USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=37 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= -1.76 F(o=-4.3!,f=-1.8) USER MOD Set 1.2: A 64 HIS :FLIP no HD1:sc= 0 X(o=-1.8,f=-1.8) USER MOD Set 2.1: A 11 SER OG : rot -160:sc= -0.0726 USER MOD Set 2.2: A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -120:sc= 0.0765 (180deg=0) USER MOD Single : A 2 SER OG : rot 15:sc= 0.662 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0084 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 -48:sc= 0.611 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 30:sc= -1.41 USER MOD Single : A 18 ASN : amide:sc= -0.43 X(o=-0.43,f=-0.29) USER MOD Single : A 24 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0893) USER MOD Single : A 27 GLN : amide:sc= -0.225 X(o=-0.23,f=-0.32) 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 45:sc= -0.0584 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS :FLIP no HE2:sc= -3.84! C(o=-5.5!,f=-3.8!) USER MOD Single : A 42 THR OG1 : rot -79:sc= 1.15 USER MOD Single : A 46 SER OG : rot 5:sc= 0.744! 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 38:sc= 1.16 USER MOD Single : A 57 SER OG : rot -112:sc= 1.26 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -0.788 X(o=-0.79,f=-0.35) USER MOD Single : A 66 GLN : amide:sc= -2.25 K(o=-2.2,f=-3.7!) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= -1.1 K(o=-1.1,f=-3.6!) USER MOD Single : A 80 GLN : amide:sc= -0.129 K(o=-0.13,f=-1.1!) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 HIS : no HD1:sc= -0.483 K(o=-0.48,f=-2.5!) USER MOD Single : A 93 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 96 GLN : amide:sc= 1.06 K(o=1.1,f=-0.019) USER MOD Single : A 99 HIS : no HD1:sc= -3! C(o=-3!,f=-3.4!) USER MOD Single : A 101 THR OG1 : rot -170:sc= -0.0021 USER MOD Single : A 106 LYS NZ :NH3+ -139:sc= -0.708 (180deg=-2.17!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 22:sc= 0.116 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 38:sc= 0.055 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 38:sc= 0.77 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 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 -58:sc= 0.00322 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.885 22.256 -27.723 1.00 0.00 N ATOM 2 CA GLY A 1 -11.466 21.064 -28.314 1.00 0.00 C ATOM 3 C GLY A 1 -12.092 20.150 -27.279 1.00 0.00 C ATOM 4 O GLY A 1 -12.022 20.419 -26.080 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.349 23.100 -28.116 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.022 22.234 -26.692 1.00 0.00 H new ATOM 0 H3 GLY A 1 -9.868 22.289 -27.937 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.223 21.355 -29.042 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.694 20.518 -28.857 1.00 0.00 H new ATOM 8 N SER A 2 -12.706 19.067 -27.744 1.00 0.00 N ATOM 9 CA SER A 2 -13.352 18.112 -26.850 1.00 0.00 C ATOM 10 C SER A 2 -13.451 16.737 -27.504 1.00 0.00 C ATOM 11 O SER A 2 -13.385 16.613 -28.727 1.00 0.00 O ATOM 12 CB SER A 2 -14.747 18.607 -26.463 1.00 0.00 C ATOM 13 OG SER A 2 -14.669 19.692 -25.554 1.00 0.00 O ATOM 0 H SER A 2 -12.770 18.829 -28.734 1.00 0.00 H new ATOM 0 HA SER A 2 -12.743 18.024 -25.950 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.288 18.916 -27.357 1.00 0.00 H new ATOM 0 HB3 SER A 2 -15.314 17.792 -26.013 1.00 0.00 H new ATOM 0 HG SER A 2 -13.757 20.050 -25.550 1.00 0.00 H new ATOM 19 N SER A 3 -13.611 15.707 -26.679 1.00 0.00 N ATOM 20 CA SER A 3 -13.716 14.340 -27.175 1.00 0.00 C ATOM 21 C SER A 3 -15.059 13.725 -26.794 1.00 0.00 C ATOM 22 O SER A 3 -15.846 14.328 -26.065 1.00 0.00 O ATOM 23 CB SER A 3 -12.575 13.485 -26.621 1.00 0.00 C ATOM 24 OG SER A 3 -12.423 12.291 -27.368 1.00 0.00 O ATOM 0 H SER A 3 -13.671 15.793 -25.664 1.00 0.00 H new ATOM 0 HA SER A 3 -13.645 14.368 -28.262 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.645 14.054 -26.645 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.773 13.242 -25.577 1.00 0.00 H new ATOM 0 HG SER A 3 -11.686 11.763 -26.995 1.00 0.00 H new ATOM 30 N GLY A 4 -15.315 12.520 -27.294 1.00 0.00 N ATOM 31 CA GLY A 4 -16.563 11.842 -26.996 1.00 0.00 C ATOM 32 C GLY A 4 -16.472 10.343 -27.201 1.00 0.00 C ATOM 33 O GLY A 4 -16.711 9.844 -28.300 1.00 0.00 O ATOM 0 H GLY A 4 -14.680 12.001 -27.900 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.847 12.048 -25.964 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.352 12.245 -27.630 1.00 0.00 H new ATOM 37 N SER A 5 -16.124 9.622 -26.139 1.00 0.00 N ATOM 38 CA SER A 5 -15.997 8.171 -26.209 1.00 0.00 C ATOM 39 C SER A 5 -16.506 7.519 -24.927 1.00 0.00 C ATOM 40 O SER A 5 -16.306 8.041 -23.831 1.00 0.00 O ATOM 41 CB SER A 5 -14.539 7.777 -26.451 1.00 0.00 C ATOM 42 OG SER A 5 -13.772 7.905 -25.266 1.00 0.00 O ATOM 0 H SER A 5 -15.925 10.019 -25.221 1.00 0.00 H new ATOM 0 HA SER A 5 -16.605 7.817 -27.042 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.492 6.749 -26.809 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.114 8.407 -27.233 1.00 0.00 H new ATOM 0 HG SER A 5 -12.844 7.646 -25.447 1.00 0.00 H new ATOM 48 N SER A 6 -17.165 6.374 -25.075 1.00 0.00 N ATOM 49 CA SER A 6 -17.707 5.651 -23.930 1.00 0.00 C ATOM 50 C SER A 6 -17.605 4.144 -24.142 1.00 0.00 C ATOM 51 O SER A 6 -17.526 3.669 -25.274 1.00 0.00 O ATOM 52 CB SER A 6 -19.166 6.047 -23.694 1.00 0.00 C ATOM 53 OG SER A 6 -19.275 7.422 -23.371 1.00 0.00 O ATOM 0 H SER A 6 -17.336 5.927 -25.976 1.00 0.00 H new ATOM 0 HA SER A 6 -17.119 5.918 -23.052 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.753 5.832 -24.587 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.583 5.446 -22.886 1.00 0.00 H new ATOM 0 HG SER A 6 -20.217 7.650 -23.227 1.00 0.00 H new ATOM 59 N GLY A 7 -17.607 3.396 -23.042 1.00 0.00 N ATOM 60 CA GLY A 7 -17.514 1.951 -23.128 1.00 0.00 C ATOM 61 C GLY A 7 -16.854 1.339 -21.908 1.00 0.00 C ATOM 62 O GLY A 7 -17.369 1.446 -20.796 1.00 0.00 O ATOM 0 H GLY A 7 -17.671 3.766 -22.094 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.513 1.532 -23.245 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -16.948 1.679 -24.019 1.00 0.00 H new ATOM 66 N GLY A 8 -15.711 0.693 -22.117 1.00 0.00 N ATOM 67 CA GLY A 8 -14.999 0.069 -21.016 1.00 0.00 C ATOM 68 C GLY A 8 -15.608 -1.258 -20.611 1.00 0.00 C ATOM 69 O GLY A 8 -16.747 -1.311 -20.147 1.00 0.00 O ATOM 0 H GLY A 8 -15.265 0.590 -23.029 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -13.958 -0.084 -21.301 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -14.999 0.742 -20.159 1.00 0.00 H new ATOM 73 N SER A 9 -14.848 -2.335 -20.787 1.00 0.00 N ATOM 74 CA SER A 9 -15.322 -3.670 -20.440 1.00 0.00 C ATOM 75 C SER A 9 -14.561 -4.221 -19.238 1.00 0.00 C ATOM 76 O SER A 9 -14.182 -5.392 -19.214 1.00 0.00 O ATOM 77 CB SER A 9 -15.166 -4.614 -21.634 1.00 0.00 C ATOM 78 OG SER A 9 -15.726 -5.886 -21.354 1.00 0.00 O ATOM 0 H SER A 9 -13.902 -2.309 -21.168 1.00 0.00 H new ATOM 0 HA SER A 9 -16.377 -3.598 -20.177 1.00 0.00 H new ATOM 0 HB2 SER A 9 -15.653 -4.183 -22.509 1.00 0.00 H new ATOM 0 HB3 SER A 9 -14.110 -4.724 -21.879 1.00 0.00 H new ATOM 0 HG SER A 9 -15.408 -6.198 -20.481 1.00 0.00 H new ATOM 84 N ASP A 10 -14.343 -3.369 -18.243 1.00 0.00 N ATOM 85 CA ASP A 10 -13.628 -3.769 -17.037 1.00 0.00 C ATOM 86 C ASP A 10 -12.281 -4.395 -17.385 1.00 0.00 C ATOM 87 O ASP A 10 -11.889 -5.409 -16.808 1.00 0.00 O ATOM 88 CB ASP A 10 -14.468 -4.757 -16.225 1.00 0.00 C ATOM 89 CG ASP A 10 -15.948 -4.432 -16.270 1.00 0.00 C ATOM 90 OD1 ASP A 10 -16.373 -3.498 -15.557 1.00 0.00 O ATOM 91 OD2 ASP A 10 -16.682 -5.110 -17.019 1.00 0.00 O ATOM 0 H ASP A 10 -14.651 -2.397 -18.248 1.00 0.00 H new ATOM 0 HA ASP A 10 -13.449 -2.876 -16.438 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -14.309 -5.765 -16.608 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -14.129 -4.752 -15.189 1.00 0.00 H new ATOM 96 N SER A 11 -11.578 -3.783 -18.332 1.00 0.00 N ATOM 97 CA SER A 11 -10.277 -4.282 -18.761 1.00 0.00 C ATOM 98 C SER A 11 -9.149 -3.542 -18.048 1.00 0.00 C ATOM 99 O SER A 11 -8.301 -4.156 -17.401 1.00 0.00 O ATOM 100 CB SER A 11 -10.123 -4.132 -20.276 1.00 0.00 C ATOM 101 OG SER A 11 -10.363 -2.796 -20.683 1.00 0.00 O ATOM 0 H SER A 11 -11.887 -2.941 -18.817 1.00 0.00 H new ATOM 0 HA SER A 11 -10.217 -5.339 -18.500 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.118 -4.431 -20.574 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.818 -4.801 -20.783 1.00 0.00 H new ATOM 0 HG SER A 11 -10.573 -2.778 -21.640 1.00 0.00 H new ATOM 107 N SER A 12 -9.147 -2.219 -18.172 1.00 0.00 N ATOM 108 CA SER A 12 -8.122 -1.394 -17.544 1.00 0.00 C ATOM 109 C SER A 12 -8.675 -0.685 -16.311 1.00 0.00 C ATOM 110 O SER A 12 -8.893 0.527 -16.323 1.00 0.00 O ATOM 111 CB SER A 12 -7.584 -0.365 -18.539 1.00 0.00 C ATOM 112 OG SER A 12 -7.278 -0.970 -19.784 1.00 0.00 O ATOM 0 H SER A 12 -9.844 -1.695 -18.702 1.00 0.00 H new ATOM 0 HA SER A 12 -7.307 -2.047 -17.232 1.00 0.00 H new ATOM 0 HB2 SER A 12 -8.322 0.424 -18.686 1.00 0.00 H new ATOM 0 HB3 SER A 12 -6.690 0.107 -18.131 1.00 0.00 H new ATOM 0 HG SER A 12 -6.938 -0.291 -20.403 1.00 0.00 H new ATOM 118 N LEU A 13 -8.902 -1.450 -15.249 1.00 0.00 N ATOM 119 CA LEU A 13 -9.430 -0.896 -14.007 1.00 0.00 C ATOM 120 C LEU A 13 -8.360 -0.101 -13.266 1.00 0.00 C ATOM 121 O LEU A 13 -8.666 0.843 -12.537 1.00 0.00 O ATOM 122 CB LEU A 13 -9.960 -2.017 -13.111 1.00 0.00 C ATOM 123 CG LEU A 13 -11.300 -2.629 -13.523 1.00 0.00 C ATOM 124 CD1 LEU A 13 -12.370 -1.552 -13.622 1.00 0.00 C ATOM 125 CD2 LEU A 13 -11.164 -3.371 -14.844 1.00 0.00 C ATOM 0 H LEU A 13 -8.729 -2.455 -15.223 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.248 -0.221 -14.258 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.215 -2.812 -13.079 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -10.057 -1.629 -12.097 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.602 -3.344 -12.758 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -13.317 -2.005 -13.916 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.486 -1.065 -12.654 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -12.075 -0.813 -14.367 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -12.127 -3.800 -15.121 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.839 -2.677 -15.619 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -10.428 -4.169 -14.739 1.00 0.00 H new ATOM 137 N PHE A 14 -7.103 -0.488 -13.458 1.00 0.00 N ATOM 138 CA PHE A 14 -5.987 0.189 -12.809 1.00 0.00 C ATOM 139 C PHE A 14 -5.049 0.805 -13.844 1.00 0.00 C ATOM 140 O PHE A 14 -4.938 0.313 -14.966 1.00 0.00 O ATOM 141 CB PHE A 14 -5.214 -0.790 -11.923 1.00 0.00 C ATOM 142 CG PHE A 14 -6.096 -1.609 -11.024 1.00 0.00 C ATOM 143 CD1 PHE A 14 -6.814 -2.682 -11.527 1.00 0.00 C ATOM 144 CD2 PHE A 14 -6.208 -1.305 -9.677 1.00 0.00 C ATOM 145 CE1 PHE A 14 -7.627 -3.437 -10.703 1.00 0.00 C ATOM 146 CE2 PHE A 14 -7.019 -2.057 -8.847 1.00 0.00 C ATOM 147 CZ PHE A 14 -7.728 -3.125 -9.361 1.00 0.00 C ATOM 0 H PHE A 14 -6.832 -1.267 -14.058 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.391 0.989 -12.188 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -4.632 -1.460 -12.557 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.504 -0.232 -11.312 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -6.737 -2.931 -12.575 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -5.655 -0.471 -9.270 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -8.183 -4.270 -11.108 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -7.098 -1.810 -7.799 1.00 0.00 H new ATOM 0 HZ PHE A 14 -8.361 -3.715 -8.715 1.00 0.00 H new ATOM 157 N GLU A 15 -4.377 1.885 -13.456 1.00 0.00 N ATOM 158 CA GLU A 15 -3.450 2.569 -14.350 1.00 0.00 C ATOM 159 C GLU A 15 -2.028 2.522 -13.799 1.00 0.00 C ATOM 160 O GLU A 15 -1.813 2.642 -12.592 1.00 0.00 O ATOM 161 CB GLU A 15 -3.883 4.022 -14.555 1.00 0.00 C ATOM 162 CG GLU A 15 -4.121 4.775 -13.256 1.00 0.00 C ATOM 163 CD GLU A 15 -4.032 6.278 -13.429 1.00 0.00 C ATOM 164 OE1 GLU A 15 -4.344 6.768 -14.535 1.00 0.00 O ATOM 165 OE2 GLU A 15 -3.650 6.966 -12.459 1.00 0.00 O ATOM 0 H GLU A 15 -4.457 2.304 -12.530 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.465 2.055 -15.311 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.118 4.542 -15.132 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.797 4.040 -15.148 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.105 4.516 -12.865 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.389 4.454 -12.515 1.00 0.00 H new ATOM 172 N THR A 16 -1.059 2.346 -14.691 1.00 0.00 N ATOM 173 CA THR A 16 0.342 2.282 -14.296 1.00 0.00 C ATOM 174 C THR A 16 1.099 3.525 -14.748 1.00 0.00 C ATOM 175 O THR A 16 0.823 4.079 -15.812 1.00 0.00 O ATOM 176 CB THR A 16 1.034 1.034 -14.877 1.00 0.00 C ATOM 177 OG1 THR A 16 0.281 -0.139 -14.552 1.00 0.00 O ATOM 178 CG2 THR A 16 2.450 0.900 -14.339 1.00 0.00 C ATOM 0 H THR A 16 -1.219 2.245 -15.693 1.00 0.00 H new ATOM 0 HA THR A 16 0.360 2.225 -13.208 1.00 0.00 H new ATOM 0 HB THR A 16 1.084 1.144 -15.960 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.726 -0.928 -14.926 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.918 0.012 -14.763 1.00 0.00 H new ATOM 0 HG22 THR A 16 3.029 1.782 -14.614 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.420 0.810 -13.253 1.00 0.00 H new ATOM 186 N TYR A 17 2.055 3.959 -13.933 1.00 0.00 N ATOM 187 CA TYR A 17 2.851 5.139 -14.249 1.00 0.00 C ATOM 188 C TYR A 17 4.201 5.091 -13.541 1.00 0.00 C ATOM 189 O TYR A 17 4.332 4.501 -12.470 1.00 0.00 O ATOM 190 CB TYR A 17 2.098 6.410 -13.850 1.00 0.00 C ATOM 191 CG TYR A 17 1.714 6.452 -12.388 1.00 0.00 C ATOM 192 CD1 TYR A 17 2.572 6.995 -11.440 1.00 0.00 C ATOM 193 CD2 TYR A 17 0.493 5.950 -11.956 1.00 0.00 C ATOM 194 CE1 TYR A 17 2.225 7.035 -10.103 1.00 0.00 C ATOM 195 CE2 TYR A 17 0.137 5.987 -10.622 1.00 0.00 C ATOM 196 CZ TYR A 17 1.007 6.530 -9.699 1.00 0.00 C ATOM 197 OH TYR A 17 0.657 6.569 -8.369 1.00 0.00 O ATOM 0 H TYR A 17 2.297 3.511 -13.049 1.00 0.00 H new ATOM 0 HA TYR A 17 3.026 5.151 -15.325 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.718 7.277 -14.079 1.00 0.00 H new ATOM 0 HB3 TYR A 17 1.196 6.494 -14.457 1.00 0.00 H new ATOM 0 HD1 TYR A 17 3.526 7.393 -11.753 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.190 5.523 -12.676 1.00 0.00 H new ATOM 0 HE1 TYR A 17 2.904 7.459 -9.378 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -0.817 5.593 -10.303 1.00 0.00 H new ATOM 0 HH TYR A 17 1.080 7.343 -7.942 1.00 0.00 H new ATOM 207 N ASN A 18 5.203 5.718 -14.150 1.00 0.00 N ATOM 208 CA ASN A 18 6.545 5.747 -13.579 1.00 0.00 C ATOM 209 C ASN A 18 6.814 7.082 -12.891 1.00 0.00 C ATOM 210 O ASN A 18 6.508 8.145 -13.433 1.00 0.00 O ATOM 211 CB ASN A 18 7.591 5.501 -14.668 1.00 0.00 C ATOM 212 CG ASN A 18 7.140 6.003 -16.026 1.00 0.00 C ATOM 213 OD1 ASN A 18 7.431 7.136 -16.409 1.00 0.00 O ATOM 214 ND2 ASN A 18 6.426 5.159 -16.761 1.00 0.00 N ATOM 0 H ASN A 18 5.111 6.212 -15.038 1.00 0.00 H new ATOM 0 HA ASN A 18 6.613 4.954 -12.834 1.00 0.00 H new ATOM 0 HB2 ASN A 18 8.522 5.995 -14.392 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.803 4.434 -14.730 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.095 5.440 -17.684 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.208 4.229 -16.403 1.00 0.00 H new ATOM 221 N VAL A 19 7.390 7.020 -11.695 1.00 0.00 N ATOM 222 CA VAL A 19 7.703 8.224 -10.934 1.00 0.00 C ATOM 223 C VAL A 19 9.210 8.404 -10.785 1.00 0.00 C ATOM 224 O VAL A 19 9.889 7.569 -10.190 1.00 0.00 O ATOM 225 CB VAL A 19 7.061 8.185 -9.534 1.00 0.00 C ATOM 226 CG1 VAL A 19 6.915 9.592 -8.975 1.00 0.00 C ATOM 227 CG2 VAL A 19 5.715 7.480 -9.585 1.00 0.00 C ATOM 0 H VAL A 19 7.649 6.149 -11.232 1.00 0.00 H new ATOM 0 HA VAL A 19 7.293 9.066 -11.491 1.00 0.00 H new ATOM 0 HB VAL A 19 7.715 7.621 -8.868 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.460 9.545 -7.986 1.00 0.00 H new ATOM 0 HG12 VAL A 19 7.898 10.058 -8.901 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.283 10.183 -9.638 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.276 7.462 -8.588 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.050 8.014 -10.264 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.852 6.459 -9.940 1.00 0.00 H new ATOM 237 N GLU A 20 9.725 9.501 -11.331 1.00 0.00 N ATOM 238 CA GLU A 20 11.153 9.791 -11.260 1.00 0.00 C ATOM 239 C GLU A 20 11.471 10.659 -10.046 1.00 0.00 C ATOM 240 O GLU A 20 11.453 11.888 -10.125 1.00 0.00 O ATOM 241 CB GLU A 20 11.619 10.491 -12.538 1.00 0.00 C ATOM 242 CG GLU A 20 13.060 10.968 -12.480 1.00 0.00 C ATOM 243 CD GLU A 20 13.360 12.043 -13.506 1.00 0.00 C ATOM 244 OE1 GLU A 20 13.030 13.220 -13.246 1.00 0.00 O ATOM 245 OE2 GLU A 20 13.925 11.709 -14.568 1.00 0.00 O ATOM 0 H GLU A 20 9.176 10.203 -11.827 1.00 0.00 H new ATOM 0 HA GLU A 20 11.685 8.845 -11.159 1.00 0.00 H new ATOM 0 HB2 GLU A 20 11.505 9.807 -13.379 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.970 11.345 -12.732 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.271 11.354 -11.483 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.726 10.121 -12.642 1.00 0.00 H new ATOM 252 N LEU A 21 11.762 10.012 -8.923 1.00 0.00 N ATOM 253 CA LEU A 21 12.085 10.723 -7.691 1.00 0.00 C ATOM 254 C LEU A 21 13.520 11.240 -7.720 1.00 0.00 C ATOM 255 O LEU A 21 14.403 10.618 -8.312 1.00 0.00 O ATOM 256 CB LEU A 21 11.885 9.808 -6.482 1.00 0.00 C ATOM 257 CG LEU A 21 10.487 9.210 -6.318 1.00 0.00 C ATOM 258 CD1 LEU A 21 10.454 8.244 -5.143 1.00 0.00 C ATOM 259 CD2 LEU A 21 9.454 10.311 -6.133 1.00 0.00 C ATOM 0 H LEU A 21 11.781 8.996 -8.840 1.00 0.00 H new ATOM 0 HA LEU A 21 11.412 11.577 -7.607 1.00 0.00 H new ATOM 0 HB2 LEU A 21 12.603 8.990 -6.547 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.125 10.372 -5.581 1.00 0.00 H new ATOM 0 HG LEU A 21 10.241 8.657 -7.225 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.451 7.828 -5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 21 11.166 7.437 -5.316 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.721 8.774 -4.229 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.465 9.867 -6.018 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.697 10.892 -5.243 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.459 10.965 -7.005 1.00 0.00 H new ATOM 271 N VAL A 22 13.747 12.379 -7.075 1.00 0.00 N ATOM 272 CA VAL A 22 15.075 12.978 -7.023 1.00 0.00 C ATOM 273 C VAL A 22 15.651 12.919 -5.613 1.00 0.00 C ATOM 274 O VAL A 22 14.979 13.270 -4.642 1.00 0.00 O ATOM 275 CB VAL A 22 15.049 14.444 -7.494 1.00 0.00 C ATOM 276 CG1 VAL A 22 14.320 15.316 -6.484 1.00 0.00 C ATOM 277 CG2 VAL A 22 16.463 14.953 -7.728 1.00 0.00 C ATOM 0 H VAL A 22 13.027 12.906 -6.580 1.00 0.00 H new ATOM 0 HA VAL A 22 15.709 12.399 -7.695 1.00 0.00 H new ATOM 0 HB VAL A 22 14.508 14.495 -8.439 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.312 16.348 -6.834 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.295 14.963 -6.371 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.830 15.263 -5.522 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.426 15.990 -8.060 1.00 0.00 H new ATOM 0 HG22 VAL A 22 17.031 14.889 -6.800 1.00 0.00 H new ATOM 0 HG23 VAL A 22 16.947 14.344 -8.492 1.00 0.00 H new ATOM 287 N ARG A 23 16.898 12.472 -5.507 1.00 0.00 N ATOM 288 CA ARG A 23 17.564 12.367 -4.214 1.00 0.00 C ATOM 289 C ARG A 23 18.689 13.390 -4.097 1.00 0.00 C ATOM 290 O ARG A 23 19.739 13.250 -4.725 1.00 0.00 O ATOM 291 CB ARG A 23 18.122 10.956 -4.018 1.00 0.00 C ATOM 292 CG ARG A 23 17.070 9.864 -4.133 1.00 0.00 C ATOM 293 CD ARG A 23 17.707 8.488 -4.251 1.00 0.00 C ATOM 294 NE ARG A 23 18.760 8.285 -3.260 1.00 0.00 N ATOM 295 CZ ARG A 23 19.140 7.088 -2.826 1.00 0.00 C ATOM 296 NH1 ARG A 23 18.558 5.994 -3.295 1.00 0.00 N ATOM 297 NH2 ARG A 23 20.106 6.985 -1.922 1.00 0.00 N ATOM 0 H ARG A 23 17.467 12.177 -6.300 1.00 0.00 H new ATOM 0 HA ARG A 23 16.828 12.572 -3.437 1.00 0.00 H new ATOM 0 HB2 ARG A 23 18.902 10.777 -4.758 1.00 0.00 H new ATOM 0 HB3 ARG A 23 18.593 10.894 -3.037 1.00 0.00 H new ATOM 0 HG2 ARG A 23 16.419 9.891 -3.259 1.00 0.00 H new ATOM 0 HG3 ARG A 23 16.443 10.052 -5.004 1.00 0.00 H new ATOM 0 HD2 ARG A 23 16.941 7.722 -4.128 1.00 0.00 H new ATOM 0 HD3 ARG A 23 18.122 8.365 -5.251 1.00 0.00 H new ATOM 0 HE ARG A 23 19.230 9.107 -2.880 1.00 0.00 H new ATOM 0 HH11 ARG A 23 17.816 6.069 -3.991 1.00 0.00 H new ATOM 0 HH12 ARG A 23 18.852 5.076 -2.960 1.00 0.00 H new ATOM 0 HH21 ARG A 23 20.557 7.825 -1.560 1.00 0.00 H new ATOM 0 HH22 ARG A 23 20.397 6.066 -1.589 1.00 0.00 H new ATOM 311 N LYS A 24 18.463 14.421 -3.289 1.00 0.00 N ATOM 312 CA LYS A 24 19.457 15.468 -3.088 1.00 0.00 C ATOM 313 C LYS A 24 20.807 14.872 -2.705 1.00 0.00 C ATOM 314 O LYS A 24 20.960 13.652 -2.634 1.00 0.00 O ATOM 315 CB LYS A 24 18.990 16.440 -2.001 1.00 0.00 C ATOM 316 CG LYS A 24 17.858 17.350 -2.445 1.00 0.00 C ATOM 317 CD LYS A 24 18.384 18.637 -3.058 1.00 0.00 C ATOM 318 CE LYS A 24 17.250 19.560 -3.477 1.00 0.00 C ATOM 319 NZ LYS A 24 16.449 18.983 -4.591 1.00 0.00 N ATOM 0 H LYS A 24 17.599 14.553 -2.763 1.00 0.00 H new ATOM 0 HA LYS A 24 19.573 16.009 -4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.666 15.870 -1.130 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.835 17.052 -1.685 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.234 16.829 -3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.223 17.586 -1.591 1.00 0.00 H new ATOM 0 HD2 LYS A 24 19.024 19.149 -2.339 1.00 0.00 H new ATOM 0 HD3 LYS A 24 19.002 18.402 -3.924 1.00 0.00 H new ATOM 0 HE2 LYS A 24 16.600 19.749 -2.622 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.660 20.522 -3.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 15.786 19.700 -4.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 17.085 18.685 -5.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 15.915 18.160 -4.245 1.00 0.00 H new ATOM 333 N ASP A 25 21.783 15.738 -2.458 1.00 0.00 N ATOM 334 CA ASP A 25 23.121 15.296 -2.080 1.00 0.00 C ATOM 335 C ASP A 25 23.130 14.749 -0.656 1.00 0.00 C ATOM 336 O ASP A 25 23.484 15.454 0.288 1.00 0.00 O ATOM 337 CB ASP A 25 24.116 16.451 -2.202 1.00 0.00 C ATOM 338 CG ASP A 25 25.542 16.019 -1.921 1.00 0.00 C ATOM 339 OD1 ASP A 25 26.168 15.421 -2.820 1.00 0.00 O ATOM 340 OD2 ASP A 25 26.030 16.277 -0.801 1.00 0.00 O ATOM 0 H ASP A 25 21.673 16.751 -2.513 1.00 0.00 H new ATOM 0 HA ASP A 25 23.419 14.497 -2.759 1.00 0.00 H new ATOM 0 HB2 ASP A 25 24.058 16.872 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 25 23.836 17.243 -1.507 1.00 0.00 H new ATOM 345 N GLY A 26 22.736 13.488 -0.509 1.00 0.00 N ATOM 346 CA GLY A 26 22.705 12.868 0.802 1.00 0.00 C ATOM 347 C GLY A 26 21.351 12.271 1.130 1.00 0.00 C ATOM 348 O GLY A 26 21.266 11.163 1.659 1.00 0.00 O ATOM 0 H GLY A 26 22.438 12.885 -1.275 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.464 12.087 0.849 1.00 0.00 H new ATOM 0 HA3 GLY A 26 22.964 13.610 1.557 1.00 0.00 H new ATOM 352 N GLN A 27 20.290 13.007 0.816 1.00 0.00 N ATOM 353 CA GLN A 27 18.933 12.543 1.082 1.00 0.00 C ATOM 354 C GLN A 27 18.707 11.154 0.496 1.00 0.00 C ATOM 355 O GLN A 27 19.166 10.852 -0.606 1.00 0.00 O ATOM 356 CB GLN A 27 17.913 13.526 0.504 1.00 0.00 C ATOM 357 CG GLN A 27 16.472 13.068 0.659 1.00 0.00 C ATOM 358 CD GLN A 27 15.483 14.030 0.032 1.00 0.00 C ATOM 359 OE1 GLN A 27 14.852 14.830 0.724 1.00 0.00 O ATOM 360 NE2 GLN A 27 15.342 13.959 -1.287 1.00 0.00 N ATOM 0 H GLN A 27 20.343 13.926 0.377 1.00 0.00 H new ATOM 0 HA GLN A 27 18.801 12.486 2.162 1.00 0.00 H new ATOM 0 HB2 GLN A 27 18.033 14.492 0.994 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.126 13.677 -0.554 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.356 12.085 0.202 1.00 0.00 H new ATOM 0 HG3 GLN A 27 16.242 12.956 1.719 1.00 0.00 H new ATOM 0 HE21 GLN A 27 15.885 13.281 -1.822 1.00 0.00 H new ATOM 0 HE22 GLN A 27 14.691 14.582 -1.765 1.00 0.00 H new ATOM 369 N SER A 28 17.999 10.311 1.240 1.00 0.00 N ATOM 370 CA SER A 28 17.716 8.951 0.796 1.00 0.00 C ATOM 371 C SER A 28 16.293 8.841 0.256 1.00 0.00 C ATOM 372 O SER A 28 15.436 9.673 0.557 1.00 0.00 O ATOM 373 CB SER A 28 17.915 7.964 1.947 1.00 0.00 C ATOM 374 OG SER A 28 19.288 7.667 2.133 1.00 0.00 O ATOM 0 H SER A 28 17.611 10.546 2.153 1.00 0.00 H new ATOM 0 HA SER A 28 18.411 8.705 -0.007 1.00 0.00 H new ATOM 0 HB2 SER A 28 17.503 8.383 2.865 1.00 0.00 H new ATOM 0 HB3 SER A 28 17.366 7.045 1.741 1.00 0.00 H new ATOM 0 HG SER A 28 19.388 7.035 2.876 1.00 0.00 H new ATOM 380 N LEU A 29 16.048 7.808 -0.542 1.00 0.00 N ATOM 381 CA LEU A 29 14.729 7.586 -1.125 1.00 0.00 C ATOM 382 C LEU A 29 13.628 7.946 -0.132 1.00 0.00 C ATOM 383 O LEU A 29 12.916 8.934 -0.311 1.00 0.00 O ATOM 384 CB LEU A 29 14.581 6.128 -1.562 1.00 0.00 C ATOM 385 CG LEU A 29 13.443 5.833 -2.539 1.00 0.00 C ATOM 386 CD1 LEU A 29 13.721 6.471 -3.891 1.00 0.00 C ATOM 387 CD2 LEU A 29 13.243 4.331 -2.687 1.00 0.00 C ATOM 0 H LEU A 29 16.746 7.110 -0.801 1.00 0.00 H new ATOM 0 HA LEU A 29 14.631 8.231 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.518 5.810 -2.020 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.437 5.516 -0.672 1.00 0.00 H new ATOM 0 HG LEU A 29 12.525 6.264 -2.139 1.00 0.00 H new ATOM 0 HD11 LEU A 29 12.900 6.250 -4.573 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.813 7.551 -3.772 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.649 6.070 -4.298 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.429 4.139 -3.386 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.160 3.877 -3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.997 3.899 -1.717 1.00 0.00 H new ATOM 399 N GLY A 30 13.496 7.139 0.916 1.00 0.00 N ATOM 400 CA GLY A 30 12.482 7.391 1.923 1.00 0.00 C ATOM 401 C GLY A 30 11.165 6.712 1.601 1.00 0.00 C ATOM 402 O GLY A 30 10.123 7.364 1.535 1.00 0.00 O ATOM 0 H GLY A 30 14.073 6.315 1.086 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.841 7.041 2.891 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.321 8.465 2.012 1.00 0.00 H new ATOM 406 N ILE A 31 11.212 5.399 1.399 1.00 0.00 N ATOM 407 CA ILE A 31 10.013 4.633 1.081 1.00 0.00 C ATOM 408 C ILE A 31 10.051 3.257 1.738 1.00 0.00 C ATOM 409 O ILE A 31 11.008 2.502 1.566 1.00 0.00 O ATOM 410 CB ILE A 31 9.843 4.459 -0.439 1.00 0.00 C ATOM 411 CG1 ILE A 31 9.781 5.824 -1.127 1.00 0.00 C ATOM 412 CG2 ILE A 31 8.590 3.650 -0.742 1.00 0.00 C ATOM 413 CD1 ILE A 31 9.964 5.754 -2.627 1.00 0.00 C ATOM 0 H ILE A 31 12.066 4.844 1.450 1.00 0.00 H new ATOM 0 HA ILE A 31 9.165 5.196 1.471 1.00 0.00 H new ATOM 0 HB ILE A 31 10.705 3.917 -0.827 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.820 6.289 -0.908 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.551 6.470 -0.705 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.483 3.535 -1.821 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.671 2.667 -0.279 1.00 0.00 H new ATOM 0 HG23 ILE A 31 7.717 4.168 -0.344 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.908 6.758 -3.048 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.937 5.319 -2.855 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.179 5.135 -3.061 1.00 0.00 H new ATOM 425 N ARG A 32 9.003 2.937 2.490 1.00 0.00 N ATOM 426 CA ARG A 32 8.916 1.652 3.173 1.00 0.00 C ATOM 427 C ARG A 32 8.027 0.684 2.397 1.00 0.00 C ATOM 428 O ARG A 32 6.978 1.068 1.880 1.00 0.00 O ATOM 429 CB ARG A 32 8.370 1.838 4.589 1.00 0.00 C ATOM 430 CG ARG A 32 9.351 2.509 5.537 1.00 0.00 C ATOM 431 CD ARG A 32 10.268 1.493 6.200 1.00 0.00 C ATOM 432 NE ARG A 32 9.610 0.801 7.304 1.00 0.00 N ATOM 433 CZ ARG A 32 10.266 0.210 8.297 1.00 0.00 C ATOM 434 NH1 ARG A 32 11.592 0.229 8.323 1.00 0.00 N ATOM 435 NH2 ARG A 32 9.597 -0.400 9.266 1.00 0.00 N ATOM 0 H ARG A 32 8.202 3.550 2.642 1.00 0.00 H new ATOM 0 HA ARG A 32 9.920 1.231 3.231 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.458 2.433 4.542 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.095 0.864 4.994 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.949 3.237 4.988 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.802 3.059 6.302 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.597 0.764 5.459 1.00 0.00 H new ATOM 0 HD3 ARG A 32 11.161 1.997 6.569 1.00 0.00 H new ATOM 0 HE ARG A 32 8.591 0.769 7.314 1.00 0.00 H new ATOM 0 HH11 ARG A 32 12.110 0.698 7.580 1.00 0.00 H new ATOM 0 HH12 ARG A 32 12.094 -0.225 9.086 1.00 0.00 H new ATOM 0 HH21 ARG A 32 8.577 -0.416 9.250 1.00 0.00 H new ATOM 0 HH22 ARG A 32 10.102 -0.853 10.027 1.00 0.00 H new ATOM 449 N ILE A 33 8.455 -0.572 2.320 1.00 0.00 N ATOM 450 CA ILE A 33 7.697 -1.594 1.608 1.00 0.00 C ATOM 451 C ILE A 33 7.240 -2.698 2.555 1.00 0.00 C ATOM 452 O ILE A 33 7.746 -2.824 3.670 1.00 0.00 O ATOM 453 CB ILE A 33 8.527 -2.219 0.471 1.00 0.00 C ATOM 454 CG1 ILE A 33 9.747 -2.945 1.040 1.00 0.00 C ATOM 455 CG2 ILE A 33 8.955 -1.149 -0.522 1.00 0.00 C ATOM 456 CD1 ILE A 33 10.197 -4.120 0.200 1.00 0.00 C ATOM 0 H ILE A 33 9.322 -0.906 2.741 1.00 0.00 H new ATOM 0 HA ILE A 33 6.824 -1.101 1.181 1.00 0.00 H new ATOM 0 HB ILE A 33 7.908 -2.947 -0.054 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.571 -2.237 1.131 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.515 -3.295 2.046 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.541 -1.606 -1.320 1.00 0.00 H new ATOM 0 HG22 ILE A 33 8.071 -0.673 -0.948 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.560 -0.400 -0.011 1.00 0.00 H new ATOM 0 HD11 ILE A 33 11.066 -4.587 0.663 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.389 -4.848 0.129 1.00 0.00 H new ATOM 0 HD13 ILE A 33 10.461 -3.773 -0.799 1.00 0.00 H new ATOM 468 N VAL A 34 6.280 -3.498 2.102 1.00 0.00 N ATOM 469 CA VAL A 34 5.756 -4.595 2.907 1.00 0.00 C ATOM 470 C VAL A 34 5.598 -5.862 2.074 1.00 0.00 C ATOM 471 O VAL A 34 5.538 -5.807 0.847 1.00 0.00 O ATOM 472 CB VAL A 34 4.396 -4.232 3.533 1.00 0.00 C ATOM 473 CG1 VAL A 34 3.282 -4.374 2.507 1.00 0.00 C ATOM 474 CG2 VAL A 34 4.123 -5.099 4.753 1.00 0.00 C ATOM 0 H VAL A 34 5.849 -3.407 1.182 1.00 0.00 H new ATOM 0 HA VAL A 34 6.478 -4.776 3.704 1.00 0.00 H new ATOM 0 HB VAL A 34 4.430 -3.191 3.856 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.329 -4.114 2.967 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.474 -3.707 1.667 1.00 0.00 H new ATOM 0 HG13 VAL A 34 3.244 -5.404 2.151 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.158 -4.829 5.183 1.00 0.00 H new ATOM 0 HG22 VAL A 34 4.108 -6.148 4.458 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.907 -4.942 5.494 1.00 0.00 H new ATOM 484 N GLY A 35 5.530 -7.005 2.751 1.00 0.00 N ATOM 485 CA GLY A 35 5.379 -8.270 2.057 1.00 0.00 C ATOM 486 C GLY A 35 4.083 -8.973 2.408 1.00 0.00 C ATOM 487 O GLY A 35 4.049 -9.817 3.304 1.00 0.00 O ATOM 0 H GLY A 35 5.577 -7.077 3.767 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.415 -8.097 0.981 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.219 -8.919 2.304 1.00 0.00 H new ATOM 491 N TYR A 36 3.013 -8.624 1.702 1.00 0.00 N ATOM 492 CA TYR A 36 1.707 -9.224 1.947 1.00 0.00 C ATOM 493 C TYR A 36 1.632 -10.627 1.353 1.00 0.00 C ATOM 494 O TYR A 36 2.238 -10.910 0.320 1.00 0.00 O ATOM 495 CB TYR A 36 0.601 -8.348 1.355 1.00 0.00 C ATOM 496 CG TYR A 36 -0.016 -7.395 2.354 1.00 0.00 C ATOM 497 CD1 TYR A 36 0.503 -6.119 2.537 1.00 0.00 C ATOM 498 CD2 TYR A 36 -1.116 -7.770 3.114 1.00 0.00 C ATOM 499 CE1 TYR A 36 -0.057 -5.244 3.448 1.00 0.00 C ATOM 500 CE2 TYR A 36 -1.683 -6.901 4.027 1.00 0.00 C ATOM 501 CZ TYR A 36 -1.150 -5.640 4.190 1.00 0.00 C ATOM 502 OH TYR A 36 -1.711 -4.773 5.100 1.00 0.00 O ATOM 0 H TYR A 36 3.025 -7.929 0.956 1.00 0.00 H new ATOM 0 HA TYR A 36 1.566 -9.297 3.025 1.00 0.00 H new ATOM 0 HB2 TYR A 36 1.009 -7.775 0.523 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -0.180 -8.990 0.947 1.00 0.00 H new ATOM 0 HD1 TYR A 36 1.359 -5.806 1.957 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -1.536 -8.757 2.990 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.359 -4.256 3.578 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -2.539 -7.208 4.610 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.473 -5.206 5.538 1.00 0.00 H new ATOM 512 N VAL A 37 0.883 -11.504 2.015 1.00 0.00 N ATOM 513 CA VAL A 37 0.726 -12.878 1.553 1.00 0.00 C ATOM 514 C VAL A 37 -0.744 -13.225 1.350 1.00 0.00 C ATOM 515 O VAL A 37 -1.091 -14.019 0.477 1.00 0.00 O ATOM 516 CB VAL A 37 1.346 -13.878 2.547 1.00 0.00 C ATOM 517 CG1 VAL A 37 1.066 -15.308 2.110 1.00 0.00 C ATOM 518 CG2 VAL A 37 2.842 -13.636 2.682 1.00 0.00 C ATOM 0 H VAL A 37 0.376 -11.287 2.873 1.00 0.00 H new ATOM 0 HA VAL A 37 1.249 -12.953 0.599 1.00 0.00 H new ATOM 0 HB VAL A 37 0.887 -13.726 3.524 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.512 -16.001 2.824 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.011 -15.472 2.069 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.496 -15.478 1.123 1.00 0.00 H new ATOM 0 HG21 VAL A 37 3.264 -14.351 3.388 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.320 -13.760 1.710 1.00 0.00 H new ATOM 0 HG23 VAL A 37 3.015 -12.623 3.045 1.00 0.00 H new ATOM 528 N GLY A 38 -1.607 -12.623 2.163 1.00 0.00 N ATOM 529 CA GLY A 38 -3.031 -12.881 2.057 1.00 0.00 C ATOM 530 C GLY A 38 -3.497 -13.965 3.008 1.00 0.00 C ATOM 531 O GLY A 38 -2.831 -14.988 3.170 1.00 0.00 O ATOM 0 H GLY A 38 -1.345 -11.961 2.893 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.580 -11.962 2.262 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.269 -13.173 1.034 1.00 0.00 H new ATOM 535 N THR A 39 -4.643 -13.741 3.643 1.00 0.00 N ATOM 536 CA THR A 39 -5.196 -14.705 4.585 1.00 0.00 C ATOM 537 C THR A 39 -6.719 -14.722 4.525 1.00 0.00 C ATOM 538 O THR A 39 -7.326 -14.005 3.730 1.00 0.00 O ATOM 539 CB THR A 39 -4.755 -14.396 6.029 1.00 0.00 C ATOM 540 OG1 THR A 39 -5.166 -15.453 6.903 1.00 0.00 O ATOM 541 CG2 THR A 39 -5.345 -13.078 6.505 1.00 0.00 C ATOM 0 H THR A 39 -5.206 -12.899 3.522 1.00 0.00 H new ATOM 0 HA THR A 39 -4.813 -15.684 4.296 1.00 0.00 H new ATOM 0 HB THR A 39 -3.668 -14.315 6.044 1.00 0.00 H new ATOM 0 HG1 THR A 39 -4.963 -16.318 6.489 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.020 -12.882 7.527 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.006 -12.272 5.855 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.433 -13.135 6.475 1.00 0.00 H new ATOM 549 N SER A 40 -7.331 -15.546 5.370 1.00 0.00 N ATOM 550 CA SER A 40 -8.785 -15.658 5.410 1.00 0.00 C ATOM 551 C SER A 40 -9.331 -16.127 4.065 1.00 0.00 C ATOM 552 O SER A 40 -10.462 -15.810 3.696 1.00 0.00 O ATOM 553 CB SER A 40 -9.411 -14.314 5.787 1.00 0.00 C ATOM 554 OG SER A 40 -9.448 -14.145 7.193 1.00 0.00 O ATOM 0 H SER A 40 -6.843 -16.145 6.036 1.00 0.00 H new ATOM 0 HA SER A 40 -9.047 -16.398 6.167 1.00 0.00 H new ATOM 0 HB2 SER A 40 -8.839 -13.503 5.335 1.00 0.00 H new ATOM 0 HB3 SER A 40 -10.422 -14.254 5.384 1.00 0.00 H new ATOM 0 HG SER A 40 -9.851 -13.278 7.408 1.00 0.00 H new ATOM 560 N HIS A 41 -8.518 -16.885 3.335 1.00 0.00 N ATOM 561 CA HIS A 41 -8.918 -17.399 2.030 1.00 0.00 C ATOM 562 C HIS A 41 -9.559 -16.301 1.187 1.00 0.00 C ATOM 563 O HIS A 41 -10.527 -16.542 0.465 1.00 0.00 O ATOM 564 CB HIS A 41 -9.893 -18.565 2.195 1.00 0.00 C ATOM 565 CG HIS A 41 -11.142 -18.202 2.937 1.00 0.00 C ATOM 566 ND1 HIS A 41 -12.211 -17.461 2.562 1.00 0.00 N flip ATOM 567 CD2 HIS A 41 -11.395 -18.610 4.230 1.00 0.00 C flip ATOM 568 CE1 HIS A 41 -13.082 -17.437 3.623 1.00 0.00 C flip ATOM 569 NE2 HIS A 41 -12.567 -18.139 4.616 1.00 0.00 N flip ATOM 0 H HIS A 41 -7.579 -17.157 3.625 1.00 0.00 H new ATOM 0 HA HIS A 41 -8.024 -17.752 1.516 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -10.163 -18.944 1.209 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.390 -19.376 2.722 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -12.345 -17.005 1.659 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -10.738 -19.219 4.833 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -14.034 -16.927 3.642 1.00 0.00 H new ATOM 578 N THR A 42 -9.013 -15.092 1.283 1.00 0.00 N ATOM 579 CA THR A 42 -9.532 -13.957 0.531 1.00 0.00 C ATOM 580 C THR A 42 -8.784 -13.782 -0.786 1.00 0.00 C ATOM 581 O THR A 42 -9.387 -13.498 -1.820 1.00 0.00 O ATOM 582 CB THR A 42 -9.430 -12.652 1.343 1.00 0.00 C ATOM 583 OG1 THR A 42 -8.078 -12.442 1.767 1.00 0.00 O ATOM 584 CG2 THR A 42 -10.346 -12.697 2.556 1.00 0.00 C ATOM 0 H THR A 42 -8.211 -14.874 1.875 1.00 0.00 H new ATOM 0 HA THR A 42 -10.581 -14.167 0.325 1.00 0.00 H new ATOM 0 HB THR A 42 -9.741 -11.827 0.703 1.00 0.00 H new ATOM 0 HG1 THR A 42 -7.891 -12.999 2.551 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.257 -11.765 3.114 1.00 0.00 H new ATOM 0 HG22 THR A 42 -11.377 -12.827 2.228 1.00 0.00 H new ATOM 0 HG23 THR A 42 -10.061 -13.532 3.196 1.00 0.00 H new ATOM 592 N GLY A 43 -7.467 -13.955 -0.741 1.00 0.00 N ATOM 593 CA GLY A 43 -6.659 -13.812 -1.939 1.00 0.00 C ATOM 594 C GLY A 43 -7.032 -12.586 -2.748 1.00 0.00 C ATOM 595 O GLY A 43 -7.115 -12.646 -3.974 1.00 0.00 O ATOM 0 H GLY A 43 -6.945 -14.191 0.103 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.607 -13.752 -1.659 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -6.774 -14.701 -2.559 1.00 0.00 H new ATOM 599 N GLU A 44 -7.260 -11.471 -2.059 1.00 0.00 N ATOM 600 CA GLU A 44 -7.629 -10.227 -2.723 1.00 0.00 C ATOM 601 C GLU A 44 -6.558 -9.161 -2.515 1.00 0.00 C ATOM 602 O GLU A 44 -6.785 -7.979 -2.773 1.00 0.00 O ATOM 603 CB GLU A 44 -8.975 -9.722 -2.197 1.00 0.00 C ATOM 604 CG GLU A 44 -9.011 -9.545 -0.689 1.00 0.00 C ATOM 605 CD GLU A 44 -8.599 -8.151 -0.255 1.00 0.00 C ATOM 606 OE1 GLU A 44 -9.105 -7.173 -0.846 1.00 0.00 O ATOM 607 OE2 GLU A 44 -7.772 -8.037 0.673 1.00 0.00 O ATOM 0 H GLU A 44 -7.196 -11.405 -1.043 1.00 0.00 H new ATOM 0 HA GLU A 44 -7.716 -10.427 -3.791 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -9.207 -8.769 -2.672 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -9.756 -10.423 -2.491 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -10.018 -9.751 -0.327 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -8.349 -10.276 -0.225 1.00 0.00 H new ATOM 614 N ALA A 45 -5.389 -9.588 -2.047 1.00 0.00 N ATOM 615 CA ALA A 45 -4.282 -8.671 -1.806 1.00 0.00 C ATOM 616 C ALA A 45 -3.013 -9.430 -1.432 1.00 0.00 C ATOM 617 O ALA A 45 -2.899 -9.960 -0.327 1.00 0.00 O ATOM 618 CB ALA A 45 -4.647 -7.678 -0.712 1.00 0.00 C ATOM 0 H ALA A 45 -5.185 -10.563 -1.827 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.089 -8.123 -2.728 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.811 -7.000 -0.543 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -5.523 -7.106 -1.018 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.869 -8.217 0.209 1.00 0.00 H new ATOM 624 N SER A 46 -2.063 -9.477 -2.359 1.00 0.00 N ATOM 625 CA SER A 46 -0.803 -10.175 -2.128 1.00 0.00 C ATOM 626 C SER A 46 0.311 -9.584 -2.987 1.00 0.00 C ATOM 627 O SER A 46 0.298 -9.708 -4.211 1.00 0.00 O ATOM 628 CB SER A 46 -0.959 -11.667 -2.431 1.00 0.00 C ATOM 629 OG SER A 46 -0.930 -11.910 -3.826 1.00 0.00 O ATOM 0 H SER A 46 -2.141 -9.040 -3.277 1.00 0.00 H new ATOM 0 HA SER A 46 -0.534 -10.051 -1.079 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.159 -12.225 -1.945 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.899 -12.029 -2.015 1.00 0.00 H new ATOM 0 HG SER A 46 -0.736 -11.074 -4.300 1.00 0.00 H new ATOM 635 N GLY A 47 1.274 -8.941 -2.335 1.00 0.00 N ATOM 636 CA GLY A 47 2.383 -8.340 -3.053 1.00 0.00 C ATOM 637 C GLY A 47 3.126 -7.315 -2.221 1.00 0.00 C ATOM 638 O GLY A 47 3.138 -7.394 -0.992 1.00 0.00 O ATOM 0 H GLY A 47 1.306 -8.825 -1.322 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.076 -9.122 -3.365 1.00 0.00 H new ATOM 0 HA3 GLY A 47 2.009 -7.865 -3.960 1.00 0.00 H new ATOM 642 N ILE A 48 3.749 -6.351 -2.889 1.00 0.00 N ATOM 643 CA ILE A 48 4.498 -5.306 -2.202 1.00 0.00 C ATOM 644 C ILE A 48 3.703 -4.007 -2.144 1.00 0.00 C ATOM 645 O ILE A 48 3.279 -3.479 -3.173 1.00 0.00 O ATOM 646 CB ILE A 48 5.850 -5.037 -2.891 1.00 0.00 C ATOM 647 CG1 ILE A 48 6.687 -6.316 -2.936 1.00 0.00 C ATOM 648 CG2 ILE A 48 6.602 -3.930 -2.167 1.00 0.00 C ATOM 649 CD1 ILE A 48 7.010 -6.877 -1.569 1.00 0.00 C ATOM 0 H ILE A 48 3.750 -6.272 -3.906 1.00 0.00 H new ATOM 0 HA ILE A 48 4.680 -5.663 -1.188 1.00 0.00 H new ATOM 0 HB ILE A 48 5.662 -4.712 -3.914 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.151 -7.071 -3.512 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.618 -6.113 -3.465 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.555 -3.751 -2.665 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.008 -3.016 -2.182 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.783 -4.228 -1.134 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.606 -7.783 -1.679 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.573 -6.140 -0.997 1.00 0.00 H new ATOM 0 HD13 ILE A 48 6.084 -7.113 -1.044 1.00 0.00 H new ATOM 661 N TYR A 49 3.505 -3.494 -0.934 1.00 0.00 N ATOM 662 CA TYR A 49 2.760 -2.256 -0.741 1.00 0.00 C ATOM 663 C TYR A 49 3.534 -1.287 0.147 1.00 0.00 C ATOM 664 O TYR A 49 4.242 -1.699 1.066 1.00 0.00 O ATOM 665 CB TYR A 49 1.392 -2.551 -0.123 1.00 0.00 C ATOM 666 CG TYR A 49 0.514 -3.429 -0.986 1.00 0.00 C ATOM 667 CD1 TYR A 49 0.676 -4.809 -0.997 1.00 0.00 C ATOM 668 CD2 TYR A 49 -0.476 -2.879 -1.790 1.00 0.00 C ATOM 669 CE1 TYR A 49 -0.123 -5.615 -1.784 1.00 0.00 C ATOM 670 CE2 TYR A 49 -1.281 -3.678 -2.579 1.00 0.00 C ATOM 671 CZ TYR A 49 -1.100 -5.045 -2.573 1.00 0.00 C ATOM 672 OH TYR A 49 -1.899 -5.844 -3.359 1.00 0.00 O ATOM 0 H TYR A 49 3.850 -3.917 -0.072 1.00 0.00 H new ATOM 0 HA TYR A 49 2.618 -1.791 -1.717 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.536 -3.034 0.844 1.00 0.00 H new ATOM 0 HB3 TYR A 49 0.877 -1.609 0.065 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.440 -5.259 -0.380 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.619 -1.809 -1.799 1.00 0.00 H new ATOM 0 HE1 TYR A 49 0.017 -6.686 -1.782 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.048 -3.234 -3.197 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.536 -5.286 -3.851 1.00 0.00 H new ATOM 682 N VAL A 50 3.393 0.004 -0.133 1.00 0.00 N ATOM 683 CA VAL A 50 4.077 1.034 0.640 1.00 0.00 C ATOM 684 C VAL A 50 3.554 1.084 2.071 1.00 0.00 C ATOM 685 O VAL A 50 2.464 1.595 2.329 1.00 0.00 O ATOM 686 CB VAL A 50 3.911 2.423 -0.004 1.00 0.00 C ATOM 687 CG1 VAL A 50 4.429 3.509 0.927 1.00 0.00 C ATOM 688 CG2 VAL A 50 4.624 2.476 -1.347 1.00 0.00 C ATOM 0 H VAL A 50 2.811 0.362 -0.890 1.00 0.00 H new ATOM 0 HA VAL A 50 5.135 0.771 0.651 1.00 0.00 H new ATOM 0 HB VAL A 50 2.849 2.600 -0.175 1.00 0.00 H new ATOM 0 HG11 VAL A 50 4.303 4.483 0.455 1.00 0.00 H new ATOM 0 HG12 VAL A 50 3.869 3.484 1.862 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.486 3.339 1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 50 4.496 3.465 -1.788 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.686 2.277 -1.203 1.00 0.00 H new ATOM 0 HG23 VAL A 50 4.201 1.724 -2.013 1.00 0.00 H new ATOM 698 N LYS A 51 4.339 0.550 3.001 1.00 0.00 N ATOM 699 CA LYS A 51 3.958 0.535 4.408 1.00 0.00 C ATOM 700 C LYS A 51 3.943 1.947 4.983 1.00 0.00 C ATOM 701 O LYS A 51 3.077 2.290 5.789 1.00 0.00 O ATOM 702 CB LYS A 51 4.922 -0.343 5.209 1.00 0.00 C ATOM 703 CG LYS A 51 4.570 -0.445 6.683 1.00 0.00 C ATOM 704 CD LYS A 51 3.366 -1.344 6.908 1.00 0.00 C ATOM 705 CE LYS A 51 3.205 -1.703 8.377 1.00 0.00 C ATOM 706 NZ LYS A 51 2.470 -0.649 9.129 1.00 0.00 N ATOM 0 H LYS A 51 5.244 0.122 2.805 1.00 0.00 H new ATOM 0 HA LYS A 51 2.952 0.121 4.482 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.933 -1.344 4.777 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.931 0.058 5.112 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.425 -0.835 7.236 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.362 0.549 7.078 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.465 -0.843 6.554 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.476 -2.255 6.320 1.00 0.00 H new ATOM 0 HE2 LYS A 51 2.671 -2.649 8.463 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.188 -1.850 8.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.381 -0.932 10.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 2.992 0.248 9.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.522 -0.526 8.718 1.00 0.00 H new ATOM 720 N SER A 52 4.904 2.763 4.564 1.00 0.00 N ATOM 721 CA SER A 52 5.002 4.138 5.039 1.00 0.00 C ATOM 722 C SER A 52 5.944 4.952 4.157 1.00 0.00 C ATOM 723 O SER A 52 6.563 4.422 3.234 1.00 0.00 O ATOM 724 CB SER A 52 5.492 4.165 6.488 1.00 0.00 C ATOM 725 OG SER A 52 4.411 4.037 7.395 1.00 0.00 O ATOM 0 H SER A 52 5.627 2.496 3.896 1.00 0.00 H new ATOM 0 HA SER A 52 4.009 4.585 4.990 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.204 3.356 6.649 1.00 0.00 H new ATOM 0 HB3 SER A 52 6.022 5.098 6.679 1.00 0.00 H new ATOM 0 HG SER A 52 3.753 3.407 7.033 1.00 0.00 H new ATOM 731 N VAL A 53 6.046 6.245 4.447 1.00 0.00 N ATOM 732 CA VAL A 53 6.912 7.134 3.681 1.00 0.00 C ATOM 733 C VAL A 53 7.566 8.175 4.583 1.00 0.00 C ATOM 734 O VAL A 53 6.889 9.033 5.150 1.00 0.00 O ATOM 735 CB VAL A 53 6.131 7.855 2.566 1.00 0.00 C ATOM 736 CG1 VAL A 53 7.035 8.830 1.826 1.00 0.00 C ATOM 737 CG2 VAL A 53 5.521 6.846 1.606 1.00 0.00 C ATOM 0 H VAL A 53 5.540 6.700 5.207 1.00 0.00 H new ATOM 0 HA VAL A 53 7.684 6.512 3.229 1.00 0.00 H new ATOM 0 HB VAL A 53 5.321 8.423 3.022 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.466 9.330 1.042 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.419 9.572 2.525 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.868 8.287 1.380 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.973 7.372 0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.313 6.249 1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.839 6.192 2.150 1.00 0.00 H new ATOM 747 N ILE A 54 8.886 8.093 4.712 1.00 0.00 N ATOM 748 CA ILE A 54 9.632 9.029 5.544 1.00 0.00 C ATOM 749 C ILE A 54 9.408 10.467 5.089 1.00 0.00 C ATOM 750 O ILE A 54 9.490 10.790 3.904 1.00 0.00 O ATOM 751 CB ILE A 54 11.141 8.724 5.520 1.00 0.00 C ATOM 752 CG1 ILE A 54 11.409 7.322 6.071 1.00 0.00 C ATOM 753 CG2 ILE A 54 11.905 9.768 6.321 1.00 0.00 C ATOM 754 CD1 ILE A 54 11.182 6.221 5.058 1.00 0.00 C ATOM 0 H ILE A 54 9.461 7.388 4.251 1.00 0.00 H new ATOM 0 HA ILE A 54 9.262 8.911 6.562 1.00 0.00 H new ATOM 0 HB ILE A 54 11.488 8.761 4.487 1.00 0.00 H new ATOM 0 HG12 ILE A 54 12.438 7.271 6.427 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.765 7.150 6.933 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.970 9.539 6.295 1.00 0.00 H new ATOM 0 HG22 ILE A 54 11.735 10.754 5.889 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.558 9.760 7.354 1.00 0.00 H new ATOM 0 HD11 ILE A 54 11.391 5.255 5.518 1.00 0.00 H new ATOM 0 HD12 ILE A 54 10.146 6.246 4.720 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.845 6.368 4.206 1.00 0.00 H new ATOM 766 N PRO A 55 9.120 11.354 6.054 1.00 0.00 N ATOM 767 CA PRO A 55 8.881 12.774 5.777 1.00 0.00 C ATOM 768 C PRO A 55 10.150 13.503 5.349 1.00 0.00 C ATOM 769 O PRO A 55 11.260 13.060 5.641 1.00 0.00 O ATOM 770 CB PRO A 55 8.379 13.317 7.118 1.00 0.00 C ATOM 771 CG PRO A 55 8.952 12.394 8.138 1.00 0.00 C ATOM 772 CD PRO A 55 9.007 11.040 7.488 1.00 0.00 C ATOM 0 HA PRO A 55 8.180 12.916 4.954 1.00 0.00 H new ATOM 0 HB2 PRO A 55 8.712 14.342 7.280 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.290 13.326 7.159 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.946 12.720 8.445 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.333 12.371 9.035 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.859 10.459 7.841 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.113 10.455 7.702 1.00 0.00 H new ATOM 780 N GLY A 56 9.978 14.624 4.656 1.00 0.00 N ATOM 781 CA GLY A 56 11.119 15.397 4.199 1.00 0.00 C ATOM 782 C GLY A 56 12.043 14.593 3.306 1.00 0.00 C ATOM 783 O GLY A 56 13.255 14.809 3.300 1.00 0.00 O ATOM 0 H GLY A 56 9.069 15.011 4.403 1.00 0.00 H new ATOM 0 HA2 GLY A 56 10.766 16.274 3.656 1.00 0.00 H new ATOM 0 HA3 GLY A 56 11.677 15.760 5.062 1.00 0.00 H new ATOM 787 N SER A 57 11.470 13.663 2.549 1.00 0.00 N ATOM 788 CA SER A 57 12.252 12.820 1.651 1.00 0.00 C ATOM 789 C SER A 57 11.818 13.021 0.202 1.00 0.00 C ATOM 790 O SER A 57 10.965 13.858 -0.091 1.00 0.00 O ATOM 791 CB SER A 57 12.103 11.348 2.040 1.00 0.00 C ATOM 792 OG SER A 57 10.860 10.828 1.601 1.00 0.00 O ATOM 0 H SER A 57 10.468 13.474 2.539 1.00 0.00 H new ATOM 0 HA SER A 57 13.299 13.108 1.742 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.917 10.769 1.604 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.182 11.245 3.122 1.00 0.00 H new ATOM 0 HG SER A 57 10.292 10.638 2.377 1.00 0.00 H new ATOM 798 N ALA A 58 12.412 12.247 -0.699 1.00 0.00 N ATOM 799 CA ALA A 58 12.086 12.337 -2.117 1.00 0.00 C ATOM 800 C ALA A 58 10.665 11.855 -2.386 1.00 0.00 C ATOM 801 O ALA A 58 9.869 12.557 -3.009 1.00 0.00 O ATOM 802 CB ALA A 58 13.083 11.534 -2.940 1.00 0.00 C ATOM 0 H ALA A 58 13.122 11.550 -0.473 1.00 0.00 H new ATOM 0 HA ALA A 58 12.148 13.384 -2.412 1.00 0.00 H new ATOM 0 HB1 ALA A 58 12.827 11.610 -3.997 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.087 11.927 -2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.050 10.489 -2.633 1.00 0.00 H new ATOM 808 N ALA A 59 10.354 10.652 -1.914 1.00 0.00 N ATOM 809 CA ALA A 59 9.028 10.077 -2.102 1.00 0.00 C ATOM 810 C ALA A 59 7.948 10.984 -1.523 1.00 0.00 C ATOM 811 O ALA A 59 6.932 11.246 -2.167 1.00 0.00 O ATOM 812 CB ALA A 59 8.957 8.696 -1.467 1.00 0.00 C ATOM 0 H ALA A 59 11.003 10.057 -1.399 1.00 0.00 H new ATOM 0 HA ALA A 59 8.849 9.982 -3.173 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.961 8.278 -1.615 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.697 8.044 -1.931 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.162 8.775 -0.399 1.00 0.00 H new ATOM 818 N TYR A 60 8.175 11.461 -0.303 1.00 0.00 N ATOM 819 CA TYR A 60 7.219 12.337 0.364 1.00 0.00 C ATOM 820 C TYR A 60 7.054 13.647 -0.400 1.00 0.00 C ATOM 821 O TYR A 60 5.945 14.022 -0.782 1.00 0.00 O ATOM 822 CB TYR A 60 7.672 12.623 1.797 1.00 0.00 C ATOM 823 CG TYR A 60 6.699 13.473 2.581 1.00 0.00 C ATOM 824 CD1 TYR A 60 5.587 12.907 3.193 1.00 0.00 C ATOM 825 CD2 TYR A 60 6.892 14.843 2.712 1.00 0.00 C ATOM 826 CE1 TYR A 60 4.695 13.681 3.910 1.00 0.00 C ATOM 827 CE2 TYR A 60 6.005 15.624 3.428 1.00 0.00 C ATOM 828 CZ TYR A 60 4.909 15.038 4.025 1.00 0.00 C ATOM 829 OH TYR A 60 4.023 15.812 4.740 1.00 0.00 O ATOM 0 H TYR A 60 9.012 11.256 0.243 1.00 0.00 H new ATOM 0 HA TYR A 60 6.255 11.829 0.389 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.817 11.677 2.319 1.00 0.00 H new ATOM 0 HB3 TYR A 60 8.640 13.124 1.770 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.417 11.844 3.107 1.00 0.00 H new ATOM 0 HD2 TYR A 60 7.750 15.305 2.246 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.835 13.225 4.378 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.169 16.688 3.519 1.00 0.00 H new ATOM 0 HH TYR A 60 4.319 16.746 4.725 1.00 0.00 H new ATOM 839 N HIS A 61 8.167 14.340 -0.621 1.00 0.00 N ATOM 840 CA HIS A 61 8.148 15.608 -1.341 1.00 0.00 C ATOM 841 C HIS A 61 7.383 15.475 -2.655 1.00 0.00 C ATOM 842 O HIS A 61 6.429 16.210 -2.905 1.00 0.00 O ATOM 843 CB HIS A 61 9.575 16.085 -1.614 1.00 0.00 C ATOM 844 CG HIS A 61 10.207 16.780 -0.448 1.00 0.00 C ATOM 845 ND1 HIS A 61 9.545 17.714 0.320 1.00 0.00 N ATOM 846 CD2 HIS A 61 11.449 16.672 0.080 1.00 0.00 C ATOM 847 CE1 HIS A 61 10.353 18.152 1.270 1.00 0.00 C ATOM 848 NE2 HIS A 61 11.514 17.535 1.147 1.00 0.00 N ATOM 0 H HIS A 61 9.093 14.045 -0.312 1.00 0.00 H new ATOM 0 HA HIS A 61 7.640 16.344 -0.718 1.00 0.00 H new ATOM 0 HB2 HIS A 61 10.189 15.228 -1.892 1.00 0.00 H new ATOM 0 HB3 HIS A 61 9.566 16.762 -2.469 1.00 0.00 H new ATOM 0 HD2 HIS A 61 12.241 16.028 -0.272 1.00 0.00 H new ATOM 0 HE1 HIS A 61 10.106 18.889 2.019 1.00 0.00 H new ATOM 0 HE2 HIS A 61 12.327 17.676 1.747 1.00 0.00 H new ATOM 857 N ASN A 62 7.810 14.534 -3.490 1.00 0.00 N ATOM 858 CA ASN A 62 7.166 14.306 -4.779 1.00 0.00 C ATOM 859 C ASN A 62 5.650 14.233 -4.624 1.00 0.00 C ATOM 860 O ASN A 62 4.908 14.856 -5.382 1.00 0.00 O ATOM 861 CB ASN A 62 7.688 13.015 -5.412 1.00 0.00 C ATOM 862 CG ASN A 62 7.676 13.068 -6.928 1.00 0.00 C ATOM 863 OD1 ASN A 62 7.221 11.990 -7.554 1.00 0.00 O flip ATOM 864 ND2 ASN A 62 8.071 14.068 -7.528 1.00 0.00 N flip ATOM 0 H ASN A 62 8.599 13.917 -3.298 1.00 0.00 H new ATOM 0 HA ASN A 62 7.407 15.146 -5.431 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.705 12.829 -5.066 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.078 12.176 -5.076 1.00 0.00 H new ATOM 0 HD21 ASN A 62 8.413 14.875 -7.005 1.00 0.00 H new ATOM 0 HD22 ASN A 62 8.057 14.090 -8.548 1.00 0.00 H new ATOM 871 N GLY A 63 5.198 13.468 -3.635 1.00 0.00 N ATOM 872 CA GLY A 63 3.773 13.328 -3.398 1.00 0.00 C ATOM 873 C GLY A 63 3.102 12.426 -4.414 1.00 0.00 C ATOM 874 O GLY A 63 1.951 12.650 -4.791 1.00 0.00 O ATOM 0 H GLY A 63 5.793 12.943 -2.994 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.612 12.926 -2.398 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.305 14.312 -3.425 1.00 0.00 H new ATOM 878 N HIS A 64 3.823 11.402 -4.861 1.00 0.00 N ATOM 879 CA HIS A 64 3.290 10.462 -5.841 1.00 0.00 C ATOM 880 C HIS A 64 3.348 9.033 -5.311 1.00 0.00 C ATOM 881 O HIS A 64 2.496 8.205 -5.636 1.00 0.00 O ATOM 882 CB HIS A 64 4.070 10.565 -7.153 1.00 0.00 C ATOM 883 CG HIS A 64 3.734 11.784 -7.955 1.00 0.00 C ATOM 884 ND1 HIS A 64 4.252 13.034 -7.925 1.00 0.00 N flip ATOM 885 CD2 HIS A 64 2.755 11.799 -8.927 1.00 0.00 C flip ATOM 886 CE1 HIS A 64 3.585 13.774 -8.870 1.00 0.00 C flip ATOM 887 NE2 HIS A 64 2.687 13.006 -9.461 1.00 0.00 N flip ATOM 0 H HIS A 64 4.777 11.202 -4.560 1.00 0.00 H new ATOM 0 HA HIS A 64 2.247 10.719 -6.026 1.00 0.00 H new ATOM 0 HB2 HIS A 64 5.137 10.568 -6.932 1.00 0.00 H new ATOM 0 HB3 HIS A 64 3.872 9.678 -7.755 1.00 0.00 H new ATOM 0 HD2 HIS A 64 2.140 10.956 -9.208 1.00 0.00 H new ATOM 0 HE1 HIS A 64 3.765 14.815 -9.094 1.00 0.00 H new ATOM 0 HE2 HIS A 64 2.050 13.295 -10.203 1.00 0.00 H new ATOM 896 N ILE A 65 4.358 8.750 -4.495 1.00 0.00 N ATOM 897 CA ILE A 65 4.526 7.421 -3.921 1.00 0.00 C ATOM 898 C ILE A 65 4.289 7.439 -2.415 1.00 0.00 C ATOM 899 O ILE A 65 5.154 7.858 -1.646 1.00 0.00 O ATOM 900 CB ILE A 65 5.933 6.861 -4.201 1.00 0.00 C ATOM 901 CG1 ILE A 65 6.190 6.796 -5.708 1.00 0.00 C ATOM 902 CG2 ILE A 65 6.090 5.484 -3.572 1.00 0.00 C ATOM 903 CD1 ILE A 65 7.651 6.921 -6.078 1.00 0.00 C ATOM 0 H ILE A 65 5.072 9.423 -4.217 1.00 0.00 H new ATOM 0 HA ILE A 65 3.786 6.776 -4.395 1.00 0.00 H new ATOM 0 HB ILE A 65 6.669 7.530 -3.754 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.806 5.852 -6.093 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.630 7.592 -6.198 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.090 5.101 -3.779 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.945 5.558 -2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 65 5.348 4.805 -3.992 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.758 6.866 -7.161 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.036 7.877 -5.723 1.00 0.00 H new ATOM 0 HD13 ILE A 65 8.214 6.110 -5.617 1.00 0.00 H new ATOM 915 N GLN A 66 3.112 6.981 -2.001 1.00 0.00 N ATOM 916 CA GLN A 66 2.762 6.943 -0.586 1.00 0.00 C ATOM 917 C GLN A 66 1.995 5.669 -0.249 1.00 0.00 C ATOM 918 O GLN A 66 1.680 4.870 -1.131 1.00 0.00 O ATOM 919 CB GLN A 66 1.926 8.169 -0.214 1.00 0.00 C ATOM 920 CG GLN A 66 0.900 8.550 -1.269 1.00 0.00 C ATOM 921 CD GLN A 66 1.465 9.482 -2.323 1.00 0.00 C ATOM 922 OE1 GLN A 66 2.321 10.319 -2.033 1.00 0.00 O ATOM 923 NE2 GLN A 66 0.988 9.342 -3.554 1.00 0.00 N ATOM 0 H GLN A 66 2.385 6.631 -2.625 1.00 0.00 H new ATOM 0 HA GLN A 66 3.686 6.952 -0.008 1.00 0.00 H new ATOM 0 HB2 GLN A 66 1.412 7.975 0.727 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.592 9.015 -0.045 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.527 7.646 -1.751 1.00 0.00 H new ATOM 0 HG3 GLN A 66 0.048 9.028 -0.786 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.279 8.635 -3.749 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.330 9.941 -4.305 1.00 0.00 H new ATOM 932 N VAL A 67 1.699 5.484 1.034 1.00 0.00 N ATOM 933 CA VAL A 67 0.969 4.307 1.488 1.00 0.00 C ATOM 934 C VAL A 67 -0.183 3.977 0.546 1.00 0.00 C ATOM 935 O VAL A 67 -0.579 4.800 -0.279 1.00 0.00 O ATOM 936 CB VAL A 67 0.413 4.506 2.911 1.00 0.00 C ATOM 937 CG1 VAL A 67 1.546 4.728 3.901 1.00 0.00 C ATOM 938 CG2 VAL A 67 -0.568 5.667 2.941 1.00 0.00 C ATOM 0 H VAL A 67 1.954 6.135 1.777 1.00 0.00 H new ATOM 0 HA VAL A 67 1.677 3.479 1.495 1.00 0.00 H new ATOM 0 HB VAL A 67 -0.121 3.602 3.204 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.134 4.867 4.901 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.207 3.861 3.898 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.110 5.616 3.615 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.951 5.794 3.954 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.061 6.580 2.628 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.396 5.461 2.263 1.00 0.00 H new ATOM 948 N ASN A 68 -0.717 2.767 0.674 1.00 0.00 N ATOM 949 CA ASN A 68 -1.825 2.327 -0.167 1.00 0.00 C ATOM 950 C ASN A 68 -1.427 2.337 -1.639 1.00 0.00 C ATOM 951 O ASN A 68 -2.172 2.820 -2.491 1.00 0.00 O ATOM 952 CB ASN A 68 -3.044 3.226 0.049 1.00 0.00 C ATOM 953 CG ASN A 68 -3.906 2.761 1.207 1.00 0.00 C ATOM 954 OD1 ASN A 68 -4.335 1.608 1.253 1.00 0.00 O ATOM 955 ND2 ASN A 68 -4.165 3.660 2.150 1.00 0.00 N ATOM 0 H ASN A 68 -0.401 2.073 1.352 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.080 1.306 0.115 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.711 4.247 0.234 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.643 3.246 -0.861 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.740 3.406 2.953 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.789 4.605 2.071 1.00 0.00 H new ATOM 962 N ASP A 69 -0.247 1.799 -1.931 1.00 0.00 N ATOM 963 CA ASP A 69 0.250 1.744 -3.301 1.00 0.00 C ATOM 964 C ASP A 69 0.910 0.398 -3.586 1.00 0.00 C ATOM 965 O ASP A 69 1.678 -0.113 -2.771 1.00 0.00 O ATOM 966 CB ASP A 69 1.246 2.877 -3.551 1.00 0.00 C ATOM 967 CG ASP A 69 0.564 4.166 -3.968 1.00 0.00 C ATOM 968 OD1 ASP A 69 0.192 4.956 -3.075 1.00 0.00 O ATOM 969 OD2 ASP A 69 0.403 4.384 -5.187 1.00 0.00 O ATOM 0 H ASP A 69 0.382 1.395 -1.237 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.599 1.862 -3.974 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.827 3.053 -2.645 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.949 2.574 -4.327 1.00 0.00 H new ATOM 974 N LYS A 70 0.604 -0.171 -4.746 1.00 0.00 N ATOM 975 CA LYS A 70 1.166 -1.457 -5.140 1.00 0.00 C ATOM 976 C LYS A 70 2.286 -1.273 -6.159 1.00 0.00 C ATOM 977 O LYS A 70 2.049 -0.824 -7.281 1.00 0.00 O ATOM 978 CB LYS A 70 0.075 -2.358 -5.724 1.00 0.00 C ATOM 979 CG LYS A 70 0.328 -3.839 -5.505 1.00 0.00 C ATOM 980 CD LYS A 70 -0.379 -4.686 -6.551 1.00 0.00 C ATOM 981 CE LYS A 70 0.504 -4.925 -7.765 1.00 0.00 C ATOM 982 NZ LYS A 70 -0.293 -5.294 -8.967 1.00 0.00 N ATOM 0 H LYS A 70 -0.031 0.239 -5.431 1.00 0.00 H new ATOM 0 HA LYS A 70 1.582 -1.930 -4.250 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.883 -2.092 -5.277 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -0.009 -2.167 -6.794 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.400 -4.035 -5.540 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.016 -4.125 -4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.664 -5.643 -6.114 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.299 -4.190 -6.861 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.083 -4.026 -7.975 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.217 -5.719 -7.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.346 -5.449 -9.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.826 -6.166 -8.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.956 -4.525 -9.193 1.00 0.00 H new ATOM 996 N ILE A 71 3.505 -1.622 -5.762 1.00 0.00 N ATOM 997 CA ILE A 71 4.660 -1.496 -6.642 1.00 0.00 C ATOM 998 C ILE A 71 4.822 -2.735 -7.517 1.00 0.00 C ATOM 999 O ILE A 71 4.916 -3.855 -7.015 1.00 0.00 O ATOM 1000 CB ILE A 71 5.957 -1.275 -5.841 1.00 0.00 C ATOM 1001 CG1 ILE A 71 5.831 -0.032 -4.959 1.00 0.00 C ATOM 1002 CG2 ILE A 71 7.145 -1.145 -6.783 1.00 0.00 C ATOM 1003 CD1 ILE A 71 5.174 -0.302 -3.623 1.00 0.00 C ATOM 0 H ILE A 71 3.718 -1.994 -4.837 1.00 0.00 H new ATOM 0 HA ILE A 71 4.481 -0.627 -7.275 1.00 0.00 H new ATOM 0 HB ILE A 71 6.122 -2.139 -5.197 1.00 0.00 H new ATOM 0 HG12 ILE A 71 6.824 0.385 -4.789 1.00 0.00 H new ATOM 0 HG13 ILE A 71 5.255 0.724 -5.492 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.054 -0.989 -6.202 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.243 -2.056 -7.373 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.990 -0.296 -7.449 1.00 0.00 H new ATOM 0 HD11 ILE A 71 5.118 0.624 -3.051 1.00 0.00 H new ATOM 0 HD12 ILE A 71 4.168 -0.690 -3.784 1.00 0.00 H new ATOM 0 HD13 ILE A 71 5.762 -1.035 -3.070 1.00 0.00 H new ATOM 1015 N VAL A 72 4.854 -2.525 -8.830 1.00 0.00 N ATOM 1016 CA VAL A 72 5.007 -3.624 -9.776 1.00 0.00 C ATOM 1017 C VAL A 72 6.418 -3.661 -10.352 1.00 0.00 C ATOM 1018 O VAL A 72 6.878 -4.698 -10.829 1.00 0.00 O ATOM 1019 CB VAL A 72 3.995 -3.514 -10.932 1.00 0.00 C ATOM 1020 CG1 VAL A 72 2.608 -3.934 -10.469 1.00 0.00 C ATOM 1021 CG2 VAL A 72 3.975 -2.099 -11.489 1.00 0.00 C ATOM 0 H VAL A 72 4.776 -1.604 -9.262 1.00 0.00 H new ATOM 0 HA VAL A 72 4.819 -4.545 -9.224 1.00 0.00 H new ATOM 0 HB VAL A 72 4.305 -4.189 -11.730 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.906 -3.850 -11.299 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.637 -4.967 -10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.285 -3.287 -9.654 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.255 -2.039 -12.305 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.690 -1.402 -10.701 1.00 0.00 H new ATOM 0 HG23 VAL A 72 4.966 -1.840 -11.861 1.00 0.00 H new ATOM 1031 N ALA A 73 7.101 -2.522 -10.303 1.00 0.00 N ATOM 1032 CA ALA A 73 8.461 -2.424 -10.817 1.00 0.00 C ATOM 1033 C ALA A 73 9.197 -1.238 -10.202 1.00 0.00 C ATOM 1034 O ALA A 73 8.582 -0.239 -9.828 1.00 0.00 O ATOM 1035 CB ALA A 73 8.445 -2.307 -12.334 1.00 0.00 C ATOM 0 H ALA A 73 6.734 -1.654 -9.912 1.00 0.00 H new ATOM 0 HA ALA A 73 8.994 -3.333 -10.539 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.468 -2.235 -12.704 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.966 -3.188 -12.762 1.00 0.00 H new ATOM 0 HB3 ALA A 73 7.890 -1.415 -12.624 1.00 0.00 H new ATOM 1041 N VAL A 74 10.517 -1.355 -10.100 1.00 0.00 N ATOM 1042 CA VAL A 74 11.337 -0.293 -9.530 1.00 0.00 C ATOM 1043 C VAL A 74 12.537 0.013 -10.420 1.00 0.00 C ATOM 1044 O VAL A 74 13.375 -0.854 -10.668 1.00 0.00 O ATOM 1045 CB VAL A 74 11.838 -0.664 -8.121 1.00 0.00 C ATOM 1046 CG1 VAL A 74 12.758 0.418 -7.579 1.00 0.00 C ATOM 1047 CG2 VAL A 74 10.663 -0.896 -7.183 1.00 0.00 C ATOM 0 H VAL A 74 11.041 -2.175 -10.405 1.00 0.00 H new ATOM 0 HA VAL A 74 10.704 0.592 -9.461 1.00 0.00 H new ATOM 0 HB VAL A 74 12.408 -1.591 -8.189 1.00 0.00 H new ATOM 0 HG11 VAL A 74 13.102 0.138 -6.583 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.617 0.531 -8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 74 12.216 1.362 -7.524 1.00 0.00 H new ATOM 0 HG21 VAL A 74 11.035 -1.157 -6.192 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.064 0.013 -7.118 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.047 -1.710 -7.566 1.00 0.00 H new ATOM 1057 N ASP A 75 12.613 1.251 -10.896 1.00 0.00 N ATOM 1058 CA ASP A 75 13.711 1.672 -11.757 1.00 0.00 C ATOM 1059 C ASP A 75 13.756 0.833 -13.030 1.00 0.00 C ATOM 1060 O ASP A 75 14.830 0.518 -13.540 1.00 0.00 O ATOM 1061 CB ASP A 75 15.043 1.563 -11.012 1.00 0.00 C ATOM 1062 CG ASP A 75 15.400 2.838 -10.274 1.00 0.00 C ATOM 1063 OD1 ASP A 75 14.836 3.070 -9.184 1.00 0.00 O ATOM 1064 OD2 ASP A 75 16.242 3.605 -10.787 1.00 0.00 O ATOM 0 H ASP A 75 11.927 1.980 -10.700 1.00 0.00 H new ATOM 0 HA ASP A 75 13.543 2.713 -12.035 1.00 0.00 H new ATOM 0 HB2 ASP A 75 14.992 0.738 -10.302 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.835 1.324 -11.722 1.00 0.00 H new ATOM 1069 N GLY A 76 12.581 0.474 -13.538 1.00 0.00 N ATOM 1070 CA GLY A 76 12.509 -0.326 -14.747 1.00 0.00 C ATOM 1071 C GLY A 76 12.812 -1.789 -14.493 1.00 0.00 C ATOM 1072 O GLY A 76 13.270 -2.500 -15.387 1.00 0.00 O ATOM 0 H GLY A 76 11.678 0.723 -13.134 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.513 -0.234 -15.181 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.214 0.066 -15.481 1.00 0.00 H new ATOM 1076 N VAL A 77 12.557 -2.240 -13.268 1.00 0.00 N ATOM 1077 CA VAL A 77 12.806 -3.629 -12.898 1.00 0.00 C ATOM 1078 C VAL A 77 11.546 -4.285 -12.347 1.00 0.00 C ATOM 1079 O VAL A 77 11.007 -3.858 -11.327 1.00 0.00 O ATOM 1080 CB VAL A 77 13.929 -3.737 -11.849 1.00 0.00 C ATOM 1081 CG1 VAL A 77 14.095 -5.178 -11.391 1.00 0.00 C ATOM 1082 CG2 VAL A 77 15.235 -3.193 -12.409 1.00 0.00 C ATOM 0 H VAL A 77 12.179 -1.664 -12.516 1.00 0.00 H new ATOM 0 HA VAL A 77 13.115 -4.148 -13.805 1.00 0.00 H new ATOM 0 HB VAL A 77 13.653 -3.135 -10.983 1.00 0.00 H new ATOM 0 HG11 VAL A 77 14.893 -5.235 -10.650 1.00 0.00 H new ATOM 0 HG12 VAL A 77 13.163 -5.529 -10.948 1.00 0.00 H new ATOM 0 HG13 VAL A 77 14.349 -5.805 -12.246 1.00 0.00 H new ATOM 0 HG21 VAL A 77 16.017 -3.277 -11.655 1.00 0.00 H new ATOM 0 HG22 VAL A 77 15.519 -3.766 -13.292 1.00 0.00 H new ATOM 0 HG23 VAL A 77 15.106 -2.146 -12.682 1.00 0.00 H new ATOM 1092 N ASN A 78 11.081 -5.327 -13.029 1.00 0.00 N ATOM 1093 CA ASN A 78 9.883 -6.044 -12.607 1.00 0.00 C ATOM 1094 C ASN A 78 10.116 -6.759 -11.279 1.00 0.00 C ATOM 1095 O ASN A 78 10.645 -7.870 -11.246 1.00 0.00 O ATOM 1096 CB ASN A 78 9.465 -7.054 -13.677 1.00 0.00 C ATOM 1097 CG ASN A 78 8.132 -7.707 -13.366 1.00 0.00 C ATOM 1098 OD1 ASN A 78 8.079 -8.796 -12.794 1.00 0.00 O ATOM 1099 ND2 ASN A 78 7.046 -7.043 -13.744 1.00 0.00 N ATOM 0 H ASN A 78 11.515 -5.694 -13.876 1.00 0.00 H new ATOM 0 HA ASN A 78 9.083 -5.316 -12.471 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.404 -6.552 -14.643 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.232 -7.824 -13.766 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.121 -7.433 -13.563 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.137 -6.143 -14.215 1.00 0.00 H new ATOM 1106 N ILE A 79 9.716 -6.114 -10.188 1.00 0.00 N ATOM 1107 CA ILE A 79 9.880 -6.689 -8.859 1.00 0.00 C ATOM 1108 C ILE A 79 8.636 -7.465 -8.439 1.00 0.00 C ATOM 1109 O ILE A 79 8.435 -7.739 -7.256 1.00 0.00 O ATOM 1110 CB ILE A 79 10.173 -5.603 -7.808 1.00 0.00 C ATOM 1111 CG1 ILE A 79 8.952 -4.700 -7.621 1.00 0.00 C ATOM 1112 CG2 ILE A 79 11.387 -4.782 -8.219 1.00 0.00 C ATOM 1113 CD1 ILE A 79 8.830 -4.130 -6.225 1.00 0.00 C ATOM 0 H ILE A 79 9.276 -5.194 -10.199 1.00 0.00 H new ATOM 0 HA ILE A 79 10.730 -7.370 -8.912 1.00 0.00 H new ATOM 0 HB ILE A 79 10.391 -6.089 -6.857 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.004 -3.879 -8.336 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.051 -5.268 -7.853 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.582 -4.018 -7.466 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.255 -5.435 -8.306 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.195 -4.304 -9.179 1.00 0.00 H new ATOM 0 HD11 ILE A 79 7.942 -3.500 -6.165 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.746 -4.944 -5.506 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.714 -3.534 -5.997 1.00 0.00 H new ATOM 1125 N GLN A 80 7.806 -7.816 -9.416 1.00 0.00 N ATOM 1126 CA GLN A 80 6.582 -8.561 -9.147 1.00 0.00 C ATOM 1127 C GLN A 80 6.893 -9.896 -8.477 1.00 0.00 C ATOM 1128 O GLN A 80 7.150 -10.894 -9.150 1.00 0.00 O ATOM 1129 CB GLN A 80 5.807 -8.796 -10.444 1.00 0.00 C ATOM 1130 CG GLN A 80 5.023 -7.582 -10.913 1.00 0.00 C ATOM 1131 CD GLN A 80 3.775 -7.956 -11.688 1.00 0.00 C ATOM 1132 OE1 GLN A 80 3.111 -8.945 -11.377 1.00 0.00 O ATOM 1133 NE2 GLN A 80 3.448 -7.165 -12.703 1.00 0.00 N ATOM 0 H GLN A 80 7.959 -7.597 -10.400 1.00 0.00 H new ATOM 0 HA GLN A 80 5.968 -7.969 -8.468 1.00 0.00 H new ATOM 0 HB2 GLN A 80 6.506 -9.091 -11.227 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.119 -9.629 -10.300 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.742 -6.980 -10.049 1.00 0.00 H new ATOM 0 HG3 GLN A 80 5.663 -6.961 -11.540 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.027 -6.355 -12.926 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.618 -7.367 -13.260 1.00 0.00 H new ATOM 1142 N GLY A 81 6.869 -9.906 -7.148 1.00 0.00 N ATOM 1143 CA GLY A 81 7.151 -11.123 -6.410 1.00 0.00 C ATOM 1144 C GLY A 81 8.400 -11.009 -5.559 1.00 0.00 C ATOM 1145 O GLY A 81 8.593 -11.782 -4.620 1.00 0.00 O ATOM 0 H GLY A 81 6.659 -9.093 -6.569 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.301 -11.362 -5.771 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.266 -11.950 -7.110 1.00 0.00 H new ATOM 1149 N PHE A 82 9.253 -10.045 -5.889 1.00 0.00 N ATOM 1150 CA PHE A 82 10.492 -9.834 -5.150 1.00 0.00 C ATOM 1151 C PHE A 82 10.233 -9.823 -3.646 1.00 0.00 C ATOM 1152 O PHE A 82 9.298 -9.179 -3.172 1.00 0.00 O ATOM 1153 CB PHE A 82 11.148 -8.519 -5.576 1.00 0.00 C ATOM 1154 CG PHE A 82 12.054 -8.659 -6.766 1.00 0.00 C ATOM 1155 CD1 PHE A 82 11.666 -9.408 -7.865 1.00 0.00 C ATOM 1156 CD2 PHE A 82 13.294 -8.041 -6.785 1.00 0.00 C ATOM 1157 CE1 PHE A 82 12.497 -9.539 -8.961 1.00 0.00 C ATOM 1158 CE2 PHE A 82 14.129 -8.168 -7.879 1.00 0.00 C ATOM 1159 CZ PHE A 82 13.731 -8.918 -8.968 1.00 0.00 C ATOM 0 H PHE A 82 9.109 -9.397 -6.664 1.00 0.00 H new ATOM 0 HA PHE A 82 11.167 -10.659 -5.379 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.369 -7.792 -5.806 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.720 -8.120 -4.739 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.702 -9.895 -7.865 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.611 -7.454 -5.936 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.182 -10.126 -9.811 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.093 -7.681 -7.882 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.383 -9.019 -9.823 1.00 0.00 H new ATOM 1169 N ALA A 83 11.070 -10.540 -2.903 1.00 0.00 N ATOM 1170 CA ALA A 83 10.933 -10.611 -1.453 1.00 0.00 C ATOM 1171 C ALA A 83 11.317 -9.288 -0.799 1.00 0.00 C ATOM 1172 O ALA A 83 12.113 -8.525 -1.343 1.00 0.00 O ATOM 1173 CB ALA A 83 11.785 -11.743 -0.898 1.00 0.00 C ATOM 0 H ALA A 83 11.849 -11.079 -3.281 1.00 0.00 H new ATOM 0 HA ALA A 83 9.887 -10.810 -1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.673 -11.785 0.185 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.462 -12.689 -1.333 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.831 -11.567 -1.149 1.00 0.00 H new ATOM 1179 N ASN A 84 10.744 -9.023 0.370 1.00 0.00 N ATOM 1180 CA ASN A 84 11.025 -7.791 1.097 1.00 0.00 C ATOM 1181 C ASN A 84 12.475 -7.359 0.896 1.00 0.00 C ATOM 1182 O ASN A 84 12.745 -6.250 0.433 1.00 0.00 O ATOM 1183 CB ASN A 84 10.740 -7.978 2.589 1.00 0.00 C ATOM 1184 CG ASN A 84 10.931 -6.697 3.379 1.00 0.00 C ATOM 1185 OD1 ASN A 84 11.850 -6.588 4.192 1.00 0.00 O ATOM 1186 ND2 ASN A 84 10.062 -5.722 3.144 1.00 0.00 N ATOM 0 H ASN A 84 10.082 -9.645 0.834 1.00 0.00 H new ATOM 0 HA ASN A 84 10.374 -7.010 0.704 1.00 0.00 H new ATOM 0 HB2 ASN A 84 9.718 -8.333 2.719 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.399 -8.749 2.988 1.00 0.00 H new ATOM 0 HD21 ASN A 84 10.140 -4.838 3.646 1.00 0.00 H new ATOM 0 HD22 ASN A 84 9.316 -5.857 2.461 1.00 0.00 H new ATOM 1193 N HIS A 85 13.404 -8.243 1.246 1.00 0.00 N ATOM 1194 CA HIS A 85 14.826 -7.954 1.102 1.00 0.00 C ATOM 1195 C HIS A 85 15.202 -7.792 -0.368 1.00 0.00 C ATOM 1196 O HIS A 85 15.897 -6.847 -0.741 1.00 0.00 O ATOM 1197 CB HIS A 85 15.661 -9.068 1.734 1.00 0.00 C ATOM 1198 CG HIS A 85 15.159 -10.444 1.421 1.00 0.00 C ATOM 1199 ND1 HIS A 85 14.109 -11.033 2.093 1.00 0.00 N ATOM 1200 CD2 HIS A 85 15.569 -11.347 0.499 1.00 0.00 C ATOM 1201 CE1 HIS A 85 13.895 -12.240 1.599 1.00 0.00 C ATOM 1202 NE2 HIS A 85 14.767 -12.455 0.631 1.00 0.00 N ATOM 0 H HIS A 85 13.198 -9.165 1.631 1.00 0.00 H new ATOM 0 HA HIS A 85 15.035 -7.017 1.617 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.691 -8.979 1.389 1.00 0.00 H new ATOM 0 HB3 HIS A 85 15.674 -8.932 2.815 1.00 0.00 H new ATOM 0 HD2 HIS A 85 16.376 -11.220 -0.208 1.00 0.00 H new ATOM 0 HE1 HIS A 85 13.136 -12.933 1.931 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.834 -13.305 0.072 1.00 0.00 H new ATOM 1211 N ASP A 86 14.739 -8.721 -1.197 1.00 0.00 N ATOM 1212 CA ASP A 86 15.026 -8.681 -2.627 1.00 0.00 C ATOM 1213 C ASP A 86 14.682 -7.315 -3.213 1.00 0.00 C ATOM 1214 O ASP A 86 15.333 -6.847 -4.146 1.00 0.00 O ATOM 1215 CB ASP A 86 14.244 -9.775 -3.356 1.00 0.00 C ATOM 1216 CG ASP A 86 14.948 -11.116 -3.314 1.00 0.00 C ATOM 1217 OD1 ASP A 86 14.836 -11.814 -2.284 1.00 0.00 O ATOM 1218 OD2 ASP A 86 15.611 -11.469 -4.312 1.00 0.00 O ATOM 0 H ASP A 86 14.164 -9.511 -0.904 1.00 0.00 H new ATOM 0 HA ASP A 86 16.093 -8.856 -2.764 1.00 0.00 H new ATOM 0 HB2 ASP A 86 13.256 -9.872 -2.906 1.00 0.00 H new ATOM 0 HB3 ASP A 86 14.094 -9.479 -4.394 1.00 0.00 H new ATOM 1223 N VAL A 87 13.652 -6.682 -2.659 1.00 0.00 N ATOM 1224 CA VAL A 87 13.221 -5.370 -3.126 1.00 0.00 C ATOM 1225 C VAL A 87 14.080 -4.263 -2.525 1.00 0.00 C ATOM 1226 O VAL A 87 14.333 -3.242 -3.164 1.00 0.00 O ATOM 1227 CB VAL A 87 11.744 -5.107 -2.776 1.00 0.00 C ATOM 1228 CG1 VAL A 87 11.364 -3.672 -3.108 1.00 0.00 C ATOM 1229 CG2 VAL A 87 10.841 -6.089 -3.507 1.00 0.00 C ATOM 0 H VAL A 87 13.101 -7.057 -1.887 1.00 0.00 H new ATOM 0 HA VAL A 87 13.336 -5.366 -4.210 1.00 0.00 H new ATOM 0 HB VAL A 87 11.610 -5.254 -1.704 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.317 -3.505 -2.854 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.990 -2.988 -2.535 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.512 -3.494 -4.173 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.801 -5.889 -3.248 1.00 0.00 H new ATOM 0 HG22 VAL A 87 10.976 -5.976 -4.583 1.00 0.00 H new ATOM 0 HG23 VAL A 87 11.098 -7.107 -3.214 1.00 0.00 H new ATOM 1239 N VAL A 88 14.526 -4.472 -1.291 1.00 0.00 N ATOM 1240 CA VAL A 88 15.358 -3.493 -0.602 1.00 0.00 C ATOM 1241 C VAL A 88 16.638 -3.214 -1.382 1.00 0.00 C ATOM 1242 O VAL A 88 16.974 -2.061 -1.650 1.00 0.00 O ATOM 1243 CB VAL A 88 15.728 -3.968 0.816 1.00 0.00 C ATOM 1244 CG1 VAL A 88 16.716 -3.007 1.460 1.00 0.00 C ATOM 1245 CG2 VAL A 88 14.478 -4.113 1.671 1.00 0.00 C ATOM 0 H VAL A 88 14.325 -5.311 -0.747 1.00 0.00 H new ATOM 0 HA VAL A 88 14.773 -2.576 -0.529 1.00 0.00 H new ATOM 0 HB VAL A 88 16.205 -4.945 0.741 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.966 -3.359 2.461 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.622 -2.958 0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.269 -2.015 1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 88 14.757 -4.449 2.670 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.971 -3.150 1.741 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.809 -4.843 1.216 1.00 0.00 H new ATOM 1255 N GLU A 89 17.348 -4.278 -1.745 1.00 0.00 N ATOM 1256 CA GLU A 89 18.592 -4.147 -2.494 1.00 0.00 C ATOM 1257 C GLU A 89 18.372 -3.350 -3.777 1.00 0.00 C ATOM 1258 O GLU A 89 19.192 -2.509 -4.147 1.00 0.00 O ATOM 1259 CB GLU A 89 19.159 -5.528 -2.829 1.00 0.00 C ATOM 1260 CG GLU A 89 18.455 -6.210 -3.990 1.00 0.00 C ATOM 1261 CD GLU A 89 18.746 -7.697 -4.057 1.00 0.00 C ATOM 1262 OE1 GLU A 89 19.805 -8.118 -3.547 1.00 0.00 O ATOM 1263 OE2 GLU A 89 17.915 -8.439 -4.621 1.00 0.00 O ATOM 0 H GLU A 89 17.083 -5.240 -1.532 1.00 0.00 H new ATOM 0 HA GLU A 89 19.307 -3.610 -1.871 1.00 0.00 H new ATOM 0 HB2 GLU A 89 20.218 -5.429 -3.065 1.00 0.00 H new ATOM 0 HB3 GLU A 89 19.087 -6.165 -1.947 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.380 -6.058 -3.898 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.764 -5.741 -4.924 1.00 0.00 H new ATOM 1270 N VAL A 90 17.260 -3.622 -4.453 1.00 0.00 N ATOM 1271 CA VAL A 90 16.931 -2.931 -5.694 1.00 0.00 C ATOM 1272 C VAL A 90 16.903 -1.420 -5.491 1.00 0.00 C ATOM 1273 O VAL A 90 17.360 -0.659 -6.345 1.00 0.00 O ATOM 1274 CB VAL A 90 15.569 -3.390 -6.248 1.00 0.00 C ATOM 1275 CG1 VAL A 90 15.231 -2.636 -7.525 1.00 0.00 C ATOM 1276 CG2 VAL A 90 15.571 -4.891 -6.490 1.00 0.00 C ATOM 0 H VAL A 90 16.572 -4.316 -4.162 1.00 0.00 H new ATOM 0 HA VAL A 90 17.710 -3.183 -6.413 1.00 0.00 H new ATOM 0 HB VAL A 90 14.801 -3.166 -5.508 1.00 0.00 H new ATOM 0 HG11 VAL A 90 14.266 -2.973 -7.902 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.185 -1.567 -7.315 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.000 -2.826 -8.274 1.00 0.00 H new ATOM 0 HG21 VAL A 90 14.601 -5.198 -6.881 1.00 0.00 H new ATOM 0 HG22 VAL A 90 16.349 -5.142 -7.211 1.00 0.00 H new ATOM 0 HG23 VAL A 90 15.764 -5.411 -5.552 1.00 0.00 H new ATOM 1286 N LEU A 91 16.363 -0.992 -4.355 1.00 0.00 N ATOM 1287 CA LEU A 91 16.275 0.429 -4.039 1.00 0.00 C ATOM 1288 C LEU A 91 17.663 1.033 -3.853 1.00 0.00 C ATOM 1289 O LEU A 91 17.967 2.094 -4.399 1.00 0.00 O ATOM 1290 CB LEU A 91 15.441 0.639 -2.773 1.00 0.00 C ATOM 1291 CG LEU A 91 14.055 -0.006 -2.767 1.00 0.00 C ATOM 1292 CD1 LEU A 91 13.442 0.059 -1.377 1.00 0.00 C ATOM 1293 CD2 LEU A 91 13.148 0.670 -3.785 1.00 0.00 C ATOM 0 H LEU A 91 15.980 -1.608 -3.638 1.00 0.00 H new ATOM 0 HA LEU A 91 15.789 0.932 -4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 91 16.003 0.252 -1.923 1.00 0.00 H new ATOM 0 HB3 LEU A 91 15.322 1.711 -2.615 1.00 0.00 H new ATOM 0 HG LEU A 91 14.162 -1.054 -3.045 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.456 -0.405 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU A 91 14.082 -0.472 -0.672 1.00 0.00 H new ATOM 0 HD13 LEU A 91 13.348 1.100 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 91 12.166 0.198 -3.767 1.00 0.00 H new ATOM 0 HD22 LEU A 91 13.047 1.727 -3.538 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.580 0.570 -4.781 1.00 0.00 H new ATOM 1305 N ARG A 92 18.502 0.349 -3.081 1.00 0.00 N ATOM 1306 CA ARG A 92 19.858 0.818 -2.825 1.00 0.00 C ATOM 1307 C ARG A 92 20.630 0.988 -4.130 1.00 0.00 C ATOM 1308 O ARG A 92 21.336 1.978 -4.320 1.00 0.00 O ATOM 1309 CB ARG A 92 20.594 -0.162 -1.909 1.00 0.00 C ATOM 1310 CG ARG A 92 20.040 -0.205 -0.494 1.00 0.00 C ATOM 1311 CD ARG A 92 21.001 -0.899 0.459 1.00 0.00 C ATOM 1312 NE ARG A 92 21.949 0.038 1.058 1.00 0.00 N ATOM 1313 CZ ARG A 92 21.681 0.767 2.135 1.00 0.00 C ATOM 1314 NH1 ARG A 92 20.499 0.668 2.729 1.00 0.00 N ATOM 1315 NH2 ARG A 92 22.595 1.597 2.621 1.00 0.00 N ATOM 0 H ARG A 92 18.266 -0.531 -2.623 1.00 0.00 H new ATOM 0 HA ARG A 92 19.793 1.788 -2.332 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.541 -1.161 -2.342 1.00 0.00 H new ATOM 0 HB3 ARG A 92 21.648 0.112 -1.869 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.850 0.810 -0.145 1.00 0.00 H new ATOM 0 HG3 ARG A 92 19.083 -0.727 -0.492 1.00 0.00 H new ATOM 0 HD2 ARG A 92 20.435 -1.396 1.247 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.548 -1.674 -0.078 1.00 0.00 H new ATOM 0 HE ARG A 92 22.867 0.138 0.625 1.00 0.00 H new ATOM 0 HH11 ARG A 92 19.794 0.031 2.359 1.00 0.00 H new ATOM 0 HH12 ARG A 92 20.295 1.229 3.556 1.00 0.00 H new ATOM 0 HH21 ARG A 92 23.505 1.676 2.167 1.00 0.00 H new ATOM 0 HH22 ARG A 92 22.388 2.156 3.448 1.00 0.00 H new ATOM 1329 N ASN A 93 20.491 0.016 -5.025 1.00 0.00 N ATOM 1330 CA ASN A 93 21.177 0.057 -6.312 1.00 0.00 C ATOM 1331 C ASN A 93 20.783 1.305 -7.097 1.00 0.00 C ATOM 1332 O ASN A 93 21.606 1.896 -7.796 1.00 0.00 O ATOM 1333 CB ASN A 93 20.852 -1.196 -7.127 1.00 0.00 C ATOM 1334 CG ASN A 93 21.783 -2.350 -6.809 1.00 0.00 C ATOM 1335 OD1 ASN A 93 22.803 -2.540 -7.472 1.00 0.00 O ATOM 1336 ND2 ASN A 93 21.434 -3.128 -5.791 1.00 0.00 N ATOM 0 H ASN A 93 19.910 -0.810 -4.883 1.00 0.00 H new ATOM 0 HA ASN A 93 22.250 0.091 -6.124 1.00 0.00 H new ATOM 0 HB2 ASN A 93 19.823 -1.498 -6.930 1.00 0.00 H new ATOM 0 HB3 ASN A 93 20.917 -0.962 -8.190 1.00 0.00 H new ATOM 0 HD21 ASN A 93 22.020 -3.921 -5.531 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.579 -2.933 -5.269 1.00 0.00 H new ATOM 1343 N ALA A 94 19.520 1.700 -6.977 1.00 0.00 N ATOM 1344 CA ALA A 94 19.018 2.878 -7.673 1.00 0.00 C ATOM 1345 C ALA A 94 19.719 4.143 -7.187 1.00 0.00 C ATOM 1346 O ALA A 94 20.063 4.261 -6.011 1.00 0.00 O ATOM 1347 CB ALA A 94 17.513 3.001 -7.485 1.00 0.00 C ATOM 0 H ALA A 94 18.825 1.221 -6.404 1.00 0.00 H new ATOM 0 HA ALA A 94 19.232 2.761 -8.735 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.152 3.885 -8.010 1.00 0.00 H new ATOM 0 HB2 ALA A 94 17.022 2.115 -7.887 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.285 3.092 -6.423 1.00 0.00 H new ATOM 1353 N GLY A 95 19.927 5.086 -8.100 1.00 0.00 N ATOM 1354 CA GLY A 95 20.586 6.330 -7.744 1.00 0.00 C ATOM 1355 C GLY A 95 19.617 7.490 -7.640 1.00 0.00 C ATOM 1356 O GLY A 95 18.449 7.303 -7.301 1.00 0.00 O ATOM 0 H GLY A 95 19.651 5.012 -9.079 1.00 0.00 H new ATOM 0 HA2 GLY A 95 21.102 6.205 -6.792 1.00 0.00 H new ATOM 0 HA3 GLY A 95 21.346 6.561 -8.490 1.00 0.00 H new ATOM 1360 N GLN A 96 20.103 8.693 -7.931 1.00 0.00 N ATOM 1361 CA GLN A 96 19.272 9.889 -7.866 1.00 0.00 C ATOM 1362 C GLN A 96 17.953 9.675 -8.602 1.00 0.00 C ATOM 1363 O GLN A 96 16.878 9.756 -8.007 1.00 0.00 O ATOM 1364 CB GLN A 96 20.014 11.085 -8.463 1.00 0.00 C ATOM 1365 CG GLN A 96 19.483 12.429 -7.991 1.00 0.00 C ATOM 1366 CD GLN A 96 20.497 13.545 -8.145 1.00 0.00 C ATOM 1367 OE1 GLN A 96 21.126 13.687 -9.194 1.00 0.00 O ATOM 1368 NE2 GLN A 96 20.662 14.344 -7.098 1.00 0.00 N ATOM 0 H GLN A 96 21.068 8.865 -8.214 1.00 0.00 H new ATOM 0 HA GLN A 96 19.054 10.093 -6.818 1.00 0.00 H new ATOM 0 HB2 GLN A 96 21.071 11.011 -8.206 1.00 0.00 H new ATOM 0 HB3 GLN A 96 19.946 11.038 -9.550 1.00 0.00 H new ATOM 0 HG2 GLN A 96 18.585 12.679 -8.556 1.00 0.00 H new ATOM 0 HG3 GLN A 96 19.190 12.352 -6.944 1.00 0.00 H new ATOM 0 HE21 GLN A 96 20.119 14.190 -6.248 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.331 15.112 -7.143 1.00 0.00 H new ATOM 1377 N VAL A 97 18.042 9.402 -9.900 1.00 0.00 N ATOM 1378 CA VAL A 97 16.856 9.176 -10.717 1.00 0.00 C ATOM 1379 C VAL A 97 16.234 7.817 -10.419 1.00 0.00 C ATOM 1380 O VAL A 97 16.716 6.785 -10.889 1.00 0.00 O ATOM 1381 CB VAL A 97 17.185 9.260 -12.219 1.00 0.00 C ATOM 1382 CG1 VAL A 97 15.941 8.999 -13.054 1.00 0.00 C ATOM 1383 CG2 VAL A 97 17.789 10.615 -12.557 1.00 0.00 C ATOM 0 H VAL A 97 18.924 9.332 -10.408 1.00 0.00 H new ATOM 0 HA VAL A 97 16.143 9.961 -10.464 1.00 0.00 H new ATOM 0 HB VAL A 97 17.920 8.491 -12.455 1.00 0.00 H new ATOM 0 HG11 VAL A 97 16.193 9.063 -14.112 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.556 8.004 -12.832 1.00 0.00 H new ATOM 0 HG13 VAL A 97 15.181 9.743 -12.817 1.00 0.00 H new ATOM 0 HG21 VAL A 97 18.015 10.657 -13.622 1.00 0.00 H new ATOM 0 HG22 VAL A 97 17.079 11.403 -12.306 1.00 0.00 H new ATOM 0 HG23 VAL A 97 18.706 10.757 -11.985 1.00 0.00 H new ATOM 1393 N VAL A 98 15.160 7.822 -9.636 1.00 0.00 N ATOM 1394 CA VAL A 98 14.471 6.588 -9.276 1.00 0.00 C ATOM 1395 C VAL A 98 13.098 6.515 -9.935 1.00 0.00 C ATOM 1396 O VAL A 98 12.156 7.184 -9.508 1.00 0.00 O ATOM 1397 CB VAL A 98 14.303 6.464 -7.750 1.00 0.00 C ATOM 1398 CG1 VAL A 98 13.577 5.175 -7.396 1.00 0.00 C ATOM 1399 CG2 VAL A 98 15.657 6.529 -7.059 1.00 0.00 C ATOM 0 H VAL A 98 14.748 8.666 -9.239 1.00 0.00 H new ATOM 0 HA VAL A 98 15.088 5.764 -9.634 1.00 0.00 H new ATOM 0 HB VAL A 98 13.700 7.301 -7.399 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.467 5.105 -6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 98 12.591 5.173 -7.861 1.00 0.00 H new ATOM 0 HG13 VAL A 98 14.151 4.323 -7.759 1.00 0.00 H new ATOM 0 HG21 VAL A 98 15.520 6.440 -5.981 1.00 0.00 H new ATOM 0 HG22 VAL A 98 16.286 5.713 -7.414 1.00 0.00 H new ATOM 0 HG23 VAL A 98 16.136 7.481 -7.286 1.00 0.00 H new ATOM 1409 N HIS A 99 12.990 5.696 -10.977 1.00 0.00 N ATOM 1410 CA HIS A 99 11.731 5.534 -11.694 1.00 0.00 C ATOM 1411 C HIS A 99 10.894 4.418 -11.077 1.00 0.00 C ATOM 1412 O HIS A 99 11.037 3.248 -11.435 1.00 0.00 O ATOM 1413 CB HIS A 99 11.996 5.231 -13.170 1.00 0.00 C ATOM 1414 CG HIS A 99 12.238 6.455 -13.998 1.00 0.00 C ATOM 1415 ND1 HIS A 99 13.361 6.624 -14.780 1.00 0.00 N ATOM 1416 CD2 HIS A 99 11.494 7.574 -14.164 1.00 0.00 C ATOM 1417 CE1 HIS A 99 13.298 7.794 -15.390 1.00 0.00 C ATOM 1418 NE2 HIS A 99 12.174 8.390 -15.034 1.00 0.00 N ATOM 0 H HIS A 99 13.759 5.135 -11.343 1.00 0.00 H new ATOM 0 HA HIS A 99 11.174 6.468 -11.616 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.861 4.573 -13.248 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.144 4.688 -13.580 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.543 7.785 -13.699 1.00 0.00 H new ATOM 0 HE1 HIS A 99 14.039 8.195 -16.065 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.862 9.307 -15.353 1.00 0.00 H new ATOM 1427 N LEU A 100 10.020 4.787 -10.146 1.00 0.00 N ATOM 1428 CA LEU A 100 9.160 3.817 -9.477 1.00 0.00 C ATOM 1429 C LEU A 100 7.920 3.520 -10.315 1.00 0.00 C ATOM 1430 O LEU A 100 7.257 4.432 -10.808 1.00 0.00 O ATOM 1431 CB LEU A 100 8.746 4.337 -8.100 1.00 0.00 C ATOM 1432 CG LEU A 100 8.514 3.276 -7.023 1.00 0.00 C ATOM 1433 CD1 LEU A 100 7.640 2.153 -7.561 1.00 0.00 C ATOM 1434 CD2 LEU A 100 9.841 2.728 -6.520 1.00 0.00 C ATOM 0 H LEU A 100 9.889 5.750 -9.838 1.00 0.00 H new ATOM 0 HA LEU A 100 9.724 2.892 -9.355 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.516 5.023 -7.746 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.830 4.917 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 100 7.996 3.742 -6.185 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.485 1.407 -6.781 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.677 2.558 -7.872 1.00 0.00 H new ATOM 0 HD13 LEU A 100 8.131 1.688 -8.416 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.657 1.974 -5.754 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.386 2.277 -7.349 1.00 0.00 H new ATOM 0 HD23 LEU A 100 10.432 3.539 -6.096 1.00 0.00 H new ATOM 1446 N THR A 101 7.611 2.236 -10.471 1.00 0.00 N ATOM 1447 CA THR A 101 6.451 1.818 -11.247 1.00 0.00 C ATOM 1448 C THR A 101 5.334 1.316 -10.340 1.00 0.00 C ATOM 1449 O THR A 101 5.448 0.255 -9.725 1.00 0.00 O ATOM 1450 CB THR A 101 6.817 0.710 -12.252 1.00 0.00 C ATOM 1451 OG1 THR A 101 7.994 1.078 -12.980 1.00 0.00 O ATOM 1452 CG2 THR A 101 5.672 0.459 -13.222 1.00 0.00 C ATOM 0 H THR A 101 8.149 1.468 -10.070 1.00 0.00 H new ATOM 0 HA THR A 101 6.105 2.695 -11.794 1.00 0.00 H new ATOM 0 HB THR A 101 7.007 -0.207 -11.694 1.00 0.00 H new ATOM 0 HG1 THR A 101 8.131 0.450 -13.720 1.00 0.00 H new ATOM 0 HG21 THR A 101 5.954 -0.327 -13.922 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.786 0.150 -12.667 1.00 0.00 H new ATOM 0 HG23 THR A 101 5.455 1.374 -13.773 1.00 0.00 H new ATOM 1460 N LEU A 102 4.253 2.085 -10.260 1.00 0.00 N ATOM 1461 CA LEU A 102 3.113 1.718 -9.427 1.00 0.00 C ATOM 1462 C LEU A 102 1.838 1.628 -10.258 1.00 0.00 C ATOM 1463 O LEU A 102 1.788 2.107 -11.391 1.00 0.00 O ATOM 1464 CB LEU A 102 2.930 2.736 -8.300 1.00 0.00 C ATOM 1465 CG LEU A 102 4.212 3.242 -7.638 1.00 0.00 C ATOM 1466 CD1 LEU A 102 4.802 4.398 -8.431 1.00 0.00 C ATOM 1467 CD2 LEU A 102 3.941 3.662 -6.201 1.00 0.00 C ATOM 0 H LEU A 102 4.142 2.966 -10.762 1.00 0.00 H new ATOM 0 HA LEU A 102 3.312 0.738 -8.994 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.387 3.594 -8.697 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.300 2.288 -7.531 1.00 0.00 H new ATOM 0 HG LEU A 102 4.937 2.428 -7.627 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.714 4.745 -7.945 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.034 4.064 -9.442 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.081 5.214 -8.475 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.865 4.019 -5.746 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.198 4.460 -6.189 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.565 2.808 -5.637 1.00 0.00 H new ATOM 1479 N VAL A 103 0.807 1.012 -9.688 1.00 0.00 N ATOM 1480 CA VAL A 103 -0.470 0.862 -10.375 1.00 0.00 C ATOM 1481 C VAL A 103 -1.637 1.085 -9.419 1.00 0.00 C ATOM 1482 O VAL A 103 -1.932 0.239 -8.575 1.00 0.00 O ATOM 1483 CB VAL A 103 -0.604 -0.533 -11.014 1.00 0.00 C ATOM 1484 CG1 VAL A 103 -0.134 -1.610 -10.048 1.00 0.00 C ATOM 1485 CG2 VAL A 103 -2.039 -0.784 -11.449 1.00 0.00 C ATOM 0 H VAL A 103 0.832 0.609 -8.751 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.497 1.617 -11.161 1.00 0.00 H new ATOM 0 HB VAL A 103 0.031 -0.571 -11.899 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.236 -2.589 -10.517 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.911 -1.438 -9.791 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.740 -1.576 -9.143 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -2.115 -1.774 -11.898 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.697 -0.727 -10.582 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.335 -0.031 -12.179 1.00 0.00 H new ATOM 1495 N ARG A 104 -2.299 2.229 -9.559 1.00 0.00 N ATOM 1496 CA ARG A 104 -3.435 2.564 -8.708 1.00 0.00 C ATOM 1497 C ARG A 104 -4.749 2.394 -9.464 1.00 0.00 C ATOM 1498 O ARG A 104 -4.771 2.375 -10.695 1.00 0.00 O ATOM 1499 CB ARG A 104 -3.310 4.000 -8.197 1.00 0.00 C ATOM 1500 CG ARG A 104 -2.107 4.222 -7.294 1.00 0.00 C ATOM 1501 CD ARG A 104 -1.764 5.699 -7.177 1.00 0.00 C ATOM 1502 NE ARG A 104 -2.852 6.469 -6.582 1.00 0.00 N ATOM 1503 CZ ARG A 104 -2.682 7.647 -5.991 1.00 0.00 C ATOM 1504 NH1 ARG A 104 -1.474 8.187 -5.917 1.00 0.00 N ATOM 1505 NH2 ARG A 104 -3.723 8.287 -5.472 1.00 0.00 N ATOM 0 H ARG A 104 -2.068 2.939 -10.254 1.00 0.00 H new ATOM 0 HA ARG A 104 -3.434 1.882 -7.858 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -3.243 4.676 -9.050 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -4.216 4.263 -7.652 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -2.314 3.816 -6.304 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -1.249 3.678 -7.689 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -0.865 5.815 -6.572 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -1.537 6.098 -8.166 1.00 0.00 H new ATOM 0 HE ARG A 104 -3.795 6.082 -6.622 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -0.672 7.698 -6.314 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -1.347 9.091 -5.463 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -4.654 7.875 -5.527 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -3.591 9.191 -5.019 1.00 0.00 H new ATOM 1519 N ARG A 105 -5.843 2.271 -8.719 1.00 0.00 N ATOM 1520 CA ARG A 105 -7.161 2.102 -9.318 1.00 0.00 C ATOM 1521 C ARG A 105 -7.628 3.395 -9.980 1.00 0.00 C ATOM 1522 O ARG A 105 -7.648 4.454 -9.353 1.00 0.00 O ATOM 1523 CB ARG A 105 -8.174 1.664 -8.259 1.00 0.00 C ATOM 1524 CG ARG A 105 -9.448 1.074 -8.842 1.00 0.00 C ATOM 1525 CD ARG A 105 -10.093 0.085 -7.883 1.00 0.00 C ATOM 1526 NE ARG A 105 -11.542 0.021 -8.056 1.00 0.00 N ATOM 1527 CZ ARG A 105 -12.387 0.875 -7.489 1.00 0.00 C ATOM 1528 NH1 ARG A 105 -11.931 1.853 -6.719 1.00 0.00 N ATOM 1529 NH2 ARG A 105 -13.693 0.752 -7.694 1.00 0.00 N ATOM 0 H ARG A 105 -5.842 2.285 -7.699 1.00 0.00 H new ATOM 0 HA ARG A 105 -7.088 1.329 -10.083 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -7.708 0.926 -7.606 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.432 2.522 -7.638 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.151 1.875 -9.068 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -9.221 0.574 -9.784 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -9.665 -0.905 -8.041 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -9.863 0.372 -6.857 1.00 0.00 H new ATOM 0 HE ARG A 105 -11.926 -0.719 -8.644 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -10.928 1.952 -6.560 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.583 2.507 -6.285 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -14.048 0.002 -8.287 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -14.342 1.408 -7.259 1.00 0.00 H new ATOM 1543 N LYS A 106 -8.002 3.301 -11.252 1.00 0.00 N ATOM 1544 CA LYS A 106 -8.470 4.462 -12.000 1.00 0.00 C ATOM 1545 C LYS A 106 -9.865 4.877 -11.544 1.00 0.00 C ATOM 1546 O LYS A 106 -10.534 4.146 -10.813 1.00 0.00 O ATOM 1547 CB LYS A 106 -8.481 4.157 -13.500 1.00 0.00 C ATOM 1548 CG LYS A 106 -7.143 3.675 -14.032 1.00 0.00 C ATOM 1549 CD LYS A 106 -7.319 2.725 -15.205 1.00 0.00 C ATOM 1550 CE LYS A 106 -7.267 3.464 -16.534 1.00 0.00 C ATOM 1551 NZ LYS A 106 -6.760 2.595 -17.632 1.00 0.00 N ATOM 0 H LYS A 106 -7.990 2.432 -11.786 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.784 5.287 -11.808 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.238 3.399 -13.703 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -8.776 5.055 -14.043 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -6.544 4.531 -14.343 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.593 3.173 -13.236 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -6.538 1.965 -15.179 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.273 2.205 -15.114 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -8.263 3.826 -16.788 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.625 4.340 -16.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.114 3.141 -18.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -6.251 1.784 -17.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.560 2.252 -18.201 1.00 0.00 H new ATOM 1565 N THR A 107 -10.299 6.056 -11.981 1.00 0.00 N ATOM 1566 CA THR A 107 -11.614 6.568 -11.618 1.00 0.00 C ATOM 1567 C THR A 107 -12.714 5.863 -12.403 1.00 0.00 C ATOM 1568 O THR A 107 -13.671 5.347 -11.824 1.00 0.00 O ATOM 1569 CB THR A 107 -11.714 8.085 -11.866 1.00 0.00 C ATOM 1570 OG1 THR A 107 -10.700 8.770 -11.123 1.00 0.00 O ATOM 1571 CG2 THR A 107 -13.085 8.609 -11.466 1.00 0.00 C ATOM 0 H THR A 107 -9.758 6.673 -12.587 1.00 0.00 H new ATOM 0 HA THR A 107 -11.747 6.371 -10.554 1.00 0.00 H new ATOM 0 HB THR A 107 -11.569 8.268 -12.931 1.00 0.00 H new ATOM 0 HG1 THR A 107 -10.769 9.734 -11.287 1.00 0.00 H new ATOM 0 HG21 THR A 107 -13.132 9.682 -11.650 1.00 0.00 H new ATOM 0 HG22 THR A 107 -13.853 8.106 -12.054 1.00 0.00 H new ATOM 0 HG23 THR A 107 -13.254 8.415 -10.407 1.00 0.00 H new ATOM 1579 N SER A 108 -12.573 5.843 -13.725 1.00 0.00 N ATOM 1580 CA SER A 108 -13.557 5.203 -14.590 1.00 0.00 C ATOM 1581 C SER A 108 -12.888 4.604 -15.823 1.00 0.00 C ATOM 1582 O SER A 108 -12.028 5.229 -16.442 1.00 0.00 O ATOM 1583 CB SER A 108 -14.626 6.212 -15.015 1.00 0.00 C ATOM 1584 OG SER A 108 -15.643 6.322 -14.034 1.00 0.00 O ATOM 0 H SER A 108 -11.786 6.263 -14.220 1.00 0.00 H new ATOM 0 HA SER A 108 -14.030 4.398 -14.028 1.00 0.00 H new ATOM 0 HB2 SER A 108 -14.166 7.187 -15.177 1.00 0.00 H new ATOM 0 HB3 SER A 108 -15.064 5.904 -15.964 1.00 0.00 H new ATOM 0 HG SER A 108 -15.295 6.026 -13.167 1.00 0.00 H new ATOM 1590 N SER A 109 -13.291 3.387 -16.174 1.00 0.00 N ATOM 1591 CA SER A 109 -12.729 2.699 -17.330 1.00 0.00 C ATOM 1592 C SER A 109 -13.434 3.129 -18.613 1.00 0.00 C ATOM 1593 O SER A 109 -14.639 2.931 -18.769 1.00 0.00 O ATOM 1594 CB SER A 109 -12.844 1.184 -17.155 1.00 0.00 C ATOM 1595 OG SER A 109 -12.567 0.507 -18.369 1.00 0.00 O ATOM 0 H SER A 109 -14.005 2.857 -15.674 1.00 0.00 H new ATOM 0 HA SER A 109 -11.676 2.969 -17.406 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.151 0.850 -16.383 1.00 0.00 H new ATOM 0 HB3 SER A 109 -13.847 0.929 -16.814 1.00 0.00 H new ATOM 0 HG SER A 109 -12.646 -0.460 -18.230 1.00 0.00 H new ATOM 1601 N SER A 110 -12.674 3.719 -19.530 1.00 0.00 N ATOM 1602 CA SER A 110 -13.225 4.181 -20.798 1.00 0.00 C ATOM 1603 C SER A 110 -12.608 3.420 -21.968 1.00 0.00 C ATOM 1604 O SER A 110 -13.298 3.055 -22.921 1.00 0.00 O ATOM 1605 CB SER A 110 -12.983 5.682 -20.967 1.00 0.00 C ATOM 1606 OG SER A 110 -11.612 6.000 -20.800 1.00 0.00 O ATOM 0 H SER A 110 -11.674 3.888 -19.418 1.00 0.00 H new ATOM 0 HA SER A 110 -14.298 3.992 -20.790 1.00 0.00 H new ATOM 0 HB2 SER A 110 -13.315 5.998 -21.956 1.00 0.00 H new ATOM 0 HB3 SER A 110 -13.579 6.234 -20.240 1.00 0.00 H new ATOM 0 HG SER A 110 -11.484 6.965 -20.915 1.00 0.00 H new ATOM 1612 N THR A 111 -11.302 3.184 -21.889 1.00 0.00 N ATOM 1613 CA THR A 111 -10.590 2.468 -22.941 1.00 0.00 C ATOM 1614 C THR A 111 -10.948 0.986 -22.935 1.00 0.00 C ATOM 1615 O THR A 111 -10.922 0.335 -21.891 1.00 0.00 O ATOM 1616 CB THR A 111 -9.065 2.617 -22.788 1.00 0.00 C ATOM 1617 OG1 THR A 111 -8.668 2.258 -21.460 1.00 0.00 O ATOM 1618 CG2 THR A 111 -8.629 4.044 -23.085 1.00 0.00 C ATOM 0 H THR A 111 -10.716 3.478 -21.108 1.00 0.00 H new ATOM 0 HA THR A 111 -10.897 2.910 -23.889 1.00 0.00 H new ATOM 0 HB THR A 111 -8.583 1.950 -23.503 1.00 0.00 H new ATOM 0 HG1 THR A 111 -9.206 1.500 -21.151 1.00 0.00 H new ATOM 0 HG21 THR A 111 -7.548 4.125 -22.971 1.00 0.00 H new ATOM 0 HG22 THR A 111 -8.906 4.304 -24.107 1.00 0.00 H new ATOM 0 HG23 THR A 111 -9.120 4.726 -22.391 1.00 0.00 H new ATOM 1626 N SER A 112 -11.280 0.458 -24.109 1.00 0.00 N ATOM 1627 CA SER A 112 -11.645 -0.948 -24.239 1.00 0.00 C ATOM 1628 C SER A 112 -11.162 -1.514 -25.571 1.00 0.00 C ATOM 1629 O SER A 112 -11.268 -0.879 -26.620 1.00 0.00 O ATOM 1630 CB SER A 112 -13.161 -1.116 -24.120 1.00 0.00 C ATOM 1631 OG SER A 112 -13.834 -0.420 -25.155 1.00 0.00 O ATOM 0 H SER A 112 -11.304 0.983 -24.983 1.00 0.00 H new ATOM 0 HA SER A 112 -11.161 -1.500 -23.433 1.00 0.00 H new ATOM 0 HB2 SER A 112 -13.417 -2.175 -24.163 1.00 0.00 H new ATOM 0 HB3 SER A 112 -13.496 -0.746 -23.151 1.00 0.00 H new ATOM 0 HG SER A 112 -14.801 -0.544 -25.058 1.00 0.00 H new ATOM 1637 N PRO A 113 -10.618 -2.739 -25.529 1.00 0.00 N ATOM 1638 CA PRO A 113 -10.108 -3.420 -26.724 1.00 0.00 C ATOM 1639 C PRO A 113 -11.224 -3.841 -27.672 1.00 0.00 C ATOM 1640 O PRO A 113 -12.358 -3.373 -27.559 1.00 0.00 O ATOM 1641 CB PRO A 113 -9.397 -4.650 -26.154 1.00 0.00 C ATOM 1642 CG PRO A 113 -10.068 -4.905 -24.849 1.00 0.00 C ATOM 1643 CD PRO A 113 -10.459 -3.555 -24.314 1.00 0.00 C ATOM 0 HA PRO A 113 -9.461 -2.773 -27.317 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -9.491 -5.506 -26.822 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -8.331 -4.465 -26.021 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -10.943 -5.542 -24.978 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -9.398 -5.419 -24.160 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -11.384 -3.603 -23.739 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -9.694 -3.147 -23.654 1.00 0.00 H new ATOM 1651 N LEU A 114 -10.898 -4.727 -28.607 1.00 0.00 N ATOM 1652 CA LEU A 114 -11.874 -5.212 -29.576 1.00 0.00 C ATOM 1653 C LEU A 114 -12.530 -6.501 -29.089 1.00 0.00 C ATOM 1654 O LEU A 114 -13.730 -6.702 -29.268 1.00 0.00 O ATOM 1655 CB LEU A 114 -11.204 -5.448 -30.931 1.00 0.00 C ATOM 1656 CG LEU A 114 -10.953 -4.201 -31.780 1.00 0.00 C ATOM 1657 CD1 LEU A 114 -9.840 -4.456 -32.785 1.00 0.00 C ATOM 1658 CD2 LEU A 114 -12.228 -3.774 -32.491 1.00 0.00 C ATOM 0 H LEU A 114 -9.965 -5.124 -28.714 1.00 0.00 H new ATOM 0 HA LEU A 114 -12.647 -4.452 -29.688 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -10.249 -5.946 -30.760 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -11.824 -6.136 -31.506 1.00 0.00 H new ATOM 0 HG LEU A 114 -10.641 -3.392 -31.120 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -9.675 -3.558 -33.381 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -8.923 -4.714 -32.255 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -10.123 -5.279 -33.441 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -12.030 -2.885 -33.090 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -12.570 -4.580 -33.140 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -12.998 -3.550 -31.753 1.00 0.00 H new ATOM 1670 N GLU A 115 -11.733 -7.368 -28.473 1.00 0.00 N ATOM 1671 CA GLU A 115 -12.237 -8.636 -27.960 1.00 0.00 C ATOM 1672 C GLU A 115 -11.909 -8.792 -26.477 1.00 0.00 C ATOM 1673 O GLU A 115 -11.115 -9.644 -26.078 1.00 0.00 O ATOM 1674 CB GLU A 115 -11.644 -9.804 -28.750 1.00 0.00 C ATOM 1675 CG GLU A 115 -12.007 -9.787 -30.226 1.00 0.00 C ATOM 1676 CD GLU A 115 -13.505 -9.759 -30.458 1.00 0.00 C ATOM 1677 OE1 GLU A 115 -14.242 -10.348 -29.640 1.00 0.00 O ATOM 1678 OE2 GLU A 115 -13.940 -9.149 -31.457 1.00 0.00 O ATOM 0 H GLU A 115 -10.737 -7.216 -28.317 1.00 0.00 H new ATOM 0 HA GLU A 115 -13.321 -8.641 -28.078 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -10.559 -9.785 -28.651 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -11.988 -10.741 -28.311 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -11.554 -8.915 -30.698 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.584 -10.667 -30.710 1.00 0.00 H new ATOM 1685 N PRO A 116 -12.534 -7.950 -25.642 1.00 0.00 N ATOM 1686 CA PRO A 116 -12.325 -7.974 -24.191 1.00 0.00 C ATOM 1687 C PRO A 116 -12.921 -9.218 -23.540 1.00 0.00 C ATOM 1688 O PRO A 116 -13.978 -9.710 -23.936 1.00 0.00 O ATOM 1689 CB PRO A 116 -13.052 -6.717 -23.707 1.00 0.00 C ATOM 1690 CG PRO A 116 -14.089 -6.456 -24.744 1.00 0.00 C ATOM 1691 CD PRO A 116 -13.494 -6.910 -26.048 1.00 0.00 C ATOM 0 HA PRO A 116 -11.266 -7.997 -23.932 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -13.503 -6.873 -22.727 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -12.366 -5.875 -23.612 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -15.007 -7.000 -24.523 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -14.347 -5.398 -24.780 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -14.255 -7.306 -26.720 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -13.001 -6.091 -26.572 1.00 0.00 H new ATOM 1699 N PRO A 117 -12.230 -9.740 -22.516 1.00 0.00 N ATOM 1700 CA PRO A 117 -12.673 -10.932 -21.787 1.00 0.00 C ATOM 1701 C PRO A 117 -13.914 -10.667 -20.942 1.00 0.00 C ATOM 1702 O PRO A 117 -14.283 -9.517 -20.708 1.00 0.00 O ATOM 1703 CB PRO A 117 -11.477 -11.265 -20.892 1.00 0.00 C ATOM 1704 CG PRO A 117 -10.768 -9.968 -20.709 1.00 0.00 C ATOM 1705 CD PRO A 117 -10.962 -9.205 -21.990 1.00 0.00 C ATOM 0 HA PRO A 117 -12.956 -11.740 -22.461 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -11.800 -11.678 -19.936 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -10.829 -12.008 -21.357 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -11.175 -9.417 -19.861 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.709 -10.127 -20.506 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -11.021 -8.131 -21.813 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -10.138 -9.369 -22.684 1.00 0.00 H new ATOM 1713 N SER A 118 -14.553 -11.740 -20.486 1.00 0.00 N ATOM 1714 CA SER A 118 -15.756 -11.623 -19.669 1.00 0.00 C ATOM 1715 C SER A 118 -15.504 -12.140 -18.256 1.00 0.00 C ATOM 1716 O SER A 118 -15.408 -13.347 -18.033 1.00 0.00 O ATOM 1717 CB SER A 118 -16.910 -12.396 -20.310 1.00 0.00 C ATOM 1718 OG SER A 118 -16.590 -13.769 -20.447 1.00 0.00 O ATOM 0 H SER A 118 -14.258 -12.699 -20.668 1.00 0.00 H new ATOM 0 HA SER A 118 -16.025 -10.568 -19.609 1.00 0.00 H new ATOM 0 HB2 SER A 118 -17.807 -12.288 -19.701 1.00 0.00 H new ATOM 0 HB3 SER A 118 -17.136 -11.973 -21.289 1.00 0.00 H new ATOM 0 HG SER A 118 -16.080 -14.066 -19.664 1.00 0.00 H new ATOM 1724 N ASP A 119 -15.400 -11.218 -17.306 1.00 0.00 N ATOM 1725 CA ASP A 119 -15.161 -11.579 -15.913 1.00 0.00 C ATOM 1726 C ASP A 119 -16.324 -11.137 -15.030 1.00 0.00 C ATOM 1727 O ASP A 119 -17.136 -10.302 -15.428 1.00 0.00 O ATOM 1728 CB ASP A 119 -13.859 -10.948 -15.416 1.00 0.00 C ATOM 1729 CG ASP A 119 -13.948 -9.437 -15.319 1.00 0.00 C ATOM 1730 OD1 ASP A 119 -14.928 -8.938 -14.727 1.00 0.00 O ATOM 1731 OD2 ASP A 119 -13.039 -8.755 -15.836 1.00 0.00 O ATOM 0 H ASP A 119 -15.477 -10.215 -17.474 1.00 0.00 H new ATOM 0 HA ASP A 119 -15.075 -12.664 -15.854 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -13.610 -11.358 -14.437 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -13.047 -11.219 -16.091 1.00 0.00 H new ATOM 1736 N ARG A 120 -16.398 -11.704 -13.830 1.00 0.00 N ATOM 1737 CA ARG A 120 -17.463 -11.370 -12.892 1.00 0.00 C ATOM 1738 C ARG A 120 -16.894 -11.075 -11.507 1.00 0.00 C ATOM 1739 O ARG A 120 -15.895 -11.664 -11.097 1.00 0.00 O ATOM 1740 CB ARG A 120 -18.474 -12.515 -12.807 1.00 0.00 C ATOM 1741 CG ARG A 120 -19.679 -12.200 -11.937 1.00 0.00 C ATOM 1742 CD ARG A 120 -20.716 -11.387 -12.696 1.00 0.00 C ATOM 1743 NE ARG A 120 -22.044 -11.497 -12.097 1.00 0.00 N ATOM 1744 CZ ARG A 120 -22.847 -12.539 -12.276 1.00 0.00 C ATOM 1745 NH1 ARG A 120 -22.459 -13.557 -13.032 1.00 0.00 N ATOM 1746 NH2 ARG A 120 -24.041 -12.566 -11.697 1.00 0.00 N ATOM 0 H ARG A 120 -15.733 -12.396 -13.485 1.00 0.00 H new ATOM 0 HA ARG A 120 -17.968 -10.475 -13.257 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -18.817 -12.761 -13.812 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -17.975 -13.401 -12.414 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -20.129 -13.129 -11.586 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -19.357 -11.648 -11.054 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -20.413 -10.340 -12.715 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -20.756 -11.726 -13.731 1.00 0.00 H new ATOM 0 HE ARG A 120 -22.372 -10.731 -11.509 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -21.542 -13.541 -13.478 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -23.078 -14.356 -13.168 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -24.343 -11.786 -11.114 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -24.657 -13.367 -11.835 1.00 0.00 H new ATOM 1760 N GLY A 121 -17.539 -10.159 -10.791 1.00 0.00 N ATOM 1761 CA GLY A 121 -17.083 -9.802 -9.460 1.00 0.00 C ATOM 1762 C GLY A 121 -18.191 -9.223 -8.603 1.00 0.00 C ATOM 1763 O GLY A 121 -19.322 -9.060 -9.063 1.00 0.00 O ATOM 0 H GLY A 121 -18.369 -9.658 -11.109 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -16.673 -10.686 -8.971 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -16.273 -9.077 -9.539 1.00 0.00 H new ATOM 1767 N THR A 122 -17.869 -8.912 -7.352 1.00 0.00 N ATOM 1768 CA THR A 122 -18.846 -8.351 -6.428 1.00 0.00 C ATOM 1769 C THR A 122 -18.163 -7.740 -5.209 1.00 0.00 C ATOM 1770 O THR A 122 -17.090 -8.183 -4.799 1.00 0.00 O ATOM 1771 CB THR A 122 -19.852 -9.418 -5.957 1.00 0.00 C ATOM 1772 OG1 THR A 122 -20.839 -8.821 -5.109 1.00 0.00 O ATOM 1773 CG2 THR A 122 -19.143 -10.537 -5.209 1.00 0.00 C ATOM 0 H THR A 122 -16.938 -9.039 -6.955 1.00 0.00 H new ATOM 0 HA THR A 122 -19.382 -7.572 -6.970 1.00 0.00 H new ATOM 0 HB THR A 122 -20.338 -9.841 -6.836 1.00 0.00 H new ATOM 0 HG1 THR A 122 -21.476 -9.506 -4.815 1.00 0.00 H new ATOM 0 HG21 THR A 122 -19.874 -11.279 -4.886 1.00 0.00 H new ATOM 0 HG22 THR A 122 -18.413 -11.009 -5.867 1.00 0.00 H new ATOM 0 HG23 THR A 122 -18.634 -10.126 -4.337 1.00 0.00 H new ATOM 1781 N VAL A 123 -18.792 -6.721 -4.632 1.00 0.00 N ATOM 1782 CA VAL A 123 -18.245 -6.051 -3.459 1.00 0.00 C ATOM 1783 C VAL A 123 -18.805 -6.650 -2.173 1.00 0.00 C ATOM 1784 O VAL A 123 -19.993 -6.959 -2.086 1.00 0.00 O ATOM 1785 CB VAL A 123 -18.548 -4.541 -3.483 1.00 0.00 C ATOM 1786 CG1 VAL A 123 -20.048 -4.296 -3.415 1.00 0.00 C ATOM 1787 CG2 VAL A 123 -17.832 -3.836 -2.340 1.00 0.00 C ATOM 0 H VAL A 123 -19.681 -6.342 -4.958 1.00 0.00 H new ATOM 0 HA VAL A 123 -17.165 -6.198 -3.485 1.00 0.00 H new ATOM 0 HB VAL A 123 -18.179 -4.129 -4.422 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -20.243 -3.224 -3.433 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -20.533 -4.767 -4.270 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -20.445 -4.721 -2.493 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -18.057 -2.770 -2.372 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -18.169 -4.250 -1.389 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -16.756 -3.983 -2.439 1.00 0.00 H new ATOM 1797 N SER A 124 -17.941 -6.810 -1.176 1.00 0.00 N ATOM 1798 CA SER A 124 -18.348 -7.376 0.105 1.00 0.00 C ATOM 1799 C SER A 124 -18.615 -6.273 1.125 1.00 0.00 C ATOM 1800 O SER A 124 -18.451 -5.089 0.833 1.00 0.00 O ATOM 1801 CB SER A 124 -17.270 -8.325 0.633 1.00 0.00 C ATOM 1802 OG SER A 124 -17.443 -9.632 0.114 1.00 0.00 O ATOM 0 H SER A 124 -16.955 -6.556 -1.230 1.00 0.00 H new ATOM 0 HA SER A 124 -19.270 -7.936 -0.049 1.00 0.00 H new ATOM 0 HB2 SER A 124 -16.284 -7.949 0.359 1.00 0.00 H new ATOM 0 HB3 SER A 124 -17.309 -8.355 1.722 1.00 0.00 H new ATOM 0 HG SER A 124 -16.741 -10.219 0.465 1.00 0.00 H new ATOM 1808 N GLY A 125 -19.028 -6.672 2.324 1.00 0.00 N ATOM 1809 CA GLY A 125 -19.312 -5.707 3.370 1.00 0.00 C ATOM 1810 C GLY A 125 -18.331 -5.795 4.522 1.00 0.00 C ATOM 1811 O GLY A 125 -18.582 -6.455 5.530 1.00 0.00 O ATOM 0 H GLY A 125 -19.171 -7.646 2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -19.285 -4.702 2.950 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -20.323 -5.869 3.744 1.00 0.00 H new ATOM 1815 N PRO A 126 -17.181 -5.119 4.378 1.00 0.00 N ATOM 1816 CA PRO A 126 -16.135 -5.109 5.405 1.00 0.00 C ATOM 1817 C PRO A 126 -16.551 -4.331 6.649 1.00 0.00 C ATOM 1818 O PRO A 126 -17.635 -3.751 6.696 1.00 0.00 O ATOM 1819 CB PRO A 126 -14.961 -4.415 4.708 1.00 0.00 C ATOM 1820 CG PRO A 126 -15.592 -3.565 3.659 1.00 0.00 C ATOM 1821 CD PRO A 126 -16.815 -4.311 3.202 1.00 0.00 C ATOM 0 HA PRO A 126 -15.904 -6.113 5.762 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -14.383 -3.814 5.410 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -14.276 -5.141 4.270 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -15.858 -2.586 4.058 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -14.906 -3.395 2.829 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -17.617 -3.631 2.916 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -16.604 -4.936 2.335 1.00 0.00 H new ATOM 1829 N SER A 127 -15.682 -4.324 7.654 1.00 0.00 N ATOM 1830 CA SER A 127 -15.961 -3.620 8.901 1.00 0.00 C ATOM 1831 C SER A 127 -15.051 -2.405 9.054 1.00 0.00 C ATOM 1832 O SER A 127 -14.116 -2.214 8.276 1.00 0.00 O ATOM 1833 CB SER A 127 -15.780 -4.561 10.094 1.00 0.00 C ATOM 1834 OG SER A 127 -16.592 -4.163 11.184 1.00 0.00 O ATOM 0 H SER A 127 -14.779 -4.798 7.630 1.00 0.00 H new ATOM 0 HA SER A 127 -16.995 -3.276 8.872 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.034 -5.579 9.800 1.00 0.00 H new ATOM 0 HB3 SER A 127 -14.734 -4.569 10.400 1.00 0.00 H new ATOM 0 HG SER A 127 -16.460 -4.781 11.933 1.00 0.00 H new ATOM 1840 N SER A 128 -15.331 -1.587 10.063 1.00 0.00 N ATOM 1841 CA SER A 128 -14.541 -0.388 10.318 1.00 0.00 C ATOM 1842 C SER A 128 -14.612 0.570 9.133 1.00 0.00 C ATOM 1843 O SER A 128 -13.606 1.153 8.731 1.00 0.00 O ATOM 1844 CB SER A 128 -13.085 -0.762 10.600 1.00 0.00 C ATOM 1845 OG SER A 128 -12.426 0.264 11.322 1.00 0.00 O ATOM 0 H SER A 128 -16.099 -1.733 10.718 1.00 0.00 H new ATOM 0 HA SER A 128 -14.956 0.112 11.193 1.00 0.00 H new ATOM 0 HB2 SER A 128 -13.048 -1.692 11.168 1.00 0.00 H new ATOM 0 HB3 SER A 128 -12.564 -0.942 9.660 1.00 0.00 H new ATOM 0 HG SER A 128 -12.466 1.100 10.812 1.00 0.00 H new ATOM 1851 N GLY A 129 -15.809 0.728 8.577 1.00 0.00 N ATOM 1852 CA GLY A 129 -15.990 1.616 7.444 1.00 0.00 C ATOM 1853 C GLY A 129 -16.315 0.867 6.166 1.00 0.00 C ATOM 1854 O GLY A 129 -16.499 1.475 5.112 1.00 0.00 O ATOM 0 H GLY A 129 -16.657 0.256 8.891 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -16.793 2.320 7.663 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -15.083 2.202 7.297 1.00 0.00 H new TER 1858 GLY A 129