USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 934 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 SER OG : rot -51:sc= 0.085 USER MOD Set 1.2: A 64 LYS NZ :NH3+ -156:sc= -0.816 (180deg=-1.56) USER MOD Set 2.1: A 43 LYS NZ :NH3+ -169:sc= 0.065 (180deg=0) USER MOD Set 2.2: A 58 GLN : amide:sc= -0.191 K(o=-0.13,f=-2.7!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc=-0.00499 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 38:sc= 0.858 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 10 SER OG : rot 1:sc= 0.786 USER MOD Single : A 14 SER OG : rot 66:sc= 0.275 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= -1.6 (180deg=-3.12!) USER MOD Single : A 27 GLN : amide:sc= -4.04 K(o=-4,f=-12!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot -100:sc= -0.341 USER MOD Single : A 40 LYS NZ :NH3+ 153:sc= -0.931 (180deg=-2.14!) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc=-0.00101 X(o=-0.001,f=0) USER MOD Single : A 47 SER OG : rot 21:sc= 0.804 USER MOD Single : A 48 HIS : no HD1:sc= -5.28! C(o=-5.3!,f=-2.5!) USER MOD Single : A 54 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.63) USER MOD Single : A 55 SER OG : rot 180:sc= -0.39 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -2.44! C(o=-2.4!,f=-8.3!) USER MOD Single : A 69 ASN : amide:sc=-0.00209 X(o=-0.0021,f=-0.0021) USER MOD Single : A 71 THR OG1 : rot -170:sc= -0.992 USER MOD Single : A 74 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.38) USER MOD Single : A 75 HIS : no HD1:sc= -3.68! C(o=-3.7!,f=-7.9!) USER MOD Single : A 78 LYS NZ :NH3+ -141:sc= -0.208 (180deg=-1.37!) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 89 SER OG : rot 174:sc= 0.13 USER MOD Single : A 90 THR OG1 : rot -71:sc= 0.642 USER MOD Single : A 91 ASN : amide:sc= -6.1! C(o=-6.1!,f=-2.9!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -0.029 USER MOD Single : A 108 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 THR OG1 : rot 44:sc= 0.781 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.983 17.181 9.251 1.00 0.00 N ATOM 2 CA GLY A 1 12.726 17.842 9.550 1.00 0.00 C ATOM 3 C GLY A 1 11.811 17.920 8.344 1.00 0.00 C ATOM 4 O GLY A 1 10.670 17.459 8.390 1.00 0.00 O ATOM 0 H1 GLY A 1 14.573 17.153 10.107 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.796 16.210 8.927 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.482 17.705 8.504 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.219 17.306 10.353 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.927 18.849 9.916 1.00 0.00 H new ATOM 8 N SER A 2 12.311 18.505 7.260 1.00 0.00 N ATOM 9 CA SER A 2 11.528 18.647 6.038 1.00 0.00 C ATOM 10 C SER A 2 11.448 17.321 5.288 1.00 0.00 C ATOM 11 O SER A 2 10.375 16.908 4.848 1.00 0.00 O ATOM 12 CB SER A 2 12.142 19.720 5.136 1.00 0.00 C ATOM 13 OG SER A 2 13.497 19.425 4.842 1.00 0.00 O ATOM 0 H SER A 2 13.255 18.888 7.203 1.00 0.00 H new ATOM 0 HA SER A 2 10.518 18.950 6.315 1.00 0.00 H new ATOM 0 HB2 SER A 2 11.572 19.790 4.209 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.076 20.692 5.625 1.00 0.00 H new ATOM 0 HG SER A 2 13.866 20.124 4.263 1.00 0.00 H new ATOM 19 N SER A 3 12.591 16.658 5.146 1.00 0.00 N ATOM 20 CA SER A 3 12.652 15.380 4.446 1.00 0.00 C ATOM 21 C SER A 3 12.246 15.542 2.984 1.00 0.00 C ATOM 22 O SER A 3 11.548 14.696 2.425 1.00 0.00 O ATOM 23 CB SER A 3 11.744 14.356 5.130 1.00 0.00 C ATOM 24 OG SER A 3 12.196 14.070 6.442 1.00 0.00 O ATOM 0 H SER A 3 13.488 16.985 5.506 1.00 0.00 H new ATOM 0 HA SER A 3 13.681 15.022 4.481 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.724 14.738 5.169 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.718 13.438 4.543 1.00 0.00 H new ATOM 0 HG SER A 3 11.598 13.415 6.858 1.00 0.00 H new ATOM 30 N GLY A 4 12.688 16.635 2.371 1.00 0.00 N ATOM 31 CA GLY A 4 12.360 16.889 0.980 1.00 0.00 C ATOM 32 C GLY A 4 13.186 16.048 0.027 1.00 0.00 C ATOM 33 O GLY A 4 14.259 15.562 0.387 1.00 0.00 O ATOM 0 H GLY A 4 13.267 17.349 2.812 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.302 16.685 0.816 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.519 17.945 0.759 1.00 0.00 H new ATOM 37 N SER A 5 12.686 15.874 -1.192 1.00 0.00 N ATOM 38 CA SER A 5 13.383 15.081 -2.198 1.00 0.00 C ATOM 39 C SER A 5 13.254 15.720 -3.578 1.00 0.00 C ATOM 40 O SER A 5 12.265 16.390 -3.874 1.00 0.00 O ATOM 41 CB SER A 5 12.826 13.656 -2.230 1.00 0.00 C ATOM 42 OG SER A 5 13.142 12.959 -1.037 1.00 0.00 O ATOM 0 H SER A 5 11.801 16.271 -1.507 1.00 0.00 H new ATOM 0 HA SER A 5 14.439 15.045 -1.930 1.00 0.00 H new ATOM 0 HB2 SER A 5 11.744 13.688 -2.361 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.235 13.121 -3.087 1.00 0.00 H new ATOM 0 HG SER A 5 12.774 12.052 -1.081 1.00 0.00 H new ATOM 48 N SER A 6 14.262 15.506 -4.418 1.00 0.00 N ATOM 49 CA SER A 6 14.265 16.064 -5.765 1.00 0.00 C ATOM 50 C SER A 6 15.298 15.361 -6.641 1.00 0.00 C ATOM 51 O SER A 6 16.415 15.086 -6.205 1.00 0.00 O ATOM 52 CB SER A 6 14.556 17.565 -5.718 1.00 0.00 C ATOM 53 OG SER A 6 13.360 18.312 -5.582 1.00 0.00 O ATOM 0 H SER A 6 15.086 14.951 -4.189 1.00 0.00 H new ATOM 0 HA SER A 6 13.278 15.907 -6.199 1.00 0.00 H new ATOM 0 HB2 SER A 6 15.222 17.784 -4.883 1.00 0.00 H new ATOM 0 HB3 SER A 6 15.075 17.867 -6.628 1.00 0.00 H new ATOM 0 HG SER A 6 12.748 17.843 -4.977 1.00 0.00 H new ATOM 59 N GLY A 7 14.915 15.073 -7.882 1.00 0.00 N ATOM 60 CA GLY A 7 15.818 14.405 -8.800 1.00 0.00 C ATOM 61 C GLY A 7 16.306 13.072 -8.267 1.00 0.00 C ATOM 62 O GLY A 7 17.503 12.886 -8.046 1.00 0.00 O ATOM 0 H GLY A 7 13.996 15.291 -8.267 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.312 14.249 -9.753 1.00 0.00 H new ATOM 0 HA3 GLY A 7 16.675 15.050 -8.996 1.00 0.00 H new ATOM 66 N GLN A 8 15.378 12.144 -8.059 1.00 0.00 N ATOM 67 CA GLN A 8 15.721 10.823 -7.546 1.00 0.00 C ATOM 68 C GLN A 8 15.833 9.810 -8.681 1.00 0.00 C ATOM 69 O GLN A 8 14.886 9.608 -9.440 1.00 0.00 O ATOM 70 CB GLN A 8 14.673 10.358 -6.534 1.00 0.00 C ATOM 71 CG GLN A 8 15.181 9.288 -5.580 1.00 0.00 C ATOM 72 CD GLN A 8 15.888 9.871 -4.372 1.00 0.00 C ATOM 73 OE1 GLN A 8 16.538 10.913 -4.462 1.00 0.00 O ATOM 74 NE2 GLN A 8 15.765 9.200 -3.233 1.00 0.00 N ATOM 0 H GLN A 8 14.383 12.282 -8.238 1.00 0.00 H new ATOM 0 HA GLN A 8 16.689 10.894 -7.050 1.00 0.00 H new ATOM 0 HB2 GLN A 8 14.332 11.217 -5.956 1.00 0.00 H new ATOM 0 HB3 GLN A 8 13.807 9.972 -7.072 1.00 0.00 H new ATOM 0 HG2 GLN A 8 14.343 8.677 -5.246 1.00 0.00 H new ATOM 0 HG3 GLN A 8 15.865 8.627 -6.112 1.00 0.00 H new ATOM 0 HE21 GLN A 8 15.216 8.341 -3.204 1.00 0.00 H new ATOM 0 HE22 GLN A 8 16.219 9.544 -2.387 1.00 0.00 H new ATOM 83 N GLU A 9 16.997 9.178 -8.791 1.00 0.00 N ATOM 84 CA GLU A 9 17.232 8.187 -9.835 1.00 0.00 C ATOM 85 C GLU A 9 16.144 7.117 -9.825 1.00 0.00 C ATOM 86 O GLU A 9 15.413 6.969 -8.845 1.00 0.00 O ATOM 87 CB GLU A 9 18.604 7.536 -9.651 1.00 0.00 C ATOM 88 CG GLU A 9 19.733 8.292 -10.332 1.00 0.00 C ATOM 89 CD GLU A 9 19.883 7.923 -11.795 1.00 0.00 C ATOM 90 OE1 GLU A 9 19.050 8.375 -12.609 1.00 0.00 O ATOM 91 OE2 GLU A 9 20.833 7.183 -12.126 1.00 0.00 O ATOM 0 H GLU A 9 17.792 9.334 -8.171 1.00 0.00 H new ATOM 0 HA GLU A 9 17.206 8.698 -10.797 1.00 0.00 H new ATOM 0 HB2 GLU A 9 18.820 7.459 -8.585 1.00 0.00 H new ATOM 0 HB3 GLU A 9 18.570 6.520 -10.043 1.00 0.00 H new ATOM 0 HG2 GLU A 9 19.550 9.363 -10.248 1.00 0.00 H new ATOM 0 HG3 GLU A 9 20.668 8.087 -9.812 1.00 0.00 H new ATOM 98 N SER A 10 16.042 6.374 -10.922 1.00 0.00 N ATOM 99 CA SER A 10 15.040 5.321 -11.042 1.00 0.00 C ATOM 100 C SER A 10 15.451 4.299 -12.097 1.00 0.00 C ATOM 101 O SER A 10 15.936 4.657 -13.170 1.00 0.00 O ATOM 102 CB SER A 10 13.679 5.921 -11.399 1.00 0.00 C ATOM 103 OG SER A 10 13.181 6.722 -10.342 1.00 0.00 O ATOM 0 H SER A 10 16.641 6.481 -11.741 1.00 0.00 H new ATOM 0 HA SER A 10 14.964 4.814 -10.080 1.00 0.00 H new ATOM 0 HB2 SER A 10 13.769 6.522 -12.304 1.00 0.00 H new ATOM 0 HB3 SER A 10 12.972 5.121 -11.617 1.00 0.00 H new ATOM 0 HG SER A 10 13.826 6.728 -9.604 1.00 0.00 H new ATOM 109 N VAL A 11 15.254 3.022 -11.784 1.00 0.00 N ATOM 110 CA VAL A 11 15.602 1.946 -12.704 1.00 0.00 C ATOM 111 C VAL A 11 14.541 0.852 -12.697 1.00 0.00 C ATOM 112 O VAL A 11 14.173 0.338 -11.641 1.00 0.00 O ATOM 113 CB VAL A 11 16.966 1.325 -12.350 1.00 0.00 C ATOM 114 CG1 VAL A 11 17.284 0.166 -13.283 1.00 0.00 C ATOM 115 CG2 VAL A 11 18.062 2.380 -12.405 1.00 0.00 C ATOM 0 H VAL A 11 14.855 2.708 -10.900 1.00 0.00 H new ATOM 0 HA VAL A 11 15.659 2.386 -13.699 1.00 0.00 H new ATOM 0 HB VAL A 11 16.916 0.938 -11.332 1.00 0.00 H new ATOM 0 HG11 VAL A 11 18.252 -0.260 -13.017 1.00 0.00 H new ATOM 0 HG12 VAL A 11 16.513 -0.599 -13.189 1.00 0.00 H new ATOM 0 HG13 VAL A 11 17.316 0.525 -14.312 1.00 0.00 H new ATOM 0 HG21 VAL A 11 19.019 1.924 -12.152 1.00 0.00 H new ATOM 0 HG22 VAL A 11 18.114 2.799 -13.410 1.00 0.00 H new ATOM 0 HG23 VAL A 11 17.839 3.174 -11.692 1.00 0.00 H new ATOM 125 N GLU A 12 14.053 0.500 -13.882 1.00 0.00 N ATOM 126 CA GLU A 12 13.033 -0.534 -14.012 1.00 0.00 C ATOM 127 C GLU A 12 13.671 -1.905 -14.216 1.00 0.00 C ATOM 128 O GLU A 12 13.418 -2.576 -15.216 1.00 0.00 O ATOM 129 CB GLU A 12 12.097 -0.215 -15.180 1.00 0.00 C ATOM 130 CG GLU A 12 12.797 -0.181 -16.528 1.00 0.00 C ATOM 131 CD GLU A 12 12.037 0.629 -17.560 1.00 0.00 C ATOM 132 OE1 GLU A 12 11.822 1.836 -17.326 1.00 0.00 O ATOM 133 OE2 GLU A 12 11.657 0.055 -18.602 1.00 0.00 O ATOM 0 H GLU A 12 14.347 0.916 -14.766 1.00 0.00 H new ATOM 0 HA GLU A 12 12.454 -0.556 -13.088 1.00 0.00 H new ATOM 0 HB2 GLU A 12 11.302 -0.960 -15.211 1.00 0.00 H new ATOM 0 HB3 GLU A 12 11.623 0.750 -15.002 1.00 0.00 H new ATOM 0 HG2 GLU A 12 13.795 0.240 -16.404 1.00 0.00 H new ATOM 0 HG3 GLU A 12 12.924 -1.200 -16.893 1.00 0.00 H new ATOM 140 N ASP A 13 14.499 -2.313 -13.261 1.00 0.00 N ATOM 141 CA ASP A 13 15.174 -3.604 -13.335 1.00 0.00 C ATOM 142 C ASP A 13 14.401 -4.666 -12.560 1.00 0.00 C ATOM 143 O ASP A 13 14.150 -5.760 -13.068 1.00 0.00 O ATOM 144 CB ASP A 13 16.598 -3.491 -12.789 1.00 0.00 C ATOM 145 CG ASP A 13 17.254 -4.845 -12.600 1.00 0.00 C ATOM 146 OD1 ASP A 13 16.820 -5.595 -11.701 1.00 0.00 O ATOM 147 OD2 ASP A 13 18.202 -5.154 -13.352 1.00 0.00 O ATOM 0 H ASP A 13 14.719 -1.769 -12.427 1.00 0.00 H new ATOM 0 HA ASP A 13 15.218 -3.904 -14.382 1.00 0.00 H new ATOM 0 HB2 ASP A 13 17.199 -2.891 -13.472 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.578 -2.964 -11.835 1.00 0.00 H new ATOM 152 N SER A 14 14.027 -4.338 -11.328 1.00 0.00 N ATOM 153 CA SER A 14 13.287 -5.265 -10.480 1.00 0.00 C ATOM 154 C SER A 14 11.986 -4.635 -9.992 1.00 0.00 C ATOM 155 O SER A 14 11.687 -4.647 -8.797 1.00 0.00 O ATOM 156 CB SER A 14 14.141 -5.690 -9.285 1.00 0.00 C ATOM 157 OG SER A 14 14.939 -6.817 -9.603 1.00 0.00 O ATOM 0 H SER A 14 14.224 -3.436 -10.894 1.00 0.00 H new ATOM 0 HA SER A 14 13.043 -6.146 -11.074 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.781 -4.862 -8.979 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.496 -5.925 -8.438 1.00 0.00 H new ATOM 0 HG SER A 14 15.601 -6.568 -10.281 1.00 0.00 H new ATOM 163 N LEU A 15 11.216 -4.085 -10.924 1.00 0.00 N ATOM 164 CA LEU A 15 9.946 -3.449 -10.590 1.00 0.00 C ATOM 165 C LEU A 15 8.797 -4.447 -10.681 1.00 0.00 C ATOM 166 O LEU A 15 8.619 -5.113 -11.700 1.00 0.00 O ATOM 167 CB LEU A 15 9.684 -2.267 -11.525 1.00 0.00 C ATOM 168 CG LEU A 15 10.302 -0.932 -11.108 1.00 0.00 C ATOM 169 CD1 LEU A 15 10.270 0.056 -12.264 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.575 -0.363 -9.898 1.00 0.00 C ATOM 0 H LEU A 15 11.449 -4.066 -11.917 1.00 0.00 H new ATOM 0 HA LEU A 15 10.008 -3.087 -9.564 1.00 0.00 H new ATOM 0 HB2 LEU A 15 10.058 -2.524 -12.516 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.606 -2.133 -11.616 1.00 0.00 H new ATOM 0 HG LEU A 15 11.343 -1.105 -10.834 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.714 1.000 -11.948 1.00 0.00 H new ATOM 0 HD12 LEU A 15 10.835 -0.348 -13.104 1.00 0.00 H new ATOM 0 HD13 LEU A 15 9.237 0.225 -12.570 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.028 0.587 -9.615 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.525 -0.205 -10.145 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.650 -1.063 -9.066 1.00 0.00 H new ATOM 182 N ALA A 16 8.018 -4.544 -9.608 1.00 0.00 N ATOM 183 CA ALA A 16 6.884 -5.458 -9.567 1.00 0.00 C ATOM 184 C ALA A 16 5.567 -4.694 -9.475 1.00 0.00 C ATOM 185 O ALA A 16 5.480 -3.662 -8.809 1.00 0.00 O ATOM 186 CB ALA A 16 7.021 -6.419 -8.396 1.00 0.00 C ATOM 0 H ALA A 16 8.152 -4.000 -8.756 1.00 0.00 H new ATOM 0 HA ALA A 16 6.878 -6.032 -10.494 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.166 -7.095 -8.379 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.939 -6.997 -8.505 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.056 -5.854 -7.464 1.00 0.00 H new ATOM 192 N THR A 17 4.542 -5.207 -10.149 1.00 0.00 N ATOM 193 CA THR A 17 3.230 -4.572 -10.145 1.00 0.00 C ATOM 194 C THR A 17 2.489 -4.851 -8.842 1.00 0.00 C ATOM 195 O THR A 17 2.077 -5.981 -8.580 1.00 0.00 O ATOM 196 CB THR A 17 2.368 -5.057 -11.326 1.00 0.00 C ATOM 197 OG1 THR A 17 3.106 -4.946 -12.549 1.00 0.00 O ATOM 198 CG2 THR A 17 1.085 -4.246 -11.427 1.00 0.00 C ATOM 0 H THR A 17 4.596 -6.061 -10.705 1.00 0.00 H new ATOM 0 HA THR A 17 3.397 -3.499 -10.243 1.00 0.00 H new ATOM 0 HB THR A 17 2.107 -6.101 -11.153 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.552 -5.258 -13.295 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.492 -4.606 -12.268 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.512 -4.355 -10.506 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.330 -3.195 -11.580 1.00 0.00 H new ATOM 206 N VAL A 18 2.322 -3.813 -8.029 1.00 0.00 N ATOM 207 CA VAL A 18 1.628 -3.945 -6.753 1.00 0.00 C ATOM 208 C VAL A 18 0.281 -3.232 -6.783 1.00 0.00 C ATOM 209 O VAL A 18 0.218 -2.003 -6.826 1.00 0.00 O ATOM 210 CB VAL A 18 2.471 -3.379 -5.595 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.713 -3.488 -4.280 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.809 -4.098 -5.509 1.00 0.00 C ATOM 0 H VAL A 18 2.658 -2.871 -8.231 1.00 0.00 H new ATOM 0 HA VAL A 18 1.467 -5.011 -6.589 1.00 0.00 H new ATOM 0 HB VAL A 18 2.663 -2.324 -5.790 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.324 -3.083 -3.473 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.783 -2.924 -4.348 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.489 -4.535 -4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.392 -3.685 -4.685 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.640 -5.161 -5.337 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.355 -3.963 -6.443 1.00 0.00 H new ATOM 222 N LYS A 19 -0.795 -4.010 -6.760 1.00 0.00 N ATOM 223 CA LYS A 19 -2.143 -3.454 -6.783 1.00 0.00 C ATOM 224 C LYS A 19 -2.574 -3.016 -5.387 1.00 0.00 C ATOM 225 O LYS A 19 -2.487 -3.785 -4.430 1.00 0.00 O ATOM 226 CB LYS A 19 -3.132 -4.484 -7.335 1.00 0.00 C ATOM 227 CG LYS A 19 -3.033 -4.678 -8.838 1.00 0.00 C ATOM 228 CD LYS A 19 -3.417 -6.091 -9.244 1.00 0.00 C ATOM 229 CE LYS A 19 -4.927 -6.265 -9.298 1.00 0.00 C ATOM 230 NZ LYS A 19 -5.574 -5.897 -8.008 1.00 0.00 N ATOM 0 H LYS A 19 -0.760 -5.029 -6.725 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.138 -2.579 -7.434 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.960 -5.441 -6.842 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.146 -4.173 -7.083 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -3.685 -3.964 -9.342 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.015 -4.468 -9.167 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -2.988 -6.319 -10.220 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -2.993 -6.802 -8.535 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -5.335 -5.648 -10.098 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.165 -7.301 -9.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -6.503 -6.360 -7.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -4.974 -6.209 -7.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.697 -4.865 -7.963 1.00 0.00 H new ATOM 244 N VAL A 20 -3.041 -1.776 -5.279 1.00 0.00 N ATOM 245 CA VAL A 20 -3.489 -1.236 -4.001 1.00 0.00 C ATOM 246 C VAL A 20 -4.999 -1.026 -3.992 1.00 0.00 C ATOM 247 O VAL A 20 -5.565 -0.472 -4.934 1.00 0.00 O ATOM 248 CB VAL A 20 -2.793 0.100 -3.682 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.346 0.696 -2.396 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.287 -0.093 -3.585 1.00 0.00 C ATOM 0 H VAL A 20 -3.119 -1.126 -6.062 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.223 -1.967 -3.237 1.00 0.00 H new ATOM 0 HB VAL A 20 -2.995 0.798 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.842 1.640 -2.186 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.416 0.872 -2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.176 0.003 -1.572 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.812 0.862 -3.359 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.062 -0.807 -2.793 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.907 -0.472 -4.534 1.00 0.00 H new ATOM 260 N VAL A 21 -5.646 -1.472 -2.920 1.00 0.00 N ATOM 261 CA VAL A 21 -7.091 -1.332 -2.786 1.00 0.00 C ATOM 262 C VAL A 21 -7.458 -0.655 -1.471 1.00 0.00 C ATOM 263 O VAL A 21 -7.045 -1.095 -0.397 1.00 0.00 O ATOM 264 CB VAL A 21 -7.797 -2.698 -2.863 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.289 -2.544 -2.606 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.545 -3.354 -4.212 1.00 0.00 C ATOM 0 H VAL A 21 -5.192 -1.933 -2.132 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.427 -0.711 -3.616 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.384 -3.344 -2.088 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.771 -3.520 -2.665 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.446 -2.121 -1.614 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.721 -1.881 -3.355 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -8.052 -4.318 -4.248 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.928 -2.713 -5.006 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.474 -3.502 -4.350 1.00 0.00 H new ATOM 276 N LEU A 22 -8.238 0.417 -1.560 1.00 0.00 N ATOM 277 CA LEU A 22 -8.662 1.156 -0.376 1.00 0.00 C ATOM 278 C LEU A 22 -9.736 0.388 0.389 1.00 0.00 C ATOM 279 O LEU A 22 -10.753 -0.009 -0.180 1.00 0.00 O ATOM 280 CB LEU A 22 -9.191 2.535 -0.774 1.00 0.00 C ATOM 281 CG LEU A 22 -8.134 3.595 -1.085 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.751 4.757 -1.847 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.476 4.085 0.197 1.00 0.00 C ATOM 0 H LEU A 22 -8.590 0.794 -2.440 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.796 1.280 0.275 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.829 2.418 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.823 2.906 0.033 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.367 3.142 -1.713 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.984 5.501 -2.059 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.174 4.394 -2.784 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.539 5.210 -1.245 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.727 4.839 -0.044 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.232 4.521 0.850 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.998 3.247 0.704 1.00 0.00 H new ATOM 295 N ILE A 23 -9.503 0.185 1.681 1.00 0.00 N ATOM 296 CA ILE A 23 -10.451 -0.531 2.524 1.00 0.00 C ATOM 297 C ILE A 23 -11.710 0.296 2.763 1.00 0.00 C ATOM 298 O ILE A 23 -12.825 -0.118 2.446 1.00 0.00 O ATOM 299 CB ILE A 23 -9.829 -0.901 3.883 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.168 -2.279 3.808 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.887 -0.875 4.976 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.094 -3.368 3.313 1.00 0.00 C ATOM 0 H ILE A 23 -8.666 0.506 2.167 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.715 -1.446 1.993 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.064 -0.164 4.127 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.302 -2.222 3.148 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.798 -2.550 4.797 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.431 -1.139 5.930 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.316 0.125 5.043 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.673 -1.592 4.739 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.558 -4.317 3.286 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -10.948 -3.453 3.985 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.444 -3.120 2.311 1.00 0.00 H new ATOM 314 N PRO A 24 -11.529 1.497 3.333 1.00 0.00 N ATOM 315 CA PRO A 24 -12.638 2.410 3.624 1.00 0.00 C ATOM 316 C PRO A 24 -13.255 2.995 2.359 1.00 0.00 C ATOM 317 O PRO A 24 -14.470 3.175 2.274 1.00 0.00 O ATOM 318 CB PRO A 24 -11.980 3.513 4.458 1.00 0.00 C ATOM 319 CG PRO A 24 -10.547 3.491 4.051 1.00 0.00 C ATOM 320 CD PRO A 24 -10.228 2.055 3.737 1.00 0.00 C ATOM 0 HA PRO A 24 -13.459 1.905 4.132 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.433 4.484 4.259 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.091 3.322 5.525 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.378 4.127 3.182 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.908 3.867 4.850 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.490 1.973 2.939 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.820 1.535 4.604 1.00 0.00 H new ATOM 328 N VAL A 25 -12.410 3.290 1.376 1.00 0.00 N ATOM 329 CA VAL A 25 -12.873 3.854 0.113 1.00 0.00 C ATOM 330 C VAL A 25 -13.394 2.764 -0.817 1.00 0.00 C ATOM 331 O VAL A 25 -14.522 2.836 -1.303 1.00 0.00 O ATOM 332 CB VAL A 25 -11.750 4.629 -0.601 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.331 5.579 -1.637 1.00 0.00 C ATOM 334 CG2 VAL A 25 -10.898 5.383 0.409 1.00 0.00 C ATOM 0 H VAL A 25 -11.401 3.148 1.430 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.684 4.542 0.352 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.111 3.914 -1.119 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.522 6.118 -2.131 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.893 5.010 -2.377 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.994 6.291 -1.146 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.109 5.925 -0.113 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.522 6.089 0.957 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.451 4.676 1.108 1.00 0.00 H new ATOM 344 N GLY A 26 -12.565 1.754 -1.059 1.00 0.00 N ATOM 345 CA GLY A 26 -12.960 0.662 -1.930 1.00 0.00 C ATOM 346 C GLY A 26 -12.471 0.849 -3.353 1.00 0.00 C ATOM 347 O GLY A 26 -12.816 0.071 -4.241 1.00 0.00 O ATOM 0 H GLY A 26 -11.627 1.672 -0.668 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.567 -0.275 -1.534 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -14.047 0.577 -1.931 1.00 0.00 H new ATOM 351 N GLN A 27 -11.667 1.886 -3.569 1.00 0.00 N ATOM 352 CA GLN A 27 -11.133 2.173 -4.895 1.00 0.00 C ATOM 353 C GLN A 27 -9.875 1.354 -5.165 1.00 0.00 C ATOM 354 O GLN A 27 -9.250 0.838 -4.239 1.00 0.00 O ATOM 355 CB GLN A 27 -10.823 3.665 -5.030 1.00 0.00 C ATOM 356 CG GLN A 27 -10.403 4.075 -6.432 1.00 0.00 C ATOM 357 CD GLN A 27 -10.146 5.564 -6.553 1.00 0.00 C ATOM 358 OE1 GLN A 27 -10.579 6.205 -7.511 1.00 0.00 O ATOM 359 NE2 GLN A 27 -9.438 6.124 -5.579 1.00 0.00 N ATOM 0 H GLN A 27 -11.372 2.540 -2.844 1.00 0.00 H new ATOM 0 HA GLN A 27 -11.888 1.897 -5.631 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.704 4.238 -4.742 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -10.029 3.927 -4.331 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -9.501 3.531 -6.710 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.181 3.786 -7.139 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -9.098 5.555 -4.803 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -9.234 7.123 -5.606 1.00 0.00 H new ATOM 368 N GLU A 28 -9.512 1.238 -6.438 1.00 0.00 N ATOM 369 CA GLU A 28 -8.330 0.480 -6.829 1.00 0.00 C ATOM 370 C GLU A 28 -7.279 1.394 -7.453 1.00 0.00 C ATOM 371 O GLU A 28 -7.608 2.322 -8.191 1.00 0.00 O ATOM 372 CB GLU A 28 -8.709 -0.627 -7.815 1.00 0.00 C ATOM 373 CG GLU A 28 -9.515 -1.751 -7.187 1.00 0.00 C ATOM 374 CD GLU A 28 -10.397 -2.468 -8.191 1.00 0.00 C ATOM 375 OE1 GLU A 28 -11.264 -1.806 -8.799 1.00 0.00 O ATOM 376 OE2 GLU A 28 -10.220 -3.692 -8.368 1.00 0.00 O ATOM 0 H GLU A 28 -10.019 1.659 -7.216 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.907 0.028 -5.932 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.283 -0.192 -8.633 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.800 -1.042 -8.249 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.835 -2.469 -6.729 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.136 -1.345 -6.388 1.00 0.00 H new ATOM 383 N ILE A 29 -6.014 1.124 -7.150 1.00 0.00 N ATOM 384 CA ILE A 29 -4.915 1.920 -7.681 1.00 0.00 C ATOM 385 C ILE A 29 -3.707 1.047 -8.002 1.00 0.00 C ATOM 386 O ILE A 29 -3.253 0.265 -7.166 1.00 0.00 O ATOM 387 CB ILE A 29 -4.489 3.022 -6.693 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.708 3.829 -6.240 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.451 3.933 -7.330 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.401 4.819 -5.138 1.00 0.00 C ATOM 0 H ILE A 29 -5.725 0.360 -6.539 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.278 2.385 -8.598 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.042 2.552 -5.817 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.117 4.366 -7.096 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.481 3.142 -5.895 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.160 4.706 -6.619 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.575 3.348 -7.608 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.873 4.399 -8.220 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.310 5.355 -4.867 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.020 4.287 -4.266 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.651 5.529 -5.486 1.00 0.00 H new ATOM 402 N VAL A 30 -3.188 1.186 -9.218 1.00 0.00 N ATOM 403 CA VAL A 30 -2.030 0.412 -9.649 1.00 0.00 C ATOM 404 C VAL A 30 -0.777 1.278 -9.695 1.00 0.00 C ATOM 405 O VAL A 30 -0.729 2.281 -10.408 1.00 0.00 O ATOM 406 CB VAL A 30 -2.260 -0.216 -11.036 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.023 -0.976 -11.490 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.478 -1.127 -11.014 1.00 0.00 C ATOM 0 H VAL A 30 -3.552 1.828 -9.922 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.890 -0.384 -8.918 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.448 0.585 -11.751 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.204 -1.413 -12.472 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.176 -0.292 -11.548 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.801 -1.769 -10.776 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.625 -1.562 -12.003 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.323 -1.924 -10.286 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.360 -0.549 -10.737 1.00 0.00 H new ATOM 418 N ILE A 31 0.237 0.884 -8.932 1.00 0.00 N ATOM 419 CA ILE A 31 1.492 1.623 -8.888 1.00 0.00 C ATOM 420 C ILE A 31 2.681 0.679 -8.746 1.00 0.00 C ATOM 421 O ILE A 31 2.690 -0.228 -7.914 1.00 0.00 O ATOM 422 CB ILE A 31 1.510 2.632 -7.724 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.747 3.528 -7.817 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.477 1.902 -6.390 1.00 0.00 C ATOM 425 CD1 ILE A 31 2.848 4.536 -6.694 1.00 0.00 C ATOM 0 H ILE A 31 0.214 0.057 -8.336 1.00 0.00 H new ATOM 0 HA ILE A 31 1.572 2.165 -9.830 1.00 0.00 H new ATOM 0 HB ILE A 31 0.623 3.261 -7.793 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.640 2.903 -7.815 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.731 4.058 -8.770 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.490 2.628 -5.577 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.569 1.302 -6.326 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.348 1.252 -6.309 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.748 5.137 -6.824 1.00 0.00 H new ATOM 0 HD12 ILE A 31 1.973 5.186 -6.709 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.896 4.013 -5.739 1.00 0.00 H new ATOM 437 N PRO A 32 3.712 0.897 -9.577 1.00 0.00 N ATOM 438 CA PRO A 32 4.927 0.078 -9.563 1.00 0.00 C ATOM 439 C PRO A 32 5.764 0.304 -8.308 1.00 0.00 C ATOM 440 O PRO A 32 5.913 1.435 -7.845 1.00 0.00 O ATOM 441 CB PRO A 32 5.687 0.549 -10.805 1.00 0.00 C ATOM 442 CG PRO A 32 5.206 1.939 -11.039 1.00 0.00 C ATOM 443 CD PRO A 32 3.769 1.960 -10.594 1.00 0.00 C ATOM 0 HA PRO A 32 4.700 -0.988 -9.565 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.765 0.525 -10.642 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.480 -0.091 -11.662 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.800 2.658 -10.475 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.293 2.210 -12.091 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.491 2.929 -10.179 1.00 0.00 H new ATOM 0 HD3 PRO A 32 3.089 1.761 -11.422 1.00 0.00 H new ATOM 451 N PHE A 33 6.308 -0.778 -7.762 1.00 0.00 N ATOM 452 CA PHE A 33 7.130 -0.697 -6.560 1.00 0.00 C ATOM 453 C PHE A 33 8.296 -1.679 -6.632 1.00 0.00 C ATOM 454 O PHE A 33 8.123 -2.840 -7.005 1.00 0.00 O ATOM 455 CB PHE A 33 6.284 -0.982 -5.318 1.00 0.00 C ATOM 456 CG PHE A 33 6.816 -0.338 -4.070 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.120 1.014 -4.047 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.013 -1.084 -2.919 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.610 1.610 -2.900 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.502 -0.494 -1.769 1.00 0.00 C ATOM 461 CZ PHE A 33 7.802 0.854 -1.760 1.00 0.00 C ATOM 0 H PHE A 33 6.195 -1.722 -8.133 1.00 0.00 H new ATOM 0 HA PHE A 33 7.533 0.314 -6.492 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.267 -0.632 -5.493 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.228 -2.060 -5.166 1.00 0.00 H new ATOM 0 HD1 PHE A 33 6.972 1.609 -4.936 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.782 -2.139 -2.921 1.00 0.00 H new ATOM 0 HE1 PHE A 33 7.842 2.665 -2.895 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.649 -1.087 -0.878 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.186 1.316 -0.863 1.00 0.00 H new ATOM 471 N LYS A 34 9.484 -1.205 -6.272 1.00 0.00 N ATOM 472 CA LYS A 34 10.680 -2.039 -6.293 1.00 0.00 C ATOM 473 C LYS A 34 10.633 -3.085 -5.184 1.00 0.00 C ATOM 474 O LYS A 34 10.202 -2.801 -4.066 1.00 0.00 O ATOM 475 CB LYS A 34 11.933 -1.174 -6.141 1.00 0.00 C ATOM 476 CG LYS A 34 12.330 -0.450 -7.416 1.00 0.00 C ATOM 477 CD LYS A 34 13.699 0.198 -7.285 1.00 0.00 C ATOM 478 CE LYS A 34 13.624 1.509 -6.519 1.00 0.00 C ATOM 479 NZ LYS A 34 14.841 2.342 -6.725 1.00 0.00 N ATOM 0 H LYS A 34 9.644 -0.247 -5.962 1.00 0.00 H new ATOM 0 HA LYS A 34 10.717 -2.554 -7.253 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.764 -0.440 -5.354 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.762 -1.803 -5.817 1.00 0.00 H new ATOM 0 HG2 LYS A 34 12.338 -1.154 -8.248 1.00 0.00 H new ATOM 0 HG3 LYS A 34 11.586 0.312 -7.650 1.00 0.00 H new ATOM 0 HD2 LYS A 34 14.378 -0.485 -6.774 1.00 0.00 H new ATOM 0 HD3 LYS A 34 14.114 0.378 -8.277 1.00 0.00 H new ATOM 0 HE2 LYS A 34 12.744 2.067 -6.839 1.00 0.00 H new ATOM 0 HE3 LYS A 34 13.501 1.302 -5.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 14.751 3.227 -6.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 15.679 1.820 -6.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.945 2.561 -7.736 1.00 0.00 H new ATOM 493 N VAL A 35 11.082 -4.296 -5.499 1.00 0.00 N ATOM 494 CA VAL A 35 11.094 -5.384 -4.528 1.00 0.00 C ATOM 495 C VAL A 35 12.235 -5.217 -3.530 1.00 0.00 C ATOM 496 O VAL A 35 12.086 -5.518 -2.346 1.00 0.00 O ATOM 497 CB VAL A 35 11.228 -6.753 -5.221 1.00 0.00 C ATOM 498 CG1 VAL A 35 10.066 -6.986 -6.174 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.557 -6.851 -5.954 1.00 0.00 C ATOM 0 H VAL A 35 11.442 -4.548 -6.419 1.00 0.00 H new ATOM 0 HA VAL A 35 10.143 -5.346 -3.997 1.00 0.00 H new ATOM 0 HB VAL A 35 11.202 -7.531 -4.458 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.178 -7.958 -6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.129 -6.962 -5.618 1.00 0.00 H new ATOM 0 HG13 VAL A 35 10.057 -6.205 -6.934 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.635 -7.825 -6.438 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.616 -6.066 -6.708 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.374 -6.733 -5.243 1.00 0.00 H new ATOM 509 N ASP A 36 13.373 -4.735 -4.017 1.00 0.00 N ATOM 510 CA ASP A 36 14.540 -4.526 -3.168 1.00 0.00 C ATOM 511 C ASP A 36 14.489 -3.155 -2.502 1.00 0.00 C ATOM 512 O ASP A 36 15.521 -2.522 -2.277 1.00 0.00 O ATOM 513 CB ASP A 36 15.824 -4.661 -3.987 1.00 0.00 C ATOM 514 CG ASP A 36 17.063 -4.724 -3.115 1.00 0.00 C ATOM 515 OD1 ASP A 36 17.040 -5.457 -2.105 1.00 0.00 O ATOM 516 OD2 ASP A 36 18.055 -4.040 -3.444 1.00 0.00 O ATOM 0 H ASP A 36 13.512 -4.482 -4.995 1.00 0.00 H new ATOM 0 HA ASP A 36 14.533 -5.289 -2.389 1.00 0.00 H new ATOM 0 HB2 ASP A 36 15.768 -5.561 -4.599 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.906 -3.816 -4.670 1.00 0.00 H new ATOM 521 N THR A 37 13.280 -2.699 -2.188 1.00 0.00 N ATOM 522 CA THR A 37 13.093 -1.402 -1.550 1.00 0.00 C ATOM 523 C THR A 37 12.084 -1.490 -0.410 1.00 0.00 C ATOM 524 O THR A 37 11.103 -2.229 -0.493 1.00 0.00 O ATOM 525 CB THR A 37 12.618 -0.342 -2.561 1.00 0.00 C ATOM 526 OG1 THR A 37 13.576 -0.206 -3.616 1.00 0.00 O ATOM 527 CG2 THR A 37 12.412 1.002 -1.879 1.00 0.00 C ATOM 0 H THR A 37 12.415 -3.210 -2.366 1.00 0.00 H new ATOM 0 HA THR A 37 14.062 -1.103 -1.151 1.00 0.00 H new ATOM 0 HB THR A 37 11.665 -0.670 -2.977 1.00 0.00 H new ATOM 0 HG1 THR A 37 14.133 0.584 -3.452 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.077 1.735 -2.613 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.660 0.901 -1.097 1.00 0.00 H new ATOM 0 HG23 THR A 37 13.352 1.334 -1.438 1.00 0.00 H new ATOM 535 N ILE A 38 12.332 -0.732 0.652 1.00 0.00 N ATOM 536 CA ILE A 38 11.443 -0.724 1.808 1.00 0.00 C ATOM 537 C ILE A 38 10.018 -0.363 1.403 1.00 0.00 C ATOM 538 O ILE A 38 9.764 0.021 0.260 1.00 0.00 O ATOM 539 CB ILE A 38 11.927 0.268 2.882 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.138 1.654 2.270 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.210 -0.233 3.528 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.608 2.690 3.267 1.00 0.00 C ATOM 0 H ILE A 38 13.140 -0.116 0.737 1.00 0.00 H new ATOM 0 HA ILE A 38 11.455 -1.732 2.223 1.00 0.00 H new ATOM 0 HB ILE A 38 11.162 0.345 3.654 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.869 1.579 1.465 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.203 1.991 1.822 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.539 0.479 4.285 1.00 0.00 H new ATOM 0 HG22 ILE A 38 13.028 -1.201 3.995 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.984 -0.337 2.767 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.736 3.648 2.763 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.868 2.794 4.060 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.559 2.376 3.697 1.00 0.00 H new ATOM 554 N LEU A 39 9.092 -0.486 2.347 1.00 0.00 N ATOM 555 CA LEU A 39 7.691 -0.171 2.089 1.00 0.00 C ATOM 556 C LEU A 39 7.406 1.304 2.356 1.00 0.00 C ATOM 557 O LEU A 39 6.578 1.919 1.685 1.00 0.00 O ATOM 558 CB LEU A 39 6.783 -1.043 2.959 1.00 0.00 C ATOM 559 CG LEU A 39 6.923 -2.554 2.771 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.603 -3.285 4.065 1.00 0.00 C ATOM 561 CD2 LEU A 39 6.019 -3.037 1.646 1.00 0.00 C ATOM 0 H LEU A 39 9.285 -0.801 3.298 1.00 0.00 H new ATOM 0 HA LEU A 39 7.485 -0.378 1.039 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.980 -0.807 4.005 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.748 -0.767 2.760 1.00 0.00 H new ATOM 0 HG LEU A 39 7.956 -2.773 2.500 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.708 -4.359 3.912 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.291 -2.961 4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.580 -3.060 4.367 1.00 0.00 H new ATOM 0 HD21 LEU A 39 6.131 -4.115 1.526 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.982 -2.805 1.888 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.295 -2.538 0.717 1.00 0.00 H new ATOM 573 N LYS A 40 8.101 1.866 3.340 1.00 0.00 N ATOM 574 CA LYS A 40 7.927 3.270 3.695 1.00 0.00 C ATOM 575 C LYS A 40 7.670 4.117 2.453 1.00 0.00 C ATOM 576 O LYS A 40 6.639 4.783 2.346 1.00 0.00 O ATOM 577 CB LYS A 40 9.164 3.788 4.432 1.00 0.00 C ATOM 578 CG LYS A 40 8.861 4.903 5.417 1.00 0.00 C ATOM 579 CD LYS A 40 10.052 5.831 5.591 1.00 0.00 C ATOM 580 CE LYS A 40 11.057 5.268 6.585 1.00 0.00 C ATOM 581 NZ LYS A 40 12.023 4.342 5.932 1.00 0.00 N ATOM 0 H LYS A 40 8.790 1.370 3.906 1.00 0.00 H new ATOM 0 HA LYS A 40 7.061 3.348 4.352 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.632 2.961 4.965 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.889 4.147 3.701 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.001 5.475 5.068 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.589 4.474 6.381 1.00 0.00 H new ATOM 0 HD2 LYS A 40 10.538 5.985 4.628 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.707 6.807 5.934 1.00 0.00 H new ATOM 0 HE2 LYS A 40 11.601 6.087 7.056 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.527 4.740 7.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 12.915 4.338 6.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.625 3.381 5.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.204 4.659 4.958 1.00 0.00 H new ATOM 595 N TYR A 41 8.611 4.086 1.516 1.00 0.00 N ATOM 596 CA TYR A 41 8.486 4.852 0.282 1.00 0.00 C ATOM 597 C TYR A 41 7.038 4.884 -0.196 1.00 0.00 C ATOM 598 O TYR A 41 6.459 5.955 -0.388 1.00 0.00 O ATOM 599 CB TYR A 41 9.380 4.254 -0.807 1.00 0.00 C ATOM 600 CG TYR A 41 10.774 4.838 -0.833 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.732 4.444 0.093 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.135 5.784 -1.786 1.00 0.00 C ATOM 603 CE1 TYR A 41 13.007 4.975 0.072 1.00 0.00 C ATOM 604 CE2 TYR A 41 12.408 6.319 -1.815 1.00 0.00 C ATOM 605 CZ TYR A 41 13.340 5.912 -0.883 1.00 0.00 C ATOM 606 OH TYR A 41 14.609 6.443 -0.908 1.00 0.00 O ATOM 0 H TYR A 41 9.469 3.539 1.588 1.00 0.00 H new ATOM 0 HA TYR A 41 8.805 5.874 0.486 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.449 3.176 -0.658 1.00 0.00 H new ATOM 0 HB3 TYR A 41 8.911 4.412 -1.778 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.475 3.710 0.842 1.00 0.00 H new ATOM 0 HD2 TYR A 41 10.407 6.106 -2.516 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.739 4.658 0.800 1.00 0.00 H new ATOM 0 HE2 TYR A 41 12.672 7.052 -2.563 1.00 0.00 H new ATOM 0 HH TYR A 41 14.679 7.088 -1.643 1.00 0.00 H new ATOM 616 N LEU A 42 6.457 3.705 -0.384 1.00 0.00 N ATOM 617 CA LEU A 42 5.075 3.596 -0.838 1.00 0.00 C ATOM 618 C LEU A 42 4.112 4.130 0.216 1.00 0.00 C ATOM 619 O LEU A 42 3.084 4.725 -0.110 1.00 0.00 O ATOM 620 CB LEU A 42 4.737 2.139 -1.162 1.00 0.00 C ATOM 621 CG LEU A 42 3.451 1.909 -1.957 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.632 2.346 -3.403 1.00 0.00 C ATOM 623 CD2 LEU A 42 3.036 0.447 -1.887 1.00 0.00 C ATOM 0 H LEU A 42 6.921 2.810 -0.229 1.00 0.00 H new ATOM 0 HA LEU A 42 4.967 4.197 -1.741 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.568 1.710 -1.722 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.665 1.587 -0.225 1.00 0.00 H new ATOM 0 HG LEU A 42 2.659 2.512 -1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.707 2.175 -3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.882 3.407 -3.434 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.437 1.770 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.119 0.301 -2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.827 -0.176 -2.305 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.864 0.167 -0.848 1.00 0.00 H new ATOM 635 N LYS A 43 4.452 3.917 1.483 1.00 0.00 N ATOM 636 CA LYS A 43 3.620 4.380 2.587 1.00 0.00 C ATOM 637 C LYS A 43 3.446 5.895 2.539 1.00 0.00 C ATOM 638 O LYS A 43 2.329 6.397 2.409 1.00 0.00 O ATOM 639 CB LYS A 43 4.238 3.969 3.926 1.00 0.00 C ATOM 640 CG LYS A 43 3.219 3.793 5.038 1.00 0.00 C ATOM 641 CD LYS A 43 3.743 2.882 6.135 1.00 0.00 C ATOM 642 CE LYS A 43 3.482 1.418 5.817 1.00 0.00 C ATOM 643 NZ LYS A 43 4.045 0.515 6.858 1.00 0.00 N ATOM 0 H LYS A 43 5.299 3.426 1.771 1.00 0.00 H new ATOM 0 HA LYS A 43 2.639 3.916 2.489 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.783 3.035 3.793 1.00 0.00 H new ATOM 0 HB3 LYS A 43 4.966 4.723 4.227 1.00 0.00 H new ATOM 0 HG2 LYS A 43 2.968 4.766 5.461 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.299 3.377 4.627 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.814 3.042 6.262 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.268 3.140 7.081 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.408 1.251 5.733 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.919 1.173 4.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 4.013 -0.468 6.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 5.031 0.782 7.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 3.485 0.599 7.730 1.00 0.00 H new ATOM 657 N ASP A 44 4.556 6.617 2.644 1.00 0.00 N ATOM 658 CA ASP A 44 4.526 8.075 2.610 1.00 0.00 C ATOM 659 C ASP A 44 3.759 8.574 1.389 1.00 0.00 C ATOM 660 O ASP A 44 2.901 9.451 1.498 1.00 0.00 O ATOM 661 CB ASP A 44 5.949 8.635 2.597 1.00 0.00 C ATOM 662 CG ASP A 44 6.647 8.470 3.933 1.00 0.00 C ATOM 663 OD1 ASP A 44 6.945 7.317 4.307 1.00 0.00 O ATOM 664 OD2 ASP A 44 6.895 9.494 4.604 1.00 0.00 O ATOM 0 H ASP A 44 5.488 6.217 2.753 1.00 0.00 H new ATOM 0 HA ASP A 44 4.014 8.425 3.507 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.528 8.131 1.823 1.00 0.00 H new ATOM 0 HB3 ASP A 44 5.918 9.692 2.334 1.00 0.00 H new ATOM 669 N HIS A 45 4.073 8.010 0.227 1.00 0.00 N ATOM 670 CA HIS A 45 3.414 8.398 -1.015 1.00 0.00 C ATOM 671 C HIS A 45 1.950 8.750 -0.766 1.00 0.00 C ATOM 672 O HIS A 45 1.442 9.741 -1.289 1.00 0.00 O ATOM 673 CB HIS A 45 3.512 7.271 -2.043 1.00 0.00 C ATOM 674 CG HIS A 45 3.338 7.734 -3.457 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.357 7.715 -4.386 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.254 8.228 -4.100 1.00 0.00 C ATOM 677 CE1 HIS A 45 3.908 8.179 -5.538 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.635 8.497 -5.391 1.00 0.00 N ATOM 0 H HIS A 45 4.780 7.283 0.120 1.00 0.00 H new ATOM 0 HA HIS A 45 3.920 9.281 -1.406 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.483 6.785 -1.945 1.00 0.00 H new ATOM 0 HB3 HIS A 45 2.755 6.519 -1.820 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.273 8.382 -3.676 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.484 8.281 -6.446 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.032 8.881 -6.119 1.00 0.00 H new ATOM 687 N PHE A 46 1.278 7.930 0.036 1.00 0.00 N ATOM 688 CA PHE A 46 -0.128 8.153 0.353 1.00 0.00 C ATOM 689 C PHE A 46 -0.273 9.003 1.612 1.00 0.00 C ATOM 690 O PHE A 46 -0.946 10.034 1.604 1.00 0.00 O ATOM 691 CB PHE A 46 -0.849 6.817 0.539 1.00 0.00 C ATOM 692 CG PHE A 46 -1.071 6.071 -0.745 1.00 0.00 C ATOM 693 CD1 PHE A 46 -0.010 5.479 -1.410 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.341 5.963 -1.288 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.211 4.791 -2.593 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.549 5.277 -2.470 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.482 4.691 -3.123 1.00 0.00 C ATOM 0 H PHE A 46 1.684 7.105 0.478 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.582 8.689 -0.480 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -0.269 6.192 1.217 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.812 6.997 1.017 1.00 0.00 H new ATOM 0 HD1 PHE A 46 0.986 5.555 -1.000 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -3.178 6.420 -0.782 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.625 4.333 -3.101 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.544 5.199 -2.882 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.642 4.155 -4.047 1.00 0.00 H new ATOM 707 N SER A 47 0.362 8.562 2.693 1.00 0.00 N ATOM 708 CA SER A 47 0.301 9.278 3.962 1.00 0.00 C ATOM 709 C SER A 47 0.291 10.786 3.734 1.00 0.00 C ATOM 710 O SER A 47 -0.578 11.497 4.240 1.00 0.00 O ATOM 711 CB SER A 47 1.487 8.892 4.847 1.00 0.00 C ATOM 712 OG SER A 47 1.393 9.506 6.121 1.00 0.00 O ATOM 0 H SER A 47 0.925 7.712 2.716 1.00 0.00 H new ATOM 0 HA SER A 47 -0.624 8.998 4.465 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.521 7.809 4.963 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.418 9.190 4.364 1.00 0.00 H new ATOM 0 HG SER A 47 0.463 9.765 6.292 1.00 0.00 H new ATOM 718 N HIS A 48 1.264 11.269 2.968 1.00 0.00 N ATOM 719 CA HIS A 48 1.369 12.693 2.671 1.00 0.00 C ATOM 720 C HIS A 48 0.207 13.153 1.796 1.00 0.00 C ATOM 721 O HIS A 48 -0.512 14.091 2.142 1.00 0.00 O ATOM 722 CB HIS A 48 2.697 12.995 1.976 1.00 0.00 C ATOM 723 CG HIS A 48 2.610 12.968 0.481 1.00 0.00 C ATOM 724 ND1 HIS A 48 2.376 14.095 -0.279 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.729 11.943 -0.394 1.00 0.00 C ATOM 726 CE1 HIS A 48 2.353 13.763 -1.558 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.565 12.462 -1.655 1.00 0.00 N ATOM 0 H HIS A 48 1.991 10.695 2.542 1.00 0.00 H new ATOM 0 HA HIS A 48 1.329 13.239 3.614 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.049 13.976 2.294 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.442 12.269 2.302 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.918 10.909 -0.147 1.00 0.00 H new ATOM 0 HE1 HIS A 48 2.189 14.440 -2.384 1.00 0.00 H new ATOM 0 HE2 HIS A 48 2.601 11.930 -2.525 1.00 0.00 H new ATOM 736 N LEU A 49 0.029 12.487 0.660 1.00 0.00 N ATOM 737 CA LEU A 49 -1.046 12.827 -0.266 1.00 0.00 C ATOM 738 C LEU A 49 -2.374 12.970 0.470 1.00 0.00 C ATOM 739 O LEU A 49 -2.973 14.046 0.489 1.00 0.00 O ATOM 740 CB LEU A 49 -1.165 11.758 -1.354 1.00 0.00 C ATOM 741 CG LEU A 49 -2.023 12.126 -2.565 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.398 12.601 -2.121 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.333 13.193 -3.403 1.00 0.00 C ATOM 0 H LEU A 49 0.615 11.709 0.358 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.804 13.783 -0.730 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.163 11.512 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.576 10.854 -0.904 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.150 11.235 -3.180 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.994 12.858 -2.996 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.895 11.807 -1.564 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.291 13.479 -1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.958 13.443 -4.261 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.175 14.085 -2.797 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.372 12.816 -3.752 1.00 0.00 H new ATOM 755 N LEU A 50 -2.829 11.879 1.077 1.00 0.00 N ATOM 756 CA LEU A 50 -4.086 11.883 1.818 1.00 0.00 C ATOM 757 C LEU A 50 -4.104 13.003 2.853 1.00 0.00 C ATOM 758 O LEU A 50 -5.168 13.455 3.274 1.00 0.00 O ATOM 759 CB LEU A 50 -4.299 10.534 2.506 1.00 0.00 C ATOM 760 CG LEU A 50 -4.559 9.343 1.582 1.00 0.00 C ATOM 761 CD1 LEU A 50 -4.276 8.035 2.305 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.991 9.370 1.068 1.00 0.00 C ATOM 0 H LEU A 50 -2.346 10.980 1.071 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.897 12.055 1.110 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.419 10.314 3.110 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.141 10.627 3.191 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.885 9.416 0.728 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.466 7.199 1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.234 8.014 2.624 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.924 7.954 3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.158 8.516 0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.681 9.321 1.910 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -6.161 10.292 0.513 1.00 0.00 H new ATOM 774 N GLY A 51 -2.919 13.449 3.257 1.00 0.00 N ATOM 775 CA GLY A 51 -2.821 14.514 4.238 1.00 0.00 C ATOM 776 C GLY A 51 -2.873 13.998 5.662 1.00 0.00 C ATOM 777 O GLY A 51 -3.136 14.757 6.595 1.00 0.00 O ATOM 0 H GLY A 51 -2.024 13.092 2.922 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.889 15.059 4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.634 15.223 4.082 1.00 0.00 H new ATOM 781 N ILE A 52 -2.623 12.703 5.829 1.00 0.00 N ATOM 782 CA ILE A 52 -2.643 12.087 7.150 1.00 0.00 C ATOM 783 C ILE A 52 -1.301 11.442 7.476 1.00 0.00 C ATOM 784 O ILE A 52 -0.554 11.022 6.591 1.00 0.00 O ATOM 785 CB ILE A 52 -3.751 11.023 7.258 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.580 9.964 6.166 1.00 0.00 C ATOM 787 CG2 ILE A 52 -5.123 11.674 7.161 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.478 8.761 6.345 1.00 0.00 C ATOM 0 H ILE A 52 -2.405 12.061 5.067 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.844 12.883 7.867 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.670 10.534 8.229 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.783 10.418 5.196 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.542 9.633 6.152 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.895 10.909 7.239 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.242 12.394 7.971 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.216 12.187 6.204 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.303 8.053 5.535 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.259 8.283 7.300 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.520 9.079 6.329 1.00 0.00 H new ATOM 800 N PRO A 53 -0.984 11.358 8.777 1.00 0.00 N ATOM 801 CA PRO A 53 0.269 10.763 9.250 1.00 0.00 C ATOM 802 C PRO A 53 0.307 9.252 9.043 1.00 0.00 C ATOM 803 O PRO A 53 -0.717 8.576 9.141 1.00 0.00 O ATOM 804 CB PRO A 53 0.278 11.098 10.744 1.00 0.00 C ATOM 805 CG PRO A 53 -1.157 11.264 11.104 1.00 0.00 C ATOM 806 CD PRO A 53 -1.826 11.838 9.886 1.00 0.00 C ATOM 0 HA PRO A 53 1.133 11.146 8.708 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.742 10.301 11.325 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.844 12.008 10.942 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.603 10.309 11.380 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.270 11.928 11.961 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.854 11.489 9.790 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.861 12.927 9.922 1.00 0.00 H new ATOM 814 N HIS A 54 1.495 8.729 8.757 1.00 0.00 N ATOM 815 CA HIS A 54 1.667 7.298 8.537 1.00 0.00 C ATOM 816 C HIS A 54 1.658 6.540 9.861 1.00 0.00 C ATOM 817 O HIS A 54 1.537 5.315 9.886 1.00 0.00 O ATOM 818 CB HIS A 54 2.974 7.028 7.791 1.00 0.00 C ATOM 819 CG HIS A 54 4.149 7.769 8.353 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.713 7.469 9.574 1.00 0.00 N ATOM 821 CD2 HIS A 54 4.866 8.802 7.851 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.726 8.287 9.801 1.00 0.00 C ATOM 823 NE2 HIS A 54 5.840 9.105 8.770 1.00 0.00 N ATOM 0 H HIS A 54 2.352 9.275 8.672 1.00 0.00 H new ATOM 0 HA HIS A 54 0.832 6.946 7.931 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.183 5.959 7.817 1.00 0.00 H new ATOM 0 HB3 HIS A 54 2.849 7.303 6.744 1.00 0.00 H new ATOM 0 HD2 HIS A 54 4.702 9.296 6.904 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.354 8.287 10.680 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.538 9.842 8.672 1.00 0.00 H new ATOM 832 N SER A 55 1.789 7.276 10.960 1.00 0.00 N ATOM 833 CA SER A 55 1.800 6.673 12.288 1.00 0.00 C ATOM 834 C SER A 55 0.524 5.873 12.532 1.00 0.00 C ATOM 835 O SER A 55 0.485 4.991 13.390 1.00 0.00 O ATOM 836 CB SER A 55 1.952 7.753 13.361 1.00 0.00 C ATOM 837 OG SER A 55 1.045 8.819 13.142 1.00 0.00 O ATOM 0 H SER A 55 1.889 8.291 10.957 1.00 0.00 H new ATOM 0 HA SER A 55 2.650 5.993 12.344 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.778 7.319 14.346 1.00 0.00 H new ATOM 0 HB3 SER A 55 2.973 8.133 13.357 1.00 0.00 H new ATOM 0 HG SER A 55 1.160 9.496 13.842 1.00 0.00 H new ATOM 843 N VAL A 56 -0.519 6.187 11.770 1.00 0.00 N ATOM 844 CA VAL A 56 -1.797 5.499 11.902 1.00 0.00 C ATOM 845 C VAL A 56 -2.079 4.626 10.684 1.00 0.00 C ATOM 846 O VAL A 56 -2.725 3.583 10.790 1.00 0.00 O ATOM 847 CB VAL A 56 -2.956 6.496 12.085 1.00 0.00 C ATOM 848 CG1 VAL A 56 -2.755 7.324 13.345 1.00 0.00 C ATOM 849 CG2 VAL A 56 -3.084 7.393 10.863 1.00 0.00 C ATOM 0 H VAL A 56 -0.503 6.914 11.055 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.727 4.869 12.789 1.00 0.00 H new ATOM 0 HB VAL A 56 -3.883 5.933 12.194 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.584 8.023 13.457 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -2.717 6.664 14.212 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -1.820 7.879 13.270 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.908 8.092 11.009 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -2.157 7.949 10.721 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.279 6.782 9.982 1.00 0.00 H new ATOM 859 N LEU A 57 -1.590 5.059 9.527 1.00 0.00 N ATOM 860 CA LEU A 57 -1.789 4.317 8.287 1.00 0.00 C ATOM 861 C LEU A 57 -0.849 3.118 8.213 1.00 0.00 C ATOM 862 O LEU A 57 0.345 3.237 8.486 1.00 0.00 O ATOM 863 CB LEU A 57 -1.564 5.231 7.081 1.00 0.00 C ATOM 864 CG LEU A 57 -1.187 4.536 5.773 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.414 3.909 5.129 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.525 5.518 4.818 1.00 0.00 C ATOM 0 H LEU A 57 -1.053 5.920 9.422 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.816 3.952 8.272 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.473 5.808 6.913 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.777 5.942 7.331 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.474 3.743 5.998 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.126 3.419 4.199 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.846 3.174 5.808 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.150 4.684 4.918 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.264 5.005 3.892 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.214 6.333 4.599 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.378 5.920 5.278 1.00 0.00 H new ATOM 878 N GLN A 58 -1.397 1.966 7.841 1.00 0.00 N ATOM 879 CA GLN A 58 -0.606 0.745 7.730 1.00 0.00 C ATOM 880 C GLN A 58 -1.048 -0.081 6.527 1.00 0.00 C ATOM 881 O GLN A 58 -2.070 0.207 5.905 1.00 0.00 O ATOM 882 CB GLN A 58 -0.731 -0.086 9.008 1.00 0.00 C ATOM 883 CG GLN A 58 -0.197 0.618 10.246 1.00 0.00 C ATOM 884 CD GLN A 58 1.316 0.578 10.333 1.00 0.00 C ATOM 885 OE1 GLN A 58 2.014 0.989 9.405 1.00 0.00 O ATOM 886 NE2 GLN A 58 1.832 0.082 11.451 1.00 0.00 N ATOM 0 H GLN A 58 -2.384 1.852 7.611 1.00 0.00 H new ATOM 0 HA GLN A 58 0.437 1.028 7.590 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -1.780 -0.337 9.167 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.195 -1.025 8.875 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.530 1.656 10.241 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.621 0.152 11.136 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.216 -0.247 12.195 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.844 0.030 11.566 1.00 0.00 H new ATOM 895 N ILE A 59 -0.270 -1.109 6.204 1.00 0.00 N ATOM 896 CA ILE A 59 -0.581 -1.978 5.076 1.00 0.00 C ATOM 897 C ILE A 59 -0.750 -3.425 5.526 1.00 0.00 C ATOM 898 O ILE A 59 -0.107 -3.869 6.477 1.00 0.00 O ATOM 899 CB ILE A 59 0.515 -1.913 3.996 1.00 0.00 C ATOM 900 CG1 ILE A 59 0.721 -0.469 3.534 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.153 -2.806 2.819 1.00 0.00 C ATOM 902 CD1 ILE A 59 1.834 -0.312 2.522 1.00 0.00 C ATOM 0 H ILE A 59 0.581 -1.360 6.708 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.519 -1.620 4.652 1.00 0.00 H new ATOM 0 HB ILE A 59 1.450 -2.274 4.425 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -0.208 -0.099 3.101 1.00 0.00 H new ATOM 0 HG13 ILE A 59 0.939 0.154 4.401 1.00 0.00 H new ATOM 0 HG21 ILE A 59 0.937 -2.749 2.064 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.053 -3.836 3.161 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.791 -2.474 2.387 1.00 0.00 H new ATOM 0 HD11 ILE A 59 1.924 0.737 2.239 1.00 0.00 H new ATOM 0 HD12 ILE A 59 2.773 -0.652 2.959 1.00 0.00 H new ATOM 0 HD13 ILE A 59 1.608 -0.908 1.638 1.00 0.00 H new ATOM 914 N ARG A 60 -1.619 -4.156 4.836 1.00 0.00 N ATOM 915 CA ARG A 60 -1.873 -5.553 5.164 1.00 0.00 C ATOM 916 C ARG A 60 -1.644 -6.448 3.949 1.00 0.00 C ATOM 917 O ARG A 60 -2.227 -6.230 2.887 1.00 0.00 O ATOM 918 CB ARG A 60 -3.304 -5.727 5.676 1.00 0.00 C ATOM 919 CG ARG A 60 -3.724 -7.180 5.826 1.00 0.00 C ATOM 920 CD ARG A 60 -4.746 -7.352 6.940 1.00 0.00 C ATOM 921 NE ARG A 60 -4.241 -6.875 8.224 1.00 0.00 N ATOM 922 CZ ARG A 60 -4.809 -7.163 9.390 1.00 0.00 C ATOM 923 NH1 ARG A 60 -5.895 -7.923 9.433 1.00 0.00 N ATOM 924 NH2 ARG A 60 -4.291 -6.691 10.517 1.00 0.00 N ATOM 0 H ARG A 60 -2.159 -3.804 4.046 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.175 -5.848 5.948 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.399 -5.229 6.641 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.989 -5.228 4.991 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.145 -7.537 4.886 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -2.848 -7.793 6.036 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.656 -6.809 6.684 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.016 -8.405 7.025 1.00 0.00 H new ATOM 0 HE ARG A 60 -3.406 -6.289 8.226 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.296 -8.288 8.569 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -6.329 -8.142 10.330 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.456 -6.106 10.489 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.728 -6.913 11.411 1.00 0.00 H new ATOM 938 N TYR A 61 -0.791 -7.452 4.113 1.00 0.00 N ATOM 939 CA TYR A 61 -0.482 -8.378 3.029 1.00 0.00 C ATOM 940 C TYR A 61 -0.354 -9.805 3.552 1.00 0.00 C ATOM 941 O TYR A 61 0.265 -10.046 4.588 1.00 0.00 O ATOM 942 CB TYR A 61 0.812 -7.961 2.328 1.00 0.00 C ATOM 943 CG TYR A 61 1.314 -8.979 1.329 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.771 -9.055 0.052 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.332 -9.864 1.662 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.226 -9.984 -0.863 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.794 -10.796 0.752 1.00 0.00 C ATOM 948 CZ TYR A 61 2.238 -10.852 -0.509 1.00 0.00 C ATOM 949 OH TYR A 61 2.695 -11.777 -1.419 1.00 0.00 O ATOM 0 H TYR A 61 -0.301 -7.646 4.986 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.302 -8.346 2.312 1.00 0.00 H new ATOM 0 HB2 TYR A 61 0.649 -7.012 1.817 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.583 -7.790 3.079 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.020 -8.376 -0.230 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.770 -9.823 2.649 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.792 -10.031 -1.851 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.586 -11.477 1.027 1.00 0.00 H new ATOM 0 HH TYR A 61 3.410 -12.310 -1.013 1.00 0.00 H new ATOM 959 N SER A 62 -0.944 -10.749 2.826 1.00 0.00 N ATOM 960 CA SER A 62 -0.900 -12.154 3.216 1.00 0.00 C ATOM 961 C SER A 62 -1.449 -12.343 4.626 1.00 0.00 C ATOM 962 O SER A 62 -1.103 -13.301 5.316 1.00 0.00 O ATOM 963 CB SER A 62 0.534 -12.681 3.140 1.00 0.00 C ATOM 964 OG SER A 62 0.554 -14.095 3.047 1.00 0.00 O ATOM 0 H SER A 62 -1.458 -10.567 1.964 1.00 0.00 H new ATOM 0 HA SER A 62 -1.524 -12.718 2.523 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.038 -12.249 2.275 1.00 0.00 H new ATOM 0 HB3 SER A 62 1.089 -12.364 4.023 1.00 0.00 H new ATOM 0 HG SER A 62 -0.004 -14.477 3.756 1.00 0.00 H new ATOM 970 N GLY A 63 -2.309 -11.421 5.049 1.00 0.00 N ATOM 971 CA GLY A 63 -2.894 -11.503 6.374 1.00 0.00 C ATOM 972 C GLY A 63 -1.908 -11.138 7.466 1.00 0.00 C ATOM 973 O GLY A 63 -2.190 -11.311 8.652 1.00 0.00 O ATOM 0 H GLY A 63 -2.611 -10.618 4.497 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -3.756 -10.838 6.429 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.261 -12.515 6.544 1.00 0.00 H new ATOM 977 N LYS A 64 -0.746 -10.633 7.067 1.00 0.00 N ATOM 978 CA LYS A 64 0.287 -10.243 8.019 1.00 0.00 C ATOM 979 C LYS A 64 0.596 -8.753 7.907 1.00 0.00 C ATOM 980 O LYS A 64 0.403 -8.148 6.852 1.00 0.00 O ATOM 981 CB LYS A 64 1.561 -11.058 7.784 1.00 0.00 C ATOM 982 CG LYS A 64 2.538 -10.397 6.826 1.00 0.00 C ATOM 983 CD LYS A 64 3.701 -11.316 6.494 1.00 0.00 C ATOM 984 CE LYS A 64 3.408 -12.164 5.265 1.00 0.00 C ATOM 985 NZ LYS A 64 2.661 -13.404 5.613 1.00 0.00 N ATOM 0 H LYS A 64 -0.496 -10.484 6.089 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.086 -10.444 9.023 1.00 0.00 H new ATOM 0 HB2 LYS A 64 2.058 -11.223 8.740 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.288 -12.038 7.393 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.018 -10.120 5.909 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.916 -9.476 7.269 1.00 0.00 H new ATOM 0 HD2 LYS A 64 4.598 -10.722 6.322 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.907 -11.965 7.345 1.00 0.00 H new ATOM 0 HE2 LYS A 64 2.829 -11.580 4.550 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.345 -12.430 4.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.826 -14.125 4.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.990 -13.761 6.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.644 -13.193 5.668 1.00 0.00 H new ATOM 999 N ILE A 65 1.077 -8.169 9.000 1.00 0.00 N ATOM 1000 CA ILE A 65 1.414 -6.752 9.022 1.00 0.00 C ATOM 1001 C ILE A 65 2.872 -6.527 8.635 1.00 0.00 C ATOM 1002 O ILE A 65 3.786 -6.967 9.334 1.00 0.00 O ATOM 1003 CB ILE A 65 1.162 -6.135 10.410 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.313 -6.269 10.792 1.00 0.00 C ATOM 1005 CG2 ILE A 65 1.589 -4.674 10.426 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.249 -5.542 9.851 1.00 0.00 C ATOM 0 H ILE A 65 1.242 -8.656 9.881 1.00 0.00 H new ATOM 0 HA ILE A 65 0.768 -6.263 8.293 1.00 0.00 H new ATOM 0 HB ILE A 65 1.758 -6.675 11.145 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.580 -7.326 10.813 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.455 -5.884 11.802 1.00 0.00 H new ATOM 0 HG21 ILE A 65 1.405 -4.252 11.414 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.652 -4.603 10.194 1.00 0.00 H new ATOM 0 HG23 ILE A 65 1.017 -4.120 9.682 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.278 -5.680 10.183 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.008 -4.479 9.848 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.136 -5.943 8.844 1.00 0.00 H new ATOM 1018 N LEU A 66 3.083 -5.839 7.518 1.00 0.00 N ATOM 1019 CA LEU A 66 4.431 -5.554 7.039 1.00 0.00 C ATOM 1020 C LEU A 66 5.058 -4.408 7.826 1.00 0.00 C ATOM 1021 O LEU A 66 4.368 -3.681 8.541 1.00 0.00 O ATOM 1022 CB LEU A 66 4.400 -5.207 5.549 1.00 0.00 C ATOM 1023 CG LEU A 66 3.491 -6.074 4.677 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.639 -5.695 3.211 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.804 -7.549 4.882 1.00 0.00 C ATOM 0 H LEU A 66 2.338 -5.468 6.928 1.00 0.00 H new ATOM 0 HA LEU A 66 5.039 -6.447 7.186 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.087 -4.168 5.445 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.416 -5.274 5.159 1.00 0.00 H new ATOM 0 HG LEU A 66 2.457 -5.898 4.975 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.985 -6.322 2.605 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.365 -4.649 3.076 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.673 -5.842 2.900 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.148 -8.151 4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.842 -7.742 4.612 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.647 -7.812 5.928 1.00 0.00 H new ATOM 1037 N LYS A 67 6.371 -4.252 7.689 1.00 0.00 N ATOM 1038 CA LYS A 67 7.092 -3.193 8.385 1.00 0.00 C ATOM 1039 C LYS A 67 7.878 -2.333 7.400 1.00 0.00 C ATOM 1040 O LYS A 67 8.645 -2.848 6.587 1.00 0.00 O ATOM 1041 CB LYS A 67 8.041 -3.792 9.426 1.00 0.00 C ATOM 1042 CG LYS A 67 7.371 -4.096 10.755 1.00 0.00 C ATOM 1043 CD LYS A 67 8.200 -5.058 11.590 1.00 0.00 C ATOM 1044 CE LYS A 67 7.341 -5.799 12.602 1.00 0.00 C ATOM 1045 NZ LYS A 67 8.125 -6.817 13.355 1.00 0.00 N ATOM 0 H LYS A 67 6.957 -4.846 7.102 1.00 0.00 H new ATOM 0 HA LYS A 67 6.361 -2.561 8.890 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.472 -4.710 9.027 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.866 -3.100 9.594 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.221 -3.169 11.308 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.385 -4.524 10.577 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.695 -5.776 10.936 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.984 -4.508 12.110 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.906 -5.085 13.302 1.00 0.00 H new ATOM 0 HE3 LYS A 67 6.513 -6.286 12.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 7.504 -7.300 14.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 8.519 -7.513 12.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 8.900 -6.349 13.866 1.00 0.00 H new ATOM 1059 N ASN A 68 7.683 -1.021 7.480 1.00 0.00 N ATOM 1060 CA ASN A 68 8.376 -0.090 6.596 1.00 0.00 C ATOM 1061 C ASN A 68 9.814 -0.537 6.354 1.00 0.00 C ATOM 1062 O ASN A 68 10.186 -0.886 5.234 1.00 0.00 O ATOM 1063 CB ASN A 68 8.361 1.319 7.193 1.00 0.00 C ATOM 1064 CG ASN A 68 8.632 1.317 8.685 1.00 0.00 C ATOM 1065 OD1 ASN A 68 8.131 0.463 9.418 1.00 0.00 O ATOM 1066 ND2 ASN A 68 9.429 2.276 9.143 1.00 0.00 N ATOM 0 H ASN A 68 7.051 -0.578 8.147 1.00 0.00 H new ATOM 0 HA ASN A 68 7.853 -0.078 5.640 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.110 1.931 6.691 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.392 1.781 7.003 1.00 0.00 H new ATOM 0 HD21 ASN A 68 9.648 2.325 10.138 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.822 2.963 8.500 1.00 0.00 H new ATOM 1073 N ASN A 69 10.618 -0.525 7.412 1.00 0.00 N ATOM 1074 CA ASN A 69 12.016 -0.929 7.315 1.00 0.00 C ATOM 1075 C ASN A 69 12.149 -2.251 6.565 1.00 0.00 C ATOM 1076 O ASN A 69 13.161 -2.508 5.915 1.00 0.00 O ATOM 1077 CB ASN A 69 12.630 -1.057 8.710 1.00 0.00 C ATOM 1078 CG ASN A 69 13.960 -1.785 8.692 1.00 0.00 C ATOM 1079 OD1 ASN A 69 14.126 -2.815 9.345 1.00 0.00 O ATOM 1080 ND2 ASN A 69 14.917 -1.250 7.942 1.00 0.00 N ATOM 0 H ASN A 69 10.325 -0.240 8.347 1.00 0.00 H new ATOM 0 HA ASN A 69 12.553 -0.160 6.759 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.769 -0.063 9.135 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.937 -1.589 9.362 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.834 -1.695 7.891 1.00 0.00 H new ATOM 0 HD22 ASN A 69 14.735 -0.395 7.417 1.00 0.00 H new ATOM 1087 N GLU A 70 11.119 -3.086 6.662 1.00 0.00 N ATOM 1088 CA GLU A 70 11.121 -4.382 5.993 1.00 0.00 C ATOM 1089 C GLU A 70 11.187 -4.212 4.478 1.00 0.00 C ATOM 1090 O GLU A 70 11.099 -3.097 3.962 1.00 0.00 O ATOM 1091 CB GLU A 70 9.872 -5.180 6.374 1.00 0.00 C ATOM 1092 CG GLU A 70 10.081 -6.684 6.353 1.00 0.00 C ATOM 1093 CD GLU A 70 9.035 -7.430 7.158 1.00 0.00 C ATOM 1094 OE1 GLU A 70 7.956 -6.854 7.408 1.00 0.00 O ATOM 1095 OE2 GLU A 70 9.296 -8.591 7.539 1.00 0.00 O ATOM 0 H GLU A 70 10.273 -2.888 7.197 1.00 0.00 H new ATOM 0 HA GLU A 70 12.006 -4.929 6.319 1.00 0.00 H new ATOM 0 HB2 GLU A 70 9.550 -4.880 7.371 1.00 0.00 H new ATOM 0 HB3 GLU A 70 9.064 -4.924 5.688 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.059 -7.036 5.322 1.00 0.00 H new ATOM 0 HG3 GLU A 70 11.070 -6.915 6.748 1.00 0.00 H new ATOM 1102 N THR A 71 11.343 -5.326 3.770 1.00 0.00 N ATOM 1103 CA THR A 71 11.423 -5.302 2.315 1.00 0.00 C ATOM 1104 C THR A 71 10.563 -6.399 1.698 1.00 0.00 C ATOM 1105 O THR A 71 10.283 -7.415 2.337 1.00 0.00 O ATOM 1106 CB THR A 71 12.875 -5.470 1.829 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.612 -6.274 2.757 1.00 0.00 O ATOM 1108 CG2 THR A 71 13.553 -4.117 1.672 1.00 0.00 C ATOM 0 H THR A 71 11.416 -6.257 4.181 1.00 0.00 H new ATOM 0 HA THR A 71 11.050 -4.329 1.995 1.00 0.00 H new ATOM 0 HB THR A 71 12.855 -5.963 0.857 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.565 -6.247 2.529 1.00 0.00 H new ATOM 0 HG21 THR A 71 14.577 -4.261 1.328 1.00 0.00 H new ATOM 0 HG22 THR A 71 13.006 -3.518 0.943 1.00 0.00 H new ATOM 0 HG23 THR A 71 13.562 -3.601 2.632 1.00 0.00 H new ATOM 1116 N LEU A 72 10.146 -6.190 0.455 1.00 0.00 N ATOM 1117 CA LEU A 72 9.318 -7.162 -0.249 1.00 0.00 C ATOM 1118 C LEU A 72 10.094 -8.448 -0.515 1.00 0.00 C ATOM 1119 O LEU A 72 9.544 -9.546 -0.431 1.00 0.00 O ATOM 1120 CB LEU A 72 8.816 -6.574 -1.569 1.00 0.00 C ATOM 1121 CG LEU A 72 7.772 -5.463 -1.454 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.604 -5.913 -0.591 1.00 0.00 C ATOM 1123 CD2 LEU A 72 8.400 -4.198 -0.887 1.00 0.00 C ATOM 0 H LEU A 72 10.368 -5.355 -0.087 1.00 0.00 H new ATOM 0 HA LEU A 72 8.463 -7.399 0.384 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.673 -6.185 -2.119 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.393 -7.382 -2.166 1.00 0.00 H new ATOM 0 HG LEU A 72 7.394 -5.242 -2.452 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.872 -5.108 -0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.137 -6.790 -1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.964 -6.163 0.407 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.643 -3.418 -0.812 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.806 -4.406 0.103 1.00 0.00 H new ATOM 0 HD23 LEU A 72 9.202 -3.863 -1.545 1.00 0.00 H new ATOM 1135 N VAL A 73 11.377 -8.304 -0.834 1.00 0.00 N ATOM 1136 CA VAL A 73 12.230 -9.454 -1.108 1.00 0.00 C ATOM 1137 C VAL A 73 12.417 -10.310 0.139 1.00 0.00 C ATOM 1138 O VAL A 73 12.704 -11.503 0.047 1.00 0.00 O ATOM 1139 CB VAL A 73 13.612 -9.015 -1.628 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.509 -8.509 -3.059 1.00 0.00 C ATOM 1141 CG2 VAL A 73 14.209 -7.951 -0.720 1.00 0.00 C ATOM 0 H VAL A 73 11.848 -7.402 -0.909 1.00 0.00 H new ATOM 0 HA VAL A 73 11.730 -10.043 -1.877 1.00 0.00 H new ATOM 0 HB VAL A 73 14.275 -9.880 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.495 -8.204 -3.409 1.00 0.00 H new ATOM 0 HG12 VAL A 73 13.127 -9.304 -3.699 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.831 -7.656 -3.096 1.00 0.00 H new ATOM 0 HG21 VAL A 73 15.185 -7.652 -1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.549 -7.084 -0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 73 14.321 -8.353 0.287 1.00 0.00 H new ATOM 1151 N GLN A 74 12.250 -9.693 1.304 1.00 0.00 N ATOM 1152 CA GLN A 74 12.401 -10.399 2.571 1.00 0.00 C ATOM 1153 C GLN A 74 11.176 -11.261 2.863 1.00 0.00 C ATOM 1154 O GLN A 74 11.261 -12.252 3.588 1.00 0.00 O ATOM 1155 CB GLN A 74 12.622 -9.404 3.711 1.00 0.00 C ATOM 1156 CG GLN A 74 14.066 -8.951 3.852 1.00 0.00 C ATOM 1157 CD GLN A 74 15.023 -10.108 4.062 1.00 0.00 C ATOM 1158 OE1 GLN A 74 15.021 -10.747 5.114 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.848 -10.384 3.059 1.00 0.00 N ATOM 0 H GLN A 74 12.010 -8.706 1.397 1.00 0.00 H new ATOM 0 HA GLN A 74 13.272 -11.050 2.493 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.990 -8.531 3.547 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.300 -9.860 4.647 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.359 -8.400 2.958 1.00 0.00 H new ATOM 0 HG3 GLN A 74 14.146 -8.261 4.692 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.816 -9.828 2.204 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.514 -11.152 3.143 1.00 0.00 H new ATOM 1168 N HIS A 75 10.039 -10.876 2.293 1.00 0.00 N ATOM 1169 CA HIS A 75 8.796 -11.613 2.492 1.00 0.00 C ATOM 1170 C HIS A 75 8.644 -12.714 1.446 1.00 0.00 C ATOM 1171 O HIS A 75 8.062 -13.763 1.714 1.00 0.00 O ATOM 1172 CB HIS A 75 7.599 -10.664 2.428 1.00 0.00 C ATOM 1173 CG HIS A 75 7.462 -9.792 3.638 1.00 0.00 C ATOM 1174 ND1 HIS A 75 7.000 -10.256 4.852 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.730 -8.477 3.816 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.989 -9.264 5.724 1.00 0.00 C ATOM 1177 NE2 HIS A 75 7.427 -8.174 5.121 1.00 0.00 N ATOM 0 H HIS A 75 9.952 -10.058 1.690 1.00 0.00 H new ATOM 0 HA HIS A 75 8.831 -12.075 3.479 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.693 -10.033 1.544 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.688 -11.249 2.307 1.00 0.00 H new ATOM 0 HD2 HIS A 75 8.111 -7.794 3.071 1.00 0.00 H new ATOM 0 HE1 HIS A 75 6.675 -9.333 6.755 1.00 0.00 H new ATOM 0 HE2 HIS A 75 7.525 -7.256 5.554 1.00 0.00 H new ATOM 1186 N GLY A 76 9.172 -12.465 0.251 1.00 0.00 N ATOM 1187 CA GLY A 76 9.084 -13.443 -0.818 1.00 0.00 C ATOM 1188 C GLY A 76 8.421 -12.885 -2.061 1.00 0.00 C ATOM 1189 O GLY A 76 7.412 -13.415 -2.527 1.00 0.00 O ATOM 0 H GLY A 76 9.659 -11.603 0.004 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.085 -13.792 -1.070 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.523 -14.309 -0.468 1.00 0.00 H new ATOM 1193 N VAL A 77 8.986 -11.809 -2.600 1.00 0.00 N ATOM 1194 CA VAL A 77 8.444 -11.178 -3.797 1.00 0.00 C ATOM 1195 C VAL A 77 9.497 -11.085 -4.895 1.00 0.00 C ATOM 1196 O VAL A 77 10.663 -10.793 -4.630 1.00 0.00 O ATOM 1197 CB VAL A 77 7.909 -9.766 -3.493 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.222 -9.180 -4.717 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.960 -9.800 -2.304 1.00 0.00 C ATOM 0 H VAL A 77 9.820 -11.356 -2.226 1.00 0.00 H new ATOM 0 HA VAL A 77 7.621 -11.805 -4.140 1.00 0.00 H new ATOM 0 HB VAL A 77 8.752 -9.124 -3.237 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.851 -8.182 -4.483 1.00 0.00 H new ATOM 0 HG12 VAL A 77 7.935 -9.118 -5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.388 -9.819 -5.007 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.592 -8.794 -2.103 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.119 -10.456 -2.528 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.488 -10.174 -1.427 1.00 0.00 H new ATOM 1209 N LYS A 78 9.078 -11.336 -6.131 1.00 0.00 N ATOM 1210 CA LYS A 78 9.984 -11.280 -7.272 1.00 0.00 C ATOM 1211 C LYS A 78 9.674 -10.074 -8.154 1.00 0.00 C ATOM 1212 O LYS A 78 8.564 -9.542 -8.151 1.00 0.00 O ATOM 1213 CB LYS A 78 9.882 -12.567 -8.095 1.00 0.00 C ATOM 1214 CG LYS A 78 10.710 -13.711 -7.538 1.00 0.00 C ATOM 1215 CD LYS A 78 10.793 -14.869 -8.520 1.00 0.00 C ATOM 1216 CE LYS A 78 11.952 -14.696 -9.489 1.00 0.00 C ATOM 1217 NZ LYS A 78 11.565 -13.890 -10.679 1.00 0.00 N ATOM 0 H LYS A 78 8.116 -11.580 -6.368 1.00 0.00 H new ATOM 0 HA LYS A 78 11.001 -11.179 -6.892 1.00 0.00 H new ATOM 0 HB2 LYS A 78 8.838 -12.875 -8.144 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.202 -12.362 -9.117 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.714 -13.356 -7.307 1.00 0.00 H new ATOM 0 HG3 LYS A 78 10.271 -14.057 -6.602 1.00 0.00 H new ATOM 0 HD2 LYS A 78 10.912 -15.804 -7.972 1.00 0.00 H new ATOM 0 HD3 LYS A 78 9.859 -14.942 -9.077 1.00 0.00 H new ATOM 0 HE2 LYS A 78 12.784 -14.212 -8.977 1.00 0.00 H new ATOM 0 HE3 LYS A 78 12.304 -15.676 -9.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 12.011 -14.290 -11.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.531 -13.908 -10.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.882 -12.908 -10.551 1.00 0.00 H new ATOM 1231 N PRO A 79 10.676 -9.634 -8.929 1.00 0.00 N ATOM 1232 CA PRO A 79 10.533 -8.488 -9.832 1.00 0.00 C ATOM 1233 C PRO A 79 9.621 -8.792 -11.015 1.00 0.00 C ATOM 1234 O PRO A 79 9.636 -9.899 -11.552 1.00 0.00 O ATOM 1235 CB PRO A 79 11.964 -8.233 -10.311 1.00 0.00 C ATOM 1236 CG PRO A 79 12.649 -9.550 -10.177 1.00 0.00 C ATOM 1237 CD PRO A 79 12.025 -10.220 -8.984 1.00 0.00 C ATOM 0 HA PRO A 79 10.077 -7.632 -9.335 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.979 -7.882 -11.343 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.453 -7.469 -9.707 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.517 -10.152 -11.076 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.722 -9.420 -10.035 1.00 0.00 H new ATOM 0 HD2 PRO A 79 11.988 -11.303 -9.105 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.587 -10.020 -8.072 1.00 0.00 H new ATOM 1245 N GLN A 80 8.830 -7.803 -11.416 1.00 0.00 N ATOM 1246 CA GLN A 80 7.911 -7.966 -12.537 1.00 0.00 C ATOM 1247 C GLN A 80 6.828 -8.988 -12.208 1.00 0.00 C ATOM 1248 O GLN A 80 6.541 -9.880 -13.005 1.00 0.00 O ATOM 1249 CB GLN A 80 8.674 -8.399 -13.790 1.00 0.00 C ATOM 1250 CG GLN A 80 9.811 -7.462 -14.164 1.00 0.00 C ATOM 1251 CD GLN A 80 10.841 -8.123 -15.058 1.00 0.00 C ATOM 1252 OE1 GLN A 80 11.897 -8.556 -14.594 1.00 0.00 O ATOM 1253 NE2 GLN A 80 10.540 -8.205 -16.349 1.00 0.00 N ATOM 0 H GLN A 80 8.806 -6.880 -10.982 1.00 0.00 H new ATOM 0 HA GLN A 80 7.433 -7.005 -12.726 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.076 -9.400 -13.633 1.00 0.00 H new ATOM 0 HB3 GLN A 80 7.977 -8.463 -14.626 1.00 0.00 H new ATOM 0 HG2 GLN A 80 9.404 -6.587 -14.670 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.298 -7.107 -13.256 1.00 0.00 H new ATOM 0 HE21 GLN A 80 9.654 -7.833 -16.691 1.00 0.00 H new ATOM 0 HE22 GLN A 80 11.195 -8.640 -16.999 1.00 0.00 H new ATOM 1262 N GLU A 81 6.231 -8.852 -11.028 1.00 0.00 N ATOM 1263 CA GLU A 81 5.180 -9.765 -10.594 1.00 0.00 C ATOM 1264 C GLU A 81 3.898 -9.004 -10.267 1.00 0.00 C ATOM 1265 O GLU A 81 3.855 -7.777 -10.351 1.00 0.00 O ATOM 1266 CB GLU A 81 5.639 -10.562 -9.371 1.00 0.00 C ATOM 1267 CG GLU A 81 5.380 -9.854 -8.051 1.00 0.00 C ATOM 1268 CD GLU A 81 5.639 -10.745 -6.851 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.467 -11.672 -6.968 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.014 -10.513 -5.795 1.00 0.00 O ATOM 0 H GLU A 81 6.457 -8.119 -10.356 1.00 0.00 H new ATOM 0 HA GLU A 81 4.973 -10.455 -11.412 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.129 -11.525 -9.363 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.706 -10.767 -9.461 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.015 -8.970 -7.986 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.347 -9.507 -8.025 1.00 0.00 H new ATOM 1277 N ILE A 82 2.858 -9.742 -9.895 1.00 0.00 N ATOM 1278 CA ILE A 82 1.576 -9.138 -9.556 1.00 0.00 C ATOM 1279 C ILE A 82 1.089 -9.611 -8.190 1.00 0.00 C ATOM 1280 O ILE A 82 1.051 -10.811 -7.915 1.00 0.00 O ATOM 1281 CB ILE A 82 0.503 -9.463 -10.612 1.00 0.00 C ATOM 1282 CG1 ILE A 82 0.952 -8.980 -11.992 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.826 -8.828 -10.229 1.00 0.00 C ATOM 1284 CD1 ILE A 82 0.229 -9.658 -13.135 1.00 0.00 C ATOM 0 H ILE A 82 2.878 -10.759 -9.821 1.00 0.00 H new ATOM 0 HA ILE A 82 1.733 -8.060 -9.530 1.00 0.00 H new ATOM 0 HB ILE A 82 0.369 -10.544 -10.652 1.00 0.00 H new ATOM 0 HG12 ILE A 82 0.794 -7.904 -12.060 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.023 -9.152 -12.097 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.574 -9.066 -10.985 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -1.149 -9.216 -9.263 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.707 -7.746 -10.165 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.598 -9.266 -14.083 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.408 -10.732 -13.092 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.841 -9.465 -13.055 1.00 0.00 H new ATOM 1296 N VAL A 83 0.716 -8.661 -7.339 1.00 0.00 N ATOM 1297 CA VAL A 83 0.228 -8.981 -6.003 1.00 0.00 C ATOM 1298 C VAL A 83 -1.023 -8.177 -5.667 1.00 0.00 C ATOM 1299 O VAL A 83 -1.485 -7.367 -6.470 1.00 0.00 O ATOM 1300 CB VAL A 83 1.302 -8.707 -4.933 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.622 -9.356 -5.323 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.476 -7.211 -4.724 1.00 0.00 C ATOM 0 H VAL A 83 0.742 -7.664 -7.551 1.00 0.00 H new ATOM 0 HA VAL A 83 -0.015 -10.044 -6.001 1.00 0.00 H new ATOM 0 HB VAL A 83 0.972 -9.146 -3.991 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.369 -9.152 -4.556 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.484 -10.433 -5.418 1.00 0.00 H new ATOM 0 HG13 VAL A 83 2.960 -8.949 -6.276 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.238 -7.036 -3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.783 -6.746 -5.661 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.531 -6.777 -4.396 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.567 -8.408 -4.477 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.766 -7.705 -4.036 1.00 0.00 C ATOM 1314 C GLN A 84 -2.648 -7.294 -2.572 1.00 0.00 C ATOM 1315 O GLN A 84 -2.458 -8.134 -1.693 1.00 0.00 O ATOM 1316 CB GLN A 84 -4.000 -8.587 -4.232 1.00 0.00 C ATOM 1317 CG GLN A 84 -5.313 -7.858 -3.993 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.523 -8.728 -4.269 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.515 -9.928 -3.992 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.571 -8.127 -4.820 1.00 0.00 N ATOM 0 H GLN A 84 -1.197 -9.076 -3.801 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.872 -6.804 -4.640 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.994 -8.985 -5.247 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.939 -9.439 -3.555 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -5.348 -7.510 -2.960 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.354 -6.973 -4.629 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.534 -7.130 -5.033 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.413 -8.662 -5.031 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.762 -5.994 -2.317 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.669 -5.470 -0.959 1.00 0.00 C ATOM 1331 C VAL A 85 -3.859 -4.575 -0.633 1.00 0.00 C ATOM 1332 O VAL A 85 -4.612 -4.180 -1.522 1.00 0.00 O ATOM 1333 CB VAL A 85 -1.368 -4.671 -0.754 1.00 0.00 C ATOM 1334 CG1 VAL A 85 -0.154 -5.565 -0.959 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -1.324 -3.475 -1.692 1.00 0.00 C ATOM 0 H VAL A 85 -2.919 -5.285 -3.033 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.669 -6.328 -0.287 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.347 -4.301 0.271 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.756 -4.983 -0.810 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.181 -6.386 -0.242 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.165 -5.968 -1.972 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -0.398 -2.922 -1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.368 -3.821 -2.725 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.175 -2.824 -1.491 1.00 0.00 H new ATOM 1345 N GLU A 86 -4.021 -4.260 0.648 1.00 0.00 N ATOM 1346 CA GLU A 86 -5.121 -3.412 1.092 1.00 0.00 C ATOM 1347 C GLU A 86 -4.626 -2.342 2.061 1.00 0.00 C ATOM 1348 O GLU A 86 -3.934 -2.643 3.034 1.00 0.00 O ATOM 1349 CB GLU A 86 -6.209 -4.256 1.759 1.00 0.00 C ATOM 1350 CG GLU A 86 -7.191 -4.871 0.776 1.00 0.00 C ATOM 1351 CD GLU A 86 -7.833 -6.137 1.309 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -7.120 -7.153 1.446 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -9.050 -6.111 1.588 1.00 0.00 O ATOM 0 H GLU A 86 -3.405 -4.579 1.396 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.541 -2.918 0.216 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.737 -5.052 2.335 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.757 -3.634 2.466 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.969 -4.144 0.542 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.674 -5.095 -0.157 1.00 0.00 H new ATOM 1360 N ILE A 87 -4.985 -1.092 1.787 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.579 0.022 2.635 1.00 0.00 C ATOM 1362 C ILE A 87 -5.712 0.452 3.560 1.00 0.00 C ATOM 1363 O ILE A 87 -6.885 0.394 3.190 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.129 1.233 1.795 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.738 0.986 1.208 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.136 2.496 2.643 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.175 2.177 0.466 1.00 0.00 C ATOM 0 H ILE A 87 -5.556 -0.826 0.985 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.738 -0.328 3.234 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.831 1.367 0.972 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -2.056 0.714 2.013 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.785 0.134 0.529 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.816 3.343 2.036 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.144 2.678 3.017 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.453 2.373 3.484 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.187 1.930 0.077 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.836 2.436 -0.361 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -2.095 3.025 1.146 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.354 0.884 4.764 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.341 1.325 5.743 1.00 0.00 C ATOM 1381 C PHE A 88 -5.670 2.066 6.896 1.00 0.00 C ATOM 1382 O PHE A 88 -4.444 2.096 6.999 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.128 0.128 6.280 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.303 -0.802 7.123 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -5.944 -0.453 8.415 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -5.888 -2.026 6.624 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.184 -1.307 9.192 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.128 -2.884 7.397 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.777 -2.524 8.683 1.00 0.00 C ATOM 0 H PHE A 88 -4.388 0.938 5.086 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.029 2.009 5.246 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.969 0.492 6.871 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.545 -0.429 5.441 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.261 0.497 8.819 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.161 -2.313 5.619 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.909 -1.022 10.197 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.809 -3.835 6.996 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.185 -3.193 9.290 1.00 0.00 H new ATOM 1399 N SER A 89 -6.484 2.662 7.761 1.00 0.00 N ATOM 1400 CA SER A 89 -5.971 3.407 8.905 1.00 0.00 C ATOM 1401 C SER A 89 -6.343 2.718 10.214 1.00 0.00 C ATOM 1402 O SER A 89 -7.462 2.229 10.376 1.00 0.00 O ATOM 1403 CB SER A 89 -6.515 4.837 8.895 1.00 0.00 C ATOM 1404 OG SER A 89 -5.828 5.650 9.831 1.00 0.00 O ATOM 0 H SER A 89 -7.501 2.644 7.692 1.00 0.00 H new ATOM 0 HA SER A 89 -4.884 3.439 8.828 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.413 5.261 7.896 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.579 4.826 9.130 1.00 0.00 H new ATOM 0 HG SER A 89 -6.130 6.578 9.742 1.00 0.00 H new ATOM 1410 N THR A 90 -5.397 2.681 11.147 1.00 0.00 N ATOM 1411 CA THR A 90 -5.624 2.052 12.442 1.00 0.00 C ATOM 1412 C THR A 90 -6.572 2.882 13.299 1.00 0.00 C ATOM 1413 O THR A 90 -7.372 2.340 14.060 1.00 0.00 O ATOM 1414 CB THR A 90 -4.303 1.849 13.207 1.00 0.00 C ATOM 1415 OG1 THR A 90 -3.686 3.116 13.464 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.349 0.967 12.416 1.00 0.00 C ATOM 0 H THR A 90 -4.466 3.080 11.030 1.00 0.00 H new ATOM 0 HA THR A 90 -6.075 1.079 12.245 1.00 0.00 H new ATOM 0 HB THR A 90 -4.529 1.356 14.153 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.337 3.486 12.626 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.423 0.838 12.977 1.00 0.00 H new ATOM 0 HG22 THR A 90 -3.809 -0.006 12.247 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.130 1.436 11.457 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.477 4.202 13.169 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.328 5.108 13.932 1.00 0.00 C ATOM 1426 C ASN A 91 -8.051 6.083 13.008 1.00 0.00 C ATOM 1427 O ASN A 91 -7.626 7.221 12.810 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.495 5.881 14.957 1.00 0.00 C ATOM 1429 CG ASN A 91 -7.285 6.223 16.205 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -7.963 5.370 16.777 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.201 7.477 16.633 1.00 0.00 N ATOM 0 H ASN A 91 -5.820 4.667 12.543 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.074 4.511 14.456 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.623 5.288 15.233 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.125 6.800 14.502 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.711 7.766 17.468 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.626 8.151 16.127 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.172 5.628 12.429 1.00 0.00 N ATOM 1439 CA PRO A 92 -9.980 6.444 11.518 1.00 0.00 C ATOM 1440 C PRO A 92 -10.697 7.580 12.238 1.00 0.00 C ATOM 1441 O PRO A 92 -11.258 8.474 11.604 1.00 0.00 O ATOM 1442 CB PRO A 92 -10.993 5.446 10.951 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.100 4.384 11.991 1.00 0.00 C ATOM 1444 CD PRO A 92 -9.738 4.282 12.620 1.00 0.00 C ATOM 0 HA PRO A 92 -9.369 6.931 10.758 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.957 5.921 10.769 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.655 5.036 9.999 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.855 4.640 12.734 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.398 3.433 11.549 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -9.802 4.019 13.676 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.129 3.518 12.137 1.00 0.00 H new ATOM 1452 N ASP A 93 -10.674 7.541 13.566 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.320 8.569 14.372 1.00 0.00 C ATOM 1454 C ASP A 93 -10.487 9.847 14.394 1.00 0.00 C ATOM 1455 O ASP A 93 -11.023 10.948 14.526 1.00 0.00 O ATOM 1456 CB ASP A 93 -11.540 8.065 15.800 1.00 0.00 C ATOM 1457 CG ASP A 93 -12.311 6.760 15.840 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -11.687 5.696 15.646 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -13.539 6.803 16.066 1.00 0.00 O ATOM 0 H ASP A 93 -10.215 6.808 14.107 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.286 8.794 13.921 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -10.574 7.928 16.287 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.080 8.821 16.370 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.174 9.693 14.264 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.266 10.835 14.269 1.00 0.00 C ATOM 1466 C LEU A 94 -7.895 11.242 12.847 1.00 0.00 C ATOM 1467 O LEU A 94 -8.001 12.412 12.477 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.002 10.502 15.063 1.00 0.00 C ATOM 1469 CG LEU A 94 -7.112 10.626 16.583 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -5.908 9.988 17.259 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -7.242 12.087 16.991 1.00 0.00 C ATOM 0 H LEU A 94 -8.714 8.789 14.154 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.777 11.672 14.745 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.704 9.481 14.822 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.200 11.157 14.722 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.008 10.097 16.907 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.004 10.086 18.340 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.859 8.932 16.993 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.998 10.488 16.929 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -7.319 12.156 18.076 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -6.364 12.638 16.654 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.136 12.514 16.536 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.462 10.269 12.053 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.075 10.526 10.671 1.00 0.00 C ATOM 1485 C TYR A 95 -7.684 9.488 9.732 1.00 0.00 C ATOM 1486 O TYR A 95 -7.024 8.545 9.295 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.551 10.519 10.536 1.00 0.00 C ATOM 1488 CG TYR A 95 -4.847 11.354 11.582 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -4.577 12.698 11.360 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.451 10.797 12.792 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -3.934 13.465 12.312 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.809 11.556 13.751 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.552 12.889 13.506 1.00 0.00 C ATOM 1494 OH TYR A 95 -2.911 13.648 14.458 1.00 0.00 O ATOM 0 H TYR A 95 -7.370 9.295 12.343 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.454 11.509 10.392 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.193 9.491 10.602 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.280 10.887 9.546 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -4.875 13.152 10.426 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.649 9.753 12.986 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -3.732 14.509 12.123 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.510 11.108 14.687 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.712 13.092 15.240 1.00 0.00 H new ATOM 1504 N PRO A 96 -8.975 9.666 9.414 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.703 8.757 8.524 1.00 0.00 C ATOM 1506 C PRO A 96 -9.230 8.860 7.077 1.00 0.00 C ATOM 1507 O PRO A 96 -8.802 9.923 6.628 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.154 9.227 8.647 1.00 0.00 C ATOM 1509 CG PRO A 96 -11.057 10.659 9.045 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.823 10.768 9.898 1.00 0.00 C ATOM 0 HA PRO A 96 -9.554 7.712 8.798 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.688 9.114 7.703 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.697 8.645 9.392 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.984 11.304 8.169 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.943 10.971 9.598 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.334 11.735 9.776 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.056 10.660 10.957 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.311 7.749 6.352 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.894 7.715 4.956 1.00 0.00 C ATOM 1520 C VAL A 97 -10.022 8.162 4.034 1.00 0.00 C ATOM 1521 O VAL A 97 -11.164 7.723 4.175 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.434 6.304 4.542 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.692 6.353 3.215 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.565 5.688 5.626 1.00 0.00 C ATOM 0 H VAL A 97 -9.662 6.860 6.709 1.00 0.00 H new ATOM 0 HA VAL A 97 -8.056 8.405 4.859 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.315 5.675 4.415 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.375 5.348 2.938 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.352 6.750 2.444 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.817 6.996 3.311 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -7.249 4.692 5.317 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.687 6.313 5.787 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.135 5.617 6.552 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.695 9.036 3.088 1.00 0.00 N ATOM 1535 CA ARG A 98 -10.682 9.543 2.142 1.00 0.00 C ATOM 1536 C ARG A 98 -10.166 9.439 0.710 1.00 0.00 C ATOM 1537 O ARG A 98 -8.967 9.561 0.461 1.00 0.00 O ATOM 1538 CB ARG A 98 -11.029 10.998 2.465 1.00 0.00 C ATOM 1539 CG ARG A 98 -11.676 11.181 3.828 1.00 0.00 C ATOM 1540 CD ARG A 98 -12.464 12.480 3.901 1.00 0.00 C ATOM 1541 NE ARG A 98 -13.580 12.391 4.839 1.00 0.00 N ATOM 1542 CZ ARG A 98 -14.636 11.607 4.652 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -14.719 10.848 3.568 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -15.612 11.581 5.551 1.00 0.00 N ATOM 0 H ARG A 98 -8.754 9.408 2.956 1.00 0.00 H new ATOM 0 HA ARG A 98 -11.581 8.933 2.232 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -10.120 11.598 2.420 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -11.702 11.381 1.698 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -12.339 10.340 4.033 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.907 11.177 4.601 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -11.800 13.290 4.203 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -12.842 12.731 2.910 1.00 0.00 H new ATOM 0 HE ARG A 98 -13.547 12.962 5.684 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -13.971 10.865 2.875 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -15.531 10.247 3.427 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -15.552 12.163 6.386 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -16.422 10.979 5.407 1.00 0.00 H new ATOM 1558 N ARG A 99 -11.080 9.211 -0.228 1.00 0.00 N ATOM 1559 CA ARG A 99 -10.717 9.088 -1.634 1.00 0.00 C ATOM 1560 C ARG A 99 -9.942 10.315 -2.105 1.00 0.00 C ATOM 1561 O ARG A 99 -10.334 11.450 -1.834 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.971 8.903 -2.492 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.742 8.048 -3.728 1.00 0.00 C ATOM 1564 CD ARG A 99 -10.912 8.784 -4.768 1.00 0.00 C ATOM 1565 NE ARG A 99 -11.202 8.326 -6.124 1.00 0.00 N ATOM 1566 CZ ARG A 99 -11.002 9.067 -7.208 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -10.514 10.294 -7.096 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -11.292 8.581 -8.408 1.00 0.00 N ATOM 0 H ARG A 99 -12.077 9.108 -0.039 1.00 0.00 H new ATOM 0 HA ARG A 99 -10.078 8.212 -1.743 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -12.753 8.447 -1.885 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.338 9.882 -2.800 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.237 7.125 -3.445 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -12.702 7.766 -4.160 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.108 9.854 -4.697 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -9.853 8.639 -4.555 1.00 0.00 H new ATOM 0 HE ARG A 99 -11.579 7.386 -6.245 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -10.291 10.672 -6.175 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.362 10.860 -7.930 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.669 7.638 -8.499 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.138 9.151 -9.240 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.842 10.078 -2.812 1.00 0.00 N ATOM 1583 CA ILE A 100 -8.013 11.164 -3.320 1.00 0.00 C ATOM 1584 C ILE A 100 -8.680 11.856 -4.505 1.00 0.00 C ATOM 1585 O ILE A 100 -8.724 11.314 -5.609 1.00 0.00 O ATOM 1586 CB ILE A 100 -6.624 10.657 -3.752 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.798 10.261 -2.526 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -5.901 11.720 -4.564 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.561 9.460 -2.864 1.00 0.00 C ATOM 0 H ILE A 100 -8.504 9.144 -3.046 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.893 11.878 -2.505 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.754 9.775 -4.379 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.502 11.163 -1.991 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -6.424 9.680 -1.849 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -4.921 11.347 -4.862 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -6.484 11.958 -5.454 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.778 12.619 -3.960 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.025 9.215 -1.947 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.851 8.540 -3.372 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.914 10.047 -3.516 1.00 0.00 H new ATOM 1601 N ASP A 101 -9.195 13.056 -4.267 1.00 0.00 N ATOM 1602 CA ASP A 101 -9.857 13.825 -5.315 1.00 0.00 C ATOM 1603 C ASP A 101 -8.834 14.489 -6.230 1.00 0.00 C ATOM 1604 O ASP A 101 -8.978 14.475 -7.452 1.00 0.00 O ATOM 1605 CB ASP A 101 -10.772 14.885 -4.698 1.00 0.00 C ATOM 1606 CG ASP A 101 -11.003 16.061 -5.627 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -11.644 15.867 -6.682 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -10.545 17.175 -5.299 1.00 0.00 O ATOM 0 H ASP A 101 -9.167 13.518 -3.358 1.00 0.00 H new ATOM 0 HA ASP A 101 -10.459 13.139 -5.911 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -11.730 14.431 -4.445 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -10.333 15.242 -3.766 1.00 0.00 H new ATOM 1613 N GLY A 102 -7.800 15.072 -5.631 1.00 0.00 N ATOM 1614 CA GLY A 102 -6.769 15.734 -6.407 1.00 0.00 C ATOM 1615 C GLY A 102 -6.493 15.033 -7.723 1.00 0.00 C ATOM 1616 O GLY A 102 -6.525 15.655 -8.785 1.00 0.00 O ATOM 0 H GLY A 102 -7.658 15.097 -4.621 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.071 16.763 -6.603 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.850 15.777 -5.822 1.00 0.00 H new ATOM 1620 N LEU A 103 -6.221 13.735 -7.653 1.00 0.00 N ATOM 1621 CA LEU A 103 -5.937 12.948 -8.848 1.00 0.00 C ATOM 1622 C LEU A 103 -6.835 13.372 -10.006 1.00 0.00 C ATOM 1623 O LEU A 103 -8.038 13.571 -9.833 1.00 0.00 O ATOM 1624 CB LEU A 103 -6.129 11.458 -8.559 1.00 0.00 C ATOM 1625 CG LEU A 103 -4.948 10.745 -7.900 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -5.412 9.476 -7.202 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -3.875 10.425 -8.931 1.00 0.00 C ATOM 0 H LEU A 103 -6.191 13.205 -6.782 1.00 0.00 H new ATOM 0 HA LEU A 103 -4.900 13.127 -9.132 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.002 11.342 -7.916 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -6.355 10.952 -9.498 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.519 11.411 -7.152 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -4.558 8.982 -6.739 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -6.144 9.729 -6.435 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -5.867 8.806 -7.931 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.042 9.918 -8.444 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.293 9.778 -9.702 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.520 11.350 -9.386 1.00 0.00 H new ATOM 1639 N THR A 104 -6.243 13.508 -11.189 1.00 0.00 N ATOM 1640 CA THR A 104 -6.988 13.907 -12.376 1.00 0.00 C ATOM 1641 C THR A 104 -8.011 12.847 -12.765 1.00 0.00 C ATOM 1642 O THR A 104 -9.049 13.157 -13.351 1.00 0.00 O ATOM 1643 CB THR A 104 -6.049 14.162 -13.570 1.00 0.00 C ATOM 1644 OG1 THR A 104 -5.454 12.931 -13.996 1.00 0.00 O ATOM 1645 CG2 THR A 104 -4.959 15.156 -13.199 1.00 0.00 C ATOM 0 H THR A 104 -5.249 13.347 -11.350 1.00 0.00 H new ATOM 0 HA THR A 104 -7.506 14.833 -12.127 1.00 0.00 H new ATOM 0 HB THR A 104 -6.639 14.582 -14.385 1.00 0.00 H new ATOM 0 HG1 THR A 104 -4.860 13.101 -14.756 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.308 15.320 -14.058 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.414 16.101 -12.903 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.372 14.760 -12.370 1.00 0.00 H new ATOM 1653 N ASP A 105 -7.713 11.595 -12.436 1.00 0.00 N ATOM 1654 CA ASP A 105 -8.608 10.487 -12.751 1.00 0.00 C ATOM 1655 C ASP A 105 -9.923 10.619 -11.989 1.00 0.00 C ATOM 1656 O ASP A 105 -9.966 10.447 -10.770 1.00 0.00 O ATOM 1657 CB ASP A 105 -7.941 9.153 -12.415 1.00 0.00 C ATOM 1658 CG ASP A 105 -6.661 8.933 -13.198 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -6.736 8.820 -14.439 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -5.584 8.873 -12.568 1.00 0.00 O ATOM 0 H ASP A 105 -6.858 11.322 -11.951 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.823 10.517 -13.819 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.721 9.118 -11.348 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.636 8.340 -12.624 1.00 0.00 H new ATOM 1665 N VAL A 106 -10.994 10.925 -12.714 1.00 0.00 N ATOM 1666 CA VAL A 106 -12.310 11.079 -12.107 1.00 0.00 C ATOM 1667 C VAL A 106 -13.159 9.829 -12.309 1.00 0.00 C ATOM 1668 O VAL A 106 -12.824 8.963 -13.117 1.00 0.00 O ATOM 1669 CB VAL A 106 -13.058 12.294 -12.689 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -12.295 13.578 -12.402 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -13.278 12.117 -14.183 1.00 0.00 C ATOM 0 H VAL A 106 -10.976 11.071 -13.723 1.00 0.00 H new ATOM 0 HA VAL A 106 -12.150 11.237 -11.040 1.00 0.00 H new ATOM 0 HB VAL A 106 -14.033 12.364 -12.207 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -12.838 14.425 -12.820 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -12.194 13.708 -11.325 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -11.305 13.522 -12.855 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -13.808 12.984 -14.578 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -12.315 12.021 -14.684 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -13.870 11.219 -14.360 1.00 0.00 H new ATOM 1681 N SER A 107 -14.260 9.742 -11.570 1.00 0.00 N ATOM 1682 CA SER A 107 -15.156 8.596 -11.665 1.00 0.00 C ATOM 1683 C SER A 107 -16.605 9.050 -11.812 1.00 0.00 C ATOM 1684 O SER A 107 -16.937 10.201 -11.531 1.00 0.00 O ATOM 1685 CB SER A 107 -15.012 7.704 -10.430 1.00 0.00 C ATOM 1686 OG SER A 107 -15.322 6.356 -10.735 1.00 0.00 O ATOM 0 H SER A 107 -14.553 10.452 -10.899 1.00 0.00 H new ATOM 0 HA SER A 107 -14.881 8.024 -12.551 1.00 0.00 H new ATOM 0 HB2 SER A 107 -13.993 7.768 -10.048 1.00 0.00 H new ATOM 0 HB3 SER A 107 -15.672 8.062 -9.640 1.00 0.00 H new ATOM 0 HG SER A 107 -15.221 5.807 -9.930 1.00 0.00 H new ATOM 1692 N GLN A 108 -17.463 8.136 -12.254 1.00 0.00 N ATOM 1693 CA GLN A 108 -18.877 8.442 -12.439 1.00 0.00 C ATOM 1694 C GLN A 108 -19.707 7.902 -11.279 1.00 0.00 C ATOM 1695 O GLN A 108 -20.848 7.478 -11.465 1.00 0.00 O ATOM 1696 CB GLN A 108 -19.379 7.854 -13.758 1.00 0.00 C ATOM 1697 CG GLN A 108 -18.858 8.583 -14.987 1.00 0.00 C ATOM 1698 CD GLN A 108 -19.815 8.508 -16.160 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -20.146 7.423 -16.637 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -20.266 9.665 -16.631 1.00 0.00 N ATOM 0 H GLN A 108 -17.204 7.178 -12.491 1.00 0.00 H new ATOM 0 HA GLN A 108 -18.988 9.526 -12.467 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -19.084 6.806 -13.815 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -20.469 7.879 -13.766 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -18.679 9.628 -14.736 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -17.898 8.156 -15.278 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -19.965 10.541 -16.205 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -20.913 9.677 -17.419 1.00 0.00 H new ATOM 1709 N ILE A 109 -19.127 7.920 -10.084 1.00 0.00 N ATOM 1710 CA ILE A 109 -19.814 7.433 -8.894 1.00 0.00 C ATOM 1711 C ILE A 109 -19.524 8.321 -7.689 1.00 0.00 C ATOM 1712 O ILE A 109 -18.405 8.806 -7.518 1.00 0.00 O ATOM 1713 CB ILE A 109 -19.406 5.986 -8.561 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -20.097 5.520 -7.278 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -17.894 5.880 -8.423 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -20.052 4.021 -7.078 1.00 0.00 C ATOM 0 H ILE A 109 -18.183 8.267 -9.914 1.00 0.00 H new ATOM 0 HA ILE A 109 -20.881 7.460 -9.113 1.00 0.00 H new ATOM 0 HB ILE A 109 -19.723 5.338 -9.378 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -19.626 6.007 -6.424 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -21.137 5.845 -7.296 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -17.621 4.851 -8.188 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -17.422 6.175 -9.360 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -17.555 6.537 -7.623 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -20.561 3.762 -6.149 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -20.549 3.527 -7.913 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -19.014 3.692 -7.027 1.00 0.00 H new ATOM 1728 N ILE A 110 -20.538 8.528 -6.856 1.00 0.00 N ATOM 1729 CA ILE A 110 -20.391 9.355 -5.665 1.00 0.00 C ATOM 1730 C ILE A 110 -21.531 9.111 -4.682 1.00 0.00 C ATOM 1731 O ILE A 110 -22.705 9.149 -5.052 1.00 0.00 O ATOM 1732 CB ILE A 110 -20.347 10.853 -6.021 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -19.576 11.631 -4.954 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -21.758 11.403 -6.170 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -20.101 11.416 -3.552 1.00 0.00 C ATOM 0 H ILE A 110 -21.470 8.134 -6.984 1.00 0.00 H new ATOM 0 HA ILE A 110 -19.446 9.073 -5.200 1.00 0.00 H new ATOM 0 HB ILE A 110 -19.830 10.970 -6.973 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -18.527 11.338 -4.989 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -19.618 12.694 -5.190 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -21.711 12.463 -6.422 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -22.277 10.864 -6.963 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -22.299 11.277 -5.232 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -19.507 11.998 -2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -21.142 11.736 -3.500 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -20.033 10.359 -3.296 1.00 0.00 H new ATOM 1747 N THR A 111 -21.177 8.861 -3.424 1.00 0.00 N ATOM 1748 CA THR A 111 -22.170 8.611 -2.387 1.00 0.00 C ATOM 1749 C THR A 111 -22.851 9.905 -1.955 1.00 0.00 C ATOM 1750 O THR A 111 -22.347 10.627 -1.095 1.00 0.00 O ATOM 1751 CB THR A 111 -21.536 7.942 -1.153 1.00 0.00 C ATOM 1752 OG1 THR A 111 -20.470 8.753 -0.648 1.00 0.00 O ATOM 1753 CG2 THR A 111 -21.007 6.558 -1.500 1.00 0.00 C ATOM 0 H THR A 111 -20.210 8.827 -3.100 1.00 0.00 H new ATOM 0 HA THR A 111 -22.913 7.938 -2.815 1.00 0.00 H new ATOM 0 HB THR A 111 -22.306 7.839 -0.388 1.00 0.00 H new ATOM 0 HG1 THR A 111 -20.753 9.691 -0.630 1.00 0.00 H new ATOM 0 HG21 THR A 111 -20.564 6.105 -0.613 1.00 0.00 H new ATOM 0 HG22 THR A 111 -21.827 5.934 -1.855 1.00 0.00 H new ATOM 0 HG23 THR A 111 -20.251 6.643 -2.281 1.00 0.00 H new ATOM 1761 N VAL A 112 -24.001 10.192 -2.557 1.00 0.00 N ATOM 1762 CA VAL A 112 -24.753 11.398 -2.233 1.00 0.00 C ATOM 1763 C VAL A 112 -25.561 11.215 -0.953 1.00 0.00 C ATOM 1764 O VAL A 112 -25.699 10.101 -0.448 1.00 0.00 O ATOM 1765 CB VAL A 112 -25.707 11.789 -3.377 1.00 0.00 C ATOM 1766 CG1 VAL A 112 -24.920 12.207 -4.610 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -26.650 10.640 -3.701 1.00 0.00 C ATOM 0 H VAL A 112 -24.432 9.606 -3.272 1.00 0.00 H new ATOM 0 HA VAL A 112 -24.024 12.196 -2.089 1.00 0.00 H new ATOM 0 HB VAL A 112 -26.306 12.640 -3.052 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -25.611 12.480 -5.408 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -24.291 13.063 -4.367 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -24.294 11.378 -4.940 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -27.317 10.934 -4.512 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -26.070 9.769 -4.006 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -27.239 10.393 -2.818 1.00 0.00 H new ATOM 1777 N SER A 113 -26.094 12.317 -0.433 1.00 0.00 N ATOM 1778 CA SER A 113 -26.886 12.279 0.790 1.00 0.00 C ATOM 1779 C SER A 113 -28.209 13.016 0.604 1.00 0.00 C ATOM 1780 O SER A 113 -28.394 13.745 -0.369 1.00 0.00 O ATOM 1781 CB SER A 113 -26.103 12.897 1.950 1.00 0.00 C ATOM 1782 OG SER A 113 -26.684 12.558 3.197 1.00 0.00 O ATOM 0 H SER A 113 -25.991 13.247 -0.840 1.00 0.00 H new ATOM 0 HA SER A 113 -27.101 11.236 1.022 1.00 0.00 H new ATOM 0 HB2 SER A 113 -25.070 12.550 1.921 1.00 0.00 H new ATOM 0 HB3 SER A 113 -26.079 13.981 1.840 1.00 0.00 H new ATOM 0 HG SER A 113 -26.164 12.964 3.921 1.00 0.00 H new ATOM 1788 N GLY A 114 -29.126 12.820 1.547 1.00 0.00 N ATOM 1789 CA GLY A 114 -30.420 13.472 1.469 1.00 0.00 C ATOM 1790 C GLY A 114 -30.501 14.706 2.346 1.00 0.00 C ATOM 1791 O GLY A 114 -29.487 15.304 2.708 1.00 0.00 O ATOM 0 H GLY A 114 -28.996 12.222 2.363 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -30.621 13.751 0.435 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -31.197 12.767 1.766 1.00 0.00 H new ATOM 1795 N PRO A 115 -31.731 15.106 2.700 1.00 0.00 N ATOM 1796 CA PRO A 115 -31.970 16.281 3.543 1.00 0.00 C ATOM 1797 C PRO A 115 -31.520 16.062 4.984 1.00 0.00 C ATOM 1798 O PRO A 115 -30.970 15.013 5.320 1.00 0.00 O ATOM 1799 CB PRO A 115 -33.489 16.461 3.479 1.00 0.00 C ATOM 1800 CG PRO A 115 -34.019 15.103 3.173 1.00 0.00 C ATOM 1801 CD PRO A 115 -32.984 14.441 2.305 1.00 0.00 C ATOM 0 HA PRO A 115 -31.409 17.150 3.199 1.00 0.00 H new ATOM 0 HB2 PRO A 115 -33.883 16.836 4.423 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -33.770 17.179 2.708 1.00 0.00 H new ATOM 0 HG2 PRO A 115 -34.184 14.533 4.087 1.00 0.00 H new ATOM 0 HG3 PRO A 115 -34.978 15.165 2.659 1.00 0.00 H new ATOM 0 HD2 PRO A 115 -32.941 13.366 2.480 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -33.198 14.583 1.246 1.00 0.00 H new ATOM 1809 N SER A 116 -31.758 17.058 5.831 1.00 0.00 N ATOM 1810 CA SER A 116 -31.374 16.975 7.235 1.00 0.00 C ATOM 1811 C SER A 116 -32.431 17.620 8.127 1.00 0.00 C ATOM 1812 O SER A 116 -33.425 18.160 7.639 1.00 0.00 O ATOM 1813 CB SER A 116 -30.021 17.654 7.457 1.00 0.00 C ATOM 1814 OG SER A 116 -29.356 17.110 8.584 1.00 0.00 O ATOM 0 H SER A 116 -32.215 17.932 5.570 1.00 0.00 H new ATOM 0 HA SER A 116 -31.292 15.921 7.501 1.00 0.00 H new ATOM 0 HB2 SER A 116 -29.399 17.532 6.570 1.00 0.00 H new ATOM 0 HB3 SER A 116 -30.167 18.725 7.599 1.00 0.00 H new ATOM 0 HG SER A 116 -28.493 17.559 8.703 1.00 0.00 H new ATOM 1820 N SER A 117 -32.210 17.559 9.436 1.00 0.00 N ATOM 1821 CA SER A 117 -33.144 18.133 10.397 1.00 0.00 C ATOM 1822 C SER A 117 -33.588 19.525 9.958 1.00 0.00 C ATOM 1823 O SER A 117 -32.768 20.429 9.798 1.00 0.00 O ATOM 1824 CB SER A 117 -32.503 18.204 11.784 1.00 0.00 C ATOM 1825 OG SER A 117 -32.000 16.939 12.178 1.00 0.00 O ATOM 0 H SER A 117 -31.392 17.118 9.856 1.00 0.00 H new ATOM 0 HA SER A 117 -34.021 17.488 10.443 1.00 0.00 H new ATOM 0 HB2 SER A 117 -31.694 18.935 11.777 1.00 0.00 H new ATOM 0 HB3 SER A 117 -33.238 18.549 12.511 1.00 0.00 H new ATOM 0 HG SER A 117 -31.594 17.011 13.067 1.00 0.00 H new ATOM 1831 N GLY A 118 -34.893 19.690 9.765 1.00 0.00 N ATOM 1832 CA GLY A 118 -35.425 20.974 9.346 1.00 0.00 C ATOM 1833 C GLY A 118 -36.732 21.313 10.034 1.00 0.00 C ATOM 1834 O GLY A 118 -37.040 20.774 11.097 1.00 0.00 O ATOM 0 H GLY A 118 -35.591 18.957 9.891 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -34.693 21.754 9.558 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -35.578 20.966 8.267 1.00 0.00 H new TER 1838 GLY A 118