USER MOD reduce.3.24.130724 H: found=0, std=0, add=908, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 908 hydrogens (12 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 55 SER OG : rot 14:sc= 0.768 USER MOD Set 1.2: A 99 CYS SG : rot 180:sc= 0.198 USER MOD Single : A 1 ATP O2' : rot 27:sc= 0.485 USER MOD Single : A 1 ATP O3' : rot -77:sc= 1.53 USER MOD Single : A 25 SER OG : rot 24:sc= 0.218 USER MOD Single : A 29 GLN : amide:sc= -0.11 K(o=-0.11,f=-1.9!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -2.74! C(o=-2.7!,f=-3.4!) USER MOD Single : A 35 SER OG : rot 180:sc= 0.137 USER MOD Single : A 42 HIS :FLIP no HD1:sc= -0.824 F(o=-2.4!,f=-0.82) USER MOD Single : A 43 ASN : amide:sc=-0.00246 K(o=-0.0025,f=-1.9!) USER MOD Single : A 47 SER OG : rot 180:sc= 0.00405 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= -0.415 K(o=-0.42,f=-3.5!) USER MOD Single : A 64 SER OG : rot -149:sc= -1.19! USER MOD Single : A 68 THR OG1 : rot 73:sc= 0.337 USER MOD Single : A 75 SER OG : rot 160:sc= -0.376 USER MOD Single : A 85 LYS NZ :NH3+ -146:sc= -5.85! (180deg=-7.36!) USER MOD Single : A 88 GLN : amide:sc= -0.053 K(o=-0.053,f=-1.9!) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 141:sc= -0.486 USER MOD Single : A 100 HIS : no HE2:sc= 0.388 K(o=0.39,f=-4.5!) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 GLN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD Single : A 107 GLN : amide:sc= -0.494 K(o=-0.49,f=-2) USER MOD Single : A 109 GLN : amide:sc= -0.318 K(o=-0.32,f=-2) USER MOD Single : A 112 THR OG1 : rot -160:sc= -0.0195 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.703! C(o=-0.7!,f=-5.8!) USER MOD Single : A 120 SER OG : rot -90:sc= -1.41 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot -76:sc= 0.888 USER MOD Single : A 137 GLN :FLIP amide:sc= -5.56! C(o=-11!,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 14.999 -30.886 -26.752 1.00 0.00 N ATOM 2 CA GLY A 17 15.471 -31.314 -28.099 1.00 0.00 C ATOM 3 C GLY A 17 15.969 -30.094 -28.876 1.00 0.00 C ATOM 4 O GLY A 17 17.042 -30.106 -29.447 1.00 0.00 O ATOM 0 HA2 GLY A 17 16.272 -32.047 -28.000 1.00 0.00 H new ATOM 0 HA3 GLY A 17 14.661 -31.799 -28.643 1.00 0.00 H new ATOM 10 N ALA A 18 15.199 -29.041 -28.904 1.00 0.00 N ATOM 11 CA ALA A 18 15.629 -27.823 -29.645 1.00 0.00 C ATOM 12 C ALA A 18 16.728 -27.108 -28.842 1.00 0.00 C ATOM 13 O ALA A 18 16.783 -27.219 -27.634 1.00 0.00 O ATOM 14 CB ALA A 18 14.424 -26.891 -29.822 1.00 0.00 C ATOM 0 H ALA A 18 14.291 -28.972 -28.445 1.00 0.00 H new ATOM 0 HA ALA A 18 16.019 -28.099 -30.625 1.00 0.00 H new ATOM 0 HB1 ALA A 18 14.732 -25.997 -30.364 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.645 -27.406 -30.384 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.037 -26.607 -28.843 1.00 0.00 H new ATOM 20 N PRO A 19 17.598 -26.378 -29.501 1.00 0.00 N ATOM 21 CA PRO A 19 18.703 -25.641 -28.817 1.00 0.00 C ATOM 22 C PRO A 19 18.186 -24.419 -28.046 1.00 0.00 C ATOM 23 O PRO A 19 17.012 -24.309 -27.754 1.00 0.00 O ATOM 24 CB PRO A 19 19.617 -25.214 -29.974 1.00 0.00 C ATOM 25 CG PRO A 19 18.704 -25.090 -31.150 1.00 0.00 C ATOM 26 CD PRO A 19 17.632 -26.169 -30.963 1.00 0.00 C ATOM 0 HA PRO A 19 19.209 -26.253 -28.070 1.00 0.00 H new ATOM 0 HB2 PRO A 19 20.115 -24.269 -29.758 1.00 0.00 H new ATOM 0 HB3 PRO A 19 20.398 -25.952 -30.155 1.00 0.00 H new ATOM 0 HG2 PRO A 19 18.256 -24.097 -31.194 1.00 0.00 H new ATOM 0 HG3 PRO A 19 19.247 -25.236 -32.084 1.00 0.00 H new ATOM 0 HD2 PRO A 19 16.664 -25.842 -31.344 1.00 0.00 H new ATOM 0 HD3 PRO A 19 17.890 -27.086 -31.493 1.00 0.00 H new ATOM 34 N GLU A 20 19.056 -23.503 -27.714 1.00 0.00 N ATOM 35 CA GLU A 20 18.619 -22.289 -26.963 1.00 0.00 C ATOM 36 C GLU A 20 19.572 -21.132 -27.270 1.00 0.00 C ATOM 37 O GLU A 20 20.727 -21.335 -27.589 1.00 0.00 O ATOM 38 CB GLU A 20 18.644 -22.581 -25.460 1.00 0.00 C ATOM 39 CG GLU A 20 17.582 -23.631 -25.122 1.00 0.00 C ATOM 40 CD GLU A 20 17.360 -23.662 -23.608 1.00 0.00 C ATOM 41 OE1 GLU A 20 18.165 -24.273 -22.924 1.00 0.00 O ATOM 42 OE2 GLU A 20 16.390 -23.075 -23.160 1.00 0.00 O ATOM 0 H GLU A 20 20.052 -23.543 -27.931 1.00 0.00 H new ATOM 0 HA GLU A 20 17.607 -22.020 -27.265 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.630 -22.939 -25.165 1.00 0.00 H new ATOM 0 HB3 GLU A 20 18.456 -21.666 -24.898 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.648 -23.397 -25.633 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.900 -24.612 -25.474 1.00 0.00 H new ATOM 49 N GLY A 21 19.099 -19.920 -27.177 1.00 0.00 N ATOM 50 CA GLY A 21 19.978 -18.752 -27.464 1.00 0.00 C ATOM 51 C GLY A 21 21.286 -18.894 -26.681 1.00 0.00 C ATOM 52 O GLY A 21 21.419 -19.752 -25.831 1.00 0.00 O ATOM 0 H GLY A 21 18.141 -19.688 -26.914 1.00 0.00 H new ATOM 0 HA2 GLY A 21 20.186 -18.693 -28.532 1.00 0.00 H new ATOM 0 HA3 GLY A 21 19.474 -17.827 -27.186 1.00 0.00 H new ATOM 56 N PRO A 22 22.246 -18.054 -26.969 1.00 0.00 N ATOM 57 CA PRO A 22 23.572 -18.077 -26.286 1.00 0.00 C ATOM 58 C PRO A 22 23.498 -17.496 -24.868 1.00 0.00 C ATOM 59 O PRO A 22 23.505 -16.296 -24.677 1.00 0.00 O ATOM 60 CB PRO A 22 24.450 -17.205 -27.193 1.00 0.00 C ATOM 61 CG PRO A 22 23.499 -16.233 -27.816 1.00 0.00 C ATOM 62 CD PRO A 22 22.172 -16.985 -27.982 1.00 0.00 C ATOM 0 HA PRO A 22 23.956 -19.089 -26.155 1.00 0.00 H new ATOM 0 HB2 PRO A 22 25.224 -16.692 -26.622 1.00 0.00 H new ATOM 0 HB3 PRO A 22 24.957 -17.804 -27.949 1.00 0.00 H new ATOM 0 HG2 PRO A 22 23.372 -15.353 -27.186 1.00 0.00 H new ATOM 0 HG3 PRO A 22 23.873 -15.884 -28.779 1.00 0.00 H new ATOM 0 HD2 PRO A 22 21.317 -16.331 -27.812 1.00 0.00 H new ATOM 0 HD3 PRO A 22 22.066 -17.393 -28.987 1.00 0.00 H new ATOM 70 N GLY A 23 23.427 -18.339 -23.874 1.00 0.00 N ATOM 71 CA GLY A 23 23.353 -17.836 -22.474 1.00 0.00 C ATOM 72 C GLY A 23 22.236 -16.795 -22.364 1.00 0.00 C ATOM 73 O GLY A 23 21.445 -16.626 -23.271 1.00 0.00 O ATOM 0 H GLY A 23 23.417 -19.354 -23.972 1.00 0.00 H new ATOM 0 HA2 GLY A 23 23.163 -18.662 -21.789 1.00 0.00 H new ATOM 0 HA3 GLY A 23 24.306 -17.394 -22.184 1.00 0.00 H new ATOM 77 N PRO A 24 22.176 -16.102 -21.258 1.00 0.00 N ATOM 78 CA PRO A 24 21.141 -15.055 -21.015 1.00 0.00 C ATOM 79 C PRO A 24 20.969 -14.117 -22.217 1.00 0.00 C ATOM 80 O PRO A 24 21.820 -14.037 -23.080 1.00 0.00 O ATOM 81 CB PRO A 24 21.683 -14.296 -19.799 1.00 0.00 C ATOM 82 CG PRO A 24 22.489 -15.310 -19.050 1.00 0.00 C ATOM 83 CD PRO A 24 23.092 -16.240 -20.110 1.00 0.00 C ATOM 0 HA PRO A 24 20.152 -15.483 -20.853 1.00 0.00 H new ATOM 0 HB2 PRO A 24 22.296 -13.448 -20.102 1.00 0.00 H new ATOM 0 HB3 PRO A 24 20.874 -13.901 -19.185 1.00 0.00 H new ATOM 0 HG2 PRO A 24 23.271 -14.829 -18.462 1.00 0.00 H new ATOM 0 HG3 PRO A 24 21.864 -15.867 -18.353 1.00 0.00 H new ATOM 0 HD2 PRO A 24 24.108 -15.944 -20.371 1.00 0.00 H new ATOM 0 HD3 PRO A 24 23.140 -17.270 -19.758 1.00 0.00 H new ATOM 91 N SER A 25 19.875 -13.409 -22.277 1.00 0.00 N ATOM 92 CA SER A 25 19.651 -12.480 -23.421 1.00 0.00 C ATOM 93 C SER A 25 20.454 -11.197 -23.200 1.00 0.00 C ATOM 94 O SER A 25 21.333 -11.139 -22.363 1.00 0.00 O ATOM 95 CB SER A 25 18.162 -12.140 -23.517 1.00 0.00 C ATOM 96 OG SER A 25 17.900 -11.513 -24.764 1.00 0.00 O ATOM 0 H SER A 25 19.127 -13.433 -21.584 1.00 0.00 H new ATOM 0 HA SER A 25 19.975 -12.957 -24.346 1.00 0.00 H new ATOM 0 HB2 SER A 25 17.564 -13.046 -23.421 1.00 0.00 H new ATOM 0 HB3 SER A 25 17.875 -11.480 -22.698 1.00 0.00 H new ATOM 0 HG SER A 25 18.590 -11.770 -25.411 1.00 0.00 H new ATOM 102 N GLY A 26 20.158 -10.165 -23.943 1.00 0.00 N ATOM 103 CA GLY A 26 20.905 -8.887 -23.775 1.00 0.00 C ATOM 104 C GLY A 26 20.331 -7.833 -24.723 1.00 0.00 C ATOM 105 O GLY A 26 19.212 -7.941 -25.183 1.00 0.00 O ATOM 0 H GLY A 26 19.431 -10.152 -24.659 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.831 -8.543 -22.743 1.00 0.00 H new ATOM 0 HA3 GLY A 26 21.964 -9.042 -23.984 1.00 0.00 H new ATOM 109 N GLY A 27 21.089 -6.812 -25.019 1.00 0.00 N ATOM 110 CA GLY A 27 20.586 -5.752 -25.938 1.00 0.00 C ATOM 111 C GLY A 27 21.635 -4.645 -26.062 1.00 0.00 C ATOM 112 O GLY A 27 22.275 -4.273 -25.098 1.00 0.00 O ATOM 0 H GLY A 27 22.034 -6.666 -24.664 1.00 0.00 H new ATOM 0 HA2 GLY A 27 20.373 -6.177 -26.919 1.00 0.00 H new ATOM 0 HA3 GLY A 27 19.651 -5.341 -25.559 1.00 0.00 H new ATOM 116 N ALA A 28 21.816 -4.116 -27.240 1.00 0.00 N ATOM 117 CA ALA A 28 22.823 -3.033 -27.424 1.00 0.00 C ATOM 118 C ALA A 28 22.252 -1.712 -26.905 1.00 0.00 C ATOM 119 O ALA A 28 22.965 -0.879 -26.382 1.00 0.00 O ATOM 120 CB ALA A 28 23.158 -2.895 -28.911 1.00 0.00 C ATOM 0 H ALA A 28 21.310 -4.387 -28.083 1.00 0.00 H new ATOM 0 HA ALA A 28 23.728 -3.280 -26.869 1.00 0.00 H new ATOM 0 HB1 ALA A 28 23.895 -2.103 -29.046 1.00 0.00 H new ATOM 0 HB2 ALA A 28 23.565 -3.836 -29.281 1.00 0.00 H new ATOM 0 HB3 ALA A 28 22.253 -2.648 -29.466 1.00 0.00 H new ATOM 126 N GLN A 29 20.970 -1.513 -27.047 1.00 0.00 N ATOM 127 CA GLN A 29 20.355 -0.245 -26.561 1.00 0.00 C ATOM 128 C GLN A 29 20.254 -0.279 -25.035 1.00 0.00 C ATOM 129 O GLN A 29 19.195 -0.096 -24.469 1.00 0.00 O ATOM 130 CB GLN A 29 18.956 -0.094 -27.162 1.00 0.00 C ATOM 131 CG GLN A 29 19.048 -0.143 -28.688 1.00 0.00 C ATOM 132 CD GLN A 29 19.821 1.078 -29.192 1.00 0.00 C ATOM 133 OE1 GLN A 29 19.879 2.092 -28.525 1.00 0.00 O ATOM 134 NE2 GLN A 29 20.421 1.023 -30.349 1.00 0.00 N ATOM 0 H GLN A 29 20.322 -2.173 -27.478 1.00 0.00 H new ATOM 0 HA GLN A 29 20.974 0.599 -26.865 1.00 0.00 H new ATOM 0 HB2 GLN A 29 18.306 -0.890 -26.801 1.00 0.00 H new ATOM 0 HB3 GLN A 29 18.512 0.849 -26.844 1.00 0.00 H new ATOM 0 HG2 GLN A 29 19.548 -1.059 -29.004 1.00 0.00 H new ATOM 0 HG3 GLN A 29 18.049 -0.159 -29.123 1.00 0.00 H new ATOM 0 HE21 GLN A 29 20.372 0.172 -30.909 1.00 0.00 H new ATOM 0 HE22 GLN A 29 20.939 1.831 -30.694 1.00 0.00 H new ATOM 143 N GLY A 30 21.349 -0.512 -24.364 1.00 0.00 N ATOM 144 CA GLY A 30 21.314 -0.557 -22.875 1.00 0.00 C ATOM 145 C GLY A 30 22.683 -0.990 -22.346 1.00 0.00 C ATOM 146 O GLY A 30 23.429 -0.197 -21.805 1.00 0.00 O ATOM 0 H GLY A 30 22.265 -0.673 -24.782 1.00 0.00 H new ATOM 0 HA2 GLY A 30 21.052 0.423 -22.477 1.00 0.00 H new ATOM 0 HA3 GLY A 30 20.546 -1.253 -22.539 1.00 0.00 H new ATOM 150 N GLY A 31 23.020 -2.241 -22.497 1.00 0.00 N ATOM 151 CA GLY A 31 24.341 -2.722 -22.002 1.00 0.00 C ATOM 152 C GLY A 31 24.273 -2.931 -20.488 1.00 0.00 C ATOM 153 O GLY A 31 25.110 -3.591 -19.905 1.00 0.00 O ATOM 0 H GLY A 31 22.438 -2.951 -22.942 1.00 0.00 H new ATOM 0 HA2 GLY A 31 24.609 -3.655 -22.497 1.00 0.00 H new ATOM 0 HA3 GLY A 31 25.118 -1.998 -22.245 1.00 0.00 H new ATOM 157 N SER A 32 23.282 -2.374 -19.847 1.00 0.00 N ATOM 158 CA SER A 32 23.162 -2.541 -18.371 1.00 0.00 C ATOM 159 C SER A 32 21.783 -2.063 -17.914 1.00 0.00 C ATOM 160 O SER A 32 21.375 -0.954 -18.196 1.00 0.00 O ATOM 161 CB SER A 32 24.245 -1.715 -17.674 1.00 0.00 C ATOM 162 OG SER A 32 24.191 -1.949 -16.275 1.00 0.00 O ATOM 0 H SER A 32 22.551 -1.811 -20.281 1.00 0.00 H new ATOM 0 HA SER A 32 23.286 -3.593 -18.114 1.00 0.00 H new ATOM 0 HB2 SER A 32 25.228 -1.984 -18.061 1.00 0.00 H new ATOM 0 HB3 SER A 32 24.099 -0.655 -17.882 1.00 0.00 H new ATOM 0 HG SER A 32 24.886 -1.422 -15.828 1.00 0.00 H new ATOM 168 N ILE A 33 21.060 -2.891 -17.210 1.00 0.00 N ATOM 169 CA ILE A 33 19.708 -2.483 -16.736 1.00 0.00 C ATOM 170 C ILE A 33 19.851 -1.482 -15.588 1.00 0.00 C ATOM 171 O ILE A 33 20.932 -1.014 -15.291 1.00 0.00 O ATOM 172 CB ILE A 33 18.946 -3.715 -16.246 1.00 0.00 C ATOM 173 CG1 ILE A 33 19.826 -4.506 -15.276 1.00 0.00 C ATOM 174 CG2 ILE A 33 18.583 -4.600 -17.441 1.00 0.00 C ATOM 175 CD1 ILE A 33 18.999 -5.615 -14.624 1.00 0.00 C ATOM 0 H ILE A 33 21.348 -3.832 -16.943 1.00 0.00 H new ATOM 0 HA ILE A 33 19.160 -2.020 -17.556 1.00 0.00 H new ATOM 0 HB ILE A 33 18.035 -3.400 -15.737 1.00 0.00 H new ATOM 0 HG12 ILE A 33 20.675 -4.936 -15.807 1.00 0.00 H new ATOM 0 HG13 ILE A 33 20.230 -3.842 -14.512 1.00 0.00 H new ATOM 0 HG21 ILE A 33 18.040 -5.478 -17.092 1.00 0.00 H new ATOM 0 HG22 ILE A 33 17.957 -4.038 -18.133 1.00 0.00 H new ATOM 0 HG23 ILE A 33 19.494 -4.915 -17.950 1.00 0.00 H new ATOM 0 HD11 ILE A 33 19.626 -6.178 -13.933 1.00 0.00 H new ATOM 0 HD12 ILE A 33 18.164 -5.174 -14.079 1.00 0.00 H new ATOM 0 HD13 ILE A 33 18.616 -6.284 -15.394 1.00 0.00 H new ATOM 187 N HIS A 34 18.768 -1.150 -14.939 1.00 0.00 N ATOM 188 CA HIS A 34 18.842 -0.180 -13.810 1.00 0.00 C ATOM 189 C HIS A 34 17.608 -0.340 -12.919 1.00 0.00 C ATOM 190 O HIS A 34 16.495 -0.084 -13.333 1.00 0.00 O ATOM 191 CB HIS A 34 18.888 1.246 -14.365 1.00 0.00 C ATOM 192 CG HIS A 34 20.234 1.498 -14.988 1.00 0.00 C ATOM 193 ND1 HIS A 34 20.420 1.521 -16.361 1.00 0.00 N ATOM 194 CD2 HIS A 34 21.468 1.741 -14.438 1.00 0.00 C ATOM 195 CE1 HIS A 34 21.723 1.770 -16.589 1.00 0.00 C ATOM 196 NE2 HIS A 34 22.407 1.912 -15.450 1.00 0.00 N ATOM 0 H HIS A 34 17.835 -1.509 -15.142 1.00 0.00 H new ATOM 0 HA HIS A 34 19.741 -0.372 -13.224 1.00 0.00 H new ATOM 0 HB2 HIS A 34 18.101 1.385 -15.106 1.00 0.00 H new ATOM 0 HB3 HIS A 34 18.705 1.965 -13.566 1.00 0.00 H new ATOM 0 HD2 HIS A 34 21.678 1.792 -13.380 1.00 0.00 H new ATOM 0 HE1 HIS A 34 22.162 1.846 -17.573 1.00 0.00 H new ATOM 0 HE2 HIS A 34 23.403 2.104 -15.345 1.00 0.00 H new ATOM 204 N SER A 35 17.797 -0.761 -11.699 1.00 0.00 N ATOM 205 CA SER A 35 16.635 -0.937 -10.783 1.00 0.00 C ATOM 206 C SER A 35 16.136 0.434 -10.323 1.00 0.00 C ATOM 207 O SER A 35 15.475 1.142 -11.057 1.00 0.00 O ATOM 208 CB SER A 35 17.065 -1.758 -9.565 1.00 0.00 C ATOM 209 OG SER A 35 18.272 -1.226 -9.038 1.00 0.00 O ATOM 0 H SER A 35 18.706 -0.991 -11.297 1.00 0.00 H new ATOM 0 HA SER A 35 15.834 -1.458 -11.308 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.284 -1.738 -8.805 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.208 -2.801 -9.848 1.00 0.00 H new ATOM 0 HG SER A 35 18.547 -1.750 -8.257 1.00 0.00 H new ATOM 215 N GLY A 36 16.447 0.814 -9.114 1.00 0.00 N ATOM 216 CA GLY A 36 15.989 2.140 -8.610 1.00 0.00 C ATOM 217 C GLY A 36 16.813 2.529 -7.381 1.00 0.00 C ATOM 218 O GLY A 36 16.400 2.329 -6.256 1.00 0.00 O ATOM 0 H GLY A 36 16.998 0.265 -8.454 1.00 0.00 H new ATOM 0 HA2 GLY A 36 16.098 2.895 -9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 36 14.930 2.098 -8.353 1.00 0.00 H new ATOM 222 N ARG A 37 17.976 3.085 -7.586 1.00 0.00 N ATOM 223 CA ARG A 37 18.825 3.486 -6.429 1.00 0.00 C ATOM 224 C ARG A 37 18.164 4.654 -5.693 1.00 0.00 C ATOM 225 O ARG A 37 18.315 5.800 -6.066 1.00 0.00 O ATOM 226 CB ARG A 37 20.204 3.916 -6.933 1.00 0.00 C ATOM 227 CG ARG A 37 20.944 2.700 -7.494 1.00 0.00 C ATOM 228 CD ARG A 37 22.371 3.102 -7.872 1.00 0.00 C ATOM 229 NE ARG A 37 23.098 1.913 -8.398 1.00 0.00 N ATOM 230 CZ ARG A 37 24.340 2.025 -8.785 1.00 0.00 C ATOM 231 NH1 ARG A 37 24.944 3.180 -8.710 1.00 0.00 N ATOM 232 NH2 ARG A 37 24.977 0.984 -9.246 1.00 0.00 N ATOM 0 H ARG A 37 18.375 3.279 -8.505 1.00 0.00 H new ATOM 0 HA ARG A 37 18.934 2.642 -5.748 1.00 0.00 H new ATOM 0 HB2 ARG A 37 20.099 4.679 -7.704 1.00 0.00 H new ATOM 0 HB3 ARG A 37 20.778 4.361 -6.120 1.00 0.00 H new ATOM 0 HG2 ARG A 37 20.964 1.900 -6.754 1.00 0.00 H new ATOM 0 HG3 ARG A 37 20.420 2.313 -8.368 1.00 0.00 H new ATOM 0 HD2 ARG A 37 22.351 3.891 -8.623 1.00 0.00 H new ATOM 0 HD3 ARG A 37 22.890 3.503 -7.002 1.00 0.00 H new ATOM 0 HE ARG A 37 22.625 1.011 -8.456 1.00 0.00 H new ATOM 0 HH11 ARG A 37 24.446 3.994 -8.349 1.00 0.00 H new ATOM 0 HH12 ARG A 37 25.914 3.269 -9.012 1.00 0.00 H new ATOM 0 HH21 ARG A 37 24.505 0.082 -9.304 1.00 0.00 H new ATOM 0 HH22 ARG A 37 25.947 1.072 -9.548 1.00 0.00 H new ATOM 246 N ILE A 38 17.431 4.371 -4.647 1.00 0.00 N ATOM 247 CA ILE A 38 16.755 5.463 -3.878 1.00 0.00 C ATOM 248 C ILE A 38 16.767 5.105 -2.393 1.00 0.00 C ATOM 249 O ILE A 38 15.936 4.358 -1.914 1.00 0.00 O ATOM 250 CB ILE A 38 15.310 5.613 -4.374 1.00 0.00 C ATOM 251 CG1 ILE A 38 15.338 5.872 -5.883 1.00 0.00 C ATOM 252 CG2 ILE A 38 14.615 6.788 -3.663 1.00 0.00 C ATOM 253 CD1 ILE A 38 13.936 6.238 -6.381 1.00 0.00 C ATOM 0 H ILE A 38 17.270 3.429 -4.290 1.00 0.00 H new ATOM 0 HA ILE A 38 17.280 6.407 -4.025 1.00 0.00 H new ATOM 0 HB ILE A 38 14.755 4.701 -4.155 1.00 0.00 H new ATOM 0 HG12 ILE A 38 16.035 6.680 -6.108 1.00 0.00 H new ATOM 0 HG13 ILE A 38 15.698 4.986 -6.405 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.592 6.880 -4.027 1.00 0.00 H new ATOM 0 HG22 ILE A 38 14.603 6.607 -2.588 1.00 0.00 H new ATOM 0 HG23 ILE A 38 15.157 7.711 -3.870 1.00 0.00 H new ATOM 0 HD11 ILE A 38 13.967 6.420 -7.455 1.00 0.00 H new ATOM 0 HD12 ILE A 38 13.250 5.417 -6.172 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.592 7.137 -5.870 1.00 0.00 H new ATOM 265 N ALA A 39 17.709 5.634 -1.663 1.00 0.00 N ATOM 266 CA ALA A 39 17.792 5.333 -0.204 1.00 0.00 C ATOM 267 C ALA A 39 16.926 6.328 0.573 1.00 0.00 C ATOM 268 O ALA A 39 17.394 7.356 1.022 1.00 0.00 O ATOM 269 CB ALA A 39 19.246 5.451 0.254 1.00 0.00 C ATOM 0 H ALA A 39 18.429 6.265 -2.015 1.00 0.00 H new ATOM 0 HA ALA A 39 17.433 4.321 -0.018 1.00 0.00 H new ATOM 0 HB1 ALA A 39 19.311 5.232 1.320 1.00 0.00 H new ATOM 0 HB2 ALA A 39 19.861 4.742 -0.300 1.00 0.00 H new ATOM 0 HB3 ALA A 39 19.605 6.464 0.070 1.00 0.00 H new ATOM 275 N ALA A 40 15.663 6.031 0.728 1.00 0.00 N ATOM 276 CA ALA A 40 14.750 6.954 1.468 1.00 0.00 C ATOM 277 C ALA A 40 13.695 6.132 2.221 1.00 0.00 C ATOM 278 O ALA A 40 13.748 4.916 2.260 1.00 0.00 O ATOM 279 CB ALA A 40 14.075 7.901 0.465 1.00 0.00 C ATOM 0 H ALA A 40 15.221 5.184 0.372 1.00 0.00 H new ATOM 0 HA ALA A 40 15.316 7.543 2.190 1.00 0.00 H new ATOM 0 HB1 ALA A 40 13.407 8.578 0.997 1.00 0.00 H new ATOM 0 HB2 ALA A 40 14.836 8.479 -0.058 1.00 0.00 H new ATOM 0 HB3 ALA A 40 13.502 7.319 -0.257 1.00 0.00 H new ATOM 285 N VAL A 41 12.745 6.792 2.827 1.00 0.00 N ATOM 286 CA VAL A 41 11.684 6.061 3.582 1.00 0.00 C ATOM 287 C VAL A 41 10.714 5.422 2.586 1.00 0.00 C ATOM 288 O VAL A 41 10.411 5.982 1.551 1.00 0.00 O ATOM 289 CB VAL A 41 10.923 7.043 4.479 1.00 0.00 C ATOM 290 CG1 VAL A 41 9.784 6.321 5.206 1.00 0.00 C ATOM 291 CG2 VAL A 41 11.878 7.640 5.516 1.00 0.00 C ATOM 0 H VAL A 41 12.657 7.808 2.832 1.00 0.00 H new ATOM 0 HA VAL A 41 12.139 5.288 4.201 1.00 0.00 H new ATOM 0 HB VAL A 41 10.509 7.836 3.857 1.00 0.00 H new ATOM 0 HG11 VAL A 41 9.251 7.029 5.840 1.00 0.00 H new ATOM 0 HG12 VAL A 41 9.095 5.899 4.474 1.00 0.00 H new ATOM 0 HG13 VAL A 41 10.195 5.521 5.821 1.00 0.00 H new ATOM 0 HG21 VAL A 41 11.334 8.338 6.152 1.00 0.00 H new ATOM 0 HG22 VAL A 41 12.296 6.841 6.128 1.00 0.00 H new ATOM 0 HG23 VAL A 41 12.685 8.167 5.007 1.00 0.00 H new ATOM 301 N HIS A 42 10.239 4.247 2.887 1.00 0.00 N ATOM 302 CA HIS A 42 9.299 3.548 1.959 1.00 0.00 C ATOM 303 C HIS A 42 8.348 2.653 2.761 1.00 0.00 C ATOM 304 O HIS A 42 8.724 2.061 3.753 1.00 0.00 O ATOM 305 CB HIS A 42 10.116 2.661 1.007 1.00 0.00 C ATOM 306 CG HIS A 42 10.615 3.455 -0.169 1.00 0.00 C ATOM 307 ND1 HIS A 42 11.581 4.422 -0.285 1.00 0.00 N flip ATOM 308 CD2 HIS A 42 10.114 3.267 -1.447 1.00 0.00 C flip ATOM 309 CE1 HIS A 42 11.682 4.828 -1.611 1.00 0.00 C flip ATOM 310 NE2 HIS A 42 10.776 4.099 -2.268 1.00 0.00 N flip ATOM 0 H HIS A 42 10.461 3.735 3.741 1.00 0.00 H new ATOM 0 HA HIS A 42 8.724 4.286 1.400 1.00 0.00 H new ATOM 0 HB2 HIS A 42 10.960 2.227 1.542 1.00 0.00 H new ATOM 0 HB3 HIS A 42 9.500 1.832 0.657 1.00 0.00 H new ATOM 0 HD2 HIS A 42 9.333 2.577 -1.731 1.00 0.00 H new ATOM 0 HE1 HIS A 42 12.349 5.572 -2.021 1.00 0.00 H new ATOM 0 HE2 HIS A 42 10.607 4.166 -3.272 1.00 0.00 H new ATOM 318 N ASN A 43 7.128 2.524 2.315 1.00 0.00 N ATOM 319 CA ASN A 43 6.163 1.638 3.021 1.00 0.00 C ATOM 320 C ASN A 43 6.368 0.209 2.515 1.00 0.00 C ATOM 321 O ASN A 43 5.821 -0.183 1.503 1.00 0.00 O ATOM 322 CB ASN A 43 4.739 2.091 2.707 1.00 0.00 C ATOM 323 CG ASN A 43 4.476 3.435 3.381 1.00 0.00 C ATOM 324 OD1 ASN A 43 5.278 3.902 4.165 1.00 0.00 O ATOM 325 ND2 ASN A 43 3.380 4.083 3.107 1.00 0.00 N ATOM 0 H ASN A 43 6.758 2.996 1.490 1.00 0.00 H new ATOM 0 HA ASN A 43 6.323 1.683 4.098 1.00 0.00 H new ATOM 0 HB2 ASN A 43 4.603 2.179 1.629 1.00 0.00 H new ATOM 0 HB3 ASN A 43 4.023 1.348 3.059 1.00 0.00 H new ATOM 0 HD21 ASN A 43 3.195 4.983 3.551 1.00 0.00 H new ATOM 0 HD22 ASN A 43 2.707 3.691 2.449 1.00 0.00 H new ATOM 332 N VAL A 44 7.165 -0.569 3.198 1.00 0.00 N ATOM 333 CA VAL A 44 7.418 -1.971 2.739 1.00 0.00 C ATOM 334 C VAL A 44 6.335 -2.905 3.334 1.00 0.00 C ATOM 335 O VAL A 44 6.148 -2.925 4.535 1.00 0.00 O ATOM 336 CB VAL A 44 8.828 -2.402 3.196 1.00 0.00 C ATOM 337 CG1 VAL A 44 8.832 -2.780 4.677 1.00 0.00 C ATOM 338 CG2 VAL A 44 9.296 -3.608 2.377 1.00 0.00 C ATOM 0 H VAL A 44 7.652 -0.297 4.052 1.00 0.00 H new ATOM 0 HA VAL A 44 7.368 -2.031 1.652 1.00 0.00 H new ATOM 0 HB VAL A 44 9.502 -1.560 3.042 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.837 -3.080 4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.519 -1.922 5.272 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.143 -3.608 4.843 1.00 0.00 H new ATOM 0 HG21 VAL A 44 10.292 -3.906 2.705 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.603 -4.437 2.521 1.00 0.00 H new ATOM 0 HG23 VAL A 44 9.327 -3.341 1.321 1.00 0.00 H new ATOM 348 N PRO A 45 5.611 -3.668 2.526 1.00 0.00 N ATOM 349 CA PRO A 45 4.543 -4.581 3.049 1.00 0.00 C ATOM 350 C PRO A 45 5.000 -5.443 4.231 1.00 0.00 C ATOM 351 O PRO A 45 6.102 -5.951 4.259 1.00 0.00 O ATOM 352 CB PRO A 45 4.201 -5.472 1.846 1.00 0.00 C ATOM 353 CG PRO A 45 4.519 -4.641 0.649 1.00 0.00 C ATOM 354 CD PRO A 45 5.704 -3.753 1.045 1.00 0.00 C ATOM 0 HA PRO A 45 3.699 -4.009 3.436 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.787 -6.391 1.856 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.151 -5.764 1.857 1.00 0.00 H new ATOM 0 HG2 PRO A 45 4.772 -5.270 -0.205 1.00 0.00 H new ATOM 0 HG3 PRO A 45 3.661 -4.036 0.356 1.00 0.00 H new ATOM 0 HD2 PRO A 45 6.652 -4.188 0.729 1.00 0.00 H new ATOM 0 HD3 PRO A 45 5.636 -2.768 0.584 1.00 0.00 H new ATOM 362 N LEU A 46 4.144 -5.619 5.202 1.00 0.00 N ATOM 363 CA LEU A 46 4.508 -6.459 6.375 1.00 0.00 C ATOM 364 C LEU A 46 4.670 -7.910 5.926 1.00 0.00 C ATOM 365 O LEU A 46 5.430 -8.673 6.487 1.00 0.00 O ATOM 366 CB LEU A 46 3.379 -6.416 7.408 1.00 0.00 C ATOM 367 CG LEU A 46 3.171 -4.981 7.951 1.00 0.00 C ATOM 368 CD1 LEU A 46 1.692 -4.769 8.263 1.00 0.00 C ATOM 369 CD2 LEU A 46 3.981 -4.757 9.237 1.00 0.00 C ATOM 0 H LEU A 46 3.208 -5.216 5.232 1.00 0.00 H new ATOM 0 HA LEU A 46 5.435 -6.081 6.806 1.00 0.00 H new ATOM 0 HB2 LEU A 46 2.454 -6.774 6.955 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.611 -7.090 8.233 1.00 0.00 H new ATOM 0 HG LEU A 46 3.509 -4.275 7.192 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.542 -3.759 8.646 1.00 0.00 H new ATOM 0 HD12 LEU A 46 1.106 -4.904 7.354 1.00 0.00 H new ATOM 0 HD13 LEU A 46 1.371 -5.492 9.012 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.817 -3.742 9.598 1.00 0.00 H new ATOM 0 HD22 LEU A 46 3.660 -5.469 9.998 1.00 0.00 H new ATOM 0 HD23 LEU A 46 5.041 -4.902 9.029 1.00 0.00 H new ATOM 381 N SER A 47 3.918 -8.295 4.939 1.00 0.00 N ATOM 382 CA SER A 47 3.957 -9.704 4.450 1.00 0.00 C ATOM 383 C SER A 47 5.342 -10.091 3.908 1.00 0.00 C ATOM 384 O SER A 47 5.705 -11.251 3.932 1.00 0.00 O ATOM 385 CB SER A 47 2.920 -9.865 3.339 1.00 0.00 C ATOM 386 OG SER A 47 3.052 -8.799 2.410 1.00 0.00 O ATOM 0 H SER A 47 3.267 -7.688 4.441 1.00 0.00 H new ATOM 0 HA SER A 47 3.737 -10.361 5.291 1.00 0.00 H new ATOM 0 HB2 SER A 47 3.058 -10.821 2.834 1.00 0.00 H new ATOM 0 HB3 SER A 47 1.916 -9.870 3.762 1.00 0.00 H new ATOM 0 HG SER A 47 2.388 -8.903 1.696 1.00 0.00 H new ATOM 392 N VAL A 48 6.109 -9.156 3.397 1.00 0.00 N ATOM 393 CA VAL A 48 7.454 -9.513 2.830 1.00 0.00 C ATOM 394 C VAL A 48 8.584 -9.163 3.807 1.00 0.00 C ATOM 395 O VAL A 48 9.713 -8.967 3.405 1.00 0.00 O ATOM 396 CB VAL A 48 7.670 -8.772 1.501 1.00 0.00 C ATOM 397 CG1 VAL A 48 6.452 -8.972 0.595 1.00 0.00 C ATOM 398 CG2 VAL A 48 7.885 -7.274 1.743 1.00 0.00 C ATOM 0 H VAL A 48 5.866 -8.167 3.347 1.00 0.00 H new ATOM 0 HA VAL A 48 7.474 -10.590 2.660 1.00 0.00 H new ATOM 0 HB VAL A 48 8.559 -9.179 1.020 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.608 -8.445 -0.346 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.316 -10.035 0.398 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.563 -8.578 1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.036 -6.769 0.789 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.009 -6.856 2.240 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.763 -7.129 2.373 1.00 0.00 H new ATOM 408 N LEU A 49 8.310 -9.103 5.086 1.00 0.00 N ATOM 409 CA LEU A 49 9.395 -8.791 6.064 1.00 0.00 C ATOM 410 C LEU A 49 10.013 -10.101 6.551 1.00 0.00 C ATOM 411 O LEU A 49 9.327 -10.989 7.017 1.00 0.00 O ATOM 412 CB LEU A 49 8.820 -8.046 7.274 1.00 0.00 C ATOM 413 CG LEU A 49 8.382 -6.623 6.897 1.00 0.00 C ATOM 414 CD1 LEU A 49 7.824 -5.946 8.153 1.00 0.00 C ATOM 415 CD2 LEU A 49 9.572 -5.807 6.356 1.00 0.00 C ATOM 0 H LEU A 49 7.387 -9.256 5.493 1.00 0.00 H new ATOM 0 HA LEU A 49 10.144 -8.167 5.577 1.00 0.00 H new ATOM 0 HB2 LEU A 49 7.968 -8.597 7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 49 9.568 -8.001 8.065 1.00 0.00 H new ATOM 0 HG LEU A 49 7.624 -6.672 6.116 1.00 0.00 H new ATOM 0 HD11 LEU A 49 7.506 -4.932 7.909 1.00 0.00 H new ATOM 0 HD12 LEU A 49 6.971 -6.514 8.524 1.00 0.00 H new ATOM 0 HD13 LEU A 49 8.597 -5.909 8.920 1.00 0.00 H new ATOM 0 HD21 LEU A 49 9.237 -4.803 6.096 1.00 0.00 H new ATOM 0 HD22 LEU A 49 10.347 -5.744 7.120 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.975 -6.296 5.469 1.00 0.00 H new ATOM 427 N ILE A 50 11.305 -10.228 6.441 1.00 0.00 N ATOM 428 CA ILE A 50 11.985 -11.479 6.888 1.00 0.00 C ATOM 429 C ILE A 50 12.479 -11.326 8.327 1.00 0.00 C ATOM 430 O ILE A 50 13.304 -10.483 8.630 1.00 0.00 O ATOM 431 CB ILE A 50 13.174 -11.737 5.975 1.00 0.00 C ATOM 432 CG1 ILE A 50 12.710 -11.625 4.524 1.00 0.00 C ATOM 433 CG2 ILE A 50 13.738 -13.133 6.235 1.00 0.00 C ATOM 434 CD1 ILE A 50 13.848 -12.025 3.587 1.00 0.00 C ATOM 0 H ILE A 50 11.925 -9.515 6.058 1.00 0.00 H new ATOM 0 HA ILE A 50 11.282 -12.311 6.843 1.00 0.00 H new ATOM 0 HB ILE A 50 13.957 -11.004 6.171 1.00 0.00 H new ATOM 0 HG12 ILE A 50 11.846 -12.268 4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.393 -10.604 4.311 1.00 0.00 H new ATOM 0 HG21 ILE A 50 14.589 -13.310 5.577 1.00 0.00 H new ATOM 0 HG22 ILE A 50 14.060 -13.208 7.274 1.00 0.00 H new ATOM 0 HG23 ILE A 50 12.967 -13.879 6.040 1.00 0.00 H new ATOM 0 HD11 ILE A 50 13.513 -11.944 2.553 1.00 0.00 H new ATOM 0 HD12 ILE A 50 14.700 -11.363 3.746 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.144 -13.054 3.793 1.00 0.00 H new ATOM 446 N ARG A 51 11.980 -12.151 9.209 1.00 0.00 N ATOM 447 CA ARG A 51 12.404 -12.098 10.641 1.00 0.00 C ATOM 448 C ARG A 51 12.691 -13.524 11.145 1.00 0.00 C ATOM 449 O ARG A 51 11.792 -14.217 11.577 1.00 0.00 O ATOM 450 CB ARG A 51 11.259 -11.508 11.466 1.00 0.00 C ATOM 451 CG ARG A 51 11.196 -10.001 11.237 1.00 0.00 C ATOM 452 CD ARG A 51 10.098 -9.394 12.113 1.00 0.00 C ATOM 453 NE ARG A 51 10.240 -7.911 12.131 1.00 0.00 N ATOM 454 CZ ARG A 51 11.196 -7.356 12.823 1.00 0.00 C ATOM 455 NH1 ARG A 51 12.029 -8.099 13.500 1.00 0.00 N ATOM 456 NH2 ARG A 51 11.320 -6.057 12.839 1.00 0.00 N ATOM 0 H ARG A 51 11.288 -12.869 8.996 1.00 0.00 H new ATOM 0 HA ARG A 51 13.301 -11.487 10.738 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.314 -11.970 11.181 1.00 0.00 H new ATOM 0 HB3 ARG A 51 11.411 -11.720 12.524 1.00 0.00 H new ATOM 0 HG2 ARG A 51 12.158 -9.546 11.475 1.00 0.00 H new ATOM 0 HG3 ARG A 51 10.995 -9.791 10.187 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.116 -9.671 11.729 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.167 -9.789 13.127 1.00 0.00 H new ATOM 0 HE ARG A 51 9.590 -7.330 11.602 1.00 0.00 H new ATOM 0 HH11 ARG A 51 11.932 -9.114 13.488 1.00 0.00 H new ATOM 0 HH12 ARG A 51 12.776 -7.664 14.041 1.00 0.00 H new ATOM 0 HH21 ARG A 51 10.669 -5.476 12.310 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.068 -5.623 13.380 1.00 0.00 H new ATOM 470 N PRO A 52 13.929 -13.955 11.116 1.00 0.00 N ATOM 471 CA PRO A 52 14.331 -15.300 11.600 1.00 0.00 C ATOM 472 C PRO A 52 14.875 -15.256 13.032 1.00 0.00 C ATOM 473 O PRO A 52 15.735 -16.032 13.398 1.00 0.00 O ATOM 474 CB PRO A 52 15.450 -15.648 10.630 1.00 0.00 C ATOM 475 CG PRO A 52 16.166 -14.343 10.429 1.00 0.00 C ATOM 476 CD PRO A 52 15.104 -13.232 10.597 1.00 0.00 C ATOM 0 HA PRO A 52 13.505 -16.011 11.629 1.00 0.00 H new ATOM 0 HB2 PRO A 52 16.113 -16.409 11.040 1.00 0.00 H new ATOM 0 HB3 PRO A 52 15.059 -16.039 9.691 1.00 0.00 H new ATOM 0 HG2 PRO A 52 16.970 -14.225 11.156 1.00 0.00 H new ATOM 0 HG3 PRO A 52 16.622 -14.298 9.440 1.00 0.00 H new ATOM 0 HD2 PRO A 52 15.438 -12.459 11.289 1.00 0.00 H new ATOM 0 HD3 PRO A 52 14.886 -12.739 9.650 1.00 0.00 H new ATOM 484 N LEU A 53 14.400 -14.338 13.839 1.00 0.00 N ATOM 485 CA LEU A 53 14.912 -14.224 15.242 1.00 0.00 C ATOM 486 C LEU A 53 13.726 -13.911 16.190 1.00 0.00 C ATOM 487 O LEU A 53 13.018 -12.946 15.980 1.00 0.00 O ATOM 488 CB LEU A 53 15.950 -13.068 15.275 1.00 0.00 C ATOM 489 CG LEU A 53 17.282 -13.513 15.923 1.00 0.00 C ATOM 490 CD1 LEU A 53 17.902 -14.697 15.139 1.00 0.00 C ATOM 491 CD2 LEU A 53 18.262 -12.320 15.933 1.00 0.00 C ATOM 0 H LEU A 53 13.679 -13.662 13.587 1.00 0.00 H new ATOM 0 HA LEU A 53 15.381 -15.153 15.567 1.00 0.00 H new ATOM 0 HB2 LEU A 53 16.138 -12.719 14.260 1.00 0.00 H new ATOM 0 HB3 LEU A 53 15.539 -12.225 15.831 1.00 0.00 H new ATOM 0 HG LEU A 53 17.089 -13.842 16.944 1.00 0.00 H new ATOM 0 HD11 LEU A 53 18.838 -14.995 15.611 1.00 0.00 H new ATOM 0 HD12 LEU A 53 17.209 -15.539 15.143 1.00 0.00 H new ATOM 0 HD13 LEU A 53 18.095 -14.391 14.111 1.00 0.00 H new ATOM 0 HD21 LEU A 53 19.204 -12.626 16.389 1.00 0.00 H new ATOM 0 HD22 LEU A 53 18.444 -11.990 14.910 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.831 -11.500 16.507 1.00 0.00 H new ATOM 503 N PRO A 54 13.501 -14.703 17.225 1.00 0.00 N ATOM 504 CA PRO A 54 12.378 -14.457 18.179 1.00 0.00 C ATOM 505 C PRO A 54 12.696 -13.312 19.150 1.00 0.00 C ATOM 506 O PRO A 54 13.824 -12.873 19.253 1.00 0.00 O ATOM 507 CB PRO A 54 12.240 -15.791 18.921 1.00 0.00 C ATOM 508 CG PRO A 54 13.619 -16.366 18.921 1.00 0.00 C ATOM 509 CD PRO A 54 14.276 -15.904 17.613 1.00 0.00 C ATOM 0 HA PRO A 54 11.461 -14.152 17.674 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.872 -15.644 19.936 1.00 0.00 H new ATOM 0 HB3 PRO A 54 11.534 -16.453 18.419 1.00 0.00 H new ATOM 0 HG2 PRO A 54 14.186 -16.019 19.785 1.00 0.00 H new ATOM 0 HG3 PRO A 54 13.587 -17.454 18.977 1.00 0.00 H new ATOM 0 HD2 PRO A 54 15.330 -15.669 17.758 1.00 0.00 H new ATOM 0 HD3 PRO A 54 14.224 -16.677 16.846 1.00 0.00 H new ATOM 517 N SER A 55 11.714 -12.823 19.862 1.00 0.00 N ATOM 518 CA SER A 55 11.975 -11.709 20.819 1.00 0.00 C ATOM 519 C SER A 55 10.913 -11.709 21.919 1.00 0.00 C ATOM 520 O SER A 55 9.852 -12.285 21.777 1.00 0.00 O ATOM 521 CB SER A 55 11.920 -10.374 20.073 1.00 0.00 C ATOM 522 OG SER A 55 13.109 -10.204 19.315 1.00 0.00 O ATOM 0 H SER A 55 10.747 -13.146 19.822 1.00 0.00 H new ATOM 0 HA SER A 55 12.960 -11.846 21.265 1.00 0.00 H new ATOM 0 HB2 SER A 55 11.051 -10.348 19.416 1.00 0.00 H new ATOM 0 HB3 SER A 55 11.808 -9.554 20.782 1.00 0.00 H new ATOM 0 HG SER A 55 13.586 -11.058 19.258 1.00 0.00 H new ATOM 528 N VAL A 56 11.193 -11.045 23.010 1.00 0.00 N ATOM 529 CA VAL A 56 10.210 -10.968 24.137 1.00 0.00 C ATOM 530 C VAL A 56 9.484 -9.621 24.057 1.00 0.00 C ATOM 531 O VAL A 56 10.089 -8.572 24.155 1.00 0.00 O ATOM 532 CB VAL A 56 10.946 -11.121 25.489 1.00 0.00 C ATOM 533 CG1 VAL A 56 11.587 -9.796 25.932 1.00 0.00 C ATOM 534 CG2 VAL A 56 9.951 -11.575 26.563 1.00 0.00 C ATOM 0 H VAL A 56 12.069 -10.547 23.172 1.00 0.00 H new ATOM 0 HA VAL A 56 9.481 -11.775 24.060 1.00 0.00 H new ATOM 0 HB VAL A 56 11.735 -11.862 25.361 1.00 0.00 H new ATOM 0 HG11 VAL A 56 12.096 -9.939 26.885 1.00 0.00 H new ATOM 0 HG12 VAL A 56 12.307 -9.471 25.181 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.813 -9.037 26.044 1.00 0.00 H new ATOM 0 HG21 VAL A 56 10.469 -11.683 27.516 1.00 0.00 H new ATOM 0 HG22 VAL A 56 9.159 -10.833 26.662 1.00 0.00 H new ATOM 0 HG23 VAL A 56 9.517 -12.532 26.275 1.00 0.00 H new ATOM 544 N LEU A 57 8.194 -9.640 23.850 1.00 0.00 N ATOM 545 CA LEU A 57 7.428 -8.362 23.735 1.00 0.00 C ATOM 546 C LEU A 57 6.747 -8.019 25.052 1.00 0.00 C ATOM 547 O LEU A 57 6.297 -8.873 25.791 1.00 0.00 O ATOM 548 CB LEU A 57 6.356 -8.495 22.661 1.00 0.00 C ATOM 549 CG LEU A 57 7.001 -8.869 21.321 1.00 0.00 C ATOM 550 CD1 LEU A 57 5.895 -9.105 20.287 1.00 0.00 C ATOM 551 CD2 LEU A 57 7.924 -7.732 20.848 1.00 0.00 C ATOM 0 H LEU A 57 7.635 -10.488 23.755 1.00 0.00 H new ATOM 0 HA LEU A 57 8.132 -7.572 23.474 1.00 0.00 H new ATOM 0 HB2 LEU A 57 5.632 -9.256 22.951 1.00 0.00 H new ATOM 0 HB3 LEU A 57 5.810 -7.557 22.562 1.00 0.00 H new ATOM 0 HG LEU A 57 7.595 -9.775 21.439 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.343 -9.372 19.330 1.00 0.00 H new ATOM 0 HD12 LEU A 57 5.249 -9.916 20.624 1.00 0.00 H new ATOM 0 HD13 LEU A 57 5.305 -8.196 20.171 1.00 0.00 H new ATOM 0 HD21 LEU A 57 8.379 -8.005 19.896 1.00 0.00 H new ATOM 0 HD22 LEU A 57 7.342 -6.819 20.724 1.00 0.00 H new ATOM 0 HD23 LEU A 57 8.706 -7.566 21.589 1.00 0.00 H new ATOM 563 N ASP A 58 6.661 -6.753 25.327 1.00 0.00 N ATOM 564 CA ASP A 58 6.005 -6.265 26.567 1.00 0.00 C ATOM 565 C ASP A 58 4.584 -5.784 26.193 1.00 0.00 C ATOM 566 O ASP A 58 4.417 -5.089 25.211 1.00 0.00 O ATOM 567 CB ASP A 58 6.845 -5.101 27.102 1.00 0.00 C ATOM 568 CG ASP A 58 6.038 -4.267 28.099 1.00 0.00 C ATOM 569 OD1 ASP A 58 5.079 -3.646 27.680 1.00 0.00 O ATOM 570 OD2 ASP A 58 6.394 -4.265 29.266 1.00 0.00 O ATOM 0 H ASP A 58 7.028 -6.015 24.727 1.00 0.00 H new ATOM 0 HA ASP A 58 5.931 -7.042 27.328 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.743 -5.486 27.585 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.173 -4.472 26.275 1.00 0.00 H new ATOM 575 N PRO A 59 3.562 -6.154 26.937 1.00 0.00 N ATOM 576 CA PRO A 59 2.158 -5.744 26.617 1.00 0.00 C ATOM 577 C PRO A 59 1.859 -4.281 26.978 1.00 0.00 C ATOM 578 O PRO A 59 0.887 -3.711 26.525 1.00 0.00 O ATOM 579 CB PRO A 59 1.313 -6.697 27.472 1.00 0.00 C ATOM 580 CG PRO A 59 2.165 -6.988 28.664 1.00 0.00 C ATOM 581 CD PRO A 59 3.613 -6.993 28.155 1.00 0.00 C ATOM 0 HA PRO A 59 1.954 -5.805 25.548 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.368 -6.237 27.762 1.00 0.00 H new ATOM 0 HB3 PRO A 59 1.069 -7.609 26.927 1.00 0.00 H new ATOM 0 HG2 PRO A 59 2.026 -6.233 29.438 1.00 0.00 H new ATOM 0 HG3 PRO A 59 1.903 -7.949 29.106 1.00 0.00 H new ATOM 0 HD2 PRO A 59 4.299 -6.582 28.896 1.00 0.00 H new ATOM 0 HD3 PRO A 59 3.955 -8.003 27.931 1.00 0.00 H new ATOM 589 N ALA A 60 2.676 -3.672 27.792 1.00 0.00 N ATOM 590 CA ALA A 60 2.427 -2.254 28.184 1.00 0.00 C ATOM 591 C ALA A 60 3.058 -1.308 27.157 1.00 0.00 C ATOM 592 O ALA A 60 2.472 -0.318 26.767 1.00 0.00 O ATOM 593 CB ALA A 60 3.040 -2.006 29.564 1.00 0.00 C ATOM 0 H ALA A 60 3.508 -4.095 28.204 1.00 0.00 H new ATOM 0 HA ALA A 60 1.354 -2.067 28.218 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.864 -0.972 29.860 1.00 0.00 H new ATOM 0 HB2 ALA A 60 2.581 -2.675 30.292 1.00 0.00 H new ATOM 0 HB3 ALA A 60 4.113 -2.194 29.525 1.00 0.00 H new ATOM 599 N LYS A 61 4.254 -1.600 26.727 1.00 0.00 N ATOM 600 CA LYS A 61 4.934 -0.718 25.741 1.00 0.00 C ATOM 601 C LYS A 61 4.245 -0.844 24.372 1.00 0.00 C ATOM 602 O LYS A 61 4.192 0.101 23.610 1.00 0.00 O ATOM 603 CB LYS A 61 6.427 -1.123 25.651 1.00 0.00 C ATOM 604 CG LYS A 61 7.321 0.120 25.688 1.00 0.00 C ATOM 605 CD LYS A 61 8.775 -0.279 25.410 1.00 0.00 C ATOM 606 CE LYS A 61 9.295 -1.188 26.531 1.00 0.00 C ATOM 607 NZ LYS A 61 10.784 -1.151 26.546 1.00 0.00 N ATOM 0 H LYS A 61 4.791 -2.416 27.019 1.00 0.00 H new ATOM 0 HA LYS A 61 4.869 0.323 26.058 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.681 -1.786 26.478 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.605 -1.679 24.731 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.984 0.844 24.946 1.00 0.00 H new ATOM 0 HG3 LYS A 61 7.247 0.604 26.662 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.842 -0.795 24.452 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.397 0.613 25.336 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.902 -0.859 27.493 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.947 -2.209 26.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.139 -1.767 27.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.149 -1.484 25.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.105 -0.176 26.712 1.00 0.00 H new ATOM 621 N VAL A 62 3.713 -1.995 24.053 1.00 0.00 N ATOM 622 CA VAL A 62 3.031 -2.155 22.736 1.00 0.00 C ATOM 623 C VAL A 62 1.750 -1.317 22.734 1.00 0.00 C ATOM 624 O VAL A 62 1.374 -0.743 21.732 1.00 0.00 O ATOM 625 CB VAL A 62 2.684 -3.631 22.507 1.00 0.00 C ATOM 626 CG1 VAL A 62 1.793 -3.764 21.269 1.00 0.00 C ATOM 627 CG2 VAL A 62 3.972 -4.434 22.294 1.00 0.00 C ATOM 0 H VAL A 62 3.721 -2.826 24.644 1.00 0.00 H new ATOM 0 HA VAL A 62 3.692 -1.819 21.937 1.00 0.00 H new ATOM 0 HB VAL A 62 2.155 -4.015 23.379 1.00 0.00 H new ATOM 0 HG11 VAL A 62 1.548 -4.814 21.108 1.00 0.00 H new ATOM 0 HG12 VAL A 62 0.875 -3.196 21.419 1.00 0.00 H new ATOM 0 HG13 VAL A 62 2.321 -3.377 20.397 1.00 0.00 H new ATOM 0 HG21 VAL A 62 3.724 -5.483 22.131 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.502 -4.047 21.424 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.607 -4.344 23.175 1.00 0.00 H new ATOM 637 N GLN A 63 1.082 -1.235 23.852 1.00 0.00 N ATOM 638 CA GLN A 63 -0.168 -0.426 23.913 1.00 0.00 C ATOM 639 C GLN A 63 0.198 1.049 23.726 1.00 0.00 C ATOM 640 O GLN A 63 -0.530 1.808 23.117 1.00 0.00 O ATOM 641 CB GLN A 63 -0.851 -0.632 25.278 1.00 0.00 C ATOM 642 CG GLN A 63 -1.775 -1.857 25.226 1.00 0.00 C ATOM 643 CD GLN A 63 -3.064 -1.496 24.483 1.00 0.00 C ATOM 644 OE1 GLN A 63 -3.118 -0.504 23.785 1.00 0.00 O ATOM 645 NE2 GLN A 63 -4.111 -2.266 24.606 1.00 0.00 N ATOM 0 H GLN A 63 1.347 -1.692 24.724 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.857 -0.737 23.128 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -0.097 -0.768 26.054 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -1.425 0.255 25.544 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -1.272 -2.683 24.723 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -2.008 -2.193 26.236 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -4.065 -3.099 25.192 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -4.975 -2.034 24.116 1.00 0.00 H new ATOM 654 N SER A 64 1.326 1.457 24.241 1.00 0.00 N ATOM 655 CA SER A 64 1.743 2.878 24.088 1.00 0.00 C ATOM 656 C SER A 64 2.014 3.167 22.610 1.00 0.00 C ATOM 657 O SER A 64 1.702 4.228 22.108 1.00 0.00 O ATOM 658 CB SER A 64 3.017 3.127 24.899 1.00 0.00 C ATOM 659 OG SER A 64 3.382 4.496 24.799 1.00 0.00 O ATOM 0 H SER A 64 1.976 0.867 24.761 1.00 0.00 H new ATOM 0 HA SER A 64 0.951 3.533 24.450 1.00 0.00 H new ATOM 0 HB2 SER A 64 2.855 2.858 25.943 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.825 2.496 24.529 1.00 0.00 H new ATOM 0 HG SER A 64 4.357 4.579 24.854 1.00 0.00 H new ATOM 665 N LEU A 65 2.588 2.228 21.907 1.00 0.00 N ATOM 666 CA LEU A 65 2.873 2.442 20.466 1.00 0.00 C ATOM 667 C LEU A 65 1.562 2.319 19.683 1.00 0.00 C ATOM 668 O LEU A 65 1.245 3.143 18.849 1.00 0.00 O ATOM 669 CB LEU A 65 3.887 1.378 20.001 1.00 0.00 C ATOM 670 CG LEU A 65 5.328 1.918 20.132 1.00 0.00 C ATOM 671 CD1 LEU A 65 6.310 0.749 20.258 1.00 0.00 C ATOM 672 CD2 LEU A 65 5.692 2.752 18.896 1.00 0.00 C ATOM 0 H LEU A 65 2.872 1.319 22.274 1.00 0.00 H new ATOM 0 HA LEU A 65 3.295 3.432 20.295 1.00 0.00 H new ATOM 0 HB2 LEU A 65 3.775 0.473 20.598 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.687 1.103 18.965 1.00 0.00 H new ATOM 0 HG LEU A 65 5.388 2.545 21.022 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.325 1.135 20.350 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.064 0.161 21.142 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.241 0.118 19.372 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.710 3.128 18.998 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.623 2.130 18.004 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.002 3.591 18.807 1.00 0.00 H new ATOM 684 N VAL A 66 0.792 1.304 19.957 1.00 0.00 N ATOM 685 CA VAL A 66 -0.501 1.137 19.244 1.00 0.00 C ATOM 686 C VAL A 66 -1.319 2.420 19.424 1.00 0.00 C ATOM 687 O VAL A 66 -2.041 2.840 18.541 1.00 0.00 O ATOM 688 CB VAL A 66 -1.240 -0.064 19.855 1.00 0.00 C ATOM 689 CG1 VAL A 66 -2.719 -0.043 19.469 1.00 0.00 C ATOM 690 CG2 VAL A 66 -0.603 -1.360 19.348 1.00 0.00 C ATOM 0 H VAL A 66 1.004 0.582 20.646 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.346 0.957 18.180 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.162 -0.007 20.941 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.223 -0.902 19.912 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.178 0.875 19.835 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.813 -0.088 18.384 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.124 -2.215 19.779 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -0.676 -1.401 18.261 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.446 -1.389 19.642 1.00 0.00 H new ATOM 700 N ASP A 67 -1.200 3.046 20.561 1.00 0.00 N ATOM 701 CA ASP A 67 -1.952 4.304 20.812 1.00 0.00 C ATOM 702 C ASP A 67 -1.274 5.466 20.073 1.00 0.00 C ATOM 703 O ASP A 67 -1.924 6.388 19.625 1.00 0.00 O ATOM 704 CB ASP A 67 -1.956 4.584 22.320 1.00 0.00 C ATOM 705 CG ASP A 67 -3.053 3.760 23.001 1.00 0.00 C ATOM 706 OD1 ASP A 67 -3.274 2.638 22.575 1.00 0.00 O ATOM 707 OD2 ASP A 67 -3.653 4.265 23.935 1.00 0.00 O ATOM 0 H ASP A 67 -0.609 2.737 21.333 1.00 0.00 H new ATOM 0 HA ASP A 67 -2.976 4.203 20.451 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.984 4.336 22.747 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -2.122 5.646 22.501 1.00 0.00 H new ATOM 712 N THR A 68 0.026 5.435 19.953 1.00 0.00 N ATOM 713 CA THR A 68 0.737 6.541 19.254 1.00 0.00 C ATOM 714 C THR A 68 0.377 6.517 17.767 1.00 0.00 C ATOM 715 O THR A 68 -0.026 7.512 17.198 1.00 0.00 O ATOM 716 CB THR A 68 2.248 6.357 19.423 1.00 0.00 C ATOM 717 OG1 THR A 68 2.530 5.991 20.766 1.00 0.00 O ATOM 718 CG2 THR A 68 2.967 7.664 19.091 1.00 0.00 C ATOM 0 H THR A 68 0.626 4.691 20.309 1.00 0.00 H new ATOM 0 HA THR A 68 0.439 7.498 19.681 1.00 0.00 H new ATOM 0 HB THR A 68 2.595 5.574 18.749 1.00 0.00 H new ATOM 0 HG1 THR A 68 2.244 5.067 20.920 1.00 0.00 H new ATOM 0 HG21 THR A 68 4.042 7.529 19.212 1.00 0.00 H new ATOM 0 HG22 THR A 68 2.751 7.947 18.061 1.00 0.00 H new ATOM 0 HG23 THR A 68 2.622 8.450 19.763 1.00 0.00 H new ATOM 726 N ILE A 69 0.517 5.385 17.137 1.00 0.00 N ATOM 727 CA ILE A 69 0.180 5.288 15.690 1.00 0.00 C ATOM 728 C ILE A 69 -1.284 5.696 15.486 1.00 0.00 C ATOM 729 O ILE A 69 -1.623 6.381 14.541 1.00 0.00 O ATOM 730 CB ILE A 69 0.391 3.842 15.217 1.00 0.00 C ATOM 731 CG1 ILE A 69 1.828 3.404 15.547 1.00 0.00 C ATOM 732 CG2 ILE A 69 0.163 3.753 13.701 1.00 0.00 C ATOM 733 CD1 ILE A 69 2.134 2.055 14.889 1.00 0.00 C ATOM 0 H ILE A 69 0.851 4.520 17.563 1.00 0.00 H new ATOM 0 HA ILE A 69 0.823 5.952 15.112 1.00 0.00 H new ATOM 0 HB ILE A 69 -0.318 3.188 15.725 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.535 4.156 15.197 1.00 0.00 H new ATOM 0 HG13 ILE A 69 1.954 3.327 16.627 1.00 0.00 H new ATOM 0 HG21 ILE A 69 0.314 2.725 13.370 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -0.855 4.064 13.467 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.868 4.407 13.188 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.154 1.756 15.130 1.00 0.00 H new ATOM 0 HD12 ILE A 69 1.438 1.303 15.260 1.00 0.00 H new ATOM 0 HD13 ILE A 69 2.028 2.145 13.808 1.00 0.00 H new ATOM 745 N ARG A 70 -2.154 5.268 16.359 1.00 0.00 N ATOM 746 CA ARG A 70 -3.601 5.614 16.216 1.00 0.00 C ATOM 747 C ARG A 70 -3.852 7.065 16.665 1.00 0.00 C ATOM 748 O ARG A 70 -4.722 7.736 16.146 1.00 0.00 O ATOM 749 CB ARG A 70 -4.438 4.640 17.080 1.00 0.00 C ATOM 750 CG ARG A 70 -4.936 3.466 16.228 1.00 0.00 C ATOM 751 CD ARG A 70 -5.807 2.546 17.086 1.00 0.00 C ATOM 752 NE ARG A 70 -6.237 1.372 16.277 1.00 0.00 N ATOM 753 CZ ARG A 70 -6.798 0.348 16.859 1.00 0.00 C ATOM 754 NH1 ARG A 70 -6.982 0.352 18.151 1.00 0.00 N ATOM 755 NH2 ARG A 70 -7.174 -0.681 16.150 1.00 0.00 N ATOM 0 H ARG A 70 -1.926 4.691 17.169 1.00 0.00 H new ATOM 0 HA ARG A 70 -3.893 5.524 15.170 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -3.835 4.267 17.908 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -5.286 5.167 17.516 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -5.508 3.837 15.378 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -4.089 2.911 15.825 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -5.250 2.213 17.962 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -6.679 3.089 17.450 1.00 0.00 H new ATOM 0 HE ARG A 70 -6.093 1.368 15.267 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -6.687 1.156 18.706 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -7.421 -0.449 18.606 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -7.029 -0.685 15.140 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -7.613 -1.481 16.606 1.00 0.00 H new ATOM 769 N GLU A 71 -3.115 7.552 17.627 1.00 0.00 N ATOM 770 CA GLU A 71 -3.335 8.949 18.104 1.00 0.00 C ATOM 771 C GLU A 71 -2.538 9.925 17.238 1.00 0.00 C ATOM 772 O GLU A 71 -2.968 11.030 16.974 1.00 0.00 O ATOM 773 CB GLU A 71 -2.870 9.062 19.558 1.00 0.00 C ATOM 774 CG GLU A 71 -3.291 10.416 20.129 1.00 0.00 C ATOM 775 CD GLU A 71 -4.812 10.451 20.293 1.00 0.00 C ATOM 776 OE1 GLU A 71 -5.315 9.720 21.130 1.00 0.00 O ATOM 777 OE2 GLU A 71 -5.447 11.209 19.579 1.00 0.00 O ATOM 0 H GLU A 71 -2.370 7.043 18.103 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.395 9.193 18.034 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -3.301 8.256 20.152 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.787 8.954 19.613 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -2.807 10.583 21.091 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.968 11.218 19.466 1.00 0.00 H new ATOM 784 N ASP A 72 -1.374 9.531 16.803 1.00 0.00 N ATOM 785 CA ASP A 72 -0.544 10.443 15.963 1.00 0.00 C ATOM 786 C ASP A 72 0.486 9.615 15.171 1.00 0.00 C ATOM 787 O ASP A 72 1.493 9.213 15.720 1.00 0.00 O ATOM 788 CB ASP A 72 0.198 11.416 16.880 1.00 0.00 C ATOM 789 CG ASP A 72 0.812 12.540 16.044 1.00 0.00 C ATOM 790 OD1 ASP A 72 1.060 12.311 14.871 1.00 0.00 O ATOM 791 OD2 ASP A 72 1.024 13.610 16.589 1.00 0.00 O ATOM 0 H ASP A 72 -0.960 8.618 16.992 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.183 10.991 15.270 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.488 11.831 17.618 1.00 0.00 H new ATOM 0 HB3 ASP A 72 0.978 10.890 17.430 1.00 0.00 H new ATOM 796 N PRO A 73 0.253 9.338 13.901 1.00 0.00 N ATOM 797 CA PRO A 73 1.210 8.524 13.090 1.00 0.00 C ATOM 798 C PRO A 73 2.492 9.293 12.712 1.00 0.00 C ATOM 799 O PRO A 73 3.427 8.722 12.186 1.00 0.00 O ATOM 800 CB PRO A 73 0.398 8.150 11.841 1.00 0.00 C ATOM 801 CG PRO A 73 -0.598 9.254 11.683 1.00 0.00 C ATOM 802 CD PRO A 73 -0.925 9.748 13.097 1.00 0.00 C ATOM 0 HA PRO A 73 1.574 7.661 13.647 1.00 0.00 H new ATOM 0 HB2 PRO A 73 1.039 8.068 10.963 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.097 7.187 11.966 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -0.190 10.061 11.074 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -1.496 8.897 11.179 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -1.067 10.828 13.120 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -1.843 9.298 13.475 1.00 0.00 H new ATOM 810 N ASP A 74 2.547 10.577 12.965 1.00 0.00 N ATOM 811 CA ASP A 74 3.772 11.359 12.607 1.00 0.00 C ATOM 812 C ASP A 74 4.807 11.285 13.742 1.00 0.00 C ATOM 813 O ASP A 74 5.997 11.348 13.507 1.00 0.00 O ATOM 814 CB ASP A 74 3.388 12.823 12.356 1.00 0.00 C ATOM 815 CG ASP A 74 2.692 12.943 10.998 1.00 0.00 C ATOM 816 OD1 ASP A 74 3.172 12.340 10.052 1.00 0.00 O ATOM 817 OD2 ASP A 74 1.689 13.635 10.928 1.00 0.00 O ATOM 0 H ASP A 74 1.800 11.117 13.402 1.00 0.00 H new ATOM 0 HA ASP A 74 4.211 10.933 11.705 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.728 13.178 13.147 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.278 13.452 12.377 1.00 0.00 H new ATOM 822 N SER A 75 4.371 11.151 14.969 1.00 0.00 N ATOM 823 CA SER A 75 5.338 11.075 16.103 1.00 0.00 C ATOM 824 C SER A 75 5.948 9.669 16.159 1.00 0.00 C ATOM 825 O SER A 75 6.441 9.242 17.184 1.00 0.00 O ATOM 826 CB SER A 75 4.597 11.358 17.412 1.00 0.00 C ATOM 827 OG SER A 75 3.328 10.721 17.383 1.00 0.00 O ATOM 0 H SER A 75 3.388 11.091 15.233 1.00 0.00 H new ATOM 0 HA SER A 75 6.130 11.810 15.961 1.00 0.00 H new ATOM 0 HB2 SER A 75 5.180 10.994 18.258 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.474 12.432 17.548 1.00 0.00 H new ATOM 0 HG SER A 75 2.991 10.621 18.298 1.00 0.00 H new ATOM 833 N VAL A 76 5.908 8.944 15.065 1.00 0.00 N ATOM 834 CA VAL A 76 6.471 7.555 15.035 1.00 0.00 C ATOM 835 C VAL A 76 7.465 7.452 13.856 1.00 0.00 C ATOM 836 O VAL A 76 7.050 7.379 12.716 1.00 0.00 O ATOM 837 CB VAL A 76 5.308 6.564 14.827 1.00 0.00 C ATOM 838 CG1 VAL A 76 5.682 5.174 15.361 1.00 0.00 C ATOM 839 CG2 VAL A 76 4.073 7.076 15.574 1.00 0.00 C ATOM 0 H VAL A 76 5.505 9.259 14.183 1.00 0.00 H new ATOM 0 HA VAL A 76 6.988 7.324 15.967 1.00 0.00 H new ATOM 0 HB VAL A 76 5.098 6.485 13.760 1.00 0.00 H new ATOM 0 HG11 VAL A 76 4.849 4.488 15.206 1.00 0.00 H new ATOM 0 HG12 VAL A 76 6.560 4.805 14.831 1.00 0.00 H new ATOM 0 HG13 VAL A 76 5.903 5.241 16.426 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.247 6.380 15.431 1.00 0.00 H new ATOM 0 HG22 VAL A 76 4.299 7.158 16.637 1.00 0.00 H new ATOM 0 HG23 VAL A 76 3.793 8.056 15.186 1.00 0.00 H new ATOM 849 N PRO A 77 8.761 7.469 14.104 1.00 0.00 N ATOM 850 CA PRO A 77 9.772 7.400 13.007 1.00 0.00 C ATOM 851 C PRO A 77 9.927 5.986 12.419 1.00 0.00 C ATOM 852 O PRO A 77 9.532 5.009 13.024 1.00 0.00 O ATOM 853 CB PRO A 77 11.075 7.872 13.672 1.00 0.00 C ATOM 854 CG PRO A 77 10.911 7.590 15.138 1.00 0.00 C ATOM 855 CD PRO A 77 9.402 7.554 15.433 1.00 0.00 C ATOM 0 HA PRO A 77 9.478 8.013 12.155 1.00 0.00 H new ATOM 0 HB2 PRO A 77 11.936 7.341 13.266 1.00 0.00 H new ATOM 0 HB3 PRO A 77 11.242 8.934 13.494 1.00 0.00 H new ATOM 0 HG2 PRO A 77 11.376 6.640 15.401 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.400 8.360 15.734 1.00 0.00 H new ATOM 0 HD2 PRO A 77 9.140 6.697 16.054 1.00 0.00 H new ATOM 0 HD3 PRO A 77 9.082 8.447 15.970 1.00 0.00 H new ATOM 863 N PRO A 78 10.504 5.887 11.242 1.00 0.00 N ATOM 864 CA PRO A 78 10.723 4.577 10.553 1.00 0.00 C ATOM 865 C PRO A 78 11.859 3.773 11.191 1.00 0.00 C ATOM 866 O PRO A 78 12.568 4.256 12.052 1.00 0.00 O ATOM 867 CB PRO A 78 11.083 4.984 9.117 1.00 0.00 C ATOM 868 CG PRO A 78 11.710 6.334 9.250 1.00 0.00 C ATOM 869 CD PRO A 78 11.014 7.015 10.434 1.00 0.00 C ATOM 0 HA PRO A 78 9.849 3.929 10.614 1.00 0.00 H new ATOM 0 HB2 PRO A 78 11.772 4.271 8.664 1.00 0.00 H new ATOM 0 HB3 PRO A 78 10.198 5.020 8.482 1.00 0.00 H new ATOM 0 HG2 PRO A 78 12.782 6.249 9.425 1.00 0.00 H new ATOM 0 HG3 PRO A 78 11.581 6.915 8.337 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.708 7.633 11.004 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.206 7.666 10.102 1.00 0.00 H new ATOM 877 N ILE A 79 12.032 2.549 10.764 1.00 0.00 N ATOM 878 CA ILE A 79 13.120 1.684 11.324 1.00 0.00 C ATOM 879 C ILE A 79 14.168 1.427 10.239 1.00 0.00 C ATOM 880 O ILE A 79 13.936 1.661 9.072 1.00 0.00 O ATOM 881 CB ILE A 79 12.522 0.343 11.774 1.00 0.00 C ATOM 882 CG1 ILE A 79 11.511 -0.151 10.721 1.00 0.00 C ATOM 883 CG2 ILE A 79 11.817 0.520 13.124 1.00 0.00 C ATOM 884 CD1 ILE A 79 11.339 -1.665 10.842 1.00 0.00 C ATOM 0 H ILE A 79 11.462 2.105 10.044 1.00 0.00 H new ATOM 0 HA ILE A 79 13.584 2.184 12.175 1.00 0.00 H new ATOM 0 HB ILE A 79 13.321 -0.391 11.879 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.551 0.346 10.863 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.858 0.106 9.720 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.394 -0.433 13.441 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.536 0.863 13.868 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.019 1.256 13.024 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.623 -2.011 10.096 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.299 -2.154 10.678 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.972 -1.911 11.838 1.00 0.00 H new ATOM 896 N ASP A 80 15.317 0.935 10.616 1.00 0.00 N ATOM 897 CA ASP A 80 16.378 0.650 9.607 1.00 0.00 C ATOM 898 C ASP A 80 16.190 -0.775 9.086 1.00 0.00 C ATOM 899 O ASP A 80 15.949 -1.695 9.843 1.00 0.00 O ATOM 900 CB ASP A 80 17.757 0.780 10.261 1.00 0.00 C ATOM 901 CG ASP A 80 18.831 0.898 9.176 1.00 0.00 C ATOM 902 OD1 ASP A 80 18.898 1.941 8.547 1.00 0.00 O ATOM 903 OD2 ASP A 80 19.567 -0.058 8.992 1.00 0.00 O ATOM 0 H ASP A 80 15.567 0.718 11.581 1.00 0.00 H new ATOM 0 HA ASP A 80 16.307 1.359 8.783 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.782 1.656 10.909 1.00 0.00 H new ATOM 0 HB3 ASP A 80 17.955 -0.087 10.890 1.00 0.00 H new ATOM 908 N VAL A 81 16.288 -0.961 7.799 1.00 0.00 N ATOM 909 CA VAL A 81 16.106 -2.323 7.206 1.00 0.00 C ATOM 910 C VAL A 81 17.182 -2.556 6.139 1.00 0.00 C ATOM 911 O VAL A 81 17.515 -1.676 5.370 1.00 0.00 O ATOM 912 CB VAL A 81 14.695 -2.404 6.597 1.00 0.00 C ATOM 913 CG1 VAL A 81 14.596 -3.557 5.595 1.00 0.00 C ATOM 914 CG2 VAL A 81 13.677 -2.628 7.720 1.00 0.00 C ATOM 0 H VAL A 81 16.488 -0.223 7.124 1.00 0.00 H new ATOM 0 HA VAL A 81 16.208 -3.096 7.968 1.00 0.00 H new ATOM 0 HB VAL A 81 14.488 -1.470 6.074 1.00 0.00 H new ATOM 0 HG11 VAL A 81 13.589 -3.592 5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 81 15.315 -3.403 4.791 1.00 0.00 H new ATOM 0 HG13 VAL A 81 14.813 -4.498 6.101 1.00 0.00 H new ATOM 0 HG21 VAL A 81 12.675 -2.686 7.296 1.00 0.00 H new ATOM 0 HG22 VAL A 81 13.906 -3.559 8.239 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.725 -1.798 8.425 1.00 0.00 H new ATOM 924 N LEU A 82 17.738 -3.738 6.105 1.00 0.00 N ATOM 925 CA LEU A 82 18.807 -4.047 5.111 1.00 0.00 C ATOM 926 C LEU A 82 18.182 -4.517 3.794 1.00 0.00 C ATOM 927 O LEU A 82 17.369 -5.419 3.765 1.00 0.00 O ATOM 928 CB LEU A 82 19.705 -5.157 5.670 1.00 0.00 C ATOM 929 CG LEU A 82 20.286 -4.732 7.038 1.00 0.00 C ATOM 930 CD1 LEU A 82 20.614 -5.974 7.871 1.00 0.00 C ATOM 931 CD2 LEU A 82 21.567 -3.915 6.834 1.00 0.00 C ATOM 0 H LEU A 82 17.495 -4.508 6.728 1.00 0.00 H new ATOM 0 HA LEU A 82 19.395 -3.148 4.925 1.00 0.00 H new ATOM 0 HB2 LEU A 82 19.132 -6.078 5.780 1.00 0.00 H new ATOM 0 HB3 LEU A 82 20.515 -5.367 4.971 1.00 0.00 H new ATOM 0 HG LEU A 82 19.546 -4.124 7.559 1.00 0.00 H new ATOM 0 HD11 LEU A 82 21.023 -5.669 8.834 1.00 0.00 H new ATOM 0 HD12 LEU A 82 19.706 -6.555 8.030 1.00 0.00 H new ATOM 0 HD13 LEU A 82 21.347 -6.584 7.342 1.00 0.00 H new ATOM 0 HD21 LEU A 82 21.969 -3.620 7.803 1.00 0.00 H new ATOM 0 HD22 LEU A 82 22.304 -4.519 6.305 1.00 0.00 H new ATOM 0 HD23 LEU A 82 21.341 -3.024 6.249 1.00 0.00 H new ATOM 943 N TRP A 83 18.564 -3.906 2.702 1.00 0.00 N ATOM 944 CA TRP A 83 18.016 -4.293 1.366 1.00 0.00 C ATOM 945 C TRP A 83 19.081 -5.099 0.616 1.00 0.00 C ATOM 946 O TRP A 83 20.104 -4.568 0.232 1.00 0.00 O ATOM 947 CB TRP A 83 17.703 -3.003 0.605 1.00 0.00 C ATOM 948 CG TRP A 83 17.209 -3.264 -0.787 1.00 0.00 C ATOM 949 CD1 TRP A 83 16.766 -4.447 -1.293 1.00 0.00 C ATOM 950 CD2 TRP A 83 17.102 -2.298 -1.865 1.00 0.00 C ATOM 951 NE1 TRP A 83 16.402 -4.253 -2.619 1.00 0.00 N ATOM 952 CE2 TRP A 83 16.595 -2.944 -3.014 1.00 0.00 C ATOM 953 CE3 TRP A 83 17.403 -0.929 -1.947 1.00 0.00 C ATOM 954 CZ2 TRP A 83 16.392 -2.251 -4.209 1.00 0.00 C ATOM 955 CZ3 TRP A 83 17.201 -0.228 -3.147 1.00 0.00 C ATOM 956 CH2 TRP A 83 16.698 -0.889 -4.275 1.00 0.00 C ATOM 0 H TRP A 83 19.242 -3.144 2.679 1.00 0.00 H new ATOM 0 HA TRP A 83 17.115 -4.898 1.464 1.00 0.00 H new ATOM 0 HB2 TRP A 83 16.952 -2.434 1.153 1.00 0.00 H new ATOM 0 HB3 TRP A 83 18.600 -2.385 0.559 1.00 0.00 H new ATOM 0 HD1 TRP A 83 16.707 -5.381 -0.753 1.00 0.00 H new ATOM 0 HE1 TRP A 83 16.037 -4.987 -3.226 1.00 0.00 H new ATOM 0 HE3 TRP A 83 17.792 -0.412 -1.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 16.001 -2.764 -5.076 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 17.434 0.825 -3.200 1.00 0.00 H new ATOM 0 HH2 TRP A 83 16.547 -0.346 -5.196 1.00 0.00 H new ATOM 967 N ILE A 84 18.858 -6.378 0.416 1.00 0.00 N ATOM 968 CA ILE A 84 19.869 -7.227 -0.299 1.00 0.00 C ATOM 969 C ILE A 84 19.193 -7.980 -1.445 1.00 0.00 C ATOM 970 O ILE A 84 18.074 -8.440 -1.331 1.00 0.00 O ATOM 971 CB ILE A 84 20.482 -8.230 0.684 1.00 0.00 C ATOM 972 CG1 ILE A 84 20.957 -7.488 1.935 1.00 0.00 C ATOM 973 CG2 ILE A 84 21.682 -8.919 0.029 1.00 0.00 C ATOM 974 CD1 ILE A 84 21.683 -8.463 2.862 1.00 0.00 C ATOM 0 H ILE A 84 18.018 -6.872 0.717 1.00 0.00 H new ATOM 0 HA ILE A 84 20.655 -6.588 -0.703 1.00 0.00 H new ATOM 0 HB ILE A 84 19.733 -8.974 0.956 1.00 0.00 H new ATOM 0 HG12 ILE A 84 21.623 -6.671 1.655 1.00 0.00 H new ATOM 0 HG13 ILE A 84 20.107 -7.043 2.452 1.00 0.00 H new ATOM 0 HG21 ILE A 84 22.118 -9.632 0.728 1.00 0.00 H new ATOM 0 HG22 ILE A 84 21.355 -9.444 -0.868 1.00 0.00 H new ATOM 0 HG23 ILE A 84 22.429 -8.172 -0.240 1.00 0.00 H new ATOM 0 HD11 ILE A 84 22.021 -7.934 3.753 1.00 0.00 H new ATOM 0 HD12 ILE A 84 21.003 -9.264 3.152 1.00 0.00 H new ATOM 0 HD13 ILE A 84 22.543 -8.887 2.343 1.00 0.00 H new ATOM 986 N LYS A 85 19.872 -8.092 -2.558 1.00 0.00 N ATOM 987 CA LYS A 85 19.304 -8.792 -3.749 1.00 0.00 C ATOM 988 C LYS A 85 19.958 -10.173 -3.891 1.00 0.00 C ATOM 989 O LYS A 85 21.048 -10.409 -3.409 1.00 0.00 O ATOM 990 CB LYS A 85 19.593 -7.916 -4.996 1.00 0.00 C ATOM 991 CG LYS A 85 18.296 -7.570 -5.734 1.00 0.00 C ATOM 992 CD LYS A 85 18.566 -6.470 -6.768 1.00 0.00 C ATOM 993 CE LYS A 85 17.239 -5.865 -7.228 1.00 0.00 C ATOM 994 NZ LYS A 85 16.601 -5.155 -6.087 1.00 0.00 N ATOM 0 H LYS A 85 20.813 -7.721 -2.693 1.00 0.00 H new ATOM 0 HA LYS A 85 18.229 -8.937 -3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 85 20.099 -6.999 -4.692 1.00 0.00 H new ATOM 0 HB3 LYS A 85 20.269 -8.445 -5.668 1.00 0.00 H new ATOM 0 HG2 LYS A 85 17.900 -8.457 -6.228 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.540 -7.236 -5.023 1.00 0.00 H new ATOM 0 HD2 LYS A 85 19.200 -5.696 -6.334 1.00 0.00 H new ATOM 0 HD3 LYS A 85 19.105 -6.882 -7.621 1.00 0.00 H new ATOM 0 HE2 LYS A 85 17.408 -5.173 -8.053 1.00 0.00 H new ATOM 0 HE3 LYS A 85 16.578 -6.648 -7.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 15.567 -5.246 -6.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 16.927 -5.573 -5.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.863 -4.149 -6.114 1.00 0.00 H new ATOM 1008 N GLY A 86 19.288 -11.088 -4.545 1.00 0.00 N ATOM 1009 CA GLY A 86 19.847 -12.461 -4.720 1.00 0.00 C ATOM 1010 C GLY A 86 20.490 -12.603 -6.099 1.00 0.00 C ATOM 1011 O GLY A 86 20.681 -11.641 -6.816 1.00 0.00 O ATOM 0 H GLY A 86 18.371 -10.941 -4.968 1.00 0.00 H new ATOM 0 HA2 GLY A 86 20.587 -12.661 -3.945 1.00 0.00 H new ATOM 0 HA3 GLY A 86 19.055 -13.201 -4.603 1.00 0.00 H new ATOM 1015 N ALA A 87 20.834 -13.807 -6.462 1.00 0.00 N ATOM 1016 CA ALA A 87 21.480 -14.051 -7.782 1.00 0.00 C ATOM 1017 C ALA A 87 20.481 -13.828 -8.927 1.00 0.00 C ATOM 1018 O ALA A 87 20.852 -13.870 -10.084 1.00 0.00 O ATOM 1019 CB ALA A 87 21.994 -15.497 -7.823 1.00 0.00 C ATOM 0 H ALA A 87 20.693 -14.642 -5.894 1.00 0.00 H new ATOM 0 HA ALA A 87 22.307 -13.352 -7.908 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.469 -15.687 -8.785 1.00 0.00 H new ATOM 0 HB2 ALA A 87 22.720 -15.648 -7.024 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.159 -16.184 -7.689 1.00 0.00 H new ATOM 1025 N GLN A 88 19.218 -13.611 -8.626 1.00 0.00 N ATOM 1026 CA GLN A 88 18.200 -13.406 -9.715 1.00 0.00 C ATOM 1027 C GLN A 88 17.364 -12.145 -9.450 1.00 0.00 C ATOM 1028 O GLN A 88 16.178 -12.111 -9.711 1.00 0.00 O ATOM 1029 CB GLN A 88 17.286 -14.631 -9.774 1.00 0.00 C ATOM 1030 CG GLN A 88 18.148 -15.897 -9.781 1.00 0.00 C ATOM 1031 CD GLN A 88 17.302 -17.099 -10.202 1.00 0.00 C ATOM 1032 OE1 GLN A 88 16.161 -16.947 -10.592 1.00 0.00 O ATOM 1033 NE2 GLN A 88 17.816 -18.299 -10.140 1.00 0.00 N ATOM 0 H GLN A 88 18.848 -13.567 -7.676 1.00 0.00 H new ATOM 0 HA GLN A 88 18.716 -13.277 -10.666 1.00 0.00 H new ATOM 0 HB2 GLN A 88 16.612 -14.639 -8.917 1.00 0.00 H new ATOM 0 HB3 GLN A 88 16.664 -14.594 -10.669 1.00 0.00 H new ATOM 0 HG2 GLN A 88 18.986 -15.773 -10.467 1.00 0.00 H new ATOM 0 HG3 GLN A 88 18.569 -16.067 -8.790 1.00 0.00 H new ATOM 0 HE21 GLN A 88 18.774 -18.427 -9.813 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.260 -19.107 -10.419 1.00 0.00 H new ATOM 1042 N GLY A 89 17.980 -11.098 -8.971 1.00 0.00 N ATOM 1043 CA GLY A 89 17.238 -9.825 -8.729 1.00 0.00 C ATOM 1044 C GLY A 89 16.220 -9.970 -7.589 1.00 0.00 C ATOM 1045 O GLY A 89 15.664 -8.996 -7.125 1.00 0.00 O ATOM 0 H GLY A 89 18.972 -11.069 -8.735 1.00 0.00 H new ATOM 0 HA2 GLY A 89 17.945 -9.032 -8.487 1.00 0.00 H new ATOM 0 HA3 GLY A 89 16.723 -9.525 -9.641 1.00 0.00 H new ATOM 1049 N GLY A 90 15.961 -11.163 -7.136 1.00 0.00 N ATOM 1050 CA GLY A 90 14.975 -11.344 -6.038 1.00 0.00 C ATOM 1051 C GLY A 90 15.327 -10.423 -4.873 1.00 0.00 C ATOM 1052 O GLY A 90 16.300 -10.623 -4.175 1.00 0.00 O ATOM 0 H GLY A 90 16.391 -12.022 -7.480 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.970 -11.123 -6.398 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.973 -12.382 -5.706 1.00 0.00 H new ATOM 1056 N ASP A 91 14.535 -9.417 -4.658 1.00 0.00 N ATOM 1057 CA ASP A 91 14.803 -8.479 -3.539 1.00 0.00 C ATOM 1058 C ASP A 91 14.364 -9.129 -2.227 1.00 0.00 C ATOM 1059 O ASP A 91 13.292 -9.693 -2.131 1.00 0.00 O ATOM 1060 CB ASP A 91 14.013 -7.188 -3.748 1.00 0.00 C ATOM 1061 CG ASP A 91 14.549 -6.443 -4.968 1.00 0.00 C ATOM 1062 OD1 ASP A 91 15.054 -7.100 -5.862 1.00 0.00 O ATOM 1063 OD2 ASP A 91 14.444 -5.228 -4.989 1.00 0.00 O ATOM 0 H ASP A 91 13.707 -9.202 -5.213 1.00 0.00 H new ATOM 0 HA ASP A 91 15.868 -8.250 -3.504 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.956 -7.416 -3.886 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.090 -6.557 -2.863 1.00 0.00 H new ATOM 1068 N TYR A 92 15.187 -9.048 -1.216 1.00 0.00 N ATOM 1069 CA TYR A 92 14.844 -9.650 0.111 1.00 0.00 C ATOM 1070 C TYR A 92 15.048 -8.586 1.193 1.00 0.00 C ATOM 1071 O TYR A 92 16.103 -7.991 1.291 1.00 0.00 O ATOM 1072 CB TYR A 92 15.763 -10.848 0.363 1.00 0.00 C ATOM 1073 CG TYR A 92 15.531 -11.889 -0.713 1.00 0.00 C ATOM 1074 CD1 TYR A 92 14.502 -12.830 -0.570 1.00 0.00 C ATOM 1075 CD2 TYR A 92 16.339 -11.911 -1.857 1.00 0.00 C ATOM 1076 CE1 TYR A 92 14.284 -13.789 -1.566 1.00 0.00 C ATOM 1077 CE2 TYR A 92 16.120 -12.870 -2.852 1.00 0.00 C ATOM 1078 CZ TYR A 92 15.093 -13.809 -2.707 1.00 0.00 C ATOM 1079 OH TYR A 92 14.878 -14.754 -3.689 1.00 0.00 O ATOM 0 H TYR A 92 16.095 -8.585 -1.251 1.00 0.00 H new ATOM 0 HA TYR A 92 13.808 -9.988 0.127 1.00 0.00 H new ATOM 0 HB2 TYR A 92 16.805 -10.529 0.359 1.00 0.00 H new ATOM 0 HB3 TYR A 92 15.564 -11.274 1.347 1.00 0.00 H new ATOM 0 HD1 TYR A 92 13.876 -12.815 0.310 1.00 0.00 H new ATOM 0 HD2 TYR A 92 17.132 -11.187 -1.971 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.491 -14.514 -1.454 1.00 0.00 H new ATOM 0 HE2 TYR A 92 16.744 -12.885 -3.733 1.00 0.00 H new ATOM 0 HH TYR A 92 15.526 -14.627 -4.413 1.00 0.00 H new ATOM 1089 N PHE A 93 14.039 -8.321 1.992 1.00 0.00 N ATOM 1090 CA PHE A 93 14.160 -7.274 3.049 1.00 0.00 C ATOM 1091 C PHE A 93 14.380 -7.927 4.414 1.00 0.00 C ATOM 1092 O PHE A 93 13.547 -8.655 4.913 1.00 0.00 O ATOM 1093 CB PHE A 93 12.874 -6.439 3.065 1.00 0.00 C ATOM 1094 CG PHE A 93 12.664 -5.809 1.703 1.00 0.00 C ATOM 1095 CD1 PHE A 93 13.419 -4.691 1.317 1.00 0.00 C ATOM 1096 CD2 PHE A 93 11.723 -6.353 0.816 1.00 0.00 C ATOM 1097 CE1 PHE A 93 13.232 -4.123 0.052 1.00 0.00 C ATOM 1098 CE2 PHE A 93 11.541 -5.784 -0.450 1.00 0.00 C ATOM 1099 CZ PHE A 93 12.296 -4.670 -0.831 1.00 0.00 C ATOM 0 H PHE A 93 13.134 -8.790 1.954 1.00 0.00 H new ATOM 0 HA PHE A 93 15.014 -6.631 2.834 1.00 0.00 H new ATOM 0 HB2 PHE A 93 12.022 -7.069 3.322 1.00 0.00 H new ATOM 0 HB3 PHE A 93 12.940 -5.665 3.829 1.00 0.00 H new ATOM 0 HD1 PHE A 93 14.145 -4.269 1.996 1.00 0.00 H new ATOM 0 HD2 PHE A 93 11.138 -7.212 1.110 1.00 0.00 H new ATOM 0 HE1 PHE A 93 13.812 -3.261 -0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 93 10.818 -6.205 -1.132 1.00 0.00 H new ATOM 0 HZ PHE A 93 12.156 -4.232 -1.808 1.00 0.00 H new ATOM 1109 N TYR A 94 15.508 -7.662 5.016 1.00 0.00 N ATOM 1110 CA TYR A 94 15.830 -8.247 6.351 1.00 0.00 C ATOM 1111 C TYR A 94 15.690 -7.162 7.421 1.00 0.00 C ATOM 1112 O TYR A 94 16.179 -6.062 7.260 1.00 0.00 O ATOM 1113 CB TYR A 94 17.289 -8.749 6.325 1.00 0.00 C ATOM 1114 CG TYR A 94 17.326 -10.217 5.996 1.00 0.00 C ATOM 1115 CD1 TYR A 94 17.389 -10.635 4.665 1.00 0.00 C ATOM 1116 CD2 TYR A 94 17.292 -11.154 7.029 1.00 0.00 C ATOM 1117 CE1 TYR A 94 17.421 -11.999 4.365 1.00 0.00 C ATOM 1118 CE2 TYR A 94 17.323 -12.520 6.729 1.00 0.00 C ATOM 1119 CZ TYR A 94 17.388 -12.943 5.397 1.00 0.00 C ATOM 1120 OH TYR A 94 17.418 -14.291 5.101 1.00 0.00 O ATOM 0 H TYR A 94 16.232 -7.055 4.633 1.00 0.00 H new ATOM 0 HA TYR A 94 15.152 -9.071 6.576 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.861 -8.188 5.586 1.00 0.00 H new ATOM 0 HB3 TYR A 94 17.759 -8.573 7.293 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.413 -9.905 3.869 1.00 0.00 H new ATOM 0 HD2 TYR A 94 17.242 -10.826 8.057 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.471 -12.325 3.337 1.00 0.00 H new ATOM 0 HE2 TYR A 94 17.297 -13.248 7.526 1.00 0.00 H new ATOM 0 HH TYR A 94 17.389 -14.809 5.932 1.00 0.00 H new ATOM 1130 N SER A 95 15.044 -7.470 8.517 1.00 0.00 N ATOM 1131 CA SER A 95 14.885 -6.464 9.616 1.00 0.00 C ATOM 1132 C SER A 95 15.403 -7.062 10.928 1.00 0.00 C ATOM 1133 O SER A 95 15.113 -8.191 11.269 1.00 0.00 O ATOM 1134 CB SER A 95 13.401 -6.088 9.758 1.00 0.00 C ATOM 1135 OG SER A 95 13.295 -4.731 10.162 1.00 0.00 O ATOM 0 H SER A 95 14.617 -8.378 8.700 1.00 0.00 H new ATOM 0 HA SER A 95 15.457 -5.567 9.380 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.884 -6.238 8.810 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.919 -6.736 10.490 1.00 0.00 H new ATOM 0 HG SER A 95 12.544 -4.308 9.695 1.00 0.00 H new ATOM 1141 N PHE A 96 16.151 -6.294 11.673 1.00 0.00 N ATOM 1142 CA PHE A 96 16.681 -6.772 12.979 1.00 0.00 C ATOM 1143 C PHE A 96 16.482 -5.646 13.993 1.00 0.00 C ATOM 1144 O PHE A 96 17.327 -4.788 14.159 1.00 0.00 O ATOM 1145 CB PHE A 96 18.172 -7.048 12.859 1.00 0.00 C ATOM 1146 CG PHE A 96 18.404 -8.308 12.058 1.00 0.00 C ATOM 1147 CD1 PHE A 96 18.114 -9.556 12.618 1.00 0.00 C ATOM 1148 CD2 PHE A 96 18.931 -8.229 10.767 1.00 0.00 C ATOM 1149 CE1 PHE A 96 18.349 -10.724 11.882 1.00 0.00 C ATOM 1150 CE2 PHE A 96 19.172 -9.394 10.035 1.00 0.00 C ATOM 1151 CZ PHE A 96 18.879 -10.642 10.592 1.00 0.00 C ATOM 0 H PHE A 96 16.420 -5.342 11.427 1.00 0.00 H new ATOM 0 HA PHE A 96 16.167 -7.684 13.284 1.00 0.00 H new ATOM 0 HB2 PHE A 96 18.668 -6.205 12.378 1.00 0.00 H new ATOM 0 HB3 PHE A 96 18.611 -7.152 13.851 1.00 0.00 H new ATOM 0 HD1 PHE A 96 17.709 -9.619 13.617 1.00 0.00 H new ATOM 0 HD2 PHE A 96 19.153 -7.265 10.334 1.00 0.00 H new ATOM 0 HE1 PHE A 96 18.121 -11.688 12.312 1.00 0.00 H new ATOM 0 HE2 PHE A 96 19.585 -9.330 9.039 1.00 0.00 H new ATOM 0 HZ PHE A 96 19.062 -11.543 10.025 1.00 0.00 H new ATOM 1161 N GLY A 97 15.370 -5.642 14.661 1.00 0.00 N ATOM 1162 CA GLY A 97 15.076 -4.577 15.669 1.00 0.00 C ATOM 1163 C GLY A 97 13.631 -4.102 15.477 1.00 0.00 C ATOM 1164 O GLY A 97 12.834 -4.761 14.838 1.00 0.00 O ATOM 0 H GLY A 97 14.635 -6.341 14.554 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.215 -4.964 16.679 1.00 0.00 H new ATOM 0 HA3 GLY A 97 15.767 -3.743 15.549 1.00 0.00 H new ATOM 1168 N GLY A 98 13.290 -2.958 16.009 1.00 0.00 N ATOM 1169 CA GLY A 98 11.900 -2.436 15.838 1.00 0.00 C ATOM 1170 C GLY A 98 10.875 -3.553 16.086 1.00 0.00 C ATOM 1171 O GLY A 98 9.770 -3.508 15.584 1.00 0.00 O ATOM 0 H GLY A 98 13.913 -2.362 16.554 1.00 0.00 H new ATOM 0 HA2 GLY A 98 11.726 -1.613 16.531 1.00 0.00 H new ATOM 0 HA3 GLY A 98 11.776 -2.036 14.831 1.00 0.00 H new ATOM 1175 N CYS A 99 11.227 -4.557 16.847 1.00 0.00 N ATOM 1176 CA CYS A 99 10.266 -5.666 17.106 1.00 0.00 C ATOM 1177 C CYS A 99 8.987 -5.111 17.743 1.00 0.00 C ATOM 1178 O CYS A 99 7.897 -5.317 17.249 1.00 0.00 O ATOM 1179 CB CYS A 99 10.916 -6.688 18.045 1.00 0.00 C ATOM 1180 SG CYS A 99 12.665 -6.871 17.616 1.00 0.00 S ATOM 0 H CYS A 99 12.136 -4.655 17.298 1.00 0.00 H new ATOM 0 HA CYS A 99 10.007 -6.150 16.164 1.00 0.00 H new ATOM 0 HB2 CYS A 99 10.816 -6.362 19.080 1.00 0.00 H new ATOM 0 HB3 CYS A 99 10.408 -7.649 17.963 1.00 0.00 H new ATOM 0 HG CYS A 99 13.219 -7.736 18.413 1.00 0.00 H new ATOM 1186 N HIS A 100 9.108 -4.413 18.838 1.00 0.00 N ATOM 1187 CA HIS A 100 7.894 -3.854 19.499 1.00 0.00 C ATOM 1188 C HIS A 100 7.110 -3.002 18.497 1.00 0.00 C ATOM 1189 O HIS A 100 5.896 -3.032 18.464 1.00 0.00 O ATOM 1190 CB HIS A 100 8.316 -2.997 20.702 1.00 0.00 C ATOM 1191 CG HIS A 100 8.610 -3.889 21.884 1.00 0.00 C ATOM 1192 ND1 HIS A 100 9.742 -4.688 21.940 1.00 0.00 N ATOM 1193 CD2 HIS A 100 7.925 -4.127 23.054 1.00 0.00 C ATOM 1194 CE1 HIS A 100 9.706 -5.362 23.105 1.00 0.00 C ATOM 1195 NE2 HIS A 100 8.621 -5.058 23.821 1.00 0.00 N ATOM 0 H HIS A 100 9.992 -4.206 19.303 1.00 0.00 H new ATOM 0 HA HIS A 100 7.258 -4.669 19.846 1.00 0.00 H new ATOM 0 HB2 HIS A 100 9.198 -2.409 20.450 1.00 0.00 H new ATOM 0 HB3 HIS A 100 7.524 -2.292 20.954 1.00 0.00 H new ATOM 0 HD1 HIS A 100 10.470 -4.753 21.228 1.00 0.00 H new ATOM 0 HD2 HIS A 100 6.991 -3.663 23.334 1.00 0.00 H new ATOM 0 HE1 HIS A 100 10.463 -6.064 23.422 1.00 0.00 H new ATOM 1203 N ARG A 101 7.786 -2.245 17.678 1.00 0.00 N ATOM 1204 CA ARG A 101 7.059 -1.403 16.687 1.00 0.00 C ATOM 1205 C ARG A 101 6.375 -2.306 15.655 1.00 0.00 C ATOM 1206 O ARG A 101 5.325 -1.981 15.138 1.00 0.00 O ATOM 1207 CB ARG A 101 8.040 -0.448 15.997 1.00 0.00 C ATOM 1208 CG ARG A 101 8.430 0.665 16.978 1.00 0.00 C ATOM 1209 CD ARG A 101 9.308 1.705 16.274 1.00 0.00 C ATOM 1210 NE ARG A 101 10.711 1.204 16.204 1.00 0.00 N ATOM 1211 CZ ARG A 101 11.703 2.046 16.085 1.00 0.00 C ATOM 1212 NH1 ARG A 101 11.467 3.327 16.005 1.00 0.00 N ATOM 1213 NH2 ARG A 101 12.931 1.606 16.042 1.00 0.00 N ATOM 0 H ARG A 101 8.803 -2.173 17.651 1.00 0.00 H new ATOM 0 HA ARG A 101 6.300 -0.811 17.198 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.928 -0.991 15.672 1.00 0.00 H new ATOM 0 HB3 ARG A 101 7.583 -0.020 15.105 1.00 0.00 H new ATOM 0 HG2 ARG A 101 7.533 1.143 17.373 1.00 0.00 H new ATOM 0 HG3 ARG A 101 8.966 0.241 17.827 1.00 0.00 H new ATOM 0 HD2 ARG A 101 8.929 1.898 15.270 1.00 0.00 H new ATOM 0 HD3 ARG A 101 9.275 2.651 16.815 1.00 0.00 H new ATOM 0 HE ARG A 101 10.896 0.202 16.249 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.507 3.672 16.035 1.00 0.00 H new ATOM 0 HH12 ARG A 101 12.242 3.984 15.912 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.116 0.605 16.101 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.705 2.263 15.949 1.00 0.00 H new ATOM 1227 N TYR A 102 6.945 -3.445 15.361 1.00 0.00 N ATOM 1228 CA TYR A 102 6.304 -4.363 14.378 1.00 0.00 C ATOM 1229 C TYR A 102 4.993 -4.884 14.981 1.00 0.00 C ATOM 1230 O TYR A 102 3.983 -4.969 14.314 1.00 0.00 O ATOM 1231 CB TYR A 102 7.255 -5.532 14.072 1.00 0.00 C ATOM 1232 CG TYR A 102 6.511 -6.641 13.364 1.00 0.00 C ATOM 1233 CD1 TYR A 102 5.807 -7.582 14.119 1.00 0.00 C ATOM 1234 CD2 TYR A 102 6.525 -6.733 11.966 1.00 0.00 C ATOM 1235 CE1 TYR A 102 5.113 -8.615 13.484 1.00 0.00 C ATOM 1236 CE2 TYR A 102 5.829 -7.770 11.328 1.00 0.00 C ATOM 1237 CZ TYR A 102 5.122 -8.710 12.088 1.00 0.00 C ATOM 1238 OH TYR A 102 4.438 -9.730 11.460 1.00 0.00 O ATOM 0 H TYR A 102 7.824 -3.777 15.758 1.00 0.00 H new ATOM 0 HA TYR A 102 6.092 -3.836 13.448 1.00 0.00 H new ATOM 0 HB2 TYR A 102 8.081 -5.185 13.451 1.00 0.00 H new ATOM 0 HB3 TYR A 102 7.689 -5.909 14.998 1.00 0.00 H new ATOM 0 HD1 TYR A 102 5.799 -7.511 15.197 1.00 0.00 H new ATOM 0 HD2 TYR A 102 7.070 -6.007 11.381 1.00 0.00 H new ATOM 0 HE1 TYR A 102 4.569 -9.341 14.071 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.838 -7.844 10.251 1.00 0.00 H new ATOM 0 HH TYR A 102 4.547 -9.648 10.490 1.00 0.00 H new ATOM 1248 N ALA A 103 5.006 -5.229 16.240 1.00 0.00 N ATOM 1249 CA ALA A 103 3.765 -5.737 16.895 1.00 0.00 C ATOM 1250 C ALA A 103 2.671 -4.670 16.826 1.00 0.00 C ATOM 1251 O ALA A 103 1.524 -4.962 16.555 1.00 0.00 O ATOM 1252 CB ALA A 103 4.059 -6.062 18.361 1.00 0.00 C ATOM 0 H ALA A 103 5.825 -5.181 16.846 1.00 0.00 H new ATOM 0 HA ALA A 103 3.429 -6.636 16.379 1.00 0.00 H new ATOM 0 HB1 ALA A 103 3.153 -6.433 18.840 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.837 -6.824 18.416 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.397 -5.161 18.873 1.00 0.00 H new ATOM 1258 N ALA A 104 3.013 -3.436 17.076 1.00 0.00 N ATOM 1259 CA ALA A 104 1.985 -2.360 17.029 1.00 0.00 C ATOM 1260 C ALA A 104 1.409 -2.264 15.614 1.00 0.00 C ATOM 1261 O ALA A 104 0.210 -2.196 15.426 1.00 0.00 O ATOM 1262 CB ALA A 104 2.622 -1.023 17.420 1.00 0.00 C ATOM 0 H ALA A 104 3.957 -3.128 17.310 1.00 0.00 H new ATOM 0 HA ALA A 104 1.183 -2.594 17.729 1.00 0.00 H new ATOM 0 HB1 ALA A 104 1.868 -0.237 17.385 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.026 -1.094 18.430 1.00 0.00 H new ATOM 0 HB3 ALA A 104 3.426 -0.786 16.724 1.00 0.00 H new ATOM 1268 N TYR A 105 2.250 -2.264 14.617 1.00 0.00 N ATOM 1269 CA TYR A 105 1.752 -2.179 13.220 1.00 0.00 C ATOM 1270 C TYR A 105 1.024 -3.484 12.867 1.00 0.00 C ATOM 1271 O TYR A 105 -0.015 -3.476 12.237 1.00 0.00 O ATOM 1272 CB TYR A 105 2.957 -1.972 12.282 1.00 0.00 C ATOM 1273 CG TYR A 105 3.203 -0.495 12.055 1.00 0.00 C ATOM 1274 CD1 TYR A 105 2.438 0.203 11.113 1.00 0.00 C ATOM 1275 CD2 TYR A 105 4.197 0.171 12.781 1.00 0.00 C ATOM 1276 CE1 TYR A 105 2.667 1.567 10.898 1.00 0.00 C ATOM 1277 CE2 TYR A 105 4.427 1.535 12.565 1.00 0.00 C ATOM 1278 CZ TYR A 105 3.662 2.233 11.624 1.00 0.00 C ATOM 1279 OH TYR A 105 3.889 3.577 11.411 1.00 0.00 O ATOM 0 H TYR A 105 3.264 -2.319 14.712 1.00 0.00 H new ATOM 0 HA TYR A 105 1.058 -1.345 13.110 1.00 0.00 H new ATOM 0 HB2 TYR A 105 3.845 -2.433 12.714 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.773 -2.467 11.329 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.671 -0.311 10.552 1.00 0.00 H new ATOM 0 HD2 TYR A 105 4.787 -0.367 13.508 1.00 0.00 H new ATOM 0 HE1 TYR A 105 2.076 2.106 10.172 1.00 0.00 H new ATOM 0 HE2 TYR A 105 5.195 2.048 13.125 1.00 0.00 H new ATOM 0 HH TYR A 105 4.612 3.883 11.997 1.00 0.00 H new ATOM 1289 N GLN A 106 1.566 -4.602 13.265 1.00 0.00 N ATOM 1290 CA GLN A 106 0.920 -5.901 12.955 1.00 0.00 C ATOM 1291 C GLN A 106 -0.402 -6.005 13.717 1.00 0.00 C ATOM 1292 O GLN A 106 -1.357 -6.591 13.248 1.00 0.00 O ATOM 1293 CB GLN A 106 1.858 -7.039 13.383 1.00 0.00 C ATOM 1294 CG GLN A 106 1.346 -8.404 12.844 1.00 0.00 C ATOM 1295 CD GLN A 106 0.945 -9.333 14.002 1.00 0.00 C ATOM 1296 OE1 GLN A 106 0.048 -8.942 14.869 1.00 0.00 O flip ATOM 1297 NE2 GLN A 106 1.457 -10.429 14.117 1.00 0.00 N flip ATOM 0 H GLN A 106 2.435 -4.668 13.795 1.00 0.00 H new ATOM 0 HA GLN A 106 0.723 -5.973 11.885 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.864 -6.848 13.008 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.924 -7.073 14.470 1.00 0.00 H new ATOM 0 HG2 GLN A 106 0.491 -8.243 12.188 1.00 0.00 H new ATOM 0 HG3 GLN A 106 2.123 -8.878 12.244 1.00 0.00 H new ATOM 0 HE21 GLN A 106 2.157 -10.738 13.443 1.00 0.00 H new ATOM 0 HE22 GLN A 106 1.186 -11.040 14.888 1.00 0.00 H new ATOM 1306 N GLN A 107 -0.463 -5.438 14.891 1.00 0.00 N ATOM 1307 CA GLN A 107 -1.720 -5.501 15.686 1.00 0.00 C ATOM 1308 C GLN A 107 -2.783 -4.614 15.033 1.00 0.00 C ATOM 1309 O GLN A 107 -3.937 -4.982 14.935 1.00 0.00 O ATOM 1310 CB GLN A 107 -1.444 -5.015 17.114 1.00 0.00 C ATOM 1311 CG GLN A 107 -2.761 -4.949 17.907 1.00 0.00 C ATOM 1312 CD GLN A 107 -2.475 -5.071 19.408 1.00 0.00 C ATOM 1313 OE1 GLN A 107 -1.517 -4.513 19.904 1.00 0.00 O ATOM 1314 NE2 GLN A 107 -3.275 -5.785 20.154 1.00 0.00 N ATOM 0 H GLN A 107 0.305 -4.933 15.334 1.00 0.00 H new ATOM 0 HA GLN A 107 -2.081 -6.529 15.718 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -0.745 -5.689 17.608 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -0.975 -4.032 17.089 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.273 -4.009 17.701 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -3.427 -5.751 17.589 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.079 -6.253 19.736 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.095 -5.874 21.154 1.00 0.00 H new ATOM 1323 N LEU A 108 -2.404 -3.448 14.583 1.00 0.00 N ATOM 1324 CA LEU A 108 -3.394 -2.541 13.935 1.00 0.00 C ATOM 1325 C LEU A 108 -3.769 -3.096 12.559 1.00 0.00 C ATOM 1326 O LEU A 108 -4.387 -2.427 11.755 1.00 0.00 O ATOM 1327 CB LEU A 108 -2.781 -1.146 13.778 1.00 0.00 C ATOM 1328 CG LEU A 108 -2.613 -0.497 15.164 1.00 0.00 C ATOM 1329 CD1 LEU A 108 -1.825 0.814 15.023 1.00 0.00 C ATOM 1330 CD2 LEU A 108 -3.994 -0.214 15.796 1.00 0.00 C ATOM 0 H LEU A 108 -1.452 -3.085 14.636 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.289 -2.475 14.554 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.815 -1.216 13.279 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -3.420 -0.525 13.150 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.067 -1.182 15.813 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.706 1.274 16.004 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.843 0.604 14.599 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -2.366 1.495 14.366 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -3.859 0.245 16.775 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -4.557 0.463 15.153 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.542 -1.150 15.906 1.00 0.00 H new ATOM 1342 N GLN A 109 -3.407 -4.319 12.289 1.00 0.00 N ATOM 1343 CA GLN A 109 -3.746 -4.931 10.974 1.00 0.00 C ATOM 1344 C GLN A 109 -3.412 -3.962 9.836 1.00 0.00 C ATOM 1345 O GLN A 109 -4.073 -3.943 8.817 1.00 0.00 O ATOM 1346 CB GLN A 109 -5.241 -5.258 10.937 1.00 0.00 C ATOM 1347 CG GLN A 109 -5.644 -5.959 12.236 1.00 0.00 C ATOM 1348 CD GLN A 109 -4.815 -7.234 12.407 1.00 0.00 C ATOM 1349 OE1 GLN A 109 -4.347 -7.802 11.441 1.00 0.00 O ATOM 1350 NE2 GLN A 109 -4.614 -7.711 13.605 1.00 0.00 N ATOM 0 H GLN A 109 -2.888 -4.924 12.926 1.00 0.00 H new ATOM 0 HA GLN A 109 -3.163 -5.843 10.847 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -5.821 -4.344 10.810 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -5.463 -5.897 10.083 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -5.486 -5.294 13.085 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -6.706 -6.203 12.215 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -5.007 -7.234 14.416 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -4.064 -8.561 13.730 1.00 0.00 H new ATOM 1359 N ARG A 110 -2.388 -3.165 9.987 1.00 0.00 N ATOM 1360 CA ARG A 110 -2.025 -2.221 8.898 1.00 0.00 C ATOM 1361 C ARG A 110 -1.499 -3.025 7.713 1.00 0.00 C ATOM 1362 O ARG A 110 -1.050 -4.143 7.859 1.00 0.00 O ATOM 1363 CB ARG A 110 -0.942 -1.251 9.390 1.00 0.00 C ATOM 1364 CG ARG A 110 -1.530 -0.259 10.415 1.00 0.00 C ATOM 1365 CD ARG A 110 -2.155 0.944 9.693 1.00 0.00 C ATOM 1366 NE ARG A 110 -2.891 1.789 10.678 1.00 0.00 N ATOM 1367 CZ ARG A 110 -2.258 2.697 11.371 1.00 0.00 C ATOM 1368 NH1 ARG A 110 -0.973 2.864 11.214 1.00 0.00 N ATOM 1369 NH2 ARG A 110 -2.912 3.438 12.224 1.00 0.00 N ATOM 0 H ARG A 110 -1.792 -3.129 10.814 1.00 0.00 H new ATOM 0 HA ARG A 110 -2.900 -1.645 8.598 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -0.124 -1.810 9.844 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -0.524 -0.704 8.545 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -2.284 -0.758 11.024 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -0.747 0.081 11.093 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -1.378 1.531 9.203 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -2.835 0.601 8.913 1.00 0.00 H new ATOM 0 HE ARG A 110 -3.894 1.657 10.811 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -0.461 2.285 10.549 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -0.481 3.574 11.756 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -3.916 3.307 12.348 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -2.419 4.148 12.766 1.00 0.00 H new ATOM 1383 N GLU A 111 -1.574 -2.473 6.538 1.00 0.00 N ATOM 1384 CA GLU A 111 -1.099 -3.211 5.332 1.00 0.00 C ATOM 1385 C GLU A 111 0.428 -3.111 5.201 1.00 0.00 C ATOM 1386 O GLU A 111 1.083 -4.072 4.845 1.00 0.00 O ATOM 1387 CB GLU A 111 -1.761 -2.622 4.082 1.00 0.00 C ATOM 1388 CG GLU A 111 -3.225 -3.064 4.023 1.00 0.00 C ATOM 1389 CD GLU A 111 -3.981 -2.486 5.221 1.00 0.00 C ATOM 1390 OE1 GLU A 111 -4.124 -1.276 5.279 1.00 0.00 O ATOM 1391 OE2 GLU A 111 -4.403 -3.264 6.061 1.00 0.00 O ATOM 0 H GLU A 111 -1.944 -1.540 6.357 1.00 0.00 H new ATOM 0 HA GLU A 111 -1.370 -4.262 5.435 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -1.699 -1.534 4.103 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -1.234 -2.954 3.188 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -3.681 -2.724 3.093 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -3.288 -4.152 4.030 1.00 0.00 H new ATOM 1398 N THR A 112 1.003 -1.956 5.458 1.00 0.00 N ATOM 1399 CA THR A 112 2.491 -1.803 5.315 1.00 0.00 C ATOM 1400 C THR A 112 3.075 -1.079 6.526 1.00 0.00 C ATOM 1401 O THR A 112 2.364 -0.655 7.415 1.00 0.00 O ATOM 1402 CB THR A 112 2.779 -0.964 4.069 1.00 0.00 C ATOM 1403 OG1 THR A 112 2.026 0.239 4.136 1.00 0.00 O ATOM 1404 CG2 THR A 112 2.390 -1.736 2.796 1.00 0.00 C ATOM 0 H THR A 112 0.509 -1.116 5.759 1.00 0.00 H new ATOM 0 HA THR A 112 2.942 -2.792 5.236 1.00 0.00 H new ATOM 0 HB THR A 112 3.845 -0.741 4.031 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.947 0.626 3.239 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.602 -1.123 1.920 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.966 -2.660 2.741 1.00 0.00 H new ATOM 0 HG23 THR A 112 1.326 -1.972 2.825 1.00 0.00 H new ATOM 1412 N ILE A 113 4.380 -0.926 6.552 1.00 0.00 N ATOM 1413 CA ILE A 113 5.041 -0.212 7.697 1.00 0.00 C ATOM 1414 C ILE A 113 6.170 0.692 7.164 1.00 0.00 C ATOM 1415 O ILE A 113 6.890 0.290 6.271 1.00 0.00 O ATOM 1416 CB ILE A 113 5.655 -1.233 8.664 1.00 0.00 C ATOM 1417 CG1 ILE A 113 6.106 -0.505 9.934 1.00 0.00 C ATOM 1418 CG2 ILE A 113 6.872 -1.912 8.018 1.00 0.00 C ATOM 1419 CD1 ILE A 113 6.531 -1.525 10.993 1.00 0.00 C ATOM 0 H ILE A 113 5.017 -1.264 5.830 1.00 0.00 H new ATOM 0 HA ILE A 113 4.292 0.387 8.214 1.00 0.00 H new ATOM 0 HB ILE A 113 4.910 -1.991 8.905 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.936 0.163 9.706 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.295 0.114 10.317 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.298 -2.634 8.715 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.562 -2.425 7.108 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.621 -1.159 7.772 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.851 -1.002 11.894 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.689 -2.175 11.230 1.00 0.00 H new ATOM 0 HD13 ILE A 113 7.356 -2.125 10.610 1.00 0.00 H new ATOM 1431 N PRO A 114 6.375 1.885 7.704 1.00 0.00 N ATOM 1432 CA PRO A 114 7.491 2.756 7.232 1.00 0.00 C ATOM 1433 C PRO A 114 8.850 2.143 7.595 1.00 0.00 C ATOM 1434 O PRO A 114 9.084 1.756 8.723 1.00 0.00 O ATOM 1435 CB PRO A 114 7.279 4.100 7.966 1.00 0.00 C ATOM 1436 CG PRO A 114 5.897 4.030 8.544 1.00 0.00 C ATOM 1437 CD PRO A 114 5.611 2.549 8.785 1.00 0.00 C ATOM 0 HA PRO A 114 7.490 2.876 6.149 1.00 0.00 H new ATOM 0 HB2 PRO A 114 8.025 4.241 8.749 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.375 4.941 7.279 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.835 4.595 9.474 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.166 4.461 7.860 1.00 0.00 H new ATOM 0 HD2 PRO A 114 5.945 2.228 9.772 1.00 0.00 H new ATOM 0 HD3 PRO A 114 4.546 2.328 8.722 1.00 0.00 H new ATOM 1445 N ALA A 115 9.742 2.049 6.651 1.00 0.00 N ATOM 1446 CA ALA A 115 11.082 1.457 6.941 1.00 0.00 C ATOM 1447 C ALA A 115 12.138 2.106 6.044 1.00 0.00 C ATOM 1448 O ALA A 115 11.954 2.252 4.852 1.00 0.00 O ATOM 1449 CB ALA A 115 11.044 -0.049 6.670 1.00 0.00 C ATOM 0 H ALA A 115 9.604 2.356 5.688 1.00 0.00 H new ATOM 0 HA ALA A 115 11.335 1.635 7.986 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.022 -0.482 6.882 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.295 -0.515 7.310 1.00 0.00 H new ATOM 0 HB3 ALA A 115 10.788 -0.224 5.625 1.00 0.00 H new ATOM 1455 N LYS A 116 13.244 2.492 6.615 1.00 0.00 N ATOM 1456 CA LYS A 116 14.324 3.128 5.815 1.00 0.00 C ATOM 1457 C LYS A 116 15.100 2.041 5.063 1.00 0.00 C ATOM 1458 O LYS A 116 15.747 1.204 5.662 1.00 0.00 O ATOM 1459 CB LYS A 116 15.273 3.877 6.767 1.00 0.00 C ATOM 1460 CG LYS A 116 14.709 5.267 7.082 1.00 0.00 C ATOM 1461 CD LYS A 116 15.716 6.053 7.932 1.00 0.00 C ATOM 1462 CE LYS A 116 15.897 5.378 9.298 1.00 0.00 C ATOM 1463 NZ LYS A 116 16.400 6.379 10.280 1.00 0.00 N ATOM 0 H LYS A 116 13.447 2.393 7.610 1.00 0.00 H new ATOM 0 HA LYS A 116 13.897 3.828 5.097 1.00 0.00 H new ATOM 0 HB2 LYS A 116 15.399 3.309 7.689 1.00 0.00 H new ATOM 0 HB3 LYS A 116 16.259 3.970 6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 116 14.502 5.804 6.157 1.00 0.00 H new ATOM 0 HG3 LYS A 116 13.763 5.174 7.615 1.00 0.00 H new ATOM 0 HD2 LYS A 116 16.674 6.108 7.416 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.368 7.077 8.067 1.00 0.00 H new ATOM 0 HE2 LYS A 116 14.949 4.962 9.639 1.00 0.00 H new ATOM 0 HE3 LYS A 116 16.599 4.548 9.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 16.524 5.924 11.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 17.313 6.756 9.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 15.715 7.157 10.365 1.00 0.00 H new ATOM 1477 N LEU A 117 15.049 2.047 3.757 1.00 0.00 N ATOM 1478 CA LEU A 117 15.798 1.009 2.987 1.00 0.00 C ATOM 1479 C LEU A 117 17.269 1.416 2.889 1.00 0.00 C ATOM 1480 O LEU A 117 17.593 2.552 2.607 1.00 0.00 O ATOM 1481 CB LEU A 117 15.229 0.874 1.570 1.00 0.00 C ATOM 1482 CG LEU A 117 13.714 0.619 1.611 1.00 0.00 C ATOM 1483 CD1 LEU A 117 13.206 0.387 0.180 1.00 0.00 C ATOM 1484 CD2 LEU A 117 13.406 -0.618 2.466 1.00 0.00 C ATOM 0 H LEU A 117 14.527 2.718 3.194 1.00 0.00 H new ATOM 0 HA LEU A 117 15.700 0.054 3.504 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.434 1.782 1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 117 15.726 0.055 1.050 1.00 0.00 H new ATOM 0 HG LEU A 117 13.217 1.484 2.050 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.131 0.205 0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.414 1.268 -0.427 1.00 0.00 H new ATOM 0 HD13 LEU A 117 13.712 -0.477 -0.250 1.00 0.00 H new ATOM 0 HD21 LEU A 117 12.329 -0.787 2.487 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.902 -1.489 2.038 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.768 -0.457 3.482 1.00 0.00 H new ATOM 1496 N VAL A 118 18.162 0.488 3.117 1.00 0.00 N ATOM 1497 CA VAL A 118 19.625 0.792 3.038 1.00 0.00 C ATOM 1498 C VAL A 118 20.329 -0.338 2.286 1.00 0.00 C ATOM 1499 O VAL A 118 20.419 -1.451 2.765 1.00 0.00 O ATOM 1500 CB VAL A 118 20.202 0.898 4.453 1.00 0.00 C ATOM 1501 CG1 VAL A 118 21.700 1.205 4.378 1.00 0.00 C ATOM 1502 CG2 VAL A 118 19.490 2.020 5.211 1.00 0.00 C ATOM 0 H VAL A 118 17.939 -0.478 3.357 1.00 0.00 H new ATOM 0 HA VAL A 118 19.777 1.736 2.514 1.00 0.00 H new ATOM 0 HB VAL A 118 20.053 -0.047 4.975 1.00 0.00 H new ATOM 0 HG11 VAL A 118 22.107 1.280 5.386 1.00 0.00 H new ATOM 0 HG12 VAL A 118 22.209 0.405 3.840 1.00 0.00 H new ATOM 0 HG13 VAL A 118 21.852 2.149 3.854 1.00 0.00 H new ATOM 0 HG21 VAL A 118 19.900 2.096 6.218 1.00 0.00 H new ATOM 0 HG22 VAL A 118 19.638 2.964 4.687 1.00 0.00 H new ATOM 0 HG23 VAL A 118 18.424 1.800 5.269 1.00 0.00 H new ATOM 1512 N GLN A 119 20.826 -0.065 1.110 1.00 0.00 N ATOM 1513 CA GLN A 119 21.517 -1.131 0.332 1.00 0.00 C ATOM 1514 C GLN A 119 22.549 -1.824 1.224 1.00 0.00 C ATOM 1515 O GLN A 119 23.338 -1.182 1.888 1.00 0.00 O ATOM 1516 CB GLN A 119 22.231 -0.512 -0.875 1.00 0.00 C ATOM 1517 CG GLN A 119 21.196 0.017 -1.868 1.00 0.00 C ATOM 1518 CD GLN A 119 20.527 1.264 -1.283 1.00 0.00 C ATOM 1519 OE1 GLN A 119 21.174 2.068 -0.641 1.00 0.00 O ATOM 1520 NE2 GLN A 119 19.253 1.462 -1.478 1.00 0.00 N ATOM 0 H GLN A 119 20.783 0.847 0.656 1.00 0.00 H new ATOM 0 HA GLN A 119 20.781 -1.856 -0.014 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.883 0.298 -0.548 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.864 -1.257 -1.357 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.675 0.258 -2.817 1.00 0.00 H new ATOM 0 HG3 GLN A 119 20.448 -0.749 -2.074 1.00 0.00 H new ATOM 0 HE21 GLN A 119 18.709 0.788 -2.017 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.801 2.291 -1.092 1.00 0.00 H new ATOM 1529 N SER A 120 22.549 -3.133 1.239 1.00 0.00 N ATOM 1530 CA SER A 120 23.530 -3.890 2.081 1.00 0.00 C ATOM 1531 C SER A 120 24.135 -5.023 1.250 1.00 0.00 C ATOM 1532 O SER A 120 23.816 -5.191 0.089 1.00 0.00 O ATOM 1533 CB SER A 120 22.808 -4.472 3.302 1.00 0.00 C ATOM 1534 OG SER A 120 22.656 -3.460 4.286 1.00 0.00 O ATOM 0 H SER A 120 21.908 -3.715 0.701 1.00 0.00 H new ATOM 0 HA SER A 120 24.323 -3.222 2.417 1.00 0.00 H new ATOM 0 HB2 SER A 120 21.832 -4.861 3.010 1.00 0.00 H new ATOM 0 HB3 SER A 120 23.376 -5.309 3.709 1.00 0.00 H new ATOM 0 HG SER A 120 23.434 -3.464 4.882 1.00 0.00 H new ATOM 1540 N THR A 121 25.012 -5.796 1.839 1.00 0.00 N ATOM 1541 CA THR A 121 25.663 -6.926 1.103 1.00 0.00 C ATOM 1542 C THR A 121 25.507 -8.215 1.913 1.00 0.00 C ATOM 1543 O THR A 121 25.246 -8.190 3.100 1.00 0.00 O ATOM 1544 CB THR A 121 27.151 -6.615 0.924 1.00 0.00 C ATOM 1545 OG1 THR A 121 27.674 -6.100 2.140 1.00 0.00 O ATOM 1546 CG2 THR A 121 27.330 -5.580 -0.189 1.00 0.00 C ATOM 0 H THR A 121 25.309 -5.692 2.809 1.00 0.00 H new ATOM 0 HA THR A 121 25.193 -7.051 0.127 1.00 0.00 H new ATOM 0 HB THR A 121 27.683 -7.528 0.656 1.00 0.00 H new ATOM 0 HG1 THR A 121 28.627 -5.902 2.028 1.00 0.00 H new ATOM 0 HG21 THR A 121 28.390 -5.360 -0.314 1.00 0.00 H new ATOM 0 HG22 THR A 121 26.929 -5.976 -1.122 1.00 0.00 H new ATOM 0 HG23 THR A 121 26.799 -4.666 0.076 1.00 0.00 H new ATOM 1554 N LEU A 122 25.658 -9.344 1.279 1.00 0.00 N ATOM 1555 CA LEU A 122 25.509 -10.632 2.020 1.00 0.00 C ATOM 1556 C LEU A 122 26.473 -10.657 3.217 1.00 0.00 C ATOM 1557 O LEU A 122 26.148 -11.171 4.269 1.00 0.00 O ATOM 1558 CB LEU A 122 25.807 -11.813 1.081 1.00 0.00 C ATOM 1559 CG LEU A 122 25.437 -13.144 1.761 1.00 0.00 C ATOM 1560 CD1 LEU A 122 23.909 -13.262 1.930 1.00 0.00 C ATOM 1561 CD2 LEU A 122 25.941 -14.305 0.895 1.00 0.00 C ATOM 0 H LEU A 122 25.877 -9.433 0.287 1.00 0.00 H new ATOM 0 HA LEU A 122 24.485 -10.719 2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 122 25.243 -11.701 0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 122 26.863 -11.815 0.813 1.00 0.00 H new ATOM 0 HG LEU A 122 25.901 -13.178 2.747 1.00 0.00 H new ATOM 0 HD11 LEU A 122 23.668 -14.209 2.412 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.546 -12.439 2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 122 23.430 -13.221 0.951 1.00 0.00 H new ATOM 0 HD21 LEU A 122 25.683 -15.252 1.370 1.00 0.00 H new ATOM 0 HD22 LEU A 122 25.475 -14.254 -0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 122 27.024 -14.236 0.788 1.00 0.00 H new ATOM 1573 N SER A 123 27.653 -10.106 3.074 1.00 0.00 N ATOM 1574 CA SER A 123 28.617 -10.103 4.212 1.00 0.00 C ATOM 1575 C SER A 123 27.953 -9.479 5.443 1.00 0.00 C ATOM 1576 O SER A 123 28.034 -10.003 6.535 1.00 0.00 O ATOM 1577 CB SER A 123 29.853 -9.286 3.831 1.00 0.00 C ATOM 1578 OG SER A 123 30.563 -8.924 5.007 1.00 0.00 O ATOM 0 H SER A 123 27.988 -9.660 2.220 1.00 0.00 H new ATOM 0 HA SER A 123 28.913 -11.127 4.439 1.00 0.00 H new ATOM 0 HB2 SER A 123 30.496 -9.867 3.169 1.00 0.00 H new ATOM 0 HB3 SER A 123 29.556 -8.392 3.283 1.00 0.00 H new ATOM 0 HG SER A 123 31.356 -8.402 4.763 1.00 0.00 H new ATOM 1584 N ASP A 124 27.289 -8.368 5.275 1.00 0.00 N ATOM 1585 CA ASP A 124 26.615 -7.722 6.430 1.00 0.00 C ATOM 1586 C ASP A 124 25.673 -8.745 7.077 1.00 0.00 C ATOM 1587 O ASP A 124 25.651 -8.927 8.284 1.00 0.00 O ATOM 1588 CB ASP A 124 25.816 -6.514 5.911 1.00 0.00 C ATOM 1589 CG ASP A 124 26.713 -5.272 5.867 1.00 0.00 C ATOM 1590 OD1 ASP A 124 27.145 -4.839 6.923 1.00 0.00 O ATOM 1591 OD2 ASP A 124 26.951 -4.776 4.778 1.00 0.00 O ATOM 0 H ASP A 124 27.186 -7.881 4.385 1.00 0.00 H new ATOM 0 HA ASP A 124 27.340 -7.384 7.170 1.00 0.00 H new ATOM 0 HB2 ASP A 124 25.426 -6.726 4.916 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.958 -6.330 6.557 1.00 0.00 H new ATOM 1596 N LEU A 125 24.898 -9.425 6.283 1.00 0.00 N ATOM 1597 CA LEU A 125 23.970 -10.433 6.851 1.00 0.00 C ATOM 1598 C LEU A 125 24.784 -11.482 7.621 1.00 0.00 C ATOM 1599 O LEU A 125 24.384 -11.940 8.670 1.00 0.00 O ATOM 1600 CB LEU A 125 23.171 -11.089 5.710 1.00 0.00 C ATOM 1601 CG LEU A 125 21.803 -11.584 6.219 1.00 0.00 C ATOM 1602 CD1 LEU A 125 20.816 -10.413 6.354 1.00 0.00 C ATOM 1603 CD2 LEU A 125 21.231 -12.593 5.225 1.00 0.00 C ATOM 0 H LEU A 125 24.868 -9.326 5.268 1.00 0.00 H new ATOM 0 HA LEU A 125 23.268 -9.959 7.537 1.00 0.00 H new ATOM 0 HB2 LEU A 125 23.026 -10.372 4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 125 23.736 -11.925 5.298 1.00 0.00 H new ATOM 0 HG LEU A 125 21.944 -12.046 7.196 1.00 0.00 H new ATOM 0 HD11 LEU A 125 19.857 -10.785 6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 125 21.211 -9.684 7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 125 20.679 -9.939 5.382 1.00 0.00 H new ATOM 0 HD21 LEU A 125 20.263 -12.946 5.581 1.00 0.00 H new ATOM 0 HD22 LEU A 125 21.108 -12.116 4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 125 21.913 -13.438 5.131 1.00 0.00 H new ATOM 1615 N ARG A 126 25.930 -11.850 7.115 1.00 0.00 N ATOM 1616 CA ARG A 126 26.778 -12.855 7.828 1.00 0.00 C ATOM 1617 C ARG A 126 27.068 -12.355 9.243 1.00 0.00 C ATOM 1618 O ARG A 126 27.132 -13.125 10.180 1.00 0.00 O ATOM 1619 CB ARG A 126 28.096 -13.032 7.067 1.00 0.00 C ATOM 1620 CG ARG A 126 28.845 -14.259 7.596 1.00 0.00 C ATOM 1621 CD ARG A 126 30.311 -14.196 7.159 1.00 0.00 C ATOM 1622 NE ARG A 126 30.939 -15.536 7.333 1.00 0.00 N ATOM 1623 CZ ARG A 126 31.304 -15.936 8.521 1.00 0.00 C ATOM 1624 NH1 ARG A 126 31.119 -15.162 9.555 1.00 0.00 N ATOM 1625 NH2 ARG A 126 31.854 -17.109 8.673 1.00 0.00 N ATOM 0 H ARG A 126 26.318 -11.500 6.239 1.00 0.00 H new ATOM 0 HA ARG A 126 26.256 -13.810 7.879 1.00 0.00 H new ATOM 0 HB2 ARG A 126 27.898 -13.148 6.002 1.00 0.00 H new ATOM 0 HB3 ARG A 126 28.714 -12.141 7.181 1.00 0.00 H new ATOM 0 HG2 ARG A 126 28.781 -14.295 8.683 1.00 0.00 H new ATOM 0 HG3 ARG A 126 28.382 -15.171 7.219 1.00 0.00 H new ATOM 0 HD2 ARG A 126 30.378 -13.884 6.117 1.00 0.00 H new ATOM 0 HD3 ARG A 126 30.846 -13.452 7.750 1.00 0.00 H new ATOM 0 HE ARG A 126 31.084 -16.141 6.524 1.00 0.00 H new ATOM 0 HH11 ARG A 126 30.689 -14.245 9.435 1.00 0.00 H new ATOM 0 HH12 ARG A 126 31.404 -15.474 10.483 1.00 0.00 H new ATOM 0 HH21 ARG A 126 31.999 -17.713 7.864 1.00 0.00 H new ATOM 0 HH22 ARG A 126 32.139 -17.422 9.601 1.00 0.00 H new ATOM 1639 N VAL A 127 27.230 -11.071 9.412 1.00 0.00 N ATOM 1640 CA VAL A 127 27.498 -10.540 10.775 1.00 0.00 C ATOM 1641 C VAL A 127 26.326 -10.924 11.678 1.00 0.00 C ATOM 1642 O VAL A 127 26.491 -11.175 12.856 1.00 0.00 O ATOM 1643 CB VAL A 127 27.630 -9.016 10.728 1.00 0.00 C ATOM 1644 CG1 VAL A 127 27.882 -8.489 12.141 1.00 0.00 C ATOM 1645 CG2 VAL A 127 28.808 -8.633 9.831 1.00 0.00 C ATOM 0 H VAL A 127 27.188 -10.372 8.670 1.00 0.00 H new ATOM 0 HA VAL A 127 28.428 -10.959 11.160 1.00 0.00 H new ATOM 0 HB VAL A 127 26.712 -8.583 10.330 1.00 0.00 H new ATOM 0 HG11 VAL A 127 27.977 -7.403 12.113 1.00 0.00 H new ATOM 0 HG12 VAL A 127 27.047 -8.764 12.786 1.00 0.00 H new ATOM 0 HG13 VAL A 127 28.802 -8.924 12.533 1.00 0.00 H new ATOM 0 HG21 VAL A 127 28.902 -7.548 9.798 1.00 0.00 H new ATOM 0 HG22 VAL A 127 29.725 -9.064 10.231 1.00 0.00 H new ATOM 0 HG23 VAL A 127 28.637 -9.014 8.824 1.00 0.00 H new ATOM 1655 N TYR A 128 25.134 -10.969 11.132 1.00 0.00 N ATOM 1656 CA TYR A 128 23.941 -11.335 11.964 1.00 0.00 C ATOM 1657 C TYR A 128 23.699 -12.849 11.936 1.00 0.00 C ATOM 1658 O TYR A 128 23.485 -13.471 12.957 1.00 0.00 O ATOM 1659 CB TYR A 128 22.690 -10.654 11.407 1.00 0.00 C ATOM 1660 CG TYR A 128 22.780 -9.159 11.578 1.00 0.00 C ATOM 1661 CD1 TYR A 128 22.411 -8.568 12.792 1.00 0.00 C ATOM 1662 CD2 TYR A 128 23.213 -8.363 10.515 1.00 0.00 C ATOM 1663 CE1 TYR A 128 22.480 -7.179 12.942 1.00 0.00 C ATOM 1664 CE2 TYR A 128 23.281 -6.974 10.662 1.00 0.00 C ATOM 1665 CZ TYR A 128 22.915 -6.381 11.877 1.00 0.00 C ATOM 1666 OH TYR A 128 22.982 -5.010 12.023 1.00 0.00 O ATOM 0 H TYR A 128 24.935 -10.769 10.152 1.00 0.00 H new ATOM 0 HA TYR A 128 24.138 -11.010 12.986 1.00 0.00 H new ATOM 0 HB2 TYR A 128 22.576 -10.899 10.351 1.00 0.00 H new ATOM 0 HB3 TYR A 128 21.805 -11.032 11.919 1.00 0.00 H new ATOM 0 HD1 TYR A 128 22.073 -9.184 13.612 1.00 0.00 H new ATOM 0 HD2 TYR A 128 23.496 -8.821 9.579 1.00 0.00 H new ATOM 0 HE1 TYR A 128 22.198 -6.722 13.879 1.00 0.00 H new ATOM 0 HE2 TYR A 128 23.615 -6.359 9.839 1.00 0.00 H new ATOM 0 HH TYR A 128 23.305 -4.608 11.190 1.00 0.00 H new ATOM 1676 N LEU A 129 23.695 -13.436 10.765 1.00 0.00 N ATOM 1677 CA LEU A 129 23.426 -14.899 10.632 1.00 0.00 C ATOM 1678 C LEU A 129 24.656 -15.616 10.087 1.00 0.00 C ATOM 1679 O LEU A 129 24.552 -16.448 9.212 1.00 0.00 O ATOM 1680 CB LEU A 129 22.296 -15.092 9.627 1.00 0.00 C ATOM 1681 CG LEU A 129 21.012 -14.391 10.091 1.00 0.00 C ATOM 1682 CD1 LEU A 129 19.888 -14.719 9.097 1.00 0.00 C ATOM 1683 CD2 LEU A 129 20.615 -14.861 11.501 1.00 0.00 C ATOM 0 H LEU A 129 23.870 -12.955 9.883 1.00 0.00 H new ATOM 0 HA LEU A 129 23.167 -15.303 11.611 1.00 0.00 H new ATOM 0 HB2 LEU A 129 22.598 -14.698 8.657 1.00 0.00 H new ATOM 0 HB3 LEU A 129 22.104 -16.156 9.493 1.00 0.00 H new ATOM 0 HG LEU A 129 21.181 -13.315 10.127 1.00 0.00 H new ATOM 0 HD11 LEU A 129 18.968 -14.228 9.413 1.00 0.00 H new ATOM 0 HD12 LEU A 129 20.166 -14.365 8.104 1.00 0.00 H new ATOM 0 HD13 LEU A 129 19.732 -15.797 9.067 1.00 0.00 H new ATOM 0 HD21 LEU A 129 19.702 -14.352 11.811 1.00 0.00 H new ATOM 0 HD22 LEU A 129 20.444 -15.938 11.491 1.00 0.00 H new ATOM 0 HD23 LEU A 129 21.417 -14.627 12.202 1.00 0.00 H new ATOM 1695 N GLY A 130 25.812 -15.304 10.581 1.00 0.00 N ATOM 1696 CA GLY A 130 27.041 -15.973 10.075 1.00 0.00 C ATOM 1697 C GLY A 130 27.008 -17.475 10.406 1.00 0.00 C ATOM 1698 O GLY A 130 28.018 -18.060 10.745 1.00 0.00 O ATOM 0 H GLY A 130 25.964 -14.613 11.316 1.00 0.00 H new ATOM 0 HA2 GLY A 130 27.121 -15.833 8.997 1.00 0.00 H new ATOM 0 HA3 GLY A 130 27.923 -15.515 10.522 1.00 0.00 H new ATOM 1702 N ALA A 131 25.865 -18.111 10.305 1.00 0.00 N ATOM 1703 CA ALA A 131 25.792 -19.571 10.609 1.00 0.00 C ATOM 1704 C ALA A 131 24.629 -20.202 9.831 1.00 0.00 C ATOM 1705 O ALA A 131 24.819 -21.119 9.057 1.00 0.00 O ATOM 1706 CB ALA A 131 25.586 -19.772 12.115 1.00 0.00 C ATOM 0 H ALA A 131 24.983 -17.681 10.026 1.00 0.00 H new ATOM 0 HA ALA A 131 26.723 -20.052 10.309 1.00 0.00 H new ATOM 0 HB1 ALA A 131 25.533 -20.838 12.336 1.00 0.00 H new ATOM 0 HB2 ALA A 131 26.421 -19.330 12.659 1.00 0.00 H new ATOM 0 HB3 ALA A 131 24.657 -19.291 12.423 1.00 0.00 H new ATOM 1712 N SER A 132 23.427 -19.718 10.024 1.00 0.00 N ATOM 1713 CA SER A 132 22.252 -20.289 9.292 1.00 0.00 C ATOM 1714 C SER A 132 21.930 -19.404 8.086 1.00 0.00 C ATOM 1715 O SER A 132 20.783 -19.196 7.744 1.00 0.00 O ATOM 1716 CB SER A 132 21.042 -20.328 10.229 1.00 0.00 C ATOM 1717 OG SER A 132 21.205 -21.381 11.167 1.00 0.00 O ATOM 0 H SER A 132 23.207 -18.950 10.658 1.00 0.00 H new ATOM 0 HA SER A 132 22.486 -21.299 8.954 1.00 0.00 H new ATOM 0 HB2 SER A 132 20.940 -19.376 10.749 1.00 0.00 H new ATOM 0 HB3 SER A 132 20.128 -20.477 9.654 1.00 0.00 H new ATOM 0 HG SER A 132 20.432 -21.406 11.769 1.00 0.00 H new ATOM 1723 N THR A 133 22.936 -18.871 7.450 1.00 0.00 N ATOM 1724 CA THR A 133 22.695 -17.984 6.275 1.00 0.00 C ATOM 1725 C THR A 133 22.292 -18.837 5.044 1.00 0.00 C ATOM 1726 O THR A 133 23.070 -19.651 4.589 1.00 0.00 O ATOM 1727 CB THR A 133 24.003 -17.215 5.962 1.00 0.00 C ATOM 1728 OG1 THR A 133 24.880 -17.315 7.072 1.00 0.00 O ATOM 1729 CG2 THR A 133 23.708 -15.737 5.683 1.00 0.00 C ATOM 0 H THR A 133 23.917 -19.011 7.693 1.00 0.00 H new ATOM 0 HA THR A 133 21.890 -17.284 6.500 1.00 0.00 H new ATOM 0 HB THR A 133 24.464 -17.653 5.077 1.00 0.00 H new ATOM 0 HG1 THR A 133 24.575 -16.715 7.785 1.00 0.00 H new ATOM 0 HG21 THR A 133 24.640 -15.215 5.465 1.00 0.00 H new ATOM 0 HG22 THR A 133 23.038 -15.655 4.827 1.00 0.00 H new ATOM 0 HG23 THR A 133 23.236 -15.289 6.558 1.00 0.00 H new ATOM 1737 N PRO A 134 21.112 -18.646 4.484 1.00 0.00 N ATOM 1738 CA PRO A 134 20.676 -19.408 3.279 1.00 0.00 C ATOM 1739 C PRO A 134 21.255 -18.804 1.995 1.00 0.00 C ATOM 1740 O PRO A 134 22.050 -17.885 2.034 1.00 0.00 O ATOM 1741 CB PRO A 134 19.153 -19.270 3.309 1.00 0.00 C ATOM 1742 CG PRO A 134 18.913 -17.930 3.927 1.00 0.00 C ATOM 1743 CD PRO A 134 20.063 -17.704 4.923 1.00 0.00 C ATOM 0 HA PRO A 134 21.015 -20.444 3.289 1.00 0.00 H new ATOM 0 HB2 PRO A 134 18.729 -19.327 2.306 1.00 0.00 H new ATOM 0 HB3 PRO A 134 18.693 -20.066 3.895 1.00 0.00 H new ATOM 0 HG2 PRO A 134 18.897 -17.148 3.167 1.00 0.00 H new ATOM 0 HG3 PRO A 134 17.948 -17.902 4.434 1.00 0.00 H new ATOM 0 HD2 PRO A 134 20.417 -16.673 4.896 1.00 0.00 H new ATOM 0 HD3 PRO A 134 19.749 -17.907 5.947 1.00 0.00 H new ATOM 1751 N ASP A 135 20.856 -19.312 0.859 1.00 0.00 N ATOM 1752 CA ASP A 135 21.362 -18.783 -0.440 1.00 0.00 C ATOM 1753 C ASP A 135 20.261 -17.967 -1.106 1.00 0.00 C ATOM 1754 O ASP A 135 19.131 -18.397 -1.227 1.00 0.00 O ATOM 1755 CB ASP A 135 21.745 -19.950 -1.345 1.00 0.00 C ATOM 1756 CG ASP A 135 22.568 -19.434 -2.527 1.00 0.00 C ATOM 1757 OD1 ASP A 135 22.849 -18.248 -2.555 1.00 0.00 O ATOM 1758 OD2 ASP A 135 22.904 -20.235 -3.384 1.00 0.00 O ATOM 0 H ASP A 135 20.192 -20.082 0.776 1.00 0.00 H new ATOM 0 HA ASP A 135 22.235 -18.154 -0.269 1.00 0.00 H new ATOM 0 HB2 ASP A 135 22.319 -20.686 -0.783 1.00 0.00 H new ATOM 0 HB3 ASP A 135 20.848 -20.453 -1.706 1.00 0.00 H new ATOM 1763 N LEU A 136 20.589 -16.786 -1.525 1.00 0.00 N ATOM 1764 CA LEU A 136 19.579 -15.901 -2.179 1.00 0.00 C ATOM 1765 C LEU A 136 19.563 -16.139 -3.691 1.00 0.00 C ATOM 1766 O LEU A 136 20.592 -16.254 -4.327 1.00 0.00 O ATOM 1767 CB LEU A 136 19.936 -14.440 -1.906 1.00 0.00 C ATOM 1768 CG LEU A 136 19.920 -14.161 -0.399 1.00 0.00 C ATOM 1769 CD1 LEU A 136 20.340 -12.707 -0.163 1.00 0.00 C ATOM 1770 CD2 LEU A 136 18.509 -14.392 0.168 1.00 0.00 C ATOM 0 H LEU A 136 21.523 -16.384 -1.445 1.00 0.00 H new ATOM 0 HA LEU A 136 18.594 -16.129 -1.772 1.00 0.00 H new ATOM 0 HB2 LEU A 136 20.922 -14.217 -2.313 1.00 0.00 H new ATOM 0 HB3 LEU A 136 19.227 -13.785 -2.412 1.00 0.00 H new ATOM 0 HG LEU A 136 20.612 -14.836 0.105 1.00 0.00 H new ATOM 0 HD11 LEU A 136 20.333 -12.495 0.906 1.00 0.00 H new ATOM 0 HD12 LEU A 136 21.344 -12.550 -0.557 1.00 0.00 H new ATOM 0 HD13 LEU A 136 19.643 -12.040 -0.670 1.00 0.00 H new ATOM 0 HD21 LEU A 136 18.510 -14.191 1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 136 17.804 -13.723 -0.326 1.00 0.00 H new ATOM 0 HD23 LEU A 136 18.211 -15.426 -0.007 1.00 0.00 H new ATOM 1782 N GLN A 137 18.387 -16.204 -4.266 1.00 0.00 N ATOM 1783 CA GLN A 137 18.252 -16.426 -5.739 1.00 0.00 C ATOM 1784 C GLN A 137 17.325 -15.358 -6.329 1.00 0.00 C ATOM 1785 O GLN A 137 17.673 -14.192 -6.249 1.00 0.00 O ATOM 1786 CB GLN A 137 17.652 -17.816 -5.982 1.00 0.00 C ATOM 1787 CG GLN A 137 18.312 -18.829 -5.045 1.00 0.00 C ATOM 1788 CD GLN A 137 19.833 -18.778 -5.225 1.00 0.00 C ATOM 1789 OE1 GLN A 137 20.607 -18.663 -4.178 1.00 0.00 O flip ATOM 1790 NE2 GLN A 137 20.323 -18.843 -6.335 1.00 0.00 N flip ATOM 1791 OXT GLN A 137 16.284 -15.725 -6.850 1.00 0.00 O ATOM 0 H GLN A 137 17.501 -16.111 -3.769 1.00 0.00 H new ATOM 0 HA GLN A 137 19.230 -16.360 -6.215 1.00 0.00 H new ATOM 0 HB2 GLN A 137 16.576 -17.794 -5.811 1.00 0.00 H new ATOM 0 HB3 GLN A 137 17.804 -18.113 -7.020 1.00 0.00 H new ATOM 0 HG2 GLN A 137 18.050 -18.607 -4.010 1.00 0.00 H new ATOM 0 HG3 GLN A 137 17.943 -19.832 -5.259 1.00 0.00 H new ATOM 0 HE21 GLN A 137 19.721 -18.933 -7.154 1.00 0.00 H new ATOM 0 HE22 GLN A 137 21.336 -18.808 -6.448 1.00 0.00 H new TER 1800 GLN A 137 HETATM 1801 MG MG A 2 17.860 -0.390 23.519 1.00 0.00 MG HETATM 1802 PG ATP A 1 12.005 -2.174 18.971 1.00 0.00 P HETATM 1803 O1G ATP A 1 11.282 -3.387 19.477 1.00 0.00 O HETATM 1804 O2G ATP A 1 11.107 -1.136 18.387 1.00 0.00 O HETATM 1805 O3G ATP A 1 13.297 -2.494 18.279 1.00 0.00 O HETATM 1806 PB ATP A 1 13.223 -0.159 21.509 1.00 0.00 P HETATM 1807 O1B ATP A 1 12.288 0.112 22.645 1.00 0.00 O HETATM 1808 O2B ATP A 1 14.561 -0.623 21.988 1.00 0.00 O HETATM 1809 O3B ATP A 1 12.542 -1.440 20.590 1.00 0.00 O HETATM 1810 PA ATP A 1 13.118 2.143 19.288 1.00 0.00 P HETATM 1811 O1A ATP A 1 13.703 1.435 18.137 1.00 0.00 O HETATM 1812 O2A ATP A 1 13.559 3.544 19.445 1.00 0.00 O HETATM 1813 O3A ATP A 1 13.510 1.343 20.730 1.00 0.00 O HETATM 1814 O5' ATP A 1 11.451 2.169 19.044 1.00 0.00 O HETATM 1815 C5' ATP A 1 10.538 2.814 19.923 1.00 0.00 C HETATM 1816 C4' ATP A 1 10.637 4.359 19.888 1.00 0.00 C HETATM 1817 O4' ATP A 1 9.328 4.917 19.937 1.00 0.00 O HETATM 1818 C3' ATP A 1 11.420 5.008 21.059 1.00 0.00 C HETATM 1819 O3' ATP A 1 12.609 5.627 20.572 1.00 0.00 O HETATM 1820 C2' ATP A 1 10.477 6.053 21.659 1.00 0.00 C HETATM 1821 O2' ATP A 1 11.215 7.249 21.841 1.00 0.00 O HETATM 1822 C1' ATP A 1 9.374 6.176 20.595 1.00 0.00 C HETATM 1823 N9 ATP A 1 8.034 6.520 21.137 1.00 0.00 N HETATM 1824 C8 ATP A 1 7.240 7.613 20.852 1.00 0.00 C HETATM 1825 N7 ATP A 1 6.062 7.607 21.426 1.00 0.00 N HETATM 1826 C5 ATP A 1 6.075 6.458 22.208 1.00 0.00 C HETATM 1827 C6 ATP A 1 5.165 5.850 23.113 1.00 0.00 C HETATM 1828 N6 ATP A 1 3.944 6.328 23.365 1.00 0.00 N HETATM 1829 N1 ATP A 1 5.554 4.742 23.782 1.00 0.00 N HETATM 1830 C2 ATP A 1 6.773 4.235 23.557 1.00 0.00 C HETATM 1831 N3 ATP A 1 7.709 4.662 22.711 1.00 0.00 N HETATM 1832 C4 ATP A 1 7.319 5.791 22.057 1.00 0.00 C HETATM 0 HO3' ATP A 1 13.284 4.941 20.390 1.00 0.00 H new HETATM 0 HO2' ATP A 1 11.949 7.282 21.193 1.00 0.00 H new HETATM 0 HN62 ATP A 1 3.334 5.847 24.026 1.00 0.00 H new HETATM 0 HN61 ATP A 1 3.621 7.174 22.896 1.00 0.00 H new HETATM 0 H5'2 ATP A 1 9.522 2.517 19.662 1.00 0.00 H new HETATM 0 H5'1 ATP A 1 10.720 2.469 20.941 1.00 0.00 H new HETATM 0 H8 ATP A 1 7.569 8.421 20.198 1.00 0.00 H new HETATM 0 H4' ATP A 1 11.180 4.572 18.967 1.00 0.00 H new HETATM 0 H3' ATP A 1 11.723 4.271 21.802 1.00 0.00 H new HETATM 0 H2' ATP A 1 10.050 5.808 22.631 1.00 0.00 H new HETATM 0 H2 ATP A 1 7.034 3.355 24.145 1.00 0.00 H new HETATM 0 H1' ATP A 1 9.618 7.002 19.927 1.00 0.00 H new