 5.953 8.746 -13.123 1.00 0.00 O ATOM 211 CB ASN A 18 6.860 6.389 -14.887 1.00 0.00 C ATOM 212 CG ASN A 18 7.057 4.992 -15.444 1.00 0.00 C ATOM 213 OD1 ASN A 18 8.126 4.398 -15.295 1.00 0.00 O ATOM 214 ND2 ASN A 18 6.025 4.461 -16.089 1.00 0.00 N ATOM 0 H ASN A 18 4.338 6.899 -14.764 1.00 0.00 H new ATOM 0 HA ASN A 18 6.253 5.509 -13.022 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.379 7.013 -15.640 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.833 6.834 -14.678 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.099 3.524 -16.485 1.00 0.00 H new ATOM 0 HD22 ASN A 18 5.159 4.990 -16.188 1.00 0.00 H new ATOM 221 N VAL A 19 7.060 7.423 -11.678 1.00 0.00 N ATOM 222 CA VAL A 19 7.441 8.519 -10.796 1.00 0.00 C ATOM 223 C VAL A 19 8.957 8.652 -10.708 1.00 0.00 C ATOM 224 O VAL A 19 9.640 7.760 -10.207 1.00 0.00 O ATOM 225 CB VAL A 19 6.870 8.323 -9.378 1.00 0.00 C ATOM 226 CG1 VAL A 19 6.831 9.647 -8.630 1.00 0.00 C ATOM 227 CG2 VAL A 19 5.485 7.697 -9.444 1.00 0.00 C ATOM 0 H VAL A 19 7.389 6.506 -11.377 1.00 0.00 H new ATOM 0 HA VAL A 19 7.024 9.430 -11.225 1.00 0.00 H new ATOM 0 HB VAL A 19 7.525 7.644 -8.832 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.425 9.489 -7.631 1.00 0.00 H new ATOM 0 HG12 VAL A 19 7.841 10.051 -8.552 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.200 10.352 -9.171 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.097 7.566 -8.434 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.818 8.349 -10.008 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.547 6.727 -9.938 1.00 0.00 H new ATOM 237 N GLU A 20 9.476 9.774 -11.197 1.00 0.00 N ATOM 238 CA GLU A 20 10.913 10.024 -11.173 1.00 0.00 C ATOM 239 C GLU A 20 11.317 10.754 -9.896 1.00 0.00 C ATOM 240 O GLU A 20 11.191 11.976 -9.799 1.00 0.00 O ATOM 241 CB GLU A 20 11.331 10.843 -12.396 1.00 0.00 C ATOM 242 CG GLU A 20 12.805 11.211 -12.407 1.00 0.00 C ATOM 243 CD GLU A 20 13.073 12.523 -13.118 1.00 0.00 C ATOM 244 OE1 GLU A 20 12.195 13.411 -13.076 1.00 0.00 O ATOM 245 OE2 GLU A 20 14.160 12.663 -13.717 1.00 0.00 O ATOM 0 H GLU A 20 8.924 10.523 -11.614 1.00 0.00 H new ATOM 0 HA GLU A 20 11.424 9.061 -11.197 1.00 0.00 H new ATOM 0 HB2 GLU A 20 11.100 10.277 -13.298 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.737 11.756 -12.432 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.167 11.278 -11.381 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.371 10.416 -12.893 1.00 0.00 H new ATOM 252 N LEU A 21 11.803 9.998 -8.918 1.00 0.00 N ATOM 253 CA LEU A 21 12.226 10.572 -7.645 1.00 0.00 C ATOM 254 C LEU A 21 13.688 11.002 -7.701 1.00 0.00 C ATOM 255 O LEU A 21 14.527 10.313 -8.282 1.00 0.00 O ATOM 256 CB LEU A 21 12.022 9.561 -6.515 1.00 0.00 C ATOM 257 CG LEU A 21 10.620 8.964 -6.393 1.00 0.00 C ATOM 258 CD1 LEU A 21 10.583 7.907 -5.300 1.00 0.00 C ATOM 259 CD2 LEU A 21 9.598 10.057 -6.115 1.00 0.00 C ATOM 0 H LEU A 21 11.914 8.986 -8.982 1.00 0.00 H new ATOM 0 HA LEU A 21 11.615 11.453 -7.450 1.00 0.00 H new ATOM 0 HB2 LEU A 21 12.732 8.745 -6.652 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.272 10.046 -5.571 1.00 0.00 H new ATOM 0 HG LEU A 21 10.365 8.487 -7.340 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.577 7.493 -5.228 1.00 0.00 H new ATOM 0 HD12 LEU A 21 11.287 7.110 -5.541 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.859 8.359 -4.347 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.605 9.614 -6.031 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.850 10.562 -5.183 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.606 10.779 -6.932 1.00 0.00 H new ATOM 271 N VAL A 22 13.987 12.145 -7.091 1.00 0.00 N ATOM 272 CA VAL A 22 15.349 12.665 -7.068 1.00 0.00 C ATOM 273 C VAL A 22 15.985 12.481 -5.695 1.00 0.00 C ATOM 274 O VAL A 22 15.310 12.574 -4.670 1.00 0.00 O ATOM 275 CB VAL A 22 15.385 14.159 -7.443 1.00 0.00 C ATOM 276 CG1 VAL A 22 14.660 14.990 -6.395 1.00 0.00 C ATOM 277 CG2 VAL A 22 16.822 14.632 -7.609 1.00 0.00 C ATOM 0 H VAL A 22 13.305 12.728 -6.607 1.00 0.00 H new ATOM 0 HA VAL A 22 15.917 12.099 -7.806 1.00 0.00 H new ATOM 0 HB VAL A 22 14.871 14.289 -8.395 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.696 16.042 -6.677 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.621 14.667 -6.329 1.00 0.00 H new ATOM 0 HG13 VAL A 22 15.143 14.857 -5.427 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.829 15.689 -7.874 1.00 0.00 H new ATOM 0 HG22 VAL A 22 17.363 14.489 -6.673 1.00 0.00 H new ATOM 0 HG23 VAL A 22 17.305 14.057 -8.399 1.00 0.00 H new ATOM 287 N ARG A 23 17.288 12.221 -5.682 1.00 0.00 N ATOM 288 CA ARG A 23 18.015 12.023 -4.435 1.00 0.00 C ATOM 289 C ARG A 23 18.994 13.168 -4.188 1.00 0.00 C ATOM 290 O ARG A 23 20.078 13.208 -4.769 1.00 0.00 O ATOM 291 CB ARG A 23 18.769 10.692 -4.464 1.00 0.00 C ATOM 292 CG ARG A 23 17.872 9.490 -4.714 1.00 0.00 C ATOM 293 CD ARG A 23 18.429 8.234 -4.062 1.00 0.00 C ATOM 294 NE ARG A 23 19.775 7.923 -4.533 1.00 0.00 N ATOM 295 CZ ARG A 23 20.592 7.075 -3.917 1.00 0.00 C ATOM 296 NH1 ARG A 23 20.201 6.458 -2.811 1.00 0.00 N ATOM 297 NH2 ARG A 23 21.803 6.844 -4.408 1.00 0.00 N ATOM 0 H ARG A 23 17.862 12.143 -6.522 1.00 0.00 H new ATOM 0 HA ARG A 23 17.290 12.005 -3.621 1.00 0.00 H new ATOM 0 HB2 ARG A 23 19.532 10.733 -5.241 1.00 0.00 H new ATOM 0 HB3 ARG A 23 19.287 10.557 -3.515 1.00 0.00 H new ATOM 0 HG2 ARG A 23 16.874 9.692 -4.324 1.00 0.00 H new ATOM 0 HG3 ARG A 23 17.768 9.329 -5.787 1.00 0.00 H new ATOM 0 HD2 ARG A 23 18.445 8.364 -2.980 1.00 0.00 H new ATOM 0 HD3 ARG A 23 17.768 7.393 -4.272 1.00 0.00 H new ATOM 0 HE ARG A 23 20.107 8.382 -5.381 1.00 0.00 H new ATOM 0 HH11 ARG A 23 19.271 6.634 -2.431 1.00 0.00 H new ATOM 0 HH12 ARG A 23 20.830 5.808 -2.340 1.00 0.00 H new ATOM 0 HH21 ARG A 23 22.107 7.317 -5.259 1.00 0.00 H new ATOM 0 HH22 ARG A 23 22.430 6.193 -3.935 1.00 0.00 H new ATOM 311 N LYS A 24 18.603 14.097 -3.323 1.00 0.00 N ATOM 312 CA LYS A 24 19.444 15.243 -2.998 1.00 0.00 C ATOM 313 C LYS A 24 20.870 14.800 -2.689 1.00 0.00 C ATOM 314 O LYS A 24 21.165 13.606 -2.651 1.00 0.00 O ATOM 315 CB LYS A 24 18.865 16.004 -1.803 1.00 0.00 C ATOM 316 CG LYS A 24 17.800 17.018 -2.186 1.00 0.00 C ATOM 317 CD LYS A 24 17.692 18.128 -1.154 1.00 0.00 C ATOM 318 CE LYS A 24 18.610 19.293 -1.491 1.00 0.00 C ATOM 319 NZ LYS A 24 19.949 19.145 -0.856 1.00 0.00 N ATOM 0 H LYS A 24 17.708 14.079 -2.834 1.00 0.00 H new ATOM 0 HA LYS A 24 19.467 15.903 -3.865 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.438 15.289 -1.100 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.674 16.518 -1.283 1.00 0.00 H new ATOM 0 HG2 LYS A 24 18.038 17.447 -3.160 1.00 0.00 H new ATOM 0 HG3 LYS A 24 16.837 16.517 -2.285 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.661 18.479 -1.102 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.946 17.736 -0.169 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.727 19.363 -2.573 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.152 20.225 -1.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 20.411 20.075 -0.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.838 18.755 0.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.534 18.502 -1.426 1.00 0.00 H new ATOM 333 N ASP A 25 21.751 15.770 -2.469 1.00 0.00 N ATOM 334 CA ASP A 25 23.147 15.480 -2.161 1.00 0.00 C ATOM 335 C ASP A 25 23.257 14.583 -0.932 1.00 0.00 C ATOM 336 O ASP A 25 23.234 15.060 0.202 1.00 0.00 O ATOM 337 CB ASP A 25 23.921 16.779 -1.931 1.00 0.00 C ATOM 338 CG ASP A 25 25.353 16.531 -1.499 1.00 0.00 C ATOM 339 OD1 ASP A 25 25.937 15.518 -1.937 1.00 0.00 O ATOM 340 OD2 ASP A 25 25.889 17.349 -0.722 1.00 0.00 O ATOM 0 H ASP A 25 21.523 16.764 -2.498 1.00 0.00 H new ATOM 0 HA ASP A 25 23.580 14.954 -3.012 1.00 0.00 H new ATOM 0 HB2 ASP A 25 23.918 17.368 -2.848 1.00 0.00 H new ATOM 0 HB3 ASP A 25 23.413 17.372 -1.170 1.00 0.00 H new ATOM 345 N GLY A 26 23.375 13.280 -1.166 1.00 0.00 N ATOM 346 CA GLY A 26 23.486 12.336 -0.068 1.00 0.00 C ATOM 347 C GLY A 26 22.156 12.079 0.611 1.00 0.00 C ATOM 348 O GLY A 26 22.088 11.972 1.835 1.00 0.00 O ATOM 0 H GLY A 26 23.396 12.861 -2.096 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.888 11.394 -0.442 1.00 0.00 H new ATOM 0 HA3 GLY A 26 24.197 12.718 0.665 1.00 0.00 H new ATOM 352 N GLN A 27 21.096 11.980 -0.185 1.00 0.00 N ATOM 353 CA GLN A 27 19.761 11.736 0.348 1.00 0.00 C ATOM 354 C GLN A 27 19.266 10.346 -0.038 1.00 0.00 C ATOM 355 O GLN A 27 19.568 9.848 -1.122 1.00 0.00 O ATOM 356 CB GLN A 27 18.783 12.798 -0.160 1.00 0.00 C ATOM 357 CG GLN A 27 17.343 12.549 0.259 1.00 0.00 C ATOM 358 CD GLN A 27 16.484 13.794 0.158 1.00 0.00 C ATOM 359 OE1 GLN A 27 16.346 14.546 1.123 1.00 0.00 O ATOM 360 NE2 GLN A 27 15.900 14.018 -1.013 1.00 0.00 N ATOM 0 H GLN A 27 21.136 12.065 -1.201 1.00 0.00 H new ATOM 0 HA GLN A 27 19.816 11.793 1.435 1.00 0.00 H new ATOM 0 HB2 GLN A 27 19.096 13.775 0.209 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.835 12.837 -1.248 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.916 11.766 -0.367 1.00 0.00 H new ATOM 0 HG3 GLN A 27 17.325 12.182 1.285 1.00 0.00 H new ATOM 0 HE21 GLN A 27 16.042 13.368 -1.786 1.00 0.00 H new ATOM 0 HE22 GLN A 27 15.309 14.840 -1.139 1.00 0.00 H new ATOM 369 N SER A 28 18.504 9.725 0.857 1.00 0.00 N ATOM 370 CA SER A 28 17.971 8.390 0.611 1.00 0.00 C ATOM 371 C SER A 28 16.579 8.467 -0.008 1.00 0.00 C ATOM 372 O SER A 28 16.053 9.554 -0.249 1.00 0.00 O ATOM 373 CB SER A 28 17.919 7.591 1.915 1.00 0.00 C ATOM 374 OG SER A 28 19.167 6.977 2.187 1.00 0.00 O ATOM 0 H SER A 28 18.242 10.125 1.758 1.00 0.00 H new ATOM 0 HA SER A 28 18.634 7.884 -0.091 1.00 0.00 H new ATOM 0 HB2 SER A 28 17.648 8.251 2.739 1.00 0.00 H new ATOM 0 HB3 SER A 28 17.142 6.829 1.848 1.00 0.00 H new ATOM 0 HG SER A 28 19.108 6.474 3.026 1.00 0.00 H new ATOM 380 N LEU A 29 15.986 7.305 -0.262 1.00 0.00 N ATOM 381 CA LEU A 29 14.654 7.238 -0.853 1.00 0.00 C ATOM 382 C LEU A 29 13.585 7.602 0.173 1.00 0.00 C ATOM 383 O LEU A 29 12.952 8.653 0.079 1.00 0.00 O ATOM 384 CB LEU A 29 14.390 5.837 -1.407 1.00 0.00 C ATOM 385 CG LEU A 29 13.452 5.758 -2.612 1.00 0.00 C ATOM 386 CD1 LEU A 29 14.037 6.515 -3.794 1.00 0.00 C ATOM 387 CD2 LEU A 29 13.184 4.307 -2.985 1.00 0.00 C ATOM 0 H LEU A 29 16.407 6.396 -0.068 1.00 0.00 H new ATOM 0 HA LEU A 29 14.609 7.959 -1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.345 5.392 -1.686 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.974 5.224 -0.607 1.00 0.00 H new ATOM 0 HG LEU A 29 12.504 6.224 -2.342 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.356 6.448 -4.642 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.177 7.561 -3.523 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.998 6.079 -4.065 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.515 4.270 -3.844 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.124 3.816 -3.236 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.721 3.794 -2.142 1.00 0.00 H new ATOM 399 N GLY A 30 13.390 6.725 1.153 1.00 0.00 N ATOM 400 CA GLY A 30 12.399 6.973 2.184 1.00 0.00 C ATOM 401 C GLY A 30 11.054 6.356 1.854 1.00 0.00 C ATOM 402 O GLY A 30 10.017 7.010 1.975 1.00 0.00 O ATOM 0 H GLY A 30 13.900 5.847 1.251 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.757 6.572 3.132 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.279 8.048 2.318 1.00 0.00 H new ATOM 406 N ILE A 31 11.070 5.095 1.435 1.00 0.00 N ATOM 407 CA ILE A 31 9.842 4.391 1.086 1.00 0.00 C ATOM 408 C ILE A 31 9.750 3.053 1.813 1.00 0.00 C ATOM 409 O ILE A 31 10.597 2.178 1.632 1.00 0.00 O ATOM 410 CB ILE A 31 9.745 4.146 -0.431 1.00 0.00 C ATOM 411 CG1 ILE A 31 9.731 5.477 -1.185 1.00 0.00 C ATOM 412 CG2 ILE A 31 8.501 3.333 -0.758 1.00 0.00 C ATOM 413 CD1 ILE A 31 9.710 5.320 -2.689 1.00 0.00 C ATOM 0 H ILE A 31 11.919 4.540 1.329 1.00 0.00 H new ATOM 0 HA ILE A 31 9.014 5.028 1.396 1.00 0.00 H new ATOM 0 HB ILE A 31 10.620 3.579 -0.749 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.858 6.051 -0.876 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.610 6.056 -0.901 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.447 3.168 -1.834 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.549 2.372 -0.246 1.00 0.00 H new ATOM 0 HG23 ILE A 31 7.615 3.876 -0.429 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.701 6.304 -3.157 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.597 4.773 -3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.817 4.769 -2.985 1.00 0.00 H new ATOM 425 N ARG A 32 8.716 2.902 2.634 1.00 0.00 N ATOM 426 CA ARG A 32 8.513 1.670 3.387 1.00 0.00 C ATOM 427 C ARG A 32 7.643 0.691 2.605 1.00 0.00 C ATOM 428 O ARG A 32 6.548 1.038 2.160 1.00 0.00 O ATOM 429 CB ARG A 32 7.867 1.976 4.740 1.00 0.00 C ATOM 430 CG ARG A 32 8.837 2.541 5.765 1.00 0.00 C ATOM 431 CD ARG A 32 9.523 1.436 6.552 1.00 0.00 C ATOM 432 NE ARG A 32 8.696 0.955 7.655 1.00 0.00 N ATOM 433 CZ ARG A 32 8.835 -0.245 8.209 1.00 0.00 C ATOM 434 NH1 ARG A 32 9.763 -1.081 7.764 1.00 0.00 N ATOM 435 NH2 ARG A 32 8.044 -0.610 9.210 1.00 0.00 N ATOM 0 H ARG A 32 8.006 3.617 2.795 1.00 0.00 H new ATOM 0 HA ARG A 32 9.487 1.210 3.552 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.054 2.686 4.592 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.424 1.062 5.136 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.588 3.149 5.260 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.302 3.199 6.450 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.755 0.606 5.885 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.471 1.805 6.944 1.00 0.00 H new ATOM 0 HE ARG A 32 7.972 1.574 8.020 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.373 -0.804 6.995 1.00 0.00 H new ATOM 0 HH12 ARG A 32 9.867 -2.001 8.191 1.00 0.00 H new ATOM 0 HH21 ARG A 32 7.329 0.031 9.555 1.00 0.00 H new ATOM 0 HH22 ARG A 32 8.151 -1.531 9.635 1.00 0.00 H new ATOM 449 N ILE A 33 8.137 -0.531 2.441 1.00 0.00 N ATOM 450 CA ILE A 33 7.404 -1.559 1.713 1.00 0.00 C ATOM 451 C ILE A 33 6.921 -2.659 2.652 1.00 0.00 C ATOM 452 O ILE A 33 7.313 -2.712 3.818 1.00 0.00 O ATOM 453 CB ILE A 33 8.269 -2.189 0.605 1.00 0.00 C ATOM 454 CG1 ILE A 33 9.509 -2.851 1.209 1.00 0.00 C ATOM 455 CG2 ILE A 33 8.669 -1.136 -0.418 1.00 0.00 C ATOM 456 CD1 ILE A 33 10.074 -3.966 0.358 1.00 0.00 C ATOM 0 H ILE A 33 9.042 -0.834 2.802 1.00 0.00 H new ATOM 0 HA ILE A 33 6.543 -1.070 1.257 1.00 0.00 H new ATOM 0 HB ILE A 33 7.682 -2.955 0.098 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.279 -2.094 1.359 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.256 -3.248 2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.280 -1.597 -1.194 1.00 0.00 H new ATOM 0 HG22 ILE A 33 7.774 -0.707 -0.868 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.241 -0.349 0.074 1.00 0.00 H new ATOM 0 HD11 ILE A 33 10.951 -4.389 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.320 -4.743 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 33 10.358 -3.571 -0.617 1.00 0.00 H new ATOM 468 N VAL A 34 6.068 -3.539 2.136 1.00 0.00 N ATOM 469 CA VAL A 34 5.534 -4.640 2.927 1.00 0.00 C ATOM 470 C VAL A 34 5.184 -5.832 2.044 1.00 0.00 C ATOM 471 O VAL A 34 4.669 -5.669 0.938 1.00 0.00 O ATOM 472 CB VAL A 34 4.279 -4.211 3.712 1.00 0.00 C ATOM 473 CG1 VAL A 34 3.061 -4.189 2.801 1.00 0.00 C ATOM 474 CG2 VAL A 34 4.051 -5.135 4.898 1.00 0.00 C ATOM 0 H VAL A 34 5.732 -3.510 1.173 1.00 0.00 H new ATOM 0 HA VAL A 34 6.313 -4.930 3.632 1.00 0.00 H new ATOM 0 HB VAL A 34 4.437 -3.202 4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.185 -3.884 3.373 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.228 -3.483 1.988 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.897 -5.185 2.389 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.161 -4.817 5.441 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.914 -6.156 4.543 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.915 -5.095 5.562 1.00 0.00 H new ATOM 484 N GLY A 35 5.466 -7.033 2.540 1.00 0.00 N ATOM 485 CA GLY A 35 5.174 -8.236 1.783 1.00 0.00 C ATOM 486 C GLY A 35 3.976 -8.988 2.328 1.00 0.00 C ATOM 487 O GLY A 35 4.090 -9.725 3.308 1.00 0.00 O ATOM 0 H GLY A 35 5.892 -7.194 3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.990 -7.971 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.046 -8.890 1.796 1.00 0.00 H new ATOM 491 N TYR A 36 2.824 -8.801 1.694 1.00 0.00 N ATOM 492 CA TYR A 36 1.598 -9.464 2.124 1.00 0.00 C ATOM 493 C TYR A 36 1.508 -10.872 1.542 1.00 0.00 C ATOM 494 O TYR A 36 2.036 -11.146 0.464 1.00 0.00 O ATOM 495 CB TYR A 36 0.376 -8.647 1.702 1.00 0.00 C ATOM 496 CG TYR A 36 -0.119 -7.702 2.774 1.00 0.00 C ATOM 497 CD1 TYR A 36 0.378 -6.408 2.870 1.00 0.00 C ATOM 498 CD2 TYR A 36 -1.082 -8.103 3.691 1.00 0.00 C ATOM 499 CE1 TYR A 36 -0.070 -5.541 3.847 1.00 0.00 C ATOM 500 CE2 TYR A 36 -1.538 -7.242 4.671 1.00 0.00 C ATOM 501 CZ TYR A 36 -1.029 -5.963 4.745 1.00 0.00 C ATOM 502 OH TYR A 36 -1.479 -5.103 5.721 1.00 0.00 O ATOM 0 H TYR A 36 2.713 -8.196 0.880 1.00 0.00 H new ATOM 0 HA TYR A 36 1.618 -9.540 3.211 1.00 0.00 H new ATOM 0 HB2 TYR A 36 0.624 -8.073 0.809 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -0.430 -9.328 1.429 1.00 0.00 H new ATOM 0 HD1 TYR A 36 1.128 -6.074 2.168 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -1.481 -9.105 3.637 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.328 -4.539 3.908 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -2.289 -7.569 5.375 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.154 -5.555 6.270 1.00 0.00 H new ATOM 512 N VAL A 37 0.833 -11.761 2.264 1.00 0.00 N ATOM 513 CA VAL A 37 0.670 -13.141 1.820 1.00 0.00 C ATOM 514 C VAL A 37 -0.792 -13.568 1.881 1.00 0.00 C ATOM 515 O VAL A 37 -1.234 -14.416 1.107 1.00 0.00 O ATOM 516 CB VAL A 37 1.513 -14.107 2.673 1.00 0.00 C ATOM 517 CG1 VAL A 37 2.996 -13.822 2.496 1.00 0.00 C ATOM 518 CG2 VAL A 37 1.114 -14.010 4.138 1.00 0.00 C ATOM 0 H VAL A 37 0.390 -11.551 3.159 1.00 0.00 H new ATOM 0 HA VAL A 37 1.015 -13.185 0.787 1.00 0.00 H new ATOM 0 HB VAL A 37 1.321 -15.125 2.334 1.00 0.00 H new ATOM 0 HG11 VAL A 37 3.575 -14.515 3.107 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.268 -13.947 1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 37 3.210 -12.799 2.806 1.00 0.00 H new ATOM 0 HG21 VAL A 37 1.720 -14.699 4.726 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.275 -12.992 4.492 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.061 -14.269 4.246 1.00 0.00 H new ATOM 528 N GLY A 38 -1.538 -12.975 2.808 1.00 0.00 N ATOM 529 CA GLY A 38 -2.944 -13.307 2.952 1.00 0.00 C ATOM 530 C GLY A 38 -3.609 -13.605 1.623 1.00 0.00 C ATOM 531 O GLY A 38 -3.721 -12.729 0.766 1.00 0.00 O ATOM 0 H GLY A 38 -1.194 -12.271 3.461 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.044 -14.172 3.607 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.462 -12.479 3.436 1.00 0.00 H new ATOM 535 N THR A 39 -4.051 -14.847 1.449 1.00 0.00 N ATOM 536 CA THR A 39 -4.706 -15.259 0.214 1.00 0.00 C ATOM 537 C THR A 39 -6.135 -15.719 0.477 1.00 0.00 C ATOM 538 O THR A 39 -7.050 -15.399 -0.282 1.00 0.00 O ATOM 539 CB THR A 39 -3.932 -16.396 -0.479 1.00 0.00 C ATOM 540 OG1 THR A 39 -4.590 -16.766 -1.696 1.00 0.00 O ATOM 541 CG2 THR A 39 -3.820 -17.609 0.431 1.00 0.00 C ATOM 0 H THR A 39 -3.967 -15.585 2.148 1.00 0.00 H new ATOM 0 HA THR A 39 -4.723 -14.388 -0.441 1.00 0.00 H new ATOM 0 HB THR A 39 -2.928 -16.037 -0.704 1.00 0.00 H new ATOM 0 HG1 THR A 39 -4.091 -17.488 -2.131 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.269 -18.398 -0.081 1.00 0.00 H new ATOM 0 HG22 THR A 39 -3.292 -17.332 1.344 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.818 -17.968 0.683 1.00 0.00 H new ATOM 549 N SER A 40 -6.320 -16.472 1.557 1.00 0.00 N ATOM 550 CA SER A 40 -7.639 -16.979 1.918 1.00 0.00 C ATOM 551 C SER A 40 -8.529 -15.855 2.441 1.00 0.00 C ATOM 552 O SER A 40 -9.612 -15.607 1.911 1.00 0.00 O ATOM 553 CB SER A 40 -7.514 -18.079 2.974 1.00 0.00 C ATOM 554 OG SER A 40 -8.685 -18.875 3.021 1.00 0.00 O ATOM 0 H SER A 40 -5.574 -16.744 2.197 1.00 0.00 H new ATOM 0 HA SER A 40 -8.099 -17.396 1.022 1.00 0.00 H new ATOM 0 HB2 SER A 40 -6.652 -18.707 2.749 1.00 0.00 H new ATOM 0 HB3 SER A 40 -7.336 -17.631 3.951 1.00 0.00 H new ATOM 0 HG SER A 40 -8.580 -19.572 3.702 1.00 0.00 H new ATOM 560 N HIS A 41 -8.063 -15.178 3.486 1.00 0.00 N ATOM 561 CA HIS A 41 -8.815 -14.079 4.082 1.00 0.00 C ATOM 562 C HIS A 41 -9.464 -13.217 3.003 1.00 0.00 C ATOM 563 O HIS A 41 -8.864 -12.952 1.961 1.00 0.00 O ATOM 564 CB HIS A 41 -7.900 -13.221 4.956 1.00 0.00 C ATOM 565 CG HIS A 41 -7.168 -12.160 4.194 1.00 0.00 C ATOM 566 ND1 HIS A 41 -7.487 -10.868 3.946 1.00 0.00 N flip ATOM 567 CD2 HIS A 41 -5.952 -12.376 3.581 1.00 0.00 C flip ATOM 568 CE1 HIS A 41 -6.469 -10.333 3.197 1.00 0.00 C flip ATOM 569 NE2 HIS A 41 -5.554 -11.263 2.990 1.00 0.00 N flip ATOM 0 H HIS A 41 -7.169 -15.371 3.937 1.00 0.00 H new ATOM 0 HA HIS A 41 -9.602 -14.505 4.704 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -8.495 -12.750 5.738 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -7.175 -13.866 5.452 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -8.328 -10.382 4.258 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -5.409 -13.310 3.583 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -6.423 -9.316 2.835 1.00 0.00 H new ATOM 578 N THR A 42 -10.694 -12.782 3.260 1.00 0.00 N ATOM 579 CA THR A 42 -11.424 -11.952 2.311 1.00 0.00 C ATOM 580 C THR A 42 -10.507 -10.920 1.663 1.00 0.00 C ATOM 581 O THR A 42 -9.627 -10.361 2.316 1.00 0.00 O ATOM 582 CB THR A 42 -12.599 -11.223 2.990 1.00 0.00 C ATOM 583 OG1 THR A 42 -13.378 -10.530 2.009 1.00 0.00 O ATOM 584 CG2 THR A 42 -12.094 -10.237 4.033 1.00 0.00 C ATOM 0 H THR A 42 -11.205 -12.991 4.118 1.00 0.00 H new ATOM 0 HA THR A 42 -11.815 -12.620 1.543 1.00 0.00 H new ATOM 0 HB THR A 42 -13.221 -11.967 3.488 1.00 0.00 H new ATOM 0 HG1 THR A 42 -14.124 -10.071 2.448 1.00 0.00 H new ATOM 0 HG21 THR A 42 -12.942 -9.734 4.499 1.00 0.00 H new ATOM 0 HG22 THR A 42 -11.526 -10.772 4.794 1.00 0.00 H new ATOM 0 HG23 THR A 42 -11.452 -9.498 3.554 1.00 0.00 H new ATOM 592 N GLY A 43 -10.721 -10.671 0.375 1.00 0.00 N ATOM 593 CA GLY A 43 -9.906 -9.706 -0.339 1.00 0.00 C ATOM 594 C GLY A 43 -8.450 -10.122 -0.419 1.00 0.00 C ATOM 595 O GLY A 43 -7.598 -9.555 0.264 1.00 0.00 O ATOM 0 H GLY A 43 -11.444 -11.120 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -10.300 -9.578 -1.347 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.977 -8.738 0.156 1.00 0.00 H new ATOM 599 N GLU A 44 -8.166 -11.117 -1.253 1.00 0.00 N ATOM 600 CA GLU A 44 -6.803 -11.610 -1.417 1.00 0.00 C ATOM 601 C GLU A 44 -5.809 -10.454 -1.471 1.00 0.00 C ATOM 602 O GLU A 44 -5.920 -9.565 -2.314 1.00 0.00 O ATOM 603 CB GLU A 44 -6.691 -12.454 -2.689 1.00 0.00 C ATOM 604 CG GLU A 44 -5.309 -13.045 -2.907 1.00 0.00 C ATOM 605 CD GLU A 44 -5.029 -13.352 -4.366 1.00 0.00 C ATOM 606 OE1 GLU A 44 -5.875 -14.009 -5.007 1.00 0.00 O ATOM 607 OE2 GLU A 44 -3.964 -12.934 -4.865 1.00 0.00 O ATOM 0 H GLU A 44 -8.860 -11.597 -1.825 1.00 0.00 H new ATOM 0 HA GLU A 44 -6.563 -12.232 -0.555 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -7.420 -13.263 -2.643 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -6.953 -11.837 -3.549 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.557 -12.349 -2.535 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.213 -13.960 -2.322 1.00 0.00 H new ATOM 614 N ALA A 45 -4.838 -10.474 -0.564 1.00 0.00 N ATOM 615 CA ALA A 45 -3.823 -9.429 -0.509 1.00 0.00 C ATOM 616 C ALA A 45 -2.419 -10.024 -0.538 1.00 0.00 C ATOM 617 O ALA A 45 -1.962 -10.608 0.444 1.00 0.00 O ATOM 618 CB ALA A 45 -4.011 -8.576 0.738 1.00 0.00 C ATOM 0 H ALA A 45 -4.733 -11.202 0.143 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.940 -8.797 -1.390 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.246 -7.800 0.766 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.998 -8.113 0.717 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.924 -9.204 1.625 1.00 0.00 H new ATOM 624 N SER A 46 -1.741 -9.874 -1.672 1.00 0.00 N ATOM 625 CA SER A 46 -0.391 -10.401 -1.830 1.00 0.00 C ATOM 626 C SER A 46 0.435 -9.510 -2.753 1.00 0.00 C ATOM 627 O SER A 46 -0.017 -9.124 -3.830 1.00 0.00 O ATOM 628 CB SER A 46 -0.439 -11.825 -2.387 1.00 0.00 C ATOM 629 OG SER A 46 -0.822 -11.827 -3.751 1.00 0.00 O ATOM 0 H SER A 46 -2.105 -9.392 -2.494 1.00 0.00 H new ATOM 0 HA SER A 46 0.083 -10.418 -0.849 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.539 -12.294 -2.280 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.143 -12.422 -1.808 1.00 0.00 H new ATOM 0 HG SER A 46 -0.843 -12.749 -4.083 1.00 0.00 H new ATOM 635 N GLY A 47 1.650 -9.187 -2.321 1.00 0.00 N ATOM 636 CA GLY A 47 2.521 -8.344 -3.119 1.00 0.00 C ATOM 637 C GLY A 47 3.195 -7.263 -2.297 1.00 0.00 C ATOM 638 O GLY A 47 3.087 -7.250 -1.070 1.00 0.00 O ATOM 0 H GLY A 47 2.047 -9.494 -1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.282 -8.962 -3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.941 -7.881 -3.917 1.00 0.00 H new ATOM 642 N ILE A 48 3.893 -6.357 -2.973 1.00 0.00 N ATOM 643 CA ILE A 48 4.587 -5.268 -2.296 1.00 0.00 C ATOM 644 C ILE A 48 3.726 -4.010 -2.252 1.00 0.00 C ATOM 645 O ILE A 48 3.268 -3.523 -3.286 1.00 0.00 O ATOM 646 CB ILE A 48 5.924 -4.938 -2.986 1.00 0.00 C ATOM 647 CG1 ILE A 48 6.772 -6.203 -3.136 1.00 0.00 C ATOM 648 CG2 ILE A 48 6.679 -3.878 -2.198 1.00 0.00 C ATOM 649 CD1 ILE A 48 7.225 -6.786 -1.816 1.00 0.00 C ATOM 0 H ILE A 48 3.993 -6.355 -3.988 1.00 0.00 H new ATOM 0 HA ILE A 48 4.786 -5.605 -1.278 1.00 0.00 H new ATOM 0 HB ILE A 48 5.715 -4.544 -3.980 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.197 -6.954 -3.678 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.648 -5.974 -3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.622 -3.655 -2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.077 -2.971 -2.138 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.880 -4.247 -1.192 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.821 -7.680 -1.999 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.827 -6.051 -1.281 1.00 0.00 H new ATOM 0 HD13 ILE A 48 6.354 -7.047 -1.215 1.00 0.00 H new ATOM 661 N TYR A 49 3.511 -3.489 -1.049 1.00 0.00 N ATOM 662 CA TYR A 49 2.705 -2.288 -0.870 1.00 0.00 C ATOM 663 C TYR A 49 3.439 -1.261 -0.012 1.00 0.00 C ATOM 664 O TYR A 49 4.204 -1.617 0.884 1.00 0.00 O ATOM 665 CB TYR A 49 1.363 -2.640 -0.226 1.00 0.00 C ATOM 666 CG TYR A 49 0.501 -3.543 -1.080 1.00 0.00 C ATOM 667 CD1 TYR A 49 0.624 -4.925 -1.007 1.00 0.00 C ATOM 668 CD2 TYR A 49 -0.437 -3.014 -1.958 1.00 0.00 C ATOM 669 CE1 TYR A 49 -0.160 -5.754 -1.785 1.00 0.00 C ATOM 670 CE2 TYR A 49 -1.227 -3.836 -2.739 1.00 0.00 C ATOM 671 CZ TYR A 49 -1.085 -5.205 -2.649 1.00 0.00 C ATOM 672 OH TYR A 49 -1.869 -6.026 -3.426 1.00 0.00 O ATOM 0 H TYR A 49 3.884 -3.880 -0.184 1.00 0.00 H new ATOM 0 HA TYR A 49 2.526 -1.852 -1.853 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.546 -3.126 0.733 1.00 0.00 H new ATOM 0 HB3 TYR A 49 0.817 -1.720 -0.018 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.345 -5.358 -0.330 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.551 -1.942 -2.031 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -0.050 -6.826 -1.717 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -1.952 -3.409 -3.416 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.468 -5.480 -3.977 1.00 0.00 H new ATOM 682 N VAL A 50 3.199 0.015 -0.294 1.00 0.00 N ATOM 683 CA VAL A 50 3.835 1.095 0.452 1.00 0.00 C ATOM 684 C VAL A 50 3.276 1.189 1.867 1.00 0.00 C ATOM 685 O VAL A 50 2.254 1.835 2.101 1.00 0.00 O ATOM 686 CB VAL A 50 3.648 2.451 -0.254 1.00 0.00 C ATOM 687 CG1 VAL A 50 4.137 3.587 0.632 1.00 0.00 C ATOM 688 CG2 VAL A 50 4.371 2.459 -1.593 1.00 0.00 C ATOM 0 H VAL A 50 2.569 0.327 -1.033 1.00 0.00 H new ATOM 0 HA VAL A 50 4.899 0.863 0.500 1.00 0.00 H new ATOM 0 HB VAL A 50 2.584 2.600 -0.440 1.00 0.00 H new ATOM 0 HG11 VAL A 50 3.997 4.537 0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 50 3.570 3.592 1.563 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.195 3.447 0.853 1.00 0.00 H new ATOM 0 HG21 VAL A 50 4.228 3.425 -2.078 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.435 2.287 -1.433 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.968 1.671 -2.229 1.00 0.00 H new ATOM 698 N LYS A 51 3.953 0.542 2.809 1.00 0.00 N ATOM 699 CA LYS A 51 3.526 0.553 4.203 1.00 0.00 C ATOM 700 C LYS A 51 3.458 1.979 4.740 1.00 0.00 C ATOM 701 O LYS A 51 2.518 2.343 5.446 1.00 0.00 O ATOM 702 CB LYS A 51 4.483 -0.281 5.058 1.00 0.00 C ATOM 703 CG LYS A 51 4.099 -0.333 6.527 1.00 0.00 C ATOM 704 CD LYS A 51 3.057 -1.406 6.793 1.00 0.00 C ATOM 705 CE LYS A 51 3.085 -1.863 8.243 1.00 0.00 C ATOM 706 NZ LYS A 51 1.783 -2.449 8.666 1.00 0.00 N ATOM 0 H LYS A 51 4.801 0.003 2.632 1.00 0.00 H new ATOM 0 HA LYS A 51 2.529 0.116 4.255 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.517 -1.297 4.664 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.489 0.130 4.968 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.986 -0.529 7.129 1.00 0.00 H new ATOM 0 HG3 LYS A 51 3.711 0.637 6.837 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.067 -1.021 6.551 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.236 -2.259 6.138 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.876 -2.602 8.376 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.328 -1.017 8.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.844 -2.748 9.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 1.032 -1.737 8.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.563 -3.272 8.070 1.00 0.00 H new ATOM 720 N SER A 52 4.461 2.783 4.400 1.00 0.00 N ATOM 721 CA SER A 52 4.516 4.169 4.850 1.00 0.00 C ATOM 722 C SER A 52 5.471 4.984 3.982 1.00 0.00 C ATOM 723 O SER A 52 6.175 4.438 3.132 1.00 0.00 O ATOM 724 CB SER A 52 4.957 4.235 6.313 1.00 0.00 C ATOM 725 OG SER A 52 3.874 3.956 7.184 1.00 0.00 O ATOM 0 H SER A 52 5.246 2.498 3.815 1.00 0.00 H new ATOM 0 HA SER A 52 3.517 4.595 4.760 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.761 3.520 6.487 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.358 5.225 6.531 1.00 0.00 H new ATOM 0 HG SER A 52 3.177 3.471 6.695 1.00 0.00 H new ATOM 731 N VAL A 53 5.489 6.294 4.204 1.00 0.00 N ATOM 732 CA VAL A 53 6.357 7.186 3.444 1.00 0.00 C ATOM 733 C VAL A 53 7.150 8.101 4.370 1.00 0.00 C ATOM 734 O VAL A 53 6.606 9.049 4.938 1.00 0.00 O ATOM 735 CB VAL A 53 5.549 8.049 2.456 1.00 0.00 C ATOM 736 CG1 VAL A 53 6.461 9.028 1.734 1.00 0.00 C ATOM 737 CG2 VAL A 53 4.806 7.167 1.464 1.00 0.00 C ATOM 0 H VAL A 53 4.913 6.761 4.904 1.00 0.00 H new ATOM 0 HA VAL A 53 7.046 6.555 2.883 1.00 0.00 H new ATOM 0 HB VAL A 53 4.813 8.623 3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 53 5.873 9.629 1.040 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.943 9.681 2.462 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.222 8.477 1.182 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.240 7.793 0.773 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.522 6.565 0.905 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.122 6.510 2.002 1.00 0.00 H new ATOM 747 N ILE A 54 8.438 7.812 4.518 1.00 0.00 N ATOM 748 CA ILE A 54 9.307 8.610 5.374 1.00 0.00 C ATOM 749 C ILE A 54 9.312 10.072 4.942 1.00 0.00 C ATOM 750 O ILE A 54 9.499 10.398 3.769 1.00 0.00 O ATOM 751 CB ILE A 54 10.752 8.078 5.362 1.00 0.00 C ATOM 752 CG1 ILE A 54 10.835 6.746 6.111 1.00 0.00 C ATOM 753 CG2 ILE A 54 11.697 9.098 5.979 1.00 0.00 C ATOM 754 CD1 ILE A 54 10.495 5.548 5.252 1.00 0.00 C ATOM 0 H ILE A 54 8.903 7.031 4.056 1.00 0.00 H new ATOM 0 HA ILE A 54 8.909 8.534 6.386 1.00 0.00 H new ATOM 0 HB ILE A 54 11.053 7.911 4.328 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.843 6.624 6.508 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.157 6.775 6.964 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.715 8.707 5.963 1.00 0.00 H new ATOM 0 HG22 ILE A 54 11.655 10.025 5.407 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.399 9.293 7.009 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.575 4.639 5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.477 5.647 4.876 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.188 5.494 4.413 1.00 0.00 H new ATOM 766 N PRO A 55 9.102 10.976 5.910 1.00 0.00 N ATOM 767 CA PRO A 55 9.080 12.420 5.655 1.00 0.00 C ATOM 768 C PRO A 55 10.460 12.968 5.306 1.00 0.00 C ATOM 769 O PRO A 55 11.479 12.347 5.605 1.00 0.00 O ATOM 770 CB PRO A 55 8.591 13.007 6.981 1.00 0.00 C ATOM 771 CG PRO A 55 8.974 11.998 8.007 1.00 0.00 C ATOM 772 CD PRO A 55 8.872 10.659 7.330 1.00 0.00 C ATOM 0 HA PRO A 55 8.450 12.674 4.803 1.00 0.00 H new ATOM 0 HB2 PRO A 55 9.056 13.972 7.182 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.513 13.169 6.968 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.986 12.176 8.370 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.312 12.050 8.871 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.615 9.959 7.711 1.00 0.00 H new ATOM 0 HD3 PRO A 55 7.894 10.203 7.487 1.00 0.00 H new ATOM 780 N GLY A 56 10.485 14.136 4.672 1.00 0.00 N ATOM 781 CA GLY A 56 11.745 14.748 4.293 1.00 0.00 C ATOM 782 C GLY A 56 12.575 13.856 3.392 1.00 0.00 C ATOM 783 O GLY A 56 13.803 13.942 3.383 1.00 0.00 O ATOM 0 H GLY A 56 9.655 14.670 4.414 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.548 15.691 3.784 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.316 14.984 5.191 1.00 0.00 H new ATOM 787 N SER A 57 11.904 12.996 2.633 1.00 0.00 N ATOM 788 CA SER A 57 12.588 12.080 1.727 1.00 0.00 C ATOM 789 C SER A 57 12.118 12.284 0.291 1.00 0.00 C ATOM 790 O SER A 57 11.067 12.876 0.048 1.00 0.00 O ATOM 791 CB SER A 57 12.347 10.631 2.155 1.00 0.00 C ATOM 792 OG SER A 57 11.133 10.137 1.617 1.00 0.00 O ATOM 0 H SER A 57 10.887 12.914 2.627 1.00 0.00 H new ATOM 0 HA SER A 57 13.656 12.292 1.774 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.177 10.007 1.822 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.318 10.570 3.243 1.00 0.00 H new ATOM 0 HG SER A 57 10.446 10.126 2.316 1.00 0.00 H new ATOM 798 N ALA A 58 12.904 11.788 -0.659 1.00 0.00 N ATOM 799 CA ALA A 58 12.568 11.912 -2.072 1.00 0.00 C ATOM 800 C ALA A 58 11.093 11.611 -2.314 1.00 0.00 C ATOM 801 O ALA A 58 10.367 12.429 -2.878 1.00 0.00 O ATOM 802 CB ALA A 58 13.442 10.987 -2.906 1.00 0.00 C ATOM 0 H ALA A 58 13.779 11.296 -0.475 1.00 0.00 H new ATOM 0 HA ALA A 58 12.756 12.942 -2.376 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.180 11.090 -3.959 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.490 11.252 -2.765 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.283 9.955 -2.592 1.00 0.00 H new ATOM 808 N ALA A 59 10.657 10.431 -1.884 1.00 0.00 N ATOM 809 CA ALA A 59 9.268 10.023 -2.054 1.00 0.00 C ATOM 810 C ALA A 59 8.313 11.124 -1.605 1.00 0.00 C ATOM 811 O ALA A 59 7.429 11.537 -2.356 1.00 0.00 O ATOM 812 CB ALA A 59 8.997 8.740 -1.282 1.00 0.00 C ATOM 0 H ALA A 59 11.245 9.742 -1.416 1.00 0.00 H new ATOM 0 HA ALA A 59 9.096 9.840 -3.115 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.956 8.447 -1.418 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.648 7.948 -1.652 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.192 8.905 -0.222 1.00 0.00 H new ATOM 818 N TYR A 60 8.497 11.595 -0.376 1.00 0.00 N ATOM 819 CA TYR A 60 7.649 12.647 0.173 1.00 0.00 C ATOM 820 C TYR A 60 7.729 13.911 -0.677 1.00 0.00 C ATOM 821 O TYR A 60 6.709 14.521 -1.001 1.00 0.00 O ATOM 822 CB TYR A 60 8.059 12.960 1.613 1.00 0.00 C ATOM 823 CG TYR A 60 7.328 14.143 2.207 1.00 0.00 C ATOM 824 CD1 TYR A 60 6.057 13.998 2.750 1.00 0.00 C ATOM 825 CD2 TYR A 60 7.909 15.405 2.226 1.00 0.00 C ATOM 826 CE1 TYR A 60 5.386 15.076 3.293 1.00 0.00 C ATOM 827 CE2 TYR A 60 7.245 16.489 2.769 1.00 0.00 C ATOM 828 CZ TYR A 60 5.983 16.319 3.300 1.00 0.00 C ATOM 829 OH TYR A 60 5.318 17.395 3.841 1.00 0.00 O ATOM 0 H TYR A 60 9.225 11.265 0.258 1.00 0.00 H new ATOM 0 HA TYR A 60 6.619 12.291 0.164 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.876 12.082 2.233 1.00 0.00 H new ATOM 0 HB3 TYR A 60 9.131 13.154 1.643 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.586 13.026 2.747 1.00 0.00 H new ATOM 0 HD2 TYR A 60 8.896 15.541 1.809 1.00 0.00 H new ATOM 0 HE1 TYR A 60 4.398 14.946 3.710 1.00 0.00 H new ATOM 0 HE2 TYR A 60 7.711 17.463 2.778 1.00 0.00 H new ATOM 0 HH TYR A 60 5.878 18.196 3.768 1.00 0.00 H new ATOM 839 N HIS A 61 8.949 14.299 -1.035 1.00 0.00 N ATOM 840 CA HIS A 61 9.163 15.491 -1.849 1.00 0.00 C ATOM 841 C HIS A 61 8.271 15.471 -3.087 1.00 0.00 C ATOM 842 O HIS A 61 7.444 16.360 -3.281 1.00 0.00 O ATOM 843 CB HIS A 61 10.631 15.591 -2.266 1.00 0.00 C ATOM 844 CG HIS A 61 11.559 15.880 -1.126 1.00 0.00 C ATOM 845 ND1 HIS A 61 11.219 16.697 -0.068 1.00 0.00 N ATOM 846 CD2 HIS A 61 12.820 15.455 -0.882 1.00 0.00 C ATOM 847 CE1 HIS A 61 12.233 16.763 0.777 1.00 0.00 C ATOM 848 NE2 HIS A 61 13.217 16.018 0.306 1.00 0.00 N ATOM 0 H HIS A 61 9.803 13.806 -0.775 1.00 0.00 H new ATOM 0 HA HIS A 61 8.902 16.363 -1.249 1.00 0.00 H new ATOM 0 HB2 HIS A 61 10.930 14.656 -2.739 1.00 0.00 H new ATOM 0 HB3 HIS A 61 10.735 16.375 -3.016 1.00 0.00 H new ATOM 0 HD2 HIS A 61 13.406 14.796 -1.506 1.00 0.00 H new ATOM 0 HE1 HIS A 61 12.254 17.330 1.696 1.00 0.00 H new ATOM 0 HE2 HIS A 61 14.124 15.883 0.752 1.00 0.00 H new ATOM 857 N ASN A 62 8.446 14.451 -3.921 1.00 0.00 N ATOM 858 CA ASN A 62 7.658 14.317 -5.140 1.00 0.00 C ATOM 859 C ASN A 62 6.168 14.239 -4.819 1.00 0.00 C ATOM 860 O ASN A 62 5.333 14.732 -5.576 1.00 0.00 O ATOM 861 CB ASN A 62 8.089 13.071 -5.917 1.00 0.00 C ATOM 862 CG ASN A 62 7.905 13.230 -7.414 1.00 0.00 C ATOM 863 OD1 ASN A 62 8.447 12.290 -8.179 1.00 0.00 O flip ATOM 864 ND2 ASN A 62 7.283 14.186 -7.876 1.00 0.00 N flip ATOM 0 H ASN A 62 9.127 13.705 -3.775 1.00 0.00 H new ATOM 0 HA ASN A 62 7.834 15.200 -5.755 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.136 12.857 -5.703 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.512 12.213 -5.572 1.00 0.00 H new ATOM 0 HD21 ASN A 62 6.883 14.885 -7.250 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.167 14.279 -8.885 1.00 0.00 H new ATOM 871 N GLY A 63 5.843 13.617 -3.690 1.00 0.00 N ATOM 872 CA GLY A 63 4.455 13.487 -3.288 1.00 0.00 C ATOM 873 C GLY A 63 3.637 12.686 -4.281 1.00 0.00 C ATOM 874 O GLY A 63 2.454 12.962 -4.488 1.00 0.00 O ATOM 0 H GLY A 63 6.516 13.201 -3.047 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.406 13.007 -2.311 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.017 14.479 -3.178 1.00 0.00 H new ATOM 878 N HIS A 64 4.266 11.692 -4.900 1.00 0.00 N ATOM 879 CA HIS A 64 3.588 10.850 -5.879 1.00 0.00 C ATOM 880 C HIS A 64 3.402 9.434 -5.340 1.00 0.00 C ATOM 881 O HIS A 64 2.365 8.808 -5.559 1.00 0.00 O ATOM 882 CB HIS A 64 4.381 10.811 -7.186 1.00 0.00 C ATOM 883 CG HIS A 64 4.039 11.925 -8.127 1.00 0.00 C ATOM 884 ND1 HIS A 64 4.469 13.207 -8.174 1.00 0.00 N flip ATOM 885 CD2 HIS A 64 3.152 11.780 -9.173 1.00 0.00 C flip ATOM 886 CE1 HIS A 64 3.841 13.808 -9.238 1.00 0.00 C flip ATOM 887 NE2 HIS A 64 3.053 12.925 -9.824 1.00 0.00 N flip ATOM 0 H HIS A 64 5.244 11.450 -4.741 1.00 0.00 H new ATOM 0 HA HIS A 64 2.605 11.279 -6.073 1.00 0.00 H new ATOM 0 HB2 HIS A 64 5.446 10.854 -6.957 1.00 0.00 H new ATOM 0 HB3 HIS A 64 4.200 9.858 -7.683 1.00 0.00 H new ATOM 0 HD2 HIS A 64 2.622 10.873 -9.421 1.00 0.00 H new ATOM 0 HE1 HIS A 64 3.971 14.835 -9.545 1.00 0.00 H new ATOM 0 HE2 HIS A 64 2.467 13.098 -10.641 1.00 0.00 H new ATOM 896 N ILE A 65 4.414 8.936 -4.637 1.00 0.00 N ATOM 897 CA ILE A 65 4.361 7.595 -4.068 1.00 0.00 C ATOM 898 C ILE A 65 3.848 7.627 -2.633 1.00 0.00 C ATOM 899 O ILE A 65 4.553 8.057 -1.721 1.00 0.00 O ATOM 900 CB ILE A 65 5.744 6.918 -4.092 1.00 0.00 C ATOM 901 CG1 ILE A 65 6.271 6.836 -5.526 1.00 0.00 C ATOM 902 CG2 ILE A 65 5.666 5.532 -3.470 1.00 0.00 C ATOM 903 CD1 ILE A 65 7.780 6.888 -5.620 1.00 0.00 C ATOM 0 H ILE A 65 5.280 9.441 -4.448 1.00 0.00 H new ATOM 0 HA ILE A 65 3.672 7.018 -4.685 1.00 0.00 H new ATOM 0 HB ILE A 65 6.437 7.520 -3.504 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.919 5.911 -5.981 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.851 7.657 -6.106 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.651 5.066 -3.494 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.329 5.615 -2.437 1.00 0.00 H new ATOM 0 HG23 ILE A 65 4.961 4.920 -4.033 1.00 0.00 H new ATOM 0 HD11 ILE A 65 8.082 6.825 -6.665 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.139 7.825 -5.195 1.00 0.00 H new ATOM 0 HD13 ILE A 65 8.208 6.051 -5.068 1.00 0.00 H new ATOM 915 N GLN A 66 2.615 7.167 -2.440 1.00 0.00 N ATOM 916 CA GLN A 66 2.009 7.142 -1.114 1.00 0.00 C ATOM 917 C GLN A 66 1.492 5.747 -0.778 1.00 0.00 C ATOM 918 O GLN A 66 1.451 4.866 -1.637 1.00 0.00 O ATOM 919 CB GLN A 66 0.865 8.155 -1.035 1.00 0.00 C ATOM 920 CG GLN A 66 1.228 9.527 -1.581 1.00 0.00 C ATOM 921 CD GLN A 66 0.927 9.664 -3.061 1.00 0.00 C ATOM 922 OE1 GLN A 66 0.442 8.728 -3.697 1.00 0.00 O ATOM 923 NE2 GLN A 66 1.215 10.835 -3.617 1.00 0.00 N ATOM 0 H GLN A 66 2.017 6.807 -3.184 1.00 0.00 H new ATOM 0 HA GLN A 66 2.775 7.411 -0.386 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.009 7.768 -1.588 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.553 8.258 0.004 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.678 10.290 -1.030 1.00 0.00 H new ATOM 0 HG3 GLN A 66 2.289 9.713 -1.411 1.00 0.00 H new ATOM 0 HE21 GLN A 66 1.616 11.583 -3.052 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.035 10.986 -4.610 1.00 0.00 H new ATOM 932 N VAL A 67 1.099 5.553 0.477 1.00 0.00 N ATOM 933 CA VAL A 67 0.585 4.265 0.926 1.00 0.00 C ATOM 934 C VAL A 67 -0.586 3.810 0.063 1.00 0.00 C ATOM 935 O VAL A 67 -1.050 4.543 -0.809 1.00 0.00 O ATOM 936 CB VAL A 67 0.131 4.325 2.397 1.00 0.00 C ATOM 937 CG1 VAL A 67 1.311 4.629 3.308 1.00 0.00 C ATOM 938 CG2 VAL A 67 -0.970 5.360 2.573 1.00 0.00 C ATOM 0 H VAL A 67 1.127 6.271 1.200 1.00 0.00 H new ATOM 0 HA VAL A 67 1.401 3.548 0.833 1.00 0.00 H new ATOM 0 HB VAL A 67 -0.270 3.351 2.675 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.971 4.668 4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.063 3.847 3.202 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.745 5.590 3.033 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.279 5.389 3.618 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.598 6.341 2.277 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.824 5.093 1.950 1.00 0.00 H new ATOM 948 N ASN A 68 -1.060 2.593 0.313 1.00 0.00 N ATOM 949 CA ASN A 68 -2.178 2.039 -0.442 1.00 0.00 C ATOM 950 C ASN A 68 -1.832 1.930 -1.925 1.00 0.00 C ATOM 951 O ASN A 68 -2.692 2.110 -2.787 1.00 0.00 O ATOM 952 CB ASN A 68 -3.424 2.906 -0.260 1.00 0.00 C ATOM 953 CG ASN A 68 -3.578 3.406 1.164 1.00 0.00 C ATOM 954 OD1 ASN A 68 -3.211 2.718 2.118 1.00 0.00 O ATOM 955 ND2 ASN A 68 -4.122 4.608 1.314 1.00 0.00 N ATOM 0 H ASN A 68 -0.687 1.973 1.032 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.382 1.039 -0.060 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.372 3.758 -0.938 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -4.307 2.331 -0.538 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.250 4.997 2.248 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.411 5.143 0.495 1.00 0.00 H new ATOM 962 N ASP A 69 -0.570 1.636 -2.212 1.00 0.00 N ATOM 963 CA ASP A 69 -0.110 1.502 -3.590 1.00 0.00 C ATOM 964 C ASP A 69 0.624 0.180 -3.792 1.00 0.00 C ATOM 965 O ASP A 69 1.294 -0.315 -2.886 1.00 0.00 O ATOM 966 CB ASP A 69 0.805 2.670 -3.961 1.00 0.00 C ATOM 967 CG ASP A 69 0.035 3.867 -4.480 1.00 0.00 C ATOM 968 OD1 ASP A 69 -0.955 3.663 -5.213 1.00 0.00 O ATOM 969 OD2 ASP A 69 0.422 5.009 -4.155 1.00 0.00 O ATOM 0 H ASP A 69 0.154 1.486 -1.509 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.984 1.515 -4.241 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.384 2.966 -3.086 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.517 2.343 -4.719 1.00 0.00 H new ATOM 974 N LYS A 70 0.491 -0.388 -4.986 1.00 0.00 N ATOM 975 CA LYS A 70 1.141 -1.653 -5.308 1.00 0.00 C ATOM 976 C LYS A 70 2.310 -1.436 -6.264 1.00 0.00 C ATOM 977 O LYS A 70 2.120 -1.017 -7.406 1.00 0.00 O ATOM 978 CB LYS A 70 0.134 -2.623 -5.930 1.00 0.00 C ATOM 979 CG LYS A 70 0.449 -4.084 -5.656 1.00 0.00 C ATOM 980 CD LYS A 70 -0.035 -4.979 -6.784 1.00 0.00 C ATOM 981 CE LYS A 70 0.975 -5.040 -7.919 1.00 0.00 C ATOM 982 NZ LYS A 70 0.317 -5.263 -9.236 1.00 0.00 N ATOM 0 H LYS A 70 -0.061 0.008 -5.747 1.00 0.00 H new ATOM 0 HA LYS A 70 1.526 -2.081 -4.382 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.861 -2.396 -5.547 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.105 -2.462 -7.008 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.524 -4.208 -5.528 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.020 -4.389 -4.721 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.215 -5.984 -6.401 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -0.987 -4.607 -7.162 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.543 -4.110 -7.950 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.687 -5.843 -7.728 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.849 -5.976 -9.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.656 -5.598 -9.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 0.297 -4.371 -9.770 1.00 0.00 H new ATOM 996 N ILE A 71 3.517 -1.724 -5.790 1.00 0.00 N ATOM 997 CA ILE A 71 4.715 -1.562 -6.604 1.00 0.00 C ATOM 998 C ILE A 71 4.933 -2.771 -7.508 1.00 0.00 C ATOM 999 O ILE A 71 5.012 -3.906 -7.037 1.00 0.00 O ATOM 1000 CB ILE A 71 5.967 -1.358 -5.730 1.00 0.00 C ATOM 1001 CG1 ILE A 71 5.702 -0.291 -4.664 1.00 0.00 C ATOM 1002 CG2 ILE A 71 7.158 -0.968 -6.592 1.00 0.00 C ATOM 1003 CD1 ILE A 71 6.695 -0.317 -3.524 1.00 0.00 C ATOM 0 H ILE A 71 3.691 -2.071 -4.847 1.00 0.00 H new ATOM 0 HA ILE A 71 4.561 -0.674 -7.218 1.00 0.00 H new ATOM 0 HB ILE A 71 6.199 -2.298 -5.229 1.00 0.00 H new ATOM 0 HG12 ILE A 71 5.725 0.693 -5.133 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.698 -0.430 -4.264 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.034 -0.828 -5.959 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.356 -1.757 -7.317 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.938 -0.039 -7.118 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.446 0.465 -2.807 1.00 0.00 H new ATOM 0 HD12 ILE A 71 6.656 -1.288 -3.030 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.699 -0.147 -3.912 1.00 0.00 H new ATOM 1015 N VAL A 72 5.031 -2.520 -8.810 1.00 0.00 N ATOM 1016 CA VAL A 72 5.243 -3.586 -9.780 1.00 0.00 C ATOM 1017 C VAL A 72 6.652 -3.530 -10.360 1.00 0.00 C ATOM 1018 O VAL A 72 7.187 -4.540 -10.816 1.00 0.00 O ATOM 1019 CB VAL A 72 4.223 -3.508 -10.932 1.00 0.00 C ATOM 1020 CG1 VAL A 72 2.860 -4.001 -10.472 1.00 0.00 C ATOM 1021 CG2 VAL A 72 4.133 -2.087 -11.467 1.00 0.00 C ATOM 0 H VAL A 72 4.967 -1.587 -9.217 1.00 0.00 H new ATOM 0 HA VAL A 72 5.109 -4.528 -9.248 1.00 0.00 H new ATOM 0 HB VAL A 72 4.563 -4.155 -11.740 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.152 -3.939 -11.299 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.940 -5.036 -10.141 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.509 -3.382 -9.646 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.408 -2.050 -12.280 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.817 -1.417 -10.668 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.110 -1.775 -11.837 1.00 0.00 H new ATOM 1031 N ALA A 73 7.249 -2.343 -10.337 1.00 0.00 N ATOM 1032 CA ALA A 73 8.597 -2.155 -10.858 1.00 0.00 C ATOM 1033 C ALA A 73 9.282 -0.967 -10.192 1.00 0.00 C ATOM 1034 O ALA A 73 8.642 0.038 -9.881 1.00 0.00 O ATOM 1035 CB ALA A 73 8.558 -1.966 -12.367 1.00 0.00 C ATOM 0 H ALA A 73 6.820 -1.497 -9.963 1.00 0.00 H new ATOM 0 HA ALA A 73 9.176 -3.050 -10.630 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.572 -1.827 -12.743 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.116 -2.847 -12.833 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.958 -1.089 -12.608 1.00 0.00 H new ATOM 1041 N VAL A 74 10.588 -1.089 -9.974 1.00 0.00 N ATOM 1042 CA VAL A 74 11.361 -0.024 -9.345 1.00 0.00 C ATOM 1043 C VAL A 74 12.579 0.341 -10.185 1.00 0.00 C ATOM 1044 O VAL A 74 13.455 -0.491 -10.421 1.00 0.00 O ATOM 1045 CB VAL A 74 11.826 -0.428 -7.933 1.00 0.00 C ATOM 1046 CG1 VAL A 74 12.597 0.708 -7.279 1.00 0.00 C ATOM 1047 CG2 VAL A 74 10.637 -0.839 -7.077 1.00 0.00 C ATOM 0 H VAL A 74 11.133 -1.914 -10.224 1.00 0.00 H new ATOM 0 HA VAL A 74 10.704 0.842 -9.269 1.00 0.00 H new ATOM 0 HB VAL A 74 12.494 -1.285 -8.021 1.00 0.00 H new ATOM 0 HG11 VAL A 74 12.917 0.404 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.471 0.949 -7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.956 1.586 -7.202 1.00 0.00 H new ATOM 0 HG21 VAL A 74 10.984 -1.121 -6.083 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.942 -0.004 -6.995 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.132 -1.687 -7.539 1.00 0.00 H new ATOM 1057 N ASP A 75 12.629 1.590 -10.633 1.00 0.00 N ATOM 1058 CA ASP A 75 13.741 2.067 -11.446 1.00 0.00 C ATOM 1059 C ASP A 75 13.840 1.279 -12.748 1.00 0.00 C ATOM 1060 O ASP A 75 14.932 1.043 -13.262 1.00 0.00 O ATOM 1061 CB ASP A 75 15.053 1.957 -10.668 1.00 0.00 C ATOM 1062 CG ASP A 75 16.081 2.976 -11.120 1.00 0.00 C ATOM 1063 OD1 ASP A 75 16.765 2.721 -12.134 1.00 0.00 O ATOM 1064 OD2 ASP A 75 16.202 4.029 -10.460 1.00 0.00 O ATOM 0 H ASP A 75 11.912 2.291 -10.447 1.00 0.00 H new ATOM 0 HA ASP A 75 13.558 3.114 -11.689 1.00 0.00 H new ATOM 0 HB2 ASP A 75 14.854 2.093 -9.605 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.462 0.954 -10.790 1.00 0.00 H new ATOM 1069 N GLY A 76 12.689 0.873 -13.277 1.00 0.00 N ATOM 1070 CA GLY A 76 12.668 0.114 -14.514 1.00 0.00 C ATOM 1071 C GLY A 76 13.002 -1.349 -14.303 1.00 0.00 C ATOM 1072 O GLY A 76 13.442 -2.033 -15.227 1.00 0.00 O ATOM 0 H GLY A 76 11.771 1.056 -12.871 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.681 0.196 -14.970 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.380 0.549 -15.215 1.00 0.00 H new ATOM 1076 N VAL A 77 12.793 -1.831 -13.081 1.00 0.00 N ATOM 1077 CA VAL A 77 13.075 -3.223 -12.751 1.00 0.00 C ATOM 1078 C VAL A 77 11.818 -3.939 -12.270 1.00 0.00 C ATOM 1079 O VAL A 77 11.276 -3.620 -11.213 1.00 0.00 O ATOM 1080 CB VAL A 77 14.163 -3.333 -11.665 1.00 0.00 C ATOM 1081 CG1 VAL A 77 14.323 -4.776 -11.214 1.00 0.00 C ATOM 1082 CG2 VAL A 77 15.483 -2.775 -12.176 1.00 0.00 C ATOM 0 H VAL A 77 12.430 -1.278 -12.304 1.00 0.00 H new ATOM 0 HA VAL A 77 13.434 -3.699 -13.664 1.00 0.00 H new ATOM 0 HB VAL A 77 13.854 -2.741 -10.803 1.00 0.00 H new ATOM 0 HG11 VAL A 77 15.095 -4.834 -10.447 1.00 0.00 H new ATOM 0 HG12 VAL A 77 13.379 -5.136 -10.806 1.00 0.00 H new ATOM 0 HG13 VAL A 77 14.610 -5.394 -12.065 1.00 0.00 H new ATOM 0 HG21 VAL A 77 16.240 -2.860 -11.397 1.00 0.00 H new ATOM 0 HG22 VAL A 77 15.801 -3.338 -13.054 1.00 0.00 H new ATOM 0 HG23 VAL A 77 15.355 -1.726 -12.444 1.00 0.00 H new ATOM 1092 N ASN A 78 11.361 -4.911 -13.053 1.00 0.00 N ATOM 1093 CA ASN A 78 10.167 -5.673 -12.707 1.00 0.00 C ATOM 1094 C ASN A 78 10.368 -6.436 -11.402 1.00 0.00 C ATOM 1095 O ASN A 78 10.805 -7.588 -11.405 1.00 0.00 O ATOM 1096 CB ASN A 78 9.816 -6.649 -13.832 1.00 0.00 C ATOM 1097 CG ASN A 78 8.432 -7.247 -13.668 1.00 0.00 C ATOM 1098 OD1 ASN A 78 8.288 -8.410 -13.291 1.00 0.00 O ATOM 1099 ND2 ASN A 78 7.407 -6.453 -13.950 1.00 0.00 N ATOM 0 H ASN A 78 11.799 -5.189 -13.931 1.00 0.00 H new ATOM 0 HA ASN A 78 9.344 -4.971 -12.574 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.874 -6.131 -14.790 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.554 -7.450 -13.858 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.452 -6.800 -13.857 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.574 -5.495 -14.259 1.00 0.00 H new ATOM 1106 N ILE A 79 10.047 -5.787 -10.288 1.00 0.00 N ATOM 1107 CA ILE A 79 10.191 -6.405 -8.975 1.00 0.00 C ATOM 1108 C ILE A 79 8.972 -7.254 -8.631 1.00 0.00 C ATOM 1109 O ILE A 79 8.753 -7.600 -7.470 1.00 0.00 O ATOM 1110 CB ILE A 79 10.394 -5.347 -7.874 1.00 0.00 C ATOM 1111 CG1 ILE A 79 9.150 -4.466 -7.747 1.00 0.00 C ATOM 1112 CG2 ILE A 79 11.621 -4.500 -8.174 1.00 0.00 C ATOM 1113 CD1 ILE A 79 8.926 -3.934 -6.349 1.00 0.00 C ATOM 0 H ILE A 79 9.685 -4.833 -10.268 1.00 0.00 H new ATOM 0 HA ILE A 79 11.074 -7.043 -9.021 1.00 0.00 H new ATOM 0 HB ILE A 79 10.552 -5.858 -6.924 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.237 -3.626 -8.437 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.275 -5.040 -8.053 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.751 -3.757 -7.387 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.503 -5.140 -8.219 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.490 -3.996 -9.131 1.00 0.00 H new ATOM 0 HD11 ILE A 79 8.027 -3.318 -6.334 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.806 -4.768 -5.657 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.783 -3.332 -6.047 1.00 0.00 H new ATOM 1125 N GLN A 80 8.182 -7.586 -9.647 1.00 0.00 N ATOM 1126 CA GLN A 80 6.986 -8.395 -9.451 1.00 0.00 C ATOM 1127 C GLN A 80 7.334 -9.738 -8.819 1.00 0.00 C ATOM 1128 O GLN A 80 7.724 -10.679 -9.509 1.00 0.00 O ATOM 1129 CB GLN A 80 6.270 -8.617 -10.785 1.00 0.00 C ATOM 1130 CG GLN A 80 5.590 -7.369 -11.325 1.00 0.00 C ATOM 1131 CD GLN A 80 4.479 -7.689 -12.307 1.00 0.00 C ATOM 1132 OE1 GLN A 80 3.448 -6.852 -12.328 1.00 0.00 O flip ATOM 1133 NE2 GLN A 80 4.547 -8.677 -13.038 1.00 0.00 N flip ATOM 0 H GLN A 80 8.349 -7.307 -10.614 1.00 0.00 H new ATOM 0 HA GLN A 80 6.322 -7.857 -8.775 1.00 0.00 H new ATOM 0 HB2 GLN A 80 6.991 -8.975 -11.520 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.524 -9.402 -10.662 1.00 0.00 H new ATOM 0 HG2 GLN A 80 5.181 -6.794 -10.494 1.00 0.00 H new ATOM 0 HG3 GLN A 80 6.332 -6.738 -11.814 1.00 0.00 H new ATOM 0 HE21 GLN A 80 5.358 -9.293 -12.988 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.792 -8.879 -13.693 1.00 0.00 H new ATOM 1142 N GLY A 81 7.192 -9.820 -7.499 1.00 0.00 N ATOM 1143 CA GLY A 81 7.497 -11.052 -6.795 1.00 0.00 C ATOM 1144 C GLY A 81 8.695 -10.914 -5.877 1.00 0.00 C ATOM 1145 O GLY A 81 8.892 -11.729 -4.975 1.00 0.00 O ATOM 0 H GLY A 81 6.871 -9.055 -6.905 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.629 -11.357 -6.211 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.688 -11.843 -7.520 1.00 0.00 H new ATOM 1149 N PHE A 82 9.499 -9.882 -6.108 1.00 0.00 N ATOM 1150 CA PHE A 82 10.687 -9.641 -5.296 1.00 0.00 C ATOM 1151 C PHE A 82 10.338 -9.634 -3.811 1.00 0.00 C ATOM 1152 O PHE A 82 9.407 -8.951 -3.384 1.00 0.00 O ATOM 1153 CB PHE A 82 11.336 -8.312 -5.685 1.00 0.00 C ATOM 1154 CG PHE A 82 12.308 -8.430 -6.824 1.00 0.00 C ATOM 1155 CD1 PHE A 82 11.923 -9.005 -8.024 1.00 0.00 C ATOM 1156 CD2 PHE A 82 13.608 -7.968 -6.693 1.00 0.00 C ATOM 1157 CE1 PHE A 82 12.816 -9.115 -9.074 1.00 0.00 C ATOM 1158 CE2 PHE A 82 14.505 -8.075 -7.739 1.00 0.00 C ATOM 1159 CZ PHE A 82 14.108 -8.650 -8.931 1.00 0.00 C ATOM 0 H PHE A 82 9.350 -9.199 -6.851 1.00 0.00 H new ATOM 0 HA PHE A 82 11.393 -10.450 -5.482 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.555 -7.601 -5.956 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.853 -7.902 -4.818 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.914 -9.372 -8.141 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.924 -7.519 -5.763 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.503 -9.564 -10.005 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.515 -7.710 -7.625 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.807 -8.736 -9.750 1.00 0.00 H new ATOM 1169 N ALA A 83 11.091 -10.400 -3.028 1.00 0.00 N ATOM 1170 CA ALA A 83 10.863 -10.481 -1.591 1.00 0.00 C ATOM 1171 C ALA A 83 11.145 -9.145 -0.914 1.00 0.00 C ATOM 1172 O ALA A 83 11.921 -8.334 -1.418 1.00 0.00 O ATOM 1173 CB ALA A 83 11.725 -11.577 -0.981 1.00 0.00 C ATOM 0 H ALA A 83 11.864 -10.973 -3.365 1.00 0.00 H new ATOM 0 HA ALA A 83 9.814 -10.726 -1.428 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.545 -11.626 0.093 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.472 -12.535 -1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.777 -11.356 -1.162 1.00 0.00 H new ATOM 1179 N ASN A 84 10.510 -8.921 0.232 1.00 0.00 N ATOM 1180 CA ASN A 84 10.692 -7.681 0.977 1.00 0.00 C ATOM 1181 C ASN A 84 12.123 -7.170 0.842 1.00 0.00 C ATOM 1182 O ASN A 84 12.372 -6.149 0.199 1.00 0.00 O ATOM 1183 CB ASN A 84 10.352 -7.894 2.454 1.00 0.00 C ATOM 1184 CG ASN A 84 10.210 -6.587 3.209 1.00 0.00 C ATOM 1185 OD1 ASN A 84 11.162 -6.105 3.823 1.00 0.00 O ATOM 1186 ND2 ASN A 84 9.016 -6.007 3.168 1.00 0.00 N ATOM 0 H ASN A 84 9.865 -9.582 0.665 1.00 0.00 H new ATOM 0 HA ASN A 84 10.017 -6.934 0.560 1.00 0.00 H new ATOM 0 HB2 ASN A 84 9.423 -8.458 2.532 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.131 -8.497 2.920 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.860 -5.126 3.658 1.00 0.00 H new ATOM 0 HD22 ASN A 84 8.255 -6.442 2.646 1.00 0.00 H new ATOM 1193 N HIS A 85 13.062 -7.887 1.452 1.00 0.00 N ATOM 1194 CA HIS A 85 14.469 -7.507 1.398 1.00 0.00 C ATOM 1195 C HIS A 85 14.948 -7.397 -0.046 1.00 0.00 C ATOM 1196 O HIS A 85 15.731 -6.510 -0.385 1.00 0.00 O ATOM 1197 CB HIS A 85 15.323 -8.526 2.154 1.00 0.00 C ATOM 1198 CG HIS A 85 15.362 -9.875 1.504 1.00 0.00 C ATOM 1199 ND1 HIS A 85 14.466 -10.879 1.801 1.00 0.00 N ATOM 1200 CD2 HIS A 85 16.196 -10.382 0.566 1.00 0.00 C ATOM 1201 CE1 HIS A 85 14.747 -11.947 1.075 1.00 0.00 C ATOM 1202 NE2 HIS A 85 15.793 -11.671 0.317 1.00 0.00 N ATOM 0 H HIS A 85 12.874 -8.734 1.989 1.00 0.00 H new ATOM 0 HA HIS A 85 14.574 -6.531 1.872 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.340 -8.143 2.239 1.00 0.00 H new ATOM 0 HB3 HIS A 85 14.936 -8.631 3.168 1.00 0.00 H new ATOM 0 HD2 HIS A 85 17.024 -9.868 0.100 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.213 -12.885 1.098 1.00 0.00 H new ATOM 0 HE2 HIS A 85 16.230 -12.311 -0.346 1.00 0.00 H new ATOM 1211 N ASP A 86 14.472 -8.304 -0.893 1.00 0.00 N ATOM 1212 CA ASP A 86 14.851 -8.308 -2.301 1.00 0.00 C ATOM 1213 C ASP A 86 14.520 -6.971 -2.957 1.00 0.00 C ATOM 1214 O ASP A 86 15.183 -6.552 -3.906 1.00 0.00 O ATOM 1215 CB ASP A 86 14.139 -9.443 -3.039 1.00 0.00 C ATOM 1216 CG ASP A 86 14.913 -9.918 -4.253 1.00 0.00 C ATOM 1217 OD1 ASP A 86 15.679 -9.113 -4.821 1.00 0.00 O ATOM 1218 OD2 ASP A 86 14.751 -11.096 -4.636 1.00 0.00 O ATOM 0 H ASP A 86 13.823 -9.045 -0.629 1.00 0.00 H new ATOM 0 HA ASP A 86 15.928 -8.465 -2.362 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.990 -10.280 -2.356 1.00 0.00 H new ATOM 0 HB3 ASP A 86 13.150 -9.106 -3.351 1.00 0.00 H new ATOM 1223 N VAL A 87 13.490 -6.306 -2.445 1.00 0.00 N ATOM 1224 CA VAL A 87 13.071 -5.016 -2.981 1.00 0.00 C ATOM 1225 C VAL A 87 13.884 -3.878 -2.375 1.00 0.00 C ATOM 1226 O VAL A 87 14.225 -2.912 -3.057 1.00 0.00 O ATOM 1227 CB VAL A 87 11.575 -4.759 -2.718 1.00 0.00 C ATOM 1228 CG1 VAL A 87 11.192 -3.351 -3.148 1.00 0.00 C ATOM 1229 CG2 VAL A 87 10.723 -5.794 -3.437 1.00 0.00 C ATOM 0 H VAL A 87 12.930 -6.639 -1.660 1.00 0.00 H new ATOM 0 HA VAL A 87 13.244 -5.049 -4.057 1.00 0.00 H new ATOM 0 HB VAL A 87 11.391 -4.850 -1.647 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.132 -3.187 -2.955 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.780 -2.626 -2.585 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.390 -3.229 -4.213 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.669 -5.598 -3.240 1.00 0.00 H new ATOM 0 HG22 VAL A 87 10.909 -5.737 -4.509 1.00 0.00 H new ATOM 0 HG23 VAL A 87 10.980 -6.790 -3.077 1.00 0.00 H new ATOM 1239 N VAL A 88 14.194 -4.000 -1.088 1.00 0.00 N ATOM 1240 CA VAL A 88 14.970 -2.982 -0.389 1.00 0.00 C ATOM 1241 C VAL A 88 16.310 -2.745 -1.075 1.00 0.00 C ATOM 1242 O VAL A 88 16.667 -1.609 -1.385 1.00 0.00 O ATOM 1243 CB VAL A 88 15.220 -3.377 1.079 1.00 0.00 C ATOM 1244 CG1 VAL A 88 16.091 -2.339 1.770 1.00 0.00 C ATOM 1245 CG2 VAL A 88 13.901 -3.553 1.815 1.00 0.00 C ATOM 0 H VAL A 88 13.920 -4.793 -0.508 1.00 0.00 H new ATOM 0 HA VAL A 88 14.384 -2.063 -0.416 1.00 0.00 H new ATOM 0 HB VAL A 88 15.749 -4.330 1.096 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.257 -2.635 2.806 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.049 -2.267 1.255 1.00 0.00 H new ATOM 0 HG13 VAL A 88 15.592 -1.370 1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 88 14.097 -3.832 2.850 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.343 -2.617 1.790 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.317 -4.336 1.332 1.00 0.00 H new ATOM 1255 N GLU A 89 17.048 -3.826 -1.310 1.00 0.00 N ATOM 1256 CA GLU A 89 18.350 -3.735 -1.960 1.00 0.00 C ATOM 1257 C GLU A 89 18.245 -2.984 -3.285 1.00 0.00 C ATOM 1258 O GLU A 89 19.100 -2.162 -3.615 1.00 0.00 O ATOM 1259 CB GLU A 89 18.926 -5.132 -2.197 1.00 0.00 C ATOM 1260 CG GLU A 89 18.128 -5.958 -3.193 1.00 0.00 C ATOM 1261 CD GLU A 89 18.648 -7.377 -3.323 1.00 0.00 C ATOM 1262 OE1 GLU A 89 18.342 -8.203 -2.438 1.00 0.00 O ATOM 1263 OE2 GLU A 89 19.360 -7.661 -4.309 1.00 0.00 O ATOM 0 H GLU A 89 16.766 -4.774 -1.060 1.00 0.00 H new ATOM 0 HA GLU A 89 19.019 -3.182 -1.300 1.00 0.00 H new ATOM 0 HB2 GLU A 89 19.951 -5.037 -2.555 1.00 0.00 H new ATOM 0 HB3 GLU A 89 18.968 -5.665 -1.247 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.083 -5.985 -2.883 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.158 -5.473 -4.169 1.00 0.00 H new ATOM 1270 N VAL A 90 17.191 -3.274 -4.041 1.00 0.00 N ATOM 1271 CA VAL A 90 16.973 -2.628 -5.329 1.00 0.00 C ATOM 1272 C VAL A 90 16.875 -1.114 -5.175 1.00 0.00 C ATOM 1273 O VAL A 90 17.446 -0.360 -5.964 1.00 0.00 O ATOM 1274 CB VAL A 90 15.692 -3.147 -6.009 1.00 0.00 C ATOM 1275 CG1 VAL A 90 15.387 -2.341 -7.262 1.00 0.00 C ATOM 1276 CG2 VAL A 90 15.826 -4.627 -6.336 1.00 0.00 C ATOM 0 H VAL A 90 16.474 -3.953 -3.783 1.00 0.00 H new ATOM 0 HA VAL A 90 17.832 -2.873 -5.954 1.00 0.00 H new ATOM 0 HB VAL A 90 14.859 -3.025 -5.317 1.00 0.00 H new ATOM 0 HG11 VAL A 90 14.479 -2.723 -7.728 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.245 -1.294 -6.995 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.218 -2.428 -7.962 1.00 0.00 H new ATOM 0 HG21 VAL A 90 14.912 -4.978 -6.816 1.00 0.00 H new ATOM 0 HG22 VAL A 90 16.670 -4.776 -7.010 1.00 0.00 H new ATOM 0 HG23 VAL A 90 15.992 -5.189 -5.417 1.00 0.00 H new ATOM 1286 N LEU A 91 16.148 -0.675 -4.154 1.00 0.00 N ATOM 1287 CA LEU A 91 15.975 0.750 -3.894 1.00 0.00 C ATOM 1288 C LEU A 91 17.310 1.409 -3.563 1.00 0.00 C ATOM 1289 O LEU A 91 17.650 2.457 -4.113 1.00 0.00 O ATOM 1290 CB LEU A 91 14.989 0.963 -2.744 1.00 0.00 C ATOM 1291 CG LEU A 91 13.619 0.304 -2.905 1.00 0.00 C ATOM 1292 CD1 LEU A 91 12.947 0.133 -1.551 1.00 0.00 C ATOM 1293 CD2 LEU A 91 12.739 1.123 -3.839 1.00 0.00 C ATOM 0 H LEU A 91 15.669 -1.285 -3.492 1.00 0.00 H new ATOM 0 HA LEU A 91 15.576 1.213 -4.797 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.445 0.589 -1.827 1.00 0.00 H new ATOM 0 HB3 LEU A 91 14.841 2.035 -2.612 1.00 0.00 H new ATOM 0 HG LEU A 91 13.761 -0.683 -3.345 1.00 0.00 H new ATOM 0 HD11 LEU A 91 11.973 -0.338 -1.685 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.569 -0.495 -0.913 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.817 1.109 -1.083 1.00 0.00 H new ATOM 0 HD21 LEU A 91 11.768 0.639 -3.942 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.604 2.123 -3.428 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.214 1.194 -4.817 1.00 0.00 H new ATOM 1305 N ARG A 92 18.064 0.787 -2.662 1.00 0.00 N ATOM 1306 CA ARG A 92 19.363 1.313 -2.259 1.00 0.00 C ATOM 1307 C ARG A 92 20.291 1.452 -3.462 1.00 0.00 C ATOM 1308 O ARG A 92 20.988 2.455 -3.608 1.00 0.00 O ATOM 1309 CB ARG A 92 20.003 0.401 -1.211 1.00 0.00 C ATOM 1310 CG ARG A 92 19.159 0.227 0.042 1.00 0.00 C ATOM 1311 CD ARG A 92 19.898 -0.571 1.105 1.00 0.00 C ATOM 1312 NE ARG A 92 21.071 0.141 1.607 1.00 0.00 N ATOM 1313 CZ ARG A 92 22.097 -0.460 2.199 1.00 0.00 C ATOM 1314 NH1 ARG A 92 22.096 -1.776 2.361 1.00 0.00 N ATOM 1315 NH2 ARG A 92 23.129 0.256 2.629 1.00 0.00 N ATOM 0 H ARG A 92 17.798 -0.081 -2.198 1.00 0.00 H new ATOM 0 HA ARG A 92 19.208 2.301 -1.826 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.185 -0.578 -1.655 1.00 0.00 H new ATOM 0 HB3 ARG A 92 20.974 0.809 -0.931 1.00 0.00 H new ATOM 0 HG2 ARG A 92 18.891 1.206 0.441 1.00 0.00 H new ATOM 0 HG3 ARG A 92 18.228 -0.279 -0.213 1.00 0.00 H new ATOM 0 HD2 ARG A 92 19.222 -0.785 1.933 1.00 0.00 H new ATOM 0 HD3 ARG A 92 20.207 -1.530 0.689 1.00 0.00 H new ATOM 0 HE ARG A 92 21.104 1.155 1.497 1.00 0.00 H new ATOM 0 HH11 ARG A 92 21.306 -2.330 2.031 1.00 0.00 H new ATOM 0 HH12 ARG A 92 22.885 -2.234 2.816 1.00 0.00 H new ATOM 0 HH21 ARG A 92 23.134 1.268 2.505 1.00 0.00 H new ATOM 0 HH22 ARG A 92 23.916 -0.206 3.084 1.00 0.00 H new ATOM 1329 N ASN A 93 20.294 0.438 -4.321 1.00 0.00 N ATOM 1330 CA ASN A 93 21.137 0.446 -5.511 1.00 0.00 C ATOM 1331 C ASN A 93 20.775 1.613 -6.425 1.00 0.00 C ATOM 1332 O ASN A 93 21.650 2.251 -7.011 1.00 0.00 O ATOM 1333 CB ASN A 93 20.997 -0.874 -6.271 1.00 0.00 C ATOM 1334 CG ASN A 93 21.889 -1.963 -5.706 1.00 0.00 C ATOM 1335 OD1 ASN A 93 23.094 -1.985 -5.956 1.00 0.00 O ATOM 1336 ND2 ASN A 93 21.298 -2.874 -4.941 1.00 0.00 N ATOM 0 H ASN A 93 19.722 -0.400 -4.215 1.00 0.00 H new ATOM 0 HA ASN A 93 22.172 0.564 -5.191 1.00 0.00 H new ATOM 0 HB2 ASN A 93 19.959 -1.203 -6.234 1.00 0.00 H new ATOM 0 HB3 ASN A 93 21.244 -0.714 -7.321 1.00 0.00 H new ATOM 0 HD21 ASN A 93 21.846 -3.632 -4.534 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.296 -2.816 -4.761 1.00 0.00 H new ATOM 1343 N ALA A 94 19.480 1.886 -6.543 1.00 0.00 N ATOM 1344 CA ALA A 94 19.002 2.977 -7.383 1.00 0.00 C ATOM 1345 C ALA A 94 19.812 4.247 -7.147 1.00 0.00 C ATOM 1346 O ALA A 94 20.317 4.478 -6.049 1.00 0.00 O ATOM 1347 CB ALA A 94 17.525 3.235 -7.124 1.00 0.00 C ATOM 0 H ALA A 94 18.743 1.366 -6.067 1.00 0.00 H new ATOM 0 HA ALA A 94 19.131 2.683 -8.425 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.182 4.052 -7.758 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.953 2.335 -7.351 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.380 3.503 -6.077 1.00 0.00 H new ATOM 1353 N GLY A 95 19.932 5.068 -8.186 1.00 0.00 N ATOM 1354 CA GLY A 95 20.683 6.305 -8.071 1.00 0.00 C ATOM 1355 C GLY A 95 19.786 7.514 -7.896 1.00 0.00 C ATOM 1356 O GLY A 95 18.708 7.415 -7.309 1.00 0.00 O ATOM 0 H GLY A 95 19.523 4.899 -9.105 1.00 0.00 H new ATOM 0 HA2 GLY A 95 21.364 6.236 -7.222 1.00 0.00 H new ATOM 0 HA3 GLY A 95 21.297 6.438 -8.962 1.00 0.00 H new ATOM 1360 N GLN A 96 20.231 8.658 -8.404 1.00 0.00 N ATOM 1361 CA GLN A 96 19.461 9.892 -8.299 1.00 0.00 C ATOM 1362 C GLN A 96 18.097 9.740 -8.963 1.00 0.00 C ATOM 1363 O GLN A 96 17.060 9.923 -8.325 1.00 0.00 O ATOM 1364 CB GLN A 96 20.227 11.052 -8.937 1.00 0.00 C ATOM 1365 CG GLN A 96 19.819 12.416 -8.404 1.00 0.00 C ATOM 1366 CD GLN A 96 20.954 13.421 -8.443 1.00 0.00 C ATOM 1367 OE1 GLN A 96 21.614 13.590 -9.468 1.00 0.00 O ATOM 1368 NE2 GLN A 96 21.187 14.094 -7.322 1.00 0.00 N ATOM 0 H GLN A 96 21.121 8.757 -8.893 1.00 0.00 H new ATOM 0 HA GLN A 96 19.308 10.106 -7.241 1.00 0.00 H new ATOM 0 HB2 GLN A 96 21.294 10.909 -8.767 1.00 0.00 H new ATOM 0 HB3 GLN A 96 20.070 11.031 -10.015 1.00 0.00 H new ATOM 0 HG2 GLN A 96 18.982 12.796 -8.990 1.00 0.00 H new ATOM 0 HG3 GLN A 96 19.467 12.311 -7.378 1.00 0.00 H new ATOM 0 HE21 GLN A 96 20.615 13.922 -6.495 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.938 14.783 -7.288 1.00 0.00 H new ATOM 1377 N VAL A 97 18.105 9.406 -10.250 1.00 0.00 N ATOM 1378 CA VAL A 97 16.868 9.230 -11.001 1.00 0.00 C ATOM 1379 C VAL A 97 16.226 7.881 -10.695 1.00 0.00 C ATOM 1380 O VAL A 97 16.618 6.855 -11.251 1.00 0.00 O ATOM 1381 CB VAL A 97 17.112 9.337 -12.518 1.00 0.00 C ATOM 1382 CG1 VAL A 97 15.835 9.038 -13.288 1.00 0.00 C ATOM 1383 CG2 VAL A 97 17.650 10.715 -12.875 1.00 0.00 C ATOM 0 H VAL A 97 18.954 9.252 -10.794 1.00 0.00 H new ATOM 0 HA VAL A 97 16.194 10.029 -10.691 1.00 0.00 H new ATOM 0 HB VAL A 97 17.859 8.596 -12.801 1.00 0.00 H new ATOM 0 HG11 VAL A 97 16.028 9.119 -14.358 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.498 8.028 -13.055 1.00 0.00 H new ATOM 0 HG13 VAL A 97 15.063 9.753 -13.004 1.00 0.00 H new ATOM 0 HG21 VAL A 97 17.817 10.773 -13.951 1.00 0.00 H new ATOM 0 HG22 VAL A 97 16.928 11.476 -12.578 1.00 0.00 H new ATOM 0 HG23 VAL A 97 18.591 10.885 -12.352 1.00 0.00 H new ATOM 1393 N VAL A 98 15.238 7.890 -9.806 1.00 0.00 N ATOM 1394 CA VAL A 98 14.540 6.667 -9.426 1.00 0.00 C ATOM 1395 C VAL A 98 13.120 6.651 -9.978 1.00 0.00 C ATOM 1396 O VAL A 98 12.227 7.309 -9.443 1.00 0.00 O ATOM 1397 CB VAL A 98 14.487 6.504 -7.896 1.00 0.00 C ATOM 1398 CG1 VAL A 98 13.683 5.269 -7.518 1.00 0.00 C ATOM 1399 CG2 VAL A 98 15.892 6.433 -7.318 1.00 0.00 C ATOM 0 H VAL A 98 14.903 8.730 -9.335 1.00 0.00 H new ATOM 0 HA VAL A 98 15.101 5.836 -9.853 1.00 0.00 H new ATOM 0 HB VAL A 98 13.989 7.376 -7.473 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.657 5.170 -6.433 1.00 0.00 H new ATOM 0 HG12 VAL A 98 12.666 5.366 -7.898 1.00 0.00 H new ATOM 0 HG13 VAL A 98 14.149 4.384 -7.952 1.00 0.00 H new ATOM 0 HG21 VAL A 98 15.835 6.318 -6.236 1.00 0.00 H new ATOM 0 HG22 VAL A 98 16.419 5.580 -7.746 1.00 0.00 H new ATOM 0 HG23 VAL A 98 16.431 7.350 -7.557 1.00 0.00 H new ATOM 1409 N HIS A 99 12.916 5.895 -11.052 1.00 0.00 N ATOM 1410 CA HIS A 99 11.602 5.792 -11.677 1.00 0.00 C ATOM 1411 C HIS A 99 10.791 4.660 -11.054 1.00 0.00 C ATOM 1412 O HIS A 99 11.015 3.485 -11.350 1.00 0.00 O ATOM 1413 CB HIS A 99 11.746 5.562 -13.182 1.00 0.00 C ATOM 1414 CG HIS A 99 11.924 6.826 -13.966 1.00 0.00 C ATOM 1415 ND1 HIS A 99 13.043 7.088 -14.728 1.00 0.00 N ATOM 1416 CD2 HIS A 99 11.115 7.903 -14.105 1.00 0.00 C ATOM 1417 CE1 HIS A 99 12.916 8.272 -15.300 1.00 0.00 C ATOM 1418 NE2 HIS A 99 11.755 8.787 -14.939 1.00 0.00 N ATOM 0 H HIS A 99 13.644 5.345 -11.508 1.00 0.00 H new ATOM 0 HA HIS A 99 11.073 6.730 -11.509 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.600 4.909 -13.362 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.863 5.039 -13.548 1.00 0.00 H new ATOM 0 HD1 HIS A 99 13.844 6.465 -14.834 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.147 8.041 -13.646 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.639 8.739 -15.952 1.00 0.00 H new ATOM 1427 N LEU A 100 9.850 5.020 -10.189 1.00 0.00 N ATOM 1428 CA LEU A 100 9.005 4.034 -9.522 1.00 0.00 C ATOM 1429 C LEU A 100 7.764 3.729 -10.354 1.00 0.00 C ATOM 1430 O LEU A 100 7.115 4.636 -10.877 1.00 0.00 O ATOM 1431 CB LEU A 100 8.594 4.539 -8.138 1.00 0.00 C ATOM 1432 CG LEU A 100 8.440 3.472 -7.053 1.00 0.00 C ATOM 1433 CD1 LEU A 100 7.545 2.343 -7.539 1.00 0.00 C ATOM 1434 CD2 LEU A 100 9.802 2.935 -6.637 1.00 0.00 C ATOM 0 H LEU A 100 9.652 5.987 -9.932 1.00 0.00 H new ATOM 0 HA LEU A 100 9.580 3.115 -9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.335 5.265 -7.803 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.647 5.071 -8.234 1.00 0.00 H new ATOM 0 HG LEU A 100 7.971 3.930 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.447 1.593 -6.754 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.561 2.740 -7.787 1.00 0.00 H new ATOM 0 HD13 LEU A 100 7.985 1.885 -8.425 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.674 2.177 -5.864 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.298 2.492 -7.501 1.00 0.00 H new ATOM 0 HD23 LEU A 100 10.411 3.751 -6.247 1.00 0.00 H new ATOM 1446 N THR A 101 7.437 2.446 -10.471 1.00 0.00 N ATOM 1447 CA THR A 101 6.273 2.021 -11.238 1.00 0.00 C ATOM 1448 C THR A 101 5.173 1.495 -10.323 1.00 0.00 C ATOM 1449 O THR A 101 5.277 0.395 -9.779 1.00 0.00 O ATOM 1450 CB THR A 101 6.641 0.928 -12.259 1.00 0.00 C ATOM 1451 OG1 THR A 101 7.756 1.353 -13.051 1.00 0.00 O ATOM 1452 CG2 THR A 101 5.460 0.613 -13.165 1.00 0.00 C ATOM 0 H THR A 101 7.962 1.683 -10.044 1.00 0.00 H new ATOM 0 HA THR A 101 5.909 2.899 -11.772 1.00 0.00 H new ATOM 0 HB THR A 101 6.908 0.025 -11.710 1.00 0.00 H new ATOM 0 HG1 THR A 101 7.885 0.729 -13.796 1.00 0.00 H new ATOM 0 HG21 THR A 101 5.744 -0.162 -13.877 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.622 0.262 -12.562 1.00 0.00 H new ATOM 0 HG23 THR A 101 5.166 1.513 -13.705 1.00 0.00 H new ATOM 1460 N LEU A 102 4.120 2.287 -10.156 1.00 0.00 N ATOM 1461 CA LEU A 102 2.999 1.901 -9.306 1.00 0.00 C ATOM 1462 C LEU A 102 1.714 1.781 -10.120 1.00 0.00 C ATOM 1463 O LEU A 102 1.597 2.355 -11.202 1.00 0.00 O ATOM 1464 CB LEU A 102 2.811 2.921 -8.182 1.00 0.00 C ATOM 1465 CG LEU A 102 4.090 3.426 -7.513 1.00 0.00 C ATOM 1466 CD1 LEU A 102 4.730 4.524 -8.348 1.00 0.00 C ATOM 1467 CD2 LEU A 102 3.794 3.927 -6.107 1.00 0.00 C ATOM 0 H LEU A 102 4.019 3.201 -10.598 1.00 0.00 H new ATOM 0 HA LEU A 102 3.224 0.927 -8.871 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.272 3.779 -8.584 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.176 2.475 -7.416 1.00 0.00 H new ATOM 0 HG LEU A 102 4.792 2.596 -7.441 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.639 4.872 -7.857 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.978 4.133 -9.335 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.033 5.356 -8.452 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.715 4.283 -5.646 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.074 4.744 -6.156 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.380 3.114 -5.511 1.00 0.00 H new ATOM 1479 N VAL A 103 0.752 1.032 -9.590 1.00 0.00 N ATOM 1480 CA VAL A 103 -0.526 0.840 -10.265 1.00 0.00 C ATOM 1481 C VAL A 103 -1.679 0.832 -9.268 1.00 0.00 C ATOM 1482 O VAL A 103 -1.833 -0.109 -8.489 1.00 0.00 O ATOM 1483 CB VAL A 103 -0.545 -0.477 -11.065 1.00 0.00 C ATOM 1484 CG1 VAL A 103 -0.062 -1.633 -10.203 1.00 0.00 C ATOM 1485 CG2 VAL A 103 -1.940 -0.751 -11.606 1.00 0.00 C ATOM 0 H VAL A 103 0.834 0.549 -8.696 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.650 1.677 -10.952 1.00 0.00 H new ATOM 0 HB VAL A 103 0.135 -0.378 -11.911 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.083 -2.554 -10.785 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.957 -1.437 -9.869 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.714 -1.737 -9.336 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.935 -1.685 -12.168 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.643 -0.830 -10.777 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.243 0.066 -12.261 1.00 0.00 H new ATOM 1495 N ARG A 104 -2.486 1.887 -9.297 1.00 0.00 N ATOM 1496 CA ARG A 104 -3.626 2.003 -8.395 1.00 0.00 C ATOM 1497 C ARG A 104 -4.937 1.794 -9.146 1.00 0.00 C ATOM 1498 O ARG A 104 -5.025 2.055 -10.346 1.00 0.00 O ATOM 1499 CB ARG A 104 -3.628 3.373 -7.715 1.00 0.00 C ATOM 1500 CG ARG A 104 -3.942 4.522 -8.660 1.00 0.00 C ATOM 1501 CD ARG A 104 -3.630 5.868 -8.025 1.00 0.00 C ATOM 1502 NE ARG A 104 -4.756 6.379 -7.248 1.00 0.00 N ATOM 1503 CZ ARG A 104 -5.777 7.042 -7.782 1.00 0.00 C ATOM 1504 NH1 ARG A 104 -5.813 7.270 -9.087 1.00 0.00 N ATOM 1505 NH2 ARG A 104 -6.764 7.476 -7.009 1.00 0.00 N ATOM 0 H ARG A 104 -2.372 2.674 -9.935 1.00 0.00 H new ATOM 0 HA ARG A 104 -3.536 1.228 -7.634 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -4.360 3.367 -6.908 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.653 3.545 -7.260 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -3.364 4.409 -9.577 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -4.995 4.486 -8.941 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -2.758 5.771 -7.379 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -3.371 6.585 -8.804 1.00 0.00 H new ATOM 0 HE ARG A 104 -4.759 6.218 -6.241 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -5.056 6.937 -9.684 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -6.598 7.779 -9.494 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -6.740 7.301 -6.004 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -7.547 7.985 -7.419 1.00 0.00 H new ATOM 1519 N ARG A 105 -5.953 1.322 -8.432 1.00 0.00 N ATOM 1520 CA ARG A 105 -7.260 1.076 -9.031 1.00 0.00 C ATOM 1521 C ARG A 105 -7.901 2.381 -9.491 1.00 0.00 C ATOM 1522 O ARG A 105 -8.050 3.322 -8.711 1.00 0.00 O ATOM 1523 CB ARG A 105 -8.178 0.369 -8.032 1.00 0.00 C ATOM 1524 CG ARG A 105 -9.441 -0.196 -8.660 1.00 0.00 C ATOM 1525 CD ARG A 105 -10.017 -1.332 -7.828 1.00 0.00 C ATOM 1526 NE ARG A 105 -11.465 -1.441 -7.980 1.00 0.00 N ATOM 1527 CZ ARG A 105 -12.053 -2.079 -8.986 1.00 0.00 C ATOM 1528 NH1 ARG A 105 -11.320 -2.662 -9.924 1.00 0.00 N ATOM 1529 NH2 ARG A 105 -13.377 -2.135 -9.055 1.00 0.00 N ATOM 0 H ARG A 105 -5.897 1.102 -7.438 1.00 0.00 H new ATOM 0 HA ARG A 105 -7.118 0.434 -9.901 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -7.626 -0.441 -7.555 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.456 1.072 -7.247 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.184 0.595 -8.761 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -9.220 -0.556 -9.665 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -9.550 -2.271 -8.124 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -9.774 -1.172 -6.778 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.058 -1.003 -7.275 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -10.302 -2.621 -9.874 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -11.774 -3.151 -10.695 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -13.945 -1.688 -8.335 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.827 -2.625 -9.828 1.00 0.00 H new ATOM 1543 N LYS A 106 -8.279 2.432 -10.764 1.00 0.00 N ATOM 1544 CA LYS A 106 -8.905 3.621 -11.330 1.00 0.00 C ATOM 1545 C LYS A 106 -10.215 3.938 -10.617 1.00 0.00 C ATOM 1546 O LYS A 106 -10.604 3.248 -9.674 1.00 0.00 O ATOM 1547 CB LYS A 106 -9.161 3.425 -12.826 1.00 0.00 C ATOM 1548 CG LYS A 106 -7.906 3.106 -13.621 1.00 0.00 C ATOM 1549 CD LYS A 106 -8.233 2.354 -14.900 1.00 0.00 C ATOM 1550 CE LYS A 106 -7.238 2.676 -16.005 1.00 0.00 C ATOM 1551 NZ LYS A 106 -7.599 3.926 -16.730 1.00 0.00 N ATOM 0 H LYS A 106 -8.163 1.663 -11.424 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.224 4.460 -11.191 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.881 2.618 -12.960 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.617 4.329 -13.230 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.384 4.031 -13.865 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.229 2.509 -13.010 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.227 1.282 -14.705 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -9.240 2.613 -15.228 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.241 2.780 -15.577 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -7.197 1.846 -16.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.897 4.111 -17.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.540 3.818 -17.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.613 4.723 -16.062 1.00 0.00 H new ATOM 1565 N THR A 107 -10.894 4.986 -11.073 1.00 0.00 N ATOM 1566 CA THR A 107 -12.161 5.394 -10.479 1.00 0.00 C ATOM 1567 C THR A 107 -13.334 4.684 -11.145 1.00 0.00 C ATOM 1568 O THR A 107 -13.539 4.802 -12.353 1.00 0.00 O ATOM 1569 CB THR A 107 -12.368 6.916 -10.588 1.00 0.00 C ATOM 1570 OG1 THR A 107 -11.300 7.604 -9.927 1.00 0.00 O ATOM 1571 CG2 THR A 107 -13.698 7.326 -9.975 1.00 0.00 C ATOM 0 H THR A 107 -10.587 5.568 -11.852 1.00 0.00 H new ATOM 0 HA THR A 107 -12.121 5.115 -9.426 1.00 0.00 H new ATOM 0 HB THR A 107 -12.374 7.185 -11.644 1.00 0.00 H new ATOM 0 HG1 THR A 107 -11.438 8.571 -10.002 1.00 0.00 H new ATOM 0 HG21 THR A 107 -13.822 8.405 -10.064 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.511 6.823 -10.499 1.00 0.00 H new ATOM 0 HG23 THR A 107 -13.716 7.044 -8.922 1.00 0.00 H new ATOM 1579 N SER A 108 -14.103 3.947 -10.350 1.00 0.00 N ATOM 1580 CA SER A 108 -15.255 3.216 -10.863 1.00 0.00 C ATOM 1581 C SER A 108 -16.252 4.165 -11.522 1.00 0.00 C ATOM 1582 O SER A 108 -16.201 5.377 -11.315 1.00 0.00 O ATOM 1583 CB SER A 108 -15.940 2.443 -9.734 1.00 0.00 C ATOM 1584 OG SER A 108 -16.296 3.306 -8.668 1.00 0.00 O ATOM 0 H SER A 108 -13.949 3.840 -9.347 1.00 0.00 H new ATOM 0 HA SER A 108 -14.900 2.510 -11.614 1.00 0.00 H new ATOM 0 HB2 SER A 108 -16.831 1.947 -10.118 1.00 0.00 H new ATOM 0 HB3 SER A 108 -15.274 1.662 -9.367 1.00 0.00 H new ATOM 0 HG SER A 108 -16.733 2.788 -7.960 1.00 0.00 H new ATOM 1590 N SER A 109 -17.157 3.603 -12.317 1.00 0.00 N ATOM 1591 CA SER A 109 -18.163 4.399 -13.011 1.00 0.00 C ATOM 1592 C SER A 109 -19.504 4.331 -12.285 1.00 0.00 C ATOM 1593 O SER A 109 -20.225 3.338 -12.380 1.00 0.00 O ATOM 1594 CB SER A 109 -18.326 3.911 -14.451 1.00 0.00 C ATOM 1595 OG SER A 109 -18.780 2.569 -14.487 1.00 0.00 O ATOM 0 H SER A 109 -17.214 2.601 -12.496 1.00 0.00 H new ATOM 0 HA SER A 109 -17.826 5.436 -13.022 1.00 0.00 H new ATOM 0 HB2 SER A 109 -19.034 4.552 -14.977 1.00 0.00 H new ATOM 0 HB3 SER A 109 -17.373 3.990 -14.975 1.00 0.00 H new ATOM 0 HG SER A 109 -19.411 2.417 -13.753 1.00 0.00 H new ATOM 1601 N SER A 110 -19.830 5.395 -11.558 1.00 0.00 N ATOM 1602 CA SER A 110 -21.081 5.457 -10.812 1.00 0.00 C ATOM 1603 C SER A 110 -22.143 6.224 -11.594 1.00 0.00 C ATOM 1604 O SER A 110 -21.900 7.333 -12.072 1.00 0.00 O ATOM 1605 CB SER A 110 -20.856 6.119 -9.451 1.00 0.00 C ATOM 1606 OG SER A 110 -22.051 6.138 -8.690 1.00 0.00 O ATOM 0 H SER A 110 -19.245 6.226 -11.470 1.00 0.00 H new ATOM 0 HA SER A 110 -21.434 4.437 -10.658 1.00 0.00 H new ATOM 0 HB2 SER A 110 -20.082 5.581 -8.905 1.00 0.00 H new ATOM 0 HB3 SER A 110 -20.496 7.138 -9.594 1.00 0.00 H new ATOM 0 HG SER A 110 -21.881 6.564 -7.824 1.00 0.00 H new ATOM 1612 N THR A 111 -23.324 5.626 -11.721 1.00 0.00 N ATOM 1613 CA THR A 111 -24.423 6.250 -12.446 1.00 0.00 C ATOM 1614 C THR A 111 -25.119 7.302 -11.590 1.00 0.00 C ATOM 1615 O THR A 111 -25.998 6.983 -10.790 1.00 0.00 O ATOM 1616 CB THR A 111 -25.461 5.207 -12.900 1.00 0.00 C ATOM 1617 OG1 THR A 111 -24.830 4.211 -13.714 1.00 0.00 O ATOM 1618 CG2 THR A 111 -26.587 5.868 -13.681 1.00 0.00 C ATOM 0 H THR A 111 -23.543 4.710 -11.331 1.00 0.00 H new ATOM 0 HA THR A 111 -23.990 6.728 -13.325 1.00 0.00 H new ATOM 0 HB THR A 111 -25.884 4.737 -12.012 1.00 0.00 H new ATOM 0 HG1 THR A 111 -25.496 3.550 -13.998 1.00 0.00 H new ATOM 0 HG21 THR A 111 -27.308 5.111 -13.991 1.00 0.00 H new ATOM 0 HG22 THR A 111 -27.084 6.605 -13.050 1.00 0.00 H new ATOM 0 HG23 THR A 111 -26.178 6.362 -14.562 1.00 0.00 H new ATOM 1626 N SER A 112 -24.719 8.558 -11.763 1.00 0.00 N ATOM 1627 CA SER A 112 -25.303 9.658 -11.003 1.00 0.00 C ATOM 1628 C SER A 112 -26.826 9.631 -11.092 1.00 0.00 C ATOM 1629 O SER A 112 -27.415 9.851 -12.150 1.00 0.00 O ATOM 1630 CB SER A 112 -24.774 10.998 -11.517 1.00 0.00 C ATOM 1631 OG SER A 112 -25.003 11.137 -12.909 1.00 0.00 O ATOM 0 H SER A 112 -23.993 8.839 -12.422 1.00 0.00 H new ATOM 0 HA SER A 112 -25.015 9.539 -9.958 1.00 0.00 H new ATOM 0 HB2 SER A 112 -25.260 11.814 -10.982 1.00 0.00 H new ATOM 0 HB3 SER A 112 -23.706 11.074 -11.312 1.00 0.00 H new ATOM 0 HG SER A 112 -25.878 10.758 -13.136 1.00 0.00 H new ATOM 1637 N PRO A 113 -27.479 9.355 -9.954 1.00 0.00 N ATOM 1638 CA PRO A 113 -28.942 9.294 -9.876 1.00 0.00 C ATOM 1639 C PRO A 113 -29.589 10.666 -10.029 1.00 0.00 C ATOM 1640 O PRO A 113 -28.938 11.628 -10.441 1.00 0.00 O ATOM 1641 CB PRO A 113 -29.199 8.735 -8.474 1.00 0.00 C ATOM 1642 CG PRO A 113 -27.991 9.114 -7.688 1.00 0.00 C ATOM 1643 CD PRO A 113 -26.841 9.083 -8.655 1.00 0.00 C ATOM 0 HA PRO A 113 -29.368 8.689 -10.676 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -30.104 9.159 -8.038 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -29.333 7.654 -8.497 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -28.106 10.105 -7.250 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -27.827 8.419 -6.865 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -26.091 9.835 -8.411 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -26.337 8.116 -8.649 1.00 0.00 H new ATOM 1651 N LEU A 114 -30.872 10.751 -9.696 1.00 0.00 N ATOM 1652 CA LEU A 114 -31.607 12.007 -9.796 1.00 0.00 C ATOM 1653 C LEU A 114 -31.366 12.878 -8.568 1.00 0.00 C ATOM 1654 O LEU A 114 -31.231 14.097 -8.677 1.00 0.00 O ATOM 1655 CB LEU A 114 -33.104 11.733 -9.956 1.00 0.00 C ATOM 1656 CG LEU A 114 -33.839 11.267 -8.698 1.00 0.00 C ATOM 1657 CD1 LEU A 114 -34.372 12.460 -7.919 1.00 0.00 C ATOM 1658 CD2 LEU A 114 -34.970 10.317 -9.062 1.00 0.00 C ATOM 0 H LEU A 114 -31.425 9.965 -9.354 1.00 0.00 H new ATOM 0 HA LEU A 114 -31.246 12.542 -10.674 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -33.583 12.643 -10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -33.234 10.976 -10.730 1.00 0.00 H new ATOM 0 HG LEU A 114 -33.132 10.732 -8.064 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -34.892 12.109 -7.027 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -33.542 13.103 -7.626 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -35.064 13.023 -8.545 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -35.482 9.996 -8.155 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -35.677 10.827 -9.716 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -34.563 9.447 -9.576 1.00 0.00 H new ATOM 1670 N GLU A 115 -31.311 12.245 -7.400 1.00 0.00 N ATOM 1671 CA GLU A 115 -31.085 12.964 -6.152 1.00 0.00 C ATOM 1672 C GLU A 115 -29.997 12.286 -5.324 1.00 0.00 C ATOM 1673 O GLU A 115 -30.257 11.699 -4.273 1.00 0.00 O ATOM 1674 CB GLU A 115 -32.381 13.046 -5.343 1.00 0.00 C ATOM 1675 CG GLU A 115 -32.246 13.844 -4.057 1.00 0.00 C ATOM 1676 CD GLU A 115 -33.523 13.853 -3.239 1.00 0.00 C ATOM 1677 OE1 GLU A 115 -34.395 14.705 -3.511 1.00 0.00 O ATOM 1678 OE2 GLU A 115 -33.650 13.010 -2.327 1.00 0.00 O ATOM 0 H GLU A 115 -31.420 11.237 -7.292 1.00 0.00 H new ATOM 0 HA GLU A 115 -30.755 13.973 -6.398 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -33.157 13.497 -5.961 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -32.713 12.036 -5.101 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -31.438 13.425 -3.457 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -31.966 14.870 -4.298 1.00 0.00 H new ATOM 1685 N PRO A 116 -28.749 12.368 -5.807 1.00 0.00 N ATOM 1686 CA PRO A 116 -27.596 11.769 -5.127 1.00 0.00 C ATOM 1687 C PRO A 116 -27.247 12.492 -3.831 1.00 0.00 C ATOM 1688 O PRO A 116 -27.302 13.719 -3.742 1.00 0.00 O ATOM 1689 CB PRO A 116 -26.465 11.922 -6.146 1.00 0.00 C ATOM 1690 CG PRO A 116 -26.864 13.087 -6.984 1.00 0.00 C ATOM 1691 CD PRO A 116 -28.366 13.052 -7.053 1.00 0.00 C ATOM 0 HA PRO A 116 -27.787 10.737 -4.833 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -25.509 12.098 -5.653 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -26.351 11.021 -6.749 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -26.515 14.022 -6.545 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -26.426 13.020 -7.980 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -28.789 14.055 -7.107 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -28.715 12.511 -7.932 1.00 0.00 H new ATOM 1699 N PRO A 117 -26.878 11.716 -2.801 1.00 0.00 N ATOM 1700 CA PRO A 117 -26.512 12.262 -1.490 1.00 0.00 C ATOM 1701 C PRO A 117 -25.186 13.014 -1.526 1.00 0.00 C ATOM 1702 O PRO A 117 -24.124 12.413 -1.691 1.00 0.00 O ATOM 1703 CB PRO A 117 -26.397 11.018 -0.607 1.00 0.00 C ATOM 1704 CG PRO A 117 -26.083 9.910 -1.552 1.00 0.00 C ATOM 1705 CD PRO A 117 -26.790 10.247 -2.835 1.00 0.00 C ATOM 0 HA PRO A 117 -27.242 12.989 -1.133 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -25.613 11.135 0.141 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -27.325 10.828 -0.068 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -25.008 9.825 -1.710 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -26.424 8.953 -1.158 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -26.233 9.898 -3.704 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -27.777 9.786 -2.883 1.00 0.00 H new ATOM 1713 N SER A 118 -25.253 14.333 -1.371 1.00 0.00 N ATOM 1714 CA SER A 118 -24.058 15.167 -1.389 1.00 0.00 C ATOM 1715 C SER A 118 -23.934 15.967 -0.095 1.00 0.00 C ATOM 1716 O SER A 118 -24.928 16.233 0.580 1.00 0.00 O ATOM 1717 CB SER A 118 -24.091 16.117 -2.588 1.00 0.00 C ATOM 1718 OG SER A 118 -24.978 17.198 -2.358 1.00 0.00 O ATOM 0 H SER A 118 -26.123 14.847 -1.232 1.00 0.00 H new ATOM 0 HA SER A 118 -23.190 14.513 -1.476 1.00 0.00 H new ATOM 0 HB2 SER A 118 -23.089 16.500 -2.780 1.00 0.00 H new ATOM 0 HB3 SER A 118 -24.401 15.572 -3.480 1.00 0.00 H new ATOM 0 HG SER A 118 -24.980 17.791 -3.138 1.00 0.00 H new ATOM 1724 N ASP A 119 -22.707 16.347 0.242 1.00 0.00 N ATOM 1725 CA ASP A 119 -22.452 17.118 1.454 1.00 0.00 C ATOM 1726 C ASP A 119 -21.275 18.068 1.255 1.00 0.00 C ATOM 1727 O ASP A 119 -20.385 17.810 0.444 1.00 0.00 O ATOM 1728 CB ASP A 119 -22.174 16.181 2.630 1.00 0.00 C ATOM 1729 CG ASP A 119 -21.738 16.929 3.875 1.00 0.00 C ATOM 1730 OD1 ASP A 119 -22.364 17.961 4.197 1.00 0.00 O ATOM 1731 OD2 ASP A 119 -20.771 16.483 4.528 1.00 0.00 O ATOM 0 H ASP A 119 -21.873 16.134 -0.306 1.00 0.00 H new ATOM 0 HA ASP A 119 -23.341 17.710 1.673 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -23.072 15.604 2.852 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -21.399 15.468 2.348 1.00 0.00 H new ATOM 1736 N ARG A 120 -21.278 19.169 2.000 1.00 0.00 N ATOM 1737 CA ARG A 120 -20.212 20.159 1.904 1.00 0.00 C ATOM 1738 C ARG A 120 -18.859 19.536 2.235 1.00 0.00 C ATOM 1739 O ARG A 120 -18.786 18.501 2.897 1.00 0.00 O ATOM 1740 CB ARG A 120 -20.490 21.332 2.846 1.00 0.00 C ATOM 1741 CG ARG A 120 -20.461 20.951 4.318 1.00 0.00 C ATOM 1742 CD ARG A 120 -20.190 22.159 5.201 1.00 0.00 C ATOM 1743 NE ARG A 120 -18.760 22.393 5.384 1.00 0.00 N ATOM 1744 CZ ARG A 120 -18.243 23.576 5.696 1.00 0.00 C ATOM 1745 NH1 ARG A 120 -19.035 24.627 5.859 1.00 0.00 N ATOM 1746 NH2 ARG A 120 -16.932 23.710 5.846 1.00 0.00 N ATOM 0 H ARG A 120 -22.006 19.398 2.676 1.00 0.00 H new ATOM 0 HA ARG A 120 -20.182 20.525 0.878 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -19.752 22.114 2.667 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -21.466 21.755 2.608 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -21.414 20.501 4.597 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -19.692 20.197 4.485 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -20.648 23.043 4.757 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -20.660 22.010 6.173 1.00 0.00 H new ATOM 0 HE ARG A 120 -18.124 21.605 5.266 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -20.044 24.528 5.745 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -18.635 25.534 6.099 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -16.319 22.904 5.722 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -16.536 24.619 6.086 1.00 0.00 H new ATOM 1760 N GLY A 121 -17.789 20.173 1.769 1.00 0.00 N ATOM 1761 CA GLY A 121 -16.454 19.666 2.025 1.00 0.00 C ATOM 1762 C GLY A 121 -15.420 20.258 1.088 1.00 0.00 C ATOM 1763 O GLY A 121 -15.652 20.370 -0.116 1.00 0.00 O ATOM 0 H GLY A 121 -17.823 21.031 1.219 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -16.176 19.888 3.055 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -16.455 18.581 1.922 1.00 0.00 H new ATOM 1767 N THR A 122 -14.273 20.641 1.641 1.00 0.00 N ATOM 1768 CA THR A 122 -13.200 21.227 0.848 1.00 0.00 C ATOM 1769 C THR A 122 -11.915 21.341 1.660 1.00 0.00 C ATOM 1770 O THR A 122 -11.950 21.465 2.884 1.00 0.00 O ATOM 1771 CB THR A 122 -13.587 22.623 0.324 1.00 0.00 C ATOM 1772 OG1 THR A 122 -12.533 23.151 -0.488 1.00 0.00 O ATOM 1773 CG2 THR A 122 -13.871 23.574 1.477 1.00 0.00 C ATOM 0 H THR A 122 -14.064 20.556 2.636 1.00 0.00 H new ATOM 0 HA THR A 122 -13.034 20.561 0.001 1.00 0.00 H new ATOM 0 HB THR A 122 -14.492 22.524 -0.276 1.00 0.00 H new ATOM 0 HG1 THR A 122 -12.788 24.038 -0.819 1.00 0.00 H new ATOM 0 HG21 THR A 122 -14.142 24.553 1.083 1.00 0.00 H new ATOM 0 HG22 THR A 122 -14.694 23.184 2.076 1.00 0.00 H new ATOM 0 HG23 THR A 122 -12.981 23.667 2.099 1.00 0.00 H new ATOM 1781 N VAL A 123 -10.779 21.298 0.970 1.00 0.00 N ATOM 1782 CA VAL A 123 -9.481 21.397 1.627 1.00 0.00 C ATOM 1783 C VAL A 123 -8.630 22.494 0.999 1.00 0.00 C ATOM 1784 O VAL A 123 -8.577 22.630 -0.224 1.00 0.00 O ATOM 1785 CB VAL A 123 -8.714 20.064 1.559 1.00 0.00 C ATOM 1786 CG1 VAL A 123 -7.343 20.203 2.205 1.00 0.00 C ATOM 1787 CG2 VAL A 123 -9.515 18.954 2.222 1.00 0.00 C ATOM 0 H VAL A 123 -10.732 21.195 -0.044 1.00 0.00 H new ATOM 0 HA VAL A 123 -9.673 21.643 2.671 1.00 0.00 H new ATOM 0 HB VAL A 123 -8.570 19.801 0.511 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -6.815 19.251 2.148 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -6.770 20.968 1.681 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -7.461 20.490 3.250 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -8.958 18.019 2.165 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -9.692 19.207 3.267 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -10.470 18.839 1.710 1.00 0.00 H new ATOM 1797 N SER A 124 -7.963 23.275 1.843 1.00 0.00 N ATOM 1798 CA SER A 124 -7.115 24.364 1.370 1.00 0.00 C ATOM 1799 C SER A 124 -5.680 23.886 1.168 1.00 0.00 C ATOM 1800 O SER A 124 -5.340 22.750 1.496 1.00 0.00 O ATOM 1801 CB SER A 124 -7.143 25.528 2.362 1.00 0.00 C ATOM 1802 OG SER A 124 -6.772 25.100 3.661 1.00 0.00 O ATOM 0 H SER A 124 -7.993 23.174 2.858 1.00 0.00 H new ATOM 0 HA SER A 124 -7.504 24.705 0.411 1.00 0.00 H new ATOM 0 HB2 SER A 124 -6.464 26.312 2.026 1.00 0.00 H new ATOM 0 HB3 SER A 124 -8.143 25.962 2.390 1.00 0.00 H new ATOM 0 HG SER A 124 -6.796 25.863 4.276 1.00 0.00 H new ATOM 1808 N GLY A 125 -4.842 24.764 0.626 1.00 0.00 N ATOM 1809 CA GLY A 125 -3.453 24.415 0.389 1.00 0.00 C ATOM 1810 C GLY A 125 -2.622 25.605 -0.047 1.00 0.00 C ATOM 1811 O GLY A 125 -2.599 25.977 -1.221 1.00 0.00 O ATOM 0 H GLY A 125 -5.100 25.711 0.347 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -3.027 23.993 1.299 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -3.402 23.640 -0.376 1.00 0.00 H new ATOM 1815 N PRO A 126 -1.921 26.226 0.913 1.00 0.00 N ATOM 1816 CA PRO A 126 -1.073 27.392 0.646 1.00 0.00 C ATOM 1817 C PRO A 126 0.168 27.033 -0.163 1.00 0.00 C ATOM 1818 O PRO A 126 0.932 26.145 0.215 1.00 0.00 O ATOM 1819 CB PRO A 126 -0.679 27.871 2.045 1.00 0.00 C ATOM 1820 CG PRO A 126 -0.778 26.658 2.904 1.00 0.00 C ATOM 1821 CD PRO A 126 -1.902 25.838 2.334 1.00 0.00 C ATOM 0 HA PRO A 126 -1.591 28.145 0.052 1.00 0.00 H new ATOM 0 HB2 PRO A 126 0.331 28.280 2.053 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -1.345 28.659 2.395 1.00 0.00 H new ATOM 0 HG2 PRO A 126 0.157 26.097 2.897 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -0.979 26.929 3.940 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -1.722 24.770 2.457 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -2.850 26.060 2.824 1.00 0.00 H new ATOM 1829 N SER A 127 0.363 27.728 -1.279 1.00 0.00 N ATOM 1830 CA SER A 127 1.510 27.480 -2.144 1.00 0.00 C ATOM 1831 C SER A 127 2.379 28.728 -2.266 1.00 0.00 C ATOM 1832 O SER A 127 2.208 29.530 -3.184 1.00 0.00 O ATOM 1833 CB SER A 127 1.043 27.033 -3.531 1.00 0.00 C ATOM 1834 OG SER A 127 2.146 26.739 -4.370 1.00 0.00 O ATOM 0 H SER A 127 -0.259 28.468 -1.605 1.00 0.00 H new ATOM 0 HA SER A 127 2.106 26.685 -1.695 1.00 0.00 H new ATOM 0 HB2 SER A 127 0.408 26.152 -3.438 1.00 0.00 H new ATOM 0 HB3 SER A 127 0.436 27.817 -3.984 1.00 0.00 H new ATOM 0 HG SER A 127 1.821 26.454 -5.250 1.00 0.00 H new ATOM 1840 N SER A 128 3.312 28.885 -1.332 1.00 0.00 N ATOM 1841 CA SER A 128 4.207 30.037 -1.331 1.00 0.00 C ATOM 1842 C SER A 128 5.423 29.781 -2.216 1.00 0.00 C ATOM 1843 O SER A 128 6.146 28.803 -2.029 1.00 0.00 O ATOM 1844 CB SER A 128 4.657 30.358 0.095 1.00 0.00 C ATOM 1845 OG SER A 128 5.263 29.231 0.704 1.00 0.00 O ATOM 0 H SER A 128 3.468 28.229 -0.566 1.00 0.00 H new ATOM 0 HA SER A 128 3.661 30.891 -1.733 1.00 0.00 H new ATOM 0 HB2 SER A 128 5.362 31.189 0.079 1.00 0.00 H new ATOM 0 HB3 SER A 128 3.800 30.678 0.687 1.00 0.00 H new ATOM 0 HG SER A 128 5.814 28.759 0.045 1.00 0.00 H new ATOM 1851 N GLY A 129 5.643 30.668 -3.181 1.00 0.00 N ATOM 1852 CA GLY A 129 6.772 30.522 -4.081 1.00 0.00 C ATOM 1853 C GLY A 129 6.521 29.490 -5.163 1.00 0.00 C ATOM 1854 O GLY A 129 5.708 29.707 -6.061 1.00 0.00 O ATOM 0 H GLY A 129 5.059 31.486 -3.356 1.00 0.00 H new ATOM 0 HA2 GLY A 129 6.990 31.484 -4.544 1.00 0.00 H new ATOM 0 HA3 GLY A 129 7.655 30.237 -3.509 1.00 0.00 H new TER 1858 GLY A 129