USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 CYS SG : rot -178:sc= -5.17! USER MOD Set 1.2: A 107 HIS : no HE2:sc= 1.13 K(o=-2.8,f=-13!) USER MOD Set 1.3: A 109 SER OG : rot 146:sc= 1.19 USER MOD Set 2.1: A 53 THR OG1 : rot -127:sc= 1.62 USER MOD Set 2.2: A 91 TYR OH : rot 173:sc= 0.349 USER MOD Set 3.1: A 28 SER OG : rot -141:sc= 0.17 USER MOD Set 3.2: A 30 SER OG : rot 78:sc= 0.179 USER MOD Single : A 1 MET CE :methyl -146:sc= 0 (180deg=-1.16) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.275 X(o=-0.27,f=-0.16) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc=-0.00457 X(o=-0.0046,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 7 HIS : no HD1:sc= -0.0549 X(o=-0.055,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.0916 X(o=-0.092,f=-0.092) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.0203 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 16 THR OG1 : rot 38:sc= 0.396 USER MOD Single : A 17 GLN : amide:sc= -0.573 K(o=-0.57,f=-0.0062) USER MOD Single : A 21 SER OG : rot 180:sc=-0.00308 USER MOD Single : A 22 MET CE :methyl 163:sc= -0.194 (180deg=-0.706) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 38:sc= 0.176 USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 43:sc= 0.355 USER MOD Single : A 35 THR OG1 : rot -120:sc= -0.446 USER MOD Single : A 38 TYR OH : rot -60:sc= -1.14 USER MOD Single : A 41 THR OG1 : rot -56:sc= -0.148 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 51 LYS NZ :NH3+ 168:sc= 1.06 (180deg=0.979) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0.917 (180deg=0.917) USER MOD Single : A 55 LYS NZ :NH3+ -149:sc= -2.47! (180deg=-4.52!) USER MOD Single : A 61 SER OG : rot -49:sc= 0.467 USER MOD Single : A 65 TYR OH : rot 180:sc= -0.183 USER MOD Single : A 67 THR OG1 : rot -170:sc= -3.77! USER MOD Single : A 68 ASN : amide:sc= -1.12 K(o=-1.1,f=-0.24) USER MOD Single : A 69 ASN : amide:sc= -1.24! K(o=-1.2!,f=-0.31) USER MOD Single : A 73 SER OG : rot -93:sc= 0.804 USER MOD Single : A 75 SER OG : rot 36:sc= 0.565 USER MOD Single : A 79 GLN : amide:sc= -0.894 K(o=-0.89,f=-3.2!) USER MOD Single : A 82 LYS NZ :NH3+ 164:sc= -0.0305 (180deg=-0.278) USER MOD Single : A 84 GLN : amide:sc= -1.4 K(o=-1.4,f=-5.4!) USER MOD Single : A 90 LYS NZ :NH3+ -129:sc= 0.174 (180deg=-0.598) USER MOD Single : A 93 HIS : no HD1:sc= -0.467 K(o=-0.47,f=-1.7) USER MOD Single : A 94 LYS NZ :NH3+ -168:sc=-0.00854 (180deg=-0.174) USER MOD Single : A 96 SER OG : rot -150:sc= -2.5! USER MOD Single : A 98 LYS NZ :NH3+ 165:sc= 1.18 (180deg=0.372) USER MOD Single : A 99 SER OG : rot -21:sc= -1.54! USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0.0103 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.836 -15.059 -1.870 1.00 52.12 N ATOM 2 CA MET A 1 -0.734 -15.577 -2.712 1.00 51.22 C ATOM 3 C MET A 1 -0.983 -17.035 -3.086 1.00 31.51 C ATOM 4 O MET A 1 -0.798 -17.938 -2.268 1.00 43.23 O ATOM 5 CB MET A 1 0.615 -15.442 -1.985 1.00 33.04 C ATOM 6 CG MET A 1 1.781 -16.114 -2.707 1.00 72.33 C ATOM 7 SD MET A 1 2.019 -15.490 -4.385 1.00 4.50 S ATOM 8 CE MET A 1 3.346 -16.548 -4.963 1.00 20.10 C ATOM 0 H1 MET A 1 -1.649 -14.066 -1.626 1.00 52.12 H new ATOM 0 H2 MET A 1 -2.733 -15.124 -2.393 1.00 52.12 H new ATOM 0 H3 MET A 1 -1.902 -15.623 -0.999 1.00 52.12 H new ATOM 0 HA MET A 1 -0.699 -14.983 -3.625 1.00 51.22 H new ATOM 0 HB2 MET A 1 0.842 -14.384 -1.857 1.00 33.04 H new ATOM 0 HB3 MET A 1 0.523 -15.872 -0.987 1.00 33.04 H new ATOM 0 HG2 MET A 1 2.695 -15.959 -2.134 1.00 72.33 H new ATOM 0 HG3 MET A 1 1.607 -17.189 -2.745 1.00 72.33 H new ATOM 0 HE1 MET A 1 3.992 -15.986 -5.637 1.00 20.10 H new ATOM 0 HE2 MET A 1 3.929 -16.899 -4.111 1.00 20.10 H new ATOM 0 HE3 MET A 1 2.925 -17.403 -5.492 1.00 20.10 H new ATOM 20 N ALA A 2 -1.421 -17.259 -4.318 1.00 23.30 N ATOM 21 CA ALA A 2 -1.622 -18.606 -4.827 1.00 11.25 C ATOM 22 C ALA A 2 -0.296 -19.171 -5.323 1.00 62.11 C ATOM 23 O ALA A 2 0.398 -18.537 -6.123 1.00 12.45 O ATOM 24 CB ALA A 2 -2.664 -18.609 -5.941 1.00 63.04 C ATOM 0 H ALA A 2 -1.644 -16.520 -4.985 1.00 23.30 H new ATOM 0 HA ALA A 2 -1.993 -19.239 -4.021 1.00 11.25 H new ATOM 0 HB1 ALA A 2 -2.800 -19.626 -6.309 1.00 63.04 H new ATOM 0 HB2 ALA A 2 -3.611 -18.233 -5.554 1.00 63.04 H new ATOM 0 HB3 ALA A 2 -2.326 -17.970 -6.757 1.00 63.04 H new ATOM 30 N HIS A 3 0.065 -20.350 -4.837 1.00 20.45 N ATOM 31 CA HIS A 3 1.334 -20.970 -5.191 1.00 41.31 C ATOM 32 C HIS A 3 1.216 -22.489 -5.116 1.00 14.54 C ATOM 33 O HIS A 3 0.885 -23.042 -4.067 1.00 61.24 O ATOM 34 CB HIS A 3 2.459 -20.472 -4.266 1.00 23.32 C ATOM 35 CG HIS A 3 2.279 -20.851 -2.824 1.00 30.41 C ATOM 36 ND1 HIS A 3 3.141 -21.694 -2.156 1.00 73.03 N ATOM 37 CD2 HIS A 3 1.332 -20.496 -1.920 1.00 73.32 C ATOM 38 CE1 HIS A 3 2.732 -21.844 -0.910 1.00 11.32 C ATOM 39 NE2 HIS A 3 1.639 -21.129 -0.742 1.00 30.43 N ATOM 0 H HIS A 3 -0.506 -20.898 -4.194 1.00 20.45 H new ATOM 0 HA HIS A 3 1.584 -20.688 -6.214 1.00 41.31 H new ATOM 0 HB2 HIS A 3 3.409 -20.872 -4.620 1.00 23.32 H new ATOM 0 HB3 HIS A 3 2.522 -19.386 -4.340 1.00 23.32 H new ATOM 0 HD2 HIS A 3 0.493 -19.838 -2.095 1.00 73.32 H new ATOM 0 HE1 HIS A 3 3.212 -22.450 -0.156 1.00 11.32 H new ATOM 0 HE2 HIS A 3 1.106 -21.057 0.125 1.00 30.43 H new ATOM 48 N HIS A 4 1.464 -23.153 -6.236 1.00 51.22 N ATOM 49 CA HIS A 4 1.413 -24.611 -6.303 1.00 51.34 C ATOM 50 C HIS A 4 2.783 -25.156 -6.687 1.00 0.14 C ATOM 51 O HIS A 4 3.585 -24.455 -7.311 1.00 74.33 O ATOM 52 CB HIS A 4 0.353 -25.075 -7.309 1.00 24.43 C ATOM 53 CG HIS A 4 -1.038 -24.633 -6.966 1.00 72.12 C ATOM 54 ND1 HIS A 4 -1.778 -25.197 -5.950 1.00 51.04 N ATOM 55 CD2 HIS A 4 -1.822 -23.671 -7.506 1.00 71.54 C ATOM 56 CE1 HIS A 4 -2.953 -24.604 -5.882 1.00 1.32 C ATOM 57 NE2 HIS A 4 -3.008 -23.673 -6.813 1.00 72.33 N ATOM 0 H HIS A 4 1.705 -22.703 -7.119 1.00 51.22 H new ATOM 0 HA HIS A 4 1.137 -24.996 -5.321 1.00 51.34 H new ATOM 0 HB2 HIS A 4 0.612 -24.695 -8.297 1.00 24.43 H new ATOM 0 HB3 HIS A 4 0.374 -26.163 -7.370 1.00 24.43 H new ATOM 0 HD2 HIS A 4 -1.563 -23.022 -8.329 1.00 71.54 H new ATOM 0 HE1 HIS A 4 -3.739 -24.841 -5.181 1.00 1.32 H new ATOM 0 HE2 HIS A 4 -3.801 -23.056 -6.990 1.00 72.33 H new ATOM 66 N HIS A 5 3.053 -26.401 -6.312 1.00 1.20 N ATOM 67 CA HIS A 5 4.357 -27.011 -6.560 1.00 3.11 C ATOM 68 C HIS A 5 4.216 -28.222 -7.485 1.00 72.12 C ATOM 69 O HIS A 5 3.197 -28.912 -7.463 1.00 25.44 O ATOM 70 CB HIS A 5 5.008 -27.407 -5.228 1.00 71.20 C ATOM 71 CG HIS A 5 6.467 -27.732 -5.342 1.00 35.25 C ATOM 72 ND1 HIS A 5 7.446 -26.767 -5.471 1.00 61.31 N ATOM 73 CD2 HIS A 5 7.115 -28.921 -5.345 1.00 64.31 C ATOM 74 CE1 HIS A 5 8.628 -27.349 -5.548 1.00 14.53 C ATOM 75 NE2 HIS A 5 8.453 -28.653 -5.473 1.00 10.22 N ATOM 0 H HIS A 5 2.387 -27.009 -5.835 1.00 1.20 H new ATOM 0 HA HIS A 5 5.001 -26.286 -7.058 1.00 3.11 H new ATOM 0 HB2 HIS A 5 4.881 -26.592 -4.516 1.00 71.20 H new ATOM 0 HB3 HIS A 5 4.483 -28.271 -4.820 1.00 71.20 H new ATOM 0 HD2 HIS A 5 6.662 -29.898 -5.262 1.00 64.31 H new ATOM 0 HE1 HIS A 5 9.576 -26.843 -5.654 1.00 14.53 H new ATOM 0 HE2 HIS A 5 9.195 -29.352 -5.505 1.00 10.22 H new ATOM 84 N HIS A 6 5.244 -28.466 -8.301 1.00 74.41 N ATOM 85 CA HIS A 6 5.216 -29.548 -9.291 1.00 62.44 C ATOM 86 C HIS A 6 5.783 -30.844 -8.707 1.00 42.35 C ATOM 87 O HIS A 6 6.247 -30.874 -7.564 1.00 32.12 O ATOM 88 CB HIS A 6 6.022 -29.151 -10.538 1.00 4.33 C ATOM 89 CG HIS A 6 5.586 -27.856 -11.157 1.00 54.12 C ATOM 90 ND1 HIS A 6 6.447 -26.803 -11.385 1.00 25.22 N ATOM 91 CD2 HIS A 6 4.373 -27.446 -11.592 1.00 51.05 C ATOM 92 CE1 HIS A 6 5.780 -25.803 -11.929 1.00 34.00 C ATOM 93 NE2 HIS A 6 4.519 -26.169 -12.065 1.00 2.42 N ATOM 0 H HIS A 6 6.110 -27.927 -8.296 1.00 74.41 H new ATOM 0 HA HIS A 6 4.176 -29.718 -9.570 1.00 62.44 H new ATOM 0 HB2 HIS A 6 7.076 -29.077 -10.269 1.00 4.33 H new ATOM 0 HB3 HIS A 6 5.937 -29.944 -11.281 1.00 4.33 H new ATOM 0 HD2 HIS A 6 3.458 -28.020 -11.570 1.00 51.05 H new ATOM 0 HE1 HIS A 6 6.195 -24.848 -12.214 1.00 34.00 H new ATOM 0 HE2 HIS A 6 3.774 -25.594 -12.459 1.00 2.42 H new ATOM 102 N HIS A 7 5.749 -31.907 -9.509 1.00 3.41 N ATOM 103 CA HIS A 7 6.285 -33.211 -9.118 1.00 22.42 C ATOM 104 C HIS A 7 6.669 -34.004 -10.366 1.00 74.24 C ATOM 105 O HIS A 7 5.985 -33.919 -11.389 1.00 22.25 O ATOM 106 CB HIS A 7 5.254 -33.989 -8.281 1.00 14.31 C ATOM 107 CG HIS A 7 3.927 -34.172 -8.963 1.00 52.42 C ATOM 108 ND1 HIS A 7 2.818 -33.410 -8.665 1.00 2.02 N ATOM 109 CD2 HIS A 7 3.535 -35.035 -9.932 1.00 55.24 C ATOM 110 CE1 HIS A 7 1.805 -33.797 -9.418 1.00 30.14 C ATOM 111 NE2 HIS A 7 2.214 -34.780 -10.197 1.00 45.03 N ATOM 0 H HIS A 7 5.350 -31.889 -10.447 1.00 3.41 H new ATOM 0 HA HIS A 7 7.174 -33.060 -8.506 1.00 22.42 H new ATOM 0 HB2 HIS A 7 5.664 -34.969 -8.037 1.00 14.31 H new ATOM 0 HB3 HIS A 7 5.097 -33.466 -7.338 1.00 14.31 H new ATOM 0 HD2 HIS A 7 4.150 -35.785 -10.408 1.00 55.24 H new ATOM 0 HE1 HIS A 7 0.809 -33.379 -9.399 1.00 30.14 H new ATOM 0 HE2 HIS A 7 1.641 -35.270 -10.884 1.00 45.03 H new ATOM 120 N HIS A 8 7.760 -34.763 -10.288 1.00 1.42 N ATOM 121 CA HIS A 8 8.234 -35.544 -11.430 1.00 40.41 C ATOM 122 C HIS A 8 9.204 -36.634 -10.976 1.00 31.21 C ATOM 123 O HIS A 8 9.919 -36.465 -9.988 1.00 1.54 O ATOM 124 CB HIS A 8 8.911 -34.625 -12.462 1.00 5.14 C ATOM 125 CG HIS A 8 9.436 -35.346 -13.669 1.00 51.02 C ATOM 126 ND1 HIS A 8 10.773 -35.391 -13.998 1.00 43.10 N ATOM 127 CD2 HIS A 8 8.794 -36.050 -14.633 1.00 71.51 C ATOM 128 CE1 HIS A 8 10.932 -36.088 -15.106 1.00 10.51 C ATOM 129 NE2 HIS A 8 9.747 -36.499 -15.511 1.00 62.52 N ATOM 0 H HIS A 8 8.332 -34.854 -9.448 1.00 1.42 H new ATOM 0 HA HIS A 8 7.373 -36.023 -11.897 1.00 40.41 H new ATOM 0 HB2 HIS A 8 8.195 -33.869 -12.786 1.00 5.14 H new ATOM 0 HB3 HIS A 8 9.734 -34.098 -11.979 1.00 5.14 H new ATOM 0 HD2 HIS A 8 7.730 -36.225 -14.698 1.00 71.51 H new ATOM 0 HE1 HIS A 8 11.873 -36.288 -15.598 1.00 10.51 H new ATOM 0 HE2 HIS A 8 9.568 -37.061 -16.343 1.00 62.52 H new ATOM 138 N MET A 9 9.209 -37.751 -11.701 1.00 32.43 N ATOM 139 CA MET A 9 10.118 -38.863 -11.426 1.00 63.23 C ATOM 140 C MET A 9 10.562 -39.506 -12.739 1.00 31.31 C ATOM 141 O MET A 9 10.068 -39.142 -13.808 1.00 61.42 O ATOM 142 CB MET A 9 9.436 -39.917 -10.538 1.00 35.41 C ATOM 143 CG MET A 9 8.256 -40.620 -11.204 1.00 51.11 C ATOM 144 SD MET A 9 7.592 -41.969 -10.204 1.00 3.44 S ATOM 145 CE MET A 9 6.263 -42.555 -11.256 1.00 24.31 C ATOM 0 H MET A 9 8.586 -37.911 -12.493 1.00 32.43 H new ATOM 0 HA MET A 9 10.989 -38.474 -10.898 1.00 63.23 H new ATOM 0 HB2 MET A 9 10.174 -40.665 -10.247 1.00 35.41 H new ATOM 0 HB3 MET A 9 9.090 -39.437 -9.622 1.00 35.41 H new ATOM 0 HG2 MET A 9 7.467 -39.893 -11.396 1.00 51.11 H new ATOM 0 HG3 MET A 9 8.571 -41.011 -12.171 1.00 51.11 H new ATOM 0 HE1 MET A 9 5.757 -43.390 -10.772 1.00 24.31 H new ATOM 0 HE2 MET A 9 5.550 -41.748 -11.425 1.00 24.31 H new ATOM 0 HE3 MET A 9 6.673 -42.883 -12.211 1.00 24.31 H new ATOM 155 N GLY A 10 11.489 -40.457 -12.648 1.00 41.12 N ATOM 156 CA GLY A 10 11.962 -41.176 -13.824 1.00 0.44 C ATOM 157 C GLY A 10 11.568 -42.643 -13.795 1.00 11.55 C ATOM 158 O GLY A 10 10.642 -43.024 -13.076 1.00 74.43 O ATOM 0 H GLY A 10 11.926 -40.746 -11.773 1.00 41.12 H new ATOM 0 HA2 GLY A 10 11.555 -40.710 -14.721 1.00 0.44 H new ATOM 0 HA3 GLY A 10 13.047 -41.094 -13.886 1.00 0.44 H new ATOM 162 N THR A 11 12.276 -43.469 -14.564 1.00 73.24 N ATOM 163 CA THR A 11 11.987 -44.902 -14.648 1.00 53.21 C ATOM 164 C THR A 11 13.282 -45.720 -14.623 1.00 62.12 C ATOM 165 O THR A 11 14.378 -45.162 -14.519 1.00 32.23 O ATOM 166 CB THR A 11 11.173 -45.235 -15.914 1.00 24.22 C ATOM 167 OG1 THR A 11 10.831 -46.630 -15.953 1.00 5.43 O ATOM 168 CG2 THR A 11 11.966 -44.865 -17.141 1.00 21.21 C ATOM 0 H THR A 11 13.060 -43.168 -15.143 1.00 73.24 H new ATOM 0 HA THR A 11 11.388 -45.168 -13.777 1.00 53.21 H new ATOM 0 HB THR A 11 10.248 -44.658 -15.891 1.00 24.22 H new ATOM 0 HG1 THR A 11 10.314 -46.817 -16.764 1.00 5.43 H new ATOM 0 HG21 THR A 11 11.387 -45.102 -18.034 1.00 21.21 H new ATOM 0 HG22 THR A 11 12.186 -43.798 -17.124 1.00 21.21 H new ATOM 0 HG23 THR A 11 12.900 -45.427 -17.154 1.00 21.21 H new ATOM 176 N LEU A 12 13.151 -47.041 -14.722 1.00 73.43 N ATOM 177 CA LEU A 12 14.300 -47.946 -14.648 1.00 60.44 C ATOM 178 C LEU A 12 14.378 -48.823 -15.897 1.00 2.34 C ATOM 179 O LEU A 12 13.456 -49.586 -16.187 1.00 43.41 O ATOM 180 CB LEU A 12 14.208 -48.836 -13.397 1.00 50.00 C ATOM 181 CG LEU A 12 14.226 -48.092 -12.050 1.00 32.44 C ATOM 182 CD1 LEU A 12 14.081 -49.077 -10.892 1.00 40.14 C ATOM 183 CD2 LEU A 12 15.506 -47.267 -11.904 1.00 54.24 C ATOM 0 H LEU A 12 12.256 -47.512 -14.854 1.00 73.43 H new ATOM 0 HA LEU A 12 15.202 -47.338 -14.586 1.00 60.44 H new ATOM 0 HB2 LEU A 12 13.291 -49.422 -13.456 1.00 50.00 H new ATOM 0 HB3 LEU A 12 15.038 -49.542 -13.413 1.00 50.00 H new ATOM 0 HG LEU A 12 13.378 -47.408 -12.025 1.00 32.44 H new ATOM 0 HD11 LEU A 12 14.096 -48.533 -9.948 1.00 40.14 H new ATOM 0 HD12 LEU A 12 13.137 -49.614 -10.987 1.00 40.14 H new ATOM 0 HD13 LEU A 12 14.907 -49.788 -10.914 1.00 40.14 H new ATOM 0 HD21 LEU A 12 15.498 -46.749 -10.945 1.00 54.24 H new ATOM 0 HD22 LEU A 12 16.372 -47.927 -11.953 1.00 54.24 H new ATOM 0 HD23 LEU A 12 15.562 -46.536 -12.710 1.00 54.24 H new ATOM 195 N GLU A 13 15.482 -48.706 -16.628 1.00 52.03 N ATOM 196 CA GLU A 13 15.718 -49.524 -17.815 1.00 22.25 C ATOM 197 C GLU A 13 16.347 -50.859 -17.405 1.00 62.32 C ATOM 198 O GLU A 13 17.528 -50.917 -17.050 1.00 2.42 O ATOM 199 CB GLU A 13 16.629 -48.775 -18.800 1.00 51.21 C ATOM 200 CG GLU A 13 16.051 -47.439 -19.264 1.00 55.21 C ATOM 201 CD GLU A 13 17.016 -46.643 -20.127 1.00 31.33 C ATOM 202 OE1 GLU A 13 17.043 -46.854 -21.359 1.00 54.41 O ATOM 203 OE2 GLU A 13 17.752 -45.796 -19.582 1.00 45.33 O ATOM 0 H GLU A 13 16.233 -48.048 -16.418 1.00 52.03 H new ATOM 0 HA GLU A 13 14.768 -49.722 -18.311 1.00 22.25 H new ATOM 0 HB2 GLU A 13 17.596 -48.600 -18.328 1.00 51.21 H new ATOM 0 HB3 GLU A 13 16.808 -49.407 -19.670 1.00 51.21 H new ATOM 0 HG2 GLU A 13 15.135 -47.621 -19.826 1.00 55.21 H new ATOM 0 HG3 GLU A 13 15.777 -46.845 -18.392 1.00 55.21 H new ATOM 210 N ALA A 14 15.541 -51.919 -17.432 1.00 75.13 N ATOM 211 CA ALA A 14 15.970 -53.240 -16.969 1.00 74.41 C ATOM 212 C ALA A 14 16.814 -53.966 -18.020 1.00 5.34 C ATOM 213 O ALA A 14 17.083 -53.433 -19.101 1.00 31.41 O ATOM 214 CB ALA A 14 14.754 -54.081 -16.588 1.00 21.45 C ATOM 0 H ALA A 14 14.580 -51.889 -17.772 1.00 75.13 H new ATOM 0 HA ALA A 14 16.598 -53.097 -16.090 1.00 74.41 H new ATOM 0 HB1 ALA A 14 15.083 -55.062 -16.245 1.00 21.45 H new ATOM 0 HB2 ALA A 14 14.203 -53.583 -15.790 1.00 21.45 H new ATOM 0 HB3 ALA A 14 14.107 -54.199 -17.457 1.00 21.45 H new ATOM 220 N GLN A 15 17.222 -55.194 -17.696 1.00 73.23 N ATOM 221 CA GLN A 15 18.074 -55.996 -18.577 1.00 10.44 C ATOM 222 C GLN A 15 17.462 -57.379 -18.803 1.00 33.22 C ATOM 223 O GLN A 15 16.760 -57.911 -17.934 1.00 53.33 O ATOM 224 CB GLN A 15 19.475 -56.155 -17.967 1.00 53.15 C ATOM 225 CG GLN A 15 20.208 -54.840 -17.728 1.00 42.52 C ATOM 226 CD GLN A 15 21.560 -55.035 -17.062 1.00 12.50 C ATOM 227 OE1 GLN A 15 21.763 -55.984 -16.298 1.00 73.33 O ATOM 228 NE2 GLN A 15 22.492 -54.142 -17.349 1.00 64.32 N ATOM 0 H GLN A 15 16.974 -55.658 -16.822 1.00 73.23 H new ATOM 0 HA GLN A 15 18.153 -55.479 -19.533 1.00 10.44 H new ATOM 0 HB2 GLN A 15 19.388 -56.686 -17.019 1.00 53.15 H new ATOM 0 HB3 GLN A 15 20.078 -56.778 -18.628 1.00 53.15 H new ATOM 0 HG2 GLN A 15 20.347 -54.328 -18.680 1.00 42.52 H new ATOM 0 HG3 GLN A 15 19.591 -54.193 -17.105 1.00 42.52 H new ATOM 0 HE21 GLN A 15 22.283 -53.373 -17.985 1.00 64.32 H new ATOM 0 HE22 GLN A 15 23.420 -54.222 -16.934 1.00 64.32 H new ATOM 237 N THR A 16 17.726 -57.952 -19.972 1.00 2.53 N ATOM 238 CA THR A 16 17.310 -59.313 -20.281 1.00 64.02 C ATOM 239 C THR A 16 18.474 -60.276 -20.043 1.00 10.20 C ATOM 240 O THR A 16 19.481 -60.226 -20.754 1.00 24.02 O ATOM 241 CB THR A 16 16.816 -59.426 -21.745 1.00 64.03 C ATOM 242 OG1 THR A 16 17.820 -58.935 -22.649 1.00 72.31 O ATOM 243 CG2 THR A 16 15.527 -58.637 -21.952 1.00 44.12 C ATOM 0 H THR A 16 18.231 -57.489 -20.727 1.00 2.53 H new ATOM 0 HA THR A 16 16.481 -59.577 -19.624 1.00 64.02 H new ATOM 0 HB THR A 16 16.621 -60.479 -21.949 1.00 64.03 H new ATOM 0 HG1 THR A 16 18.707 -59.196 -22.325 1.00 72.31 H new ATOM 0 HG21 THR A 16 15.203 -58.734 -22.988 1.00 44.12 H new ATOM 0 HG22 THR A 16 14.752 -59.026 -21.292 1.00 44.12 H new ATOM 0 HG23 THR A 16 15.703 -57.586 -21.724 1.00 44.12 H new ATOM 251 N GLN A 17 18.345 -61.131 -19.030 1.00 71.03 N ATOM 252 CA GLN A 17 19.420 -62.048 -18.653 1.00 43.41 C ATOM 253 C GLN A 17 19.526 -63.202 -19.658 1.00 71.34 C ATOM 254 O GLN A 17 18.568 -63.959 -19.859 1.00 24.31 O ATOM 255 CB GLN A 17 19.186 -62.590 -17.233 1.00 10.42 C ATOM 256 CG GLN A 17 19.001 -61.500 -16.176 1.00 13.32 C ATOM 257 CD GLN A 17 20.212 -60.584 -16.016 1.00 52.11 C ATOM 258 OE1 GLN A 17 20.069 -59.397 -15.712 1.00 64.41 O ATOM 259 NE2 GLN A 17 21.411 -61.126 -16.186 1.00 14.45 N ATOM 0 H GLN A 17 17.506 -61.208 -18.455 1.00 71.03 H new ATOM 0 HA GLN A 17 20.361 -61.498 -18.665 1.00 43.41 H new ATOM 0 HB2 GLN A 17 18.303 -63.229 -17.240 1.00 10.42 H new ATOM 0 HB3 GLN A 17 20.032 -63.217 -16.950 1.00 10.42 H new ATOM 0 HG2 GLN A 17 18.133 -60.896 -16.439 1.00 13.32 H new ATOM 0 HG3 GLN A 17 18.784 -61.970 -15.217 1.00 13.32 H new ATOM 0 HE21 GLN A 17 21.494 -62.111 -16.437 1.00 14.45 H new ATOM 0 HE22 GLN A 17 22.249 -60.558 -16.065 1.00 14.45 H new ATOM 268 N GLY A 18 20.691 -63.322 -20.290 1.00 1.13 N ATOM 269 CA GLY A 18 20.905 -64.348 -21.300 1.00 52.34 C ATOM 270 C GLY A 18 21.142 -65.729 -20.707 1.00 34.32 C ATOM 271 O GLY A 18 21.195 -65.885 -19.485 1.00 71.43 O ATOM 0 H GLY A 18 21.498 -62.722 -20.119 1.00 1.13 H new ATOM 0 HA2 GLY A 18 20.038 -64.386 -21.960 1.00 52.34 H new ATOM 0 HA3 GLY A 18 21.761 -64.071 -21.915 1.00 52.34 H new ATOM 275 N PRO A 19 21.268 -66.763 -21.560 1.00 11.21 N ATOM 276 CA PRO A 19 21.506 -68.135 -21.133 1.00 44.43 C ATOM 277 C PRO A 19 22.994 -68.510 -21.156 1.00 61.53 C ATOM 278 O PRO A 19 23.871 -67.649 -21.070 1.00 33.10 O ATOM 279 CB PRO A 19 20.730 -68.916 -22.195 1.00 34.13 C ATOM 280 CG PRO A 19 20.898 -68.114 -23.451 1.00 11.35 C ATOM 281 CD PRO A 19 21.174 -66.683 -23.030 1.00 74.15 C ATOM 0 HA PRO A 19 21.199 -68.327 -20.105 1.00 44.43 H new ATOM 0 HB2 PRO A 19 21.125 -69.925 -22.313 1.00 34.13 H new ATOM 0 HB3 PRO A 19 19.679 -69.015 -21.925 1.00 34.13 H new ATOM 0 HG2 PRO A 19 21.720 -68.505 -24.051 1.00 11.35 H new ATOM 0 HG3 PRO A 19 20.000 -68.169 -24.066 1.00 11.35 H new ATOM 0 HD2 PRO A 19 22.097 -66.307 -23.470 1.00 74.15 H new ATOM 0 HD3 PRO A 19 20.375 -66.012 -23.344 1.00 74.15 H new ATOM 289 N GLY A 20 23.257 -69.806 -21.274 1.00 53.25 N ATOM 290 CA GLY A 20 24.615 -70.320 -21.334 1.00 63.03 C ATOM 291 C GLY A 20 24.656 -71.632 -22.085 1.00 10.53 C ATOM 292 O GLY A 20 23.613 -72.113 -22.532 1.00 74.25 O ATOM 0 H GLY A 20 22.536 -70.526 -21.330 1.00 53.25 H new ATOM 0 HA2 GLY A 20 25.263 -69.594 -21.825 1.00 63.03 H new ATOM 0 HA3 GLY A 20 25.001 -70.461 -20.324 1.00 63.03 H new ATOM 296 N SER A 21 25.837 -72.223 -22.227 1.00 73.15 N ATOM 297 CA SER A 21 25.980 -73.473 -22.967 1.00 14.22 C ATOM 298 C SER A 21 27.171 -74.287 -22.463 1.00 10.43 C ATOM 299 O SER A 21 28.327 -73.905 -22.653 1.00 10.21 O ATOM 300 CB SER A 21 26.124 -73.194 -24.469 1.00 12.32 C ATOM 301 OG SER A 21 24.952 -72.590 -25.001 1.00 22.03 O ATOM 0 H SER A 21 26.708 -71.858 -21.841 1.00 73.15 H new ATOM 0 HA SER A 21 25.078 -74.061 -22.802 1.00 14.22 H new ATOM 0 HB2 SER A 21 26.980 -72.541 -24.638 1.00 12.32 H new ATOM 0 HB3 SER A 21 26.325 -74.127 -24.996 1.00 12.32 H new ATOM 0 HG SER A 21 25.076 -72.423 -25.959 1.00 22.03 H new ATOM 307 N MET A 22 26.862 -75.395 -21.800 1.00 63.14 N ATOM 308 CA MET A 22 27.855 -76.374 -21.357 1.00 73.31 C ATOM 309 C MET A 22 27.236 -77.766 -21.467 1.00 20.42 C ATOM 310 O MET A 22 26.145 -77.907 -22.026 1.00 43.13 O ATOM 311 CB MET A 22 28.299 -76.102 -19.904 1.00 54.34 C ATOM 312 CG MET A 22 29.042 -74.782 -19.709 1.00 52.42 C ATOM 313 SD MET A 22 29.535 -74.495 -17.993 1.00 3.25 S ATOM 314 CE MET A 22 30.598 -75.909 -17.703 1.00 22.13 C ATOM 0 H MET A 22 25.905 -75.644 -21.551 1.00 63.14 H new ATOM 0 HA MET A 22 28.741 -76.301 -21.987 1.00 73.31 H new ATOM 0 HB2 MET A 22 27.419 -76.108 -19.261 1.00 54.34 H new ATOM 0 HB3 MET A 22 28.941 -76.919 -19.574 1.00 54.34 H new ATOM 0 HG2 MET A 22 29.929 -74.774 -20.342 1.00 52.42 H new ATOM 0 HG3 MET A 22 28.406 -73.961 -20.041 1.00 52.42 H new ATOM 0 HE1 MET A 22 31.211 -75.728 -16.820 1.00 22.13 H new ATOM 0 HE2 MET A 22 29.987 -76.797 -17.545 1.00 22.13 H new ATOM 0 HE3 MET A 22 31.244 -76.062 -18.568 1.00 22.13 H new ATOM 324 N GLN A 23 27.923 -78.787 -20.954 1.00 42.32 N ATOM 325 CA GLN A 23 27.364 -80.142 -20.890 1.00 71.32 C ATOM 326 C GLN A 23 28.353 -81.101 -20.232 1.00 74.11 C ATOM 327 O GLN A 23 29.569 -80.934 -20.363 1.00 61.22 O ATOM 328 CB GLN A 23 26.979 -80.653 -22.291 1.00 23.42 C ATOM 329 CG GLN A 23 28.154 -80.817 -23.248 1.00 73.31 C ATOM 330 CD GLN A 23 27.712 -81.223 -24.643 1.00 45.10 C ATOM 331 OE1 GLN A 23 27.490 -80.376 -25.515 1.00 2.12 O ATOM 332 NE2 GLN A 23 27.551 -82.519 -24.857 1.00 73.02 N ATOM 0 H GLN A 23 28.867 -78.704 -20.576 1.00 42.32 H new ATOM 0 HA GLN A 23 26.459 -80.100 -20.283 1.00 71.32 H new ATOM 0 HB2 GLN A 23 26.474 -81.613 -22.188 1.00 23.42 H new ATOM 0 HB3 GLN A 23 26.261 -79.961 -22.732 1.00 23.42 H new ATOM 0 HG2 GLN A 23 28.707 -79.880 -23.304 1.00 73.31 H new ATOM 0 HG3 GLN A 23 28.838 -81.568 -22.854 1.00 73.31 H new ATOM 0 HE21 GLN A 23 27.745 -83.187 -24.111 1.00 73.02 H new ATOM 0 HE22 GLN A 23 27.233 -82.850 -25.768 1.00 73.02 H new ATOM 341 N GLY A 24 27.828 -82.093 -19.520 1.00 4.42 N ATOM 342 CA GLY A 24 28.667 -83.087 -18.870 1.00 12.50 C ATOM 343 C GLY A 24 27.921 -84.392 -18.656 1.00 71.41 C ATOM 344 O GLY A 24 26.951 -84.439 -17.896 1.00 61.51 O ATOM 0 H GLY A 24 26.827 -82.228 -19.380 1.00 4.42 H new ATOM 0 HA2 GLY A 24 29.554 -83.269 -19.477 1.00 12.50 H new ATOM 0 HA3 GLY A 24 29.011 -82.702 -17.910 1.00 12.50 H new ATOM 348 N SER A 25 28.363 -85.450 -19.331 1.00 41.01 N ATOM 349 CA SER A 25 27.692 -86.743 -19.263 1.00 14.24 C ATOM 350 C SER A 25 28.693 -87.889 -19.413 1.00 14.43 C ATOM 351 O SER A 25 29.434 -87.950 -20.400 1.00 11.33 O ATOM 352 CB SER A 25 26.625 -86.824 -20.364 1.00 34.44 C ATOM 353 OG SER A 25 27.184 -86.531 -21.637 1.00 60.00 O ATOM 0 H SER A 25 29.186 -85.436 -19.933 1.00 41.01 H new ATOM 0 HA SER A 25 27.216 -86.839 -18.287 1.00 14.24 H new ATOM 0 HB2 SER A 25 26.185 -87.821 -20.377 1.00 34.44 H new ATOM 0 HB3 SER A 25 25.819 -86.123 -20.147 1.00 34.44 H new ATOM 0 HG SER A 25 28.086 -86.910 -21.693 1.00 60.00 H new ATOM 359 N MET A 26 28.721 -88.778 -18.422 1.00 62.34 N ATOM 360 CA MET A 26 29.537 -89.993 -18.473 1.00 2.51 C ATOM 361 C MET A 26 28.755 -91.176 -17.906 1.00 11.11 C ATOM 362 O MET A 26 28.312 -91.134 -16.755 1.00 5.31 O ATOM 363 CB MET A 26 30.837 -89.839 -17.671 1.00 50.04 C ATOM 364 CG MET A 26 31.861 -88.891 -18.278 1.00 55.43 C ATOM 365 SD MET A 26 33.378 -88.832 -17.301 1.00 2.11 S ATOM 366 CE MET A 26 34.401 -87.748 -18.293 1.00 34.05 C ATOM 0 H MET A 26 28.181 -88.678 -17.563 1.00 62.34 H new ATOM 0 HA MET A 26 29.788 -90.168 -19.519 1.00 2.51 H new ATOM 0 HB2 MET A 26 30.588 -89.488 -16.670 1.00 50.04 H new ATOM 0 HB3 MET A 26 31.296 -90.822 -17.560 1.00 50.04 H new ATOM 0 HG2 MET A 26 32.095 -89.210 -19.294 1.00 55.43 H new ATOM 0 HG3 MET A 26 31.434 -87.891 -18.348 1.00 55.43 H new ATOM 0 HE1 MET A 26 35.370 -87.620 -17.811 1.00 34.05 H new ATOM 0 HE2 MET A 26 34.542 -88.185 -19.282 1.00 34.05 H new ATOM 0 HE3 MET A 26 33.914 -86.778 -18.391 1.00 34.05 H new ATOM 376 N PRO A 27 28.557 -92.241 -18.698 1.00 74.34 N ATOM 377 CA PRO A 27 27.963 -93.476 -18.205 1.00 71.44 C ATOM 378 C PRO A 27 28.984 -94.279 -17.409 1.00 34.14 C ATOM 379 O PRO A 27 29.909 -94.863 -17.974 1.00 11.14 O ATOM 380 CB PRO A 27 27.537 -94.234 -19.475 1.00 53.44 C ATOM 381 CG PRO A 27 27.865 -93.329 -20.629 1.00 33.13 C ATOM 382 CD PRO A 27 28.882 -92.337 -20.125 1.00 61.22 C ATOM 0 HA PRO A 27 27.124 -93.296 -17.533 1.00 71.44 H new ATOM 0 HB2 PRO A 27 28.068 -95.182 -19.560 1.00 53.44 H new ATOM 0 HB3 PRO A 27 26.472 -94.466 -19.452 1.00 53.44 H new ATOM 0 HG2 PRO A 27 28.264 -93.900 -21.468 1.00 33.13 H new ATOM 0 HG3 PRO A 27 26.971 -92.819 -20.987 1.00 33.13 H new ATOM 0 HD2 PRO A 27 29.902 -92.686 -20.286 1.00 61.22 H new ATOM 0 HD3 PRO A 27 28.792 -91.374 -20.627 1.00 61.22 H new ATOM 390 N SER A 28 28.826 -94.283 -16.100 1.00 3.22 N ATOM 391 CA SER A 28 29.759 -94.969 -15.212 1.00 34.34 C ATOM 392 C SER A 28 29.114 -96.217 -14.623 1.00 61.20 C ATOM 393 O SER A 28 27.918 -96.454 -14.802 1.00 25.04 O ATOM 394 CB SER A 28 30.222 -94.027 -14.088 1.00 12.32 C ATOM 395 OG SER A 28 31.135 -94.678 -13.214 1.00 70.24 O ATOM 0 H SER A 28 28.056 -93.817 -15.620 1.00 3.22 H new ATOM 0 HA SER A 28 30.630 -95.270 -15.794 1.00 34.34 H new ATOM 0 HB2 SER A 28 30.695 -93.145 -14.521 1.00 12.32 H new ATOM 0 HB3 SER A 28 29.358 -93.680 -13.522 1.00 12.32 H new ATOM 0 HG SER A 28 30.957 -94.402 -12.291 1.00 70.24 H new ATOM 401 N SER A 29 29.918 -97.013 -13.929 1.00 60.23 N ATOM 402 CA SER A 29 29.434 -98.210 -13.253 1.00 32.34 C ATOM 403 C SER A 29 29.788 -98.153 -11.766 1.00 73.11 C ATOM 404 O SER A 29 29.451 -99.060 -11.003 1.00 31.03 O ATOM 405 CB SER A 29 30.038 -99.464 -13.901 1.00 33.44 C ATOM 406 OG SER A 29 29.761 -99.506 -15.294 1.00 52.53 O ATOM 0 H SER A 29 30.919 -96.848 -13.819 1.00 60.23 H new ATOM 0 HA SER A 29 28.349 -98.257 -13.351 1.00 32.34 H new ATOM 0 HB2 SER A 29 31.116 -99.476 -13.741 1.00 33.44 H new ATOM 0 HB3 SER A 29 29.635-100.355 -13.420 1.00 33.44 H new ATOM 0 HG SER A 29 30.158-100.313 -15.682 1.00 52.53 H new ATOM 412 N SER A 30 30.452 -97.067 -11.364 1.00 64.34 N ATOM 413 CA SER A 30 30.898 -96.892 -9.986 1.00 21.24 C ATOM 414 C SER A 30 29.704 -96.746 -9.042 1.00 2.22 C ATOM 415 O SER A 30 28.714 -96.105 -9.384 1.00 33.13 O ATOM 416 CB SER A 30 31.797 -95.654 -9.889 1.00 51.34 C ATOM 417 OG SER A 30 32.834 -95.700 -10.856 1.00 75.40 O ATOM 0 H SER A 30 30.693 -96.292 -11.981 1.00 64.34 H new ATOM 0 HA SER A 30 31.462 -97.776 -9.688 1.00 21.24 H new ATOM 0 HB2 SER A 30 31.199 -94.754 -10.034 1.00 51.34 H new ATOM 0 HB3 SER A 30 32.229 -95.592 -8.890 1.00 51.34 H new ATOM 0 HG SER A 30 32.476 -95.447 -11.732 1.00 75.40 H new ATOM 423 N GLU A 31 29.824 -97.328 -7.853 1.00 40.24 N ATOM 424 CA GLU A 31 28.763 -97.305 -6.839 1.00 62.35 C ATOM 425 C GLU A 31 28.241 -95.883 -6.582 1.00 41.11 C ATOM 426 O GLU A 31 27.091 -95.696 -6.172 1.00 60.14 O ATOM 427 CB GLU A 31 29.302 -97.895 -5.526 1.00 12.31 C ATOM 428 CG GLU A 31 28.242 -98.116 -4.451 1.00 22.01 C ATOM 429 CD GLU A 31 27.287 -99.246 -4.797 1.00 14.11 C ATOM 430 OE1 GLU A 31 27.697-100.419 -4.692 1.00 62.50 O ATOM 431 OE2 GLU A 31 26.125 -98.971 -5.161 1.00 55.42 O ATOM 0 H GLU A 31 30.661 -97.832 -7.560 1.00 40.24 H new ATOM 0 HA GLU A 31 27.931 -97.901 -7.214 1.00 62.35 H new ATOM 0 HB2 GLU A 31 29.787 -98.847 -5.742 1.00 12.31 H new ATOM 0 HB3 GLU A 31 30.069 -97.229 -5.131 1.00 12.31 H new ATOM 0 HG2 GLU A 31 28.732 -98.337 -3.503 1.00 22.01 H new ATOM 0 HG3 GLU A 31 27.675 -97.196 -4.310 1.00 22.01 H new ATOM 438 N ASP A 32 29.090 -94.891 -6.834 1.00 41.14 N ATOM 439 CA ASP A 32 28.783 -93.498 -6.503 1.00 53.41 C ATOM 440 C ASP A 32 27.684 -92.912 -7.395 1.00 74.21 C ATOM 441 O ASP A 32 27.014 -91.954 -7.000 1.00 0.32 O ATOM 442 CB ASP A 32 30.053 -92.643 -6.609 1.00 20.24 C ATOM 443 CG ASP A 32 29.849 -91.217 -6.112 1.00 71.33 C ATOM 444 OD1 ASP A 32 30.013 -90.980 -4.894 1.00 22.21 O ATOM 445 OD2 ASP A 32 29.534 -90.328 -6.935 1.00 71.55 O ATOM 0 H ASP A 32 30.003 -95.025 -7.269 1.00 41.14 H new ATOM 0 HA ASP A 32 28.410 -93.484 -5.479 1.00 53.41 H new ATOM 0 HB2 ASP A 32 30.851 -93.113 -6.033 1.00 20.24 H new ATOM 0 HB3 ASP A 32 30.382 -92.617 -7.648 1.00 20.24 H new ATOM 450 N VAL A 33 27.486 -93.476 -8.589 1.00 64.33 N ATOM 451 CA VAL A 33 26.493 -92.934 -9.516 1.00 3.41 C ATOM 452 C VAL A 33 25.081 -93.071 -8.938 1.00 52.31 C ATOM 453 O VAL A 33 24.512 -94.163 -8.855 1.00 55.05 O ATOM 454 CB VAL A 33 26.580 -93.565 -10.933 1.00 32.24 C ATOM 455 CG1 VAL A 33 26.346 -95.073 -10.906 1.00 21.34 C ATOM 456 CG2 VAL A 33 25.603 -92.879 -11.889 1.00 54.35 C ATOM 0 H VAL A 33 27.991 -94.293 -8.931 1.00 64.33 H new ATOM 0 HA VAL A 33 26.721 -91.875 -9.637 1.00 3.41 H new ATOM 0 HB VAL A 33 27.595 -93.405 -11.298 1.00 32.24 H new ATOM 0 HG11 VAL A 33 26.416 -95.470 -11.919 1.00 21.34 H new ATOM 0 HG12 VAL A 33 27.100 -95.547 -10.277 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.355 -95.280 -10.503 1.00 21.34 H new ATOM 0 HG21 VAL A 33 25.679 -93.335 -12.876 1.00 54.35 H new ATOM 0 HG22 VAL A 33 24.586 -92.993 -11.514 1.00 54.35 H new ATOM 0 HG23 VAL A 33 25.847 -91.819 -11.959 1.00 54.35 H new ATOM 466 N THR A 34 24.541 -91.939 -8.523 1.00 32.15 N ATOM 467 CA THR A 34 23.263 -91.875 -7.827 1.00 71.11 C ATOM 468 C THR A 34 22.136 -91.468 -8.785 1.00 2.24 C ATOM 469 O THR A 34 22.385 -90.834 -9.813 1.00 60.35 O ATOM 470 CB THR A 34 23.362 -90.856 -6.666 1.00 3.00 C ATOM 471 OG1 THR A 34 24.529 -91.140 -5.875 1.00 50.55 O ATOM 472 CG2 THR A 34 22.123 -90.892 -5.778 1.00 1.10 C ATOM 0 H THR A 34 24.979 -91.028 -8.660 1.00 32.15 H new ATOM 0 HA THR A 34 23.031 -92.864 -7.431 1.00 71.11 H new ATOM 0 HB THR A 34 23.436 -89.859 -7.100 1.00 3.00 H new ATOM 0 HG1 THR A 34 25.284 -91.341 -6.466 1.00 50.55 H new ATOM 0 HG21 THR A 34 22.230 -90.163 -4.975 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.242 -90.650 -6.373 1.00 1.10 H new ATOM 0 HG23 THR A 34 22.010 -91.889 -5.351 1.00 1.10 H new ATOM 480 N THR A 35 20.905 -91.854 -8.453 1.00 71.32 N ATOM 481 CA THR A 35 19.733 -91.505 -9.253 1.00 44.34 C ATOM 482 C THR A 35 18.502 -91.361 -8.363 1.00 64.43 C ATOM 483 O THR A 35 18.251 -92.208 -7.506 1.00 74.11 O ATOM 484 CB THR A 35 19.461 -92.572 -10.343 1.00 51.43 C ATOM 485 OG1 THR A 35 20.560 -92.615 -11.267 1.00 13.30 O ATOM 486 CG2 THR A 35 18.160 -92.294 -11.101 1.00 62.32 C ATOM 0 H THR A 35 20.693 -92.414 -7.627 1.00 71.32 H new ATOM 0 HA THR A 35 19.939 -90.553 -9.741 1.00 44.34 H new ATOM 0 HB THR A 35 19.357 -93.536 -9.844 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.238 -92.406 -12.169 1.00 13.30 H new ATOM 0 HG21 THR A 35 18.007 -93.065 -11.856 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.324 -92.299 -10.402 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.222 -91.320 -11.585 1.00 62.32 H new ATOM 494 N LEU A 36 17.766 -90.265 -8.548 1.00 13.40 N ATOM 495 CA LEU A 36 16.487 -90.058 -7.867 1.00 32.23 C ATOM 496 C LEU A 36 15.523 -89.336 -8.798 1.00 30.20 C ATOM 497 O LEU A 36 15.933 -88.493 -9.603 1.00 35.32 O ATOM 498 CB LEU A 36 16.643 -89.259 -6.557 1.00 70.33 C ATOM 499 CG LEU A 36 17.437 -89.959 -5.429 1.00 3.23 C ATOM 500 CD1 LEU A 36 18.902 -89.529 -5.438 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.802 -89.700 -4.062 1.00 4.14 C ATOM 0 H LEU A 36 18.036 -89.502 -9.168 1.00 13.40 H new ATOM 0 HA LEU A 36 16.093 -91.040 -7.605 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.134 -88.313 -6.787 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.649 -89.019 -6.180 1.00 70.33 H new ATOM 0 HG LEU A 36 17.400 -91.032 -5.617 1.00 3.23 H new ATOM 0 HD11 LEU A 36 19.435 -90.037 -4.634 1.00 10.31 H new ATOM 0 HD12 LEU A 36 19.352 -89.792 -6.395 1.00 10.31 H new ATOM 0 HD13 LEU A 36 18.966 -88.451 -5.291 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.382 -90.205 -3.290 1.00 4.14 H new ATOM 0 HD22 LEU A 36 16.789 -88.628 -3.864 1.00 4.14 H new ATOM 0 HD23 LEU A 36 15.781 -90.082 -4.057 1.00 4.14 H new ATOM 513 N CYS A 37 14.244 -89.675 -8.695 1.00 71.23 N ATOM 514 CA CYS A 37 13.211 -89.033 -9.504 1.00 40.31 C ATOM 515 C CYS A 37 12.734 -87.753 -8.824 1.00 32.44 C ATOM 516 O CYS A 37 12.556 -87.718 -7.605 1.00 34.41 O ATOM 517 CB CYS A 37 12.037 -89.988 -9.734 1.00 1.21 C ATOM 518 SG CYS A 37 12.495 -91.500 -10.610 1.00 21.43 S ATOM 0 H CYS A 37 13.895 -90.392 -8.059 1.00 71.23 H new ATOM 0 HA CYS A 37 13.636 -88.776 -10.474 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.602 -90.254 -8.771 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.264 -89.470 -10.301 1.00 1.21 H new ATOM 0 HG CYS A 37 11.436 -92.231 -10.797 1.00 21.43 H new ATOM 524 N TYR A 38 12.539 -86.707 -9.615 1.00 44.52 N ATOM 525 CA TYR A 38 12.129 -85.402 -9.107 1.00 13.14 C ATOM 526 C TYR A 38 10.710 -85.072 -9.557 1.00 33.50 C ATOM 527 O TYR A 38 10.297 -85.434 -10.658 1.00 34.40 O ATOM 528 CB TYR A 38 13.093 -84.310 -9.600 1.00 2.52 C ATOM 529 CG TYR A 38 14.430 -84.276 -8.875 1.00 51.01 C ATOM 530 CD1 TYR A 38 15.194 -85.427 -8.706 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.921 -83.085 -8.349 1.00 74.21 C ATOM 532 CE1 TYR A 38 16.406 -85.388 -8.042 1.00 42.41 C ATOM 533 CE2 TYR A 38 16.130 -83.041 -7.687 1.00 41.03 C ATOM 534 CZ TYR A 38 16.867 -84.193 -7.533 1.00 0.42 C ATOM 535 OH TYR A 38 18.072 -84.150 -6.874 1.00 72.24 O ATOM 0 H TYR A 38 12.660 -86.738 -10.627 1.00 44.52 H new ATOM 0 HA TYR A 38 12.155 -85.438 -8.018 1.00 13.14 H new ATOM 0 HB2 TYR A 38 13.275 -84.457 -10.665 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.609 -83.339 -9.490 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.834 -86.366 -9.100 1.00 5.21 H new ATOM 0 HD2 TYR A 38 14.345 -82.178 -8.461 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.989 -86.289 -7.923 1.00 42.41 H new ATOM 0 HE2 TYR A 38 16.497 -82.106 -7.291 1.00 41.03 H new ATOM 0 HH TYR A 38 18.040 -84.743 -6.094 1.00 72.24 H new ATOM 545 N ARG A 39 9.968 -84.404 -8.686 1.00 41.31 N ATOM 546 CA ARG A 39 8.640 -83.897 -9.007 1.00 13.40 C ATOM 547 C ARG A 39 8.321 -82.712 -8.101 1.00 14.02 C ATOM 548 O ARG A 39 8.176 -82.867 -6.888 1.00 25.40 O ATOM 549 CB ARG A 39 7.578 -85.001 -8.856 1.00 74.33 C ATOM 550 CG ARG A 39 6.146 -84.516 -9.081 1.00 12.21 C ATOM 551 CD ARG A 39 5.150 -85.671 -9.100 1.00 54.31 C ATOM 552 NE ARG A 39 5.269 -86.525 -7.916 1.00 25.32 N ATOM 553 CZ ARG A 39 4.237 -87.027 -7.240 1.00 14.22 C ATOM 554 NH1 ARG A 39 2.990 -86.741 -7.598 1.00 32.13 N ATOM 555 NH2 ARG A 39 4.458 -87.816 -6.201 1.00 64.21 N ATOM 0 H ARG A 39 10.270 -84.197 -7.734 1.00 41.31 H new ATOM 0 HA ARG A 39 8.626 -83.569 -10.046 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.796 -85.801 -9.564 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.653 -85.430 -7.857 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.873 -83.814 -8.293 1.00 12.21 H new ATOM 0 HG3 ARG A 39 6.091 -83.973 -10.025 1.00 12.21 H new ATOM 0 HD2 ARG A 39 4.137 -85.274 -9.159 1.00 54.31 H new ATOM 0 HD3 ARG A 39 5.309 -86.271 -9.996 1.00 54.31 H new ATOM 0 HE ARG A 39 6.207 -86.751 -7.586 1.00 25.32 H new ATOM 0 HH11 ARG A 39 2.816 -86.132 -8.397 1.00 32.13 H new ATOM 0 HH12 ARG A 39 2.207 -87.131 -7.074 1.00 32.13 H new ATOM 0 HH21 ARG A 39 5.414 -88.036 -5.922 1.00 64.21 H new ATOM 0 HH22 ARG A 39 3.672 -88.204 -5.679 1.00 64.21 H new ATOM 569 N VAL A 40 8.249 -81.526 -8.687 1.00 72.34 N ATOM 570 CA VAL A 40 7.979 -80.309 -7.928 1.00 72.44 C ATOM 571 C VAL A 40 6.644 -79.712 -8.347 1.00 70.43 C ATOM 572 O VAL A 40 6.255 -79.790 -9.512 1.00 61.43 O ATOM 573 CB VAL A 40 9.097 -79.251 -8.124 1.00 33.24 C ATOM 574 CG1 VAL A 40 9.107 -78.731 -9.559 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.952 -78.096 -7.127 1.00 22.25 C ATOM 0 H VAL A 40 8.374 -81.378 -9.688 1.00 72.34 H new ATOM 0 HA VAL A 40 7.947 -80.584 -6.874 1.00 72.44 H new ATOM 0 HB VAL A 40 10.053 -79.738 -7.931 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.899 -77.991 -9.672 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.284 -79.559 -10.245 1.00 32.30 H new ATOM 0 HG13 VAL A 40 8.145 -78.271 -9.786 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.750 -77.372 -7.290 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.987 -77.611 -7.270 1.00 22.25 H new ATOM 0 HG23 VAL A 40 9.016 -78.483 -6.110 1.00 22.25 H new ATOM 585 N THR A 41 5.952 -79.124 -7.392 1.00 2.24 N ATOM 586 CA THR A 41 4.690 -78.449 -7.643 1.00 62.42 C ATOM 587 C THR A 41 4.928 -76.942 -7.632 1.00 74.20 C ATOM 588 O THR A 41 5.790 -76.460 -6.892 1.00 2.33 O ATOM 589 CB THR A 41 3.639 -78.840 -6.579 1.00 55.34 C ATOM 590 OG1 THR A 41 4.177 -78.629 -5.265 1.00 61.12 O ATOM 591 CG2 THR A 41 3.231 -80.303 -6.727 1.00 64.10 C ATOM 0 H THR A 41 6.248 -79.100 -6.416 1.00 2.24 H new ATOM 0 HA THR A 41 4.304 -78.752 -8.616 1.00 62.42 H new ATOM 0 HB THR A 41 2.758 -78.215 -6.725 1.00 55.34 H new ATOM 0 HG1 THR A 41 5.012 -79.133 -5.169 1.00 61.12 H new ATOM 0 HG21 THR A 41 2.491 -80.553 -5.967 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.803 -80.463 -7.717 1.00 64.10 H new ATOM 0 HG23 THR A 41 4.107 -80.939 -6.603 1.00 64.10 H new ATOM 599 N GLY A 42 4.188 -76.198 -8.445 1.00 41.40 N ATOM 600 CA GLY A 42 4.449 -74.773 -8.575 1.00 24.42 C ATOM 601 C GLY A 42 3.190 -73.937 -8.639 1.00 40.24 C ATOM 602 O GLY A 42 2.097 -74.451 -8.890 1.00 32.35 O ATOM 0 H GLY A 42 3.418 -76.550 -9.013 1.00 41.40 H new ATOM 0 HA2 GLY A 42 5.053 -74.443 -7.730 1.00 24.42 H new ATOM 0 HA3 GLY A 42 5.038 -74.599 -9.475 1.00 24.42 H new ATOM 606 N LYS A 43 3.353 -72.643 -8.387 1.00 4.30 N ATOM 607 CA LYS A 43 2.269 -71.678 -8.491 1.00 54.14 C ATOM 608 C LYS A 43 1.860 -71.519 -9.953 1.00 34.03 C ATOM 609 O LYS A 43 2.703 -71.604 -10.849 1.00 15.12 O ATOM 610 CB LYS A 43 2.726 -70.321 -7.929 1.00 24.05 C ATOM 611 CG LYS A 43 1.630 -69.255 -7.874 1.00 42.10 C ATOM 612 CD LYS A 43 0.603 -69.538 -6.778 1.00 4.43 C ATOM 613 CE LYS A 43 1.235 -69.505 -5.388 1.00 3.20 C ATOM 614 NZ LYS A 43 0.226 -69.695 -4.312 1.00 10.25 N ATOM 0 H LYS A 43 4.244 -72.234 -8.104 1.00 4.30 H new ATOM 0 HA LYS A 43 1.414 -72.035 -7.916 1.00 54.14 H new ATOM 0 HB2 LYS A 43 3.119 -70.472 -6.924 1.00 24.05 H new ATOM 0 HB3 LYS A 43 3.548 -69.948 -8.540 1.00 24.05 H new ATOM 0 HG2 LYS A 43 2.083 -68.279 -7.701 1.00 42.10 H new ATOM 0 HG3 LYS A 43 1.125 -69.206 -8.839 1.00 42.10 H new ATOM 0 HD2 LYS A 43 -0.198 -68.801 -6.831 1.00 4.43 H new ATOM 0 HD3 LYS A 43 0.149 -70.514 -6.948 1.00 4.43 H new ATOM 0 HE2 LYS A 43 1.993 -70.285 -5.316 1.00 3.20 H new ATOM 0 HE3 LYS A 43 1.744 -68.552 -5.244 1.00 3.20 H new ATOM 0 HZ1 LYS A 43 0.697 -69.666 -3.385 1.00 10.25 H new ATOM 0 HZ2 LYS A 43 -0.484 -68.936 -4.364 1.00 10.25 H new ATOM 0 HZ3 LYS A 43 -0.242 -70.616 -4.434 1.00 10.25 H new ATOM 628 N VAL A 44 0.580 -71.264 -10.193 1.00 15.21 N ATOM 629 CA VAL A 44 0.094 -71.065 -11.551 1.00 11.51 C ATOM 630 C VAL A 44 0.379 -69.628 -11.989 1.00 43.13 C ATOM 631 O VAL A 44 -0.502 -68.765 -12.007 1.00 73.31 O ATOM 632 CB VAL A 44 -1.420 -71.395 -11.668 1.00 65.30 C ATOM 633 CG1 VAL A 44 -1.652 -72.899 -11.523 1.00 4.45 C ATOM 634 CG2 VAL A 44 -2.233 -70.627 -10.621 1.00 65.34 C ATOM 0 H VAL A 44 -0.136 -71.191 -9.470 1.00 15.21 H new ATOM 0 HA VAL A 44 0.621 -71.751 -12.214 1.00 11.51 H new ATOM 0 HB VAL A 44 -1.758 -71.082 -12.656 1.00 65.30 H new ATOM 0 HG11 VAL A 44 -2.718 -73.113 -11.607 1.00 4.45 H new ATOM 0 HG12 VAL A 44 -1.113 -73.428 -12.309 1.00 4.45 H new ATOM 0 HG13 VAL A 44 -1.292 -73.231 -10.549 1.00 4.45 H new ATOM 0 HG21 VAL A 44 -3.289 -70.877 -10.725 1.00 65.34 H new ATOM 0 HG22 VAL A 44 -1.892 -70.902 -9.623 1.00 65.34 H new ATOM 0 HG23 VAL A 44 -2.097 -69.556 -10.769 1.00 65.34 H new ATOM 644 N GLN A 45 1.639 -69.386 -12.332 1.00 50.12 N ATOM 645 CA GLN A 45 2.119 -68.048 -12.664 1.00 32.13 C ATOM 646 C GLN A 45 3.041 -68.104 -13.880 1.00 53.04 C ATOM 647 O GLN A 45 2.832 -67.393 -14.864 1.00 31.24 O ATOM 648 CB GLN A 45 2.859 -67.451 -11.455 1.00 23.21 C ATOM 649 CG GLN A 45 3.430 -66.056 -11.694 1.00 74.44 C ATOM 650 CD GLN A 45 4.204 -65.524 -10.498 1.00 75.11 C ATOM 651 OE1 GLN A 45 3.897 -65.842 -9.349 1.00 53.52 O ATOM 652 NE2 GLN A 45 5.216 -64.714 -10.761 1.00 75.34 N ATOM 0 H GLN A 45 2.356 -70.109 -12.388 1.00 50.12 H new ATOM 0 HA GLN A 45 1.268 -67.412 -12.908 1.00 32.13 H new ATOM 0 HB2 GLN A 45 2.174 -67.410 -10.608 1.00 23.21 H new ATOM 0 HB3 GLN A 45 3.672 -68.121 -11.175 1.00 23.21 H new ATOM 0 HG2 GLN A 45 4.086 -66.081 -12.564 1.00 74.44 H new ATOM 0 HG3 GLN A 45 2.616 -65.370 -11.929 1.00 74.44 H new ATOM 0 HE21 GLN A 45 5.439 -64.474 -11.727 1.00 75.34 H new ATOM 0 HE22 GLN A 45 5.773 -64.330 -9.998 1.00 75.34 H new ATOM 661 N GLY A 46 4.055 -68.961 -13.805 1.00 33.40 N ATOM 662 CA GLY A 46 5.001 -69.111 -14.895 1.00 5.31 C ATOM 663 C GLY A 46 5.665 -70.471 -14.878 1.00 42.35 C ATOM 664 O GLY A 46 5.768 -71.098 -13.822 1.00 52.52 O ATOM 0 H GLY A 46 4.239 -69.560 -13.000 1.00 33.40 H new ATOM 0 HA2 GLY A 46 4.486 -68.969 -15.845 1.00 5.31 H new ATOM 0 HA3 GLY A 46 5.762 -68.334 -14.826 1.00 5.31 H new ATOM 668 N VAL A 47 6.124 -70.927 -16.041 1.00 50.43 N ATOM 669 CA VAL A 47 6.728 -72.253 -16.162 1.00 62.01 C ATOM 670 C VAL A 47 8.176 -72.256 -15.667 1.00 63.33 C ATOM 671 O VAL A 47 8.752 -71.201 -15.382 1.00 24.14 O ATOM 672 CB VAL A 47 6.676 -72.784 -17.620 1.00 61.21 C ATOM 673 CG1 VAL A 47 5.231 -72.863 -18.111 1.00 73.20 C ATOM 674 CG2 VAL A 47 7.523 -71.921 -18.554 1.00 13.12 C ATOM 0 H VAL A 47 6.090 -70.399 -16.913 1.00 50.43 H new ATOM 0 HA VAL A 47 6.137 -72.918 -15.532 1.00 62.01 H new ATOM 0 HB VAL A 47 7.097 -73.790 -17.628 1.00 61.21 H new ATOM 0 HG11 VAL A 47 5.214 -73.237 -19.135 1.00 73.20 H new ATOM 0 HG12 VAL A 47 4.665 -73.538 -17.469 1.00 73.20 H new ATOM 0 HG13 VAL A 47 4.781 -71.870 -18.080 1.00 73.20 H new ATOM 0 HG21 VAL A 47 7.466 -72.318 -19.567 1.00 13.12 H new ATOM 0 HG22 VAL A 47 7.148 -70.898 -18.544 1.00 13.12 H new ATOM 0 HG23 VAL A 47 8.560 -71.931 -18.218 1.00 13.12 H new ATOM 684 N PHE A 48 8.745 -73.452 -15.582 1.00 44.21 N ATOM 685 CA PHE A 48 10.098 -73.662 -15.069 1.00 43.23 C ATOM 686 C PHE A 48 11.130 -73.277 -16.141 1.00 63.04 C ATOM 687 O PHE A 48 11.047 -73.739 -17.284 1.00 45.54 O ATOM 688 CB PHE A 48 10.236 -75.145 -14.669 1.00 61.12 C ATOM 689 CG PHE A 48 11.211 -75.435 -13.556 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.987 -74.953 -12.273 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.336 -76.213 -13.786 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.865 -75.240 -11.245 1.00 23.41 C ATOM 693 CE2 PHE A 48 13.215 -76.507 -12.762 1.00 23.53 C ATOM 694 CZ PHE A 48 12.982 -76.017 -11.491 1.00 52.33 C ATOM 0 H PHE A 48 8.278 -74.312 -15.869 1.00 44.21 H new ATOM 0 HA PHE A 48 10.280 -73.034 -14.197 1.00 43.23 H new ATOM 0 HB2 PHE A 48 9.254 -75.515 -14.373 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.538 -75.713 -15.549 1.00 61.12 H new ATOM 0 HD1 PHE A 48 10.116 -74.346 -12.076 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.527 -76.594 -14.778 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.679 -74.858 -10.252 1.00 23.41 H new ATOM 0 HE2 PHE A 48 14.084 -77.119 -12.954 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.672 -76.241 -10.691 1.00 52.33 H new ATOM 704 N PHE A 49 12.083 -72.416 -15.780 1.00 15.34 N ATOM 705 CA PHE A 49 13.095 -71.941 -16.728 1.00 4.40 C ATOM 706 C PHE A 49 14.081 -73.043 -17.118 1.00 62.32 C ATOM 707 O PHE A 49 15.068 -73.282 -16.413 1.00 1.00 O ATOM 708 CB PHE A 49 13.877 -70.737 -16.165 1.00 33.40 C ATOM 709 CG PHE A 49 13.435 -69.398 -16.706 1.00 61.25 C ATOM 710 CD1 PHE A 49 13.366 -69.178 -18.077 1.00 2.54 C ATOM 711 CD2 PHE A 49 13.110 -68.354 -15.851 1.00 61.52 C ATOM 712 CE1 PHE A 49 12.978 -67.951 -18.580 1.00 70.11 C ATOM 713 CE2 PHE A 49 12.720 -67.125 -16.350 1.00 52.45 C ATOM 714 CZ PHE A 49 12.654 -66.923 -17.715 1.00 63.23 C ATOM 0 H PHE A 49 12.176 -72.033 -14.839 1.00 15.34 H new ATOM 0 HA PHE A 49 12.551 -71.630 -17.620 1.00 4.40 H new ATOM 0 HB2 PHE A 49 13.775 -70.728 -15.080 1.00 33.40 H new ATOM 0 HB3 PHE A 49 14.936 -70.872 -16.385 1.00 33.40 H new ATOM 0 HD1 PHE A 49 13.619 -69.977 -18.758 1.00 2.54 H new ATOM 0 HD2 PHE A 49 13.162 -68.504 -14.783 1.00 61.52 H new ATOM 0 HE1 PHE A 49 12.928 -67.795 -19.648 1.00 70.11 H new ATOM 0 HE2 PHE A 49 12.467 -66.323 -15.673 1.00 52.45 H new ATOM 0 HZ PHE A 49 12.350 -65.963 -18.106 1.00 63.23 H new ATOM 724 N ARG A 50 13.818 -73.689 -18.255 1.00 20.24 N ATOM 725 CA ARG A 50 14.757 -74.648 -18.839 1.00 11.11 C ATOM 726 C ARG A 50 16.147 -74.024 -18.967 1.00 62.02 C ATOM 727 O ARG A 50 17.155 -74.724 -18.914 1.00 13.04 O ATOM 728 CB ARG A 50 14.249 -75.132 -20.210 1.00 4.24 C ATOM 729 CG ARG A 50 15.320 -75.781 -21.092 1.00 63.42 C ATOM 730 CD ARG A 50 14.724 -76.391 -22.358 1.00 31.41 C ATOM 731 NE ARG A 50 15.710 -76.506 -23.440 1.00 52.04 N ATOM 732 CZ ARG A 50 16.120 -77.657 -23.980 1.00 22.45 C ATOM 733 NH1 ARG A 50 15.808 -78.817 -23.423 1.00 12.14 N ATOM 734 NH2 ARG A 50 16.892 -77.641 -25.056 1.00 70.43 N ATOM 0 H ARG A 50 12.959 -73.565 -18.791 1.00 20.24 H new ATOM 0 HA ARG A 50 14.829 -75.511 -18.177 1.00 11.11 H new ATOM 0 HB2 ARG A 50 13.443 -75.849 -20.052 1.00 4.24 H new ATOM 0 HB3 ARG A 50 13.821 -74.284 -20.745 1.00 4.24 H new ATOM 0 HG2 ARG A 50 16.066 -75.035 -21.365 1.00 63.42 H new ATOM 0 HG3 ARG A 50 15.837 -76.555 -20.525 1.00 63.42 H new ATOM 0 HD2 ARG A 50 14.323 -77.378 -22.129 1.00 31.41 H new ATOM 0 HD3 ARG A 50 13.888 -75.778 -22.695 1.00 31.41 H new ATOM 0 HE ARG A 50 16.112 -75.643 -23.806 1.00 52.04 H new ATOM 0 HH11 ARG A 50 15.248 -78.839 -22.571 1.00 12.14 H new ATOM 0 HH12 ARG A 50 16.128 -79.688 -23.846 1.00 12.14 H new ATOM 0 HH21 ARG A 50 17.172 -76.752 -25.470 1.00 70.43 H new ATOM 0 HH22 ARG A 50 17.207 -78.518 -25.471 1.00 70.43 H new ATOM 748 N LYS A 51 16.182 -72.702 -19.132 1.00 31.42 N ATOM 749 CA LYS A 51 17.435 -71.952 -19.177 1.00 51.24 C ATOM 750 C LYS A 51 18.315 -72.300 -17.971 1.00 43.40 C ATOM 751 O LYS A 51 19.344 -72.968 -18.108 1.00 4.25 O ATOM 752 CB LYS A 51 17.143 -70.440 -19.201 1.00 42.54 C ATOM 753 CG LYS A 51 18.393 -69.558 -19.151 1.00 63.21 C ATOM 754 CD LYS A 51 18.050 -68.064 -19.156 1.00 2.41 C ATOM 755 CE LYS A 51 17.381 -67.630 -20.459 1.00 61.10 C ATOM 756 NZ LYS A 51 17.056 -66.176 -20.474 1.00 63.52 N ATOM 0 H LYS A 51 15.348 -72.125 -19.238 1.00 31.42 H new ATOM 0 HA LYS A 51 17.971 -72.226 -20.086 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.582 -70.204 -20.105 1.00 42.54 H new ATOM 0 HB3 LYS A 51 16.503 -70.192 -18.355 1.00 42.54 H new ATOM 0 HG2 LYS A 51 18.966 -69.794 -18.254 1.00 63.21 H new ATOM 0 HG3 LYS A 51 19.030 -69.785 -20.006 1.00 63.21 H new ATOM 0 HD2 LYS A 51 17.389 -67.842 -18.318 1.00 2.41 H new ATOM 0 HD3 LYS A 51 18.960 -67.483 -19.006 1.00 2.41 H new ATOM 0 HE2 LYS A 51 18.039 -67.861 -21.297 1.00 61.10 H new ATOM 0 HE3 LYS A 51 16.467 -68.205 -20.604 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 16.795 -65.889 -21.439 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 16.260 -65.992 -19.831 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 17.886 -65.632 -20.163 1.00 63.52 H new ATOM 770 N TYR A 52 17.877 -71.881 -16.787 1.00 33.33 N ATOM 771 CA TYR A 52 18.662 -72.054 -15.566 1.00 52.21 C ATOM 772 C TYR A 52 18.738 -73.524 -15.161 1.00 31.13 C ATOM 773 O TYR A 52 19.724 -73.958 -14.562 1.00 33.12 O ATOM 774 CB TYR A 52 18.069 -71.216 -14.428 1.00 51.11 C ATOM 775 CG TYR A 52 18.105 -69.719 -14.694 1.00 65.03 C ATOM 776 CD1 TYR A 52 19.316 -69.034 -14.747 1.00 73.20 C ATOM 777 CD2 TYR A 52 16.933 -68.994 -14.900 1.00 31.11 C ATOM 778 CE1 TYR A 52 19.358 -67.675 -14.994 1.00 34.30 C ATOM 779 CE2 TYR A 52 16.971 -67.634 -15.147 1.00 52.05 C ATOM 780 CZ TYR A 52 18.185 -66.980 -15.194 1.00 23.30 C ATOM 781 OH TYR A 52 18.228 -65.629 -15.441 1.00 53.21 O ATOM 0 H TYR A 52 16.979 -71.417 -16.646 1.00 33.33 H new ATOM 0 HA TYR A 52 19.676 -71.709 -15.766 1.00 52.21 H new ATOM 0 HB2 TYR A 52 17.036 -71.523 -14.262 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.616 -71.427 -13.509 1.00 51.11 H new ATOM 0 HD1 TYR A 52 20.238 -69.574 -14.592 1.00 73.20 H new ATOM 0 HD2 TYR A 52 15.981 -69.502 -14.866 1.00 31.11 H new ATOM 0 HE1 TYR A 52 20.306 -67.160 -15.030 1.00 34.30 H new ATOM 0 HE2 TYR A 52 16.054 -67.086 -15.303 1.00 52.05 H new ATOM 0 HH TYR A 52 17.317 -65.289 -15.561 1.00 53.21 H new ATOM 791 N THR A 53 17.693 -74.281 -15.484 1.00 44.10 N ATOM 792 CA THR A 53 17.653 -75.704 -15.173 1.00 3.41 C ATOM 793 C THR A 53 18.754 -76.452 -15.928 1.00 73.23 C ATOM 794 O THR A 53 19.548 -77.190 -15.329 1.00 72.33 O ATOM 795 CB THR A 53 16.273 -76.305 -15.520 1.00 45.12 C ATOM 796 OG1 THR A 53 15.246 -75.539 -14.876 1.00 53.20 O ATOM 797 CG2 THR A 53 16.171 -77.767 -15.087 1.00 71.23 C ATOM 0 H THR A 53 16.862 -73.931 -15.961 1.00 44.10 H new ATOM 0 HA THR A 53 17.821 -75.817 -14.102 1.00 3.41 H new ATOM 0 HB THR A 53 16.148 -76.267 -16.602 1.00 45.12 H new ATOM 0 HG1 THR A 53 14.665 -76.138 -14.362 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.187 -78.156 -15.347 1.00 71.23 H new ATOM 0 HG22 THR A 53 16.938 -78.351 -15.595 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.316 -77.838 -14.009 1.00 71.23 H new ATOM 805 N LYS A 54 18.825 -76.236 -17.242 1.00 52.34 N ATOM 806 CA LYS A 54 19.804 -76.932 -18.063 1.00 30.44 C ATOM 807 C LYS A 54 21.201 -76.402 -17.759 1.00 3.54 C ATOM 808 O LYS A 54 22.152 -77.168 -17.720 1.00 44.10 O ATOM 809 CB LYS A 54 19.482 -76.825 -19.568 1.00 40.44 C ATOM 810 CG LYS A 54 20.006 -75.566 -20.256 1.00 35.45 C ATOM 811 CD LYS A 54 19.701 -75.568 -21.757 1.00 30.33 C ATOM 812 CE LYS A 54 20.185 -76.848 -22.443 1.00 3.15 C ATOM 813 NZ LYS A 54 21.645 -77.072 -22.268 1.00 23.31 N ATOM 0 H LYS A 54 18.221 -75.591 -17.752 1.00 52.34 H new ATOM 0 HA LYS A 54 19.763 -77.992 -17.812 1.00 30.44 H new ATOM 0 HB2 LYS A 54 19.897 -77.696 -20.075 1.00 40.44 H new ATOM 0 HB3 LYS A 54 18.400 -76.866 -19.696 1.00 40.44 H new ATOM 0 HG2 LYS A 54 19.557 -74.686 -19.795 1.00 35.45 H new ATOM 0 HG3 LYS A 54 21.083 -75.490 -20.104 1.00 35.45 H new ATOM 0 HD2 LYS A 54 18.627 -75.461 -21.908 1.00 30.33 H new ATOM 0 HD3 LYS A 54 20.176 -74.705 -22.224 1.00 30.33 H new ATOM 0 HE2 LYS A 54 19.639 -77.701 -22.040 1.00 3.15 H new ATOM 0 HE3 LYS A 54 19.954 -76.796 -23.507 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 21.922 -77.951 -22.751 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 22.170 -76.272 -22.676 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 21.865 -77.150 -21.255 1.00 23.31 H new ATOM 827 N LYS A 55 21.317 -75.091 -17.515 1.00 61.15 N ATOM 828 CA LYS A 55 22.600 -74.508 -17.113 1.00 23.30 C ATOM 829 C LYS A 55 23.110 -75.188 -15.842 1.00 15.04 C ATOM 830 O LYS A 55 24.297 -75.496 -15.724 1.00 2.24 O ATOM 831 CB LYS A 55 22.477 -72.994 -16.878 1.00 11.43 C ATOM 832 CG LYS A 55 22.282 -72.170 -18.151 1.00 64.44 C ATOM 833 CD LYS A 55 22.135 -70.672 -17.856 1.00 65.33 C ATOM 834 CE LYS A 55 23.462 -70.002 -17.484 1.00 14.41 C ATOM 835 NZ LYS A 55 24.061 -70.551 -16.237 1.00 63.50 N ATOM 0 H LYS A 55 20.549 -74.423 -17.588 1.00 61.15 H new ATOM 0 HA LYS A 55 23.310 -74.671 -17.924 1.00 23.30 H new ATOM 0 HB2 LYS A 55 21.637 -72.810 -16.209 1.00 11.43 H new ATOM 0 HB3 LYS A 55 23.374 -72.644 -16.367 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.131 -72.326 -18.816 1.00 64.44 H new ATOM 0 HG3 LYS A 55 21.396 -72.523 -18.678 1.00 64.44 H new ATOM 0 HD2 LYS A 55 21.716 -70.175 -18.731 1.00 65.33 H new ATOM 0 HD3 LYS A 55 21.424 -70.536 -17.041 1.00 65.33 H new ATOM 0 HE2 LYS A 55 24.168 -70.126 -18.305 1.00 14.41 H new ATOM 0 HE3 LYS A 55 23.300 -68.931 -17.362 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 24.598 -69.804 -15.752 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.305 -70.897 -15.612 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.699 -71.337 -16.475 1.00 63.50 H new ATOM 849 N GLU A 56 22.197 -75.421 -14.900 1.00 61.35 N ATOM 850 CA GLU A 56 22.529 -76.087 -13.645 1.00 4.44 C ATOM 851 C GLU A 56 23.045 -77.496 -13.921 1.00 34.44 C ATOM 852 O GLU A 56 24.133 -77.874 -13.478 1.00 61.15 O ATOM 853 CB GLU A 56 21.291 -76.157 -12.735 1.00 12.34 C ATOM 854 CG GLU A 56 21.568 -76.744 -11.353 1.00 53.51 C ATOM 855 CD GLU A 56 22.472 -75.856 -10.504 1.00 25.14 C ATOM 856 OE1 GLU A 56 22.364 -74.613 -10.608 1.00 24.04 O ATOM 857 OE2 GLU A 56 23.279 -76.389 -9.714 1.00 63.10 O ATOM 0 H GLU A 56 21.216 -75.156 -14.985 1.00 61.35 H new ATOM 0 HA GLU A 56 23.307 -75.513 -13.142 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.883 -75.153 -12.617 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.525 -76.757 -13.226 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.623 -76.896 -10.832 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.031 -77.724 -11.466 1.00 53.51 H new ATOM 864 N ALA A 57 22.253 -78.262 -14.670 1.00 2.01 N ATOM 865 CA ALA A 57 22.600 -79.640 -15.003 1.00 74.43 C ATOM 866 C ALA A 57 23.915 -79.711 -15.776 1.00 71.13 C ATOM 867 O ALA A 57 24.759 -80.557 -15.500 1.00 12.10 O ATOM 868 CB ALA A 57 21.474 -80.288 -15.801 1.00 4.12 C ATOM 0 H ALA A 57 21.363 -77.949 -15.058 1.00 2.01 H new ATOM 0 HA ALA A 57 22.734 -80.190 -14.071 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.745 -81.316 -16.043 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.559 -80.284 -15.209 1.00 4.12 H new ATOM 0 HB3 ALA A 57 21.312 -79.728 -16.722 1.00 4.12 H new ATOM 874 N ASP A 58 24.091 -78.804 -16.726 1.00 44.45 N ATOM 875 CA ASP A 58 25.285 -78.789 -17.571 1.00 61.14 C ATOM 876 C ASP A 58 26.524 -78.438 -16.753 1.00 50.21 C ATOM 877 O ASP A 58 27.602 -78.991 -16.969 1.00 33.21 O ATOM 878 CB ASP A 58 25.130 -77.786 -18.728 1.00 0.41 C ATOM 879 CG ASP A 58 24.058 -78.178 -19.743 1.00 35.12 C ATOM 880 OD1 ASP A 58 23.876 -79.389 -20.001 1.00 22.10 O ATOM 881 OD2 ASP A 58 23.403 -77.272 -20.304 1.00 32.14 O ATOM 0 H ASP A 58 23.421 -78.064 -16.935 1.00 44.45 H new ATOM 0 HA ASP A 58 25.405 -79.789 -17.987 1.00 61.14 H new ATOM 0 HB2 ASP A 58 24.887 -76.806 -18.317 1.00 0.41 H new ATOM 0 HB3 ASP A 58 26.086 -77.688 -19.242 1.00 0.41 H new ATOM 886 N ALA A 59 26.357 -77.513 -15.813 1.00 41.11 N ATOM 887 CA ALA A 59 27.457 -77.054 -14.970 1.00 31.13 C ATOM 888 C ALA A 59 27.895 -78.146 -13.995 1.00 41.12 C ATOM 889 O ALA A 59 29.086 -78.426 -13.856 1.00 73.43 O ATOM 890 CB ALA A 59 27.046 -75.800 -14.206 1.00 33.22 C ATOM 0 H ALA A 59 25.463 -77.063 -15.615 1.00 41.11 H new ATOM 0 HA ALA A 59 28.303 -76.817 -15.615 1.00 31.13 H new ATOM 0 HB1 ALA A 59 27.874 -75.467 -13.581 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.785 -75.012 -14.913 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.184 -76.023 -13.577 1.00 33.22 H new ATOM 896 N LEU A 60 26.920 -78.760 -13.326 1.00 54.24 N ATOM 897 CA LEU A 60 27.194 -79.780 -12.309 1.00 74.52 C ATOM 898 C LEU A 60 27.258 -81.184 -12.925 1.00 2.20 C ATOM 899 O LEU A 60 27.533 -82.158 -12.227 1.00 5.04 O ATOM 900 CB LEU A 60 26.128 -79.726 -11.196 1.00 10.34 C ATOM 901 CG LEU A 60 26.322 -78.651 -10.106 1.00 60.33 C ATOM 902 CD1 LEU A 60 27.505 -78.998 -9.206 1.00 41.11 C ATOM 903 CD2 LEU A 60 26.504 -77.266 -10.723 1.00 51.52 C ATOM 0 H LEU A 60 25.928 -78.569 -13.469 1.00 54.24 H new ATOM 0 HA LEU A 60 28.170 -79.565 -11.873 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.156 -79.567 -11.663 1.00 10.34 H new ATOM 0 HB3 LEU A 60 26.093 -80.701 -10.710 1.00 10.34 H new ATOM 0 HG LEU A 60 25.420 -78.631 -9.495 1.00 60.33 H new ATOM 0 HD11 LEU A 60 27.622 -78.226 -8.445 1.00 41.11 H new ATOM 0 HD12 LEU A 60 27.325 -79.959 -8.723 1.00 41.11 H new ATOM 0 HD13 LEU A 60 28.413 -79.057 -9.806 1.00 41.11 H new ATOM 0 HD21 LEU A 60 26.638 -76.530 -9.931 1.00 51.52 H new ATOM 0 HD22 LEU A 60 27.382 -77.268 -11.369 1.00 51.52 H new ATOM 0 HD23 LEU A 60 25.622 -77.010 -11.310 1.00 51.52 H new ATOM 915 N SER A 61 26.991 -81.277 -14.227 1.00 74.52 N ATOM 916 CA SER A 61 27.154 -82.523 -14.980 1.00 3.53 C ATOM 917 C SER A 61 26.123 -83.581 -14.550 1.00 64.03 C ATOM 918 O SER A 61 26.446 -84.766 -14.421 1.00 34.12 O ATOM 919 CB SER A 61 28.595 -83.053 -14.818 1.00 74.53 C ATOM 920 OG SER A 61 28.841 -84.177 -15.651 1.00 63.03 O ATOM 0 H SER A 61 26.657 -80.494 -14.789 1.00 74.52 H new ATOM 0 HA SER A 61 26.976 -82.311 -16.034 1.00 3.53 H new ATOM 0 HB2 SER A 61 29.303 -82.260 -15.059 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.766 -83.328 -13.777 1.00 74.53 H new ATOM 0 HG SER A 61 28.119 -84.830 -15.540 1.00 63.03 H new ATOM 926 N LEU A 62 24.872 -83.152 -14.359 1.00 73.12 N ATOM 927 CA LEU A 62 23.772 -84.083 -14.097 1.00 32.44 C ATOM 928 C LEU A 62 23.177 -84.580 -15.407 1.00 13.42 C ATOM 929 O LEU A 62 23.091 -83.836 -16.386 1.00 54.02 O ATOM 930 CB LEU A 62 22.648 -83.443 -13.255 1.00 62.02 C ATOM 931 CG LEU A 62 22.978 -83.170 -11.777 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.674 -84.370 -11.140 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.809 -81.905 -11.631 1.00 20.31 C ATOM 0 H LEU A 62 24.597 -82.170 -14.381 1.00 73.12 H new ATOM 0 HA LEU A 62 24.194 -84.913 -13.531 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.364 -82.500 -13.723 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.775 -84.095 -13.297 1.00 62.02 H new ATOM 0 HG LEU A 62 22.040 -83.013 -11.245 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.896 -84.150 -10.096 1.00 22.14 H new ATOM 0 HD12 LEU A 62 23.022 -85.241 -11.197 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.602 -84.577 -11.672 1.00 22.14 H new ATOM 0 HD21 LEU A 62 24.029 -81.734 -10.577 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.742 -82.017 -12.183 1.00 20.31 H new ATOM 0 HD23 LEU A 62 23.252 -81.056 -12.028 1.00 20.31 H new ATOM 945 N VAL A 63 22.768 -85.839 -15.411 1.00 63.31 N ATOM 946 CA VAL A 63 22.071 -86.425 -16.545 1.00 53.30 C ATOM 947 C VAL A 63 20.702 -86.918 -16.094 1.00 24.01 C ATOM 948 O VAL A 63 20.460 -87.072 -14.901 1.00 52.40 O ATOM 949 CB VAL A 63 22.877 -87.590 -17.180 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.218 -87.090 -17.711 1.00 23.31 C ATOM 951 CG2 VAL A 63 23.082 -88.725 -16.181 1.00 10.23 C ATOM 0 H VAL A 63 22.909 -86.481 -14.631 1.00 63.31 H new ATOM 0 HA VAL A 63 21.957 -85.656 -17.309 1.00 53.30 H new ATOM 0 HB VAL A 63 22.299 -87.981 -18.018 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.768 -87.922 -18.152 1.00 23.31 H new ATOM 0 HG12 VAL A 63 24.047 -86.325 -18.469 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.798 -86.665 -16.892 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.649 -89.527 -16.653 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.630 -88.353 -15.315 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.113 -89.107 -15.860 1.00 10.23 H new ATOM 961 N GLY A 64 19.806 -87.136 -17.042 1.00 15.23 N ATOM 962 CA GLY A 64 18.462 -87.575 -16.716 1.00 55.25 C ATOM 963 C GLY A 64 17.445 -86.993 -17.671 1.00 30.41 C ATOM 964 O GLY A 64 17.675 -86.980 -18.885 1.00 63.55 O ATOM 0 H GLY A 64 19.985 -87.016 -18.039 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.415 -88.663 -16.751 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.218 -87.278 -15.696 1.00 55.25 H new ATOM 968 N TYR A 65 16.330 -86.499 -17.141 1.00 73.32 N ATOM 969 CA TYR A 65 15.281 -85.921 -17.985 1.00 13.32 C ATOM 970 C TYR A 65 14.265 -85.145 -17.153 1.00 31.43 C ATOM 971 O TYR A 65 14.006 -85.494 -16.007 1.00 30.44 O ATOM 972 CB TYR A 65 14.610 -87.029 -18.835 1.00 12.34 C ATOM 973 CG TYR A 65 13.092 -87.127 -18.736 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.261 -86.393 -19.587 1.00 43.24 C ATOM 975 CD2 TYR A 65 12.493 -87.975 -17.809 1.00 2.54 C ATOM 976 CE1 TYR A 65 10.883 -86.500 -19.506 1.00 74.34 C ATOM 977 CE2 TYR A 65 11.120 -88.092 -17.728 1.00 14.21 C ATOM 978 CZ TYR A 65 10.318 -87.354 -18.579 1.00 4.14 C ATOM 979 OH TYR A 65 8.948 -87.480 -18.509 1.00 22.34 O ATOM 0 H TYR A 65 16.127 -86.485 -16.141 1.00 73.32 H new ATOM 0 HA TYR A 65 15.738 -85.205 -18.668 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.875 -86.867 -19.880 1.00 12.34 H new ATOM 0 HB3 TYR A 65 15.035 -87.989 -18.543 1.00 12.34 H new ATOM 0 HD1 TYR A 65 12.701 -85.732 -20.319 1.00 43.24 H new ATOM 0 HD2 TYR A 65 13.114 -88.552 -17.140 1.00 2.54 H new ATOM 0 HE1 TYR A 65 10.254 -85.919 -20.164 1.00 74.34 H new ATOM 0 HE2 TYR A 65 10.674 -88.757 -17.003 1.00 14.21 H new ATOM 0 HH TYR A 65 8.714 -88.121 -17.805 1.00 22.34 H new ATOM 989 N VAL A 66 13.711 -84.079 -17.733 1.00 23.54 N ATOM 990 CA VAL A 66 12.716 -83.242 -17.042 1.00 72.34 C ATOM 991 C VAL A 66 11.590 -82.848 -17.995 1.00 10.41 C ATOM 992 O VAL A 66 11.830 -82.646 -19.183 1.00 63.31 O ATOM 993 CB VAL A 66 13.360 -81.959 -16.432 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.295 -80.963 -15.968 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.281 -82.316 -15.264 1.00 12.42 C ATOM 0 H VAL A 66 13.932 -83.771 -18.680 1.00 23.54 H new ATOM 0 HA VAL A 66 12.308 -83.837 -16.225 1.00 72.34 H new ATOM 0 HB VAL A 66 13.950 -81.488 -17.218 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.780 -80.081 -15.549 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.678 -80.669 -16.817 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.668 -81.429 -15.208 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.719 -81.406 -14.854 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.706 -82.823 -14.489 1.00 12.42 H new ATOM 0 HG23 VAL A 66 15.075 -82.974 -15.615 1.00 12.42 H new ATOM 1005 N THR A 67 10.370 -82.753 -17.459 1.00 33.35 N ATOM 1006 CA THR A 67 9.203 -82.312 -18.215 1.00 62.00 C ATOM 1007 C THR A 67 8.132 -81.762 -17.271 1.00 43.22 C ATOM 1008 O THR A 67 8.162 -82.019 -16.067 1.00 43.20 O ATOM 1009 CB THR A 67 8.586 -83.458 -19.049 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.474 -82.963 -19.803 1.00 12.03 O ATOM 1011 CG2 THR A 67 8.114 -84.601 -18.162 1.00 52.41 C ATOM 0 H THR A 67 10.167 -82.981 -16.486 1.00 33.35 H new ATOM 0 HA THR A 67 9.544 -81.531 -18.895 1.00 62.00 H new ATOM 0 HB THR A 67 9.359 -83.836 -19.719 1.00 20.20 H new ATOM 0 HG1 THR A 67 6.990 -83.715 -20.204 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.686 -85.389 -18.781 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.959 -84.999 -17.601 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.358 -84.234 -17.467 1.00 52.41 H new ATOM 1019 N ASN A 68 7.195 -80.996 -17.821 1.00 24.14 N ATOM 1020 CA ASN A 68 6.045 -80.516 -17.059 1.00 73.40 C ATOM 1021 C ASN A 68 4.881 -81.476 -17.276 1.00 73.12 C ATOM 1022 O ASN A 68 4.832 -82.174 -18.291 1.00 10.52 O ATOM 1023 CB ASN A 68 5.661 -79.090 -17.492 1.00 71.15 C ATOM 1024 CG ASN A 68 4.544 -78.473 -16.655 1.00 11.14 C ATOM 1025 OD1 ASN A 68 3.741 -77.686 -17.157 1.00 14.14 O ATOM 1026 ND2 ASN A 68 4.501 -78.792 -15.367 1.00 71.23 N ATOM 0 H ASN A 68 7.209 -80.693 -18.795 1.00 24.14 H new ATOM 0 HA ASN A 68 6.298 -80.480 -15.999 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.543 -78.452 -17.432 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.352 -79.108 -18.537 1.00 71.15 H new ATOM 0 HD21 ASN A 68 3.788 -78.382 -14.763 1.00 71.23 H new ATOM 0 HD22 ASN A 68 5.181 -79.447 -14.981 1.00 71.23 H new ATOM 1033 N ASN A 69 3.963 -81.534 -16.322 1.00 74.00 N ATOM 1034 CA ASN A 69 2.834 -82.458 -16.398 1.00 52.24 C ATOM 1035 C ASN A 69 1.515 -81.701 -16.432 1.00 5.25 C ATOM 1036 O ASN A 69 1.441 -80.547 -16.005 1.00 52.52 O ATOM 1037 CB ASN A 69 2.851 -83.431 -15.207 1.00 72.13 C ATOM 1038 CG ASN A 69 4.033 -84.389 -15.234 1.00 72.22 C ATOM 1039 OD1 ASN A 69 4.535 -84.803 -14.189 1.00 2.34 O ATOM 1040 ND2 ASN A 69 4.480 -84.758 -16.426 1.00 31.15 N ATOM 0 H ASN A 69 3.975 -80.952 -15.484 1.00 74.00 H new ATOM 0 HA ASN A 69 2.930 -83.029 -17.321 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.876 -82.859 -14.279 1.00 72.13 H new ATOM 0 HB3 ASN A 69 1.925 -84.006 -15.202 1.00 72.13 H new ATOM 0 HD21 ASN A 69 5.265 -85.406 -16.498 1.00 31.15 H new ATOM 0 HD22 ASN A 69 4.039 -84.394 -17.271 1.00 31.15 H new ATOM 1047 N GLU A 70 0.475 -82.366 -16.931 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.872 -81.802 -16.970 1.00 54.22 C ATOM 1049 C GLU A 70 -1.378 -81.575 -15.545 1.00 23.41 C ATOM 1050 O GLU A 70 -2.272 -80.759 -15.305 1.00 22.31 O ATOM 1051 CB GLU A 70 -1.818 -82.743 -17.733 1.00 35.24 C ATOM 1052 CG GLU A 70 -3.230 -82.198 -17.916 1.00 73.50 C ATOM 1053 CD GLU A 70 -4.141 -83.180 -18.628 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.780 -84.010 -17.946 1.00 32.11 O ATOM 1055 OE2 GLU A 70 -4.222 -83.136 -19.873 1.00 22.30 O ATOM 0 H GLU A 70 0.542 -83.307 -17.318 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.845 -80.845 -17.491 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -1.391 -82.951 -18.714 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -1.874 -83.693 -17.201 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -3.652 -81.956 -16.941 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -3.187 -81.269 -18.484 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.782 -82.301 -14.601 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.070 -82.129 -13.176 1.00 52.32 C ATOM 1064 C ASP A 71 -0.627 -80.743 -12.712 1.00 60.33 C ATOM 1065 O ASP A 71 -1.097 -80.233 -11.696 1.00 61.33 O ATOM 1066 CB ASP A 71 -0.344 -83.214 -12.364 1.00 72.43 C ATOM 1067 CG ASP A 71 -0.523 -83.062 -10.857 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -1.519 -83.592 -10.312 1.00 44.11 O ATOM 1069 OD2 ASP A 71 0.331 -82.422 -10.212 1.00 23.34 O ATOM 0 H ASP A 71 -0.089 -83.022 -14.800 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.144 -82.223 -13.018 1.00 52.32 H new ATOM 0 HB2 ASP A 71 -0.712 -84.194 -12.669 1.00 72.43 H new ATOM 0 HB3 ASP A 71 0.719 -83.185 -12.601 1.00 72.43 H new ATOM 1074 N GLY A 72 0.260 -80.134 -13.492 1.00 2.22 N ATOM 1075 CA GLY A 72 0.794 -78.826 -13.162 1.00 24.21 C ATOM 1076 C GLY A 72 2.231 -78.918 -12.700 1.00 64.40 C ATOM 1077 O GLY A 72 3.051 -78.045 -12.998 1.00 24.14 O ATOM 0 H GLY A 72 0.623 -80.530 -14.359 1.00 2.22 H new ATOM 0 HA2 GLY A 72 0.731 -78.175 -14.034 1.00 24.21 H new ATOM 0 HA3 GLY A 72 0.187 -78.370 -12.380 1.00 24.21 H new ATOM 1081 N SER A 73 2.536 -80.001 -11.998 1.00 74.30 N ATOM 1082 CA SER A 73 3.862 -80.225 -11.444 1.00 53.52 C ATOM 1083 C SER A 73 4.894 -80.501 -12.539 1.00 5.24 C ATOM 1084 O SER A 73 4.560 -80.989 -13.623 1.00 20.32 O ATOM 1085 CB SER A 73 3.805 -81.391 -10.449 1.00 23.04 C ATOM 1086 OG SER A 73 3.114 -82.504 -10.999 1.00 33.31 O ATOM 0 H SER A 73 1.871 -80.748 -11.797 1.00 74.30 H new ATOM 0 HA SER A 73 4.178 -79.319 -10.928 1.00 53.52 H new ATOM 0 HB2 SER A 73 4.817 -81.688 -10.175 1.00 23.04 H new ATOM 0 HB3 SER A 73 3.309 -81.068 -9.534 1.00 23.04 H new ATOM 0 HG SER A 73 2.169 -82.463 -10.741 1.00 33.31 H new ATOM 1092 N VAL A 74 6.146 -80.158 -12.255 1.00 2.14 N ATOM 1093 CA VAL A 74 7.266 -80.455 -13.143 1.00 23.14 C ATOM 1094 C VAL A 74 8.031 -81.657 -12.597 1.00 45.15 C ATOM 1095 O VAL A 74 8.540 -81.614 -11.478 1.00 50.12 O ATOM 1096 CB VAL A 74 8.225 -79.240 -13.276 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.354 -79.538 -14.264 1.00 25.24 C ATOM 1098 CG2 VAL A 74 7.451 -77.987 -13.688 1.00 44.21 C ATOM 0 H VAL A 74 6.414 -79.666 -11.403 1.00 2.14 H new ATOM 0 HA VAL A 74 6.870 -80.678 -14.134 1.00 23.14 H new ATOM 0 HB VAL A 74 8.677 -79.055 -12.302 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.011 -78.671 -14.338 1.00 25.24 H new ATOM 0 HG12 VAL A 74 9.926 -80.398 -13.915 1.00 25.24 H new ATOM 0 HG13 VAL A 74 8.931 -79.758 -15.244 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.139 -77.147 -13.776 1.00 44.21 H new ATOM 0 HG22 VAL A 74 6.964 -78.159 -14.648 1.00 44.21 H new ATOM 0 HG23 VAL A 74 6.697 -77.761 -12.934 1.00 44.21 H new ATOM 1108 N SER A 75 8.097 -82.728 -13.375 1.00 24.41 N ATOM 1109 CA SER A 75 8.699 -83.974 -12.916 1.00 33.53 C ATOM 1110 C SER A 75 9.870 -84.378 -13.815 1.00 25.55 C ATOM 1111 O SER A 75 10.110 -83.763 -14.854 1.00 44.43 O ATOM 1112 CB SER A 75 7.634 -85.080 -12.872 1.00 45.42 C ATOM 1113 OG SER A 75 8.155 -86.284 -12.332 1.00 50.11 O ATOM 0 H SER A 75 7.740 -82.760 -14.330 1.00 24.41 H new ATOM 0 HA SER A 75 9.092 -83.825 -11.910 1.00 33.53 H new ATOM 0 HB2 SER A 75 6.787 -84.747 -12.271 1.00 45.42 H new ATOM 0 HB3 SER A 75 7.258 -85.264 -13.878 1.00 45.42 H new ATOM 0 HG SER A 75 8.796 -86.073 -11.621 1.00 50.11 H new ATOM 1119 N GLY A 76 10.595 -85.411 -13.400 1.00 32.44 N ATOM 1120 CA GLY A 76 11.745 -85.881 -14.144 1.00 51.54 C ATOM 1121 C GLY A 76 12.625 -86.782 -13.301 1.00 43.42 C ATOM 1122 O GLY A 76 12.189 -87.273 -12.259 1.00 53.55 O ATOM 0 H GLY A 76 10.401 -85.937 -12.548 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.410 -86.423 -15.029 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.326 -85.028 -14.494 1.00 51.54 H new ATOM 1126 N VAL A 77 13.854 -87.015 -13.750 1.00 42.05 N ATOM 1127 CA VAL A 77 14.814 -87.836 -13.020 1.00 43.44 C ATOM 1128 C VAL A 77 16.214 -87.221 -13.120 1.00 74.14 C ATOM 1129 O VAL A 77 16.620 -86.767 -14.199 1.00 42.33 O ATOM 1130 CB VAL A 77 14.868 -89.293 -13.559 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.787 -90.151 -12.692 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.470 -89.914 -13.650 1.00 44.22 C ATOM 0 H VAL A 77 14.212 -86.641 -14.629 1.00 42.05 H new ATOM 0 HA VAL A 77 14.484 -87.866 -11.982 1.00 43.44 H new ATOM 0 HB VAL A 77 15.276 -89.258 -14.569 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.813 -91.168 -13.084 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.793 -89.732 -12.703 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.412 -90.166 -11.669 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.548 -90.932 -14.031 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.014 -89.931 -12.660 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.852 -89.321 -14.324 1.00 44.22 H new ATOM 1142 N VAL A 78 16.931 -87.197 -11.991 1.00 11.12 N ATOM 1143 CA VAL A 78 18.318 -86.729 -11.939 1.00 13.11 C ATOM 1144 C VAL A 78 19.255 -87.893 -11.634 1.00 3.40 C ATOM 1145 O VAL A 78 18.969 -88.723 -10.762 1.00 63.53 O ATOM 1146 CB VAL A 78 18.529 -85.637 -10.857 1.00 55.53 C ATOM 1147 CG1 VAL A 78 20.012 -85.297 -10.694 1.00 52.34 C ATOM 1148 CG2 VAL A 78 17.733 -84.379 -11.177 1.00 23.42 C ATOM 0 H VAL A 78 16.565 -87.502 -11.089 1.00 11.12 H new ATOM 0 HA VAL A 78 18.541 -86.299 -12.916 1.00 13.11 H new ATOM 0 HB VAL A 78 18.163 -86.043 -9.914 1.00 55.53 H new ATOM 0 HG11 VAL A 78 20.127 -84.529 -9.929 1.00 52.34 H new ATOM 0 HG12 VAL A 78 20.560 -86.191 -10.396 1.00 52.34 H new ATOM 0 HG13 VAL A 78 20.407 -84.928 -11.641 1.00 52.34 H new ATOM 0 HG21 VAL A 78 17.903 -83.634 -10.400 1.00 23.42 H new ATOM 0 HG22 VAL A 78 18.054 -83.980 -12.139 1.00 23.42 H new ATOM 0 HG23 VAL A 78 16.671 -84.622 -11.221 1.00 23.42 H new ATOM 1158 N GLN A 79 20.370 -87.939 -12.353 1.00 61.04 N ATOM 1159 CA GLN A 79 21.388 -88.964 -12.167 1.00 72.34 C ATOM 1160 C GLN A 79 22.771 -88.312 -12.173 1.00 51.25 C ATOM 1161 O GLN A 79 22.979 -87.295 -12.839 1.00 1.41 O ATOM 1162 CB GLN A 79 21.324 -90.010 -13.290 1.00 75.34 C ATOM 1163 CG GLN A 79 19.935 -90.231 -13.872 1.00 65.40 C ATOM 1164 CD GLN A 79 19.947 -91.205 -15.031 1.00 13.34 C ATOM 1165 OE1 GLN A 79 19.178 -91.070 -15.979 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.803 -92.213 -14.948 1.00 41.24 N ATOM 0 H GLN A 79 20.594 -87.264 -13.084 1.00 61.04 H new ATOM 0 HA GLN A 79 21.207 -89.460 -11.214 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.995 -89.704 -14.092 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.698 -90.959 -12.906 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.272 -90.606 -13.092 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.527 -89.277 -14.206 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.425 -92.289 -14.143 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.840 -92.913 -15.689 1.00 41.24 H new ATOM 1175 N GLY A 80 23.703 -88.894 -11.430 1.00 73.20 N ATOM 1176 CA GLY A 80 25.066 -88.389 -11.394 1.00 70.11 C ATOM 1177 C GLY A 80 25.696 -88.624 -10.041 1.00 45.11 C ATOM 1178 O GLY A 80 25.121 -89.344 -9.222 1.00 30.00 O ATOM 0 H GLY A 80 23.539 -89.714 -10.846 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.660 -88.880 -12.165 1.00 70.11 H new ATOM 0 HA3 GLY A 80 25.068 -87.323 -11.620 1.00 70.11 H new ATOM 1182 N PRO A 81 26.884 -88.052 -9.768 1.00 21.24 N ATOM 1183 CA PRO A 81 27.507 -88.152 -8.449 1.00 24.25 C ATOM 1184 C PRO A 81 26.561 -87.680 -7.353 1.00 43.11 C ATOM 1185 O PRO A 81 25.821 -86.706 -7.537 1.00 61.12 O ATOM 1186 CB PRO A 81 28.733 -87.231 -8.524 1.00 14.12 C ATOM 1187 CG PRO A 81 28.572 -86.451 -9.795 1.00 1.43 C ATOM 1188 CD PRO A 81 27.712 -87.285 -10.710 1.00 73.32 C ATOM 0 HA PRO A 81 27.769 -89.182 -8.206 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.779 -86.568 -7.660 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.657 -87.808 -8.532 1.00 14.12 H new ATOM 0 HG2 PRO A 81 28.106 -85.485 -9.600 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.541 -86.251 -10.251 1.00 1.43 H new ATOM 0 HD2 PRO A 81 27.105 -86.666 -11.371 1.00 73.32 H new ATOM 0 HD3 PRO A 81 28.311 -87.937 -11.346 1.00 73.32 H new ATOM 1196 N LYS A 82 26.614 -88.366 -6.220 1.00 34.24 N ATOM 1197 CA LYS A 82 25.743 -88.092 -5.084 1.00 65.22 C ATOM 1198 C LYS A 82 25.628 -86.587 -4.826 1.00 10.03 C ATOM 1199 O LYS A 82 24.526 -86.037 -4.747 1.00 13.55 O ATOM 1200 CB LYS A 82 26.301 -88.824 -3.845 1.00 54.13 C ATOM 1201 CG LYS A 82 25.393 -88.817 -2.612 1.00 14.43 C ATOM 1202 CD LYS A 82 25.405 -87.480 -1.870 1.00 71.14 C ATOM 1203 CE LYS A 82 24.592 -87.551 -0.584 1.00 51.01 C ATOM 1204 NZ LYS A 82 25.183 -88.507 0.391 1.00 4.33 N ATOM 0 H LYS A 82 27.267 -89.134 -6.061 1.00 34.24 H new ATOM 0 HA LYS A 82 24.739 -88.456 -5.302 1.00 65.22 H new ATOM 0 HB2 LYS A 82 26.506 -89.859 -4.118 1.00 54.13 H new ATOM 0 HB3 LYS A 82 27.255 -88.370 -3.575 1.00 54.13 H new ATOM 0 HG2 LYS A 82 24.372 -89.048 -2.918 1.00 14.43 H new ATOM 0 HG3 LYS A 82 25.708 -89.607 -1.931 1.00 14.43 H new ATOM 0 HD2 LYS A 82 26.433 -87.200 -1.638 1.00 71.14 H new ATOM 0 HD3 LYS A 82 25.001 -86.700 -2.515 1.00 71.14 H new ATOM 0 HE2 LYS A 82 24.537 -86.560 -0.134 1.00 51.01 H new ATOM 0 HE3 LYS A 82 23.571 -87.853 -0.816 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 24.779 -88.336 1.334 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 24.970 -89.481 0.095 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 26.214 -88.373 0.427 1.00 4.33 H new ATOM 1218 N GLU A 83 26.773 -85.925 -4.716 1.00 45.34 N ATOM 1219 CA GLU A 83 26.811 -84.526 -4.292 1.00 53.14 C ATOM 1220 C GLU A 83 26.256 -83.583 -5.364 1.00 41.52 C ATOM 1221 O GLU A 83 25.703 -82.530 -5.046 1.00 1.31 O ATOM 1222 CB GLU A 83 28.220 -84.121 -3.860 1.00 53.44 C ATOM 1223 CG GLU A 83 29.302 -84.503 -4.850 1.00 34.25 C ATOM 1224 CD GLU A 83 30.634 -83.862 -4.512 1.00 42.22 C ATOM 1225 OE1 GLU A 83 30.891 -82.734 -4.984 1.00 53.32 O ATOM 1226 OE2 GLU A 83 31.409 -84.467 -3.745 1.00 25.22 O ATOM 0 H GLU A 83 27.688 -86.331 -4.914 1.00 45.34 H new ATOM 0 HA GLU A 83 26.157 -84.433 -3.425 1.00 53.14 H new ATOM 0 HB2 GLU A 83 28.246 -83.042 -3.707 1.00 53.44 H new ATOM 0 HB3 GLU A 83 28.441 -84.584 -2.899 1.00 53.44 H new ATOM 0 HG2 GLU A 83 29.415 -85.587 -4.863 1.00 34.25 H new ATOM 0 HG3 GLU A 83 28.999 -84.202 -5.853 1.00 34.25 H new ATOM 1233 N GLN A 84 26.429 -83.940 -6.633 1.00 71.32 N ATOM 1234 CA GLN A 84 25.901 -83.125 -7.728 1.00 73.41 C ATOM 1235 C GLN A 84 24.380 -83.265 -7.810 1.00 4.41 C ATOM 1236 O GLN A 84 23.670 -82.290 -8.061 1.00 35.12 O ATOM 1237 CB GLN A 84 26.565 -83.497 -9.062 1.00 70.43 C ATOM 1238 CG GLN A 84 27.936 -82.853 -9.282 1.00 43.51 C ATOM 1239 CD GLN A 84 28.915 -83.091 -8.144 1.00 53.33 C ATOM 1240 OE1 GLN A 84 29.633 -84.088 -8.126 1.00 64.14 O ATOM 1241 NE2 GLN A 84 28.962 -82.172 -7.193 1.00 5.13 N ATOM 0 H GLN A 84 26.926 -84.780 -6.930 1.00 71.32 H new ATOM 0 HA GLN A 84 26.137 -82.081 -7.524 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.673 -84.581 -9.111 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.904 -83.205 -9.878 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.365 -83.241 -10.206 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.805 -81.779 -9.418 1.00 43.51 H new ATOM 0 HE21 GLN A 84 28.351 -81.357 -7.241 1.00 5.13 H new ATOM 0 HE22 GLN A 84 29.610 -82.279 -6.412 1.00 5.13 H new ATOM 1250 N VAL A 85 23.882 -84.481 -7.586 1.00 33.13 N ATOM 1251 CA VAL A 85 22.441 -84.702 -7.449 1.00 22.34 C ATOM 1252 C VAL A 85 21.918 -83.835 -6.304 1.00 73.43 C ATOM 1253 O VAL A 85 20.863 -83.208 -6.410 1.00 53.31 O ATOM 1254 CB VAL A 85 22.114 -86.193 -7.169 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.610 -86.404 -6.994 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.663 -87.082 -8.285 1.00 25.24 C ATOM 0 H VAL A 85 24.450 -85.323 -7.496 1.00 33.13 H new ATOM 0 HA VAL A 85 21.957 -84.430 -8.387 1.00 22.34 H new ATOM 0 HB VAL A 85 22.600 -86.476 -6.235 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.411 -87.458 -6.799 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.254 -85.806 -6.155 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.092 -86.099 -7.903 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.424 -88.124 -8.071 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.212 -86.794 -9.235 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.745 -86.963 -8.346 1.00 25.24 H new ATOM 1266 N ASP A 86 22.696 -83.790 -5.219 1.00 15.30 N ATOM 1267 CA ASP A 86 22.420 -82.900 -4.093 1.00 63.23 C ATOM 1268 C ASP A 86 22.374 -81.449 -4.567 1.00 64.31 C ATOM 1269 O ASP A 86 21.459 -80.705 -4.225 1.00 72.04 O ATOM 1270 CB ASP A 86 23.487 -83.065 -2.998 1.00 35.40 C ATOM 1271 CG ASP A 86 23.349 -82.052 -1.863 1.00 14.31 C ATOM 1272 OD1 ASP A 86 23.914 -80.939 -1.969 1.00 61.35 O ATOM 1273 OD2 ASP A 86 22.689 -82.368 -0.852 1.00 32.10 O ATOM 0 H ASP A 86 23.529 -84.366 -5.099 1.00 15.30 H new ATOM 0 HA ASP A 86 21.450 -83.166 -3.673 1.00 63.23 H new ATOM 0 HB2 ASP A 86 23.423 -84.072 -2.587 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.476 -82.966 -3.446 1.00 35.40 H new ATOM 1278 N ALA A 87 23.356 -81.057 -5.377 1.00 21.34 N ATOM 1279 CA ALA A 87 23.410 -79.700 -5.909 1.00 34.53 C ATOM 1280 C ALA A 87 22.126 -79.371 -6.668 1.00 20.20 C ATOM 1281 O ALA A 87 21.583 -78.265 -6.554 1.00 62.15 O ATOM 1282 CB ALA A 87 24.626 -79.535 -6.817 1.00 10.13 C ATOM 0 H ALA A 87 24.122 -81.659 -5.678 1.00 21.34 H new ATOM 0 HA ALA A 87 23.503 -79.004 -5.075 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.654 -78.517 -7.207 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.535 -79.730 -6.247 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.559 -80.240 -7.646 1.00 10.13 H new ATOM 1288 N PHE A 88 21.633 -80.350 -7.419 1.00 23.24 N ATOM 1289 CA PHE A 88 20.437 -80.171 -8.232 1.00 53.22 C ATOM 1290 C PHE A 88 19.193 -80.036 -7.349 1.00 41.43 C ATOM 1291 O PHE A 88 18.343 -79.182 -7.601 1.00 24.23 O ATOM 1292 CB PHE A 88 20.274 -81.341 -9.213 1.00 13.44 C ATOM 1293 CG PHE A 88 19.458 -80.992 -10.437 1.00 60.45 C ATOM 1294 CD1 PHE A 88 18.069 -80.990 -10.398 1.00 41.43 C ATOM 1295 CD2 PHE A 88 20.088 -80.660 -11.629 1.00 2.04 C ATOM 1296 CE1 PHE A 88 17.329 -80.665 -11.521 1.00 43.45 C ATOM 1297 CE2 PHE A 88 19.354 -80.333 -12.752 1.00 65.45 C ATOM 1298 CZ PHE A 88 17.973 -80.336 -12.700 1.00 72.11 C ATOM 0 H PHE A 88 22.046 -81.280 -7.481 1.00 23.24 H new ATOM 0 HA PHE A 88 20.550 -79.250 -8.805 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.261 -81.681 -9.528 1.00 13.44 H new ATOM 0 HB3 PHE A 88 19.800 -82.175 -8.696 1.00 13.44 H new ATOM 0 HD1 PHE A 88 17.561 -81.245 -9.480 1.00 41.43 H new ATOM 0 HD2 PHE A 88 21.167 -80.657 -11.679 1.00 2.04 H new ATOM 0 HE1 PHE A 88 16.250 -80.668 -11.477 1.00 43.45 H new ATOM 0 HE2 PHE A 88 19.859 -80.075 -13.671 1.00 65.45 H new ATOM 0 HZ PHE A 88 17.398 -80.082 -13.578 1.00 72.11 H new ATOM 1308 N VAL A 89 19.086 -80.868 -6.311 1.00 5.13 N ATOM 1309 CA VAL A 89 17.933 -80.803 -5.409 1.00 63.22 C ATOM 1310 C VAL A 89 17.954 -79.499 -4.608 1.00 22.42 C ATOM 1311 O VAL A 89 16.906 -78.915 -4.325 1.00 63.11 O ATOM 1312 CB VAL A 89 17.845 -82.023 -4.447 1.00 62.24 C ATOM 1313 CG1 VAL A 89 18.962 -82.012 -3.408 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.471 -82.080 -3.774 1.00 71.34 C ATOM 0 H VAL A 89 19.772 -81.585 -6.076 1.00 5.13 H new ATOM 0 HA VAL A 89 17.043 -80.831 -6.038 1.00 63.22 H new ATOM 0 HB VAL A 89 17.975 -82.924 -5.047 1.00 62.24 H new ATOM 0 HG11 VAL A 89 18.862 -82.881 -2.757 1.00 41.30 H new ATOM 0 HG12 VAL A 89 19.928 -82.045 -3.912 1.00 41.30 H new ATOM 0 HG13 VAL A 89 18.895 -81.102 -2.811 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.429 -82.940 -3.105 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.308 -81.167 -3.202 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.697 -82.174 -4.535 1.00 71.34 H new ATOM 1324 N LYS A 90 19.153 -79.034 -4.257 1.00 72.24 N ATOM 1325 CA LYS A 90 19.306 -77.748 -3.580 1.00 63.21 C ATOM 1326 C LYS A 90 18.855 -76.626 -4.512 1.00 31.12 C ATOM 1327 O LYS A 90 18.207 -75.667 -4.085 1.00 14.12 O ATOM 1328 CB LYS A 90 20.761 -77.539 -3.137 1.00 12.24 C ATOM 1329 CG LYS A 90 21.250 -78.590 -2.141 1.00 73.32 C ATOM 1330 CD LYS A 90 20.487 -78.534 -0.816 1.00 40.24 C ATOM 1331 CE LYS A 90 20.811 -79.731 0.077 1.00 1.53 C ATOM 1332 NZ LYS A 90 22.273 -79.909 0.271 1.00 60.33 N ATOM 0 H LYS A 90 20.029 -79.527 -4.430 1.00 72.24 H new ATOM 0 HA LYS A 90 18.682 -77.738 -2.686 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.406 -77.554 -4.016 1.00 12.24 H new ATOM 0 HB3 LYS A 90 20.858 -76.551 -2.688 1.00 12.24 H new ATOM 0 HG2 LYS A 90 21.140 -79.582 -2.579 1.00 73.32 H new ATOM 0 HG3 LYS A 90 22.313 -78.441 -1.952 1.00 73.32 H new ATOM 0 HD2 LYS A 90 20.736 -77.611 -0.292 1.00 40.24 H new ATOM 0 HD3 LYS A 90 19.416 -78.508 -1.014 1.00 40.24 H new ATOM 0 HE2 LYS A 90 20.331 -79.599 1.047 1.00 1.53 H new ATOM 0 HE3 LYS A 90 20.392 -80.635 -0.365 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 22.534 -80.893 0.059 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 22.788 -79.269 -0.367 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 22.522 -79.689 1.257 1.00 60.33 H new ATOM 1346 N TYR A 91 19.191 -76.768 -5.792 1.00 10.11 N ATOM 1347 CA TYR A 91 18.683 -75.875 -6.830 1.00 12.44 C ATOM 1348 C TYR A 91 17.161 -75.974 -6.900 1.00 44.40 C ATOM 1349 O TYR A 91 16.468 -74.967 -7.010 1.00 2.03 O ATOM 1350 CB TYR A 91 19.303 -76.228 -8.195 1.00 54.24 C ATOM 1351 CG TYR A 91 18.569 -75.638 -9.390 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.692 -74.291 -9.715 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.756 -76.434 -10.194 1.00 52.30 C ATOM 1354 CE1 TYR A 91 18.026 -73.757 -10.803 1.00 23.41 C ATOM 1355 CE2 TYR A 91 17.089 -75.907 -11.281 1.00 24.51 C ATOM 1356 CZ TYR A 91 17.225 -74.569 -11.581 1.00 4.44 C ATOM 1357 OH TYR A 91 16.562 -74.042 -12.668 1.00 53.33 O ATOM 0 H TYR A 91 19.816 -77.497 -6.136 1.00 10.11 H new ATOM 0 HA TYR A 91 18.962 -74.851 -6.580 1.00 12.44 H new ATOM 0 HB2 TYR A 91 20.336 -75.882 -8.212 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.329 -77.313 -8.299 1.00 54.24 H new ATOM 0 HD1 TYR A 91 19.317 -73.653 -9.108 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.646 -77.483 -9.962 1.00 52.30 H new ATOM 0 HE1 TYR A 91 18.132 -72.709 -11.043 1.00 23.41 H new ATOM 0 HE2 TYR A 91 16.464 -76.540 -11.893 1.00 24.51 H new ATOM 0 HH TYR A 91 16.134 -74.765 -13.172 1.00 53.33 H new ATOM 1367 N LEU A 92 16.655 -77.202 -6.817 1.00 51.34 N ATOM 1368 CA LEU A 92 15.223 -77.468 -6.910 1.00 60.14 C ATOM 1369 C LEU A 92 14.480 -76.813 -5.739 1.00 5.34 C ATOM 1370 O LEU A 92 13.329 -76.403 -5.874 1.00 21.55 O ATOM 1371 CB LEU A 92 14.969 -78.992 -6.938 1.00 42.10 C ATOM 1372 CG LEU A 92 13.909 -79.479 -7.944 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.549 -78.856 -7.658 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.350 -79.183 -9.377 1.00 4.50 C ATOM 0 H LEU A 92 17.224 -78.038 -6.684 1.00 51.34 H new ATOM 0 HA LEU A 92 14.843 -77.037 -7.836 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.911 -79.494 -7.161 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.667 -79.309 -5.940 1.00 42.10 H new ATOM 0 HG LEU A 92 13.811 -80.559 -7.830 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.822 -79.219 -8.385 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.227 -79.131 -6.654 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.623 -77.771 -7.730 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.588 -79.535 -10.072 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.487 -78.109 -9.501 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.291 -79.694 -9.581 1.00 4.50 H new ATOM 1386 N HIS A 93 15.152 -76.720 -4.590 1.00 5.42 N ATOM 1387 CA HIS A 93 14.589 -76.046 -3.413 1.00 23.34 C ATOM 1388 C HIS A 93 14.395 -74.554 -3.688 1.00 11.23 C ATOM 1389 O HIS A 93 13.519 -73.910 -3.107 1.00 14.15 O ATOM 1390 CB HIS A 93 15.497 -76.231 -2.188 1.00 35.40 C ATOM 1391 CG HIS A 93 15.639 -77.656 -1.733 1.00 30.45 C ATOM 1392 ND1 HIS A 93 16.682 -78.086 -0.944 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.860 -78.746 -1.944 1.00 73.34 C ATOM 1394 CE1 HIS A 93 16.542 -79.374 -0.692 1.00 65.23 C ATOM 1395 NE2 HIS A 93 15.445 -79.801 -1.286 1.00 2.30 N ATOM 0 H HIS A 93 16.087 -77.102 -4.447 1.00 5.42 H new ATOM 0 HA HIS A 93 13.620 -76.499 -3.203 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.486 -75.836 -2.420 1.00 35.40 H new ATOM 0 HB3 HIS A 93 15.102 -75.637 -1.364 1.00 35.40 H new ATOM 0 HD2 HIS A 93 13.948 -78.779 -2.522 1.00 73.34 H new ATOM 0 HE1 HIS A 93 17.213 -79.977 -0.099 1.00 65.23 H new ATOM 0 HE2 HIS A 93 15.089 -80.757 -1.261 1.00 2.30 H new ATOM 1404 N LYS A 94 15.238 -74.008 -4.561 1.00 64.43 N ATOM 1405 CA LYS A 94 15.125 -72.615 -4.983 1.00 13.01 C ATOM 1406 C LYS A 94 14.144 -72.506 -6.148 1.00 4.10 C ATOM 1407 O LYS A 94 13.378 -71.542 -6.250 1.00 53.20 O ATOM 1408 CB LYS A 94 16.507 -72.076 -5.392 1.00 13.44 C ATOM 1409 CG LYS A 94 16.496 -70.639 -5.918 1.00 34.11 C ATOM 1410 CD LYS A 94 16.049 -69.636 -4.855 1.00 31.12 C ATOM 1411 CE LYS A 94 16.038 -68.208 -5.392 1.00 75.41 C ATOM 1412 NZ LYS A 94 17.386 -67.765 -5.841 1.00 1.31 N ATOM 0 H LYS A 94 16.012 -74.514 -4.992 1.00 64.43 H new ATOM 0 HA LYS A 94 14.751 -72.017 -4.152 1.00 13.01 H new ATOM 0 HB2 LYS A 94 17.173 -72.130 -4.531 1.00 13.44 H new ATOM 0 HB3 LYS A 94 16.925 -72.728 -6.160 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.494 -70.375 -6.267 1.00 34.11 H new ATOM 0 HG3 LYS A 94 15.830 -70.574 -6.778 1.00 34.11 H new ATOM 0 HD2 LYS A 94 15.052 -69.900 -4.503 1.00 31.12 H new ATOM 0 HD3 LYS A 94 16.716 -69.696 -3.995 1.00 31.12 H new ATOM 0 HE2 LYS A 94 15.339 -68.141 -6.226 1.00 75.41 H new ATOM 0 HE3 LYS A 94 15.675 -67.533 -4.617 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 17.377 -66.738 -6.005 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 18.088 -67.993 -5.108 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 17.636 -68.254 -6.724 1.00 1.31 H new ATOM 1426 N GLY A 95 14.163 -73.522 -7.008 1.00 31.54 N ATOM 1427 CA GLY A 95 13.349 -73.517 -8.207 1.00 21.24 C ATOM 1428 C GLY A 95 13.772 -72.425 -9.171 1.00 10.52 C ATOM 1429 O GLY A 95 14.878 -71.889 -9.067 1.00 3.03 O ATOM 0 H GLY A 95 14.736 -74.357 -6.891 1.00 31.54 H new ATOM 0 HA2 GLY A 95 13.423 -74.486 -8.700 1.00 21.24 H new ATOM 0 HA3 GLY A 95 12.303 -73.377 -7.935 1.00 21.24 H new ATOM 1433 N SER A 96 12.904 -72.097 -10.120 1.00 75.45 N ATOM 1434 CA SER A 96 13.155 -70.987 -11.023 1.00 64.44 C ATOM 1435 C SER A 96 12.760 -69.685 -10.320 1.00 73.22 C ATOM 1436 O SER A 96 11.753 -69.649 -9.611 1.00 41.20 O ATOM 1437 CB SER A 96 12.370 -71.176 -12.328 1.00 73.31 C ATOM 1438 OG SER A 96 12.766 -70.236 -13.309 1.00 75.44 O ATOM 0 H SER A 96 12.023 -72.584 -10.282 1.00 75.45 H new ATOM 0 HA SER A 96 14.213 -70.945 -11.282 1.00 64.44 H new ATOM 0 HB2 SER A 96 12.527 -72.186 -12.706 1.00 73.31 H new ATOM 0 HB3 SER A 96 11.303 -71.071 -12.131 1.00 73.31 H new ATOM 0 HG SER A 96 12.008 -70.040 -13.899 1.00 75.44 H new ATOM 1444 N PRO A 97 13.547 -68.602 -10.500 1.00 15.32 N ATOM 1445 CA PRO A 97 13.354 -67.334 -9.776 1.00 63.34 C ATOM 1446 C PRO A 97 11.904 -66.833 -9.791 1.00 3.15 C ATOM 1447 O PRO A 97 11.428 -66.265 -8.806 1.00 13.01 O ATOM 1448 CB PRO A 97 14.281 -66.342 -10.513 1.00 53.52 C ATOM 1449 CG PRO A 97 14.733 -67.055 -11.749 1.00 13.42 C ATOM 1450 CD PRO A 97 14.691 -68.519 -11.420 1.00 51.42 C ATOM 0 HA PRO A 97 13.586 -67.451 -8.717 1.00 63.34 H new ATOM 0 HB2 PRO A 97 13.752 -65.422 -10.763 1.00 53.52 H new ATOM 0 HB3 PRO A 97 15.130 -66.062 -9.890 1.00 53.52 H new ATOM 0 HG2 PRO A 97 14.081 -66.826 -12.592 1.00 13.42 H new ATOM 0 HG3 PRO A 97 15.740 -66.747 -12.031 1.00 13.42 H new ATOM 0 HD2 PRO A 97 14.543 -69.131 -12.309 1.00 51.42 H new ATOM 0 HD3 PRO A 97 15.615 -68.857 -10.951 1.00 51.42 H new ATOM 1458 N LYS A 98 11.201 -67.055 -10.901 1.00 53.54 N ATOM 1459 CA LYS A 98 9.844 -66.526 -11.069 1.00 24.34 C ATOM 1460 C LYS A 98 8.783 -67.626 -10.981 1.00 74.31 C ATOM 1461 O LYS A 98 7.625 -67.410 -11.334 1.00 21.32 O ATOM 1462 CB LYS A 98 9.744 -65.746 -12.396 1.00 51.22 C ATOM 1463 CG LYS A 98 10.194 -66.516 -13.641 1.00 43.41 C ATOM 1464 CD LYS A 98 9.088 -67.394 -14.225 1.00 31.02 C ATOM 1465 CE LYS A 98 9.510 -68.009 -15.553 1.00 2.21 C ATOM 1466 NZ LYS A 98 8.386 -68.702 -16.227 1.00 75.23 N ATOM 0 H LYS A 98 11.545 -67.595 -11.695 1.00 53.54 H new ATOM 0 HA LYS A 98 9.644 -65.840 -10.246 1.00 24.34 H new ATOM 0 HB2 LYS A 98 8.710 -65.432 -12.537 1.00 51.22 H new ATOM 0 HB3 LYS A 98 10.344 -64.840 -12.312 1.00 51.22 H new ATOM 0 HG2 LYS A 98 10.528 -65.808 -14.399 1.00 43.41 H new ATOM 0 HG3 LYS A 98 11.051 -67.140 -13.387 1.00 43.41 H new ATOM 0 HD2 LYS A 98 8.839 -68.186 -13.519 1.00 31.02 H new ATOM 0 HD3 LYS A 98 8.186 -66.799 -14.368 1.00 31.02 H new ATOM 0 HE2 LYS A 98 9.899 -67.228 -16.207 1.00 2.21 H new ATOM 0 HE3 LYS A 98 10.322 -68.716 -15.383 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 8.635 -68.882 -17.221 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 8.198 -69.606 -15.748 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 7.535 -68.105 -16.186 1.00 75.23 H new ATOM 1480 N SER A 99 9.177 -68.796 -10.488 1.00 22.33 N ATOM 1481 CA SER A 99 8.243 -69.897 -10.268 1.00 33.13 C ATOM 1482 C SER A 99 8.145 -70.197 -8.773 1.00 51.15 C ATOM 1483 O SER A 99 9.050 -70.799 -8.190 1.00 65.20 O ATOM 1484 CB SER A 99 8.686 -71.149 -11.043 1.00 24.15 C ATOM 1485 OG SER A 99 9.982 -71.565 -10.648 1.00 42.35 O ATOM 0 H SER A 99 10.141 -69.007 -10.232 1.00 22.33 H new ATOM 0 HA SER A 99 7.260 -69.605 -10.637 1.00 33.13 H new ATOM 0 HB2 SER A 99 7.974 -71.957 -10.872 1.00 24.15 H new ATOM 0 HB3 SER A 99 8.679 -70.939 -12.113 1.00 24.15 H new ATOM 0 HG SER A 99 10.456 -70.812 -10.237 1.00 42.35 H new ATOM 1491 N VAL A 100 7.065 -69.745 -8.148 1.00 74.22 N ATOM 1492 CA VAL A 100 6.850 -69.985 -6.728 1.00 45.42 C ATOM 1493 C VAL A 100 6.538 -71.461 -6.484 1.00 51.00 C ATOM 1494 O VAL A 100 5.414 -71.915 -6.703 1.00 74.34 O ATOM 1495 CB VAL A 100 5.706 -69.103 -6.168 1.00 21.34 C ATOM 1496 CG1 VAL A 100 5.529 -69.331 -4.667 1.00 13.01 C ATOM 1497 CG2 VAL A 100 5.971 -67.628 -6.472 1.00 20.43 C ATOM 0 H VAL A 100 6.325 -69.210 -8.603 1.00 74.22 H new ATOM 0 HA VAL A 100 7.768 -69.718 -6.204 1.00 45.42 H new ATOM 0 HB VAL A 100 4.777 -69.390 -6.660 1.00 21.34 H new ATOM 0 HG11 VAL A 100 4.720 -68.701 -4.296 1.00 13.01 H new ATOM 0 HG12 VAL A 100 5.287 -70.378 -4.484 1.00 13.01 H new ATOM 0 HG13 VAL A 100 6.454 -69.077 -4.149 1.00 13.01 H new ATOM 0 HG21 VAL A 100 5.158 -67.022 -6.072 1.00 20.43 H new ATOM 0 HG22 VAL A 100 6.911 -67.325 -6.011 1.00 20.43 H new ATOM 0 HG23 VAL A 100 6.034 -67.484 -7.551 1.00 20.43 H new ATOM 1507 N VAL A 101 7.554 -72.206 -6.068 1.00 73.33 N ATOM 1508 CA VAL A 101 7.413 -73.634 -5.808 1.00 33.12 C ATOM 1509 C VAL A 101 6.533 -73.881 -4.581 1.00 14.21 C ATOM 1510 O VAL A 101 6.709 -73.252 -3.532 1.00 71.23 O ATOM 1511 CB VAL A 101 8.794 -74.319 -5.621 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.603 -74.250 -6.915 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.577 -73.694 -4.463 1.00 23.20 C ATOM 0 H VAL A 101 8.492 -71.842 -5.902 1.00 73.33 H new ATOM 0 HA VAL A 101 6.931 -74.076 -6.680 1.00 33.12 H new ATOM 0 HB VAL A 101 8.617 -75.366 -5.374 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.568 -74.734 -6.767 1.00 0.11 H new ATOM 0 HG12 VAL A 101 9.060 -74.759 -7.711 1.00 0.11 H new ATOM 0 HG13 VAL A 101 9.759 -73.207 -7.191 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.538 -74.197 -4.360 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.741 -72.635 -4.664 1.00 23.20 H new ATOM 0 HG23 VAL A 101 9.009 -73.804 -3.539 1.00 23.20 H new ATOM 1523 N LYS A 102 5.571 -74.780 -4.730 1.00 25.24 N ATOM 1524 CA LYS A 102 4.642 -75.120 -3.658 1.00 22.23 C ATOM 1525 C LYS A 102 5.255 -76.172 -2.736 1.00 52.51 C ATOM 1526 O LYS A 102 5.416 -75.950 -1.535 1.00 64.20 O ATOM 1527 CB LYS A 102 3.330 -75.643 -4.259 1.00 14.41 C ATOM 1528 CG LYS A 102 2.249 -75.970 -3.229 1.00 2.24 C ATOM 1529 CD LYS A 102 1.083 -76.738 -3.854 1.00 35.55 C ATOM 1530 CE LYS A 102 0.446 -75.978 -5.016 1.00 34.44 C ATOM 1531 NZ LYS A 102 -0.598 -76.785 -5.705 1.00 11.03 N ATOM 0 H LYS A 102 5.411 -75.295 -5.596 1.00 25.24 H new ATOM 0 HA LYS A 102 4.436 -74.225 -3.071 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.940 -74.898 -4.953 1.00 14.41 H new ATOM 0 HB3 LYS A 102 3.543 -76.540 -4.841 1.00 14.41 H new ATOM 0 HG2 LYS A 102 2.683 -76.561 -2.422 1.00 2.24 H new ATOM 0 HG3 LYS A 102 1.879 -75.046 -2.784 1.00 2.24 H new ATOM 0 HD2 LYS A 102 1.436 -77.707 -4.206 1.00 35.55 H new ATOM 0 HD3 LYS A 102 0.328 -76.932 -3.092 1.00 35.55 H new ATOM 0 HE2 LYS A 102 0.003 -75.053 -4.645 1.00 34.44 H new ATOM 0 HE3 LYS A 102 1.218 -75.697 -5.732 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -1.004 -76.232 -6.487 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 -0.171 -77.656 -6.082 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 -1.349 -77.032 -5.029 1.00 11.03 H new ATOM 1545 N LYS A 103 5.617 -77.310 -3.319 1.00 12.03 N ATOM 1546 CA LYS A 103 6.186 -78.428 -2.571 1.00 72.44 C ATOM 1547 C LYS A 103 7.069 -79.271 -3.489 1.00 14.24 C ATOM 1548 O LYS A 103 6.704 -79.532 -4.638 1.00 53.50 O ATOM 1549 CB LYS A 103 5.061 -79.297 -1.976 1.00 61.22 C ATOM 1550 CG LYS A 103 5.555 -80.548 -1.246 1.00 3.35 C ATOM 1551 CD LYS A 103 4.400 -81.406 -0.729 1.00 22.31 C ATOM 1552 CE LYS A 103 3.514 -81.919 -1.862 1.00 15.43 C ATOM 1553 NZ LYS A 103 2.363 -82.708 -1.350 1.00 35.52 N ATOM 0 H LYS A 103 5.525 -77.484 -4.320 1.00 12.03 H new ATOM 0 HA LYS A 103 6.793 -78.035 -1.756 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.478 -78.692 -1.282 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.388 -79.600 -2.778 1.00 61.22 H new ATOM 0 HG2 LYS A 103 6.173 -81.141 -1.921 1.00 3.35 H new ATOM 0 HG3 LYS A 103 6.189 -80.253 -0.410 1.00 3.35 H new ATOM 0 HD2 LYS A 103 4.799 -82.252 -0.170 1.00 22.31 H new ATOM 0 HD3 LYS A 103 3.797 -80.821 -0.034 1.00 22.31 H new ATOM 0 HE2 LYS A 103 3.145 -81.075 -2.445 1.00 15.43 H new ATOM 0 HE3 LYS A 103 4.107 -82.537 -2.536 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 1.786 -83.039 -2.149 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 2.715 -83.527 -0.815 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 1.782 -82.111 -0.727 1.00 35.52 H new ATOM 1567 N VAL A 104 8.228 -79.685 -2.987 1.00 20.25 N ATOM 1568 CA VAL A 104 9.144 -80.530 -3.749 1.00 63.52 C ATOM 1569 C VAL A 104 9.002 -81.987 -3.305 1.00 23.40 C ATOM 1570 O VAL A 104 8.819 -82.267 -2.116 1.00 41.12 O ATOM 1571 CB VAL A 104 10.618 -80.060 -3.593 1.00 12.25 C ATOM 1572 CG1 VAL A 104 11.085 -80.144 -2.139 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.546 -80.853 -4.513 1.00 13.11 C ATOM 0 H VAL A 104 8.557 -79.448 -2.051 1.00 20.25 H new ATOM 0 HA VAL A 104 8.880 -80.447 -4.803 1.00 63.52 H new ATOM 0 HB VAL A 104 10.660 -79.012 -3.890 1.00 12.25 H new ATOM 0 HG11 VAL A 104 12.119 -79.808 -2.069 1.00 24.45 H new ATOM 0 HG12 VAL A 104 10.454 -79.509 -1.517 1.00 24.45 H new ATOM 0 HG13 VAL A 104 11.015 -81.175 -1.793 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.571 -80.505 -4.384 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.489 -81.912 -4.262 1.00 13.11 H new ATOM 0 HG23 VAL A 104 11.241 -80.709 -5.549 1.00 13.11 H new ATOM 1583 N SER A 105 9.055 -82.909 -4.260 1.00 70.15 N ATOM 1584 CA SER A 105 8.895 -84.326 -3.976 1.00 14.10 C ATOM 1585 C SER A 105 9.914 -85.135 -4.775 1.00 74.04 C ATOM 1586 O SER A 105 9.967 -85.049 -6.003 1.00 24.02 O ATOM 1587 CB SER A 105 7.467 -84.768 -4.313 1.00 4.52 C ATOM 1588 OG SER A 105 6.512 -83.984 -3.612 1.00 72.03 O ATOM 0 H SER A 105 9.209 -82.695 -5.245 1.00 70.15 H new ATOM 0 HA SER A 105 9.070 -84.503 -2.915 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.299 -84.679 -5.386 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.338 -85.820 -4.057 1.00 4.52 H new ATOM 0 HG SER A 105 5.608 -84.284 -3.845 1.00 72.03 H new ATOM 1594 N ILE A 106 10.735 -85.898 -4.068 1.00 60.24 N ATOM 1595 CA ILE A 106 11.782 -86.705 -4.686 1.00 10.30 C ATOM 1596 C ILE A 106 11.454 -88.184 -4.495 1.00 61.14 C ATOM 1597 O ILE A 106 10.656 -88.526 -3.622 1.00 52.41 O ATOM 1598 CB ILE A 106 13.167 -86.387 -4.058 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.364 -84.865 -3.926 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.290 -86.995 -4.895 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.360 -84.127 -5.249 1.00 61.02 C ATOM 0 H ILE A 106 10.696 -85.976 -3.052 1.00 60.24 H new ATOM 0 HA ILE A 106 11.828 -86.470 -5.749 1.00 10.30 H new ATOM 0 HB ILE A 106 13.199 -86.829 -3.062 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.574 -84.460 -3.293 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.309 -84.674 -3.418 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.252 -86.761 -4.438 1.00 61.45 H new ATOM 0 HG22 ILE A 106 14.164 -88.077 -4.942 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.257 -86.582 -5.903 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.504 -83.061 -5.072 1.00 61.02 H new ATOM 0 HD12 ILE A 106 14.167 -84.503 -5.878 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.406 -84.285 -5.751 1.00 61.02 H new ATOM 1613 N HIS A 107 12.046 -89.064 -5.302 1.00 62.33 N ATOM 1614 CA HIS A 107 11.780 -90.495 -5.180 1.00 42.21 C ATOM 1615 C HIS A 107 13.066 -91.300 -5.351 1.00 3.14 C ATOM 1616 O HIS A 107 13.926 -90.960 -6.161 1.00 44.31 O ATOM 1617 CB HIS A 107 10.718 -90.941 -6.194 1.00 1.15 C ATOM 1618 CG HIS A 107 10.108 -92.276 -5.875 1.00 52.33 C ATOM 1619 ND1 HIS A 107 10.374 -93.422 -6.589 1.00 63.51 N ATOM 1620 CD2 HIS A 107 9.234 -92.638 -4.903 1.00 51.43 C ATOM 1621 CE1 HIS A 107 9.696 -94.429 -6.074 1.00 61.40 C ATOM 1622 NE2 HIS A 107 8.998 -93.980 -5.051 1.00 21.31 N ATOM 0 H HIS A 107 12.705 -88.814 -6.039 1.00 62.33 H new ATOM 0 HA HIS A 107 11.392 -90.684 -4.179 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.929 -90.190 -6.235 1.00 1.15 H new ATOM 0 HB3 HIS A 107 11.169 -90.984 -7.185 1.00 1.15 H new ATOM 0 HD1 HIS A 107 10.999 -93.483 -7.393 1.00 63.51 H new ATOM 0 HD2 HIS A 107 8.805 -91.990 -4.153 1.00 51.43 H new ATOM 0 HE1 HIS A 107 9.711 -95.448 -6.430 1.00 61.40 H new ATOM 1631 N ALA A 108 13.149 -92.387 -4.598 1.00 62.21 N ATOM 1632 CA ALA A 108 14.355 -93.208 -4.459 1.00 71.54 C ATOM 1633 C ALA A 108 14.741 -93.996 -5.720 1.00 51.20 C ATOM 1634 O ALA A 108 15.667 -94.807 -5.668 1.00 13.21 O ATOM 1635 CB ALA A 108 14.204 -94.150 -3.272 1.00 1.01 C ATOM 0 H ALA A 108 12.362 -92.736 -4.051 1.00 62.21 H new ATOM 0 HA ALA A 108 15.175 -92.510 -4.292 1.00 71.54 H new ATOM 0 HB1 ALA A 108 15.103 -94.758 -3.173 1.00 1.01 H new ATOM 0 HB2 ALA A 108 14.058 -93.568 -2.362 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.343 -94.799 -3.430 1.00 1.01 H new ATOM 1641 N SER A 109 14.054 -93.772 -6.839 1.00 22.12 N ATOM 1642 CA SER A 109 14.156 -94.666 -7.995 1.00 13.31 C ATOM 1643 C SER A 109 15.594 -94.758 -8.512 1.00 70.35 C ATOM 1644 O SER A 109 16.260 -93.749 -8.745 1.00 20.01 O ATOM 1645 CB SER A 109 13.260 -94.147 -9.122 1.00 75.32 C ATOM 1646 OG SER A 109 11.896 -94.139 -8.733 1.00 74.32 O ATOM 0 H SER A 109 13.422 -92.982 -6.971 1.00 22.12 H new ATOM 0 HA SER A 109 13.839 -95.659 -7.677 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.567 -93.139 -9.399 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.385 -94.772 -10.006 1.00 75.32 H new ATOM 0 HG SER A 109 11.441 -93.378 -9.150 1.00 74.32 H new ATOM 1652 N SER A 110 16.036 -96.002 -8.691 1.00 53.15 N ATOM 1653 CA SER A 110 17.408 -96.316 -9.060 1.00 44.34 C ATOM 1654 C SER A 110 17.723 -95.883 -10.492 1.00 21.33 C ATOM 1655 O SER A 110 16.862 -95.362 -11.206 1.00 40.12 O ATOM 1656 CB SER A 110 17.654 -97.824 -8.883 1.00 20.12 C ATOM 1657 OG SER A 110 19.006 -98.175 -9.142 1.00 61.20 O ATOM 0 H SER A 110 15.443 -96.825 -8.582 1.00 53.15 H new ATOM 0 HA SER A 110 18.076 -95.759 -8.403 1.00 44.34 H new ATOM 0 HB2 SER A 110 17.391 -98.118 -7.867 1.00 20.12 H new ATOM 0 HB3 SER A 110 17.000 -98.380 -9.555 1.00 20.12 H new ATOM 0 HG SER A 110 19.123 -99.140 -9.018 1.00 61.20 H new ATOM 1663 N ARG A 111 18.975 -96.113 -10.886 1.00 10.21 N ATOM 1664 CA ARG A 111 19.511 -95.688 -12.178 1.00 70.34 C ATOM 1665 C ARG A 111 18.546 -95.939 -13.335 1.00 33.55 C ATOM 1666 O ARG A 111 18.005 -97.038 -13.493 1.00 43.23 O ATOM 1667 CB ARG A 111 20.830 -96.415 -12.449 1.00 25.13 C ATOM 1668 CG ARG A 111 21.438 -96.122 -13.819 1.00 15.51 C ATOM 1669 CD ARG A 111 22.736 -96.888 -14.017 1.00 32.52 C ATOM 1670 NE ARG A 111 23.286 -96.718 -15.361 1.00 21.10 N ATOM 1671 CZ ARG A 111 24.571 -96.891 -15.658 1.00 63.31 C ATOM 1672 NH1 ARG A 111 25.433 -97.224 -14.701 1.00 42.52 N ATOM 1673 NH2 ARG A 111 24.991 -96.731 -16.905 1.00 12.12 N ATOM 0 H ARG A 111 19.655 -96.607 -10.308 1.00 10.21 H new ATOM 0 HA ARG A 111 19.669 -94.611 -12.119 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.549 -96.138 -11.678 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.665 -97.489 -12.360 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.729 -96.394 -14.601 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.625 -95.053 -13.916 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.468 -96.552 -13.283 1.00 32.52 H new ATOM 0 HD3 ARG A 111 22.561 -97.948 -13.831 1.00 32.52 H new ATOM 0 HE ARG A 111 22.649 -96.452 -16.112 1.00 21.10 H new ATOM 0 HH11 ARG A 111 25.108 -97.346 -13.742 1.00 42.52 H new ATOM 0 HH12 ARG A 111 26.419 -97.357 -14.926 1.00 42.52 H new ATOM 0 HH21 ARG A 111 24.329 -96.475 -17.637 1.00 12.12 H new ATOM 0 HH22 ARG A 111 25.976 -96.864 -17.132 1.00 12.12 H new ATOM 1687 N VAL A 112 18.349 -94.898 -14.129 1.00 42.33 N ATOM 1688 CA VAL A 112 17.570 -94.957 -15.360 1.00 22.53 C ATOM 1689 C VAL A 112 18.441 -94.470 -16.515 1.00 21.24 C ATOM 1690 O VAL A 112 19.590 -94.079 -16.303 1.00 51.15 O ATOM 1691 CB VAL A 112 16.288 -94.090 -15.274 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.370 -94.578 -14.156 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.646 -92.617 -15.084 1.00 12.43 C ATOM 0 H VAL A 112 18.731 -93.973 -13.935 1.00 42.33 H new ATOM 0 HA VAL A 112 17.258 -95.989 -15.521 1.00 22.53 H new ATOM 0 HB VAL A 112 15.747 -94.190 -16.215 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.478 -93.952 -14.118 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.080 -95.611 -14.348 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.895 -94.520 -13.203 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.733 -92.025 -15.026 1.00 12.43 H new ATOM 0 HG22 VAL A 112 17.215 -92.497 -14.162 1.00 12.43 H new ATOM 0 HG23 VAL A 112 17.246 -92.277 -15.928 1.00 12.43 H new ATOM 1703 N ASP A 113 17.923 -94.524 -17.733 1.00 71.41 N ATOM 1704 CA ASP A 113 18.669 -94.037 -18.892 1.00 61.45 C ATOM 1705 C ASP A 113 18.214 -92.623 -19.259 1.00 54.52 C ATOM 1706 O ASP A 113 17.034 -92.397 -19.540 1.00 71.24 O ATOM 1707 CB ASP A 113 18.506 -94.991 -20.080 1.00 13.55 C ATOM 1708 CG ASP A 113 19.007 -96.393 -19.758 1.00 74.32 C ATOM 1709 OD1 ASP A 113 20.236 -96.577 -19.630 1.00 41.05 O ATOM 1710 OD2 ASP A 113 18.170 -97.316 -19.619 1.00 52.52 O ATOM 0 H ASP A 113 16.998 -94.896 -17.947 1.00 71.41 H new ATOM 0 HA ASP A 113 19.728 -94.000 -18.635 1.00 61.45 H new ATOM 0 HB2 ASP A 113 17.455 -95.038 -20.366 1.00 13.55 H new ATOM 0 HB3 ASP A 113 19.052 -94.599 -20.938 1.00 13.55 H new ATOM 1715 N ALA A 114 19.162 -91.682 -19.250 1.00 61.52 N ATOM 1716 CA ALA A 114 18.880 -90.260 -19.491 1.00 14.04 C ATOM 1717 C ALA A 114 18.165 -90.035 -20.826 1.00 42.21 C ATOM 1718 O ALA A 114 18.348 -90.802 -21.776 1.00 32.43 O ATOM 1719 CB ALA A 114 20.178 -89.458 -19.445 1.00 51.25 C ATOM 0 H ALA A 114 20.147 -91.882 -19.076 1.00 61.52 H new ATOM 0 HA ALA A 114 18.211 -89.916 -18.702 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.962 -88.405 -19.624 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.641 -89.571 -18.465 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.859 -89.824 -20.213 1.00 51.25 H new ATOM 1725 N ASP A 115 17.371 -88.965 -20.900 1.00 54.31 N ATOM 1726 CA ASP A 115 16.573 -88.678 -22.094 1.00 31.20 C ATOM 1727 C ASP A 115 16.645 -87.194 -22.478 1.00 74.33 C ATOM 1728 O ASP A 115 16.695 -86.864 -23.663 1.00 33.11 O ATOM 1729 CB ASP A 115 15.117 -89.108 -21.873 1.00 63.02 C ATOM 1730 CG ASP A 115 14.275 -89.013 -23.137 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.613 -89.687 -24.136 1.00 71.54 O ATOM 1732 OD2 ASP A 115 13.253 -88.298 -23.127 1.00 60.54 O ATOM 0 H ASP A 115 17.263 -88.284 -20.149 1.00 54.31 H new ATOM 0 HA ASP A 115 16.990 -89.251 -22.922 1.00 31.20 H new ATOM 0 HB2 ASP A 115 15.098 -90.134 -21.506 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.672 -88.484 -21.098 1.00 63.02 H new ATOM 1737 N GLY A 116 16.654 -86.300 -21.483 1.00 25.12 N ATOM 1738 CA GLY A 116 16.790 -84.872 -21.767 1.00 51.02 C ATOM 1739 C GLY A 116 15.992 -83.985 -20.818 1.00 52.42 C ATOM 1740 O GLY A 116 14.877 -84.329 -20.406 1.00 24.24 O ATOM 0 H GLY A 116 16.570 -86.535 -20.494 1.00 25.12 H new ATOM 0 HA2 GLY A 116 17.843 -84.597 -21.710 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.466 -84.680 -22.790 1.00 51.02 H new ATOM 1744 N PHE A 117 16.564 -82.840 -20.455 1.00 5.24 N ATOM 1745 CA PHE A 117 15.876 -81.885 -19.593 1.00 2.31 C ATOM 1746 C PHE A 117 15.153 -80.850 -20.453 1.00 32.41 C ATOM 1747 O PHE A 117 15.794 -80.028 -21.110 1.00 0.02 O ATOM 1748 CB PHE A 117 16.882 -81.167 -18.674 1.00 64.33 C ATOM 1749 CG PHE A 117 17.682 -82.082 -17.774 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.714 -82.859 -18.285 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.407 -82.158 -16.417 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.448 -83.690 -17.461 1.00 24.34 C ATOM 1753 CE2 PHE A 117 18.139 -82.987 -15.589 1.00 3.23 C ATOM 1754 CZ PHE A 117 19.160 -83.754 -16.111 1.00 43.44 C ATOM 0 H PHE A 117 17.499 -82.552 -20.744 1.00 5.24 H new ATOM 0 HA PHE A 117 15.157 -82.425 -18.978 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.573 -80.594 -19.292 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.341 -80.452 -18.054 1.00 64.33 H new ATOM 0 HD1 PHE A 117 18.945 -82.813 -19.339 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.609 -81.561 -16.001 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.247 -84.290 -17.872 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.912 -83.035 -14.534 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.733 -84.403 -15.466 1.00 43.44 H new ATOM 1764 N GLU A 118 13.823 -80.875 -20.441 1.00 33.04 N ATOM 1765 CA GLU A 118 13.042 -79.898 -21.190 1.00 23.02 C ATOM 1766 C GLU A 118 11.597 -79.857 -20.699 1.00 63.02 C ATOM 1767 O GLU A 118 10.888 -80.859 -20.739 1.00 13.12 O ATOM 1768 CB GLU A 118 13.108 -80.193 -22.698 1.00 70.42 C ATOM 1769 CG GLU A 118 12.679 -81.602 -23.090 1.00 51.04 C ATOM 1770 CD GLU A 118 12.722 -81.824 -24.595 1.00 53.34 C ATOM 1771 OE1 GLU A 118 11.822 -81.315 -25.298 1.00 62.15 O ATOM 1772 OE2 GLU A 118 13.640 -82.518 -25.083 1.00 71.34 O ATOM 0 H GLU A 118 13.268 -81.557 -19.924 1.00 33.04 H new ATOM 0 HA GLU A 118 13.476 -78.913 -21.019 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.476 -79.476 -23.223 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.129 -80.030 -23.042 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.329 -82.326 -22.600 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.668 -81.785 -22.727 1.00 51.04 H new ATOM 1779 N ILE A 119 11.168 -78.689 -20.233 1.00 14.51 N ATOM 1780 CA ILE A 119 9.812 -78.517 -19.731 1.00 51.30 C ATOM 1781 C ILE A 119 8.804 -78.715 -20.866 1.00 62.21 C ATOM 1782 O ILE A 119 8.414 -77.766 -21.558 1.00 44.42 O ATOM 1783 CB ILE A 119 9.612 -77.128 -19.049 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.424 -77.035 -17.738 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.133 -76.854 -18.766 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.930 -77.030 -17.919 1.00 71.13 C ATOM 0 H ILE A 119 11.742 -77.847 -20.193 1.00 14.51 H new ATOM 0 HA ILE A 119 9.642 -79.275 -18.966 1.00 51.30 H new ATOM 0 HB ILE A 119 9.976 -76.370 -19.743 1.00 2.53 H new ATOM 0 HG12 ILE A 119 10.133 -76.126 -17.211 1.00 24.02 H new ATOM 0 HG13 ILE A 119 10.152 -77.875 -17.099 1.00 24.02 H new ATOM 0 HG21 ILE A 119 8.028 -75.879 -18.291 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.576 -76.863 -19.703 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.741 -77.625 -18.103 1.00 53.12 H new ATOM 0 HD11 ILE A 119 12.413 -76.962 -16.944 1.00 71.13 H new ATOM 0 HD12 ILE A 119 12.240 -77.950 -18.415 1.00 71.13 H new ATOM 0 HD13 ILE A 119 12.220 -76.174 -18.528 1.00 71.13 H new ATOM 1798 N ARG A 120 8.437 -79.974 -21.079 1.00 2.03 N ATOM 1799 CA ARG A 120 7.458 -80.347 -22.087 1.00 61.44 C ATOM 1800 C ARG A 120 6.054 -80.066 -21.585 1.00 32.31 C ATOM 1801 O ARG A 120 5.742 -80.297 -20.417 1.00 1.25 O ATOM 1802 CB ARG A 120 7.640 -81.824 -22.473 1.00 4.12 C ATOM 1803 CG ARG A 120 8.780 -82.030 -23.454 1.00 2.23 C ATOM 1804 CD ARG A 120 8.971 -83.490 -23.840 1.00 30.01 C ATOM 1805 NE ARG A 120 10.205 -83.660 -24.602 1.00 3.51 N ATOM 1806 CZ ARG A 120 10.705 -84.824 -25.002 1.00 12.41 C ATOM 1807 NH1 ARG A 120 10.011 -85.948 -24.864 1.00 3.32 N ATOM 1808 NH2 ARG A 120 11.900 -84.859 -25.572 1.00 2.32 N ATOM 0 H ARG A 120 8.812 -80.765 -20.555 1.00 2.03 H new ATOM 0 HA ARG A 120 7.613 -79.746 -22.983 1.00 61.44 H new ATOM 0 HB2 ARG A 120 7.827 -82.411 -21.574 1.00 4.12 H new ATOM 0 HB3 ARG A 120 6.715 -82.199 -22.911 1.00 4.12 H new ATOM 0 HG2 ARG A 120 8.590 -81.443 -24.353 1.00 2.23 H new ATOM 0 HG3 ARG A 120 9.703 -81.651 -23.015 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.002 -84.108 -22.943 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.121 -83.830 -24.432 1.00 30.01 H new ATOM 0 HE ARG A 120 10.725 -82.817 -24.847 1.00 3.51 H new ATOM 0 HH11 ARG A 120 9.081 -85.925 -24.446 1.00 3.32 H new ATOM 0 HH12 ARG A 120 10.408 -86.834 -25.176 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.429 -83.996 -25.701 1.00 2.32 H new ATOM 0 HH22 ARG A 120 12.291 -85.748 -25.882 1.00 2.32 H new ATOM 1822 N ARG A 121 5.225 -79.547 -22.477 1.00 14.01 N ATOM 1823 CA ARG A 121 3.894 -79.068 -22.130 1.00 75.33 C ATOM 1824 C ARG A 121 2.889 -79.544 -23.172 1.00 64.21 C ATOM 1825 O ARG A 121 2.157 -80.512 -22.902 1.00 51.44 O ATOM 1826 CB ARG A 121 3.907 -77.532 -22.062 1.00 72.42 C ATOM 1827 CG ARG A 121 4.797 -76.967 -20.955 1.00 14.51 C ATOM 1828 CD ARG A 121 5.317 -75.575 -21.299 1.00 12.45 C ATOM 1829 NE ARG A 121 6.233 -75.612 -22.445 1.00 4.53 N ATOM 1830 CZ ARG A 121 6.372 -74.628 -23.336 1.00 42.14 C ATOM 1831 NH1 ARG A 121 5.657 -73.513 -23.220 1.00 1.44 N ATOM 1832 NH2 ARG A 121 7.228 -74.764 -24.344 1.00 65.01 N ATOM 1833 OXT ARG A 121 2.864 -78.960 -24.278 1.00 0.00 O ATOM 0 H ARG A 121 5.456 -79.445 -23.465 1.00 14.01 H new ATOM 0 HA ARG A 121 3.603 -79.464 -21.157 1.00 75.33 H new ATOM 0 HB2 ARG A 121 4.244 -77.139 -23.021 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.888 -77.176 -21.912 1.00 72.42 H new ATOM 0 HG2 ARG A 121 4.234 -76.924 -20.023 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.639 -77.638 -20.788 1.00 14.51 H new ATOM 0 HD2 ARG A 121 4.478 -74.917 -21.524 1.00 12.45 H new ATOM 0 HD3 ARG A 121 5.830 -75.153 -20.435 1.00 12.45 H new ATOM 0 HE ARG A 121 6.803 -76.448 -22.569 1.00 4.53 H new ATOM 0 HH11 ARG A 121 4.999 -73.407 -22.448 1.00 1.44 H new ATOM 0 HH12 ARG A 121 5.766 -72.764 -23.903 1.00 1.44 H new ATOM 0 HH21 ARG A 121 7.777 -75.619 -24.435 1.00 65.01 H new ATOM 0 HH22 ARG A 121 7.336 -74.013 -25.026 1.00 65.01 H new TER 1847 ARG A 121