USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=29 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 40 LYS NZ :NH3+ 169:sc= -1.09 (180deg=0) USER MOD Set 1.2: A 54 HIS : no HD1:sc= -1.47 K(o=-2.6,f=-9.4!) USER MOD Single : A 1 GLY N :NH3+ 138:sc= 0.027 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.105 USER MOD Single : A 5 SER OG : rot 40:sc= 0.443 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.5!) USER MOD Single : A 10 SER OG : rot -52:sc= 0.285 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.739) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 162:sc= 0.163 (180deg=-0.109) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.0124 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ -144:sc= -1.69 (180deg=-3.78!) USER MOD Single : A 45 HIS : no HD1:sc= -1.24 K(o=-1.2,f=-0.094) USER MOD Single : A 47 SER OG : rot -179:sc= -1.19 USER MOD Single : A 48 HIS : no HD1:sc= -4.81! C(o=-4.8!,f=-1.9!) USER MOD Single : A 55 SER OG : rot 180:sc= -0.18 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -1.25! C(o=-1.3!,f=-9.4!) USER MOD Single : A 69 ASN : amide:sc= -2.02! C(o=-2!,f=-5.5!) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.445 X(o=-0.44,f=-0.44) USER MOD Single : A 75 HIS : no HE2:sc= -0.665 K(o=-0.67,f=-2.3) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.11 K(o=-0.11,f=-1.2!) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 89 SER OG : rot -129:sc= 0.00473 USER MOD Single : A 90 THR OG1 : rot -71:sc= 1.2 USER MOD Single : A 91 ASN : amide:sc= -6.23! C(o=-6.2!,f=-4.9!) 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 USER MOD Single : A 108 GLN : amide:sc= -0.668 K(o=-0.67,f=-2.4!) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= -0.0617 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.839 14.414 14.114 1.00 0.00 N ATOM 2 CA GLY A 1 12.333 14.690 12.778 1.00 0.00 C ATOM 3 C GLY A 1 11.918 13.631 11.776 1.00 0.00 C ATOM 4 O GLY A 1 11.768 12.461 12.126 1.00 0.00 O ATOM 0 H1 GLY A 1 12.585 14.617 14.809 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.012 15.013 14.309 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.565 13.413 14.183 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.962 15.661 12.450 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.421 14.756 12.803 1.00 0.00 H new ATOM 8 N SER A 2 11.730 14.043 10.526 1.00 0.00 N ATOM 9 CA SER A 2 11.323 13.122 9.471 1.00 0.00 C ATOM 10 C SER A 2 11.428 13.785 8.101 1.00 0.00 C ATOM 11 O SER A 2 11.245 14.995 7.969 1.00 0.00 O ATOM 12 CB SER A 2 9.891 12.641 9.709 1.00 0.00 C ATOM 13 OG SER A 2 9.430 11.853 8.624 1.00 0.00 O ATOM 0 H SER A 2 11.853 15.008 10.219 1.00 0.00 H new ATOM 0 HA SER A 2 11.995 12.264 9.493 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.848 12.059 10.629 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.233 13.500 9.844 1.00 0.00 H new ATOM 0 HG SER A 2 8.513 11.556 8.801 1.00 0.00 H new ATOM 19 N SER A 3 11.724 12.983 7.083 1.00 0.00 N ATOM 20 CA SER A 3 11.858 13.492 5.723 1.00 0.00 C ATOM 21 C SER A 3 11.586 12.391 4.703 1.00 0.00 C ATOM 22 O SER A 3 11.568 11.207 5.039 1.00 0.00 O ATOM 23 CB SER A 3 13.259 14.068 5.507 1.00 0.00 C ATOM 24 OG SER A 3 13.516 15.133 6.405 1.00 0.00 O ATOM 0 H SER A 3 11.876 11.978 7.174 1.00 0.00 H new ATOM 0 HA SER A 3 11.122 14.284 5.583 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.003 13.284 5.645 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.356 14.422 4.481 1.00 0.00 H new ATOM 0 HG SER A 3 14.418 15.483 6.248 1.00 0.00 H new ATOM 30 N GLY A 4 11.373 12.790 3.452 1.00 0.00 N ATOM 31 CA GLY A 4 11.104 11.827 2.401 1.00 0.00 C ATOM 32 C GLY A 4 11.114 12.456 1.022 1.00 0.00 C ATOM 33 O GLY A 4 11.025 13.677 0.888 1.00 0.00 O ATOM 0 H GLY A 4 11.382 13.764 3.148 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.850 11.033 2.440 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.134 11.362 2.578 1.00 0.00 H new ATOM 37 N SER A 5 11.222 11.622 -0.007 1.00 0.00 N ATOM 38 CA SER A 5 11.249 12.104 -1.383 1.00 0.00 C ATOM 39 C SER A 5 10.996 10.962 -2.363 1.00 0.00 C ATOM 40 O SER A 5 11.809 10.047 -2.490 1.00 0.00 O ATOM 41 CB SER A 5 12.594 12.765 -1.688 1.00 0.00 C ATOM 42 OG SER A 5 13.666 11.864 -1.473 1.00 0.00 O ATOM 0 H SER A 5 11.292 10.609 0.086 1.00 0.00 H new ATOM 0 HA SER A 5 10.456 12.842 -1.499 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.607 13.110 -2.722 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.722 13.644 -1.057 1.00 0.00 H new ATOM 0 HG SER A 5 13.417 10.975 -1.801 1.00 0.00 H new ATOM 48 N SER A 6 9.862 11.025 -3.055 1.00 0.00 N ATOM 49 CA SER A 6 9.499 9.995 -4.022 1.00 0.00 C ATOM 50 C SER A 6 8.675 10.587 -5.161 1.00 0.00 C ATOM 51 O SER A 6 7.805 11.428 -4.942 1.00 0.00 O ATOM 52 CB SER A 6 8.712 8.877 -3.336 1.00 0.00 C ATOM 53 OG SER A 6 9.510 8.208 -2.374 1.00 0.00 O ATOM 0 H SER A 6 9.180 11.778 -2.964 1.00 0.00 H new ATOM 0 HA SER A 6 10.418 9.581 -4.438 1.00 0.00 H new ATOM 0 HB2 SER A 6 7.828 9.294 -2.853 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.362 8.164 -4.082 1.00 0.00 H new ATOM 0 HG SER A 6 8.984 7.499 -1.948 1.00 0.00 H new ATOM 59 N GLY A 7 8.958 10.140 -6.381 1.00 0.00 N ATOM 60 CA GLY A 7 8.236 10.636 -7.539 1.00 0.00 C ATOM 61 C GLY A 7 8.727 10.022 -8.835 1.00 0.00 C ATOM 62 O GLY A 7 8.560 8.824 -9.063 1.00 0.00 O ATOM 0 H GLY A 7 9.674 9.444 -6.588 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.174 10.423 -7.419 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.340 11.720 -7.592 1.00 0.00 H new ATOM 66 N GLN A 8 9.332 10.844 -9.685 1.00 0.00 N ATOM 67 CA GLN A 8 9.846 10.375 -10.967 1.00 0.00 C ATOM 68 C GLN A 8 11.128 9.571 -10.777 1.00 0.00 C ATOM 69 O GLN A 8 12.215 10.137 -10.663 1.00 0.00 O ATOM 70 CB GLN A 8 10.105 11.558 -11.901 1.00 0.00 C ATOM 71 CG GLN A 8 8.859 12.371 -12.214 1.00 0.00 C ATOM 72 CD GLN A 8 7.813 11.569 -12.963 1.00 0.00 C ATOM 73 OE1 GLN A 8 7.983 10.373 -13.201 1.00 0.00 O ATOM 74 NE2 GLN A 8 6.722 12.226 -13.340 1.00 0.00 N ATOM 0 H GLN A 8 9.479 11.838 -9.510 1.00 0.00 H new ATOM 0 HA GLN A 8 9.094 9.726 -11.416 1.00 0.00 H new ATOM 0 HB2 GLN A 8 10.851 12.211 -11.448 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.531 11.187 -12.834 1.00 0.00 H new ATOM 0 HG2 GLN A 8 8.429 12.743 -11.284 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.137 13.242 -12.807 1.00 0.00 H new ATOM 0 HE21 GLN A 8 6.623 13.217 -13.122 1.00 0.00 H new ATOM 0 HE22 GLN A 8 5.983 11.739 -13.848 1.00 0.00 H new ATOM 83 N GLU A 9 10.993 8.249 -10.745 1.00 0.00 N ATOM 84 CA GLU A 9 12.141 7.369 -10.568 1.00 0.00 C ATOM 85 C GLU A 9 12.922 7.224 -11.871 1.00 0.00 C ATOM 86 O GLU A 9 14.104 7.560 -11.940 1.00 0.00 O ATOM 87 CB GLU A 9 11.686 5.993 -10.077 1.00 0.00 C ATOM 88 CG GLU A 9 11.521 5.908 -8.569 1.00 0.00 C ATOM 89 CD GLU A 9 12.711 6.474 -7.819 1.00 0.00 C ATOM 90 OE1 GLU A 9 12.731 7.699 -7.577 1.00 0.00 O ATOM 91 OE2 GLU A 9 13.622 5.693 -7.474 1.00 0.00 O ATOM 0 H GLU A 9 10.100 7.765 -10.839 1.00 0.00 H new ATOM 0 HA GLU A 9 12.796 7.815 -9.820 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.738 5.742 -10.552 1.00 0.00 H new ATOM 0 HB3 GLU A 9 12.411 5.244 -10.397 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.621 6.448 -8.275 1.00 0.00 H new ATOM 0 HG3 GLU A 9 11.377 4.867 -8.281 1.00 0.00 H new ATOM 98 N SER A 10 12.251 6.719 -12.902 1.00 0.00 N ATOM 99 CA SER A 10 12.882 6.525 -14.203 1.00 0.00 C ATOM 100 C SER A 10 14.004 5.496 -14.114 1.00 0.00 C ATOM 101 O SER A 10 15.023 5.610 -14.795 1.00 0.00 O ATOM 102 CB SER A 10 13.432 7.852 -14.730 1.00 0.00 C ATOM 103 OG SER A 10 13.771 7.754 -16.102 1.00 0.00 O ATOM 0 H SER A 10 11.272 6.437 -12.862 1.00 0.00 H new ATOM 0 HA SER A 10 12.126 6.153 -14.894 1.00 0.00 H new ATOM 0 HB2 SER A 10 12.690 8.638 -14.591 1.00 0.00 H new ATOM 0 HB3 SER A 10 14.312 8.139 -14.154 1.00 0.00 H new ATOM 0 HG SER A 10 14.362 6.984 -16.239 1.00 0.00 H new ATOM 109 N VAL A 11 13.810 4.489 -13.267 1.00 0.00 N ATOM 110 CA VAL A 11 14.804 3.438 -13.088 1.00 0.00 C ATOM 111 C VAL A 11 14.519 2.250 -14.001 1.00 0.00 C ATOM 112 O VAL A 11 15.304 1.940 -14.896 1.00 0.00 O ATOM 113 CB VAL A 11 14.849 2.950 -11.628 1.00 0.00 C ATOM 114 CG1 VAL A 11 15.879 1.843 -11.466 1.00 0.00 C ATOM 115 CG2 VAL A 11 15.147 4.109 -10.689 1.00 0.00 C ATOM 0 H VAL A 11 12.973 4.380 -12.694 1.00 0.00 H new ATOM 0 HA VAL A 11 15.770 3.869 -13.349 1.00 0.00 H new ATOM 0 HB VAL A 11 13.871 2.544 -11.368 1.00 0.00 H new ATOM 0 HG11 VAL A 11 15.896 1.511 -10.428 1.00 0.00 H new ATOM 0 HG12 VAL A 11 15.616 1.004 -12.111 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.864 2.219 -11.743 1.00 0.00 H new ATOM 0 HG21 VAL A 11 15.175 3.747 -9.661 1.00 0.00 H new ATOM 0 HG22 VAL A 11 16.112 4.547 -10.946 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.368 4.865 -10.786 1.00 0.00 H new ATOM 125 N GLU A 12 13.389 1.590 -13.768 1.00 0.00 N ATOM 126 CA GLU A 12 13.000 0.436 -14.570 1.00 0.00 C ATOM 127 C GLU A 12 13.910 -0.756 -14.285 1.00 0.00 C ATOM 128 O GLU A 12 14.426 -1.389 -15.205 1.00 0.00 O ATOM 129 CB GLU A 12 13.046 0.783 -16.059 1.00 0.00 C ATOM 130 CG GLU A 12 12.148 -0.093 -16.917 1.00 0.00 C ATOM 131 CD GLU A 12 11.736 0.583 -18.210 1.00 0.00 C ATOM 132 OE1 GLU A 12 11.158 1.688 -18.142 1.00 0.00 O ATOM 133 OE2 GLU A 12 11.990 0.007 -19.288 1.00 0.00 O ATOM 0 H GLU A 12 12.727 1.834 -13.031 1.00 0.00 H new ATOM 0 HA GLU A 12 11.980 0.165 -14.299 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.755 1.825 -16.190 1.00 0.00 H new ATOM 0 HB3 GLU A 12 14.073 0.692 -16.413 1.00 0.00 H new ATOM 0 HG2 GLU A 12 12.667 -1.023 -17.147 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.256 -0.358 -16.350 1.00 0.00 H new ATOM 140 N ASP A 13 14.101 -1.054 -13.005 1.00 0.00 N ATOM 141 CA ASP A 13 14.948 -2.169 -12.597 1.00 0.00 C ATOM 142 C ASP A 13 14.300 -2.957 -11.463 1.00 0.00 C ATOM 143 O ASP A 13 14.120 -2.442 -10.360 1.00 0.00 O ATOM 144 CB ASP A 13 16.323 -1.660 -12.162 1.00 0.00 C ATOM 145 CG ASP A 13 17.184 -1.240 -13.336 1.00 0.00 C ATOM 146 OD1 ASP A 13 17.602 -2.125 -14.113 1.00 0.00 O ATOM 147 OD2 ASP A 13 17.439 -0.026 -13.480 1.00 0.00 O ATOM 0 H ASP A 13 13.681 -0.539 -12.231 1.00 0.00 H new ATOM 0 HA ASP A 13 15.070 -2.833 -13.453 1.00 0.00 H new ATOM 0 HB2 ASP A 13 16.197 -0.814 -11.487 1.00 0.00 H new ATOM 0 HB3 ASP A 13 16.835 -2.441 -11.601 1.00 0.00 H new ATOM 152 N SER A 14 13.950 -4.208 -11.743 1.00 0.00 N ATOM 153 CA SER A 14 13.318 -5.066 -10.748 1.00 0.00 C ATOM 154 C SER A 14 12.006 -4.458 -10.262 1.00 0.00 C ATOM 155 O SER A 14 11.774 -4.332 -9.059 1.00 0.00 O ATOM 156 CB SER A 14 14.260 -5.289 -9.563 1.00 0.00 C ATOM 157 OG SER A 14 15.558 -5.648 -10.004 1.00 0.00 O ATOM 0 H SER A 14 14.093 -4.650 -12.651 1.00 0.00 H new ATOM 0 HA SER A 14 13.102 -6.026 -11.217 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.315 -4.381 -8.962 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.861 -6.073 -8.920 1.00 0.00 H new ATOM 0 HG SER A 14 16.141 -5.783 -9.228 1.00 0.00 H new ATOM 163 N LEU A 15 11.149 -4.083 -11.206 1.00 0.00 N ATOM 164 CA LEU A 15 9.859 -3.488 -10.876 1.00 0.00 C ATOM 165 C LEU A 15 8.774 -4.556 -10.786 1.00 0.00 C ATOM 166 O LEU A 15 8.652 -5.407 -11.666 1.00 0.00 O ATOM 167 CB LEU A 15 9.475 -2.442 -11.923 1.00 0.00 C ATOM 168 CG LEU A 15 10.013 -1.029 -11.689 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.580 -0.101 -12.813 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.543 -0.496 -10.344 1.00 0.00 C ATOM 0 H LEU A 15 11.325 -4.181 -12.206 1.00 0.00 H new ATOM 0 HA LEU A 15 9.948 -3.004 -9.903 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.825 -2.786 -12.896 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.387 -2.391 -11.975 1.00 0.00 H new ATOM 0 HG LEU A 15 11.102 -1.072 -11.680 1.00 0.00 H new ATOM 0 HD11 LEU A 15 9.972 0.900 -12.630 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.966 -0.474 -13.762 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.491 -0.063 -12.854 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.935 0.510 -10.194 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.454 -0.468 -10.324 1.00 0.00 H new ATOM 0 HD23 LEU A 15 9.903 -1.148 -9.548 1.00 0.00 H new ATOM 182 N ALA A 16 7.986 -4.504 -9.717 1.00 0.00 N ATOM 183 CA ALA A 16 6.908 -5.464 -9.514 1.00 0.00 C ATOM 184 C ALA A 16 5.557 -4.762 -9.425 1.00 0.00 C ATOM 185 O ALA A 16 5.394 -3.801 -8.672 1.00 0.00 O ATOM 186 CB ALA A 16 7.162 -6.285 -8.259 1.00 0.00 C ATOM 0 H ALA A 16 8.074 -3.807 -8.978 1.00 0.00 H new ATOM 0 HA ALA A 16 6.884 -6.133 -10.374 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.349 -6.998 -8.120 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.104 -6.824 -8.361 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.215 -5.622 -7.395 1.00 0.00 H new ATOM 192 N THR A 17 4.591 -5.247 -10.198 1.00 0.00 N ATOM 193 CA THR A 17 3.255 -4.665 -10.207 1.00 0.00 C ATOM 194 C THR A 17 2.538 -4.912 -8.885 1.00 0.00 C ATOM 195 O THR A 17 2.107 -6.029 -8.600 1.00 0.00 O ATOM 196 CB THR A 17 2.401 -5.237 -11.355 1.00 0.00 C ATOM 197 OG1 THR A 17 3.113 -5.133 -12.593 1.00 0.00 O ATOM 198 CG2 THR A 17 1.075 -4.499 -11.463 1.00 0.00 C ATOM 0 H THR A 17 4.709 -6.042 -10.826 1.00 0.00 H new ATOM 0 HA THR A 17 3.379 -3.592 -10.355 1.00 0.00 H new ATOM 0 HB THR A 17 2.198 -6.286 -11.140 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.565 -5.500 -13.318 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.490 -4.920 -12.280 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.523 -4.604 -10.529 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.261 -3.443 -11.657 1.00 0.00 H new ATOM 206 N VAL A 18 2.413 -3.862 -8.079 1.00 0.00 N ATOM 207 CA VAL A 18 1.747 -3.964 -6.787 1.00 0.00 C ATOM 208 C VAL A 18 0.397 -3.257 -6.807 1.00 0.00 C ATOM 209 O VAL A 18 0.327 -2.028 -6.838 1.00 0.00 O ATOM 210 CB VAL A 18 2.611 -3.366 -5.661 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.874 -3.429 -4.331 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.947 -4.088 -5.574 1.00 0.00 C ATOM 0 H VAL A 18 2.765 -2.930 -8.299 1.00 0.00 H new ATOM 0 HA VAL A 18 1.595 -5.026 -6.593 1.00 0.00 H new ATOM 0 HB VAL A 18 2.804 -2.319 -5.893 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.500 -3.002 -3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.945 -2.863 -4.402 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.648 -4.468 -4.089 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.545 -3.652 -4.773 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.777 -5.144 -5.366 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.478 -3.985 -6.520 1.00 0.00 H new ATOM 222 N LYS A 19 -0.676 -4.041 -6.788 1.00 0.00 N ATOM 223 CA LYS A 19 -2.026 -3.491 -6.803 1.00 0.00 C ATOM 224 C LYS A 19 -2.438 -3.023 -5.411 1.00 0.00 C ATOM 225 O LYS A 19 -2.301 -3.757 -4.432 1.00 0.00 O ATOM 226 CB LYS A 19 -3.020 -4.537 -7.315 1.00 0.00 C ATOM 227 CG LYS A 19 -2.970 -4.737 -8.820 1.00 0.00 C ATOM 228 CD LYS A 19 -4.191 -5.489 -9.323 1.00 0.00 C ATOM 229 CE LYS A 19 -4.407 -5.268 -10.812 1.00 0.00 C ATOM 230 NZ LYS A 19 -5.240 -4.064 -11.079 1.00 0.00 N ATOM 0 H LYS A 19 -0.636 -5.060 -6.762 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.034 -2.632 -7.474 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.819 -5.489 -6.823 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.029 -4.238 -7.030 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.909 -3.768 -9.315 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.067 -5.288 -9.085 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -4.070 -6.554 -9.126 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -5.073 -5.161 -8.774 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -3.442 -5.159 -11.307 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -4.889 -6.146 -11.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.029 -3.699 -12.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -6.247 -4.319 -11.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.028 -3.331 -10.372 1.00 0.00 H new ATOM 244 N VAL A 20 -2.944 -1.796 -5.329 1.00 0.00 N ATOM 245 CA VAL A 20 -3.378 -1.231 -4.057 1.00 0.00 C ATOM 246 C VAL A 20 -4.899 -1.177 -3.970 1.00 0.00 C ATOM 247 O VAL A 20 -5.578 -0.884 -4.954 1.00 0.00 O ATOM 248 CB VAL A 20 -2.813 0.187 -3.851 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.386 0.812 -2.588 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.293 0.152 -3.796 1.00 0.00 C ATOM 0 H VAL A 20 -3.063 -1.174 -6.129 1.00 0.00 H new ATOM 0 HA VAL A 20 -2.995 -1.885 -3.273 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.109 0.804 -4.699 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.975 1.813 -2.459 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.471 0.873 -2.672 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.123 0.198 -1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.911 1.162 -3.650 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -0.973 -0.480 -2.968 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -0.904 -0.251 -4.731 1.00 0.00 H new ATOM 260 N VAL A 21 -5.429 -1.463 -2.785 1.00 0.00 N ATOM 261 CA VAL A 21 -6.870 -1.446 -2.568 1.00 0.00 C ATOM 262 C VAL A 21 -7.222 -0.735 -1.266 1.00 0.00 C ATOM 263 O VAL A 21 -6.681 -1.054 -0.206 1.00 0.00 O ATOM 264 CB VAL A 21 -7.450 -2.873 -2.534 1.00 0.00 C ATOM 265 CG1 VAL A 21 -8.951 -2.834 -2.293 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.127 -3.610 -3.825 1.00 0.00 C ATOM 0 H VAL A 21 -4.881 -1.709 -1.960 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.309 -0.903 -3.405 1.00 0.00 H new ATOM 0 HB VAL A 21 -6.988 -3.415 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.343 -3.851 -2.272 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.154 -2.347 -1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.434 -2.276 -3.095 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.544 -4.616 -3.784 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.559 -3.072 -4.669 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.046 -3.670 -3.949 1.00 0.00 H new ATOM 276 N LEU A 22 -8.131 0.229 -1.351 1.00 0.00 N ATOM 277 CA LEU A 22 -8.556 0.986 -0.179 1.00 0.00 C ATOM 278 C LEU A 22 -9.628 0.229 0.599 1.00 0.00 C ATOM 279 O LEU A 22 -10.614 -0.235 0.025 1.00 0.00 O ATOM 280 CB LEU A 22 -9.088 2.358 -0.599 1.00 0.00 C ATOM 281 CG LEU A 22 -8.033 3.412 -0.936 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.653 4.553 -1.729 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.378 3.936 0.333 1.00 0.00 C ATOM 0 H LEU A 22 -8.588 0.505 -2.220 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.690 1.121 0.469 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.731 2.225 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.715 2.744 0.205 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.264 2.945 -1.551 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.887 5.294 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.074 4.165 -2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.443 5.019 -1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.630 4.685 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.136 4.387 0.974 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -6.898 3.112 0.862 1.00 0.00 H new ATOM 295 N ILE A 23 -9.428 0.109 1.907 1.00 0.00 N ATOM 296 CA ILE A 23 -10.379 -0.589 2.763 1.00 0.00 C ATOM 297 C ILE A 23 -11.667 0.213 2.923 1.00 0.00 C ATOM 298 O ILE A 23 -12.760 -0.249 2.594 1.00 0.00 O ATOM 299 CB ILE A 23 -9.784 -0.865 4.157 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.090 -2.228 4.178 1.00 0.00 C ATOM 301 CG2 ILE A 23 -10.872 -0.801 5.219 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.050 -3.396 4.120 1.00 0.00 C ATOM 0 H ILE A 23 -8.617 0.486 2.397 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.603 -1.539 2.277 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.042 -0.098 4.378 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.403 -2.290 3.334 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.489 -2.307 5.084 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.436 -0.998 6.199 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.325 0.190 5.216 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.635 -1.549 5.004 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.488 -4.330 4.139 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -10.721 -3.359 4.978 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.634 -3.342 3.201 1.00 0.00 H new ATOM 314 N PRO A 24 -11.537 1.445 3.437 1.00 0.00 N ATOM 315 CA PRO A 24 -12.680 2.338 3.650 1.00 0.00 C ATOM 316 C PRO A 24 -13.273 2.842 2.338 1.00 0.00 C ATOM 317 O PRO A 24 -14.488 3.001 2.215 1.00 0.00 O ATOM 318 CB PRO A 24 -12.079 3.499 4.446 1.00 0.00 C ATOM 319 CG PRO A 24 -10.634 3.500 4.084 1.00 0.00 C ATOM 320 CD PRO A 24 -10.265 2.060 3.851 1.00 0.00 C ATOM 0 HA PRO A 24 -13.502 1.835 4.159 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.553 4.445 4.185 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.218 3.358 5.518 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.456 4.098 3.190 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.032 3.933 4.883 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.501 1.961 3.080 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.869 1.595 4.754 1.00 0.00 H new ATOM 328 N VAL A 25 -12.408 3.092 1.360 1.00 0.00 N ATOM 329 CA VAL A 25 -12.847 3.576 0.057 1.00 0.00 C ATOM 330 C VAL A 25 -13.293 2.424 -0.836 1.00 0.00 C ATOM 331 O VAL A 25 -14.327 2.501 -1.497 1.00 0.00 O ATOM 332 CB VAL A 25 -11.730 4.362 -0.655 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.310 5.241 -1.753 1.00 0.00 C ATOM 334 CG2 VAL A 25 -10.943 5.194 0.346 1.00 0.00 C ATOM 0 H VAL A 25 -11.399 2.967 1.446 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.692 4.241 0.235 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.047 3.649 -1.117 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.505 5.788 -2.244 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.824 4.618 -2.485 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.017 5.948 -1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.158 5.743 -0.174 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.612 5.899 0.839 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.494 4.538 1.091 1.00 0.00 H new ATOM 344 N GLY A 26 -12.503 1.354 -0.851 1.00 0.00 N ATOM 345 CA GLY A 26 -12.833 0.200 -1.666 1.00 0.00 C ATOM 346 C GLY A 26 -12.384 0.360 -3.106 1.00 0.00 C ATOM 347 O GLY A 26 -12.609 -0.523 -3.933 1.00 0.00 O ATOM 0 H GLY A 26 -11.641 1.266 -0.313 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.366 -0.688 -1.239 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -13.910 0.037 -1.640 1.00 0.00 H new ATOM 351 N GLN A 27 -11.750 1.489 -3.404 1.00 0.00 N ATOM 352 CA GLN A 27 -11.271 1.761 -4.754 1.00 0.00 C ATOM 353 C GLN A 27 -10.006 0.964 -5.055 1.00 0.00 C ATOM 354 O GLN A 27 -9.409 0.369 -4.158 1.00 0.00 O ATOM 355 CB GLN A 27 -10.999 3.256 -4.930 1.00 0.00 C ATOM 356 CG GLN A 27 -11.144 3.737 -6.364 1.00 0.00 C ATOM 357 CD GLN A 27 -11.396 5.229 -6.458 1.00 0.00 C ATOM 358 OE1 GLN A 27 -12.525 5.666 -6.684 1.00 0.00 O ATOM 359 NE2 GLN A 27 -10.344 6.020 -6.283 1.00 0.00 N ATOM 0 H GLN A 27 -11.556 2.229 -2.730 1.00 0.00 H new ATOM 0 HA GLN A 27 -12.047 1.454 -5.455 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.685 3.818 -4.296 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.990 3.476 -4.582 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -10.239 3.490 -6.919 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.966 3.203 -6.841 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -9.426 5.615 -6.098 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -10.453 7.033 -6.334 1.00 0.00 H new ATOM 368 N GLU A 28 -9.604 0.956 -6.322 1.00 0.00 N ATOM 369 CA GLU A 28 -8.411 0.230 -6.740 1.00 0.00 C ATOM 370 C GLU A 28 -7.396 1.173 -7.380 1.00 0.00 C ATOM 371 O GLU A 28 -7.748 2.004 -8.217 1.00 0.00 O ATOM 372 CB GLU A 28 -8.781 -0.882 -7.723 1.00 0.00 C ATOM 373 CG GLU A 28 -9.275 -2.151 -7.050 1.00 0.00 C ATOM 374 CD GLU A 28 -9.728 -3.202 -8.045 1.00 0.00 C ATOM 375 OE1 GLU A 28 -10.920 -3.195 -8.416 1.00 0.00 O ATOM 376 OE2 GLU A 28 -8.888 -4.032 -8.453 1.00 0.00 O ATOM 0 H GLU A 28 -10.087 1.444 -7.076 1.00 0.00 H new ATOM 0 HA GLU A 28 -7.959 -0.215 -5.853 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.553 -0.515 -8.399 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -7.910 -1.120 -8.333 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.478 -2.563 -6.430 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.103 -1.906 -6.384 1.00 0.00 H new ATOM 383 N ILE A 29 -6.137 1.038 -6.979 1.00 0.00 N ATOM 384 CA ILE A 29 -5.071 1.877 -7.513 1.00 0.00 C ATOM 385 C ILE A 29 -3.841 1.047 -7.862 1.00 0.00 C ATOM 386 O ILE A 29 -3.353 0.265 -7.045 1.00 0.00 O ATOM 387 CB ILE A 29 -4.668 2.978 -6.515 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.877 3.849 -6.166 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.544 3.828 -7.089 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.572 4.927 -5.150 1.00 0.00 C ATOM 0 H ILE A 29 -5.830 0.356 -6.286 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.460 2.344 -8.418 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.309 2.505 -5.601 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.254 4.315 -7.076 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.674 3.213 -5.781 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.270 4.602 -6.372 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.678 3.198 -7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.877 4.294 -8.016 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.474 5.505 -4.951 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.224 4.467 -4.225 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.797 5.587 -5.541 1.00 0.00 H new ATOM 402 N VAL A 30 -3.341 1.223 -9.081 1.00 0.00 N ATOM 403 CA VAL A 30 -2.164 0.493 -9.538 1.00 0.00 C ATOM 404 C VAL A 30 -0.940 1.400 -9.590 1.00 0.00 C ATOM 405 O VAL A 30 -0.972 2.468 -10.203 1.00 0.00 O ATOM 406 CB VAL A 30 -2.392 -0.123 -10.931 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.102 -0.726 -11.466 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.496 -1.168 -10.876 1.00 0.00 C ATOM 0 H VAL A 30 -3.733 1.865 -9.770 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.989 -0.307 -8.819 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.705 0.668 -11.613 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.283 -1.156 -12.451 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.342 0.051 -11.544 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.756 -1.506 -10.787 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.644 -1.593 -11.869 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.214 -1.959 -10.181 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.422 -0.702 -10.539 1.00 0.00 H new ATOM 418 N ILE A 31 0.137 0.969 -8.943 1.00 0.00 N ATOM 419 CA ILE A 31 1.373 1.741 -8.917 1.00 0.00 C ATOM 420 C ILE A 31 2.588 0.830 -8.785 1.00 0.00 C ATOM 421 O ILE A 31 2.638 -0.060 -7.935 1.00 0.00 O ATOM 422 CB ILE A 31 1.377 2.757 -7.759 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.667 3.579 -7.778 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.220 2.040 -6.426 1.00 0.00 C ATOM 425 CD1 ILE A 31 2.823 4.487 -6.578 1.00 0.00 C ATOM 0 H ILE A 31 0.179 0.089 -8.429 1.00 0.00 H new ATOM 0 HA ILE A 31 1.429 2.280 -9.863 1.00 0.00 H new ATOM 0 HB ILE A 31 0.534 3.436 -7.887 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.519 2.901 -7.824 1.00 0.00 H new ATOM 0 HG13 ILE A 31 2.690 4.182 -8.685 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.225 2.771 -5.617 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.277 1.493 -6.416 1.00 0.00 H new ATOM 0 HG23 ILE A 31 2.046 1.342 -6.289 1.00 0.00 H new ATOM 0 HD11 ILE A 31 3.760 5.039 -6.659 1.00 0.00 H new ATOM 0 HD12 ILE A 31 1.990 5.189 -6.542 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.832 3.888 -5.667 1.00 0.00 H new ATOM 437 N PRO A 32 3.594 1.057 -9.643 1.00 0.00 N ATOM 438 CA PRO A 32 4.829 0.268 -9.641 1.00 0.00 C ATOM 439 C PRO A 32 5.688 0.540 -8.410 1.00 0.00 C ATOM 440 O PRO A 32 5.755 1.669 -7.925 1.00 0.00 O ATOM 441 CB PRO A 32 5.549 0.733 -10.909 1.00 0.00 C ATOM 442 CG PRO A 32 5.028 2.106 -11.159 1.00 0.00 C ATOM 443 CD PRO A 32 3.602 2.100 -10.682 1.00 0.00 C ATOM 0 HA PRO A 32 4.629 -0.803 -9.617 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.630 0.739 -10.771 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.339 0.071 -11.749 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.616 2.850 -10.622 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.084 2.358 -12.218 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.309 3.070 -10.280 1.00 0.00 H new ATOM 0 HD3 PRO A 32 2.909 1.867 -11.490 1.00 0.00 H new ATOM 451 N PHE A 33 6.345 -0.502 -7.911 1.00 0.00 N ATOM 452 CA PHE A 33 7.200 -0.375 -6.736 1.00 0.00 C ATOM 453 C PHE A 33 8.397 -1.316 -6.831 1.00 0.00 C ATOM 454 O PHE A 33 8.314 -2.387 -7.431 1.00 0.00 O ATOM 455 CB PHE A 33 6.403 -0.672 -5.465 1.00 0.00 C ATOM 456 CG PHE A 33 6.986 -0.044 -4.231 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.314 1.302 -4.211 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.206 -0.800 -3.091 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.851 1.882 -3.078 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.742 -0.225 -1.954 1.00 0.00 C ATOM 461 CZ PHE A 33 8.066 1.118 -1.948 1.00 0.00 C ATOM 0 H PHE A 33 6.302 -1.443 -8.302 1.00 0.00 H new ATOM 0 HA PHE A 33 7.568 0.650 -6.694 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.381 -0.317 -5.595 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.350 -1.751 -5.323 1.00 0.00 H new ATOM 0 HD1 PHE A 33 7.148 1.905 -5.092 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.956 -1.851 -3.091 1.00 0.00 H new ATOM 0 HE1 PHE A 33 8.103 2.932 -3.076 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.907 -0.825 -1.071 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.486 1.569 -1.061 1.00 0.00 H new ATOM 471 N LYS A 34 9.512 -0.907 -6.234 1.00 0.00 N ATOM 472 CA LYS A 34 10.728 -1.711 -6.250 1.00 0.00 C ATOM 473 C LYS A 34 10.695 -2.768 -5.150 1.00 0.00 C ATOM 474 O LYS A 34 10.649 -2.442 -3.964 1.00 0.00 O ATOM 475 CB LYS A 34 11.958 -0.817 -6.075 1.00 0.00 C ATOM 476 CG LYS A 34 12.528 -0.305 -7.387 1.00 0.00 C ATOM 477 CD LYS A 34 11.599 0.703 -8.043 1.00 0.00 C ATOM 478 CE LYS A 34 11.890 2.119 -7.570 1.00 0.00 C ATOM 479 NZ LYS A 34 13.200 2.615 -8.075 1.00 0.00 N ATOM 0 H LYS A 34 9.598 -0.023 -5.733 1.00 0.00 H new ATOM 0 HA LYS A 34 10.787 -2.216 -7.214 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.693 0.033 -5.447 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.730 -1.375 -5.546 1.00 0.00 H new ATOM 0 HG2 LYS A 34 13.499 0.157 -7.207 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.694 -1.143 -8.064 1.00 0.00 H new ATOM 0 HD2 LYS A 34 11.709 0.650 -9.126 1.00 0.00 H new ATOM 0 HD3 LYS A 34 10.564 0.448 -7.815 1.00 0.00 H new ATOM 0 HE2 LYS A 34 11.095 2.785 -7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 34 11.887 2.145 -6.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 13.231 3.652 -8.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 13.969 2.204 -7.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 13.316 2.337 -9.070 1.00 0.00 H new ATOM 493 N VAL A 35 10.720 -4.035 -5.552 1.00 0.00 N ATOM 494 CA VAL A 35 10.696 -5.139 -4.600 1.00 0.00 C ATOM 495 C VAL A 35 11.809 -5.000 -3.568 1.00 0.00 C ATOM 496 O VAL A 35 11.706 -5.517 -2.455 1.00 0.00 O ATOM 497 CB VAL A 35 10.839 -6.497 -5.313 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.673 -6.727 -6.263 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.165 -6.572 -6.055 1.00 0.00 C ATOM 0 H VAL A 35 10.757 -4.322 -6.530 1.00 0.00 H new ATOM 0 HA VAL A 35 9.731 -5.101 -4.095 1.00 0.00 H new ATOM 0 HB VAL A 35 10.825 -7.286 -4.561 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.791 -7.691 -6.758 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.739 -6.720 -5.701 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.652 -5.935 -7.012 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.249 -7.538 -6.553 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.212 -5.776 -6.798 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.985 -6.456 -5.347 1.00 0.00 H new ATOM 509 N ASP A 36 12.872 -4.298 -3.944 1.00 0.00 N ATOM 510 CA ASP A 36 14.005 -4.088 -3.049 1.00 0.00 C ATOM 511 C ASP A 36 13.745 -2.915 -2.109 1.00 0.00 C ATOM 512 O ASP A 36 14.085 -2.966 -0.926 1.00 0.00 O ATOM 513 CB ASP A 36 15.280 -3.838 -3.857 1.00 0.00 C ATOM 514 CG ASP A 36 16.359 -3.157 -3.038 1.00 0.00 C ATOM 515 OD1 ASP A 36 17.078 -3.863 -2.301 1.00 0.00 O ATOM 516 OD2 ASP A 36 16.484 -1.918 -3.135 1.00 0.00 O ATOM 0 H ASP A 36 12.973 -3.865 -4.862 1.00 0.00 H new ATOM 0 HA ASP A 36 14.135 -4.989 -2.449 1.00 0.00 H new ATOM 0 HB2 ASP A 36 15.659 -4.787 -4.235 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.042 -3.222 -4.724 1.00 0.00 H new ATOM 521 N THR A 37 13.142 -1.857 -2.643 1.00 0.00 N ATOM 522 CA THR A 37 12.839 -0.671 -1.853 1.00 0.00 C ATOM 523 C THR A 37 11.819 -0.981 -0.764 1.00 0.00 C ATOM 524 O THR A 37 10.739 -1.504 -1.042 1.00 0.00 O ATOM 525 CB THR A 37 12.299 0.469 -2.736 1.00 0.00 C ATOM 526 OG1 THR A 37 13.299 0.874 -3.678 1.00 0.00 O ATOM 527 CG2 THR A 37 11.883 1.661 -1.887 1.00 0.00 C ATOM 0 H THR A 37 12.854 -1.798 -3.620 1.00 0.00 H new ATOM 0 HA THR A 37 13.774 -0.352 -1.391 1.00 0.00 H new ATOM 0 HB THR A 37 11.423 0.101 -3.271 1.00 0.00 H new ATOM 0 HG1 THR A 37 12.948 1.598 -4.237 1.00 0.00 H new ATOM 0 HG21 THR A 37 11.505 2.453 -2.533 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.102 1.357 -1.191 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.744 2.028 -1.328 1.00 0.00 H new ATOM 535 N ILE A 38 12.167 -0.656 0.477 1.00 0.00 N ATOM 536 CA ILE A 38 11.280 -0.899 1.607 1.00 0.00 C ATOM 537 C ILE A 38 9.860 -0.436 1.301 1.00 0.00 C ATOM 538 O ILE A 38 9.607 0.186 0.268 1.00 0.00 O ATOM 539 CB ILE A 38 11.778 -0.186 2.878 1.00 0.00 C ATOM 540 CG1 ILE A 38 11.994 1.304 2.601 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.063 -0.829 3.377 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.355 2.101 3.834 1.00 0.00 C ATOM 0 H ILE A 38 13.057 -0.224 0.725 1.00 0.00 H new ATOM 0 HA ILE A 38 11.279 -1.975 1.781 1.00 0.00 H new ATOM 0 HB ILE A 38 11.020 -0.286 3.654 1.00 0.00 H new ATOM 0 HG12 ILE A 38 12.786 1.417 1.861 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.086 1.719 2.163 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.402 -0.314 4.276 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.879 -1.878 3.608 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.830 -0.756 2.606 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.493 3.148 3.563 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.553 2.019 4.568 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.279 1.712 4.261 1.00 0.00 H new ATOM 554 N LEU A 39 8.936 -0.740 2.206 1.00 0.00 N ATOM 555 CA LEU A 39 7.540 -0.353 2.034 1.00 0.00 C ATOM 556 C LEU A 39 7.331 1.111 2.407 1.00 0.00 C ATOM 557 O LEU A 39 6.497 1.800 1.820 1.00 0.00 O ATOM 558 CB LEU A 39 6.635 -1.243 2.888 1.00 0.00 C ATOM 559 CG LEU A 39 6.515 -2.701 2.444 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.194 -3.596 3.631 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.454 -2.845 1.363 1.00 0.00 C ATOM 0 H LEU A 39 9.128 -1.253 3.066 1.00 0.00 H new ATOM 0 HA LEU A 39 7.279 -0.482 0.983 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.005 -1.226 3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.637 -0.805 2.902 1.00 0.00 H new ATOM 0 HG LEU A 39 7.473 -3.013 2.028 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.112 -4.630 3.296 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.989 -3.517 4.372 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.250 -3.284 4.077 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.383 -3.890 1.060 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.491 -2.514 1.752 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.727 -2.235 0.502 1.00 0.00 H new ATOM 573 N LYS A 40 8.096 1.582 3.386 1.00 0.00 N ATOM 574 CA LYS A 40 7.999 2.965 3.836 1.00 0.00 C ATOM 575 C LYS A 40 7.910 3.919 2.649 1.00 0.00 C ATOM 576 O LYS A 40 6.953 4.682 2.524 1.00 0.00 O ATOM 577 CB LYS A 40 9.206 3.327 4.705 1.00 0.00 C ATOM 578 CG LYS A 40 9.056 4.651 5.434 1.00 0.00 C ATOM 579 CD LYS A 40 7.913 4.610 6.434 1.00 0.00 C ATOM 580 CE LYS A 40 8.061 5.691 7.494 1.00 0.00 C ATOM 581 NZ LYS A 40 7.413 6.966 7.081 1.00 0.00 N ATOM 0 H LYS A 40 8.791 1.025 3.883 1.00 0.00 H new ATOM 0 HA LYS A 40 7.090 3.064 4.429 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.367 2.535 5.437 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.096 3.366 4.077 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.985 4.890 5.952 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.880 5.448 4.711 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.966 4.739 5.911 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.882 3.631 6.913 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.620 5.346 8.429 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.119 5.868 7.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 7.371 7.613 7.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.966 7.405 6.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.449 6.772 6.743 1.00 0.00 H new ATOM 595 N TYR A 41 8.913 3.868 1.779 1.00 0.00 N ATOM 596 CA TYR A 41 8.949 4.728 0.602 1.00 0.00 C ATOM 597 C TYR A 41 7.547 4.934 0.036 1.00 0.00 C ATOM 598 O TYR A 41 7.087 6.067 -0.117 1.00 0.00 O ATOM 599 CB TYR A 41 9.860 4.125 -0.468 1.00 0.00 C ATOM 600 CG TYR A 41 11.306 4.548 -0.340 1.00 0.00 C ATOM 601 CD1 TYR A 41 12.062 4.181 0.766 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.916 5.313 -1.327 1.00 0.00 C ATOM 603 CE1 TYR A 41 13.384 4.565 0.887 1.00 0.00 C ATOM 604 CE2 TYR A 41 13.237 5.701 -1.215 1.00 0.00 C ATOM 605 CZ TYR A 41 13.967 5.325 -0.106 1.00 0.00 C ATOM 606 OH TYR A 41 15.283 5.709 0.011 1.00 0.00 O ATOM 0 H TYR A 41 9.712 3.240 1.867 1.00 0.00 H new ATOM 0 HA TYR A 41 9.346 5.698 0.903 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.802 3.038 -0.412 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.491 4.414 -1.452 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.609 3.585 1.545 1.00 0.00 H new ATOM 0 HD2 TYR A 41 11.348 5.609 -2.196 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.958 4.272 1.754 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.696 6.295 -1.991 1.00 0.00 H new ATOM 0 HH TYR A 41 15.540 6.238 -0.773 1.00 0.00 H new ATOM 616 N LEU A 42 6.873 3.832 -0.273 1.00 0.00 N ATOM 617 CA LEU A 42 5.522 3.890 -0.822 1.00 0.00 C ATOM 618 C LEU A 42 4.542 4.454 0.202 1.00 0.00 C ATOM 619 O LEU A 42 3.647 5.228 -0.140 1.00 0.00 O ATOM 620 CB LEU A 42 5.070 2.497 -1.263 1.00 0.00 C ATOM 621 CG LEU A 42 3.848 2.447 -2.180 1.00 0.00 C ATOM 622 CD1 LEU A 42 4.199 2.962 -3.567 1.00 0.00 C ATOM 623 CD2 LEU A 42 3.297 1.030 -2.258 1.00 0.00 C ATOM 0 H LEU A 42 7.239 2.888 -0.153 1.00 0.00 H new ATOM 0 HA LEU A 42 5.536 4.552 -1.688 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.902 2.011 -1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.855 1.908 -0.372 1.00 0.00 H new ATOM 0 HG LEU A 42 3.077 3.093 -1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 42 3.317 2.919 -4.205 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.545 3.993 -3.495 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.988 2.344 -3.996 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.427 1.013 -2.915 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.063 0.363 -2.653 1.00 0.00 H new ATOM 0 HD23 LEU A 42 3.005 0.698 -1.262 1.00 0.00 H new ATOM 635 N LYS A 43 4.718 4.064 1.460 1.00 0.00 N ATOM 636 CA LYS A 43 3.852 4.533 2.535 1.00 0.00 C ATOM 637 C LYS A 43 3.663 6.045 2.461 1.00 0.00 C ATOM 638 O LYS A 43 2.536 6.539 2.450 1.00 0.00 O ATOM 639 CB LYS A 43 4.439 4.148 3.895 1.00 0.00 C ATOM 640 CG LYS A 43 3.506 4.427 5.061 1.00 0.00 C ATOM 641 CD LYS A 43 3.774 3.488 6.226 1.00 0.00 C ATOM 642 CE LYS A 43 3.243 2.090 5.948 1.00 0.00 C ATOM 643 NZ LYS A 43 1.777 1.995 6.192 1.00 0.00 N ATOM 0 H LYS A 43 5.453 3.424 1.760 1.00 0.00 H new ATOM 0 HA LYS A 43 2.879 4.057 2.418 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.689 3.087 3.886 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.370 4.694 4.047 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.630 5.459 5.388 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.472 4.318 4.735 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.846 3.440 6.417 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.307 3.883 7.128 1.00 0.00 H new ATOM 0 HE2 LYS A 43 3.457 1.819 4.914 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.764 1.371 6.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 1.551 1.061 6.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 1.488 2.735 6.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 1.267 2.123 5.295 1.00 0.00 H new ATOM 657 N ASP A 44 4.773 6.773 2.410 1.00 0.00 N ATOM 658 CA ASP A 44 4.729 8.229 2.335 1.00 0.00 C ATOM 659 C ASP A 44 3.947 8.686 1.107 1.00 0.00 C ATOM 660 O ASP A 44 3.160 9.631 1.177 1.00 0.00 O ATOM 661 CB ASP A 44 6.147 8.802 2.293 1.00 0.00 C ATOM 662 CG ASP A 44 6.740 8.979 3.677 1.00 0.00 C ATOM 663 OD1 ASP A 44 5.980 9.315 4.610 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.964 8.782 3.827 1.00 0.00 O ATOM 0 H ASP A 44 5.714 6.379 2.419 1.00 0.00 H new ATOM 0 HA ASP A 44 4.222 8.599 3.226 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.786 8.140 1.709 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.132 9.764 1.781 1.00 0.00 H new ATOM 669 N HIS A 45 4.169 8.010 -0.015 1.00 0.00 N ATOM 670 CA HIS A 45 3.484 8.348 -1.259 1.00 0.00 C ATOM 671 C HIS A 45 2.008 8.639 -1.005 1.00 0.00 C ATOM 672 O HIS A 45 1.430 9.541 -1.611 1.00 0.00 O ATOM 673 CB HIS A 45 3.625 7.208 -2.268 1.00 0.00 C ATOM 674 CG HIS A 45 3.153 7.565 -3.644 1.00 0.00 C ATOM 675 ND1 HIS A 45 3.928 7.399 -4.772 1.00 0.00 N ATOM 676 CD2 HIS A 45 1.976 8.080 -4.070 1.00 0.00 C ATOM 677 CE1 HIS A 45 3.249 7.799 -5.833 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.061 8.216 -5.434 1.00 0.00 N ATOM 0 H HIS A 45 4.817 7.226 -0.089 1.00 0.00 H new ATOM 0 HA HIS A 45 3.947 9.246 -1.668 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.671 6.906 -2.319 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.061 6.346 -1.911 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.128 8.336 -3.452 1.00 0.00 H new ATOM 0 HE1 HIS A 45 3.605 7.787 -6.853 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.326 8.580 -6.040 1.00 0.00 H new ATOM 687 N PHE A 46 1.404 7.869 -0.106 1.00 0.00 N ATOM 688 CA PHE A 46 -0.005 8.044 0.227 1.00 0.00 C ATOM 689 C PHE A 46 -0.169 8.977 1.423 1.00 0.00 C ATOM 690 O PHE A 46 -0.882 9.979 1.349 1.00 0.00 O ATOM 691 CB PHE A 46 -0.650 6.690 0.530 1.00 0.00 C ATOM 692 CG PHE A 46 -0.984 5.896 -0.701 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.022 5.377 -1.500 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.303 5.670 -1.059 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.281 4.646 -2.633 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.612 4.939 -2.191 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.600 4.427 -2.979 1.00 0.00 C ATOM 0 H PHE A 46 1.868 7.118 0.405 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.503 8.493 -0.632 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.025 6.107 1.157 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.561 6.851 1.107 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.055 5.546 -1.234 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -3.098 6.069 -0.447 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.513 4.247 -3.247 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.644 4.768 -2.459 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.840 3.856 -3.864 1.00 0.00 H new ATOM 707 N SER A 47 0.494 8.641 2.524 1.00 0.00 N ATOM 708 CA SER A 47 0.418 9.446 3.738 1.00 0.00 C ATOM 709 C SER A 47 0.292 10.928 3.400 1.00 0.00 C ATOM 710 O SER A 47 -0.693 11.576 3.755 1.00 0.00 O ATOM 711 CB SER A 47 1.655 9.214 4.608 1.00 0.00 C ATOM 712 OG SER A 47 2.729 10.044 4.200 1.00 0.00 O ATOM 0 H SER A 47 1.090 7.817 2.601 1.00 0.00 H new ATOM 0 HA SER A 47 -0.470 9.140 4.292 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.412 9.415 5.651 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.956 8.168 4.546 1.00 0.00 H new ATOM 0 HG SER A 47 3.512 9.866 4.762 1.00 0.00 H new ATOM 718 N HIS A 48 1.297 11.459 2.710 1.00 0.00 N ATOM 719 CA HIS A 48 1.299 12.866 2.323 1.00 0.00 C ATOM 720 C HIS A 48 0.053 13.207 1.511 1.00 0.00 C ATOM 721 O HIS A 48 -0.685 14.134 1.847 1.00 0.00 O ATOM 722 CB HIS A 48 2.555 13.192 1.514 1.00 0.00 C ATOM 723 CG HIS A 48 2.361 13.072 0.033 1.00 0.00 C ATOM 724 ND1 HIS A 48 2.054 14.146 -0.775 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.435 11.996 -0.785 1.00 0.00 C ATOM 726 CE1 HIS A 48 1.945 13.735 -2.026 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.173 12.434 -2.059 1.00 0.00 N ATOM 0 H HIS A 48 2.120 10.937 2.408 1.00 0.00 H new ATOM 0 HA HIS A 48 1.295 13.468 3.232 1.00 0.00 H new ATOM 0 HB2 HIS A 48 2.876 14.207 1.749 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.359 12.524 1.822 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.659 10.981 -0.490 1.00 0.00 H new ATOM 0 HE1 HIS A 48 1.710 14.357 -2.877 1.00 0.00 H new ATOM 0 HE2 HIS A 48 2.157 11.850 -2.895 1.00 0.00 H new ATOM 736 N LEU A 49 -0.174 12.454 0.440 1.00 0.00 N ATOM 737 CA LEU A 49 -1.330 12.677 -0.421 1.00 0.00 C ATOM 738 C LEU A 49 -2.606 12.811 0.404 1.00 0.00 C ATOM 739 O LEU A 49 -3.273 13.846 0.371 1.00 0.00 O ATOM 740 CB LEU A 49 -1.475 11.529 -1.422 1.00 0.00 C ATOM 741 CG LEU A 49 -2.434 11.772 -2.587 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.836 12.059 -2.073 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.938 12.917 -3.457 1.00 0.00 C ATOM 0 H LEU A 49 0.427 11.684 0.147 1.00 0.00 H new ATOM 0 HA LEU A 49 -1.172 13.608 -0.965 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.490 11.302 -1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.808 10.643 -0.882 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.470 10.869 -3.197 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.505 12.229 -2.917 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.192 11.207 -1.493 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.817 12.946 -1.440 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.633 13.075 -4.281 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.871 13.826 -2.859 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.953 12.671 -3.855 1.00 0.00 H new ATOM 755 N LEU A 50 -2.938 11.760 1.145 1.00 0.00 N ATOM 756 CA LEU A 50 -4.134 11.760 1.981 1.00 0.00 C ATOM 757 C LEU A 50 -4.082 12.891 3.004 1.00 0.00 C ATOM 758 O LEU A 50 -5.113 13.435 3.396 1.00 0.00 O ATOM 759 CB LEU A 50 -4.280 10.416 2.697 1.00 0.00 C ATOM 760 CG LEU A 50 -4.481 9.196 1.797 1.00 0.00 C ATOM 761 CD1 LEU A 50 -4.310 7.912 2.594 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.851 9.239 1.138 1.00 0.00 C ATOM 0 H LEU A 50 -2.396 10.897 1.184 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.999 11.917 1.336 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.390 10.252 3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.126 10.481 3.381 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.723 9.217 1.014 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.457 7.054 1.938 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.306 7.878 3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.045 7.883 3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -5.976 8.363 0.501 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.624 9.243 1.906 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.936 10.142 0.533 1.00 0.00 H new ATOM 774 N GLY A 51 -2.872 13.240 3.432 1.00 0.00 N ATOM 775 CA GLY A 51 -2.708 14.305 4.404 1.00 0.00 C ATOM 776 C GLY A 51 -2.801 13.806 5.832 1.00 0.00 C ATOM 777 O GLY A 51 -3.377 14.473 6.693 1.00 0.00 O ATOM 0 H GLY A 51 -2.003 12.804 3.123 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.741 14.785 4.252 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.471 15.065 4.238 1.00 0.00 H new ATOM 781 N ILE A 52 -2.235 12.631 6.084 1.00 0.00 N ATOM 782 CA ILE A 52 -2.257 12.044 7.418 1.00 0.00 C ATOM 783 C ILE A 52 -0.932 11.361 7.741 1.00 0.00 C ATOM 784 O ILE A 52 -0.208 10.906 6.855 1.00 0.00 O ATOM 785 CB ILE A 52 -3.398 11.019 7.563 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.310 9.966 6.457 1.00 0.00 C ATOM 787 CG2 ILE A 52 -4.748 11.721 7.528 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.219 8.777 6.680 1.00 0.00 C ATOM 0 H ILE A 52 -1.756 12.067 5.382 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.422 12.862 8.119 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.296 10.517 8.525 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.561 10.431 5.503 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.280 9.617 6.380 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.544 10.984 7.632 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -4.807 12.437 8.348 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.861 12.246 6.579 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.104 8.072 5.857 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -3.954 8.287 7.617 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.254 9.114 6.727 1.00 0.00 H new ATOM 800 N PRO A 53 -0.607 11.286 9.040 1.00 0.00 N ATOM 801 CA PRO A 53 0.632 10.658 9.510 1.00 0.00 C ATOM 802 C PRO A 53 0.622 9.145 9.323 1.00 0.00 C ATOM 803 O PRO A 53 -0.062 8.424 10.051 1.00 0.00 O ATOM 804 CB PRO A 53 0.667 11.013 10.998 1.00 0.00 C ATOM 805 CG PRO A 53 -0.760 11.230 11.369 1.00 0.00 C ATOM 806 CD PRO A 53 -1.422 11.807 10.149 1.00 0.00 C ATOM 0 HA PRO A 53 1.502 11.007 8.954 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.111 10.210 11.586 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.263 11.908 11.178 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.233 10.293 11.664 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.844 11.910 12.217 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.461 11.489 10.068 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.423 12.897 10.170 1.00 0.00 H new ATOM 814 N HIS A 54 1.385 8.668 8.345 1.00 0.00 N ATOM 815 CA HIS A 54 1.464 7.239 8.064 1.00 0.00 C ATOM 816 C HIS A 54 1.411 6.428 9.355 1.00 0.00 C ATOM 817 O HIS A 54 0.891 5.313 9.378 1.00 0.00 O ATOM 818 CB HIS A 54 2.749 6.919 7.299 1.00 0.00 C ATOM 819 CG HIS A 54 3.982 7.483 7.936 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.569 6.934 9.056 1.00 0.00 N ATOM 821 CD2 HIS A 54 4.740 8.554 7.602 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.634 7.644 9.385 1.00 0.00 C ATOM 823 NE2 HIS A 54 5.760 8.632 8.518 1.00 0.00 N ATOM 0 H HIS A 54 1.958 9.250 7.734 1.00 0.00 H new ATOM 0 HA HIS A 54 0.606 6.966 7.449 1.00 0.00 H new ATOM 0 HB2 HIS A 54 2.854 5.837 7.218 1.00 0.00 H new ATOM 0 HB3 HIS A 54 2.664 7.308 6.284 1.00 0.00 H new ATOM 0 HD2 HIS A 54 4.573 9.222 6.770 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.290 7.449 10.221 1.00 0.00 H new ATOM 0 HE2 HIS A 54 6.496 9.338 8.527 1.00 0.00 H new ATOM 832 N SER A 55 1.954 6.996 10.428 1.00 0.00 N ATOM 833 CA SER A 55 1.972 6.323 11.721 1.00 0.00 C ATOM 834 C SER A 55 0.646 5.616 11.985 1.00 0.00 C ATOM 835 O SER A 55 0.618 4.469 12.431 1.00 0.00 O ATOM 836 CB SER A 55 2.258 7.328 12.838 1.00 0.00 C ATOM 837 OG SER A 55 1.158 8.201 13.033 1.00 0.00 O ATOM 0 H SER A 55 2.387 7.920 10.427 1.00 0.00 H new ATOM 0 HA SER A 55 2.765 5.575 11.702 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.472 6.795 13.765 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.147 7.908 12.591 1.00 0.00 H new ATOM 0 HG SER A 55 1.365 8.833 13.753 1.00 0.00 H new ATOM 843 N VAL A 56 -0.453 6.310 11.707 1.00 0.00 N ATOM 844 CA VAL A 56 -1.784 5.750 11.912 1.00 0.00 C ATOM 845 C VAL A 56 -2.143 4.766 10.805 1.00 0.00 C ATOM 846 O VAL A 56 -2.856 3.788 11.035 1.00 0.00 O ATOM 847 CB VAL A 56 -2.855 6.855 11.969 1.00 0.00 C ATOM 848 CG1 VAL A 56 -2.738 7.646 13.263 1.00 0.00 C ATOM 849 CG2 VAL A 56 -2.738 7.773 10.761 1.00 0.00 C ATOM 0 H VAL A 56 -0.448 7.261 11.339 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.763 5.225 12.867 1.00 0.00 H new ATOM 0 HB VAL A 56 -3.838 6.385 11.946 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.503 8.422 13.285 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -2.875 6.977 14.112 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -1.752 8.107 13.320 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.502 8.548 10.818 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.751 8.236 10.750 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -2.876 7.193 9.849 1.00 0.00 H new ATOM 859 N LEU A 57 -1.644 5.030 9.602 1.00 0.00 N ATOM 860 CA LEU A 57 -1.912 4.167 8.457 1.00 0.00 C ATOM 861 C LEU A 57 -1.051 2.908 8.511 1.00 0.00 C ATOM 862 O LEU A 57 0.017 2.901 9.122 1.00 0.00 O ATOM 863 CB LEU A 57 -1.650 4.922 7.152 1.00 0.00 C ATOM 864 CG LEU A 57 -1.356 4.058 5.925 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.642 3.465 5.369 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.639 4.874 4.859 1.00 0.00 C ATOM 0 H LEU A 57 -1.052 5.834 9.395 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.960 3.870 8.494 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.519 5.544 6.934 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.807 5.595 7.308 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.704 3.239 6.228 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.413 2.853 4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.117 2.847 6.131 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.319 4.269 5.081 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.437 4.244 3.993 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.267 5.713 4.559 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.302 5.251 5.261 1.00 0.00 H new ATOM 878 N GLN A 58 -1.524 1.847 7.865 1.00 0.00 N ATOM 879 CA GLN A 58 -0.796 0.583 7.839 1.00 0.00 C ATOM 880 C GLN A 58 -1.028 -0.151 6.522 1.00 0.00 C ATOM 881 O GLN A 58 -1.783 0.312 5.667 1.00 0.00 O ATOM 882 CB GLN A 58 -1.225 -0.301 9.011 1.00 0.00 C ATOM 883 CG GLN A 58 -0.940 0.313 10.372 1.00 0.00 C ATOM 884 CD GLN A 58 0.482 0.068 10.837 1.00 0.00 C ATOM 885 OE1 GLN A 58 1.427 0.668 10.324 1.00 0.00 O ATOM 886 NE2 GLN A 58 0.642 -0.818 11.813 1.00 0.00 N ATOM 0 H GLN A 58 -2.406 1.837 7.353 1.00 0.00 H new ATOM 0 HA GLN A 58 0.268 0.803 7.929 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.293 -0.505 8.930 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.711 -1.260 8.939 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.124 1.386 10.328 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.634 -0.099 11.105 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.169 -1.292 12.209 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.576 -1.024 12.166 1.00 0.00 H new ATOM 895 N ILE A 59 -0.373 -1.296 6.366 1.00 0.00 N ATOM 896 CA ILE A 59 -0.508 -2.094 5.154 1.00 0.00 C ATOM 897 C ILE A 59 -0.703 -3.569 5.485 1.00 0.00 C ATOM 898 O ILE A 59 0.016 -4.131 6.311 1.00 0.00 O ATOM 899 CB ILE A 59 0.723 -1.943 4.240 1.00 0.00 C ATOM 900 CG1 ILE A 59 1.042 -0.464 4.018 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.486 -2.646 2.912 1.00 0.00 C ATOM 902 CD1 ILE A 59 2.275 -0.232 3.172 1.00 0.00 C ATOM 0 H ILE A 59 0.257 -1.692 7.064 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.388 -1.723 4.629 1.00 0.00 H new ATOM 0 HB ILE A 59 1.579 -2.410 4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.188 0.016 3.540 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.179 0.019 4.985 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.365 -2.530 2.277 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.303 -3.706 3.089 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.380 -2.206 2.417 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.440 0.839 3.056 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.140 -0.682 3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.134 -0.685 2.191 1.00 0.00 H new ATOM 914 N ARG A 60 -1.681 -4.192 4.835 1.00 0.00 N ATOM 915 CA ARG A 60 -1.971 -5.603 5.060 1.00 0.00 C ATOM 916 C ARG A 60 -1.700 -6.421 3.801 1.00 0.00 C ATOM 917 O ARG A 60 -2.220 -6.118 2.727 1.00 0.00 O ATOM 918 CB ARG A 60 -3.427 -5.783 5.495 1.00 0.00 C ATOM 919 CG ARG A 60 -3.929 -7.211 5.364 1.00 0.00 C ATOM 920 CD ARG A 60 -5.052 -7.500 6.347 1.00 0.00 C ATOM 921 NE ARG A 60 -5.951 -8.543 5.862 1.00 0.00 N ATOM 922 CZ ARG A 60 -6.906 -8.332 4.963 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.084 -7.120 4.454 1.00 0.00 N ATOM 924 NH2 ARG A 60 -7.683 -9.333 4.571 1.00 0.00 N ATOM 0 H ARG A 60 -2.286 -3.742 4.148 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.315 -5.961 5.853 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.530 -5.464 6.532 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -4.060 -5.128 4.896 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.282 -7.382 4.347 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.106 -7.904 5.537 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -4.627 -7.804 7.303 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.620 -6.587 6.527 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.840 -9.486 6.234 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.487 -6.349 4.753 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.818 -6.959 3.764 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -7.548 -10.266 4.960 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.416 -9.170 3.881 1.00 0.00 H new ATOM 938 N TYR A 61 -0.882 -7.459 3.941 1.00 0.00 N ATOM 939 CA TYR A 61 -0.539 -8.319 2.815 1.00 0.00 C ATOM 940 C TYR A 61 -0.776 -9.787 3.159 1.00 0.00 C ATOM 941 O TYR A 61 -0.277 -10.288 4.167 1.00 0.00 O ATOM 942 CB TYR A 61 0.920 -8.108 2.411 1.00 0.00 C ATOM 943 CG TYR A 61 1.357 -8.968 1.247 1.00 0.00 C ATOM 944 CD1 TYR A 61 0.558 -9.102 0.118 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.569 -9.647 1.275 1.00 0.00 C ATOM 946 CE1 TYR A 61 0.953 -9.888 -0.948 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.973 -10.434 0.214 1.00 0.00 C ATOM 948 CZ TYR A 61 2.161 -10.551 -0.895 1.00 0.00 C ATOM 949 OH TYR A 61 2.558 -11.334 -1.955 1.00 0.00 O ATOM 0 H TYR A 61 -0.444 -7.725 4.823 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.183 -8.052 1.977 1.00 0.00 H new ATOM 0 HB2 TYR A 61 1.069 -7.059 2.153 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.560 -8.319 3.268 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -0.388 -8.583 0.073 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.207 -9.558 2.142 1.00 0.00 H new ATOM 0 HE1 TYR A 61 0.319 -9.982 -1.817 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.919 -10.954 0.253 1.00 0.00 H new ATOM 0 HH TYR A 61 3.433 -11.730 -1.759 1.00 0.00 H new ATOM 959 N SER A 62 -1.541 -10.470 2.314 1.00 0.00 N ATOM 960 CA SER A 62 -1.847 -11.879 2.528 1.00 0.00 C ATOM 961 C SER A 62 -2.346 -12.117 3.950 1.00 0.00 C ATOM 962 O SER A 62 -2.225 -13.217 4.487 1.00 0.00 O ATOM 963 CB SER A 62 -0.610 -12.739 2.259 1.00 0.00 C ATOM 964 OG SER A 62 -0.976 -14.047 1.856 1.00 0.00 O ATOM 0 H SER A 62 -1.960 -10.070 1.475 1.00 0.00 H new ATOM 0 HA SER A 62 -2.636 -12.163 1.832 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.001 -12.273 1.484 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.004 -12.791 3.158 1.00 0.00 H new ATOM 0 HG SER A 62 -0.168 -14.576 1.689 1.00 0.00 H new ATOM 970 N GLY A 63 -2.907 -11.074 4.556 1.00 0.00 N ATOM 971 CA GLY A 63 -3.416 -11.188 5.910 1.00 0.00 C ATOM 972 C GLY A 63 -2.327 -11.031 6.953 1.00 0.00 C ATOM 973 O GLY A 63 -2.456 -11.521 8.075 1.00 0.00 O ATOM 0 H GLY A 63 -3.018 -10.153 4.133 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.182 -10.430 6.072 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.897 -12.158 6.034 1.00 0.00 H new ATOM 977 N LYS A 64 -1.251 -10.345 6.584 1.00 0.00 N ATOM 978 CA LYS A 64 -0.134 -10.124 7.495 1.00 0.00 C ATOM 979 C LYS A 64 0.164 -8.635 7.639 1.00 0.00 C ATOM 980 O LYS A 64 -0.134 -7.844 6.743 1.00 0.00 O ATOM 981 CB LYS A 64 1.112 -10.858 6.995 1.00 0.00 C ATOM 982 CG LYS A 64 1.996 -10.012 6.095 1.00 0.00 C ATOM 983 CD LYS A 64 3.009 -10.864 5.349 1.00 0.00 C ATOM 984 CE LYS A 64 2.371 -11.588 4.173 1.00 0.00 C ATOM 985 NZ LYS A 64 3.220 -12.709 3.685 1.00 0.00 N ATOM 0 H LYS A 64 -1.129 -9.932 5.659 1.00 0.00 H new ATOM 0 HA LYS A 64 -0.412 -10.517 8.473 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.695 -11.192 7.853 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.804 -11.751 6.452 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.377 -9.471 5.379 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.518 -9.265 6.694 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.823 -10.233 4.991 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.447 -11.592 6.032 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.396 -11.974 4.470 1.00 0.00 H new ATOM 0 HE3 LYS A 64 2.200 -10.881 3.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.750 -13.177 2.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 4.142 -12.338 3.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 3.362 -13.397 4.452 1.00 0.00 H new ATOM 999 N ILE A 65 0.753 -8.260 8.769 1.00 0.00 N ATOM 1000 CA ILE A 65 1.093 -6.867 9.028 1.00 0.00 C ATOM 1001 C ILE A 65 2.546 -6.580 8.668 1.00 0.00 C ATOM 1002 O ILE A 65 3.468 -7.113 9.287 1.00 0.00 O ATOM 1003 CB ILE A 65 0.858 -6.495 10.504 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.563 -6.870 10.928 1.00 0.00 C ATOM 1005 CG2 ILE A 65 1.106 -5.009 10.722 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.630 -5.991 10.312 1.00 0.00 C ATOM 0 H ILE A 65 1.005 -8.902 9.520 1.00 0.00 H new ATOM 0 HA ILE A 65 0.439 -6.261 8.401 1.00 0.00 H new ATOM 0 HB ILE A 65 1.561 -7.056 11.120 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -0.754 -7.907 10.652 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -0.637 -6.810 12.014 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.936 -4.762 11.770 1.00 0.00 H new ATOM 0 HG22 ILE A 65 2.135 -4.769 10.455 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.425 -4.431 10.098 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.612 -6.315 10.657 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.464 -4.955 10.609 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.583 -6.069 9.226 1.00 0.00 H new ATOM 1018 N LEU A 66 2.745 -5.732 7.665 1.00 0.00 N ATOM 1019 CA LEU A 66 4.088 -5.371 7.223 1.00 0.00 C ATOM 1020 C LEU A 66 4.609 -4.163 7.995 1.00 0.00 C ATOM 1021 O LEU A 66 3.833 -3.392 8.560 1.00 0.00 O ATOM 1022 CB LEU A 66 4.088 -5.071 5.723 1.00 0.00 C ATOM 1023 CG LEU A 66 3.480 -6.147 4.823 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.427 -5.669 3.380 1.00 0.00 C ATOM 1025 CD2 LEU A 66 4.274 -7.441 4.929 1.00 0.00 C ATOM 0 H LEU A 66 1.994 -5.281 7.142 1.00 0.00 H new ATOM 0 HA LEU A 66 4.748 -6.216 7.419 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.546 -4.140 5.559 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.117 -4.900 5.407 1.00 0.00 H new ATOM 0 HG LEU A 66 2.461 -6.340 5.158 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.991 -6.448 2.754 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.816 -4.769 3.317 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.436 -5.447 3.033 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.827 -8.196 4.282 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.304 -7.262 4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.260 -7.793 5.961 1.00 0.00 H new ATOM 1037 N LYS A 67 5.928 -4.002 8.012 1.00 0.00 N ATOM 1038 CA LYS A 67 6.554 -2.887 8.711 1.00 0.00 C ATOM 1039 C LYS A 67 7.281 -1.970 7.731 1.00 0.00 C ATOM 1040 O LYS A 67 7.543 -2.349 6.591 1.00 0.00 O ATOM 1041 CB LYS A 67 7.535 -3.404 9.765 1.00 0.00 C ATOM 1042 CG LYS A 67 6.875 -4.226 10.859 1.00 0.00 C ATOM 1043 CD LYS A 67 7.882 -5.108 11.578 1.00 0.00 C ATOM 1044 CE LYS A 67 7.360 -5.557 12.935 1.00 0.00 C ATOM 1045 NZ LYS A 67 6.193 -6.472 12.805 1.00 0.00 N ATOM 0 H LYS A 67 6.584 -4.631 7.549 1.00 0.00 H new ATOM 0 HA LYS A 67 5.769 -2.314 9.205 1.00 0.00 H new ATOM 0 HB2 LYS A 67 8.296 -4.011 9.274 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.048 -2.556 10.219 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.395 -3.560 11.577 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.090 -4.846 10.426 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.105 -5.982 10.965 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.817 -4.563 11.709 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.157 -6.060 13.482 1.00 0.00 H new ATOM 0 HE3 LYS A 67 7.073 -4.684 13.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 5.867 -6.755 13.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 5.423 -5.984 12.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.473 -7.317 12.268 1.00 0.00 H new ATOM 1059 N ASN A 68 7.605 -0.764 8.186 1.00 0.00 N ATOM 1060 CA ASN A 68 8.303 0.206 7.350 1.00 0.00 C ATOM 1061 C ASN A 68 9.615 -0.372 6.826 1.00 0.00 C ATOM 1062 O ASN A 68 9.798 -0.527 5.620 1.00 0.00 O ATOM 1063 CB ASN A 68 8.576 1.488 8.139 1.00 0.00 C ATOM 1064 CG ASN A 68 9.051 1.207 9.551 1.00 0.00 C ATOM 1065 OD1 ASN A 68 8.631 0.235 10.178 1.00 0.00 O ATOM 1066 ND2 ASN A 68 9.932 2.061 10.060 1.00 0.00 N ATOM 0 H ASN A 68 7.395 -0.435 9.129 1.00 0.00 H new ATOM 0 HA ASN A 68 7.664 0.441 6.499 1.00 0.00 H new ATOM 0 HB2 ASN A 68 9.328 2.080 7.617 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.667 2.089 8.177 1.00 0.00 H new ATOM 0 HD21 ASN A 68 10.287 1.924 11.006 1.00 0.00 H new ATOM 0 HD22 ASN A 68 10.253 2.854 9.505 1.00 0.00 H new ATOM 1073 N ASN A 69 10.523 -0.688 7.743 1.00 0.00 N ATOM 1074 CA ASN A 69 11.818 -1.248 7.374 1.00 0.00 C ATOM 1075 C ASN A 69 11.646 -2.523 6.554 1.00 0.00 C ATOM 1076 O ASN A 69 12.503 -2.871 5.742 1.00 0.00 O ATOM 1077 CB ASN A 69 12.646 -1.543 8.627 1.00 0.00 C ATOM 1078 CG ASN A 69 13.862 -2.399 8.329 1.00 0.00 C ATOM 1079 OD1 ASN A 69 13.741 -3.509 7.811 1.00 0.00 O ATOM 1080 ND2 ASN A 69 15.041 -1.884 8.656 1.00 0.00 N ATOM 0 H ASN A 69 10.386 -0.566 8.746 1.00 0.00 H new ATOM 0 HA ASN A 69 12.343 -0.512 6.764 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.968 -0.603 9.076 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.020 -2.049 9.362 1.00 0.00 H new ATOM 0 HD21 ASN A 69 15.895 -2.413 8.480 1.00 0.00 H new ATOM 0 HD22 ASN A 69 15.093 -0.959 9.084 1.00 0.00 H new ATOM 1087 N GLU A 70 10.531 -3.214 6.771 1.00 0.00 N ATOM 1088 CA GLU A 70 10.247 -4.450 6.052 1.00 0.00 C ATOM 1089 C GLU A 70 10.436 -4.261 4.550 1.00 0.00 C ATOM 1090 O GLU A 70 10.397 -3.139 4.043 1.00 0.00 O ATOM 1091 CB GLU A 70 8.820 -4.919 6.343 1.00 0.00 C ATOM 1092 CG GLU A 70 8.624 -6.416 6.174 1.00 0.00 C ATOM 1093 CD GLU A 70 9.288 -7.219 7.276 1.00 0.00 C ATOM 1094 OE1 GLU A 70 8.952 -6.996 8.458 1.00 0.00 O ATOM 1095 OE2 GLU A 70 10.143 -8.071 6.956 1.00 0.00 O ATOM 0 H GLU A 70 9.810 -2.939 7.438 1.00 0.00 H new ATOM 0 HA GLU A 70 10.948 -5.210 6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.556 -4.640 7.363 1.00 0.00 H new ATOM 0 HB3 GLU A 70 8.132 -4.394 5.680 1.00 0.00 H new ATOM 0 HG2 GLU A 70 7.557 -6.640 6.159 1.00 0.00 H new ATOM 0 HG3 GLU A 70 9.028 -6.725 5.210 1.00 0.00 H new ATOM 1102 N THR A 71 10.642 -5.367 3.841 1.00 0.00 N ATOM 1103 CA THR A 71 10.839 -5.325 2.398 1.00 0.00 C ATOM 1104 C THR A 71 10.072 -6.446 1.705 1.00 0.00 C ATOM 1105 O THR A 71 9.965 -7.555 2.230 1.00 0.00 O ATOM 1106 CB THR A 71 12.330 -5.435 2.031 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.123 -4.710 2.977 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.585 -4.897 0.631 1.00 0.00 C ATOM 0 H THR A 71 10.677 -6.303 4.244 1.00 0.00 H new ATOM 0 HA THR A 71 10.459 -4.363 2.055 1.00 0.00 H new ATOM 0 HB THR A 71 12.609 -6.488 2.055 1.00 0.00 H new ATOM 0 HG1 THR A 71 14.070 -4.787 2.737 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.645 -4.986 0.395 1.00 0.00 H new ATOM 0 HG22 THR A 71 12.003 -5.470 -0.091 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.289 -3.849 0.585 1.00 0.00 H new ATOM 1116 N LEU A 72 9.541 -6.151 0.523 1.00 0.00 N ATOM 1117 CA LEU A 72 8.785 -7.135 -0.243 1.00 0.00 C ATOM 1118 C LEU A 72 9.612 -8.394 -0.479 1.00 0.00 C ATOM 1119 O LEU A 72 9.101 -9.511 -0.397 1.00 0.00 O ATOM 1120 CB LEU A 72 8.346 -6.540 -1.582 1.00 0.00 C ATOM 1121 CG LEU A 72 7.181 -5.551 -1.527 1.00 0.00 C ATOM 1122 CD1 LEU A 72 5.991 -6.167 -0.807 1.00 0.00 C ATOM 1123 CD2 LEU A 72 7.609 -4.259 -0.847 1.00 0.00 C ATOM 0 H LEU A 72 9.620 -5.238 0.075 1.00 0.00 H new ATOM 0 HA LEU A 72 7.901 -7.407 0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.202 -6.037 -2.032 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.071 -7.358 -2.248 1.00 0.00 H new ATOM 0 HG LEU A 72 6.880 -5.317 -2.548 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.172 -5.449 -0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.669 -7.063 -1.337 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.278 -6.431 0.211 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.767 -3.567 -0.817 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.938 -4.475 0.170 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.429 -3.808 -1.406 1.00 0.00 H new ATOM 1135 N VAL A 73 10.896 -8.206 -0.772 1.00 0.00 N ATOM 1136 CA VAL A 73 11.796 -9.327 -1.017 1.00 0.00 C ATOM 1137 C VAL A 73 12.026 -10.135 0.255 1.00 0.00 C ATOM 1138 O VAL A 73 12.173 -11.356 0.207 1.00 0.00 O ATOM 1139 CB VAL A 73 13.154 -8.846 -1.561 1.00 0.00 C ATOM 1140 CG1 VAL A 73 12.992 -8.243 -2.947 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.786 -7.846 -0.605 1.00 0.00 C ATOM 0 H VAL A 73 11.335 -7.288 -0.845 1.00 0.00 H new ATOM 0 HA VAL A 73 11.318 -9.961 -1.764 1.00 0.00 H new ATOM 0 HB VAL A 73 13.818 -9.706 -1.642 1.00 0.00 H new ATOM 0 HG11 VAL A 73 13.962 -7.909 -3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.586 -8.994 -3.625 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.311 -7.393 -2.897 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.745 -7.516 -1.005 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.126 -6.986 -0.489 1.00 0.00 H new ATOM 0 HG23 VAL A 73 13.940 -8.318 0.365 1.00 0.00 H new ATOM 1151 N GLN A 74 12.056 -9.445 1.390 1.00 0.00 N ATOM 1152 CA GLN A 74 12.269 -10.100 2.676 1.00 0.00 C ATOM 1153 C GLN A 74 11.177 -11.129 2.950 1.00 0.00 C ATOM 1154 O GLN A 74 11.431 -12.174 3.551 1.00 0.00 O ATOM 1155 CB GLN A 74 12.303 -9.063 3.800 1.00 0.00 C ATOM 1156 CG GLN A 74 13.658 -8.394 3.970 1.00 0.00 C ATOM 1157 CD GLN A 74 14.810 -9.373 3.861 1.00 0.00 C ATOM 1158 OE1 GLN A 74 14.979 -10.247 4.711 1.00 0.00 O ATOM 1159 NE2 GLN A 74 15.610 -9.231 2.811 1.00 0.00 N ATOM 0 H GLN A 74 11.936 -8.434 1.446 1.00 0.00 H new ATOM 0 HA GLN A 74 13.228 -10.617 2.638 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.552 -8.298 3.601 1.00 0.00 H new ATOM 0 HB3 GLN A 74 12.025 -9.546 4.737 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.773 -7.618 3.214 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.696 -7.901 4.941 1.00 0.00 H new ATOM 0 HE21 GLN A 74 15.432 -8.492 2.131 1.00 0.00 H new ATOM 0 HE22 GLN A 74 16.402 -9.861 2.685 1.00 0.00 H new ATOM 1168 N HIS A 75 9.961 -10.827 2.506 1.00 0.00 N ATOM 1169 CA HIS A 75 8.830 -11.727 2.704 1.00 0.00 C ATOM 1170 C HIS A 75 8.805 -12.811 1.631 1.00 0.00 C ATOM 1171 O HIS A 75 8.263 -13.895 1.843 1.00 0.00 O ATOM 1172 CB HIS A 75 7.518 -10.942 2.684 1.00 0.00 C ATOM 1173 CG HIS A 75 7.146 -10.363 4.014 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.453 -11.068 4.975 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.376 -9.137 4.541 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.272 -10.301 6.035 1.00 0.00 C ATOM 1177 NE2 HIS A 75 6.823 -9.124 5.798 1.00 0.00 N ATOM 0 H HIS A 75 9.734 -9.967 2.007 1.00 0.00 H new ATOM 0 HA HIS A 75 8.943 -12.206 3.677 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.598 -10.135 1.955 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.716 -11.599 2.346 1.00 0.00 H new ATOM 0 HD1 HIS A 75 6.131 -12.031 4.882 1.00 0.00 H new ATOM 0 HD2 HIS A 75 7.897 -8.321 4.062 1.00 0.00 H new ATOM 0 HE1 HIS A 75 5.760 -10.588 6.942 1.00 0.00 H new ATOM 1186 N GLY A 76 9.395 -12.511 0.478 1.00 0.00 N ATOM 1187 CA GLY A 76 9.428 -13.470 -0.610 1.00 0.00 C ATOM 1188 C GLY A 76 8.718 -12.964 -1.851 1.00 0.00 C ATOM 1189 O GLY A 76 7.807 -13.614 -2.362 1.00 0.00 O ATOM 0 H GLY A 76 9.851 -11.621 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.465 -13.700 -0.856 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.964 -14.401 -0.284 1.00 0.00 H new ATOM 1193 N VAL A 77 9.135 -11.798 -2.335 1.00 0.00 N ATOM 1194 CA VAL A 77 8.533 -11.204 -3.522 1.00 0.00 C ATOM 1195 C VAL A 77 9.562 -11.033 -4.634 1.00 0.00 C ATOM 1196 O VAL A 77 10.659 -10.522 -4.406 1.00 0.00 O ATOM 1197 CB VAL A 77 7.901 -9.835 -3.207 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.291 -9.227 -4.460 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.858 -9.971 -2.108 1.00 0.00 C ATOM 0 H VAL A 77 9.887 -11.246 -1.923 1.00 0.00 H new ATOM 0 HA VAL A 77 7.752 -11.888 -3.856 1.00 0.00 H new ATOM 0 HB VAL A 77 8.685 -9.165 -2.852 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.849 -8.260 -4.218 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.067 -9.093 -5.214 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.519 -9.891 -4.848 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.421 -8.995 -1.898 1.00 0.00 H new ATOM 0 HG22 VAL A 77 6.075 -10.656 -2.432 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.329 -10.360 -1.205 1.00 0.00 H new ATOM 1209 N LYS A 78 9.202 -11.462 -5.838 1.00 0.00 N ATOM 1210 CA LYS A 78 10.093 -11.355 -6.987 1.00 0.00 C ATOM 1211 C LYS A 78 9.709 -10.168 -7.865 1.00 0.00 C ATOM 1212 O LYS A 78 8.561 -9.723 -7.882 1.00 0.00 O ATOM 1213 CB LYS A 78 10.054 -12.644 -7.811 1.00 0.00 C ATOM 1214 CG LYS A 78 10.796 -13.801 -7.164 1.00 0.00 C ATOM 1215 CD LYS A 78 9.896 -14.585 -6.224 1.00 0.00 C ATOM 1216 CE LYS A 78 10.706 -15.377 -5.208 1.00 0.00 C ATOM 1217 NZ LYS A 78 11.110 -16.709 -5.737 1.00 0.00 N ATOM 0 H LYS A 78 8.298 -11.888 -6.044 1.00 0.00 H new ATOM 0 HA LYS A 78 11.106 -11.198 -6.616 1.00 0.00 H new ATOM 0 HB2 LYS A 78 9.015 -12.933 -7.970 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.485 -12.451 -8.793 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.182 -14.465 -7.938 1.00 0.00 H new ATOM 0 HG3 LYS A 78 11.656 -13.420 -6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.227 -13.900 -5.703 1.00 0.00 H new ATOM 0 HD3 LYS A 78 9.269 -15.265 -6.801 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.596 -14.811 -4.932 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.119 -15.510 -4.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 11.660 -17.217 -5.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 10.261 -17.259 -5.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 11.692 -16.582 -6.589 1.00 0.00 H new ATOM 1231 N PRO A 79 10.690 -9.642 -8.613 1.00 0.00 N ATOM 1232 CA PRO A 79 10.478 -8.500 -9.508 1.00 0.00 C ATOM 1233 C PRO A 79 9.619 -8.862 -10.714 1.00 0.00 C ATOM 1234 O PRO A 79 9.631 -10.002 -11.176 1.00 0.00 O ATOM 1235 CB PRO A 79 11.895 -8.130 -9.952 1.00 0.00 C ATOM 1236 CG PRO A 79 12.677 -9.391 -9.815 1.00 0.00 C ATOM 1237 CD PRO A 79 12.082 -10.121 -8.643 1.00 0.00 C ATOM 0 HA PRO A 79 9.946 -7.687 -9.014 1.00 0.00 H new ATOM 0 HB2 PRO A 79 11.906 -7.767 -10.980 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.310 -7.337 -9.330 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.612 -9.991 -10.723 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.733 -9.179 -9.648 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.132 -11.202 -8.775 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.607 -9.889 -7.716 1.00 0.00 H new ATOM 1245 N GLN A 80 8.875 -7.883 -11.220 1.00 0.00 N ATOM 1246 CA GLN A 80 8.010 -8.100 -12.373 1.00 0.00 C ATOM 1247 C GLN A 80 6.898 -9.090 -12.041 1.00 0.00 C ATOM 1248 O GLN A 80 6.485 -9.880 -12.889 1.00 0.00 O ATOM 1249 CB GLN A 80 8.826 -8.611 -13.561 1.00 0.00 C ATOM 1250 CG GLN A 80 10.042 -7.755 -13.877 1.00 0.00 C ATOM 1251 CD GLN A 80 9.735 -6.648 -14.867 1.00 0.00 C ATOM 1252 OE1 GLN A 80 8.924 -6.820 -15.777 1.00 0.00 O ATOM 1253 NE2 GLN A 80 10.384 -5.503 -14.694 1.00 0.00 N ATOM 0 H GLN A 80 8.854 -6.933 -10.850 1.00 0.00 H new ATOM 0 HA GLN A 80 7.555 -7.146 -12.638 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.153 -9.630 -13.355 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.184 -8.654 -14.441 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.423 -7.317 -12.954 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.833 -8.388 -14.279 1.00 0.00 H new ATOM 0 HE21 GLN A 80 11.048 -5.404 -13.926 1.00 0.00 H new ATOM 0 HE22 GLN A 80 10.219 -4.722 -15.329 1.00 0.00 H new ATOM 1262 N GLU A 81 6.418 -9.040 -10.802 1.00 0.00 N ATOM 1263 CA GLU A 81 5.355 -9.934 -10.359 1.00 0.00 C ATOM 1264 C GLU A 81 4.085 -9.151 -10.037 1.00 0.00 C ATOM 1265 O GLU A 81 4.086 -7.920 -10.038 1.00 0.00 O ATOM 1266 CB GLU A 81 5.805 -10.727 -9.131 1.00 0.00 C ATOM 1267 CG GLU A 81 5.554 -10.007 -7.816 1.00 0.00 C ATOM 1268 CD GLU A 81 5.813 -10.889 -6.610 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.669 -11.792 -6.707 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.158 -10.674 -5.568 1.00 0.00 O ATOM 0 H GLU A 81 6.748 -8.390 -10.088 1.00 0.00 H new ATOM 0 HA GLU A 81 5.136 -10.628 -11.170 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.284 -11.685 -9.116 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.869 -10.944 -9.219 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.193 -9.126 -7.761 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.523 -9.655 -7.790 1.00 0.00 H new ATOM 1277 N ILE A 82 3.006 -9.875 -9.761 1.00 0.00 N ATOM 1278 CA ILE A 82 1.730 -9.249 -9.436 1.00 0.00 C ATOM 1279 C ILE A 82 1.248 -9.670 -8.052 1.00 0.00 C ATOM 1280 O ILE A 82 1.248 -10.855 -7.716 1.00 0.00 O ATOM 1281 CB ILE A 82 0.648 -9.603 -10.474 1.00 0.00 C ATOM 1282 CG1 ILE A 82 1.079 -9.143 -11.868 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.682 -8.973 -10.089 1.00 0.00 C ATOM 1284 CD1 ILE A 82 0.230 -9.714 -12.982 1.00 0.00 C ATOM 0 H ILE A 82 2.989 -10.895 -9.756 1.00 0.00 H new ATOM 0 HA ILE A 82 1.895 -8.172 -9.449 1.00 0.00 H new ATOM 0 HB ILE A 82 0.522 -10.686 -10.492 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.037 -8.055 -11.912 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.118 -9.429 -12.031 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.436 -9.232 -10.832 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.992 -9.345 -9.112 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.572 -7.889 -10.046 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.593 -9.345 -13.941 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.291 -10.802 -12.965 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.807 -9.407 -12.844 1.00 0.00 H new ATOM 1296 N VAL A 83 0.835 -8.692 -7.252 1.00 0.00 N ATOM 1297 CA VAL A 83 0.347 -8.961 -5.904 1.00 0.00 C ATOM 1298 C VAL A 83 -0.891 -8.128 -5.592 1.00 0.00 C ATOM 1299 O VAL A 83 -1.357 -7.355 -6.428 1.00 0.00 O ATOM 1300 CB VAL A 83 1.429 -8.669 -4.847 1.00 0.00 C ATOM 1301 CG1 VAL A 83 2.741 -9.339 -5.226 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.616 -7.169 -4.677 1.00 0.00 C ATOM 0 H VAL A 83 0.829 -7.706 -7.514 1.00 0.00 H new ATOM 0 HA VAL A 83 0.089 -10.019 -5.866 1.00 0.00 H new ATOM 0 HB VAL A 83 1.101 -9.082 -3.893 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.493 -9.121 -4.468 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.593 -10.417 -5.292 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.078 -8.959 -6.191 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.384 -6.981 -3.927 1.00 0.00 H new ATOM 0 HG22 VAL A 83 1.922 -6.730 -5.627 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.677 -6.719 -4.355 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.418 -8.292 -4.383 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.604 -7.556 -3.961 1.00 0.00 C ATOM 1314 C GLN A 84 -2.552 -7.252 -2.467 1.00 0.00 C ATOM 1315 O GLN A 84 -2.617 -8.158 -1.636 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.868 -8.352 -4.288 1.00 0.00 C ATOM 1317 CG GLN A 84 -5.155 -7.604 -3.978 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.394 -8.392 -4.356 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.467 -9.601 -4.132 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.376 -7.710 -4.933 1.00 0.00 N ATOM 0 H GLN A 84 -1.043 -8.927 -3.679 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.628 -6.612 -4.505 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.857 -8.617 -5.345 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.855 -9.285 -3.725 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -5.188 -7.371 -2.914 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.156 -6.654 -4.512 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.272 -6.709 -5.099 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.234 -8.187 -5.210 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.435 -5.971 -2.133 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.375 -5.547 -0.739 1.00 0.00 C ATOM 1331 C VAL A 85 -3.535 -4.619 -0.397 1.00 0.00 C ATOM 1332 O VAL A 85 -4.171 -4.051 -1.285 1.00 0.00 O ATOM 1333 CB VAL A 85 -1.049 -4.829 -0.427 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.129 -5.767 -0.642 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -0.907 -3.578 -1.279 1.00 0.00 C ATOM 0 H VAL A 85 -2.380 -5.209 -2.808 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.443 -6.449 -0.131 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.057 -4.528 0.621 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.058 -5.242 -0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.031 -6.631 0.016 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.143 -6.101 -1.679 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.036 -3.084 -1.045 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.921 -3.853 -2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.734 -2.900 -1.070 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.804 -4.469 0.896 1.00 0.00 N ATOM 1346 CA GLU A 86 -4.889 -3.609 1.355 1.00 0.00 C ATOM 1347 C GLU A 86 -4.354 -2.477 2.228 1.00 0.00 C ATOM 1348 O GLU A 86 -3.436 -2.675 3.026 1.00 0.00 O ATOM 1349 CB GLU A 86 -5.921 -4.425 2.136 1.00 0.00 C ATOM 1350 CG GLU A 86 -6.950 -5.110 1.252 1.00 0.00 C ATOM 1351 CD GLU A 86 -6.424 -6.388 0.628 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -5.578 -6.299 -0.286 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -6.859 -7.479 1.055 1.00 0.00 O ATOM 0 H GLU A 86 -3.286 -4.931 1.644 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.368 -3.174 0.478 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.403 -5.180 2.728 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.436 -3.768 2.837 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.838 -5.337 1.843 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.259 -4.425 0.463 1.00 0.00 H new ATOM 1360 N ILE A 87 -4.933 -1.292 2.070 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.515 -0.129 2.843 1.00 0.00 C ATOM 1362 C ILE A 87 -5.652 0.387 3.719 1.00 0.00 C ATOM 1363 O ILE A 87 -6.804 0.444 3.288 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.029 1.011 1.928 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.636 0.695 1.380 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.019 2.330 2.686 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.057 1.801 0.526 1.00 0.00 C ATOM 0 H ILE A 87 -5.693 -1.112 1.414 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.689 -0.452 3.477 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.718 1.102 1.088 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.962 0.500 2.214 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.686 -0.220 0.790 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.673 3.126 2.026 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.027 2.558 3.033 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.350 2.252 3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.069 1.508 0.172 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.710 1.981 -0.328 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.975 2.713 1.118 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.320 0.764 4.949 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.313 1.276 5.886 1.00 0.00 C ATOM 1381 C PHE A 88 -5.645 2.047 7.020 1.00 0.00 C ATOM 1382 O PHE A 88 -4.418 2.129 7.091 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.148 0.128 6.457 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.364 -0.800 7.341 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -6.145 -0.489 8.673 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -5.847 -1.984 6.839 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.424 -1.341 9.488 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.125 -2.840 7.650 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.914 -2.518 8.976 1.00 0.00 C ATOM 0 H PHE A 88 -4.371 0.725 5.320 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.969 1.958 5.344 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.980 0.542 7.026 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.577 -0.443 5.634 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.542 0.430 9.079 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.010 -2.241 5.803 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -5.259 -1.087 10.525 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -4.727 -3.759 7.247 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.351 -3.185 9.612 1.00 0.00 H new ATOM 1399 N SER A 89 -6.460 2.612 7.905 1.00 0.00 N ATOM 1400 CA SER A 89 -5.948 3.380 9.034 1.00 0.00 C ATOM 1401 C SER A 89 -6.328 2.721 10.356 1.00 0.00 C ATOM 1402 O SER A 89 -7.464 2.283 10.543 1.00 0.00 O ATOM 1403 CB SER A 89 -6.489 4.811 8.991 1.00 0.00 C ATOM 1404 OG SER A 89 -5.745 5.663 9.845 1.00 0.00 O ATOM 0 H SER A 89 -7.477 2.552 7.862 1.00 0.00 H new ATOM 0 HA SER A 89 -4.861 3.407 8.961 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.447 5.188 7.969 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.537 4.816 9.290 1.00 0.00 H new ATOM 0 HG SER A 89 -6.358 6.156 10.430 1.00 0.00 H new ATOM 1410 N THR A 90 -5.368 2.653 11.274 1.00 0.00 N ATOM 1411 CA THR A 90 -5.600 2.047 12.579 1.00 0.00 C ATOM 1412 C THR A 90 -6.597 2.862 13.395 1.00 0.00 C ATOM 1413 O THR A 90 -7.427 2.306 14.112 1.00 0.00 O ATOM 1414 CB THR A 90 -4.289 1.913 13.376 1.00 0.00 C ATOM 1415 OG1 THR A 90 -3.709 3.205 13.588 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.298 1.021 12.643 1.00 0.00 C ATOM 0 H THR A 90 -4.423 3.010 11.137 1.00 0.00 H new ATOM 0 HA THR A 90 -6.010 1.053 12.398 1.00 0.00 H new ATOM 0 HB THR A 90 -4.521 1.457 14.339 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.353 3.546 12.741 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.380 0.942 13.225 1.00 0.00 H new ATOM 0 HG22 THR A 90 -3.730 0.029 12.510 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.073 1.452 11.668 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.508 4.183 13.280 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.404 5.075 14.008 1.00 0.00 C ATOM 1426 C ASN A 91 -8.106 6.037 13.055 1.00 0.00 C ATOM 1427 O ASN A 91 -7.690 7.180 12.868 1.00 0.00 O ATOM 1428 CB ASN A 91 -6.625 5.863 15.063 1.00 0.00 C ATOM 1429 CG ASN A 91 -7.476 6.210 16.270 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -8.318 5.420 16.697 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -7.258 7.396 16.825 1.00 0.00 N ATOM 0 H ASN A 91 -5.825 4.659 12.690 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.160 4.466 14.503 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.763 5.279 15.385 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.240 6.780 14.617 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -7.799 7.685 17.640 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -6.549 8.018 16.437 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.199 5.564 12.437 1.00 0.00 N ATOM 1439 CA PRO A 92 -9.984 6.366 11.493 1.00 0.00 C ATOM 1440 C PRO A 92 -10.742 7.495 12.183 1.00 0.00 C ATOM 1441 O PRO A 92 -11.176 8.450 11.537 1.00 0.00 O ATOM 1442 CB PRO A 92 -10.962 5.353 10.895 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.092 4.293 11.933 1.00 0.00 C ATOM 1444 CD PRO A 92 -9.753 4.211 12.612 1.00 0.00 C ATOM 0 HA PRO A 92 -9.353 6.858 10.753 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.925 5.814 10.677 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.585 4.945 9.957 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.877 4.541 12.647 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.360 3.337 11.483 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -9.852 3.950 13.666 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.116 3.454 12.155 1.00 0.00 H new ATOM 1452 N ASP A 93 -10.898 7.380 13.497 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.603 8.393 14.275 1.00 0.00 C ATOM 1454 C ASP A 93 -10.766 9.662 14.400 1.00 0.00 C ATOM 1455 O ASP A 93 -11.288 10.735 14.705 1.00 0.00 O ATOM 1456 CB ASP A 93 -11.944 7.853 15.665 1.00 0.00 C ATOM 1457 CG ASP A 93 -13.106 6.879 15.638 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -12.864 5.673 15.421 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -14.257 7.322 15.834 1.00 0.00 O ATOM 0 H ASP A 93 -10.546 6.596 14.046 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.527 8.639 13.752 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.068 7.358 16.084 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -12.186 8.685 16.326 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.465 9.532 14.165 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.555 10.668 14.252 1.00 0.00 C ATOM 1466 C LEU A 94 -7.993 11.023 12.879 1.00 0.00 C ATOM 1467 O LEU A 94 -7.917 12.196 12.512 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.411 10.357 15.219 1.00 0.00 C ATOM 1469 CG LEU A 94 -7.706 10.580 16.703 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -6.563 10.058 17.559 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -7.953 12.055 16.982 1.00 0.00 C ATOM 0 H LEU A 94 -9.017 8.651 13.913 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.117 11.524 14.626 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.117 9.317 15.080 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.553 10.970 14.944 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.608 10.026 16.961 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.791 10.225 18.612 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.433 8.990 17.381 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.644 10.583 17.299 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.161 12.195 18.043 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.069 12.630 16.707 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.806 12.398 16.397 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.602 10.003 12.124 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.048 10.206 10.791 1.00 0.00 C ATOM 1485 C TYR A 95 -7.661 9.232 9.791 1.00 0.00 C ATOM 1486 O TYR A 95 -7.092 8.187 9.473 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.527 10.038 10.817 1.00 0.00 C ATOM 1488 CG TYR A 95 -4.847 10.847 11.898 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -4.804 10.394 13.211 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.246 12.065 11.606 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.185 11.130 14.201 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.622 12.808 12.590 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.595 12.337 13.886 1.00 0.00 C ATOM 1494 OH TYR A 95 -2.975 13.073 14.870 1.00 0.00 O ATOM 0 H TYR A 95 -7.658 9.026 12.413 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.290 11.221 10.476 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.289 8.984 10.960 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.121 10.328 9.848 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.263 9.449 13.461 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.267 12.438 10.593 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.163 10.763 15.217 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.158 13.752 12.346 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.610 13.896 14.482 1.00 0.00 H new ATOM 1504 N PRO A 96 -8.852 9.581 9.280 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.569 8.752 8.307 1.00 0.00 C ATOM 1506 C PRO A 96 -8.882 8.730 6.946 1.00 0.00 C ATOM 1507 O PRO A 96 -8.073 9.603 6.634 1.00 0.00 O ATOM 1508 CB PRO A 96 -10.938 9.431 8.204 1.00 0.00 C ATOM 1509 CG PRO A 96 -10.687 10.848 8.588 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.588 10.812 9.613 1.00 0.00 C ATOM 0 HA PRO A 96 -9.617 7.708 8.618 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.340 9.360 7.193 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.663 8.963 8.869 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.393 11.441 7.722 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.587 11.307 8.997 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -8.949 11.693 9.548 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.985 10.781 10.627 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.211 7.726 6.139 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.626 7.591 4.810 1.00 0.00 C ATOM 1520 C VAL A 97 -9.639 7.944 3.726 1.00 0.00 C ATOM 1521 O VAL A 97 -10.824 7.633 3.845 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.108 6.161 4.567 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.243 6.111 3.317 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -7.337 5.661 5.780 1.00 0.00 C ATOM 0 H VAL A 97 -9.879 6.995 6.382 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.788 8.286 4.761 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.964 5.504 4.413 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -6.886 5.093 3.162 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.831 6.425 2.455 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.391 6.780 3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -6.978 4.649 5.591 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.488 6.318 5.968 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.992 5.657 6.651 1.00 0.00 H new ATOM 1534 N ARG A 98 -9.163 8.594 2.669 1.00 0.00 N ATOM 1535 CA ARG A 98 -10.027 8.990 1.563 1.00 0.00 C ATOM 1536 C ARG A 98 -9.433 8.555 0.227 1.00 0.00 C ATOM 1537 O ARG A 98 -8.231 8.310 0.121 1.00 0.00 O ATOM 1538 CB ARG A 98 -10.238 10.505 1.571 1.00 0.00 C ATOM 1539 CG ARG A 98 -11.151 10.987 2.687 1.00 0.00 C ATOM 1540 CD ARG A 98 -11.762 12.341 2.361 1.00 0.00 C ATOM 1541 NE ARG A 98 -12.762 12.249 1.302 1.00 0.00 N ATOM 1542 CZ ARG A 98 -13.108 13.271 0.527 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -12.536 14.456 0.693 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -14.027 13.109 -0.416 1.00 0.00 N ATOM 0 H ARG A 98 -8.184 8.858 2.555 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.990 8.495 1.691 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -9.270 10.998 1.666 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.658 10.810 0.612 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -11.945 10.258 2.850 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -10.586 11.056 3.617 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -12.221 12.757 3.258 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -10.974 13.030 2.057 1.00 0.00 H new ATOM 0 HE ARG A 98 -13.220 11.351 1.149 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -11.829 14.584 1.417 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -12.803 15.239 0.097 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -14.469 12.199 -0.547 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -14.292 13.894 -1.010 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.283 8.461 -0.790 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.843 8.054 -2.119 1.00 0.00 C ATOM 1560 C ARG A 99 -8.717 8.955 -2.618 1.00 0.00 C ATOM 1561 O ARG A 99 -8.232 9.821 -1.889 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.015 8.092 -3.102 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.858 9.352 -2.995 1.00 0.00 C ATOM 1564 CD ARG A 99 -11.010 10.605 -3.153 1.00 0.00 C ATOM 1565 NE ARG A 99 -11.797 11.742 -3.623 1.00 0.00 N ATOM 1566 CZ ARG A 99 -11.285 12.947 -3.847 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -9.993 13.171 -3.646 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -12.065 13.932 -4.274 1.00 0.00 N ATOM 0 H ARG A 99 -11.281 8.661 -0.719 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.467 7.033 -2.053 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -10.629 8.008 -4.118 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.651 7.224 -2.930 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -12.634 9.338 -3.760 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -12.363 9.372 -2.029 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.549 10.854 -2.197 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.201 10.409 -3.856 1.00 0.00 H new ATOM 0 HE ARG A 99 -12.794 11.603 -3.788 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -9.390 12.417 -3.318 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -9.603 14.098 -3.819 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -13.059 13.764 -4.431 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.671 14.857 -4.446 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.306 8.744 -3.864 1.00 0.00 N ATOM 1583 CA ILE A 100 -7.238 9.538 -4.460 1.00 0.00 C ATOM 1584 C ILE A 100 -7.677 10.139 -5.791 1.00 0.00 C ATOM 1585 O ILE A 100 -8.212 9.442 -6.653 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.969 8.694 -4.685 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.523 8.045 -3.373 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.856 9.557 -5.261 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.982 9.032 -2.363 1.00 0.00 C ATOM 0 H ILE A 100 -8.696 8.031 -4.480 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.012 10.341 -3.758 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.197 7.904 -5.400 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -6.368 7.515 -2.934 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.756 7.300 -3.588 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.966 8.947 -5.415 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.177 9.977 -6.214 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -4.627 10.366 -4.567 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -4.686 8.501 -1.458 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.117 9.545 -2.783 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -5.753 9.762 -2.119 1.00 0.00 H new ATOM 1601 N ASP A 101 -7.446 11.438 -5.951 1.00 0.00 N ATOM 1602 CA ASP A 101 -7.815 12.134 -7.179 1.00 0.00 C ATOM 1603 C ASP A 101 -7.538 11.264 -8.401 1.00 0.00 C ATOM 1604 O ASP A 101 -6.456 10.695 -8.538 1.00 0.00 O ATOM 1605 CB ASP A 101 -7.050 13.453 -7.292 1.00 0.00 C ATOM 1606 CG ASP A 101 -7.411 14.428 -6.189 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -7.774 13.969 -5.086 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -7.330 15.651 -6.429 1.00 0.00 O ATOM 0 H ASP A 101 -7.005 12.030 -5.247 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.884 12.345 -7.141 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -5.979 13.252 -7.259 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -7.260 13.909 -8.259 1.00 0.00 H new ATOM 1613 N GLY A 102 -8.525 11.166 -9.287 1.00 0.00 N ATOM 1614 CA GLY A 102 -8.368 10.363 -10.486 1.00 0.00 C ATOM 1615 C GLY A 102 -9.117 10.938 -11.671 1.00 0.00 C ATOM 1616 O GLY A 102 -8.655 11.886 -12.307 1.00 0.00 O ATOM 0 H GLY A 102 -9.430 11.628 -9.196 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.309 10.286 -10.732 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -8.724 9.351 -10.291 1.00 0.00 H new ATOM 1620 N LEU A 103 -10.277 10.363 -11.971 1.00 0.00 N ATOM 1621 CA LEU A 103 -11.093 10.824 -13.089 1.00 0.00 C ATOM 1622 C LEU A 103 -11.630 12.228 -12.830 1.00 0.00 C ATOM 1623 O LEU A 103 -11.939 12.586 -11.693 1.00 0.00 O ATOM 1624 CB LEU A 103 -12.254 9.857 -13.331 1.00 0.00 C ATOM 1625 CG LEU A 103 -11.946 8.646 -14.212 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -11.495 9.092 -15.594 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -10.887 7.768 -13.561 1.00 0.00 C ATOM 0 H LEU A 103 -10.673 9.577 -11.456 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.463 10.855 -13.978 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -12.609 9.498 -12.365 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -13.075 10.412 -13.785 1.00 0.00 H new ATOM 0 HG LEU A 103 -12.858 8.060 -14.322 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -11.280 8.217 -16.207 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -12.285 9.678 -16.063 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.596 9.701 -15.504 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -10.681 6.911 -14.202 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -9.973 8.344 -13.420 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -11.248 7.419 -12.594 1.00 0.00 H new ATOM 1639 N THR A 104 -11.741 13.019 -13.893 1.00 0.00 N ATOM 1640 CA THR A 104 -12.243 14.383 -13.781 1.00 0.00 C ATOM 1641 C THR A 104 -13.160 14.729 -14.948 1.00 0.00 C ATOM 1642 O THR A 104 -12.923 14.310 -16.082 1.00 0.00 O ATOM 1643 CB THR A 104 -11.089 15.402 -13.729 1.00 0.00 C ATOM 1644 OG1 THR A 104 -11.607 16.715 -13.488 1.00 0.00 O ATOM 1645 CG2 THR A 104 -10.301 15.394 -15.030 1.00 0.00 C ATOM 0 H THR A 104 -11.490 12.738 -14.841 1.00 0.00 H new ATOM 0 HA THR A 104 -12.809 14.437 -12.851 1.00 0.00 H new ATOM 0 HB THR A 104 -10.420 15.120 -12.916 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.868 17.357 -13.454 1.00 0.00 H new ATOM 0 HG21 THR A 104 -9.492 16.121 -14.970 1.00 0.00 H new ATOM 0 HG22 THR A 104 -9.884 14.401 -15.197 1.00 0.00 H new ATOM 0 HG23 THR A 104 -10.962 15.654 -15.857 1.00 0.00 H new ATOM 1653 N ASP A 105 -14.206 15.496 -14.665 1.00 0.00 N ATOM 1654 CA ASP A 105 -15.159 15.900 -15.692 1.00 0.00 C ATOM 1655 C ASP A 105 -14.441 16.242 -16.994 1.00 0.00 C ATOM 1656 O ASP A 105 -13.265 16.606 -16.990 1.00 0.00 O ATOM 1657 CB ASP A 105 -15.976 17.102 -15.216 1.00 0.00 C ATOM 1658 CG ASP A 105 -17.342 17.169 -15.871 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -17.872 16.104 -16.248 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -17.881 18.288 -16.007 1.00 0.00 O ATOM 0 H ASP A 105 -14.416 15.851 -13.732 1.00 0.00 H new ATOM 0 HA ASP A 105 -15.832 15.063 -15.877 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -16.097 17.050 -14.134 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -15.427 18.019 -15.432 1.00 0.00 H new ATOM 1665 N VAL A 106 -15.157 16.120 -18.108 1.00 0.00 N ATOM 1666 CA VAL A 106 -14.588 16.415 -19.418 1.00 0.00 C ATOM 1667 C VAL A 106 -13.580 17.556 -19.335 1.00 0.00 C ATOM 1668 O VAL A 106 -13.846 18.590 -18.724 1.00 0.00 O ATOM 1669 CB VAL A 106 -15.684 16.787 -20.434 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -16.418 15.541 -20.908 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -16.655 17.789 -19.828 1.00 0.00 C ATOM 0 H VAL A 106 -16.131 15.819 -18.129 1.00 0.00 H new ATOM 0 HA VAL A 106 -14.082 15.510 -19.755 1.00 0.00 H new ATOM 0 HB VAL A 106 -15.210 17.252 -21.299 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -17.189 15.823 -21.625 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -15.711 14.861 -21.384 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -16.881 15.045 -20.055 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -17.422 18.040 -20.560 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -17.124 17.353 -18.946 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -16.115 18.692 -19.543 1.00 0.00 H new ATOM 1681 N SER A 107 -12.420 17.359 -19.954 1.00 0.00 N ATOM 1682 CA SER A 107 -11.369 18.370 -19.948 1.00 0.00 C ATOM 1683 C SER A 107 -10.705 18.472 -21.317 1.00 0.00 C ATOM 1684 O SER A 107 -10.592 17.481 -22.039 1.00 0.00 O ATOM 1685 CB SER A 107 -10.321 18.040 -18.883 1.00 0.00 C ATOM 1686 OG SER A 107 -9.499 19.162 -18.612 1.00 0.00 O ATOM 0 H SER A 107 -12.184 16.509 -20.466 1.00 0.00 H new ATOM 0 HA SER A 107 -11.825 19.332 -19.713 1.00 0.00 H new ATOM 0 HB2 SER A 107 -10.817 17.719 -17.967 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.705 17.207 -19.221 1.00 0.00 H new ATOM 0 HG SER A 107 -8.839 18.926 -17.927 1.00 0.00 H new ATOM 1692 N GLN A 108 -10.267 19.677 -21.668 1.00 0.00 N ATOM 1693 CA GLN A 108 -9.614 19.908 -22.951 1.00 0.00 C ATOM 1694 C GLN A 108 -8.239 20.538 -22.756 1.00 0.00 C ATOM 1695 O GLN A 108 -7.954 21.119 -21.708 1.00 0.00 O ATOM 1696 CB GLN A 108 -10.480 20.810 -23.832 1.00 0.00 C ATOM 1697 CG GLN A 108 -10.288 20.571 -25.321 1.00 0.00 C ATOM 1698 CD GLN A 108 -10.836 19.231 -25.773 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -10.268 18.181 -25.470 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -11.947 19.260 -26.501 1.00 0.00 N ATOM 0 H GLN A 108 -10.352 20.508 -21.082 1.00 0.00 H new ATOM 0 HA GLN A 108 -9.486 18.944 -23.444 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.529 20.652 -23.579 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.251 21.852 -23.607 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -10.780 21.367 -25.879 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -9.226 20.624 -25.560 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -12.384 20.153 -26.729 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -12.363 18.389 -26.832 1.00 0.00 H new ATOM 1709 N ILE A 109 -7.389 20.418 -23.771 1.00 0.00 N ATOM 1710 CA ILE A 109 -6.044 20.976 -23.711 1.00 0.00 C ATOM 1711 C ILE A 109 -5.875 22.113 -24.713 1.00 0.00 C ATOM 1712 O ILE A 109 -6.644 22.231 -25.668 1.00 0.00 O ATOM 1713 CB ILE A 109 -4.976 19.901 -23.985 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -5.153 19.322 -25.391 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -5.052 18.799 -22.939 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -3.864 18.824 -26.006 1.00 0.00 C ATOM 0 H ILE A 109 -7.608 19.939 -24.645 1.00 0.00 H new ATOM 0 HA ILE A 109 -5.907 21.363 -22.701 1.00 0.00 H new ATOM 0 HB ILE A 109 -3.991 20.365 -23.924 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -5.868 18.500 -25.349 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -5.584 20.086 -26.038 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -4.291 18.047 -23.147 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -4.882 19.224 -21.950 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -6.038 18.335 -22.970 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -4.065 18.428 -27.001 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -3.154 19.648 -26.080 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -3.443 18.037 -25.380 1.00 0.00 H new ATOM 1728 N ILE A 110 -4.864 22.945 -24.491 1.00 0.00 N ATOM 1729 CA ILE A 110 -4.592 24.070 -25.376 1.00 0.00 C ATOM 1730 C ILE A 110 -3.275 24.748 -25.016 1.00 0.00 C ATOM 1731 O ILE A 110 -2.915 24.846 -23.842 1.00 0.00 O ATOM 1732 CB ILE A 110 -5.724 25.113 -25.325 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -5.614 26.077 -26.508 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -5.683 25.875 -24.009 1.00 0.00 C ATOM 1735 CD1 ILE A 110 -6.026 25.462 -27.828 1.00 0.00 C ATOM 0 H ILE A 110 -4.219 22.861 -23.705 1.00 0.00 H new ATOM 0 HA ILE A 110 -4.525 23.667 -26.386 1.00 0.00 H new ATOM 0 HB ILE A 110 -6.680 24.593 -25.392 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -6.236 26.951 -26.313 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -4.585 26.429 -26.585 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -6.489 26.608 -23.988 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -5.806 25.177 -23.181 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -4.725 26.386 -23.914 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -5.923 26.202 -28.622 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -5.388 24.605 -28.045 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -7.064 25.135 -27.769 1.00 0.00 H new ATOM 1747 N THR A 111 -2.559 25.217 -26.033 1.00 0.00 N ATOM 1748 CA THR A 111 -1.282 25.887 -25.824 1.00 0.00 C ATOM 1749 C THR A 111 -1.451 27.402 -25.811 1.00 0.00 C ATOM 1750 O THR A 111 -2.316 27.946 -26.498 1.00 0.00 O ATOM 1751 CB THR A 111 -0.262 25.505 -26.914 1.00 0.00 C ATOM 1752 OG1 THR A 111 -0.295 24.092 -27.142 1.00 0.00 O ATOM 1753 CG2 THR A 111 1.143 25.926 -26.511 1.00 0.00 C ATOM 0 H THR A 111 -2.842 25.145 -27.010 1.00 0.00 H new ATOM 0 HA THR A 111 -0.908 25.558 -24.855 1.00 0.00 H new ATOM 0 HB THR A 111 -0.532 26.027 -27.832 1.00 0.00 H new ATOM 0 HG1 THR A 111 0.355 23.858 -27.837 1.00 0.00 H new ATOM 0 HG21 THR A 111 1.846 25.646 -27.296 1.00 0.00 H new ATOM 0 HG22 THR A 111 1.172 27.006 -26.366 1.00 0.00 H new ATOM 0 HG23 THR A 111 1.420 25.428 -25.582 1.00 0.00 H new ATOM 1761 N VAL A 112 -0.618 28.079 -25.027 1.00 0.00 N ATOM 1762 CA VAL A 112 -0.675 29.533 -24.926 1.00 0.00 C ATOM 1763 C VAL A 112 0.420 30.184 -25.764 1.00 0.00 C ATOM 1764 O VAL A 112 1.563 29.730 -25.771 1.00 0.00 O ATOM 1765 CB VAL A 112 -0.535 30.000 -23.465 1.00 0.00 C ATOM 1766 CG1 VAL A 112 0.732 29.433 -22.842 1.00 0.00 C ATOM 1767 CG2 VAL A 112 -0.542 31.519 -23.389 1.00 0.00 C ATOM 0 H VAL A 112 0.104 27.644 -24.453 1.00 0.00 H new ATOM 0 HA VAL A 112 -1.650 29.840 -25.305 1.00 0.00 H new ATOM 0 HB VAL A 112 -1.388 29.626 -22.899 1.00 0.00 H new ATOM 0 HG11 VAL A 112 0.814 29.774 -21.810 1.00 0.00 H new ATOM 0 HG12 VAL A 112 0.692 28.344 -22.862 1.00 0.00 H new ATOM 0 HG13 VAL A 112 1.599 29.775 -23.407 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -0.442 31.832 -22.350 1.00 0.00 H new ATOM 0 HG22 VAL A 112 0.291 31.916 -23.969 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -1.480 31.899 -23.794 1.00 0.00 H new ATOM 1777 N SER A 113 0.061 31.253 -26.468 1.00 0.00 N ATOM 1778 CA SER A 113 1.012 31.967 -27.312 1.00 0.00 C ATOM 1779 C SER A 113 1.775 33.013 -26.507 1.00 0.00 C ATOM 1780 O SER A 113 1.539 33.187 -25.312 1.00 0.00 O ATOM 1781 CB SER A 113 0.286 32.636 -28.481 1.00 0.00 C ATOM 1782 OG SER A 113 -0.570 33.669 -28.026 1.00 0.00 O ATOM 0 H SER A 113 -0.881 31.644 -26.471 1.00 0.00 H new ATOM 0 HA SER A 113 1.727 31.243 -27.703 1.00 0.00 H new ATOM 0 HB2 SER A 113 1.016 33.045 -29.180 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.295 31.892 -29.026 1.00 0.00 H new ATOM 0 HG SER A 113 -1.021 34.082 -28.792 1.00 0.00 H new ATOM 1788 N GLY A 114 2.693 33.709 -27.171 1.00 0.00 N ATOM 1789 CA GLY A 114 3.478 34.730 -26.502 1.00 0.00 C ATOM 1790 C GLY A 114 3.288 36.103 -27.116 1.00 0.00 C ATOM 1791 O GLY A 114 3.092 36.244 -28.324 1.00 0.00 O ATOM 0 H GLY A 114 2.907 33.584 -28.160 1.00 0.00 H new ATOM 0 HA2 GLY A 114 3.201 34.765 -25.448 1.00 0.00 H new ATOM 0 HA3 GLY A 114 4.533 34.459 -26.545 1.00 0.00 H new ATOM 1795 N PRO A 115 3.343 37.145 -26.274 1.00 0.00 N ATOM 1796 CA PRO A 115 3.177 38.532 -26.719 1.00 0.00 C ATOM 1797 C PRO A 115 4.357 39.018 -27.554 1.00 0.00 C ATOM 1798 O PRO A 115 5.235 38.237 -27.920 1.00 0.00 O ATOM 1799 CB PRO A 115 3.091 39.317 -25.408 1.00 0.00 C ATOM 1800 CG PRO A 115 3.816 38.477 -24.414 1.00 0.00 C ATOM 1801 CD PRO A 115 3.573 37.050 -24.823 1.00 0.00 C ATOM 0 HA PRO A 115 2.305 38.652 -27.362 1.00 0.00 H new ATOM 0 HB2 PRO A 115 3.551 40.301 -25.505 1.00 0.00 H new ATOM 0 HB3 PRO A 115 2.055 39.477 -25.110 1.00 0.00 H new ATOM 0 HG2 PRO A 115 4.882 38.707 -24.412 1.00 0.00 H new ATOM 0 HG3 PRO A 115 3.448 38.662 -23.405 1.00 0.00 H new ATOM 0 HD2 PRO A 115 4.428 36.415 -24.593 1.00 0.00 H new ATOM 0 HD3 PRO A 115 2.712 36.625 -24.307 1.00 0.00 H new ATOM 1809 N SER A 116 4.371 40.314 -27.852 1.00 0.00 N ATOM 1810 CA SER A 116 5.442 40.903 -28.647 1.00 0.00 C ATOM 1811 C SER A 116 5.544 42.404 -28.393 1.00 0.00 C ATOM 1812 O SER A 116 4.756 42.972 -27.636 1.00 0.00 O ATOM 1813 CB SER A 116 5.204 40.642 -30.135 1.00 0.00 C ATOM 1814 OG SER A 116 6.343 40.992 -30.903 1.00 0.00 O ATOM 0 H SER A 116 3.653 40.975 -27.555 1.00 0.00 H new ATOM 0 HA SER A 116 6.381 40.436 -28.349 1.00 0.00 H new ATOM 0 HB2 SER A 116 4.967 39.589 -30.289 1.00 0.00 H new ATOM 0 HB3 SER A 116 4.342 41.216 -30.475 1.00 0.00 H new ATOM 0 HG SER A 116 6.166 40.814 -31.850 1.00 0.00 H new ATOM 1820 N SER A 117 6.520 43.041 -29.031 1.00 0.00 N ATOM 1821 CA SER A 117 6.729 44.476 -28.872 1.00 0.00 C ATOM 1822 C SER A 117 7.049 45.130 -30.213 1.00 0.00 C ATOM 1823 O SER A 117 7.606 44.496 -31.108 1.00 0.00 O ATOM 1824 CB SER A 117 7.862 44.741 -27.879 1.00 0.00 C ATOM 1825 OG SER A 117 7.903 46.107 -27.505 1.00 0.00 O ATOM 0 H SER A 117 7.179 42.586 -29.663 1.00 0.00 H new ATOM 0 HA SER A 117 5.808 44.912 -28.485 1.00 0.00 H new ATOM 0 HB2 SER A 117 7.725 44.122 -26.992 1.00 0.00 H new ATOM 0 HB3 SER A 117 8.815 44.454 -28.324 1.00 0.00 H new ATOM 0 HG SER A 117 8.634 46.250 -26.869 1.00 0.00 H new ATOM 1831 N GLY A 118 6.693 46.404 -30.342 1.00 0.00 N ATOM 1832 CA GLY A 118 6.950 47.124 -31.576 1.00 0.00 C ATOM 1833 C GLY A 118 6.976 48.627 -31.376 1.00 0.00 C ATOM 1834 O GLY A 118 6.375 49.373 -32.149 1.00 0.00 O ATOM 0 H GLY A 118 6.232 46.950 -29.615 1.00 0.00 H new ATOM 0 HA2 GLY A 118 7.904 46.799 -31.991 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.182 46.871 -32.307 1.00 0.00 H new TER 1838 GLY A 118