USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 896 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 THR OG1 : rot 67:sc= 1.2 USER MOD Set 1.2: A 104 ASN : amide:sc= 0.062 K(o=1.3,f=-5.1!) USER MOD Set 2.1: A 54 GLN : amide:sc= -0.756! C(o=-1.6!,f=-3.2!) USER MOD Set 2.2: A 64 TYR OH : rot -101:sc= -0.885! USER MOD Set 2.3: A 80 THR OG1 : rot -170:sc= 0.0437 USER MOD Set 3.1: A 26 THR OG1 : rot 131:sc= 1.21 USER MOD Set 3.2: A 56 GLN : amide:sc= 1.45 K(o=2.7,f=-4.4!) USER MOD Single : A 1 GLY N :NH3+ -125:sc= 0.0483 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -103:sc= 1.23 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN : amide:sc= -0.871 K(o=-0.87,f=-7.1!) USER MOD Single : A 16 GLN : amide:sc= -0.147 K(o=-0.15,f=-1.6!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 22 GLN : amide:sc= -0.111 K(o=-0.11,f=-2!) USER MOD Single : A 23 CYS SG : rot 50:sc= 1.02 USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 SER OG : rot -55:sc= -0.0237 USER MOD Single : A 36 GLN : amide:sc= -2.13 K(o=-2.1,f=-5.9!) USER MOD Single : A 61 THR OG1 : rot 47:sc= 1.02 USER MOD Single : A 63 LYS NZ :NH3+ -108:sc= -0.61 (180deg=-3.28!) USER MOD Single : A 65 GLN : amide:sc= -0.047 X(o=-0.047,f=-0.41) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 168:sc= 0 (180deg=-0.193) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -4.56! C(o=-4.6!,f=-4.6!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= -6.33! C(o=-6.3!,f=-11!) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 96 TYR OH : rot -19:sc= 1.2 USER MOD Single : A 99 SER OG : rot -172:sc= -1.71! USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 HIS : no HD1:sc= -0.247 K(o=-0.25,f=-0.91) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.09) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot -57:sc= 0.0367 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.684 18.817 -21.324 1.00 0.00 N ATOM 2 CA GLY A 1 -3.981 17.590 -21.652 1.00 0.00 C ATOM 3 C GLY A 1 -4.813 16.354 -21.376 1.00 0.00 C ATOM 4 O GLY A 1 -6.041 16.422 -21.325 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.699 19.441 -22.156 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.659 18.593 -21.041 1.00 0.00 H new ATOM 0 H3 GLY A 1 -4.198 19.297 -20.540 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.699 17.607 -22.705 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.057 17.539 -21.075 1.00 0.00 H new ATOM 8 N SER A 2 -4.143 15.219 -21.199 1.00 0.00 N ATOM 9 CA SER A 2 -4.829 13.960 -20.933 1.00 0.00 C ATOM 10 C SER A 2 -5.081 13.785 -19.438 1.00 0.00 C ATOM 11 O SER A 2 -4.149 13.585 -18.659 1.00 0.00 O ATOM 12 CB SER A 2 -4.007 12.785 -21.464 1.00 0.00 C ATOM 13 OG SER A 2 -4.503 11.552 -20.973 1.00 0.00 O ATOM 0 H SER A 2 -3.126 15.146 -21.235 1.00 0.00 H new ATOM 0 HA SER A 2 -5.790 13.982 -21.446 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.032 12.783 -22.554 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.964 12.904 -21.170 1.00 0.00 H new ATOM 0 HG SER A 2 -3.961 10.817 -21.328 1.00 0.00 H new ATOM 19 N SER A 3 -6.349 13.861 -19.045 1.00 0.00 N ATOM 20 CA SER A 3 -6.725 13.714 -17.644 1.00 0.00 C ATOM 21 C SER A 3 -8.152 13.189 -17.516 1.00 0.00 C ATOM 22 O SER A 3 -9.005 13.467 -18.358 1.00 0.00 O ATOM 23 CB SER A 3 -6.595 15.054 -16.917 1.00 0.00 C ATOM 24 OG SER A 3 -6.976 14.935 -15.557 1.00 0.00 O ATOM 0 H SER A 3 -7.133 14.023 -19.677 1.00 0.00 H new ATOM 0 HA SER A 3 -6.049 12.992 -17.185 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.566 15.407 -16.980 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.219 15.800 -17.409 1.00 0.00 H new ATOM 0 HG SER A 3 -6.882 15.804 -15.114 1.00 0.00 H new ATOM 30 N GLY A 4 -8.403 12.428 -16.456 1.00 0.00 N ATOM 31 CA GLY A 4 -9.727 11.876 -16.236 1.00 0.00 C ATOM 32 C GLY A 4 -9.841 11.154 -14.908 1.00 0.00 C ATOM 33 O GLY A 4 -9.305 10.059 -14.741 1.00 0.00 O ATOM 0 H GLY A 4 -7.713 12.184 -15.745 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.463 12.679 -16.274 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.968 11.185 -17.044 1.00 0.00 H new ATOM 37 N SER A 5 -10.541 11.769 -13.960 1.00 0.00 N ATOM 38 CA SER A 5 -10.719 11.180 -12.638 1.00 0.00 C ATOM 39 C SER A 5 -12.193 10.900 -12.362 1.00 0.00 C ATOM 40 O SER A 5 -13.070 11.648 -12.795 1.00 0.00 O ATOM 41 CB SER A 5 -10.154 12.110 -11.562 1.00 0.00 C ATOM 42 OG SER A 5 -8.772 12.346 -11.767 1.00 0.00 O ATOM 0 H SER A 5 -10.994 12.675 -14.083 1.00 0.00 H new ATOM 0 HA SER A 5 -10.177 10.235 -12.612 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.694 13.057 -11.575 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.309 11.669 -10.577 1.00 0.00 H new ATOM 0 HG SER A 5 -8.251 11.815 -11.129 1.00 0.00 H new ATOM 48 N SER A 6 -12.458 9.818 -11.638 1.00 0.00 N ATOM 49 CA SER A 6 -13.825 9.436 -11.306 1.00 0.00 C ATOM 50 C SER A 6 -14.096 9.622 -9.816 1.00 0.00 C ATOM 51 O SER A 6 -13.169 9.700 -9.011 1.00 0.00 O ATOM 52 CB SER A 6 -14.082 7.981 -11.704 1.00 0.00 C ATOM 53 OG SER A 6 -15.466 7.739 -11.889 1.00 0.00 O ATOM 0 H SER A 6 -11.744 9.190 -11.270 1.00 0.00 H new ATOM 0 HA SER A 6 -14.501 10.083 -11.864 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.544 7.752 -12.624 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.693 7.316 -10.933 1.00 0.00 H new ATOM 0 HG SER A 6 -15.603 6.803 -12.144 1.00 0.00 H new ATOM 59 N GLY A 7 -15.374 9.693 -9.457 1.00 0.00 N ATOM 60 CA GLY A 7 -15.745 9.870 -8.065 1.00 0.00 C ATOM 61 C GLY A 7 -16.330 11.241 -7.791 1.00 0.00 C ATOM 62 O GLY A 7 -15.598 12.227 -7.692 1.00 0.00 O ATOM 0 H GLY A 7 -16.159 9.631 -10.105 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.471 9.106 -7.786 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.867 9.721 -7.436 1.00 0.00 H new ATOM 66 N CYS A 8 -17.651 11.305 -7.670 1.00 0.00 N ATOM 67 CA CYS A 8 -18.335 12.567 -7.408 1.00 0.00 C ATOM 68 C CYS A 8 -17.590 13.380 -6.355 1.00 0.00 C ATOM 69 O CYS A 8 -17.128 14.488 -6.625 1.00 0.00 O ATOM 70 CB CYS A 8 -19.770 12.307 -6.948 1.00 0.00 C ATOM 71 SG CYS A 8 -20.837 11.598 -8.224 1.00 0.00 S ATOM 0 H CYS A 8 -18.270 10.498 -7.749 1.00 0.00 H new ATOM 0 HA CYS A 8 -18.357 13.140 -8.335 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -19.749 11.633 -6.091 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -20.206 13.245 -6.605 1.00 0.00 H new ATOM 0 HG CYS A 8 -22.029 11.412 -7.739 1.00 0.00 H new ATOM 77 N GLU A 9 -17.479 12.823 -5.153 1.00 0.00 N ATOM 78 CA GLU A 9 -16.792 13.499 -4.059 1.00 0.00 C ATOM 79 C GLU A 9 -15.278 13.390 -4.217 1.00 0.00 C ATOM 80 O GLU A 9 -14.711 12.301 -4.140 1.00 0.00 O ATOM 81 CB GLU A 9 -17.219 12.905 -2.715 1.00 0.00 C ATOM 82 CG GLU A 9 -16.981 11.408 -2.608 1.00 0.00 C ATOM 83 CD GLU A 9 -17.524 10.821 -1.319 1.00 0.00 C ATOM 84 OE1 GLU A 9 -18.751 10.602 -1.237 1.00 0.00 O ATOM 85 OE2 GLU A 9 -16.722 10.582 -0.393 1.00 0.00 O ATOM 0 H GLU A 9 -17.856 11.906 -4.912 1.00 0.00 H new ATOM 0 HA GLU A 9 -17.068 14.553 -4.087 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -16.676 13.409 -1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -18.278 13.108 -2.558 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -17.449 10.908 -3.456 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -15.911 11.209 -2.671 1.00 0.00 H new ATOM 92 N GLY A 10 -14.629 14.529 -4.439 1.00 0.00 N ATOM 93 CA GLY A 10 -13.188 14.542 -4.605 1.00 0.00 C ATOM 94 C GLY A 10 -12.573 15.879 -4.242 1.00 0.00 C ATOM 95 O GLY A 10 -12.103 16.611 -5.112 1.00 0.00 O ATOM 0 H GLY A 10 -15.076 15.443 -4.507 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -12.747 13.762 -3.984 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.943 14.302 -5.640 1.00 0.00 H new ATOM 99 N GLY A 11 -12.578 16.200 -2.951 1.00 0.00 N ATOM 100 CA GLY A 11 -12.016 17.458 -2.498 1.00 0.00 C ATOM 101 C GLY A 11 -12.099 17.622 -0.993 1.00 0.00 C ATOM 102 O GLY A 11 -12.777 18.521 -0.496 1.00 0.00 O ATOM 0 H GLY A 11 -12.961 15.611 -2.212 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -10.973 17.520 -2.810 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -12.542 18.282 -2.980 1.00 0.00 H new ATOM 106 N VAL A 12 -11.409 16.749 -0.265 1.00 0.00 N ATOM 107 CA VAL A 12 -11.408 16.801 1.192 1.00 0.00 C ATOM 108 C VAL A 12 -10.161 17.503 1.716 1.00 0.00 C ATOM 109 O VAL A 12 -9.103 17.462 1.088 1.00 0.00 O ATOM 110 CB VAL A 12 -11.485 15.389 1.803 1.00 0.00 C ATOM 111 CG1 VAL A 12 -12.770 14.693 1.380 1.00 0.00 C ATOM 112 CG2 VAL A 12 -10.268 14.569 1.403 1.00 0.00 C ATOM 0 H VAL A 12 -10.844 15.998 -0.661 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.291 17.367 1.490 1.00 0.00 H new ATOM 0 HB VAL A 12 -11.491 15.482 2.889 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -12.807 13.697 1.821 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -13.627 15.273 1.722 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -12.798 14.610 0.294 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.339 13.574 1.843 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -10.228 14.483 0.317 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.364 15.061 1.762 1.00 0.00 H new ATOM 122 N ASP A 13 -10.293 18.146 2.871 1.00 0.00 N ATOM 123 CA ASP A 13 -9.175 18.857 3.482 1.00 0.00 C ATOM 124 C ASP A 13 -9.493 19.230 4.927 1.00 0.00 C ATOM 125 O ASP A 13 -10.633 19.105 5.373 1.00 0.00 O ATOM 126 CB ASP A 13 -8.843 20.115 2.679 1.00 0.00 C ATOM 127 CG ASP A 13 -7.510 20.719 3.074 1.00 0.00 C ATOM 128 OD1 ASP A 13 -7.448 21.380 4.132 1.00 0.00 O ATOM 129 OD2 ASP A 13 -6.528 20.530 2.325 1.00 0.00 O ATOM 0 H ASP A 13 -11.162 18.190 3.403 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.310 18.194 3.479 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.827 19.871 1.617 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.631 20.854 2.825 1.00 0.00 H new ATOM 134 N MET A 14 -8.477 19.686 5.652 1.00 0.00 N ATOM 135 CA MET A 14 -8.649 20.077 7.046 1.00 0.00 C ATOM 136 C MET A 14 -9.190 18.916 7.874 1.00 0.00 C ATOM 137 O MET A 14 -10.090 19.093 8.693 1.00 0.00 O ATOM 138 CB MET A 14 -9.595 21.276 7.149 1.00 0.00 C ATOM 139 CG MET A 14 -9.081 22.518 6.440 1.00 0.00 C ATOM 140 SD MET A 14 -10.052 23.988 6.823 1.00 0.00 S ATOM 141 CE MET A 14 -11.494 23.719 5.795 1.00 0.00 C ATOM 0 H MET A 14 -7.527 19.794 5.298 1.00 0.00 H new ATOM 0 HA MET A 14 -7.673 20.358 7.441 1.00 0.00 H new ATOM 0 HB2 MET A 14 -10.563 21.002 6.729 1.00 0.00 H new ATOM 0 HB3 MET A 14 -9.759 21.510 8.201 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.042 22.689 6.723 1.00 0.00 H new ATOM 0 HG3 MET A 14 -9.094 22.349 5.363 1.00 0.00 H new ATOM 0 HE1 MET A 14 -12.191 24.547 5.922 1.00 0.00 H new ATOM 0 HE2 MET A 14 -11.190 23.658 4.750 1.00 0.00 H new ATOM 0 HE3 MET A 14 -11.980 22.788 6.086 1.00 0.00 H new ATOM 151 N GLN A 15 -8.634 17.728 7.653 1.00 0.00 N ATOM 152 CA GLN A 15 -9.063 16.538 8.378 1.00 0.00 C ATOM 153 C GLN A 15 -8.542 16.558 9.811 1.00 0.00 C ATOM 154 O GLN A 15 -9.315 16.456 10.763 1.00 0.00 O ATOM 155 CB GLN A 15 -8.576 15.277 7.663 1.00 0.00 C ATOM 156 CG GLN A 15 -9.532 14.778 6.591 1.00 0.00 C ATOM 157 CD GLN A 15 -9.557 15.675 5.369 1.00 0.00 C ATOM 158 OE1 GLN A 15 -10.449 16.509 5.215 1.00 0.00 O ATOM 159 NE2 GLN A 15 -8.574 15.508 4.491 1.00 0.00 N ATOM 0 H GLN A 15 -7.887 17.565 6.978 1.00 0.00 H new ATOM 0 HA GLN A 15 -10.153 16.533 8.407 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -7.606 15.479 7.208 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -8.424 14.487 8.399 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -9.243 13.771 6.292 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -10.537 14.710 7.008 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -7.855 14.804 4.658 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -8.539 16.083 3.650 1.00 0.00 H new ATOM 168 N GLN A 16 -7.227 16.688 9.956 1.00 0.00 N ATOM 169 CA GLN A 16 -6.603 16.719 11.274 1.00 0.00 C ATOM 170 C GLN A 16 -5.902 18.052 11.513 1.00 0.00 C ATOM 171 O GLN A 16 -6.201 18.758 12.476 1.00 0.00 O ATOM 172 CB GLN A 16 -5.603 15.570 11.415 1.00 0.00 C ATOM 173 CG GLN A 16 -4.880 15.554 12.752 1.00 0.00 C ATOM 174 CD GLN A 16 -3.490 14.958 12.657 1.00 0.00 C ATOM 175 OE1 GLN A 16 -2.824 15.067 11.627 1.00 0.00 O ATOM 176 NE2 GLN A 16 -3.043 14.323 13.734 1.00 0.00 N ATOM 0 H GLN A 16 -6.573 16.774 9.178 1.00 0.00 H new ATOM 0 HA GLN A 16 -7.387 16.603 12.022 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.128 14.624 11.284 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.867 15.639 10.614 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.809 16.572 13.134 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.467 14.983 13.471 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.629 14.256 14.567 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -2.114 13.902 13.729 1.00 0.00 H new ATOM 185 N SER A 17 -4.967 18.390 10.630 1.00 0.00 N ATOM 186 CA SER A 17 -4.220 19.637 10.747 1.00 0.00 C ATOM 187 C SER A 17 -4.710 20.661 9.729 1.00 0.00 C ATOM 188 O SER A 17 -4.481 20.516 8.528 1.00 0.00 O ATOM 189 CB SER A 17 -2.725 19.380 10.552 1.00 0.00 C ATOM 190 OG SER A 17 -1.964 20.534 10.865 1.00 0.00 O ATOM 0 H SER A 17 -4.709 17.818 9.826 1.00 0.00 H new ATOM 0 HA SER A 17 -4.384 20.039 11.747 1.00 0.00 H new ATOM 0 HB2 SER A 17 -2.410 18.550 11.185 1.00 0.00 H new ATOM 0 HB3 SER A 17 -2.535 19.084 9.520 1.00 0.00 H new ATOM 0 HG SER A 17 -1.012 20.343 10.734 1.00 0.00 H new ATOM 196 N GLN A 18 -5.384 21.697 10.217 1.00 0.00 N ATOM 197 CA GLN A 18 -5.907 22.746 9.350 1.00 0.00 C ATOM 198 C GLN A 18 -5.096 24.029 9.497 1.00 0.00 C ATOM 199 O GLN A 18 -5.501 24.955 10.200 1.00 0.00 O ATOM 200 CB GLN A 18 -7.377 23.018 9.673 1.00 0.00 C ATOM 201 CG GLN A 18 -7.639 23.273 11.148 1.00 0.00 C ATOM 202 CD GLN A 18 -9.117 23.372 11.470 1.00 0.00 C ATOM 203 OE1 GLN A 18 -9.705 24.452 11.416 1.00 0.00 O ATOM 204 NE2 GLN A 18 -9.727 22.242 11.808 1.00 0.00 N ATOM 0 H GLN A 18 -5.581 21.833 11.209 1.00 0.00 H new ATOM 0 HA GLN A 18 -5.826 22.403 8.318 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -7.713 23.881 9.098 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -7.975 22.167 9.348 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -7.196 22.469 11.736 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -7.143 24.197 11.447 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -9.201 21.369 11.840 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -10.721 22.247 12.035 1.00 0.00 H new ATOM 213 N VAL A 19 -3.947 24.077 8.829 1.00 0.00 N ATOM 214 CA VAL A 19 -3.079 25.246 8.885 1.00 0.00 C ATOM 215 C VAL A 19 -3.605 26.364 7.992 1.00 0.00 C ATOM 216 O VAL A 19 -4.284 26.110 6.998 1.00 0.00 O ATOM 217 CB VAL A 19 -1.640 24.898 8.460 1.00 0.00 C ATOM 218 CG1 VAL A 19 -1.030 23.887 9.418 1.00 0.00 C ATOM 219 CG2 VAL A 19 -1.619 24.372 7.033 1.00 0.00 C ATOM 0 H VAL A 19 -3.597 23.319 8.243 1.00 0.00 H new ATOM 0 HA VAL A 19 -3.072 25.585 9.921 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.039 25.806 8.497 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.013 23.653 9.102 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -1.010 24.306 10.424 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.629 22.976 9.416 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.595 24.131 6.749 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -2.234 23.475 6.967 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.013 25.133 6.359 1.00 0.00 H new ATOM 229 N GLN A 20 -3.284 27.603 8.353 1.00 0.00 N ATOM 230 CA GLN A 20 -3.725 28.760 7.584 1.00 0.00 C ATOM 231 C GLN A 20 -2.592 29.303 6.720 1.00 0.00 C ATOM 232 O GLN A 20 -2.396 30.516 6.624 1.00 0.00 O ATOM 233 CB GLN A 20 -4.239 29.856 8.520 1.00 0.00 C ATOM 234 CG GLN A 20 -5.653 29.613 9.022 1.00 0.00 C ATOM 235 CD GLN A 20 -6.014 30.499 10.198 1.00 0.00 C ATOM 236 OE1 GLN A 20 -5.586 31.651 10.277 1.00 0.00 O ATOM 237 NE2 GLN A 20 -6.807 29.966 11.120 1.00 0.00 N ATOM 0 H GLN A 20 -2.721 27.830 9.172 1.00 0.00 H new ATOM 0 HA GLN A 20 -4.536 28.442 6.929 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -3.568 29.937 9.375 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -4.207 30.812 7.998 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.358 29.788 8.210 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -5.756 28.568 9.314 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -7.139 29.007 11.015 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -7.084 30.515 11.933 1.00 0.00 H new ATOM 246 N LEU A 21 -1.848 28.399 6.092 1.00 0.00 N ATOM 247 CA LEU A 21 -0.733 28.787 5.235 1.00 0.00 C ATOM 248 C LEU A 21 -0.746 27.995 3.932 1.00 0.00 C ATOM 249 O LEU A 21 -0.556 26.779 3.933 1.00 0.00 O ATOM 250 CB LEU A 21 0.595 28.572 5.964 1.00 0.00 C ATOM 251 CG LEU A 21 1.772 29.420 5.480 1.00 0.00 C ATOM 252 CD1 LEU A 21 2.847 29.501 6.552 1.00 0.00 C ATOM 253 CD2 LEU A 21 2.344 28.852 4.190 1.00 0.00 C ATOM 0 H LEU A 21 -1.997 27.392 6.160 1.00 0.00 H new ATOM 0 HA LEU A 21 -0.842 29.845 4.996 1.00 0.00 H new ATOM 0 HB2 LEU A 21 0.441 28.772 7.024 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.869 27.521 5.875 1.00 0.00 H new ATOM 0 HG LEU A 21 1.410 30.429 5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 21 3.677 30.108 6.190 1.00 0.00 H new ATOM 0 HD12 LEU A 21 2.431 29.955 7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 21 3.206 28.498 6.784 1.00 0.00 H new ATOM 0 HD21 LEU A 21 3.181 29.468 3.861 1.00 0.00 H new ATOM 0 HD22 LEU A 21 2.690 27.833 4.363 1.00 0.00 H new ATOM 0 HD23 LEU A 21 1.572 28.847 3.421 1.00 0.00 H new ATOM 265 N GLN A 22 -0.968 28.692 2.823 1.00 0.00 N ATOM 266 CA GLN A 22 -1.004 28.053 1.513 1.00 0.00 C ATOM 267 C GLN A 22 0.347 27.431 1.174 1.00 0.00 C ATOM 268 O GLN A 22 1.352 28.133 1.055 1.00 0.00 O ATOM 269 CB GLN A 22 -1.397 29.067 0.438 1.00 0.00 C ATOM 270 CG GLN A 22 -2.803 29.620 0.607 1.00 0.00 C ATOM 271 CD GLN A 22 -2.967 30.995 -0.009 1.00 0.00 C ATOM 272 OE1 GLN A 22 -2.026 31.551 -0.576 1.00 0.00 O ATOM 273 NE2 GLN A 22 -4.168 31.552 0.098 1.00 0.00 N ATOM 0 H GLN A 22 -1.126 29.700 2.805 1.00 0.00 H new ATOM 0 HA GLN A 22 -1.751 27.260 1.544 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -0.686 29.893 0.453 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.317 28.595 -0.541 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -3.516 28.934 0.150 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -3.044 29.671 1.669 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -4.920 31.055 0.576 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -4.339 32.476 -0.298 1.00 0.00 H new ATOM 282 N CYS A 23 0.363 26.112 1.019 1.00 0.00 N ATOM 283 CA CYS A 23 1.592 25.396 0.695 1.00 0.00 C ATOM 284 C CYS A 23 1.483 24.721 -0.669 1.00 0.00 C ATOM 285 O CYS A 23 0.427 24.224 -1.061 1.00 0.00 O ATOM 286 CB CYS A 23 1.898 24.353 1.770 1.00 0.00 C ATOM 287 SG CYS A 23 2.009 25.029 3.444 1.00 0.00 S ATOM 0 H CYS A 23 -0.460 25.517 1.112 1.00 0.00 H new ATOM 0 HA CYS A 23 2.407 26.119 0.659 1.00 0.00 H new ATOM 0 HB2 CYS A 23 1.122 23.587 1.750 1.00 0.00 H new ATOM 0 HB3 CYS A 23 2.839 23.860 1.526 1.00 0.00 H new ATOM 0 HG CYS A 23 0.964 25.764 3.686 1.00 0.00 H new ATOM 293 N PRO A 24 2.600 24.703 -1.411 1.00 0.00 N ATOM 294 CA PRO A 24 2.656 24.093 -2.743 1.00 0.00 C ATOM 295 C PRO A 24 2.550 22.573 -2.690 1.00 0.00 C ATOM 296 O PRO A 24 2.628 21.899 -3.717 1.00 0.00 O ATOM 297 CB PRO A 24 4.031 24.515 -3.269 1.00 0.00 C ATOM 298 CG PRO A 24 4.848 24.752 -2.046 1.00 0.00 C ATOM 299 CD PRO A 24 3.895 25.276 -1.007 1.00 0.00 C ATOM 0 HA PRO A 24 1.826 24.414 -3.373 1.00 0.00 H new ATOM 0 HB2 PRO A 24 4.471 23.738 -3.895 1.00 0.00 H new ATOM 0 HB3 PRO A 24 3.962 25.415 -3.880 1.00 0.00 H new ATOM 0 HG2 PRO A 24 5.324 23.831 -1.710 1.00 0.00 H new ATOM 0 HG3 PRO A 24 5.645 25.469 -2.242 1.00 0.00 H new ATOM 0 HD2 PRO A 24 4.180 24.958 -0.004 1.00 0.00 H new ATOM 0 HD3 PRO A 24 3.868 26.366 -1.000 1.00 0.00 H new ATOM 307 N LEU A 25 2.372 22.039 -1.486 1.00 0.00 N ATOM 308 CA LEU A 25 2.254 20.597 -1.299 1.00 0.00 C ATOM 309 C LEU A 25 0.837 20.216 -0.882 1.00 0.00 C ATOM 310 O LEU A 25 0.123 21.010 -0.269 1.00 0.00 O ATOM 311 CB LEU A 25 3.254 20.117 -0.246 1.00 0.00 C ATOM 312 CG LEU A 25 3.239 20.867 1.086 1.00 0.00 C ATOM 313 CD1 LEU A 25 2.139 20.329 1.989 1.00 0.00 C ATOM 314 CD2 LEU A 25 4.593 20.764 1.773 1.00 0.00 C ATOM 0 H LEU A 25 2.306 22.583 -0.625 1.00 0.00 H new ATOM 0 HA LEU A 25 2.476 20.112 -2.250 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.064 19.062 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.257 20.187 -0.668 1.00 0.00 H new ATOM 0 HG LEU A 25 3.035 21.919 0.886 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.143 20.875 2.933 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.173 20.456 1.501 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.312 19.270 2.181 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.563 21.304 2.719 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.827 19.716 1.960 1.00 0.00 H new ATOM 0 HD23 LEU A 25 5.360 21.198 1.132 1.00 0.00 H new ATOM 326 N THR A 26 0.435 18.994 -1.218 1.00 0.00 N ATOM 327 CA THR A 26 -0.895 18.506 -0.879 1.00 0.00 C ATOM 328 C THR A 26 -0.843 17.066 -0.383 1.00 0.00 C ATOM 329 O THR A 26 0.103 16.326 -0.651 1.00 0.00 O ATOM 330 CB THR A 26 -1.848 18.588 -2.086 1.00 0.00 C ATOM 331 OG1 THR A 26 -1.111 18.432 -3.304 1.00 0.00 O ATOM 332 CG2 THR A 26 -2.590 19.916 -2.102 1.00 0.00 C ATOM 0 H THR A 26 1.013 18.324 -1.725 1.00 0.00 H new ATOM 0 HA THR A 26 -1.273 19.147 -0.083 1.00 0.00 H new ATOM 0 HB THR A 26 -2.579 17.784 -1.999 1.00 0.00 H new ATOM 0 HG1 THR A 26 -1.556 17.769 -3.873 1.00 0.00 H new ATOM 0 HG21 THR A 26 -3.257 19.950 -2.964 1.00 0.00 H new ATOM 0 HG22 THR A 26 -3.174 20.018 -1.187 1.00 0.00 H new ATOM 0 HG23 THR A 26 -1.872 20.733 -2.167 1.00 0.00 H new ATOM 340 N PRO A 27 -1.884 16.656 0.357 1.00 0.00 N ATOM 341 CA PRO A 27 -1.980 15.300 0.905 1.00 0.00 C ATOM 342 C PRO A 27 -2.212 14.252 -0.178 1.00 0.00 C ATOM 343 O PRO A 27 -2.605 14.564 -1.303 1.00 0.00 O ATOM 344 CB PRO A 27 -3.190 15.380 1.839 1.00 0.00 C ATOM 345 CG PRO A 27 -4.017 16.492 1.294 1.00 0.00 C ATOM 346 CD PRO A 27 -3.047 17.485 0.716 1.00 0.00 C ATOM 0 HA PRO A 27 -1.059 14.995 1.403 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.745 14.442 1.849 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -2.885 15.580 2.866 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -4.705 16.129 0.531 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -4.622 16.948 2.077 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -3.463 17.993 -0.154 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.783 18.256 1.439 1.00 0.00 H new ATOM 354 N PRO A 28 -1.965 12.980 0.165 1.00 0.00 N ATOM 355 CA PRO A 28 -2.142 11.860 -0.764 1.00 0.00 C ATOM 356 C PRO A 28 -3.610 11.593 -1.078 1.00 0.00 C ATOM 357 O PRO A 28 -4.458 11.613 -0.186 1.00 0.00 O ATOM 358 CB PRO A 28 -1.531 10.675 -0.012 1.00 0.00 C ATOM 359 CG PRO A 28 -1.645 11.041 1.428 1.00 0.00 C ATOM 360 CD PRO A 28 -1.495 12.535 1.488 1.00 0.00 C ATOM 0 HA PRO A 28 -1.676 12.055 -1.730 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -2.066 9.750 -0.229 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -0.491 10.517 -0.299 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.607 10.729 1.835 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -0.873 10.547 2.019 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.091 12.966 2.292 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.460 12.828 1.666 1.00 0.00 H new ATOM 368 N ARG A 29 -3.902 11.342 -2.350 1.00 0.00 N ATOM 369 CA ARG A 29 -5.268 11.071 -2.781 1.00 0.00 C ATOM 370 C ARG A 29 -5.321 9.837 -3.676 1.00 0.00 C ATOM 371 O ARG A 29 -4.288 9.282 -4.048 1.00 0.00 O ATOM 372 CB ARG A 29 -5.840 12.279 -3.525 1.00 0.00 C ATOM 373 CG ARG A 29 -5.057 12.651 -4.774 1.00 0.00 C ATOM 374 CD ARG A 29 -5.147 14.141 -5.065 1.00 0.00 C ATOM 375 NE ARG A 29 -4.771 14.453 -6.441 1.00 0.00 N ATOM 376 CZ ARG A 29 -5.602 14.348 -7.472 1.00 0.00 C ATOM 377 NH1 ARG A 29 -6.850 13.942 -7.283 1.00 0.00 N ATOM 378 NH2 ARG A 29 -5.186 14.651 -8.695 1.00 0.00 N ATOM 0 H ARG A 29 -3.211 11.321 -3.100 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.871 10.881 -1.893 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -6.873 12.068 -3.803 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -5.860 13.135 -2.850 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.012 12.366 -4.648 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -5.440 12.089 -5.626 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.164 14.486 -4.880 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -4.497 14.684 -4.379 1.00 0.00 H new ATOM 0 HE ARG A 29 -3.818 14.769 -6.620 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -7.174 13.709 -6.344 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -7.486 13.862 -8.076 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -4.227 14.965 -8.844 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -5.825 14.570 -9.486 1.00 0.00 H new ATOM 392 N GLY A 30 -6.534 9.412 -4.018 1.00 0.00 N ATOM 393 CA GLY A 30 -6.700 8.246 -4.866 1.00 0.00 C ATOM 394 C GLY A 30 -5.630 7.199 -4.628 1.00 0.00 C ATOM 395 O GLY A 30 -5.015 6.702 -5.573 1.00 0.00 O ATOM 0 H GLY A 30 -7.404 9.855 -3.723 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.681 7.806 -4.686 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -6.676 8.554 -5.911 1.00 0.00 H new ATOM 399 N LEU A 31 -5.404 6.864 -3.363 1.00 0.00 N ATOM 400 CA LEU A 31 -4.398 5.870 -3.002 1.00 0.00 C ATOM 401 C LEU A 31 -5.052 4.536 -2.656 1.00 0.00 C ATOM 402 O LEU A 31 -5.696 4.401 -1.616 1.00 0.00 O ATOM 403 CB LEU A 31 -3.564 6.365 -1.819 1.00 0.00 C ATOM 404 CG LEU A 31 -2.374 5.490 -1.425 1.00 0.00 C ATOM 405 CD1 LEU A 31 -2.839 4.091 -1.053 1.00 0.00 C ATOM 406 CD2 LEU A 31 -1.356 5.433 -2.555 1.00 0.00 C ATOM 0 H LEU A 31 -5.903 7.266 -2.569 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.744 5.721 -3.861 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -3.194 7.363 -2.053 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.220 6.463 -0.954 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.895 5.935 -0.553 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -1.978 3.483 -0.776 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.529 4.149 -0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.344 3.637 -1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -0.516 4.806 -2.257 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.824 5.013 -3.445 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.998 6.439 -2.773 1.00 0.00 H new ATOM 418 N GLN A 32 -4.878 3.552 -3.533 1.00 0.00 N ATOM 419 CA GLN A 32 -5.450 2.228 -3.318 1.00 0.00 C ATOM 420 C GLN A 32 -4.586 1.151 -3.966 1.00 0.00 C ATOM 421 O GLN A 32 -3.663 1.452 -4.722 1.00 0.00 O ATOM 422 CB GLN A 32 -6.871 2.166 -3.881 1.00 0.00 C ATOM 423 CG GLN A 32 -6.946 2.430 -5.376 1.00 0.00 C ATOM 424 CD GLN A 32 -8.356 2.316 -5.919 1.00 0.00 C ATOM 425 OE1 GLN A 32 -9.128 3.275 -5.883 1.00 0.00 O ATOM 426 NE2 GLN A 32 -8.702 1.138 -6.426 1.00 0.00 N ATOM 0 H GLN A 32 -4.346 3.647 -4.398 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.484 2.044 -2.244 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.293 1.183 -3.673 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -7.491 2.896 -3.360 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -6.560 3.428 -5.585 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -6.301 1.723 -5.899 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.031 0.370 -6.436 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -9.639 1.001 -6.805 1.00 0.00 H new ATOM 435 N VAL A 33 -4.892 -0.107 -3.664 1.00 0.00 N ATOM 436 CA VAL A 33 -4.144 -1.230 -4.217 1.00 0.00 C ATOM 437 C VAL A 33 -5.047 -2.136 -5.047 1.00 0.00 C ATOM 438 O VAL A 33 -6.263 -2.159 -4.858 1.00 0.00 O ATOM 439 CB VAL A 33 -3.480 -2.064 -3.106 1.00 0.00 C ATOM 440 CG1 VAL A 33 -2.412 -1.250 -2.393 1.00 0.00 C ATOM 441 CG2 VAL A 33 -4.525 -2.567 -2.121 1.00 0.00 C ATOM 0 H VAL A 33 -5.653 -0.374 -3.039 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.369 -0.809 -4.857 1.00 0.00 H new ATOM 0 HB VAL A 33 -2.999 -2.929 -3.563 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.954 -1.856 -1.611 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.649 -0.944 -3.109 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.866 -0.365 -1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -4.038 -3.155 -1.343 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -5.037 -1.718 -1.668 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -5.250 -3.190 -2.646 1.00 0.00 H new ATOM 451 N SER A 34 -4.444 -2.881 -5.967 1.00 0.00 N ATOM 452 CA SER A 34 -5.193 -3.788 -6.829 1.00 0.00 C ATOM 453 C SER A 34 -4.377 -5.037 -7.145 1.00 0.00 C ATOM 454 O SER A 34 -3.169 -5.077 -6.911 1.00 0.00 O ATOM 455 CB SER A 34 -5.588 -3.081 -8.127 1.00 0.00 C ATOM 456 OG SER A 34 -4.478 -2.964 -9.001 1.00 0.00 O ATOM 0 H SER A 34 -3.438 -2.875 -6.135 1.00 0.00 H new ATOM 0 HA SER A 34 -6.096 -4.091 -6.298 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.386 -3.637 -8.619 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.982 -2.091 -7.900 1.00 0.00 H new ATOM 0 HG SER A 34 -3.744 -2.509 -8.538 1.00 0.00 H new ATOM 462 N ILE A 35 -5.046 -6.055 -7.676 1.00 0.00 N ATOM 463 CA ILE A 35 -4.383 -7.305 -8.025 1.00 0.00 C ATOM 464 C ILE A 35 -4.164 -7.410 -9.531 1.00 0.00 C ATOM 465 O ILE A 35 -5.108 -7.303 -10.313 1.00 0.00 O ATOM 466 CB ILE A 35 -5.195 -8.524 -7.550 1.00 0.00 C ATOM 467 CG1 ILE A 35 -5.387 -8.477 -6.033 1.00 0.00 C ATOM 468 CG2 ILE A 35 -4.503 -9.815 -7.962 1.00 0.00 C ATOM 469 CD1 ILE A 35 -6.558 -9.300 -5.545 1.00 0.00 C ATOM 0 H ILE A 35 -6.046 -6.038 -7.874 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.417 -7.302 -7.519 1.00 0.00 H new ATOM 0 HB ILE A 35 -6.177 -8.494 -8.023 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.477 -8.832 -5.549 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.528 -7.441 -5.725 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -5.089 -10.668 -7.619 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.414 -9.849 -9.048 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -3.510 -9.854 -7.515 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.633 -9.219 -4.461 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.477 -8.931 -6.001 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -6.410 -10.344 -5.822 1.00 0.00 H new ATOM 481 N GLN A 36 -2.913 -7.622 -9.928 1.00 0.00 N ATOM 482 CA GLN A 36 -2.571 -7.742 -11.340 1.00 0.00 C ATOM 483 C GLN A 36 -3.605 -8.584 -12.081 1.00 0.00 C ATOM 484 O GLN A 36 -3.524 -9.811 -12.099 1.00 0.00 O ATOM 485 CB GLN A 36 -1.182 -8.364 -11.498 1.00 0.00 C ATOM 486 CG GLN A 36 -0.691 -8.396 -12.936 1.00 0.00 C ATOM 487 CD GLN A 36 -0.755 -7.037 -13.606 1.00 0.00 C ATOM 488 OE1 GLN A 36 -0.580 -6.005 -12.959 1.00 0.00 O ATOM 489 NE2 GLN A 36 -1.007 -7.031 -14.910 1.00 0.00 N ATOM 0 H GLN A 36 -2.121 -7.714 -9.292 1.00 0.00 H new ATOM 0 HA GLN A 36 -2.566 -6.742 -11.773 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -0.471 -7.803 -10.892 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -1.202 -9.381 -11.107 1.00 0.00 H new ATOM 0 HG2 GLN A 36 0.337 -8.759 -12.957 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -1.291 -9.106 -13.505 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -1.146 -7.911 -15.407 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -1.062 -6.146 -15.415 1.00 0.00 H new ATOM 498 N GLY A 37 -4.578 -7.914 -12.691 1.00 0.00 N ATOM 499 CA GLY A 37 -5.615 -8.617 -13.425 1.00 0.00 C ATOM 500 C GLY A 37 -6.781 -9.015 -12.543 1.00 0.00 C ATOM 501 O GLY A 37 -6.596 -9.671 -11.518 1.00 0.00 O ATOM 0 H GLY A 37 -4.667 -6.898 -12.690 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.976 -7.983 -14.235 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.190 -9.509 -13.884 1.00 0.00 H new ATOM 505 N GLU A 38 -7.985 -8.617 -12.941 1.00 0.00 N ATOM 506 CA GLU A 38 -9.186 -8.935 -12.176 1.00 0.00 C ATOM 507 C GLU A 38 -9.319 -10.442 -11.975 1.00 0.00 C ATOM 508 O GLU A 38 -9.627 -11.179 -12.912 1.00 0.00 O ATOM 509 CB GLU A 38 -10.428 -8.392 -12.885 1.00 0.00 C ATOM 510 CG GLU A 38 -11.652 -8.307 -11.989 1.00 0.00 C ATOM 511 CD GLU A 38 -12.894 -7.868 -12.739 1.00 0.00 C ATOM 512 OE1 GLU A 38 -13.269 -8.547 -13.718 1.00 0.00 O ATOM 513 OE2 GLU A 38 -13.493 -6.844 -12.347 1.00 0.00 O ATOM 0 H GLU A 38 -8.155 -8.074 -13.788 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.099 -8.461 -11.198 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -10.207 -7.400 -13.279 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -10.657 -9.030 -13.739 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -11.832 -9.281 -11.533 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.456 -7.607 -11.177 1.00 0.00 H new ATOM 520 N ALA A 39 -9.085 -10.892 -10.747 1.00 0.00 N ATOM 521 CA ALA A 39 -9.180 -12.310 -10.422 1.00 0.00 C ATOM 522 C ALA A 39 -10.385 -12.589 -9.530 1.00 0.00 C ATOM 523 O ALA A 39 -10.744 -11.772 -8.681 1.00 0.00 O ATOM 524 CB ALA A 39 -7.901 -12.784 -9.748 1.00 0.00 C ATOM 0 H ALA A 39 -8.828 -10.295 -9.961 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.314 -12.862 -11.352 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -7.986 -13.845 -9.511 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.057 -12.629 -10.420 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.743 -12.219 -8.830 1.00 0.00 H new ATOM 530 N VAL A 40 -11.007 -13.747 -9.727 1.00 0.00 N ATOM 531 CA VAL A 40 -12.171 -14.133 -8.940 1.00 0.00 C ATOM 532 C VAL A 40 -11.779 -15.064 -7.798 1.00 0.00 C ATOM 533 O VAL A 40 -11.928 -14.723 -6.626 1.00 0.00 O ATOM 534 CB VAL A 40 -13.233 -14.829 -9.813 1.00 0.00 C ATOM 535 CG1 VAL A 40 -14.413 -15.275 -8.964 1.00 0.00 C ATOM 536 CG2 VAL A 40 -13.690 -13.905 -10.932 1.00 0.00 C ATOM 0 H VAL A 40 -10.724 -14.434 -10.425 1.00 0.00 H new ATOM 0 HA VAL A 40 -12.593 -13.216 -8.529 1.00 0.00 H new ATOM 0 HB VAL A 40 -12.785 -15.715 -10.263 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -15.153 -15.764 -9.598 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -14.069 -15.974 -8.201 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -14.864 -14.407 -8.483 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -14.440 -14.412 -11.539 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -14.121 -13.000 -10.504 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -12.837 -13.640 -11.556 1.00 0.00 H new ATOM 546 N ALA A 41 -11.274 -16.243 -8.150 1.00 0.00 N ATOM 547 CA ALA A 41 -10.857 -17.223 -7.155 1.00 0.00 C ATOM 548 C ALA A 41 -9.504 -17.827 -7.514 1.00 0.00 C ATOM 549 O ALA A 41 -9.383 -18.568 -8.489 1.00 0.00 O ATOM 550 CB ALA A 41 -11.907 -18.316 -7.019 1.00 0.00 C ATOM 0 H ALA A 41 -11.144 -16.542 -9.117 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.755 -16.712 -6.198 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.583 -19.041 -6.273 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -12.854 -17.874 -6.708 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -12.038 -18.817 -7.978 1.00 0.00 H new ATOM 556 N VAL A 42 -8.488 -17.506 -6.719 1.00 0.00 N ATOM 557 CA VAL A 42 -7.143 -18.018 -6.953 1.00 0.00 C ATOM 558 C VAL A 42 -6.892 -19.290 -6.150 1.00 0.00 C ATOM 559 O VAL A 42 -7.532 -19.525 -5.125 1.00 0.00 O ATOM 560 CB VAL A 42 -6.073 -16.973 -6.586 1.00 0.00 C ATOM 561 CG1 VAL A 42 -4.756 -17.653 -6.246 1.00 0.00 C ATOM 562 CG2 VAL A 42 -5.891 -15.976 -7.721 1.00 0.00 C ATOM 0 H VAL A 42 -8.571 -16.894 -5.907 1.00 0.00 H new ATOM 0 HA VAL A 42 -7.070 -18.243 -8.017 1.00 0.00 H new ATOM 0 HB VAL A 42 -6.410 -16.428 -5.704 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -4.012 -16.898 -5.989 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -4.901 -18.323 -5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -4.410 -18.226 -7.106 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -5.131 -15.245 -7.445 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.577 -16.503 -8.622 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -6.835 -15.465 -7.911 1.00 0.00 H new ATOM 572 N ARG A 43 -5.956 -20.106 -6.623 1.00 0.00 N ATOM 573 CA ARG A 43 -5.620 -21.355 -5.949 1.00 0.00 C ATOM 574 C ARG A 43 -4.607 -21.115 -4.834 1.00 0.00 C ATOM 575 O ARG A 43 -3.793 -20.194 -4.888 1.00 0.00 O ATOM 576 CB ARG A 43 -5.061 -22.365 -6.952 1.00 0.00 C ATOM 577 CG ARG A 43 -6.135 -23.136 -7.703 1.00 0.00 C ATOM 578 CD ARG A 43 -6.541 -22.422 -8.983 1.00 0.00 C ATOM 579 NE ARG A 43 -7.763 -22.980 -9.557 1.00 0.00 N ATOM 580 CZ ARG A 43 -8.083 -22.880 -10.842 1.00 0.00 C ATOM 581 NH1 ARG A 43 -7.275 -22.249 -11.683 1.00 0.00 N ATOM 582 NH2 ARG A 43 -9.213 -23.414 -11.289 1.00 0.00 N ATOM 0 H ARG A 43 -5.417 -19.925 -7.470 1.00 0.00 H new ATOM 0 HA ARG A 43 -6.532 -21.758 -5.508 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -4.432 -21.840 -7.671 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -4.420 -23.072 -6.425 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -5.768 -24.134 -7.943 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.008 -23.263 -7.063 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -6.689 -21.362 -8.776 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -5.733 -22.495 -9.711 1.00 0.00 H new ATOM 0 HE ARG A 43 -8.405 -23.473 -8.937 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.405 -21.839 -11.343 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -7.523 -22.174 -12.669 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -9.836 -23.902 -10.645 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -9.458 -23.337 -12.276 1.00 0.00 H new ATOM 596 N PRO A 44 -4.657 -21.965 -3.797 1.00 0.00 N ATOM 597 CA PRO A 44 -3.750 -21.866 -2.649 1.00 0.00 C ATOM 598 C PRO A 44 -2.316 -22.236 -3.009 1.00 0.00 C ATOM 599 O PRO A 44 -1.986 -23.412 -3.156 1.00 0.00 O ATOM 600 CB PRO A 44 -4.329 -22.874 -1.653 1.00 0.00 C ATOM 601 CG PRO A 44 -5.061 -23.861 -2.495 1.00 0.00 C ATOM 602 CD PRO A 44 -5.601 -23.086 -3.665 1.00 0.00 C ATOM 0 HA PRO A 44 -3.691 -20.849 -2.262 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -3.541 -23.355 -1.074 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -4.997 -22.388 -0.941 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -4.397 -24.659 -2.828 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -5.868 -24.332 -1.933 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -5.632 -23.694 -4.569 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -6.617 -22.736 -3.481 1.00 0.00 H new ATOM 610 N GLY A 45 -1.465 -21.224 -3.150 1.00 0.00 N ATOM 611 CA GLY A 45 -0.076 -21.464 -3.492 1.00 0.00 C ATOM 612 C GLY A 45 0.318 -20.822 -4.807 1.00 0.00 C ATOM 613 O GLY A 45 1.227 -21.294 -5.489 1.00 0.00 O ATOM 0 H GLY A 45 -1.714 -20.242 -3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 45 0.562 -21.078 -2.697 1.00 0.00 H new ATOM 0 HA3 GLY A 45 0.100 -22.538 -3.549 1.00 0.00 H new ATOM 617 N GLU A 46 -0.370 -19.742 -5.165 1.00 0.00 N ATOM 618 CA GLU A 46 -0.088 -19.036 -6.410 1.00 0.00 C ATOM 619 C GLU A 46 0.321 -17.591 -6.135 1.00 0.00 C ATOM 620 O GLU A 46 -0.487 -16.782 -5.679 1.00 0.00 O ATOM 621 CB GLU A 46 -1.313 -19.064 -7.327 1.00 0.00 C ATOM 622 CG GLU A 46 -1.391 -20.307 -8.198 1.00 0.00 C ATOM 623 CD GLU A 46 -0.303 -20.349 -9.253 1.00 0.00 C ATOM 624 OE1 GLU A 46 -0.066 -19.309 -9.902 1.00 0.00 O ATOM 625 OE2 GLU A 46 0.311 -21.422 -9.431 1.00 0.00 O ATOM 0 H GLU A 46 -1.125 -19.337 -4.612 1.00 0.00 H new ATOM 0 HA GLU A 46 0.740 -19.543 -6.906 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.214 -19.000 -6.718 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -1.298 -18.182 -7.967 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.315 -21.193 -7.568 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -2.366 -20.344 -8.685 1.00 0.00 H new ATOM 632 N ASP A 47 1.581 -17.277 -6.414 1.00 0.00 N ATOM 633 CA ASP A 47 2.099 -15.930 -6.198 1.00 0.00 C ATOM 634 C ASP A 47 1.247 -14.897 -6.928 1.00 0.00 C ATOM 635 O ASP A 47 1.083 -14.960 -8.147 1.00 0.00 O ATOM 636 CB ASP A 47 3.551 -15.838 -6.670 1.00 0.00 C ATOM 637 CG ASP A 47 3.787 -16.585 -7.967 1.00 0.00 C ATOM 638 OD1 ASP A 47 3.757 -17.833 -7.947 1.00 0.00 O ATOM 639 OD2 ASP A 47 4.002 -15.922 -9.004 1.00 0.00 O ATOM 0 H ASP A 47 2.263 -17.936 -6.790 1.00 0.00 H new ATOM 0 HA ASP A 47 2.058 -15.718 -5.130 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.821 -14.790 -6.803 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.207 -16.240 -5.898 1.00 0.00 H new ATOM 644 N VAL A 48 0.705 -13.945 -6.175 1.00 0.00 N ATOM 645 CA VAL A 48 -0.131 -12.898 -6.750 1.00 0.00 C ATOM 646 C VAL A 48 0.590 -11.554 -6.743 1.00 0.00 C ATOM 647 O VAL A 48 1.393 -11.272 -5.852 1.00 0.00 O ATOM 648 CB VAL A 48 -1.461 -12.758 -5.985 1.00 0.00 C ATOM 649 CG1 VAL A 48 -1.208 -12.332 -4.547 1.00 0.00 C ATOM 650 CG2 VAL A 48 -2.378 -11.770 -6.690 1.00 0.00 C ATOM 0 H VAL A 48 0.830 -13.877 -5.165 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.341 -13.190 -7.779 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.955 -13.729 -5.968 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.159 -12.238 -4.023 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.591 -13.080 -4.049 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.692 -11.372 -4.537 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -3.313 -11.683 -6.137 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -1.893 -10.795 -6.739 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -2.586 -12.123 -7.700 1.00 0.00 H new ATOM 660 N LEU A 49 0.299 -10.728 -7.742 1.00 0.00 N ATOM 661 CA LEU A 49 0.919 -9.412 -7.852 1.00 0.00 C ATOM 662 C LEU A 49 -0.064 -8.313 -7.462 1.00 0.00 C ATOM 663 O LEU A 49 -1.259 -8.407 -7.742 1.00 0.00 O ATOM 664 CB LEU A 49 1.422 -9.181 -9.278 1.00 0.00 C ATOM 665 CG LEU A 49 2.631 -10.012 -9.706 1.00 0.00 C ATOM 666 CD1 LEU A 49 3.872 -9.583 -8.939 1.00 0.00 C ATOM 667 CD2 LEU A 49 2.360 -11.495 -9.498 1.00 0.00 C ATOM 0 H LEU A 49 -0.362 -10.946 -8.487 1.00 0.00 H new ATOM 0 HA LEU A 49 1.765 -9.377 -7.165 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.603 -9.385 -9.968 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.675 -8.126 -9.386 1.00 0.00 H new ATOM 0 HG LEU A 49 2.807 -9.841 -10.768 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.723 -10.186 -9.257 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.078 -8.531 -9.138 1.00 0.00 H new ATOM 0 HD13 LEU A 49 3.706 -9.724 -7.871 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.232 -12.071 -9.808 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.157 -11.683 -8.444 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.497 -11.794 -10.093 1.00 0.00 H new ATOM 679 N PHE A 50 0.448 -7.270 -6.817 1.00 0.00 N ATOM 680 CA PHE A 50 -0.385 -6.151 -6.390 1.00 0.00 C ATOM 681 C PHE A 50 0.069 -4.853 -7.051 1.00 0.00 C ATOM 682 O PHE A 50 1.161 -4.353 -6.780 1.00 0.00 O ATOM 683 CB PHE A 50 -0.338 -6.005 -4.868 1.00 0.00 C ATOM 684 CG PHE A 50 -1.309 -6.899 -4.150 1.00 0.00 C ATOM 685 CD1 PHE A 50 -2.625 -6.509 -3.967 1.00 0.00 C ATOM 686 CD2 PHE A 50 -0.904 -8.129 -3.658 1.00 0.00 C ATOM 687 CE1 PHE A 50 -3.521 -7.329 -3.307 1.00 0.00 C ATOM 688 CE2 PHE A 50 -1.795 -8.954 -2.997 1.00 0.00 C ATOM 689 CZ PHE A 50 -3.105 -8.553 -2.821 1.00 0.00 C ATOM 0 H PHE A 50 1.435 -7.176 -6.578 1.00 0.00 H new ATOM 0 HA PHE A 50 -1.411 -6.355 -6.697 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.671 -6.225 -4.521 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.547 -4.968 -4.604 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.955 -5.553 -4.344 1.00 0.00 H new ATOM 0 HD2 PHE A 50 0.119 -8.447 -3.792 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -4.545 -7.013 -3.172 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -1.467 -9.911 -2.619 1.00 0.00 H new ATOM 0 HZ PHE A 50 -3.803 -9.195 -2.304 1.00 0.00 H new ATOM 699 N VAL A 51 -0.779 -4.311 -7.921 1.00 0.00 N ATOM 700 CA VAL A 51 -0.467 -3.071 -8.621 1.00 0.00 C ATOM 701 C VAL A 51 -0.920 -1.857 -7.818 1.00 0.00 C ATOM 702 O VAL A 51 -2.040 -1.820 -7.308 1.00 0.00 O ATOM 703 CB VAL A 51 -1.129 -3.029 -10.011 1.00 0.00 C ATOM 704 CG1 VAL A 51 -0.843 -1.703 -10.699 1.00 0.00 C ATOM 705 CG2 VAL A 51 -0.652 -4.195 -10.863 1.00 0.00 C ATOM 0 H VAL A 51 -1.687 -4.712 -8.157 1.00 0.00 H new ATOM 0 HA VAL A 51 0.616 -3.040 -8.741 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.208 -3.119 -9.884 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.319 -1.692 -11.680 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.238 -0.887 -10.095 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.234 -1.579 -10.817 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -1.130 -4.150 -11.842 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.430 -4.138 -10.984 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -0.914 -5.134 -10.375 1.00 0.00 H new ATOM 715 N VAL A 52 -0.042 -0.865 -7.708 1.00 0.00 N ATOM 716 CA VAL A 52 -0.352 0.352 -6.968 1.00 0.00 C ATOM 717 C VAL A 52 -0.446 1.554 -7.901 1.00 0.00 C ATOM 718 O VAL A 52 0.267 1.633 -8.902 1.00 0.00 O ATOM 719 CB VAL A 52 0.707 0.636 -5.887 1.00 0.00 C ATOM 720 CG1 VAL A 52 2.069 0.873 -6.522 1.00 0.00 C ATOM 721 CG2 VAL A 52 0.293 1.827 -5.035 1.00 0.00 C ATOM 0 H VAL A 52 0.890 -0.881 -8.122 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.317 0.193 -6.487 1.00 0.00 H new ATOM 0 HB VAL A 52 0.782 -0.237 -5.239 1.00 0.00 H new ATOM 0 HG11 VAL A 52 2.804 1.072 -5.742 1.00 0.00 H new ATOM 0 HG12 VAL A 52 2.367 -0.012 -7.085 1.00 0.00 H new ATOM 0 HG13 VAL A 52 2.013 1.729 -7.195 1.00 0.00 H new ATOM 0 HG21 VAL A 52 1.053 2.013 -4.276 1.00 0.00 H new ATOM 0 HG22 VAL A 52 0.188 2.708 -5.668 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -0.659 1.614 -4.550 1.00 0.00 H new ATOM 731 N ARG A 53 -1.329 2.489 -7.566 1.00 0.00 N ATOM 732 CA ARG A 53 -1.517 3.687 -8.374 1.00 0.00 C ATOM 733 C ARG A 53 -1.947 4.867 -7.506 1.00 0.00 C ATOM 734 O ARG A 53 -2.521 4.682 -6.433 1.00 0.00 O ATOM 735 CB ARG A 53 -2.561 3.435 -9.464 1.00 0.00 C ATOM 736 CG ARG A 53 -2.593 4.511 -10.537 1.00 0.00 C ATOM 737 CD ARG A 53 -3.860 4.425 -11.374 1.00 0.00 C ATOM 738 NE ARG A 53 -3.672 4.983 -12.710 1.00 0.00 N ATOM 739 CZ ARG A 53 -3.127 4.311 -13.717 1.00 0.00 C ATOM 740 NH1 ARG A 53 -2.718 3.062 -13.541 1.00 0.00 N ATOM 741 NH2 ARG A 53 -2.989 4.887 -14.905 1.00 0.00 N ATOM 0 H ARG A 53 -1.926 2.440 -6.740 1.00 0.00 H new ATOM 0 HA ARG A 53 -0.564 3.931 -8.843 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -2.359 2.472 -9.933 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -3.546 3.365 -9.003 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -2.530 5.494 -10.070 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -1.721 4.408 -11.183 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -4.170 3.383 -11.457 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -4.665 4.958 -10.869 1.00 0.00 H new ATOM 0 HE ARG A 53 -3.976 5.942 -12.879 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -2.822 2.615 -12.630 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -2.300 2.548 -14.317 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -3.302 5.848 -15.045 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -2.570 4.369 -15.677 1.00 0.00 H new ATOM 755 N GLN A 54 -1.664 6.076 -7.978 1.00 0.00 N ATOM 756 CA GLN A 54 -2.020 7.285 -7.244 1.00 0.00 C ATOM 757 C GLN A 54 -2.727 8.285 -8.153 1.00 0.00 C ATOM 758 O GLN A 54 -2.631 8.201 -9.377 1.00 0.00 O ATOM 759 CB GLN A 54 -0.770 7.925 -6.637 1.00 0.00 C ATOM 760 CG GLN A 54 -0.488 7.476 -5.212 1.00 0.00 C ATOM 761 CD GLN A 54 0.987 7.518 -4.868 1.00 0.00 C ATOM 762 OE1 GLN A 54 1.752 6.632 -5.252 1.00 0.00 O ATOM 763 NE2 GLN A 54 1.397 8.550 -4.140 1.00 0.00 N ATOM 0 H GLN A 54 -1.189 6.245 -8.865 1.00 0.00 H new ATOM 0 HA GLN A 54 -2.703 7.005 -6.442 1.00 0.00 H new ATOM 0 HB2 GLN A 54 0.091 7.686 -7.262 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.883 9.009 -6.652 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.037 8.113 -4.519 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.860 6.461 -5.075 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.730 9.262 -3.843 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.379 8.631 -3.878 1.00 0.00 H new ATOM 772 N GLU A 55 -3.437 9.230 -7.545 1.00 0.00 N ATOM 773 CA GLU A 55 -4.162 10.245 -8.301 1.00 0.00 C ATOM 774 C GLU A 55 -3.371 11.550 -8.356 1.00 0.00 C ATOM 775 O GLU A 55 -3.552 12.358 -9.266 1.00 0.00 O ATOM 776 CB GLU A 55 -5.536 10.495 -7.675 1.00 0.00 C ATOM 777 CG GLU A 55 -6.619 9.564 -8.194 1.00 0.00 C ATOM 778 CD GLU A 55 -7.184 10.014 -9.527 1.00 0.00 C ATOM 779 OE1 GLU A 55 -7.293 11.239 -9.744 1.00 0.00 O ATOM 780 OE2 GLU A 55 -7.519 9.140 -10.354 1.00 0.00 O ATOM 0 H GLU A 55 -3.526 9.314 -6.532 1.00 0.00 H new ATOM 0 HA GLU A 55 -4.296 9.877 -9.318 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -5.459 10.382 -6.594 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -5.832 11.526 -7.868 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -6.210 8.559 -8.297 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.425 9.507 -7.462 1.00 0.00 H new ATOM 787 N GLN A 56 -2.495 11.746 -7.376 1.00 0.00 N ATOM 788 CA GLN A 56 -1.679 12.952 -7.312 1.00 0.00 C ATOM 789 C GLN A 56 -0.369 12.763 -8.071 1.00 0.00 C ATOM 790 O GLN A 56 0.192 13.718 -8.607 1.00 0.00 O ATOM 791 CB GLN A 56 -1.389 13.321 -5.856 1.00 0.00 C ATOM 792 CG GLN A 56 -1.092 14.798 -5.650 1.00 0.00 C ATOM 793 CD GLN A 56 -1.487 15.285 -4.269 1.00 0.00 C ATOM 794 OE1 GLN A 56 -2.271 16.224 -4.131 1.00 0.00 O ATOM 795 NE2 GLN A 56 -0.944 14.647 -3.239 1.00 0.00 N ATOM 0 H GLN A 56 -2.332 11.085 -6.616 1.00 0.00 H new ATOM 0 HA GLN A 56 -2.237 13.763 -7.781 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -2.245 13.042 -5.242 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -0.540 12.736 -5.504 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -0.028 14.976 -5.803 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -1.624 15.380 -6.402 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -0.299 13.874 -3.401 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -1.172 14.930 -2.286 1.00 0.00 H new ATOM 804 N GLY A 57 0.112 11.525 -8.112 1.00 0.00 N ATOM 805 CA GLY A 57 1.352 11.234 -8.807 1.00 0.00 C ATOM 806 C GLY A 57 2.559 11.295 -7.892 1.00 0.00 C ATOM 807 O GLY A 57 3.632 11.741 -8.297 1.00 0.00 O ATOM 0 H GLY A 57 -0.335 10.718 -7.676 1.00 0.00 H new ATOM 0 HA2 GLY A 57 1.289 10.242 -9.255 1.00 0.00 H new ATOM 0 HA3 GLY A 57 1.483 11.945 -9.623 1.00 0.00 H new ATOM 811 N ASP A 58 2.383 10.847 -6.654 1.00 0.00 N ATOM 812 CA ASP A 58 3.466 10.853 -5.677 1.00 0.00 C ATOM 813 C ASP A 58 4.045 12.255 -5.516 1.00 0.00 C ATOM 814 O ASP A 58 5.257 12.451 -5.600 1.00 0.00 O ATOM 815 CB ASP A 58 4.567 9.878 -6.099 1.00 0.00 C ATOM 816 CG ASP A 58 5.294 9.278 -4.912 1.00 0.00 C ATOM 817 OD1 ASP A 58 5.374 9.950 -3.863 1.00 0.00 O ATOM 818 OD2 ASP A 58 5.785 8.135 -5.032 1.00 0.00 O ATOM 0 H ASP A 58 1.501 10.475 -6.303 1.00 0.00 H new ATOM 0 HA ASP A 58 3.058 10.536 -4.717 1.00 0.00 H new ATOM 0 HB2 ASP A 58 4.130 9.078 -6.696 1.00 0.00 H new ATOM 0 HB3 ASP A 58 5.283 10.397 -6.736 1.00 0.00 H new ATOM 823 N VAL A 59 3.169 13.228 -5.285 1.00 0.00 N ATOM 824 CA VAL A 59 3.593 14.612 -5.113 1.00 0.00 C ATOM 825 C VAL A 59 4.994 14.688 -4.517 1.00 0.00 C ATOM 826 O VAL A 59 5.875 15.359 -5.056 1.00 0.00 O ATOM 827 CB VAL A 59 2.619 15.389 -4.207 1.00 0.00 C ATOM 828 CG1 VAL A 59 2.265 14.568 -2.976 1.00 0.00 C ATOM 829 CG2 VAL A 59 3.216 16.730 -3.809 1.00 0.00 C ATOM 0 H VAL A 59 2.162 13.083 -5.213 1.00 0.00 H new ATOM 0 HA VAL A 59 3.598 15.067 -6.104 1.00 0.00 H new ATOM 0 HB VAL A 59 1.702 15.577 -4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 59 1.576 15.133 -2.348 1.00 0.00 H new ATOM 0 HG12 VAL A 59 1.793 13.635 -3.284 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.172 14.347 -2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.514 17.265 -3.169 1.00 0.00 H new ATOM 0 HG22 VAL A 59 4.148 16.567 -3.268 1.00 0.00 H new ATOM 0 HG23 VAL A 59 3.414 17.320 -4.704 1.00 0.00 H new ATOM 839 N LEU A 60 5.195 13.995 -3.401 1.00 0.00 N ATOM 840 CA LEU A 60 6.490 13.983 -2.730 1.00 0.00 C ATOM 841 C LEU A 60 6.755 12.627 -2.082 1.00 0.00 C ATOM 842 O LEU A 60 5.878 11.763 -2.044 1.00 0.00 O ATOM 843 CB LEU A 60 6.550 15.087 -1.673 1.00 0.00 C ATOM 844 CG LEU A 60 6.713 16.513 -2.200 1.00 0.00 C ATOM 845 CD1 LEU A 60 6.314 17.524 -1.136 1.00 0.00 C ATOM 846 CD2 LEU A 60 8.145 16.752 -2.656 1.00 0.00 C ATOM 0 H LEU A 60 4.477 13.434 -2.942 1.00 0.00 H new ATOM 0 HA LEU A 60 7.261 14.164 -3.479 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.638 15.043 -1.078 1.00 0.00 H new ATOM 0 HB3 LEU A 60 7.380 14.873 -1.000 1.00 0.00 H new ATOM 0 HG LEU A 60 6.053 16.641 -3.058 1.00 0.00 H new ATOM 0 HD11 LEU A 60 6.437 18.533 -1.529 1.00 0.00 H new ATOM 0 HD12 LEU A 60 5.272 17.367 -0.858 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.947 17.397 -0.258 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.243 17.772 -3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 60 8.824 16.606 -1.816 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.396 16.050 -3.451 1.00 0.00 H new ATOM 858 N THR A 61 7.969 12.448 -1.572 1.00 0.00 N ATOM 859 CA THR A 61 8.349 11.199 -0.924 1.00 0.00 C ATOM 860 C THR A 61 7.244 10.700 0.000 1.00 0.00 C ATOM 861 O THR A 61 7.089 11.189 1.119 1.00 0.00 O ATOM 862 CB THR A 61 9.648 11.360 -0.112 1.00 0.00 C ATOM 863 OG1 THR A 61 9.466 12.342 0.914 1.00 0.00 O ATOM 864 CG2 THR A 61 10.803 11.770 -1.014 1.00 0.00 C ATOM 0 H THR A 61 8.706 13.152 -1.595 1.00 0.00 H new ATOM 0 HA THR A 61 8.513 10.469 -1.717 1.00 0.00 H new ATOM 0 HB THR A 61 9.887 10.399 0.344 1.00 0.00 H new ATOM 0 HG1 THR A 61 8.620 12.175 1.380 1.00 0.00 H new ATOM 0 HG21 THR A 61 11.709 11.878 -0.418 1.00 0.00 H new ATOM 0 HG22 THR A 61 10.958 11.006 -1.776 1.00 0.00 H new ATOM 0 HG23 THR A 61 10.570 12.720 -1.495 1.00 0.00 H new ATOM 872 N THR A 62 6.478 9.723 -0.475 1.00 0.00 N ATOM 873 CA THR A 62 5.387 9.158 0.308 1.00 0.00 C ATOM 874 C THR A 62 5.701 7.730 0.739 1.00 0.00 C ATOM 875 O THR A 62 5.855 6.838 -0.096 1.00 0.00 O ATOM 876 CB THR A 62 4.065 9.164 -0.483 1.00 0.00 C ATOM 877 OG1 THR A 62 3.800 10.480 -0.983 1.00 0.00 O ATOM 878 CG2 THR A 62 2.908 8.706 0.392 1.00 0.00 C ATOM 0 H THR A 62 6.594 9.307 -1.399 1.00 0.00 H new ATOM 0 HA THR A 62 5.276 9.786 1.192 1.00 0.00 H new ATOM 0 HB THR A 62 4.164 8.471 -1.318 1.00 0.00 H new ATOM 0 HG1 THR A 62 4.475 10.718 -1.652 1.00 0.00 H new ATOM 0 HG21 THR A 62 1.986 8.719 -0.189 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.099 7.693 0.747 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.809 9.377 1.245 1.00 0.00 H new ATOM 886 N LYS A 63 5.794 7.519 2.047 1.00 0.00 N ATOM 887 CA LYS A 63 6.089 6.198 2.590 1.00 0.00 C ATOM 888 C LYS A 63 4.873 5.283 2.483 1.00 0.00 C ATOM 889 O LYS A 63 3.750 5.688 2.783 1.00 0.00 O ATOM 890 CB LYS A 63 6.528 6.311 4.052 1.00 0.00 C ATOM 891 CG LYS A 63 7.717 7.233 4.260 1.00 0.00 C ATOM 892 CD LYS A 63 9.030 6.471 4.208 1.00 0.00 C ATOM 893 CE LYS A 63 9.602 6.441 2.799 1.00 0.00 C ATOM 894 NZ LYS A 63 9.962 7.804 2.318 1.00 0.00 N ATOM 0 H LYS A 63 5.669 8.246 2.751 1.00 0.00 H new ATOM 0 HA LYS A 63 6.901 5.765 2.006 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.690 6.673 4.647 1.00 0.00 H new ATOM 0 HB3 LYS A 63 6.779 5.318 4.425 1.00 0.00 H new ATOM 0 HG2 LYS A 63 7.715 8.009 3.494 1.00 0.00 H new ATOM 0 HG3 LYS A 63 7.625 7.735 5.223 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.748 6.935 4.884 1.00 0.00 H new ATOM 0 HD3 LYS A 63 8.874 5.451 4.560 1.00 0.00 H new ATOM 0 HE2 LYS A 63 10.486 5.804 2.779 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.874 5.997 2.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 9.281 8.107 1.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 9.938 8.471 3.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 10.918 7.787 1.910 1.00 0.00 H new ATOM 908 N TYR A 64 5.105 4.047 2.056 1.00 0.00 N ATOM 909 CA TYR A 64 4.029 3.074 1.909 1.00 0.00 C ATOM 910 C TYR A 64 4.260 1.865 2.809 1.00 0.00 C ATOM 911 O TYR A 64 5.358 1.310 2.850 1.00 0.00 O ATOM 912 CB TYR A 64 3.915 2.624 0.451 1.00 0.00 C ATOM 913 CG TYR A 64 3.681 3.762 -0.517 1.00 0.00 C ATOM 914 CD1 TYR A 64 2.433 4.364 -0.624 1.00 0.00 C ATOM 915 CD2 TYR A 64 4.707 4.235 -1.326 1.00 0.00 C ATOM 916 CE1 TYR A 64 2.214 5.403 -1.507 1.00 0.00 C ATOM 917 CE2 TYR A 64 4.498 5.275 -2.211 1.00 0.00 C ATOM 918 CZ TYR A 64 3.250 5.855 -2.298 1.00 0.00 C ATOM 919 OH TYR A 64 3.037 6.890 -3.180 1.00 0.00 O ATOM 0 H TYR A 64 6.029 3.695 1.805 1.00 0.00 H new ATOM 0 HA TYR A 64 3.097 3.554 2.208 1.00 0.00 H new ATOM 0 HB2 TYR A 64 4.828 2.100 0.169 1.00 0.00 H new ATOM 0 HB3 TYR A 64 3.097 1.909 0.363 1.00 0.00 H new ATOM 0 HD1 TYR A 64 1.620 4.013 -0.006 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.685 3.782 -1.262 1.00 0.00 H new ATOM 0 HE1 TYR A 64 1.238 5.859 -1.578 1.00 0.00 H new ATOM 0 HE2 TYR A 64 5.307 5.632 -2.831 1.00 0.00 H new ATOM 0 HH TYR A 64 2.922 6.531 -4.084 1.00 0.00 H new ATOM 929 N GLN A 65 3.218 1.462 3.528 1.00 0.00 N ATOM 930 CA GLN A 65 3.307 0.318 4.428 1.00 0.00 C ATOM 931 C GLN A 65 2.415 -0.822 3.949 1.00 0.00 C ATOM 932 O GLN A 65 1.189 -0.741 4.027 1.00 0.00 O ATOM 933 CB GLN A 65 2.912 0.728 5.848 1.00 0.00 C ATOM 934 CG GLN A 65 3.239 -0.322 6.897 1.00 0.00 C ATOM 935 CD GLN A 65 4.719 -0.388 7.217 1.00 0.00 C ATOM 936 OE1 GLN A 65 5.380 -1.391 6.948 1.00 0.00 O ATOM 937 NE2 GLN A 65 5.248 0.685 7.794 1.00 0.00 N ATOM 0 H GLN A 65 2.302 1.910 3.505 1.00 0.00 H new ATOM 0 HA GLN A 65 4.340 -0.030 4.432 1.00 0.00 H new ATOM 0 HB2 GLN A 65 3.422 1.657 6.104 1.00 0.00 H new ATOM 0 HB3 GLN A 65 1.842 0.934 5.873 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.684 -0.104 7.809 1.00 0.00 H new ATOM 0 HG3 GLN A 65 2.904 -1.298 6.545 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.663 1.495 7.999 1.00 0.00 H new ATOM 0 HE22 GLN A 65 6.240 0.699 8.032 1.00 0.00 H new ATOM 946 N VAL A 66 3.039 -1.886 3.452 1.00 0.00 N ATOM 947 CA VAL A 66 2.301 -3.044 2.960 1.00 0.00 C ATOM 948 C VAL A 66 2.089 -4.070 4.067 1.00 0.00 C ATOM 949 O VAL A 66 3.048 -4.595 4.634 1.00 0.00 O ATOM 950 CB VAL A 66 3.033 -3.717 1.784 1.00 0.00 C ATOM 951 CG1 VAL A 66 2.251 -4.924 1.289 1.00 0.00 C ATOM 952 CG2 VAL A 66 3.261 -2.720 0.658 1.00 0.00 C ATOM 0 H VAL A 66 4.053 -1.970 3.380 1.00 0.00 H new ATOM 0 HA VAL A 66 1.333 -2.680 2.615 1.00 0.00 H new ATOM 0 HB VAL A 66 4.006 -4.063 2.134 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.783 -5.387 0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 66 2.145 -5.646 2.099 1.00 0.00 H new ATOM 0 HG13 VAL A 66 1.263 -4.606 0.955 1.00 0.00 H new ATOM 0 HG21 VAL A 66 3.779 -3.213 -0.165 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.301 -2.341 0.307 1.00 0.00 H new ATOM 0 HG23 VAL A 66 3.866 -1.891 1.024 1.00 0.00 H new ATOM 962 N ASP A 67 0.827 -4.353 4.370 1.00 0.00 N ATOM 963 CA ASP A 67 0.487 -5.319 5.408 1.00 0.00 C ATOM 964 C ASP A 67 -0.283 -6.499 4.823 1.00 0.00 C ATOM 965 O ASP A 67 -1.434 -6.358 4.408 1.00 0.00 O ATOM 966 CB ASP A 67 -0.339 -4.649 6.507 1.00 0.00 C ATOM 967 CG ASP A 67 0.186 -3.274 6.870 1.00 0.00 C ATOM 968 OD1 ASP A 67 1.383 -3.013 6.626 1.00 0.00 O ATOM 969 OD2 ASP A 67 -0.599 -2.459 7.398 1.00 0.00 O ATOM 0 H ASP A 67 0.022 -3.927 3.911 1.00 0.00 H new ATOM 0 HA ASP A 67 1.416 -5.693 5.839 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.375 -4.564 6.178 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -0.337 -5.281 7.395 1.00 0.00 H new ATOM 974 N LEU A 68 0.360 -7.661 4.791 1.00 0.00 N ATOM 975 CA LEU A 68 -0.264 -8.866 4.255 1.00 0.00 C ATOM 976 C LEU A 68 -1.246 -9.462 5.258 1.00 0.00 C ATOM 977 O LEU A 68 -2.426 -9.639 4.957 1.00 0.00 O ATOM 978 CB LEU A 68 0.804 -9.899 3.893 1.00 0.00 C ATOM 979 CG LEU A 68 1.531 -9.676 2.567 1.00 0.00 C ATOM 980 CD1 LEU A 68 0.641 -10.067 1.398 1.00 0.00 C ATOM 981 CD2 LEU A 68 1.976 -8.227 2.440 1.00 0.00 C ATOM 0 H LEU A 68 1.313 -7.794 5.130 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.814 -8.592 3.355 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.545 -9.921 4.692 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.335 -10.883 3.866 1.00 0.00 H new ATOM 0 HG LEU A 68 2.417 -10.310 2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.175 -9.901 0.463 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.373 -11.120 1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.264 -9.460 1.411 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.492 -8.087 1.490 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.104 -7.574 2.480 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.651 -7.981 3.259 1.00 0.00 H new ATOM 993 N GLY A 69 -0.751 -9.769 6.453 1.00 0.00 N ATOM 994 CA GLY A 69 -1.598 -10.341 7.483 1.00 0.00 C ATOM 995 C GLY A 69 -1.031 -11.625 8.054 1.00 0.00 C ATOM 996 O GLY A 69 -1.023 -11.822 9.269 1.00 0.00 O ATOM 0 H GLY A 69 0.222 -9.632 6.726 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.727 -9.616 8.286 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -2.587 -10.537 7.068 1.00 0.00 H new ATOM 1000 N ASP A 70 -0.558 -12.503 7.176 1.00 0.00 N ATOM 1001 CA ASP A 70 0.013 -13.776 7.599 1.00 0.00 C ATOM 1002 C ASP A 70 1.295 -13.558 8.397 1.00 0.00 C ATOM 1003 O ASP A 70 1.377 -13.919 9.570 1.00 0.00 O ATOM 1004 CB ASP A 70 0.297 -14.660 6.384 1.00 0.00 C ATOM 1005 CG ASP A 70 0.537 -16.108 6.766 1.00 0.00 C ATOM 1006 OD1 ASP A 70 1.307 -16.352 7.718 1.00 0.00 O ATOM 1007 OD2 ASP A 70 -0.047 -16.998 6.112 1.00 0.00 O ATOM 0 H ASP A 70 -0.559 -12.356 6.167 1.00 0.00 H new ATOM 0 HA ASP A 70 -0.712 -14.277 8.241 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.544 -14.604 5.693 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.170 -14.277 5.856 1.00 0.00 H new ATOM 1012 N GLY A 71 2.295 -12.966 7.751 1.00 0.00 N ATOM 1013 CA GLY A 71 3.560 -12.712 8.415 1.00 0.00 C ATOM 1014 C GLY A 71 4.518 -11.915 7.552 1.00 0.00 C ATOM 1015 O GLY A 71 5.732 -12.111 7.615 1.00 0.00 O ATOM 0 H GLY A 71 2.251 -12.658 6.780 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.377 -12.172 9.344 1.00 0.00 H new ATOM 0 HA3 GLY A 71 4.023 -13.662 8.684 1.00 0.00 H new ATOM 1019 N PHE A 72 3.972 -11.014 6.741 1.00 0.00 N ATOM 1020 CA PHE A 72 4.787 -10.186 5.859 1.00 0.00 C ATOM 1021 C PHE A 72 4.600 -8.706 6.177 1.00 0.00 C ATOM 1022 O PHE A 72 3.489 -8.179 6.109 1.00 0.00 O ATOM 1023 CB PHE A 72 4.427 -10.455 4.397 1.00 0.00 C ATOM 1024 CG PHE A 72 5.560 -10.200 3.444 1.00 0.00 C ATOM 1025 CD1 PHE A 72 6.732 -10.935 3.528 1.00 0.00 C ATOM 1026 CD2 PHE A 72 5.453 -9.227 2.464 1.00 0.00 C ATOM 1027 CE1 PHE A 72 7.776 -10.702 2.654 1.00 0.00 C ATOM 1028 CE2 PHE A 72 6.494 -8.990 1.586 1.00 0.00 C ATOM 1029 CZ PHE A 72 7.657 -9.729 1.680 1.00 0.00 C ATOM 0 H PHE A 72 2.969 -10.839 6.676 1.00 0.00 H new ATOM 0 HA PHE A 72 5.833 -10.445 6.022 1.00 0.00 H new ATOM 0 HB2 PHE A 72 4.104 -11.491 4.295 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.580 -9.828 4.118 1.00 0.00 H new ATOM 0 HD1 PHE A 72 6.830 -11.699 4.285 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.546 -8.647 2.385 1.00 0.00 H new ATOM 0 HE1 PHE A 72 8.685 -11.280 2.732 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.398 -8.228 0.827 1.00 0.00 H new ATOM 0 HZ PHE A 72 8.471 -9.547 0.994 1.00 0.00 H new ATOM 1039 N LYS A 73 5.695 -8.039 6.525 1.00 0.00 N ATOM 1040 CA LYS A 73 5.655 -6.619 6.853 1.00 0.00 C ATOM 1041 C LYS A 73 6.889 -5.901 6.316 1.00 0.00 C ATOM 1042 O LYS A 73 7.992 -6.072 6.832 1.00 0.00 O ATOM 1043 CB LYS A 73 5.560 -6.427 8.368 1.00 0.00 C ATOM 1044 CG LYS A 73 4.190 -6.752 8.938 1.00 0.00 C ATOM 1045 CD LYS A 73 4.072 -6.319 10.390 1.00 0.00 C ATOM 1046 CE LYS A 73 2.644 -6.448 10.896 1.00 0.00 C ATOM 1047 NZ LYS A 73 2.517 -6.018 12.316 1.00 0.00 N ATOM 0 H LYS A 73 6.622 -8.460 6.587 1.00 0.00 H new ATOM 0 HA LYS A 73 4.772 -6.188 6.382 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.305 -7.058 8.853 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.810 -5.394 8.611 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.422 -6.255 8.346 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.008 -7.824 8.861 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.734 -6.927 11.007 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.403 -5.285 10.490 1.00 0.00 H new ATOM 0 HE2 LYS A 73 1.983 -5.845 10.274 1.00 0.00 H new ATOM 0 HE3 LYS A 73 2.317 -7.483 10.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 1.529 -6.121 12.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 3.129 -6.610 12.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 2.805 -5.023 12.404 1.00 0.00 H new ATOM 1061 N ALA A 74 6.694 -5.095 5.276 1.00 0.00 N ATOM 1062 CA ALA A 74 7.790 -4.349 4.672 1.00 0.00 C ATOM 1063 C ALA A 74 7.384 -2.906 4.393 1.00 0.00 C ATOM 1064 O ALA A 74 6.229 -2.528 4.587 1.00 0.00 O ATOM 1065 CB ALA A 74 8.246 -5.028 3.389 1.00 0.00 C ATOM 0 H ALA A 74 5.787 -4.943 4.835 1.00 0.00 H new ATOM 0 HA ALA A 74 8.620 -4.335 5.378 1.00 0.00 H new ATOM 0 HB1 ALA A 74 9.065 -4.460 2.948 1.00 0.00 H new ATOM 0 HB2 ALA A 74 8.585 -6.039 3.613 1.00 0.00 H new ATOM 0 HB3 ALA A 74 7.415 -5.072 2.685 1.00 0.00 H new ATOM 1071 N MET A 75 8.341 -2.104 3.938 1.00 0.00 N ATOM 1072 CA MET A 75 8.081 -0.702 3.633 1.00 0.00 C ATOM 1073 C MET A 75 8.744 -0.300 2.319 1.00 0.00 C ATOM 1074 O MET A 75 9.967 -0.344 2.190 1.00 0.00 O ATOM 1075 CB MET A 75 8.588 0.191 4.767 1.00 0.00 C ATOM 1076 CG MET A 75 8.564 1.674 4.430 1.00 0.00 C ATOM 1077 SD MET A 75 9.758 2.624 5.391 1.00 0.00 S ATOM 1078 CE MET A 75 10.913 3.109 4.112 1.00 0.00 C ATOM 0 H MET A 75 9.303 -2.401 3.772 1.00 0.00 H new ATOM 0 HA MET A 75 7.004 -0.572 3.531 1.00 0.00 H new ATOM 0 HB2 MET A 75 7.979 0.018 5.654 1.00 0.00 H new ATOM 0 HB3 MET A 75 9.608 -0.100 5.019 1.00 0.00 H new ATOM 0 HG2 MET A 75 8.772 1.805 3.368 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.563 2.067 4.610 1.00 0.00 H new ATOM 0 HE1 MET A 75 11.587 3.872 4.501 1.00 0.00 H new ATOM 0 HE2 MET A 75 11.491 2.241 3.796 1.00 0.00 H new ATOM 0 HE3 MET A 75 10.365 3.510 3.260 1.00 0.00 H new ATOM 1088 N TYR A 76 7.928 0.091 1.346 1.00 0.00 N ATOM 1089 CA TYR A 76 8.435 0.498 0.041 1.00 0.00 C ATOM 1090 C TYR A 76 8.133 1.969 -0.227 1.00 0.00 C ATOM 1091 O TYR A 76 6.987 2.407 -0.132 1.00 0.00 O ATOM 1092 CB TYR A 76 7.822 -0.369 -1.061 1.00 0.00 C ATOM 1093 CG TYR A 76 7.868 -1.850 -0.761 1.00 0.00 C ATOM 1094 CD1 TYR A 76 9.074 -2.539 -0.741 1.00 0.00 C ATOM 1095 CD2 TYR A 76 6.703 -2.561 -0.497 1.00 0.00 C ATOM 1096 CE1 TYR A 76 9.120 -3.892 -0.469 1.00 0.00 C ATOM 1097 CE2 TYR A 76 6.740 -3.915 -0.223 1.00 0.00 C ATOM 1098 CZ TYR A 76 7.950 -4.576 -0.210 1.00 0.00 C ATOM 1099 OH TYR A 76 7.991 -5.924 0.063 1.00 0.00 O ATOM 0 H TYR A 76 6.913 0.135 1.437 1.00 0.00 H new ATOM 0 HA TYR A 76 9.517 0.362 0.042 1.00 0.00 H new ATOM 0 HB2 TYR A 76 6.785 -0.069 -1.213 1.00 0.00 H new ATOM 0 HB3 TYR A 76 8.349 -0.180 -1.996 1.00 0.00 H new ATOM 0 HD1 TYR A 76 9.992 -2.007 -0.942 1.00 0.00 H new ATOM 0 HD2 TYR A 76 5.753 -2.047 -0.506 1.00 0.00 H new ATOM 0 HE1 TYR A 76 10.067 -4.412 -0.459 1.00 0.00 H new ATOM 0 HE2 TYR A 76 5.826 -4.453 -0.020 1.00 0.00 H new ATOM 0 HH TYR A 76 7.082 -6.253 0.224 1.00 0.00 H new ATOM 1109 N VAL A 77 9.172 2.728 -0.562 1.00 0.00 N ATOM 1110 CA VAL A 77 9.019 4.150 -0.845 1.00 0.00 C ATOM 1111 C VAL A 77 8.859 4.398 -2.341 1.00 0.00 C ATOM 1112 O VAL A 77 9.420 3.677 -3.164 1.00 0.00 O ATOM 1113 CB VAL A 77 10.225 4.958 -0.328 1.00 0.00 C ATOM 1114 CG1 VAL A 77 11.491 4.561 -1.070 1.00 0.00 C ATOM 1115 CG2 VAL A 77 9.963 6.450 -0.464 1.00 0.00 C ATOM 0 H VAL A 77 10.128 2.382 -0.644 1.00 0.00 H new ATOM 0 HA VAL A 77 8.120 4.481 -0.326 1.00 0.00 H new ATOM 0 HB VAL A 77 10.366 4.732 0.729 1.00 0.00 H new ATOM 0 HG11 VAL A 77 12.332 5.142 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 77 11.685 3.499 -0.917 1.00 0.00 H new ATOM 0 HG13 VAL A 77 11.365 4.757 -2.135 1.00 0.00 H new ATOM 0 HG21 VAL A 77 10.825 7.006 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 77 9.795 6.696 -1.513 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.081 6.719 0.117 1.00 0.00 H new ATOM 1125 N ASN A 78 8.089 5.425 -2.686 1.00 0.00 N ATOM 1126 CA ASN A 78 7.854 5.769 -4.083 1.00 0.00 C ATOM 1127 C ASN A 78 7.630 4.515 -4.922 1.00 0.00 C ATOM 1128 O ASN A 78 8.159 4.391 -6.027 1.00 0.00 O ATOM 1129 CB ASN A 78 9.037 6.564 -4.640 1.00 0.00 C ATOM 1130 CG ASN A 78 9.682 7.451 -3.593 1.00 0.00 C ATOM 1131 OD1 ASN A 78 9.067 8.398 -3.102 1.00 0.00 O ATOM 1132 ND2 ASN A 78 10.927 7.148 -3.246 1.00 0.00 N ATOM 0 H ASN A 78 7.617 6.033 -2.017 1.00 0.00 H new ATOM 0 HA ASN A 78 6.955 6.384 -4.134 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.782 5.873 -5.035 1.00 0.00 H new ATOM 0 HB3 ASN A 78 8.698 7.179 -5.474 1.00 0.00 H new ATOM 0 HD21 ASN A 78 11.412 7.709 -2.546 1.00 0.00 H new ATOM 0 HD22 ASN A 78 11.398 6.354 -3.679 1.00 0.00 H new ATOM 1139 N LEU A 79 6.842 3.587 -4.390 1.00 0.00 N ATOM 1140 CA LEU A 79 6.546 2.342 -5.089 1.00 0.00 C ATOM 1141 C LEU A 79 6.246 2.602 -6.562 1.00 0.00 C ATOM 1142 O LEU A 79 6.550 1.777 -7.424 1.00 0.00 O ATOM 1143 CB LEU A 79 5.359 1.635 -4.432 1.00 0.00 C ATOM 1144 CG LEU A 79 5.062 0.219 -4.929 1.00 0.00 C ATOM 1145 CD1 LEU A 79 6.276 -0.678 -4.742 1.00 0.00 C ATOM 1146 CD2 LEU A 79 3.853 -0.357 -4.206 1.00 0.00 C ATOM 0 H LEU A 79 6.397 3.674 -3.476 1.00 0.00 H new ATOM 0 HA LEU A 79 7.425 1.700 -5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.537 1.592 -3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.469 2.246 -4.583 1.00 0.00 H new ATOM 0 HG LEU A 79 4.834 0.268 -5.994 1.00 0.00 H new ATOM 0 HD11 LEU A 79 6.046 -1.681 -5.101 1.00 0.00 H new ATOM 0 HD12 LEU A 79 7.117 -0.275 -5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 79 6.536 -0.722 -3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.656 -1.365 -4.572 1.00 0.00 H new ATOM 0 HD22 LEU A 79 4.052 -0.392 -3.135 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.983 0.273 -4.392 1.00 0.00 H new ATOM 1158 N THR A 80 5.649 3.756 -6.844 1.00 0.00 N ATOM 1159 CA THR A 80 5.309 4.126 -8.212 1.00 0.00 C ATOM 1160 C THR A 80 6.555 4.506 -9.005 1.00 0.00 C ATOM 1161 O THR A 80 6.642 4.245 -10.205 1.00 0.00 O ATOM 1162 CB THR A 80 4.315 5.302 -8.245 1.00 0.00 C ATOM 1163 OG1 THR A 80 4.644 6.251 -7.225 1.00 0.00 O ATOM 1164 CG2 THR A 80 2.889 4.811 -8.047 1.00 0.00 C ATOM 0 H THR A 80 5.391 4.450 -6.143 1.00 0.00 H new ATOM 0 HA THR A 80 4.843 3.253 -8.669 1.00 0.00 H new ATOM 0 HB THR A 80 4.385 5.781 -9.222 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.923 6.911 -7.147 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.205 5.659 -8.074 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.631 4.112 -8.842 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.807 4.310 -7.083 1.00 0.00 H new ATOM 1172 N LEU A 81 7.516 5.122 -8.326 1.00 0.00 N ATOM 1173 CA LEU A 81 8.759 5.538 -8.968 1.00 0.00 C ATOM 1174 C LEU A 81 9.504 4.336 -9.542 1.00 0.00 C ATOM 1175 O LEU A 81 9.880 4.327 -10.714 1.00 0.00 O ATOM 1176 CB LEU A 81 9.651 6.274 -7.967 1.00 0.00 C ATOM 1177 CG LEU A 81 9.472 7.791 -7.899 1.00 0.00 C ATOM 1178 CD1 LEU A 81 10.001 8.448 -9.164 1.00 0.00 C ATOM 1179 CD2 LEU A 81 8.009 8.147 -7.682 1.00 0.00 C ATOM 0 H LEU A 81 7.459 5.345 -7.332 1.00 0.00 H new ATOM 0 HA LEU A 81 8.508 6.212 -9.787 1.00 0.00 H new ATOM 0 HB2 LEU A 81 9.467 5.862 -6.975 1.00 0.00 H new ATOM 0 HB3 LEU A 81 10.691 6.061 -8.213 1.00 0.00 H new ATOM 0 HG LEU A 81 10.045 8.167 -7.052 1.00 0.00 H new ATOM 0 HD11 LEU A 81 9.865 9.527 -9.098 1.00 0.00 H new ATOM 0 HD12 LEU A 81 11.061 8.222 -9.275 1.00 0.00 H new ATOM 0 HD13 LEU A 81 9.456 8.066 -10.027 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.901 9.231 -7.636 1.00 0.00 H new ATOM 0 HD22 LEU A 81 7.413 7.758 -8.508 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.663 7.708 -6.746 1.00 0.00 H new ATOM 1191 N THR A 82 9.712 3.322 -8.708 1.00 0.00 N ATOM 1192 CA THR A 82 10.411 2.115 -9.132 1.00 0.00 C ATOM 1193 C THR A 82 9.501 1.217 -9.962 1.00 0.00 C ATOM 1194 O THR A 82 9.966 0.476 -10.827 1.00 0.00 O ATOM 1195 CB THR A 82 10.938 1.318 -7.924 1.00 0.00 C ATOM 1196 OG1 THR A 82 9.868 1.047 -7.011 1.00 0.00 O ATOM 1197 CG2 THR A 82 12.040 2.084 -7.209 1.00 0.00 C ATOM 0 H THR A 82 9.406 3.313 -7.735 1.00 0.00 H new ATOM 0 HA THR A 82 11.255 2.435 -9.742 1.00 0.00 H new ATOM 0 HB THR A 82 11.350 0.377 -8.289 1.00 0.00 H new ATOM 0 HG1 THR A 82 10.211 0.539 -6.247 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.396 1.501 -6.360 1.00 0.00 H new ATOM 0 HG22 THR A 82 12.865 2.262 -7.898 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.650 3.038 -6.856 1.00 0.00 H new ATOM 1205 N GLY A 83 8.201 1.288 -9.693 1.00 0.00 N ATOM 1206 CA GLY A 83 7.247 0.476 -10.425 1.00 0.00 C ATOM 1207 C GLY A 83 7.172 -0.944 -9.901 1.00 0.00 C ATOM 1208 O GLY A 83 6.095 -1.537 -9.849 1.00 0.00 O ATOM 0 H GLY A 83 7.792 1.893 -8.981 1.00 0.00 H new ATOM 0 HA2 GLY A 83 6.261 0.935 -10.363 1.00 0.00 H new ATOM 0 HA3 GLY A 83 7.524 0.457 -11.479 1.00 0.00 H new ATOM 1212 N GLU A 84 8.319 -1.492 -9.513 1.00 0.00 N ATOM 1213 CA GLU A 84 8.378 -2.853 -8.993 1.00 0.00 C ATOM 1214 C GLU A 84 7.131 -3.177 -8.175 1.00 0.00 C ATOM 1215 O GLU A 84 6.861 -2.568 -7.140 1.00 0.00 O ATOM 1216 CB GLU A 84 9.629 -3.039 -8.131 1.00 0.00 C ATOM 1217 CG GLU A 84 10.908 -3.181 -8.938 1.00 0.00 C ATOM 1218 CD GLU A 84 11.000 -2.175 -10.069 1.00 0.00 C ATOM 1219 OE1 GLU A 84 10.379 -2.412 -11.126 1.00 0.00 O ATOM 1220 OE2 GLU A 84 11.693 -1.151 -9.896 1.00 0.00 O ATOM 0 H GLU A 84 9.220 -1.015 -9.549 1.00 0.00 H new ATOM 0 HA GLU A 84 8.424 -3.537 -9.840 1.00 0.00 H new ATOM 0 HB2 GLU A 84 9.726 -2.187 -7.458 1.00 0.00 H new ATOM 0 HB3 GLU A 84 9.502 -3.924 -7.508 1.00 0.00 H new ATOM 0 HG2 GLU A 84 11.766 -3.058 -8.277 1.00 0.00 H new ATOM 0 HG3 GLU A 84 10.964 -4.189 -9.348 1.00 0.00 H new ATOM 1227 N PRO A 85 6.352 -4.160 -8.651 1.00 0.00 N ATOM 1228 CA PRO A 85 5.121 -4.588 -7.980 1.00 0.00 C ATOM 1229 C PRO A 85 5.397 -5.310 -6.666 1.00 0.00 C ATOM 1230 O PRO A 85 6.551 -5.558 -6.314 1.00 0.00 O ATOM 1231 CB PRO A 85 4.481 -5.544 -8.991 1.00 0.00 C ATOM 1232 CG PRO A 85 5.621 -6.056 -9.802 1.00 0.00 C ATOM 1233 CD PRO A 85 6.613 -4.929 -9.879 1.00 0.00 C ATOM 0 HA PRO A 85 4.488 -3.742 -7.711 1.00 0.00 H new ATOM 0 HB2 PRO A 85 3.955 -6.357 -8.490 1.00 0.00 H new ATOM 0 HB3 PRO A 85 3.751 -5.029 -9.615 1.00 0.00 H new ATOM 0 HG2 PRO A 85 6.066 -6.936 -9.338 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.290 -6.353 -10.797 1.00 0.00 H new ATOM 0 HD2 PRO A 85 7.638 -5.298 -9.912 1.00 0.00 H new ATOM 0 HD3 PRO A 85 6.464 -4.323 -10.772 1.00 0.00 H new ATOM 1241 N ILE A 86 4.333 -5.644 -5.945 1.00 0.00 N ATOM 1242 CA ILE A 86 4.462 -6.339 -4.670 1.00 0.00 C ATOM 1243 C ILE A 86 4.149 -7.824 -4.819 1.00 0.00 C ATOM 1244 O ILE A 86 2.985 -8.224 -4.846 1.00 0.00 O ATOM 1245 CB ILE A 86 3.531 -5.735 -3.602 1.00 0.00 C ATOM 1246 CG1 ILE A 86 3.868 -4.259 -3.376 1.00 0.00 C ATOM 1247 CG2 ILE A 86 3.641 -6.514 -2.300 1.00 0.00 C ATOM 1248 CD1 ILE A 86 2.709 -3.450 -2.839 1.00 0.00 C ATOM 0 H ILE A 86 3.372 -5.445 -6.222 1.00 0.00 H new ATOM 0 HA ILE A 86 5.497 -6.218 -4.349 1.00 0.00 H new ATOM 0 HB ILE A 86 2.503 -5.804 -3.957 1.00 0.00 H new ATOM 0 HG12 ILE A 86 4.704 -4.188 -2.680 1.00 0.00 H new ATOM 0 HG13 ILE A 86 4.200 -3.822 -4.318 1.00 0.00 H new ATOM 0 HG21 ILE A 86 2.977 -6.074 -1.556 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.357 -7.552 -2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.668 -6.474 -1.938 1.00 0.00 H new ATOM 0 HD11 ILE A 86 3.020 -2.414 -2.703 1.00 0.00 H new ATOM 0 HD12 ILE A 86 1.879 -3.490 -3.545 1.00 0.00 H new ATOM 0 HD13 ILE A 86 2.391 -3.862 -1.881 1.00 0.00 H new ATOM 1260 N ARG A 87 5.196 -8.637 -4.913 1.00 0.00 N ATOM 1261 CA ARG A 87 5.033 -10.079 -5.059 1.00 0.00 C ATOM 1262 C ARG A 87 4.779 -10.737 -3.706 1.00 0.00 C ATOM 1263 O ARG A 87 5.387 -10.368 -2.700 1.00 0.00 O ATOM 1264 CB ARG A 87 6.274 -10.691 -5.710 1.00 0.00 C ATOM 1265 CG ARG A 87 5.976 -11.915 -6.560 1.00 0.00 C ATOM 1266 CD ARG A 87 5.947 -13.182 -5.721 1.00 0.00 C ATOM 1267 NE ARG A 87 7.274 -13.546 -5.232 1.00 0.00 N ATOM 1268 CZ ARG A 87 7.481 -14.289 -4.151 1.00 0.00 C ATOM 1269 NH1 ARG A 87 6.453 -14.745 -3.450 1.00 0.00 N ATOM 1270 NH2 ARG A 87 8.719 -14.577 -3.769 1.00 0.00 N ATOM 0 H ARG A 87 6.166 -8.322 -4.891 1.00 0.00 H new ATOM 0 HA ARG A 87 4.169 -10.258 -5.699 1.00 0.00 H new ATOM 0 HB2 ARG A 87 6.757 -9.937 -6.331 1.00 0.00 H new ATOM 0 HB3 ARG A 87 6.985 -10.965 -4.930 1.00 0.00 H new ATOM 0 HG2 ARG A 87 5.016 -11.787 -7.061 1.00 0.00 H new ATOM 0 HG3 ARG A 87 6.732 -12.011 -7.340 1.00 0.00 H new ATOM 0 HD2 ARG A 87 5.275 -13.041 -4.874 1.00 0.00 H new ATOM 0 HD3 ARG A 87 5.543 -14.001 -6.316 1.00 0.00 H new ATOM 0 HE ARG A 87 8.087 -13.211 -5.749 1.00 0.00 H new ATOM 0 HH11 ARG A 87 5.500 -14.525 -3.740 1.00 0.00 H new ATOM 0 HH12 ARG A 87 6.615 -15.316 -2.620 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.513 -14.228 -4.306 1.00 0.00 H new ATOM 0 HH22 ARG A 87 8.877 -15.148 -2.938 1.00 0.00 H new ATOM 1284 N HIS A 88 3.876 -11.712 -3.688 1.00 0.00 N ATOM 1285 CA HIS A 88 3.541 -12.421 -2.458 1.00 0.00 C ATOM 1286 C HIS A 88 2.963 -13.800 -2.766 1.00 0.00 C ATOM 1287 O HIS A 88 2.131 -13.948 -3.660 1.00 0.00 O ATOM 1288 CB HIS A 88 2.543 -11.610 -1.632 1.00 0.00 C ATOM 1289 CG HIS A 88 2.265 -12.197 -0.282 1.00 0.00 C ATOM 1290 ND1 HIS A 88 3.006 -11.890 0.839 1.00 0.00 N ATOM 1291 CD2 HIS A 88 1.319 -13.076 0.123 1.00 0.00 C ATOM 1292 CE1 HIS A 88 2.530 -12.556 1.875 1.00 0.00 C ATOM 1293 NE2 HIS A 88 1.505 -13.283 1.468 1.00 0.00 N ATOM 0 H HIS A 88 3.363 -12.029 -4.511 1.00 0.00 H new ATOM 0 HA HIS A 88 4.457 -12.551 -1.882 1.00 0.00 H new ATOM 0 HB2 HIS A 88 2.926 -10.597 -1.507 1.00 0.00 H new ATOM 0 HB3 HIS A 88 1.607 -11.531 -2.184 1.00 0.00 H new ATOM 0 HD2 HIS A 88 0.559 -13.530 -0.496 1.00 0.00 H new ATOM 0 HE1 HIS A 88 2.914 -12.514 2.884 1.00 0.00 H new ATOM 0 HE2 HIS A 88 0.943 -13.898 2.057 1.00 0.00 H new ATOM 1302 N ARG A 89 3.412 -14.804 -2.020 1.00 0.00 N ATOM 1303 CA ARG A 89 2.941 -16.170 -2.215 1.00 0.00 C ATOM 1304 C ARG A 89 2.305 -16.713 -0.938 1.00 0.00 C ATOM 1305 O ARG A 89 2.752 -16.408 0.168 1.00 0.00 O ATOM 1306 CB ARG A 89 4.097 -17.074 -2.646 1.00 0.00 C ATOM 1307 CG ARG A 89 3.678 -18.190 -3.589 1.00 0.00 C ATOM 1308 CD ARG A 89 3.343 -19.464 -2.830 1.00 0.00 C ATOM 1309 NE ARG A 89 4.518 -20.309 -2.634 1.00 0.00 N ATOM 1310 CZ ARG A 89 4.454 -21.621 -2.437 1.00 0.00 C ATOM 1311 NH1 ARG A 89 3.280 -22.235 -2.411 1.00 0.00 N ATOM 1312 NH2 ARG A 89 5.568 -22.322 -2.267 1.00 0.00 N ATOM 0 H ARG A 89 4.101 -14.697 -1.275 1.00 0.00 H new ATOM 0 HA ARG A 89 2.185 -16.159 -3.001 1.00 0.00 H new ATOM 0 HB2 ARG A 89 4.860 -16.467 -3.132 1.00 0.00 H new ATOM 0 HB3 ARG A 89 4.555 -17.512 -1.759 1.00 0.00 H new ATOM 0 HG2 ARG A 89 2.811 -17.872 -4.169 1.00 0.00 H new ATOM 0 HG3 ARG A 89 4.481 -18.389 -4.299 1.00 0.00 H new ATOM 0 HD2 ARG A 89 2.916 -19.207 -1.861 1.00 0.00 H new ATOM 0 HD3 ARG A 89 2.582 -20.022 -3.376 1.00 0.00 H new ATOM 0 HE ARG A 89 5.437 -19.868 -2.649 1.00 0.00 H new ATOM 0 HH11 ARG A 89 2.422 -21.700 -2.543 1.00 0.00 H new ATOM 0 HH12 ARG A 89 3.235 -23.243 -2.259 1.00 0.00 H new ATOM 0 HH21 ARG A 89 6.474 -21.853 -2.288 1.00 0.00 H new ATOM 0 HH22 ARG A 89 5.518 -23.330 -2.116 1.00 0.00 H new ATOM 1326 N TYR A 90 1.261 -17.518 -1.100 1.00 0.00 N ATOM 1327 CA TYR A 90 0.563 -18.102 0.040 1.00 0.00 C ATOM 1328 C TYR A 90 0.799 -19.607 0.111 1.00 0.00 C ATOM 1329 O TYR A 90 1.308 -20.211 -0.832 1.00 0.00 O ATOM 1330 CB TYR A 90 -0.937 -17.814 -0.053 1.00 0.00 C ATOM 1331 CG TYR A 90 -1.301 -16.386 0.286 1.00 0.00 C ATOM 1332 CD1 TYR A 90 -0.819 -15.780 1.439 1.00 0.00 C ATOM 1333 CD2 TYR A 90 -2.128 -15.643 -0.548 1.00 0.00 C ATOM 1334 CE1 TYR A 90 -1.150 -14.476 1.752 1.00 0.00 C ATOM 1335 CE2 TYR A 90 -2.463 -14.338 -0.243 1.00 0.00 C ATOM 1336 CZ TYR A 90 -1.972 -13.759 0.908 1.00 0.00 C ATOM 1337 OH TYR A 90 -2.303 -12.459 1.216 1.00 0.00 O ATOM 0 H TYR A 90 0.879 -17.781 -2.009 1.00 0.00 H new ATOM 0 HA TYR A 90 0.959 -17.647 0.948 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -1.279 -18.037 -1.063 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.470 -18.486 0.620 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.174 -16.338 2.102 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -2.515 -16.094 -1.450 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -0.767 -14.020 2.653 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -3.106 -13.774 -0.903 1.00 0.00 H new ATOM 0 HH TYR A 90 -2.888 -12.096 0.519 1.00 0.00 H new ATOM 1347 N GLU A 91 0.425 -20.206 1.238 1.00 0.00 N ATOM 1348 CA GLU A 91 0.597 -21.640 1.433 1.00 0.00 C ATOM 1349 C GLU A 91 -0.754 -22.337 1.565 1.00 0.00 C ATOM 1350 O GLU A 91 -1.073 -23.246 0.799 1.00 0.00 O ATOM 1351 CB GLU A 91 1.446 -21.910 2.677 1.00 0.00 C ATOM 1352 CG GLU A 91 2.832 -21.292 2.614 1.00 0.00 C ATOM 1353 CD GLU A 91 3.527 -21.279 3.962 1.00 0.00 C ATOM 1354 OE1 GLU A 91 2.848 -21.014 4.976 1.00 0.00 O ATOM 1355 OE2 GLU A 91 4.749 -21.533 4.003 1.00 0.00 O ATOM 0 H GLU A 91 0.001 -19.720 2.029 1.00 0.00 H new ATOM 0 HA GLU A 91 1.109 -22.041 0.558 1.00 0.00 H new ATOM 0 HB2 GLU A 91 0.925 -21.524 3.553 1.00 0.00 H new ATOM 0 HB3 GLU A 91 1.544 -22.987 2.813 1.00 0.00 H new ATOM 0 HG2 GLU A 91 3.441 -21.847 1.901 1.00 0.00 H new ATOM 0 HG3 GLU A 91 2.754 -20.271 2.240 1.00 0.00 H new ATOM 1362 N SER A 92 -1.544 -21.904 2.542 1.00 0.00 N ATOM 1363 CA SER A 92 -2.859 -22.488 2.778 1.00 0.00 C ATOM 1364 C SER A 92 -3.963 -21.560 2.280 1.00 0.00 C ATOM 1365 O SER A 92 -3.805 -20.341 2.222 1.00 0.00 O ATOM 1366 CB SER A 92 -3.053 -22.775 4.268 1.00 0.00 C ATOM 1367 OG SER A 92 -2.149 -23.770 4.718 1.00 0.00 O ATOM 0 H SER A 92 -1.296 -21.150 3.183 1.00 0.00 H new ATOM 0 HA SER A 92 -2.918 -23.425 2.224 1.00 0.00 H new ATOM 0 HB2 SER A 92 -2.905 -21.859 4.840 1.00 0.00 H new ATOM 0 HB3 SER A 92 -4.077 -23.101 4.448 1.00 0.00 H new ATOM 0 HG SER A 92 -2.292 -23.934 5.674 1.00 0.00 H new ATOM 1373 N PRO A 93 -5.109 -22.151 1.910 1.00 0.00 N ATOM 1374 CA PRO A 93 -6.263 -21.397 1.410 1.00 0.00 C ATOM 1375 C PRO A 93 -6.929 -20.566 2.501 1.00 0.00 C ATOM 1376 O PRO A 93 -6.632 -20.725 3.684 1.00 0.00 O ATOM 1377 CB PRO A 93 -7.213 -22.491 0.915 1.00 0.00 C ATOM 1378 CG PRO A 93 -6.848 -23.698 1.708 1.00 0.00 C ATOM 1379 CD PRO A 93 -5.367 -23.600 1.952 1.00 0.00 C ATOM 0 HA PRO A 93 -5.979 -20.679 0.640 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -8.255 -22.213 1.075 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -7.091 -22.668 -0.154 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -7.398 -23.728 2.649 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -7.095 -24.611 1.166 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -5.089 -24.030 2.914 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -4.798 -24.132 1.189 1.00 0.00 H new ATOM 1387 N GLY A 94 -7.832 -19.679 2.094 1.00 0.00 N ATOM 1388 CA GLY A 94 -8.526 -18.836 3.050 1.00 0.00 C ATOM 1389 C GLY A 94 -8.350 -17.359 2.756 1.00 0.00 C ATOM 1390 O GLY A 94 -7.242 -16.905 2.467 1.00 0.00 O ATOM 0 H GLY A 94 -8.095 -19.529 1.120 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -9.588 -19.081 3.042 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -8.157 -19.050 4.053 1.00 0.00 H new ATOM 1394 N ILE A 95 -9.443 -16.608 2.828 1.00 0.00 N ATOM 1395 CA ILE A 95 -9.404 -15.175 2.567 1.00 0.00 C ATOM 1396 C ILE A 95 -8.366 -14.484 3.446 1.00 0.00 C ATOM 1397 O ILE A 95 -8.250 -14.780 4.636 1.00 0.00 O ATOM 1398 CB ILE A 95 -10.778 -14.521 2.804 1.00 0.00 C ATOM 1399 CG1 ILE A 95 -11.814 -15.096 1.837 1.00 0.00 C ATOM 1400 CG2 ILE A 95 -10.680 -13.011 2.648 1.00 0.00 C ATOM 1401 CD1 ILE A 95 -13.224 -14.619 2.107 1.00 0.00 C ATOM 0 H ILE A 95 -10.367 -16.968 3.065 1.00 0.00 H new ATOM 0 HA ILE A 95 -9.129 -15.053 1.519 1.00 0.00 H new ATOM 0 HB ILE A 95 -11.098 -14.741 3.822 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -11.537 -14.826 0.818 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.790 -16.184 1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.659 -12.563 2.818 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -9.969 -12.616 3.373 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.342 -12.771 1.640 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -13.905 -15.067 1.383 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -13.521 -14.912 3.114 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -13.264 -13.533 2.019 1.00 0.00 H new ATOM 1413 N TYR A 96 -7.616 -13.562 2.853 1.00 0.00 N ATOM 1414 CA TYR A 96 -6.588 -12.829 3.582 1.00 0.00 C ATOM 1415 C TYR A 96 -6.971 -11.360 3.736 1.00 0.00 C ATOM 1416 O TYR A 96 -7.809 -10.845 2.995 1.00 0.00 O ATOM 1417 CB TYR A 96 -5.243 -12.944 2.863 1.00 0.00 C ATOM 1418 CG TYR A 96 -4.646 -14.333 2.913 1.00 0.00 C ATOM 1419 CD1 TYR A 96 -4.957 -15.279 1.945 1.00 0.00 C ATOM 1420 CD2 TYR A 96 -3.771 -14.697 3.929 1.00 0.00 C ATOM 1421 CE1 TYR A 96 -4.415 -16.549 1.988 1.00 0.00 C ATOM 1422 CE2 TYR A 96 -3.223 -15.964 3.979 1.00 0.00 C ATOM 1423 CZ TYR A 96 -3.548 -16.887 3.006 1.00 0.00 C ATOM 1424 OH TYR A 96 -3.005 -18.150 3.052 1.00 0.00 O ATOM 0 H TYR A 96 -7.701 -13.304 1.870 1.00 0.00 H new ATOM 0 HA TYR A 96 -6.500 -13.269 4.575 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -5.371 -12.650 1.821 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -4.541 -12.240 3.309 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -5.634 -15.017 1.145 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -3.515 -13.977 4.692 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -4.669 -17.273 1.228 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -2.544 -16.231 4.775 1.00 0.00 H new ATOM 0 HH TYR A 96 -3.547 -18.759 2.508 1.00 0.00 H new ATOM 1434 N ARG A 97 -6.351 -10.692 4.703 1.00 0.00 N ATOM 1435 CA ARG A 97 -6.626 -9.283 4.955 1.00 0.00 C ATOM 1436 C ARG A 97 -5.394 -8.429 4.671 1.00 0.00 C ATOM 1437 O ARG A 97 -4.453 -8.394 5.464 1.00 0.00 O ATOM 1438 CB ARG A 97 -7.078 -9.080 6.402 1.00 0.00 C ATOM 1439 CG ARG A 97 -8.554 -9.367 6.626 1.00 0.00 C ATOM 1440 CD ARG A 97 -9.036 -8.801 7.953 1.00 0.00 C ATOM 1441 NE ARG A 97 -8.372 -9.431 9.091 1.00 0.00 N ATOM 1442 CZ ARG A 97 -8.276 -8.867 10.290 1.00 0.00 C ATOM 1443 NH1 ARG A 97 -8.800 -7.668 10.506 1.00 0.00 N ATOM 1444 NH2 ARG A 97 -7.656 -9.503 11.275 1.00 0.00 N ATOM 0 H ARG A 97 -5.655 -11.104 5.325 1.00 0.00 H new ATOM 0 HA ARG A 97 -7.426 -8.970 4.285 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -6.488 -9.727 7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -6.867 -8.052 6.699 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -9.137 -8.936 5.812 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.724 -10.443 6.605 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.854 -7.727 7.976 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -10.113 -8.943 8.038 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.959 -10.354 8.958 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -9.278 -7.177 9.751 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -8.725 -7.237 11.427 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -7.253 -10.426 11.112 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -7.583 -9.070 12.195 1.00 0.00 H new ATOM 1458 N VAL A 98 -5.407 -7.740 3.534 1.00 0.00 N ATOM 1459 CA VAL A 98 -4.291 -6.886 3.145 1.00 0.00 C ATOM 1460 C VAL A 98 -4.673 -5.412 3.226 1.00 0.00 C ATOM 1461 O VAL A 98 -5.782 -5.027 2.854 1.00 0.00 O ATOM 1462 CB VAL A 98 -3.813 -7.203 1.716 1.00 0.00 C ATOM 1463 CG1 VAL A 98 -2.660 -6.292 1.324 1.00 0.00 C ATOM 1464 CG2 VAL A 98 -3.409 -8.665 1.602 1.00 0.00 C ATOM 0 H VAL A 98 -6.178 -7.757 2.866 1.00 0.00 H new ATOM 0 HA VAL A 98 -3.480 -7.087 3.844 1.00 0.00 H new ATOM 0 HB VAL A 98 -4.638 -7.022 1.027 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.336 -6.531 0.311 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.987 -5.253 1.365 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.830 -6.438 2.015 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -3.074 -8.872 0.586 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.599 -8.874 2.301 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -4.264 -9.298 1.838 1.00 0.00 H new ATOM 1474 N SER A 99 -3.748 -4.592 3.714 1.00 0.00 N ATOM 1475 CA SER A 99 -3.989 -3.160 3.847 1.00 0.00 C ATOM 1476 C SER A 99 -2.713 -2.368 3.580 1.00 0.00 C ATOM 1477 O SER A 99 -1.609 -2.828 3.873 1.00 0.00 O ATOM 1478 CB SER A 99 -4.520 -2.839 5.245 1.00 0.00 C ATOM 1479 OG SER A 99 -5.935 -2.892 5.278 1.00 0.00 O ATOM 0 H SER A 99 -2.825 -4.895 4.024 1.00 0.00 H new ATOM 0 HA SER A 99 -4.736 -2.871 3.108 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.110 -3.547 5.965 1.00 0.00 H new ATOM 0 HB3 SER A 99 -4.183 -1.847 5.546 1.00 0.00 H new ATOM 0 HG SER A 99 -6.255 -2.562 6.144 1.00 0.00 H new ATOM 1485 N VAL A 100 -2.872 -1.172 3.022 1.00 0.00 N ATOM 1486 CA VAL A 100 -1.734 -0.313 2.716 1.00 0.00 C ATOM 1487 C VAL A 100 -1.871 1.044 3.397 1.00 0.00 C ATOM 1488 O VAL A 100 -2.828 1.779 3.152 1.00 0.00 O ATOM 1489 CB VAL A 100 -1.584 -0.101 1.198 1.00 0.00 C ATOM 1490 CG1 VAL A 100 -2.712 0.770 0.666 1.00 0.00 C ATOM 1491 CG2 VAL A 100 -0.229 0.513 0.878 1.00 0.00 C ATOM 0 H VAL A 100 -3.778 -0.776 2.773 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.845 -0.818 3.095 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.644 -1.071 0.705 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.589 0.909 -0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.669 0.286 0.862 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -2.688 1.740 1.162 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.140 0.656 -0.199 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.138 1.476 1.381 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.563 -0.152 1.223 1.00 0.00 H new ATOM 1501 N ARG A 101 -0.908 1.370 4.252 1.00 0.00 N ATOM 1502 CA ARG A 101 -0.921 2.639 4.970 1.00 0.00 C ATOM 1503 C ARG A 101 0.204 3.549 4.485 1.00 0.00 C ATOM 1504 O ARG A 101 1.381 3.205 4.584 1.00 0.00 O ATOM 1505 CB ARG A 101 -0.785 2.400 6.475 1.00 0.00 C ATOM 1506 CG ARG A 101 -0.772 3.679 7.296 1.00 0.00 C ATOM 1507 CD ARG A 101 0.641 4.214 7.471 1.00 0.00 C ATOM 1508 NE ARG A 101 0.680 5.373 8.359 1.00 0.00 N ATOM 1509 CZ ARG A 101 1.801 5.863 8.878 1.00 0.00 C ATOM 1510 NH1 ARG A 101 2.967 5.298 8.600 1.00 0.00 N ATOM 1511 NH2 ARG A 101 1.755 6.922 9.677 1.00 0.00 N ATOM 0 H ARG A 101 -0.109 0.773 4.465 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.874 3.130 4.772 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -1.610 1.771 6.810 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.135 1.847 6.665 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -1.390 4.433 6.807 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.214 3.489 8.274 1.00 0.00 H new ATOM 0 HD2 ARG A 101 1.280 3.427 7.873 1.00 0.00 H new ATOM 0 HD3 ARG A 101 1.048 4.489 6.498 1.00 0.00 H new ATOM 0 HE ARG A 101 -0.201 5.831 8.593 1.00 0.00 H new ATOM 0 HH11 ARG A 101 3.006 4.484 7.986 1.00 0.00 H new ATOM 0 HH12 ARG A 101 3.825 5.677 9.000 1.00 0.00 H new ATOM 0 HH21 ARG A 101 0.859 7.360 9.893 1.00 0.00 H new ATOM 0 HH22 ARG A 101 2.615 7.298 10.075 1.00 0.00 H new ATOM 1525 N ALA A 102 -0.168 4.712 3.959 1.00 0.00 N ATOM 1526 CA ALA A 102 0.809 5.672 3.461 1.00 0.00 C ATOM 1527 C ALA A 102 0.602 7.044 4.093 1.00 0.00 C ATOM 1528 O ALA A 102 -0.478 7.625 3.997 1.00 0.00 O ATOM 1529 CB ALA A 102 0.726 5.770 1.944 1.00 0.00 C ATOM 0 H ALA A 102 -1.139 5.012 3.867 1.00 0.00 H new ATOM 0 HA ALA A 102 1.802 5.319 3.738 1.00 0.00 H new ATOM 0 HB1 ALA A 102 1.461 6.490 1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 102 0.930 4.794 1.505 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.273 6.096 1.655 1.00 0.00 H new ATOM 1535 N GLU A 103 1.645 7.556 4.740 1.00 0.00 N ATOM 1536 CA GLU A 103 1.576 8.860 5.389 1.00 0.00 C ATOM 1537 C GLU A 103 2.730 9.752 4.942 1.00 0.00 C ATOM 1538 O GLU A 103 3.892 9.351 4.989 1.00 0.00 O ATOM 1539 CB GLU A 103 1.600 8.698 6.910 1.00 0.00 C ATOM 1540 CG GLU A 103 1.795 10.007 7.658 1.00 0.00 C ATOM 1541 CD GLU A 103 3.256 10.319 7.918 1.00 0.00 C ATOM 1542 OE1 GLU A 103 4.013 9.381 8.245 1.00 0.00 O ATOM 1543 OE2 GLU A 103 3.642 11.500 7.793 1.00 0.00 O ATOM 0 H GLU A 103 2.547 7.088 4.828 1.00 0.00 H new ATOM 0 HA GLU A 103 0.640 9.335 5.096 1.00 0.00 H new ATOM 0 HB2 GLU A 103 0.665 8.240 7.233 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.402 8.011 7.181 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.351 10.819 7.083 1.00 0.00 H new ATOM 0 HG3 GLU A 103 1.263 9.961 8.608 1.00 0.00 H new ATOM 1550 N ASN A 104 2.400 10.964 4.509 1.00 0.00 N ATOM 1551 CA ASN A 104 3.409 11.914 4.052 1.00 0.00 C ATOM 1552 C ASN A 104 3.442 13.146 4.952 1.00 0.00 C ATOM 1553 O ASN A 104 2.613 13.297 5.849 1.00 0.00 O ATOM 1554 CB ASN A 104 3.129 12.331 2.607 1.00 0.00 C ATOM 1555 CG ASN A 104 4.362 12.878 1.915 1.00 0.00 C ATOM 1556 OD1 ASN A 104 5.449 12.913 2.493 1.00 0.00 O ATOM 1557 ND2 ASN A 104 4.199 13.310 0.669 1.00 0.00 N ATOM 0 H ASN A 104 1.442 11.312 4.465 1.00 0.00 H new ATOM 0 HA ASN A 104 4.382 11.425 4.100 1.00 0.00 H new ATOM 0 HB2 ASN A 104 2.754 11.472 2.050 1.00 0.00 H new ATOM 0 HB3 ASN A 104 2.344 13.087 2.595 1.00 0.00 H new ATOM 0 HD21 ASN A 104 4.993 13.689 0.153 1.00 0.00 H new ATOM 0 HD22 ASN A 104 3.280 13.262 0.229 1.00 0.00 H new ATOM 1564 N THR A 105 4.408 14.026 4.705 1.00 0.00 N ATOM 1565 CA THR A 105 4.551 15.244 5.491 1.00 0.00 C ATOM 1566 C THR A 105 3.266 16.065 5.473 1.00 0.00 C ATOM 1567 O THR A 105 2.819 16.558 6.507 1.00 0.00 O ATOM 1568 CB THR A 105 5.711 16.115 4.972 1.00 0.00 C ATOM 1569 OG1 THR A 105 6.888 15.316 4.809 1.00 0.00 O ATOM 1570 CG2 THR A 105 5.998 17.261 5.931 1.00 0.00 C ATOM 0 H THR A 105 5.103 13.917 3.966 1.00 0.00 H new ATOM 0 HA THR A 105 4.767 14.936 6.514 1.00 0.00 H new ATOM 0 HB THR A 105 5.420 16.533 4.008 1.00 0.00 H new ATOM 0 HG1 THR A 105 7.620 15.876 4.477 1.00 0.00 H new ATOM 0 HG21 THR A 105 6.821 17.862 5.544 1.00 0.00 H new ATOM 0 HG22 THR A 105 5.109 17.884 6.030 1.00 0.00 H new ATOM 0 HG23 THR A 105 6.270 16.859 6.907 1.00 0.00 H new ATOM 1578 N ALA A 106 2.677 16.206 4.290 1.00 0.00 N ATOM 1579 CA ALA A 106 1.442 16.965 4.137 1.00 0.00 C ATOM 1580 C ALA A 106 0.287 16.286 4.867 1.00 0.00 C ATOM 1581 O ALA A 106 -0.212 16.796 5.869 1.00 0.00 O ATOM 1582 CB ALA A 106 1.108 17.139 2.663 1.00 0.00 C ATOM 0 H ALA A 106 3.035 15.804 3.424 1.00 0.00 H new ATOM 0 HA ALA A 106 1.591 17.949 4.582 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.183 17.708 2.564 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.918 17.674 2.167 1.00 0.00 H new ATOM 0 HB3 ALA A 106 0.983 16.160 2.200 1.00 0.00 H new ATOM 1588 N GLY A 107 -0.133 15.133 4.356 1.00 0.00 N ATOM 1589 CA GLY A 107 -1.227 14.404 4.971 1.00 0.00 C ATOM 1590 C GLY A 107 -0.933 12.923 5.106 1.00 0.00 C ATOM 1591 O GLY A 107 0.227 12.517 5.185 1.00 0.00 O ATOM 0 H GLY A 107 0.265 14.691 3.527 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -1.430 14.822 5.957 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -2.130 14.539 4.376 1.00 0.00 H new ATOM 1595 N HIS A 108 -1.986 12.112 5.136 1.00 0.00 N ATOM 1596 CA HIS A 108 -1.835 10.667 5.264 1.00 0.00 C ATOM 1597 C HIS A 108 -3.087 9.945 4.778 1.00 0.00 C ATOM 1598 O HIS A 108 -4.208 10.341 5.097 1.00 0.00 O ATOM 1599 CB HIS A 108 -1.547 10.290 6.718 1.00 0.00 C ATOM 1600 CG HIS A 108 -2.644 10.671 7.664 1.00 0.00 C ATOM 1601 ND1 HIS A 108 -3.053 11.973 7.858 1.00 0.00 N ATOM 1602 CD2 HIS A 108 -3.420 9.910 8.471 1.00 0.00 C ATOM 1603 CE1 HIS A 108 -4.032 11.998 8.745 1.00 0.00 C ATOM 1604 NE2 HIS A 108 -4.274 10.759 9.132 1.00 0.00 N ATOM 0 H HIS A 108 -2.953 12.431 5.073 1.00 0.00 H new ATOM 0 HA HIS A 108 -0.994 10.358 4.643 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -1.382 9.214 6.780 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -0.622 10.773 7.034 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -3.376 8.836 8.576 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -4.546 12.881 9.094 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -4.981 10.478 9.812 1.00 0.00 H new ATOM 1613 N ASP A 109 -2.889 8.884 4.003 1.00 0.00 N ATOM 1614 CA ASP A 109 -4.002 8.106 3.473 1.00 0.00 C ATOM 1615 C ASP A 109 -3.777 6.613 3.695 1.00 0.00 C ATOM 1616 O ASP A 109 -2.687 6.192 4.079 1.00 0.00 O ATOM 1617 CB ASP A 109 -4.186 8.390 1.981 1.00 0.00 C ATOM 1618 CG ASP A 109 -4.993 9.648 1.726 1.00 0.00 C ATOM 1619 OD1 ASP A 109 -4.805 10.634 2.470 1.00 0.00 O ATOM 1620 OD2 ASP A 109 -5.811 9.647 0.783 1.00 0.00 O ATOM 0 H ASP A 109 -1.968 8.543 3.728 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.906 8.402 4.006 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.208 8.487 1.509 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -4.683 7.541 1.511 1.00 0.00 H new ATOM 1625 N GLU A 110 -4.816 5.820 3.451 1.00 0.00 N ATOM 1626 CA GLU A 110 -4.731 4.375 3.627 1.00 0.00 C ATOM 1627 C GLU A 110 -5.800 3.663 2.803 1.00 0.00 C ATOM 1628 O GLU A 110 -6.807 4.260 2.425 1.00 0.00 O ATOM 1629 CB GLU A 110 -4.883 4.009 5.105 1.00 0.00 C ATOM 1630 CG GLU A 110 -5.020 2.516 5.351 1.00 0.00 C ATOM 1631 CD GLU A 110 -4.969 2.161 6.824 1.00 0.00 C ATOM 1632 OE1 GLU A 110 -5.916 2.521 7.554 1.00 0.00 O ATOM 1633 OE2 GLU A 110 -3.982 1.523 7.247 1.00 0.00 O ATOM 0 H GLU A 110 -5.725 6.154 3.131 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.751 4.049 3.278 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.018 4.381 5.654 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -5.759 4.517 5.508 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.963 2.167 4.929 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.222 1.990 4.826 1.00 0.00 H new ATOM 1640 N ALA A 111 -5.572 2.383 2.528 1.00 0.00 N ATOM 1641 CA ALA A 111 -6.515 1.589 1.751 1.00 0.00 C ATOM 1642 C ALA A 111 -6.586 0.157 2.271 1.00 0.00 C ATOM 1643 O ALA A 111 -5.756 -0.263 3.078 1.00 0.00 O ATOM 1644 CB ALA A 111 -6.126 1.599 0.280 1.00 0.00 C ATOM 0 H ALA A 111 -4.742 1.874 2.832 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.503 2.036 1.858 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -6.839 1.002 -0.289 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -6.133 2.624 -0.091 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -5.127 1.178 0.165 1.00 0.00 H new ATOM 1650 N VAL A 112 -7.583 -0.588 1.805 1.00 0.00 N ATOM 1651 CA VAL A 112 -7.763 -1.973 2.223 1.00 0.00 C ATOM 1652 C VAL A 112 -8.152 -2.858 1.044 1.00 0.00 C ATOM 1653 O VAL A 112 -8.806 -2.405 0.104 1.00 0.00 O ATOM 1654 CB VAL A 112 -8.840 -2.094 3.318 1.00 0.00 C ATOM 1655 CG1 VAL A 112 -9.013 -3.545 3.739 1.00 0.00 C ATOM 1656 CG2 VAL A 112 -8.484 -1.223 4.513 1.00 0.00 C ATOM 0 H VAL A 112 -8.279 -0.255 1.137 1.00 0.00 H new ATOM 0 HA VAL A 112 -6.807 -2.308 2.625 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.788 -1.743 2.911 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -9.778 -3.611 4.513 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.317 -4.140 2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -8.069 -3.926 4.129 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.255 -1.320 5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -7.525 -1.541 4.923 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.416 -0.182 4.197 1.00 0.00 H new ATOM 1666 N LEU A 113 -7.746 -4.121 1.100 1.00 0.00 N ATOM 1667 CA LEU A 113 -8.052 -5.071 0.036 1.00 0.00 C ATOM 1668 C LEU A 113 -8.142 -6.492 0.584 1.00 0.00 C ATOM 1669 O LEU A 113 -7.354 -6.888 1.443 1.00 0.00 O ATOM 1670 CB LEU A 113 -6.986 -5.001 -1.060 1.00 0.00 C ATOM 1671 CG LEU A 113 -7.392 -5.554 -2.426 1.00 0.00 C ATOM 1672 CD1 LEU A 113 -6.442 -5.058 -3.506 1.00 0.00 C ATOM 1673 CD2 LEU A 113 -7.424 -7.075 -2.398 1.00 0.00 C ATOM 0 H LEU A 113 -7.204 -4.511 1.871 1.00 0.00 H new ATOM 0 HA LEU A 113 -9.019 -4.803 -0.389 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.690 -3.959 -1.185 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.105 -5.544 -0.718 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.394 -5.194 -2.659 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.746 -5.462 -4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -6.470 -3.969 -3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.428 -5.388 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -7.715 -7.451 -3.379 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -6.435 -7.455 -2.143 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -8.145 -7.410 -1.652 1.00 0.00 H new ATOM 1685 N PHE A 114 -9.105 -7.255 0.079 1.00 0.00 N ATOM 1686 CA PHE A 114 -9.297 -8.633 0.517 1.00 0.00 C ATOM 1687 C PHE A 114 -9.026 -9.609 -0.624 1.00 0.00 C ATOM 1688 O PHE A 114 -9.493 -9.415 -1.747 1.00 0.00 O ATOM 1689 CB PHE A 114 -10.721 -8.829 1.043 1.00 0.00 C ATOM 1690 CG PHE A 114 -10.911 -8.343 2.452 1.00 0.00 C ATOM 1691 CD1 PHE A 114 -10.946 -6.987 2.732 1.00 0.00 C ATOM 1692 CD2 PHE A 114 -11.055 -9.243 3.496 1.00 0.00 C ATOM 1693 CE1 PHE A 114 -11.121 -6.536 4.027 1.00 0.00 C ATOM 1694 CE2 PHE A 114 -11.232 -8.798 4.792 1.00 0.00 C ATOM 1695 CZ PHE A 114 -11.263 -7.443 5.058 1.00 0.00 C ATOM 0 H PHE A 114 -9.765 -6.943 -0.634 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.589 -8.835 1.320 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -11.417 -8.304 0.389 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -10.975 -9.888 0.995 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -10.835 -6.273 1.929 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -11.029 -10.304 3.294 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.147 -5.476 4.232 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -11.346 -9.509 5.597 1.00 0.00 H new ATOM 0 HZ PHE A 114 -11.398 -7.094 6.071 1.00 0.00 H new ATOM 1705 N VAL A 115 -8.267 -10.659 -0.329 1.00 0.00 N ATOM 1706 CA VAL A 115 -7.932 -11.666 -1.328 1.00 0.00 C ATOM 1707 C VAL A 115 -8.663 -12.976 -1.054 1.00 0.00 C ATOM 1708 O VAL A 115 -8.513 -13.569 0.013 1.00 0.00 O ATOM 1709 CB VAL A 115 -6.416 -11.936 -1.369 1.00 0.00 C ATOM 1710 CG1 VAL A 115 -6.107 -13.109 -2.286 1.00 0.00 C ATOM 1711 CG2 VAL A 115 -5.666 -10.689 -1.812 1.00 0.00 C ATOM 0 H VAL A 115 -7.872 -10.834 0.595 1.00 0.00 H new ATOM 0 HA VAL A 115 -8.249 -11.271 -2.293 1.00 0.00 H new ATOM 0 HB VAL A 115 -6.083 -12.195 -0.364 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -5.031 -13.285 -2.302 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -6.615 -14.001 -1.919 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -6.453 -12.883 -3.295 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -4.596 -10.897 -1.836 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -6.001 -10.397 -2.807 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -5.863 -9.878 -1.111 1.00 0.00 H new ATOM 1721 N GLN A 116 -9.453 -13.421 -2.026 1.00 0.00 N ATOM 1722 CA GLN A 116 -10.208 -14.661 -1.889 1.00 0.00 C ATOM 1723 C GLN A 116 -9.465 -15.825 -2.537 1.00 0.00 C ATOM 1724 O GLN A 116 -9.259 -15.845 -3.750 1.00 0.00 O ATOM 1725 CB GLN A 116 -11.594 -14.512 -2.518 1.00 0.00 C ATOM 1726 CG GLN A 116 -12.295 -15.838 -2.767 1.00 0.00 C ATOM 1727 CD GLN A 116 -13.805 -15.713 -2.739 1.00 0.00 C ATOM 1728 OE1 GLN A 116 -14.369 -14.737 -3.235 1.00 0.00 O ATOM 1729 NE2 GLN A 116 -14.471 -16.705 -2.158 1.00 0.00 N ATOM 0 H GLN A 116 -9.587 -12.942 -2.916 1.00 0.00 H new ATOM 0 HA GLN A 116 -10.321 -14.872 -0.826 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -12.216 -13.899 -1.866 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -11.499 -13.977 -3.463 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -11.985 -16.233 -3.734 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -11.980 -16.559 -2.013 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.964 -17.495 -1.760 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -15.489 -16.676 -2.110 1.00 0.00 H new ATOM 1738 N VAL A 117 -9.063 -16.793 -1.719 1.00 0.00 N ATOM 1739 CA VAL A 117 -8.343 -17.961 -2.212 1.00 0.00 C ATOM 1740 C VAL A 117 -9.034 -19.252 -1.788 1.00 0.00 C ATOM 1741 O VAL A 117 -8.979 -19.643 -0.622 1.00 0.00 O ATOM 1742 CB VAL A 117 -6.889 -17.979 -1.705 1.00 0.00 C ATOM 1743 CG1 VAL A 117 -6.832 -17.605 -0.232 1.00 0.00 C ATOM 1744 CG2 VAL A 117 -6.260 -19.344 -1.943 1.00 0.00 C ATOM 0 H VAL A 117 -9.224 -16.791 -0.712 1.00 0.00 H new ATOM 0 HA VAL A 117 -8.340 -17.895 -3.300 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.318 -17.238 -2.264 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.797 -17.623 0.108 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.242 -16.604 -0.095 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.417 -18.319 0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.233 -19.340 -1.579 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.830 -20.105 -1.411 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.266 -19.566 -3.010 1.00 0.00 H new ATOM 1754 N SER A 118 -9.684 -19.910 -2.743 1.00 0.00 N ATOM 1755 CA SER A 118 -10.389 -21.157 -2.468 1.00 0.00 C ATOM 1756 C SER A 118 -9.408 -22.264 -2.093 1.00 0.00 C ATOM 1757 O SER A 118 -8.195 -22.062 -2.096 1.00 0.00 O ATOM 1758 CB SER A 118 -11.213 -21.580 -3.685 1.00 0.00 C ATOM 1759 OG SER A 118 -10.390 -21.744 -4.827 1.00 0.00 O ATOM 0 H SER A 118 -9.737 -19.601 -3.713 1.00 0.00 H new ATOM 0 HA SER A 118 -11.059 -20.989 -1.625 1.00 0.00 H new ATOM 0 HB2 SER A 118 -11.732 -22.514 -3.470 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.978 -20.830 -3.889 1.00 0.00 H new ATOM 0 HG SER A 118 -10.941 -22.016 -5.591 1.00 0.00 H new ATOM 1765 N GLY A 119 -9.945 -23.437 -1.770 1.00 0.00 N ATOM 1766 CA GLY A 119 -9.105 -24.560 -1.397 1.00 0.00 C ATOM 1767 C GLY A 119 -8.511 -25.265 -2.601 1.00 0.00 C ATOM 1768 O GLY A 119 -8.716 -24.862 -3.746 1.00 0.00 O ATOM 0 H GLY A 119 -10.947 -23.629 -1.760 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -8.300 -24.209 -0.752 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -9.692 -25.272 -0.816 1.00 0.00 H new ATOM 1772 N PRO A 120 -7.755 -26.343 -2.347 1.00 0.00 N ATOM 1773 CA PRO A 120 -7.113 -27.127 -3.406 1.00 0.00 C ATOM 1774 C PRO A 120 -8.122 -27.910 -4.240 1.00 0.00 C ATOM 1775 O PRO A 120 -9.279 -28.064 -3.848 1.00 0.00 O ATOM 1776 CB PRO A 120 -6.200 -28.084 -2.635 1.00 0.00 C ATOM 1777 CG PRO A 120 -6.832 -28.212 -1.292 1.00 0.00 C ATOM 1778 CD PRO A 120 -7.468 -26.880 -1.006 1.00 0.00 C ATOM 0 HA PRO A 120 -6.585 -26.494 -4.119 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -6.129 -29.051 -3.133 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.187 -27.690 -2.560 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -7.575 -29.009 -1.285 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.090 -28.461 -0.533 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -8.377 -26.988 -0.414 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -6.798 -26.227 -0.447 1.00 0.00 H new ATOM 1786 N SER A 121 -7.676 -28.403 -5.391 1.00 0.00 N ATOM 1787 CA SER A 121 -8.542 -29.167 -6.282 1.00 0.00 C ATOM 1788 C SER A 121 -8.585 -30.635 -5.869 1.00 0.00 C ATOM 1789 O SER A 121 -7.548 -31.261 -5.651 1.00 0.00 O ATOM 1790 CB SER A 121 -8.055 -29.046 -7.727 1.00 0.00 C ATOM 1791 OG SER A 121 -8.753 -29.940 -8.576 1.00 0.00 O ATOM 0 H SER A 121 -6.720 -28.287 -5.728 1.00 0.00 H new ATOM 0 HA SER A 121 -9.550 -28.757 -6.210 1.00 0.00 H new ATOM 0 HB2 SER A 121 -8.195 -28.023 -8.077 1.00 0.00 H new ATOM 0 HB3 SER A 121 -6.986 -29.255 -7.773 1.00 0.00 H new ATOM 0 HG SER A 121 -8.425 -29.842 -9.494 1.00 0.00 H new ATOM 1797 N SER A 122 -9.794 -31.178 -5.763 1.00 0.00 N ATOM 1798 CA SER A 122 -9.975 -32.571 -5.373 1.00 0.00 C ATOM 1799 C SER A 122 -9.136 -32.904 -4.143 1.00 0.00 C ATOM 1800 O SER A 122 -8.517 -33.965 -4.068 1.00 0.00 O ATOM 1801 CB SER A 122 -9.598 -33.500 -6.528 1.00 0.00 C ATOM 1802 OG SER A 122 -10.158 -34.789 -6.350 1.00 0.00 O ATOM 0 H SER A 122 -10.663 -30.674 -5.942 1.00 0.00 H new ATOM 0 HA SER A 122 -11.026 -32.719 -5.126 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.947 -33.075 -7.469 1.00 0.00 H new ATOM 0 HB3 SER A 122 -8.513 -33.578 -6.597 1.00 0.00 H new ATOM 0 HG SER A 122 -9.864 -35.158 -5.491 1.00 0.00 H new ATOM 1808 N GLY A 123 -9.120 -31.988 -3.179 1.00 0.00 N ATOM 1809 CA GLY A 123 -8.353 -32.202 -1.965 1.00 0.00 C ATOM 1810 C GLY A 123 -9.161 -32.891 -0.884 1.00 0.00 C ATOM 1811 O GLY A 123 -10.167 -33.540 -1.170 1.00 0.00 O ATOM 0 H GLY A 123 -9.624 -31.102 -3.217 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -7.473 -32.803 -2.196 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -7.995 -31.243 -1.591 1.00 0.00 H new TER 1815 GLY A 123