USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1066 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 42 SER OG : rot -156:sc= 0.893 USER MOD Set 1.2: A 66 THR OG1 : rot -175:sc= 1.23 USER MOD Set 2.1: A 34 ASN : amide:sc= -1.3! K(o=-1.2!,f=0.55) USER MOD Set 2.2: A 35 SER OG : rot 180:sc= 0.13 USER MOD Set 3.1: A 27 LYS NZ :NH3+ -109:sc= 1.23 (180deg=-1.03) USER MOD Set 3.2: A 126 SER OG : rot -67:sc= 0.88 USER MOD Set 4.1: A 18 MET CE :methyl -120:sc= 0 (180deg=-0.246) USER MOD Set 4.2: A 53 SER OG : rot 160:sc= 0 USER MOD Single : A 1 ALA N :NH3+ -176:sc= 0.726 (180deg=0.669) USER MOD Single : A 2 THR OG1 : rot -65:sc= 0.937 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 18:sc= 0.0191 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.167 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.031) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 19 ASN : amide:sc= -0.238 X(o=-0.24,f=-0.24) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= 0.821 K(o=0.82,f=-1.5) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 34:sc= 0.106 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0.0676 USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.105 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 59 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00993) USER MOD Single : A 60 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.26) USER MOD Single : A 61 GLN : amide:sc= -0.0138 K(o=-0.014,f=-2.4!) USER MOD Single : A 62 TYR OH : rot -68:sc= 0.406 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.727 K(o=0.73,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -110:sc= 0.293 USER MOD Single : A 93 THR OG1 : rot -92:sc= 0.348 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 50:sc= 0.404 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.0676 X(o=-0.068,f=-0.044) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -170:sc=-0.00337 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.438 X(o=-0.44,f=-0.39) USER MOD Single : A 116 ASN : amide:sc= -0.374 K(o=-0.37,f=-0.88) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= -4.92! K(o=-4.9!,f=-2.6) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 130 SER OG : rot 28:sc= 0.142 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 2.699 -25.665 -2.664 1.00 0.00 N ATOM 2 CA ALA A 1 2.778 -24.234 -2.991 1.00 0.00 C ATOM 3 C ALA A 1 1.354 -23.743 -3.255 1.00 0.00 C ATOM 4 O ALA A 1 0.419 -24.548 -3.254 1.00 0.00 O ATOM 5 CB ALA A 1 3.724 -24.007 -4.176 1.00 0.00 C ATOM 0 H1 ALA A 1 3.645 -26.016 -2.412 1.00 0.00 H new ATOM 0 H2 ALA A 1 2.053 -25.802 -1.860 1.00 0.00 H new ATOM 0 H3 ALA A 1 2.343 -26.190 -3.488 1.00 0.00 H new ATOM 0 HA ALA A 1 3.198 -23.659 -2.166 1.00 0.00 H new ATOM 0 HB1 ALA A 1 3.771 -22.942 -4.405 1.00 0.00 H new ATOM 0 HB2 ALA A 1 4.720 -24.368 -3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 1 3.354 -24.549 -5.046 1.00 0.00 H new ATOM 11 N THR A 2 1.146 -22.441 -3.439 1.00 0.00 N ATOM 12 CA THR A 2 -0.190 -21.890 -3.653 1.00 0.00 C ATOM 13 C THR A 2 -0.100 -20.766 -4.682 1.00 0.00 C ATOM 14 O THR A 2 1.002 -20.267 -4.965 1.00 0.00 O ATOM 15 CB THR A 2 -0.753 -21.469 -2.276 1.00 0.00 C ATOM 16 OG1 THR A 2 -2.165 -21.393 -2.216 1.00 0.00 O ATOM 17 CG2 THR A 2 -0.170 -20.154 -1.743 1.00 0.00 C ATOM 0 H THR A 2 1.891 -21.744 -3.444 1.00 0.00 H new ATOM 0 HA THR A 2 -0.889 -22.615 -4.070 1.00 0.00 H new ATOM 0 HB THR A 2 -0.428 -22.288 -1.634 1.00 0.00 H new ATOM 0 HG1 THR A 2 -2.480 -20.678 -2.808 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.614 -19.926 -0.774 1.00 0.00 H new ATOM 0 HG22 THR A 2 0.910 -20.253 -1.634 1.00 0.00 H new ATOM 0 HG23 THR A 2 -0.392 -19.348 -2.442 1.00 0.00 H new ATOM 25 N SER A 3 -1.252 -20.357 -5.207 1.00 0.00 N ATOM 26 CA SER A 3 -1.379 -19.214 -6.088 1.00 0.00 C ATOM 27 C SER A 3 -2.566 -18.404 -5.605 1.00 0.00 C ATOM 28 O SER A 3 -3.538 -18.945 -5.089 1.00 0.00 O ATOM 29 CB SER A 3 -1.474 -19.678 -7.542 1.00 0.00 C ATOM 30 OG SER A 3 -0.316 -20.439 -7.842 1.00 0.00 O ATOM 0 H SER A 3 -2.139 -20.826 -5.024 1.00 0.00 H new ATOM 0 HA SER A 3 -0.502 -18.568 -6.060 1.00 0.00 H new ATOM 0 HB2 SER A 3 -2.372 -20.278 -7.691 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.549 -18.820 -8.210 1.00 0.00 H new ATOM 0 HG SER A 3 -0.359 -20.748 -8.771 1.00 0.00 H new ATOM 36 N THR A 4 -2.470 -17.086 -5.633 1.00 0.00 N ATOM 37 CA THR A 4 -3.482 -16.256 -5.013 1.00 0.00 C ATOM 38 C THR A 4 -3.411 -14.883 -5.664 1.00 0.00 C ATOM 39 O THR A 4 -2.432 -14.544 -6.343 1.00 0.00 O ATOM 40 CB THR A 4 -3.280 -16.319 -3.480 1.00 0.00 C ATOM 41 OG1 THR A 4 -4.344 -15.778 -2.709 1.00 0.00 O ATOM 42 CG2 THR A 4 -1.964 -15.678 -3.046 1.00 0.00 C ATOM 0 H THR A 4 -1.707 -16.573 -6.075 1.00 0.00 H new ATOM 0 HA THR A 4 -4.506 -16.594 -5.170 1.00 0.00 H new ATOM 0 HB THR A 4 -3.258 -17.389 -3.272 1.00 0.00 H new ATOM 0 HG1 THR A 4 -5.150 -15.715 -3.263 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.866 -15.746 -1.963 1.00 0.00 H new ATOM 0 HG22 THR A 4 -1.132 -16.199 -3.519 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.953 -14.630 -3.346 1.00 0.00 H new ATOM 50 N VAL A 5 -4.502 -14.145 -5.498 1.00 0.00 N ATOM 51 CA VAL A 5 -4.853 -13.014 -6.314 1.00 0.00 C ATOM 52 C VAL A 5 -5.545 -12.028 -5.382 1.00 0.00 C ATOM 53 O VAL A 5 -6.560 -12.372 -4.764 1.00 0.00 O ATOM 54 CB VAL A 5 -5.712 -13.518 -7.498 1.00 0.00 C ATOM 55 CG1 VAL A 5 -6.828 -14.522 -7.116 1.00 0.00 C ATOM 56 CG2 VAL A 5 -6.310 -12.315 -8.236 1.00 0.00 C ATOM 0 H VAL A 5 -5.183 -14.333 -4.763 1.00 0.00 H new ATOM 0 HA VAL A 5 -4.007 -12.501 -6.771 1.00 0.00 H new ATOM 0 HB VAL A 5 -5.037 -14.080 -8.143 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -7.375 -14.817 -8.012 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.382 -15.404 -6.656 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -7.514 -14.053 -6.411 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -6.916 -12.665 -9.071 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -6.934 -11.741 -7.551 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.506 -11.682 -8.612 1.00 0.00 H new ATOM 66 N THR A 6 -4.989 -10.822 -5.243 1.00 0.00 N ATOM 67 CA THR A 6 -5.497 -9.819 -4.323 1.00 0.00 C ATOM 68 C THR A 6 -5.544 -8.447 -5.000 1.00 0.00 C ATOM 69 O THR A 6 -4.838 -8.163 -5.968 1.00 0.00 O ATOM 70 CB THR A 6 -4.703 -9.844 -3.004 1.00 0.00 C ATOM 71 OG1 THR A 6 -3.319 -9.998 -3.226 1.00 0.00 O ATOM 72 CG2 THR A 6 -5.151 -10.997 -2.113 1.00 0.00 C ATOM 0 H THR A 6 -4.170 -10.519 -5.771 1.00 0.00 H new ATOM 0 HA THR A 6 -6.527 -10.053 -4.053 1.00 0.00 H new ATOM 0 HB THR A 6 -4.897 -8.887 -2.520 1.00 0.00 H new ATOM 0 HG1 THR A 6 -2.849 -10.008 -2.366 1.00 0.00 H new ATOM 0 HG21 THR A 6 -4.573 -10.989 -1.189 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.210 -10.886 -1.879 1.00 0.00 H new ATOM 0 HG23 THR A 6 -4.991 -11.942 -2.633 1.00 0.00 H new ATOM 80 N GLY A 7 -6.418 -7.582 -4.500 1.00 0.00 N ATOM 81 CA GLY A 7 -6.852 -6.384 -5.178 1.00 0.00 C ATOM 82 C GLY A 7 -8.151 -5.928 -4.537 1.00 0.00 C ATOM 83 O GLY A 7 -8.432 -6.279 -3.391 1.00 0.00 O ATOM 0 H GLY A 7 -6.852 -7.705 -3.585 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.094 -5.605 -5.099 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.999 -6.579 -6.240 1.00 0.00 H new ATOM 87 N GLY A 8 -8.928 -5.125 -5.248 1.00 0.00 N ATOM 88 CA GLY A 8 -10.013 -4.356 -4.667 1.00 0.00 C ATOM 89 C GLY A 8 -9.630 -2.901 -4.829 1.00 0.00 C ATOM 90 O GLY A 8 -9.273 -2.484 -5.935 1.00 0.00 O ATOM 0 H GLY A 8 -8.820 -4.989 -6.253 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -10.955 -4.569 -5.171 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -10.150 -4.608 -3.615 1.00 0.00 H new ATOM 94 N TYR A 9 -9.651 -2.147 -3.733 1.00 0.00 N ATOM 95 CA TYR A 9 -9.479 -0.706 -3.744 1.00 0.00 C ATOM 96 C TYR A 9 -8.505 -0.311 -2.634 1.00 0.00 C ATOM 97 O TYR A 9 -8.400 -0.999 -1.613 1.00 0.00 O ATOM 98 CB TYR A 9 -10.867 -0.059 -3.623 1.00 0.00 C ATOM 99 CG TYR A 9 -11.817 -0.462 -4.747 1.00 0.00 C ATOM 100 CD1 TYR A 9 -11.558 -0.046 -6.065 1.00 0.00 C ATOM 101 CD2 TYR A 9 -12.924 -1.298 -4.503 1.00 0.00 C ATOM 102 CE1 TYR A 9 -12.393 -0.420 -7.133 1.00 0.00 C ATOM 103 CE2 TYR A 9 -13.760 -1.690 -5.567 1.00 0.00 C ATOM 104 CZ TYR A 9 -13.512 -1.244 -6.888 1.00 0.00 C ATOM 105 OH TYR A 9 -14.351 -1.607 -7.903 1.00 0.00 O ATOM 0 H TYR A 9 -9.791 -2.532 -2.799 1.00 0.00 H new ATOM 0 HA TYR A 9 -9.038 -0.347 -4.674 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -11.308 -0.337 -2.666 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -10.757 1.025 -3.620 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -10.697 0.576 -6.262 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -13.132 -1.639 -3.500 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -12.179 -0.079 -8.135 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -14.601 -2.339 -5.373 1.00 0.00 H new ATOM 0 HH TYR A 9 -15.066 -2.177 -7.549 1.00 0.00 H new ATOM 115 N ALA A 10 -7.751 0.770 -2.852 1.00 0.00 N ATOM 116 CA ALA A 10 -6.783 1.304 -1.904 1.00 0.00 C ATOM 117 C ALA A 10 -7.257 2.708 -1.590 1.00 0.00 C ATOM 118 O ALA A 10 -7.301 3.539 -2.498 1.00 0.00 O ATOM 119 CB ALA A 10 -5.367 1.311 -2.503 1.00 0.00 C ATOM 0 H ALA A 10 -7.802 1.308 -3.717 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.722 0.693 -1.003 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -4.665 1.715 -1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -5.076 0.293 -2.761 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -5.354 1.930 -3.400 1.00 0.00 H new ATOM 125 N GLN A 11 -7.669 2.950 -0.348 1.00 0.00 N ATOM 126 CA GLN A 11 -8.486 4.093 0.023 1.00 0.00 C ATOM 127 C GLN A 11 -7.752 4.832 1.134 1.00 0.00 C ATOM 128 O GLN A 11 -7.355 4.240 2.137 1.00 0.00 O ATOM 129 CB GLN A 11 -9.889 3.599 0.416 1.00 0.00 C ATOM 130 CG GLN A 11 -10.668 3.109 -0.822 1.00 0.00 C ATOM 131 CD GLN A 11 -11.843 2.214 -0.447 1.00 0.00 C ATOM 132 OE1 GLN A 11 -11.733 0.993 -0.463 1.00 0.00 O ATOM 133 NE2 GLN A 11 -12.988 2.783 -0.119 1.00 0.00 N ATOM 0 H GLN A 11 -7.438 2.344 0.440 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.635 4.794 -0.799 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -9.804 2.789 1.141 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -10.440 4.405 0.901 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -11.033 3.969 -1.383 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -9.993 2.562 -1.481 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -13.068 3.800 -0.109 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -13.793 2.206 0.125 1.00 0.00 H new ATOM 142 N SER A 12 -7.493 6.114 0.898 1.00 0.00 N ATOM 143 CA SER A 12 -6.527 6.913 1.625 1.00 0.00 C ATOM 144 C SER A 12 -7.141 8.292 1.853 1.00 0.00 C ATOM 145 O SER A 12 -7.899 8.769 1.006 1.00 0.00 O ATOM 146 CB SER A 12 -5.257 6.872 0.769 1.00 0.00 C ATOM 147 OG SER A 12 -4.173 7.645 1.233 1.00 0.00 O ATOM 0 H SER A 12 -7.971 6.640 0.166 1.00 0.00 H new ATOM 0 HA SER A 12 -6.265 6.557 2.621 1.00 0.00 H new ATOM 0 HB2 SER A 12 -4.930 5.835 0.689 1.00 0.00 H new ATOM 0 HB3 SER A 12 -5.510 7.205 -0.238 1.00 0.00 H new ATOM 0 HG SER A 12 -3.416 7.548 0.619 1.00 0.00 H new ATOM 153 N ASP A 13 -6.933 8.886 3.029 1.00 0.00 N ATOM 154 CA ASP A 13 -7.475 10.196 3.402 1.00 0.00 C ATOM 155 C ASP A 13 -6.432 11.018 4.158 1.00 0.00 C ATOM 156 O ASP A 13 -5.496 10.455 4.730 1.00 0.00 O ATOM 157 CB ASP A 13 -8.757 10.012 4.223 1.00 0.00 C ATOM 158 CG ASP A 13 -9.394 11.340 4.633 1.00 0.00 C ATOM 159 OD1 ASP A 13 -9.516 12.256 3.786 1.00 0.00 O ATOM 160 OD2 ASP A 13 -9.897 11.427 5.775 1.00 0.00 O ATOM 0 H ASP A 13 -6.370 8.461 3.766 1.00 0.00 H new ATOM 0 HA ASP A 13 -7.727 10.750 2.498 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.475 9.434 3.642 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -8.530 9.432 5.117 1.00 0.00 H new ATOM 165 N ALA A 14 -6.596 12.343 4.163 1.00 0.00 N ATOM 166 CA ALA A 14 -5.710 13.279 4.840 1.00 0.00 C ATOM 167 C ALA A 14 -6.211 13.619 6.240 1.00 0.00 C ATOM 168 O ALA A 14 -7.380 13.419 6.586 1.00 0.00 O ATOM 169 CB ALA A 14 -5.577 14.549 3.990 1.00 0.00 C ATOM 0 H ALA A 14 -7.370 12.801 3.682 1.00 0.00 H new ATOM 0 HA ALA A 14 -4.733 12.810 4.956 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -4.915 15.255 4.491 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -5.163 14.292 3.015 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -6.559 15.004 3.859 1.00 0.00 H new ATOM 175 N GLN A 15 -5.330 14.210 7.044 1.00 0.00 N ATOM 176 CA GLN A 15 -5.664 14.829 8.320 1.00 0.00 C ATOM 177 C GLN A 15 -6.401 16.163 8.091 1.00 0.00 C ATOM 178 O GLN A 15 -5.932 17.228 8.485 1.00 0.00 O ATOM 179 CB GLN A 15 -4.369 14.926 9.137 1.00 0.00 C ATOM 180 CG GLN A 15 -4.574 15.226 10.627 1.00 0.00 C ATOM 181 CD GLN A 15 -3.517 14.513 11.470 1.00 0.00 C ATOM 182 OE1 GLN A 15 -3.514 13.289 11.549 1.00 0.00 O ATOM 183 NE2 GLN A 15 -2.609 15.231 12.110 1.00 0.00 N ATOM 0 H GLN A 15 -4.337 14.272 6.818 1.00 0.00 H new ATOM 0 HA GLN A 15 -6.368 14.233 8.901 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -3.823 13.987 9.041 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.741 15.706 8.706 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -4.519 16.301 10.798 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -5.569 14.905 10.934 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -2.620 16.248 12.038 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -1.898 14.767 12.675 1.00 0.00 H new ATOM 192 N GLY A 16 -7.563 16.103 7.437 1.00 0.00 N ATOM 193 CA GLY A 16 -8.458 17.217 7.173 1.00 0.00 C ATOM 194 C GLY A 16 -9.203 16.924 5.876 1.00 0.00 C ATOM 195 O GLY A 16 -8.589 17.007 4.808 1.00 0.00 O ATOM 0 H GLY A 16 -7.918 15.225 7.059 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -9.161 17.345 7.996 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.895 18.146 7.088 1.00 0.00 H new ATOM 199 N GLN A 17 -10.476 16.529 5.983 1.00 0.00 N ATOM 200 CA GLN A 17 -11.370 16.132 4.906 1.00 0.00 C ATOM 201 C GLN A 17 -11.446 17.209 3.818 1.00 0.00 C ATOM 202 O GLN A 17 -12.207 18.176 3.878 1.00 0.00 O ATOM 203 CB GLN A 17 -12.759 15.717 5.433 1.00 0.00 C ATOM 204 CG GLN A 17 -13.454 16.693 6.408 1.00 0.00 C ATOM 205 CD GLN A 17 -14.917 16.332 6.675 1.00 0.00 C ATOM 206 OE1 GLN A 17 -15.461 15.376 6.124 1.00 0.00 O ATOM 207 NE2 GLN A 17 -15.622 17.115 7.475 1.00 0.00 N ATOM 0 H GLN A 17 -10.935 16.477 6.892 1.00 0.00 H new ATOM 0 HA GLN A 17 -10.948 15.243 4.438 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.416 15.567 4.577 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -12.659 14.753 5.931 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -12.910 16.703 7.352 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -13.403 17.703 6.000 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -15.176 17.909 7.934 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -16.612 16.925 7.632 1.00 0.00 H new ATOM 216 N MET A 18 -10.634 16.990 2.795 1.00 0.00 N ATOM 217 CA MET A 18 -10.572 17.745 1.549 1.00 0.00 C ATOM 218 C MET A 18 -10.135 16.788 0.444 1.00 0.00 C ATOM 219 O MET A 18 -10.809 16.654 -0.585 1.00 0.00 O ATOM 220 CB MET A 18 -9.543 18.889 1.623 1.00 0.00 C ATOM 221 CG MET A 18 -9.903 20.039 2.565 1.00 0.00 C ATOM 222 SD MET A 18 -8.669 21.368 2.554 1.00 0.00 S ATOM 223 CE MET A 18 -8.948 22.118 0.929 1.00 0.00 C ATOM 0 H MET A 18 -9.955 16.229 2.813 1.00 0.00 H new ATOM 0 HA MET A 18 -11.554 18.178 1.357 1.00 0.00 H new ATOM 0 HB2 MET A 18 -8.585 18.473 1.935 1.00 0.00 H new ATOM 0 HB3 MET A 18 -9.403 19.294 0.621 1.00 0.00 H new ATOM 0 HG2 MET A 18 -10.872 20.447 2.279 1.00 0.00 H new ATOM 0 HG3 MET A 18 -10.006 19.653 3.579 1.00 0.00 H new ATOM 0 HE1 MET A 18 -8.035 22.053 0.337 1.00 0.00 H new ATOM 0 HE2 MET A 18 -9.751 21.588 0.417 1.00 0.00 H new ATOM 0 HE3 MET A 18 -9.226 23.165 1.054 1.00 0.00 H new ATOM 233 N ASN A 19 -8.977 16.154 0.654 1.00 0.00 N ATOM 234 CA ASN A 19 -8.276 15.351 -0.327 1.00 0.00 C ATOM 235 C ASN A 19 -8.179 13.922 0.174 1.00 0.00 C ATOM 236 O ASN A 19 -7.485 13.625 1.146 1.00 0.00 O ATOM 237 CB ASN A 19 -6.910 15.949 -0.695 1.00 0.00 C ATOM 238 CG ASN A 19 -5.813 15.859 0.367 1.00 0.00 C ATOM 239 OD1 ASN A 19 -4.870 15.077 0.237 1.00 0.00 O ATOM 240 ND2 ASN A 19 -5.857 16.689 1.394 1.00 0.00 N ATOM 0 H ASN A 19 -8.492 16.194 1.550 1.00 0.00 H new ATOM 0 HA ASN A 19 -8.845 15.349 -1.257 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -6.552 15.452 -1.597 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -7.055 17.000 -0.947 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.107 16.685 2.085 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -6.641 17.334 1.495 1.00 0.00 H new ATOM 247 N LYS A 20 -8.896 13.042 -0.517 1.00 0.00 N ATOM 248 CA LYS A 20 -8.851 11.609 -0.325 1.00 0.00 C ATOM 249 C LYS A 20 -8.419 11.010 -1.654 1.00 0.00 C ATOM 250 O LYS A 20 -8.684 11.585 -2.715 1.00 0.00 O ATOM 251 CB LYS A 20 -10.180 11.056 0.229 1.00 0.00 C ATOM 252 CG LYS A 20 -11.442 11.274 -0.628 1.00 0.00 C ATOM 253 CD LYS A 20 -12.131 12.618 -0.357 1.00 0.00 C ATOM 254 CE LYS A 20 -13.371 12.753 -1.240 1.00 0.00 C ATOM 255 NZ LYS A 20 -14.050 14.046 -1.032 1.00 0.00 N ATOM 0 H LYS A 20 -9.546 13.324 -1.251 1.00 0.00 H new ATOM 0 HA LYS A 20 -8.130 11.327 0.442 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -10.060 9.984 0.389 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.353 11.506 1.206 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.172 11.218 -1.682 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.148 10.466 -0.436 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.413 12.687 0.694 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -11.441 13.438 -0.557 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.084 12.657 -2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.063 11.939 -1.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.886 14.102 -1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.346 14.127 -0.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.397 14.822 -1.263 1.00 0.00 H new ATOM 269 N MET A 21 -7.744 9.875 -1.590 1.00 0.00 N ATOM 270 CA MET A 21 -7.178 9.155 -2.711 1.00 0.00 C ATOM 271 C MET A 21 -7.911 7.817 -2.799 1.00 0.00 C ATOM 272 O MET A 21 -8.296 7.231 -1.781 1.00 0.00 O ATOM 273 CB MET A 21 -5.664 8.995 -2.490 1.00 0.00 C ATOM 274 CG MET A 21 -4.843 10.233 -2.851 1.00 0.00 C ATOM 275 SD MET A 21 -3.058 9.942 -2.660 1.00 0.00 S ATOM 276 CE MET A 21 -2.428 11.637 -2.772 1.00 0.00 C ATOM 0 H MET A 21 -7.568 9.407 -0.701 1.00 0.00 H new ATOM 0 HA MET A 21 -7.303 9.684 -3.656 1.00 0.00 H new ATOM 0 HB2 MET A 21 -5.485 8.747 -1.444 1.00 0.00 H new ATOM 0 HB3 MET A 21 -5.309 8.152 -3.083 1.00 0.00 H new ATOM 0 HG2 MET A 21 -5.056 10.522 -3.880 1.00 0.00 H new ATOM 0 HG3 MET A 21 -5.145 11.067 -2.217 1.00 0.00 H new ATOM 0 HE1 MET A 21 -1.343 11.629 -2.673 1.00 0.00 H new ATOM 0 HE2 MET A 21 -2.701 12.064 -3.737 1.00 0.00 H new ATOM 0 HE3 MET A 21 -2.861 12.240 -1.974 1.00 0.00 H new ATOM 286 N GLY A 22 -8.143 7.355 -4.021 1.00 0.00 N ATOM 287 CA GLY A 22 -8.817 6.118 -4.364 1.00 0.00 C ATOM 288 C GLY A 22 -8.597 5.856 -5.853 1.00 0.00 C ATOM 289 O GLY A 22 -8.136 6.745 -6.578 1.00 0.00 O ATOM 0 H GLY A 22 -7.845 7.870 -4.849 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -8.424 5.293 -3.770 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -9.882 6.191 -4.143 1.00 0.00 H new ATOM 293 N GLY A 23 -8.929 4.649 -6.305 1.00 0.00 N ATOM 294 CA GLY A 23 -8.790 4.226 -7.691 1.00 0.00 C ATOM 295 C GLY A 23 -8.957 2.717 -7.738 1.00 0.00 C ATOM 296 O GLY A 23 -10.079 2.247 -7.886 1.00 0.00 O ATOM 0 H GLY A 23 -9.311 3.922 -5.700 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.540 4.712 -8.315 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -7.814 4.514 -8.082 1.00 0.00 H new ATOM 300 N PHE A 24 -7.880 1.966 -7.499 1.00 0.00 N ATOM 301 CA PHE A 24 -7.845 0.508 -7.355 1.00 0.00 C ATOM 302 C PHE A 24 -6.763 0.143 -6.335 1.00 0.00 C ATOM 303 O PHE A 24 -5.999 1.005 -5.905 1.00 0.00 O ATOM 304 CB PHE A 24 -7.571 -0.166 -8.713 1.00 0.00 C ATOM 305 CG PHE A 24 -8.821 -0.569 -9.478 1.00 0.00 C ATOM 306 CD1 PHE A 24 -9.419 -1.824 -9.246 1.00 0.00 C ATOM 307 CD2 PHE A 24 -9.382 0.299 -10.432 1.00 0.00 C ATOM 308 CE1 PHE A 24 -10.575 -2.198 -9.954 1.00 0.00 C ATOM 309 CE2 PHE A 24 -10.537 -0.074 -11.140 1.00 0.00 C ATOM 310 CZ PHE A 24 -11.140 -1.318 -10.892 1.00 0.00 C ATOM 0 H PHE A 24 -6.955 2.383 -7.395 1.00 0.00 H new ATOM 0 HA PHE A 24 -8.812 0.150 -7.003 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -6.985 0.515 -9.331 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -6.959 -1.053 -8.548 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -8.988 -2.500 -8.522 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.922 1.258 -10.621 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.029 -3.162 -9.777 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.961 0.595 -11.874 1.00 0.00 H new ATOM 0 HZ PHE A 24 -12.038 -1.598 -11.422 1.00 0.00 H new ATOM 320 N ASN A 25 -6.696 -1.133 -5.953 1.00 0.00 N ATOM 321 CA ASN A 25 -5.543 -1.777 -5.326 1.00 0.00 C ATOM 322 C ASN A 25 -5.209 -2.998 -6.177 1.00 0.00 C ATOM 323 O ASN A 25 -6.124 -3.595 -6.755 1.00 0.00 O ATOM 324 CB ASN A 25 -5.895 -2.244 -3.902 1.00 0.00 C ATOM 325 CG ASN A 25 -4.761 -3.015 -3.234 1.00 0.00 C ATOM 326 OD1 ASN A 25 -3.586 -2.773 -3.475 1.00 0.00 O ATOM 327 ND2 ASN A 25 -5.074 -3.977 -2.386 1.00 0.00 N ATOM 0 H ASN A 25 -7.480 -1.774 -6.078 1.00 0.00 H new ATOM 0 HA ASN A 25 -4.706 -1.082 -5.261 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -6.147 -1.376 -3.292 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -6.783 -2.875 -3.941 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -4.337 -4.517 -1.933 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -6.053 -4.180 -2.184 1.00 0.00 H new ATOM 334 N LEU A 26 -3.953 -3.441 -6.194 1.00 0.00 N ATOM 335 CA LEU A 26 -3.598 -4.783 -6.626 1.00 0.00 C ATOM 336 C LEU A 26 -2.418 -5.278 -5.811 1.00 0.00 C ATOM 337 O LEU A 26 -1.474 -4.522 -5.557 1.00 0.00 O ATOM 338 CB LEU A 26 -3.257 -4.815 -8.122 1.00 0.00 C ATOM 339 CG LEU A 26 -3.589 -6.167 -8.771 1.00 0.00 C ATOM 340 CD1 LEU A 26 -5.107 -6.285 -8.892 1.00 0.00 C ATOM 341 CD2 LEU A 26 -2.970 -6.274 -10.163 1.00 0.00 C ATOM 0 H LEU A 26 -3.154 -2.875 -5.907 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.456 -5.437 -6.467 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -3.807 -4.025 -8.634 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -2.196 -4.603 -8.254 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.183 -6.966 -8.151 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -5.362 -7.240 -9.351 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -5.557 -6.227 -7.901 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.487 -5.472 -9.510 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.221 -7.241 -10.599 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -3.360 -5.478 -10.797 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.887 -6.180 -10.088 1.00 0.00 H new ATOM 353 N LYS A 27 -2.460 -6.555 -5.445 1.00 0.00 N ATOM 354 CA LYS A 27 -1.426 -7.244 -4.697 1.00 0.00 C ATOM 355 C LYS A 27 -1.266 -8.636 -5.308 1.00 0.00 C ATOM 356 O LYS A 27 -2.118 -9.125 -6.059 1.00 0.00 O ATOM 357 CB LYS A 27 -1.817 -7.290 -3.208 1.00 0.00 C ATOM 358 CG LYS A 27 -1.655 -5.940 -2.499 1.00 0.00 C ATOM 359 CD LYS A 27 -2.121 -5.965 -1.036 1.00 0.00 C ATOM 360 CE LYS A 27 -1.315 -6.938 -0.164 1.00 0.00 C ATOM 361 NZ LYS A 27 -1.494 -6.681 1.284 1.00 0.00 N ATOM 0 H LYS A 27 -3.250 -7.159 -5.673 1.00 0.00 H new ATOM 0 HA LYS A 27 -0.468 -6.727 -4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.853 -7.617 -3.121 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.204 -8.035 -2.701 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.607 -5.642 -2.535 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -2.221 -5.182 -3.041 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.042 -4.961 -0.618 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -3.175 -6.242 -1.001 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.619 -7.960 -0.389 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.258 -6.857 -0.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.619 -6.279 1.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -2.276 -6.010 1.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -1.713 -7.574 1.771 1.00 0.00 H new ATOM 375 N TYR A 28 -0.150 -9.272 -4.989 1.00 0.00 N ATOM 376 CA TYR A 28 0.255 -10.575 -5.482 1.00 0.00 C ATOM 377 C TYR A 28 0.947 -11.264 -4.316 1.00 0.00 C ATOM 378 O TYR A 28 1.679 -10.616 -3.563 1.00 0.00 O ATOM 379 CB TYR A 28 1.190 -10.434 -6.689 1.00 0.00 C ATOM 380 CG TYR A 28 2.447 -9.634 -6.412 1.00 0.00 C ATOM 381 CD1 TYR A 28 2.412 -8.228 -6.458 1.00 0.00 C ATOM 382 CD2 TYR A 28 3.645 -10.296 -6.085 1.00 0.00 C ATOM 383 CE1 TYR A 28 3.569 -7.487 -6.176 1.00 0.00 C ATOM 384 CE2 TYR A 28 4.811 -9.561 -5.821 1.00 0.00 C ATOM 385 CZ TYR A 28 4.777 -8.149 -5.871 1.00 0.00 C ATOM 386 OH TYR A 28 5.891 -7.422 -5.597 1.00 0.00 O ATOM 0 H TYR A 28 0.532 -8.871 -4.345 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.598 -11.158 -5.829 1.00 0.00 H new ATOM 0 HB2 TYR A 28 1.474 -11.429 -7.032 1.00 0.00 H new ATOM 0 HB3 TYR A 28 0.643 -9.960 -7.504 1.00 0.00 H new ATOM 0 HD1 TYR A 28 1.494 -7.719 -6.711 1.00 0.00 H new ATOM 0 HD2 TYR A 28 3.667 -11.375 -6.037 1.00 0.00 H new ATOM 0 HE1 TYR A 28 3.535 -6.408 -6.192 1.00 0.00 H new ATOM 0 HE2 TYR A 28 5.731 -10.073 -5.580 1.00 0.00 H new ATOM 0 HH TYR A 28 6.638 -8.027 -5.406 1.00 0.00 H new ATOM 396 N ARG A 29 0.723 -12.558 -4.128 1.00 0.00 N ATOM 397 CA ARG A 29 1.529 -13.362 -3.213 1.00 0.00 C ATOM 398 C ARG A 29 1.907 -14.629 -3.946 1.00 0.00 C ATOM 399 O ARG A 29 1.097 -15.156 -4.706 1.00 0.00 O ATOM 400 CB ARG A 29 0.760 -13.621 -1.906 1.00 0.00 C ATOM 401 CG ARG A 29 1.271 -14.809 -1.074 1.00 0.00 C ATOM 402 CD ARG A 29 0.382 -15.060 0.143 1.00 0.00 C ATOM 403 NE ARG A 29 0.895 -16.205 0.903 1.00 0.00 N ATOM 404 CZ ARG A 29 0.251 -17.334 1.224 1.00 0.00 C ATOM 405 NH1 ARG A 29 -1.049 -17.526 0.985 1.00 0.00 N ATOM 406 NH2 ARG A 29 0.941 -18.300 1.805 1.00 0.00 N ATOM 0 H ARG A 29 -0.016 -13.078 -4.600 1.00 0.00 H new ATOM 0 HA ARG A 29 2.440 -12.844 -2.915 1.00 0.00 H new ATOM 0 HB2 ARG A 29 0.804 -12.721 -1.292 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -0.289 -13.791 -2.147 1.00 0.00 H new ATOM 0 HG2 ARG A 29 1.301 -15.704 -1.695 1.00 0.00 H new ATOM 0 HG3 ARG A 29 2.292 -14.614 -0.747 1.00 0.00 H new ATOM 0 HD2 ARG A 29 0.357 -14.173 0.776 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.642 -15.253 -0.176 1.00 0.00 H new ATOM 0 HE ARG A 29 1.860 -16.132 1.226 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.599 -16.793 0.538 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -1.492 -18.406 1.250 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.935 -18.173 1.996 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.480 -19.173 2.062 1.00 0.00 H new ATOM 420 N TYR A 30 3.119 -15.102 -3.680 1.00 0.00 N ATOM 421 CA TYR A 30 3.564 -16.455 -3.946 1.00 0.00 C ATOM 422 C TYR A 30 3.886 -17.032 -2.569 1.00 0.00 C ATOM 423 O TYR A 30 4.335 -16.282 -1.696 1.00 0.00 O ATOM 424 CB TYR A 30 4.826 -16.456 -4.836 1.00 0.00 C ATOM 425 CG TYR A 30 4.690 -16.129 -6.323 1.00 0.00 C ATOM 426 CD1 TYR A 30 3.900 -15.056 -6.789 1.00 0.00 C ATOM 427 CD2 TYR A 30 5.436 -16.876 -7.260 1.00 0.00 C ATOM 428 CE1 TYR A 30 3.828 -14.749 -8.156 1.00 0.00 C ATOM 429 CE2 TYR A 30 5.381 -16.570 -8.632 1.00 0.00 C ATOM 430 CZ TYR A 30 4.565 -15.508 -9.087 1.00 0.00 C ATOM 431 OH TYR A 30 4.497 -15.195 -10.409 1.00 0.00 O ATOM 0 H TYR A 30 3.845 -14.525 -3.255 1.00 0.00 H new ATOM 0 HA TYR A 30 2.810 -17.036 -4.478 1.00 0.00 H new ATOM 0 HB2 TYR A 30 5.531 -15.744 -4.407 1.00 0.00 H new ATOM 0 HB3 TYR A 30 5.282 -17.443 -4.757 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.342 -14.461 -6.081 1.00 0.00 H new ATOM 0 HD2 TYR A 30 6.056 -17.692 -6.920 1.00 0.00 H new ATOM 0 HE1 TYR A 30 3.208 -13.932 -8.495 1.00 0.00 H new ATOM 0 HE2 TYR A 30 5.962 -17.146 -9.338 1.00 0.00 H new ATOM 0 HH TYR A 30 5.063 -15.811 -10.920 1.00 0.00 H new ATOM 441 N GLU A 31 3.681 -18.331 -2.359 1.00 0.00 N ATOM 442 CA GLU A 31 4.389 -19.072 -1.325 1.00 0.00 C ATOM 443 C GLU A 31 4.726 -20.449 -1.895 1.00 0.00 C ATOM 444 O GLU A 31 3.920 -21.066 -2.604 1.00 0.00 O ATOM 445 CB GLU A 31 3.614 -19.120 0.000 1.00 0.00 C ATOM 446 CG GLU A 31 4.462 -19.802 1.092 1.00 0.00 C ATOM 447 CD GLU A 31 3.961 -19.589 2.526 1.00 0.00 C ATOM 448 OE1 GLU A 31 3.452 -18.496 2.884 1.00 0.00 O ATOM 449 OE2 GLU A 31 4.091 -20.538 3.330 1.00 0.00 O ATOM 0 H GLU A 31 3.023 -18.894 -2.899 1.00 0.00 H new ATOM 0 HA GLU A 31 5.315 -18.563 -1.060 1.00 0.00 H new ATOM 0 HB2 GLU A 31 3.351 -18.109 0.312 1.00 0.00 H new ATOM 0 HB3 GLU A 31 2.680 -19.664 -0.137 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.496 -20.873 0.890 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.485 -19.432 1.021 1.00 0.00 H new ATOM 456 N GLU A 32 5.954 -20.872 -1.627 1.00 0.00 N ATOM 457 CA GLU A 32 6.654 -21.986 -2.241 1.00 0.00 C ATOM 458 C GLU A 32 6.337 -23.303 -1.525 1.00 0.00 C ATOM 459 O GLU A 32 5.571 -23.344 -0.556 1.00 0.00 O ATOM 460 CB GLU A 32 8.160 -21.653 -2.209 1.00 0.00 C ATOM 461 CG GLU A 32 8.830 -21.827 -3.578 1.00 0.00 C ATOM 462 CD GLU A 32 10.040 -20.898 -3.736 1.00 0.00 C ATOM 463 OE1 GLU A 32 9.878 -19.672 -3.538 1.00 0.00 O ATOM 464 OE2 GLU A 32 11.141 -21.390 -4.066 1.00 0.00 O ATOM 0 H GLU A 32 6.527 -20.409 -0.922 1.00 0.00 H new ATOM 0 HA GLU A 32 6.329 -22.126 -3.272 1.00 0.00 H new ATOM 0 HB2 GLU A 32 8.294 -20.626 -1.870 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.655 -22.296 -1.481 1.00 0.00 H new ATOM 0 HG2 GLU A 32 9.147 -22.863 -3.700 1.00 0.00 H new ATOM 0 HG3 GLU A 32 8.107 -21.621 -4.367 1.00 0.00 H new ATOM 471 N ASP A 33 6.909 -24.410 -2.009 1.00 0.00 N ATOM 472 CA ASP A 33 6.937 -25.656 -1.234 1.00 0.00 C ATOM 473 C ASP A 33 8.300 -25.897 -0.582 1.00 0.00 C ATOM 474 O ASP A 33 8.363 -26.578 0.437 1.00 0.00 O ATOM 475 CB ASP A 33 6.490 -26.861 -2.077 1.00 0.00 C ATOM 476 CG ASP A 33 5.419 -27.667 -1.345 1.00 0.00 C ATOM 477 OD1 ASP A 33 5.622 -28.124 -0.205 1.00 0.00 O ATOM 478 OD2 ASP A 33 4.271 -27.708 -1.843 1.00 0.00 O ATOM 0 H ASP A 33 7.355 -24.470 -2.924 1.00 0.00 H new ATOM 0 HA ASP A 33 6.215 -25.541 -0.426 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.101 -26.516 -3.035 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.348 -27.498 -2.292 1.00 0.00 H new ATOM 483 N ASN A 34 9.375 -25.299 -1.109 1.00 0.00 N ATOM 484 CA ASN A 34 10.751 -25.445 -0.614 1.00 0.00 C ATOM 485 C ASN A 34 11.246 -24.221 0.164 1.00 0.00 C ATOM 486 O ASN A 34 12.440 -24.147 0.453 1.00 0.00 O ATOM 487 CB ASN A 34 11.715 -25.788 -1.771 1.00 0.00 C ATOM 488 CG ASN A 34 11.856 -24.716 -2.852 1.00 0.00 C ATOM 489 OD1 ASN A 34 11.699 -25.005 -4.032 1.00 0.00 O ATOM 490 ND2 ASN A 34 12.126 -23.467 -2.517 1.00 0.00 N ATOM 0 H ASN A 34 9.310 -24.680 -1.917 1.00 0.00 H new ATOM 0 HA ASN A 34 10.738 -26.273 0.094 1.00 0.00 H new ATOM 0 HB2 ASN A 34 12.701 -25.988 -1.352 1.00 0.00 H new ATOM 0 HB3 ASN A 34 11.376 -26.711 -2.242 1.00 0.00 H new ATOM 0 HD21 ASN A 34 12.202 -22.750 -3.239 1.00 0.00 H new ATOM 0 HD22 ASN A 34 12.258 -23.219 -1.536 1.00 0.00 H new ATOM 497 N SER A 35 10.389 -23.228 0.406 1.00 0.00 N ATOM 498 CA SER A 35 10.696 -21.982 1.100 1.00 0.00 C ATOM 499 C SER A 35 9.384 -21.487 1.725 1.00 0.00 C ATOM 500 O SER A 35 8.505 -21.039 0.984 1.00 0.00 O ATOM 501 CB SER A 35 11.266 -20.942 0.121 1.00 0.00 C ATOM 502 OG SER A 35 12.522 -21.356 -0.393 1.00 0.00 O ATOM 0 H SER A 35 9.415 -23.276 0.108 1.00 0.00 H new ATOM 0 HA SER A 35 11.453 -22.140 1.869 1.00 0.00 H new ATOM 0 HB2 SER A 35 10.566 -20.790 -0.701 1.00 0.00 H new ATOM 0 HB3 SER A 35 11.376 -19.983 0.628 1.00 0.00 H new ATOM 0 HG SER A 35 12.861 -20.678 -1.014 1.00 0.00 H new ATOM 508 N PRO A 36 9.174 -21.627 3.045 1.00 0.00 N ATOM 509 CA PRO A 36 7.966 -21.153 3.712 1.00 0.00 C ATOM 510 C PRO A 36 8.034 -19.629 3.870 1.00 0.00 C ATOM 511 O PRO A 36 8.391 -19.129 4.942 1.00 0.00 O ATOM 512 CB PRO A 36 7.937 -21.911 5.045 1.00 0.00 C ATOM 513 CG PRO A 36 9.413 -22.134 5.372 1.00 0.00 C ATOM 514 CD PRO A 36 10.051 -22.307 3.993 1.00 0.00 C ATOM 0 HA PRO A 36 7.047 -21.341 3.157 1.00 0.00 H new ATOM 0 HB2 PRO A 36 7.438 -21.333 5.823 1.00 0.00 H new ATOM 0 HB3 PRO A 36 7.400 -22.855 4.956 1.00 0.00 H new ATOM 0 HG2 PRO A 36 9.839 -21.287 5.910 1.00 0.00 H new ATOM 0 HG3 PRO A 36 9.559 -23.015 5.997 1.00 0.00 H new ATOM 0 HD2 PRO A 36 11.053 -21.878 3.972 1.00 0.00 H new ATOM 0 HD3 PRO A 36 10.151 -23.363 3.741 1.00 0.00 H new ATOM 522 N LEU A 37 7.760 -18.878 2.801 1.00 0.00 N ATOM 523 CA LEU A 37 7.921 -17.429 2.757 1.00 0.00 C ATOM 524 C LEU A 37 6.899 -16.826 1.800 1.00 0.00 C ATOM 525 O LEU A 37 6.794 -17.285 0.659 1.00 0.00 O ATOM 526 CB LEU A 37 9.343 -17.108 2.267 1.00 0.00 C ATOM 527 CG LEU A 37 9.678 -15.607 2.291 1.00 0.00 C ATOM 528 CD1 LEU A 37 9.732 -15.069 3.728 1.00 0.00 C ATOM 529 CD2 LEU A 37 11.032 -15.386 1.622 1.00 0.00 C ATOM 0 H LEU A 37 7.413 -19.271 1.926 1.00 0.00 H new ATOM 0 HA LEU A 37 7.765 -17.007 3.750 1.00 0.00 H new ATOM 0 HB2 LEU A 37 10.062 -17.642 2.888 1.00 0.00 H new ATOM 0 HB3 LEU A 37 9.461 -17.482 1.250 1.00 0.00 H new ATOM 0 HG LEU A 37 8.894 -15.072 1.755 1.00 0.00 H new ATOM 0 HD11 LEU A 37 9.971 -14.006 3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 37 8.764 -15.215 4.208 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.499 -15.604 4.288 1.00 0.00 H new ATOM 0 HD21 LEU A 37 11.276 -14.324 1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 37 11.799 -15.941 2.162 1.00 0.00 H new ATOM 0 HD23 LEU A 37 10.989 -15.735 0.590 1.00 0.00 H new ATOM 541 N GLY A 38 6.200 -15.782 2.239 1.00 0.00 N ATOM 542 CA GLY A 38 5.376 -14.938 1.389 1.00 0.00 C ATOM 543 C GLY A 38 5.999 -13.549 1.268 1.00 0.00 C ATOM 544 O GLY A 38 7.007 -13.251 1.912 1.00 0.00 O ATOM 0 H GLY A 38 6.193 -15.496 3.218 1.00 0.00 H new ATOM 0 HA2 GLY A 38 5.278 -15.389 0.401 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.372 -14.860 1.805 1.00 0.00 H new ATOM 548 N VAL A 39 5.384 -12.687 0.462 1.00 0.00 N ATOM 549 CA VAL A 39 5.786 -11.304 0.219 1.00 0.00 C ATOM 550 C VAL A 39 4.543 -10.418 0.220 1.00 0.00 C ATOM 551 O VAL A 39 3.423 -10.932 0.090 1.00 0.00 O ATOM 552 CB VAL A 39 6.583 -11.178 -1.100 1.00 0.00 C ATOM 553 CG1 VAL A 39 8.015 -11.687 -0.908 1.00 0.00 C ATOM 554 CG2 VAL A 39 5.944 -11.937 -2.278 1.00 0.00 C ATOM 0 H VAL A 39 4.551 -12.947 -0.065 1.00 0.00 H new ATOM 0 HA VAL A 39 6.453 -10.973 1.015 1.00 0.00 H new ATOM 0 HB VAL A 39 6.578 -10.117 -1.350 1.00 0.00 H new ATOM 0 HG11 VAL A 39 8.564 -11.592 -1.845 1.00 0.00 H new ATOM 0 HG12 VAL A 39 8.510 -11.098 -0.136 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.992 -12.734 -0.606 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.556 -11.805 -3.171 1.00 0.00 H new ATOM 0 HG22 VAL A 39 5.880 -12.998 -2.036 1.00 0.00 H new ATOM 0 HG23 VAL A 39 4.943 -11.546 -2.463 1.00 0.00 H new ATOM 564 N ILE A 40 4.733 -9.113 0.414 1.00 0.00 N ATOM 565 CA ILE A 40 3.691 -8.099 0.399 1.00 0.00 C ATOM 566 C ILE A 40 4.252 -6.863 -0.317 1.00 0.00 C ATOM 567 O ILE A 40 5.079 -6.139 0.245 1.00 0.00 O ATOM 568 CB ILE A 40 3.264 -7.763 1.848 1.00 0.00 C ATOM 569 CG1 ILE A 40 2.660 -8.933 2.653 1.00 0.00 C ATOM 570 CG2 ILE A 40 2.306 -6.558 1.895 1.00 0.00 C ATOM 571 CD1 ILE A 40 1.262 -9.385 2.216 1.00 0.00 C ATOM 0 H ILE A 40 5.658 -8.722 0.593 1.00 0.00 H new ATOM 0 HA ILE A 40 2.806 -8.456 -0.128 1.00 0.00 H new ATOM 0 HB ILE A 40 4.206 -7.517 2.339 1.00 0.00 H new ATOM 0 HG12 ILE A 40 3.336 -9.785 2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.617 -8.644 3.703 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.029 -6.353 2.929 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.800 -5.683 1.472 1.00 0.00 H new ATOM 0 HG23 ILE A 40 1.410 -6.783 1.317 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.933 -10.211 2.847 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.564 -8.554 2.313 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.294 -9.712 1.177 1.00 0.00 H new ATOM 583 N GLY A 41 3.757 -6.578 -1.518 1.00 0.00 N ATOM 584 CA GLY A 41 3.736 -5.234 -2.079 1.00 0.00 C ATOM 585 C GLY A 41 2.435 -4.526 -1.685 1.00 0.00 C ATOM 586 O GLY A 41 1.496 -5.176 -1.216 1.00 0.00 O ATOM 0 H GLY A 41 3.355 -7.284 -2.135 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.593 -4.666 -1.718 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.820 -5.282 -3.165 1.00 0.00 H new ATOM 590 N SER A 42 2.339 -3.208 -1.877 1.00 0.00 N ATOM 591 CA SER A 42 1.080 -2.548 -2.228 1.00 0.00 C ATOM 592 C SER A 42 1.290 -1.733 -3.503 1.00 0.00 C ATOM 593 O SER A 42 2.405 -1.223 -3.688 1.00 0.00 O ATOM 594 CB SER A 42 0.542 -1.717 -1.049 1.00 0.00 C ATOM 595 OG SER A 42 1.151 -0.447 -0.897 1.00 0.00 O ATOM 0 H SER A 42 3.130 -2.570 -1.794 1.00 0.00 H new ATOM 0 HA SER A 42 0.308 -3.290 -2.432 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.531 -1.578 -1.179 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.680 -2.284 -0.129 1.00 0.00 H new ATOM 0 HG SER A 42 1.064 -0.152 0.034 1.00 0.00 H new ATOM 601 N PHE A 43 0.258 -1.514 -4.336 1.00 0.00 N ATOM 602 CA PHE A 43 0.269 -0.365 -5.249 1.00 0.00 C ATOM 603 C PHE A 43 -0.714 0.692 -4.740 1.00 0.00 C ATOM 604 O PHE A 43 -1.738 0.364 -4.140 1.00 0.00 O ATOM 605 CB PHE A 43 -0.030 -0.784 -6.702 1.00 0.00 C ATOM 606 CG PHE A 43 1.045 -0.385 -7.705 1.00 0.00 C ATOM 607 CD1 PHE A 43 1.479 0.953 -7.811 1.00 0.00 C ATOM 608 CD2 PHE A 43 1.620 -1.354 -8.546 1.00 0.00 C ATOM 609 CE1 PHE A 43 2.476 1.311 -8.733 1.00 0.00 C ATOM 610 CE2 PHE A 43 2.604 -1.000 -9.479 1.00 0.00 C ATOM 611 CZ PHE A 43 3.030 0.332 -9.572 1.00 0.00 C ATOM 0 H PHE A 43 -0.573 -2.102 -4.394 1.00 0.00 H new ATOM 0 HA PHE A 43 1.270 0.067 -5.263 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -0.158 -1.866 -6.736 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -0.978 -0.341 -7.008 1.00 0.00 H new ATOM 0 HD1 PHE A 43 1.040 1.709 -7.177 1.00 0.00 H new ATOM 0 HD2 PHE A 43 1.300 -2.383 -8.472 1.00 0.00 H new ATOM 0 HE1 PHE A 43 2.815 2.335 -8.796 1.00 0.00 H new ATOM 0 HE2 PHE A 43 3.033 -1.752 -10.125 1.00 0.00 H new ATOM 0 HZ PHE A 43 3.787 0.606 -10.292 1.00 0.00 H new ATOM 621 N THR A 44 -0.408 1.958 -5.002 1.00 0.00 N ATOM 622 CA THR A 44 -1.340 3.073 -4.936 1.00 0.00 C ATOM 623 C THR A 44 -1.875 3.243 -6.368 1.00 0.00 C ATOM 624 O THR A 44 -1.118 2.993 -7.309 1.00 0.00 O ATOM 625 CB THR A 44 -0.542 4.315 -4.483 1.00 0.00 C ATOM 626 OG1 THR A 44 0.302 4.020 -3.375 1.00 0.00 O ATOM 627 CG2 THR A 44 -1.447 5.478 -4.073 1.00 0.00 C ATOM 0 H THR A 44 0.532 2.244 -5.276 1.00 0.00 H new ATOM 0 HA THR A 44 -2.165 2.922 -4.240 1.00 0.00 H new ATOM 0 HB THR A 44 0.052 4.604 -5.350 1.00 0.00 H new ATOM 0 HG1 THR A 44 0.794 4.827 -3.115 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.834 6.325 -3.764 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.069 5.770 -4.919 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.084 5.169 -3.244 1.00 0.00 H new ATOM 635 N TYR A 45 -3.116 3.696 -6.575 1.00 0.00 N ATOM 636 CA TYR A 45 -3.653 3.944 -7.917 1.00 0.00 C ATOM 637 C TYR A 45 -4.538 5.183 -7.853 1.00 0.00 C ATOM 638 O TYR A 45 -5.582 5.100 -7.203 1.00 0.00 O ATOM 639 CB TYR A 45 -4.402 2.696 -8.417 1.00 0.00 C ATOM 640 CG TYR A 45 -4.642 2.661 -9.915 1.00 0.00 C ATOM 641 CD1 TYR A 45 -5.481 3.610 -10.535 1.00 0.00 C ATOM 642 CD2 TYR A 45 -3.984 1.691 -10.696 1.00 0.00 C ATOM 643 CE1 TYR A 45 -5.628 3.611 -11.934 1.00 0.00 C ATOM 644 CE2 TYR A 45 -4.148 1.674 -12.089 1.00 0.00 C ATOM 645 CZ TYR A 45 -4.964 2.641 -12.715 1.00 0.00 C ATOM 646 OH TYR A 45 -5.141 2.626 -14.062 1.00 0.00 O ATOM 0 H TYR A 45 -3.773 3.900 -5.822 1.00 0.00 H new ATOM 0 HA TYR A 45 -2.856 4.134 -8.636 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -3.835 1.810 -8.132 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -5.363 2.637 -7.907 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -6.011 4.336 -9.936 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -3.350 0.957 -10.220 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -6.249 4.355 -12.411 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -3.650 0.921 -12.682 1.00 0.00 H new ATOM 0 HH TYR A 45 -4.614 1.898 -14.453 1.00 0.00 H new ATOM 656 N THR A 46 -4.167 6.331 -8.434 1.00 0.00 N ATOM 657 CA THR A 46 -4.878 7.574 -8.127 1.00 0.00 C ATOM 658 C THR A 46 -5.857 7.947 -9.251 1.00 0.00 C ATOM 659 O THR A 46 -5.447 8.225 -10.383 1.00 0.00 O ATOM 660 CB THR A 46 -3.841 8.677 -7.834 1.00 0.00 C ATOM 661 OG1 THR A 46 -2.911 8.821 -8.893 1.00 0.00 O ATOM 662 CG2 THR A 46 -3.038 8.398 -6.559 1.00 0.00 C ATOM 0 H THR A 46 -3.401 6.424 -9.101 1.00 0.00 H new ATOM 0 HA THR A 46 -5.495 7.445 -7.238 1.00 0.00 H new ATOM 0 HB THR A 46 -4.424 9.590 -7.713 1.00 0.00 H new ATOM 0 HG1 THR A 46 -3.356 8.638 -9.747 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.322 9.203 -6.397 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.716 8.338 -5.708 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.504 7.453 -6.664 1.00 0.00 H new ATOM 670 N GLU A 47 -7.148 8.053 -8.930 1.00 0.00 N ATOM 671 CA GLU A 47 -8.210 8.452 -9.848 1.00 0.00 C ATOM 672 C GLU A 47 -9.436 8.870 -9.016 1.00 0.00 C ATOM 673 O GLU A 47 -10.400 8.118 -8.881 1.00 0.00 O ATOM 674 CB GLU A 47 -8.474 7.294 -10.838 1.00 0.00 C ATOM 675 CG GLU A 47 -9.231 7.724 -12.104 1.00 0.00 C ATOM 676 CD GLU A 47 -10.741 7.784 -11.896 1.00 0.00 C ATOM 677 OE1 GLU A 47 -11.355 6.714 -11.675 1.00 0.00 O ATOM 678 OE2 GLU A 47 -11.341 8.886 -11.945 1.00 0.00 O ATOM 0 H GLU A 47 -7.492 7.856 -7.990 1.00 0.00 H new ATOM 0 HA GLU A 47 -7.935 9.314 -10.456 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.521 6.851 -11.128 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.045 6.517 -10.330 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.873 8.703 -12.421 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.007 7.026 -12.911 1.00 0.00 H new ATOM 685 N LYS A 48 -9.410 10.071 -8.426 1.00 0.00 N ATOM 686 CA LYS A 48 -10.588 10.756 -7.884 1.00 0.00 C ATOM 687 C LYS A 48 -10.222 12.228 -7.715 1.00 0.00 C ATOM 688 O LYS A 48 -9.332 12.530 -6.918 1.00 0.00 O ATOM 689 CB LYS A 48 -11.032 10.144 -6.531 1.00 0.00 C ATOM 690 CG LYS A 48 -12.557 10.211 -6.320 1.00 0.00 C ATOM 691 CD LYS A 48 -13.279 9.134 -7.144 1.00 0.00 C ATOM 692 CE LYS A 48 -14.762 8.972 -6.792 1.00 0.00 C ATOM 693 NZ LYS A 48 -15.659 9.905 -7.501 1.00 0.00 N ATOM 0 H LYS A 48 -8.549 10.605 -8.310 1.00 0.00 H new ATOM 0 HA LYS A 48 -11.430 10.642 -8.567 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -10.708 9.104 -6.483 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.533 10.671 -5.717 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.787 10.079 -5.263 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.923 11.197 -6.605 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.192 9.381 -8.202 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.774 8.179 -6.997 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.068 7.950 -7.018 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -14.886 9.112 -5.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -16.642 9.731 -7.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -15.396 10.884 -7.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -15.572 9.758 -8.527 1.00 0.00 H new ATOM 707 N SER A 49 -10.831 13.149 -8.452 1.00 0.00 N ATOM 708 CA SER A 49 -10.609 14.583 -8.253 1.00 0.00 C ATOM 709 C SER A 49 -11.199 15.029 -6.912 1.00 0.00 C ATOM 710 O SER A 49 -12.108 14.385 -6.379 1.00 0.00 O ATOM 711 CB SER A 49 -11.151 15.437 -9.410 1.00 0.00 C ATOM 712 OG SER A 49 -11.749 14.670 -10.434 1.00 0.00 O ATOM 0 H SER A 49 -11.489 12.929 -9.200 1.00 0.00 H new ATOM 0 HA SER A 49 -9.531 14.743 -8.237 1.00 0.00 H new ATOM 0 HB2 SER A 49 -11.883 16.144 -9.020 1.00 0.00 H new ATOM 0 HB3 SER A 49 -10.336 16.024 -9.833 1.00 0.00 H new ATOM 0 HG SER A 49 -12.076 15.266 -11.140 1.00 0.00 H new ATOM 718 N ARG A 50 -10.685 16.120 -6.342 1.00 0.00 N ATOM 719 CA ARG A 50 -11.198 16.732 -5.122 1.00 0.00 C ATOM 720 C ARG A 50 -11.296 18.231 -5.379 1.00 0.00 C ATOM 721 O ARG A 50 -10.283 18.907 -5.509 1.00 0.00 O ATOM 722 CB ARG A 50 -10.352 16.361 -3.888 1.00 0.00 C ATOM 723 CG ARG A 50 -8.848 16.095 -4.107 1.00 0.00 C ATOM 724 CD ARG A 50 -8.504 14.640 -4.480 1.00 0.00 C ATOM 725 NE ARG A 50 -7.056 14.390 -4.372 1.00 0.00 N ATOM 726 CZ ARG A 50 -6.362 13.353 -4.860 1.00 0.00 C ATOM 727 NH1 ARG A 50 -6.929 12.425 -5.620 1.00 0.00 N ATOM 728 NH2 ARG A 50 -5.066 13.247 -4.611 1.00 0.00 N ATOM 0 H ARG A 50 -9.880 16.613 -6.728 1.00 0.00 H new ATOM 0 HA ARG A 50 -12.189 16.349 -4.879 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -10.448 17.167 -3.160 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -10.789 15.470 -3.437 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -8.487 16.754 -4.896 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.309 16.361 -3.198 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -9.044 13.957 -3.824 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.836 14.434 -5.498 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.517 15.091 -3.864 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -7.921 12.489 -5.848 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -6.373 11.648 -5.976 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -4.595 13.955 -4.047 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.538 12.457 -4.983 1.00 0.00 H new ATOM 742 N THR A 51 -12.485 18.758 -5.633 1.00 0.00 N ATOM 743 CA THR A 51 -12.647 20.130 -6.107 1.00 0.00 C ATOM 744 C THR A 51 -13.974 20.632 -5.546 1.00 0.00 C ATOM 745 O THR A 51 -15.002 20.658 -6.228 1.00 0.00 O ATOM 746 CB THR A 51 -12.497 20.144 -7.644 1.00 0.00 C ATOM 747 OG1 THR A 51 -11.195 19.691 -7.992 1.00 0.00 O ATOM 748 CG2 THR A 51 -12.715 21.495 -8.335 1.00 0.00 C ATOM 0 H THR A 51 -13.363 18.251 -5.518 1.00 0.00 H new ATOM 0 HA THR A 51 -11.883 20.824 -5.757 1.00 0.00 H new ATOM 0 HB THR A 51 -13.295 19.491 -7.998 1.00 0.00 H new ATOM 0 HG1 THR A 51 -11.096 19.697 -8.967 1.00 0.00 H new ATOM 0 HG21 THR A 51 -12.583 21.379 -9.411 1.00 0.00 H new ATOM 0 HG22 THR A 51 -13.725 21.850 -8.129 1.00 0.00 H new ATOM 0 HG23 THR A 51 -11.992 22.218 -7.957 1.00 0.00 H new ATOM 756 N ALA A 52 -13.943 20.957 -4.255 1.00 0.00 N ATOM 757 CA ALA A 52 -15.074 21.419 -3.464 1.00 0.00 C ATOM 758 C ALA A 52 -14.627 22.471 -2.437 1.00 0.00 C ATOM 759 O ALA A 52 -15.307 22.669 -1.427 1.00 0.00 O ATOM 760 CB ALA A 52 -15.751 20.205 -2.817 1.00 0.00 C ATOM 0 H ALA A 52 -13.084 20.901 -3.708 1.00 0.00 H new ATOM 0 HA ALA A 52 -15.805 21.915 -4.102 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -16.601 20.537 -2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -16.097 19.524 -3.595 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -15.037 19.689 -2.175 1.00 0.00 H new ATOM 766 N SER A 53 -13.465 23.102 -2.633 1.00 0.00 N ATOM 767 CA SER A 53 -12.930 24.111 -1.726 1.00 0.00 C ATOM 768 C SER A 53 -12.185 25.152 -2.586 1.00 0.00 C ATOM 769 O SER A 53 -12.851 25.851 -3.348 1.00 0.00 O ATOM 770 CB SER A 53 -12.137 23.386 -0.622 1.00 0.00 C ATOM 771 OG SER A 53 -12.137 24.100 0.595 1.00 0.00 O ATOM 0 H SER A 53 -12.865 22.921 -3.438 1.00 0.00 H new ATOM 0 HA SER A 53 -13.676 24.687 -1.179 1.00 0.00 H new ATOM 0 HB2 SER A 53 -12.565 22.397 -0.460 1.00 0.00 H new ATOM 0 HB3 SER A 53 -11.109 23.238 -0.954 1.00 0.00 H new ATOM 0 HG SER A 53 -11.918 23.491 1.331 1.00 0.00 H new ATOM 777 N SER A 54 -10.846 25.199 -2.612 1.00 0.00 N ATOM 778 CA SER A 54 -10.114 25.979 -3.607 1.00 0.00 C ATOM 779 C SER A 54 -10.222 25.316 -4.980 1.00 0.00 C ATOM 780 O SER A 54 -10.498 26.009 -5.959 1.00 0.00 O ATOM 781 CB SER A 54 -8.637 26.132 -3.217 1.00 0.00 C ATOM 782 OG SER A 54 -8.409 27.365 -2.568 1.00 0.00 O ATOM 0 H SER A 54 -10.250 24.702 -1.950 1.00 0.00 H new ATOM 0 HA SER A 54 -10.561 26.972 -3.649 1.00 0.00 H new ATOM 0 HB2 SER A 54 -8.344 25.312 -2.561 1.00 0.00 H new ATOM 0 HB3 SER A 54 -8.013 26.066 -4.108 1.00 0.00 H new ATOM 0 HG SER A 54 -7.462 27.438 -2.328 1.00 0.00 H new ATOM 788 N GLY A 55 -10.014 23.997 -5.059 1.00 0.00 N ATOM 789 CA GLY A 55 -9.977 23.261 -6.314 1.00 0.00 C ATOM 790 C GLY A 55 -8.659 22.519 -6.424 1.00 0.00 C ATOM 791 O GLY A 55 -7.768 22.936 -7.158 1.00 0.00 O ATOM 0 H GLY A 55 -9.865 23.409 -4.239 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -10.808 22.557 -6.360 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.092 23.946 -7.154 1.00 0.00 H new ATOM 795 N ASP A 56 -8.527 21.437 -5.658 1.00 0.00 N ATOM 796 CA ASP A 56 -7.341 20.592 -5.639 1.00 0.00 C ATOM 797 C ASP A 56 -7.349 19.786 -6.937 1.00 0.00 C ATOM 798 O ASP A 56 -7.938 18.706 -7.059 1.00 0.00 O ATOM 799 CB ASP A 56 -7.311 19.710 -4.371 1.00 0.00 C ATOM 800 CG ASP A 56 -7.712 20.467 -3.117 1.00 0.00 C ATOM 801 OD1 ASP A 56 -6.931 21.342 -2.669 1.00 0.00 O ATOM 802 OD2 ASP A 56 -8.876 20.302 -2.665 1.00 0.00 O ATOM 0 H ASP A 56 -9.258 21.120 -5.022 1.00 0.00 H new ATOM 0 HA ASP A 56 -6.427 21.184 -5.591 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -7.982 18.862 -4.508 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.308 19.305 -4.240 1.00 0.00 H new ATOM 807 N TYR A 57 -6.713 20.359 -7.959 1.00 0.00 N ATOM 808 CA TYR A 57 -6.695 19.766 -9.284 1.00 0.00 C ATOM 809 C TYR A 57 -5.553 18.748 -9.330 1.00 0.00 C ATOM 810 O TYR A 57 -4.482 18.960 -9.901 1.00 0.00 O ATOM 811 CB TYR A 57 -6.668 20.867 -10.365 1.00 0.00 C ATOM 812 CG TYR A 57 -7.919 20.885 -11.216 1.00 0.00 C ATOM 813 CD1 TYR A 57 -9.099 21.498 -10.753 1.00 0.00 C ATOM 814 CD2 TYR A 57 -7.905 20.239 -12.465 1.00 0.00 C ATOM 815 CE1 TYR A 57 -10.273 21.438 -11.529 1.00 0.00 C ATOM 816 CE2 TYR A 57 -9.070 20.179 -13.242 1.00 0.00 C ATOM 817 CZ TYR A 57 -10.267 20.761 -12.772 1.00 0.00 C ATOM 818 OH TYR A 57 -11.421 20.580 -13.476 1.00 0.00 O ATOM 0 H TYR A 57 -6.202 21.239 -7.887 1.00 0.00 H new ATOM 0 HA TYR A 57 -7.607 19.211 -9.505 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -6.547 21.838 -9.885 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -5.800 20.718 -11.007 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -9.104 22.014 -9.804 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.993 19.787 -12.827 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -11.178 21.909 -11.175 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -9.052 19.686 -14.203 1.00 0.00 H new ATOM 0 HH TYR A 57 -11.226 20.096 -14.305 1.00 0.00 H new ATOM 828 N ASN A 58 -5.827 17.587 -8.734 1.00 0.00 N ATOM 829 CA ASN A 58 -4.946 16.433 -8.732 1.00 0.00 C ATOM 830 C ASN A 58 -4.850 15.890 -10.155 1.00 0.00 C ATOM 831 O ASN A 58 -5.794 15.230 -10.600 1.00 0.00 O ATOM 832 CB ASN A 58 -5.491 15.348 -7.787 1.00 0.00 C ATOM 833 CG ASN A 58 -4.739 14.046 -8.033 1.00 0.00 C ATOM 834 OD1 ASN A 58 -3.535 13.983 -7.797 1.00 0.00 O ATOM 835 ND2 ASN A 58 -5.382 13.002 -8.537 1.00 0.00 N ATOM 0 H ASN A 58 -6.696 17.425 -8.226 1.00 0.00 H new ATOM 0 HA ASN A 58 -3.957 16.726 -8.380 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -5.373 15.660 -6.749 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -6.558 15.203 -7.957 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -4.877 12.137 -8.732 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -6.382 13.063 -8.730 1.00 0.00 H new ATOM 842 N LYS A 59 -3.740 16.108 -10.873 1.00 0.00 N ATOM 843 CA LYS A 59 -3.671 15.633 -12.260 1.00 0.00 C ATOM 844 C LYS A 59 -2.255 15.167 -12.544 1.00 0.00 C ATOM 845 O LYS A 59 -1.353 15.995 -12.541 1.00 0.00 O ATOM 846 CB LYS A 59 -4.106 16.811 -13.158 1.00 0.00 C ATOM 847 CG LYS A 59 -4.368 16.435 -14.618 1.00 0.00 C ATOM 848 CD LYS A 59 -5.592 15.521 -14.795 1.00 0.00 C ATOM 849 CE LYS A 59 -6.098 15.539 -16.243 1.00 0.00 C ATOM 850 NZ LYS A 59 -6.834 16.772 -16.591 1.00 0.00 N ATOM 0 H LYS A 59 -2.908 16.591 -10.533 1.00 0.00 H new ATOM 0 HA LYS A 59 -4.328 14.785 -12.452 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -5.011 17.253 -12.742 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -3.333 17.579 -13.127 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.514 17.345 -15.201 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.487 15.935 -15.022 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -5.331 14.501 -14.512 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -6.389 15.844 -14.125 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.249 15.428 -16.918 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.748 14.679 -16.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -7.207 16.693 -17.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -7.623 16.905 -15.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -6.192 17.588 -16.533 1.00 0.00 H new ATOM 864 N ASN A 60 -2.036 13.878 -12.798 1.00 0.00 N ATOM 865 CA ASN A 60 -0.761 13.134 -12.797 1.00 0.00 C ATOM 866 C ASN A 60 -1.105 11.679 -12.435 1.00 0.00 C ATOM 867 O ASN A 60 -2.289 11.327 -12.386 1.00 0.00 O ATOM 868 CB ASN A 60 0.357 13.748 -11.899 1.00 0.00 C ATOM 869 CG ASN A 60 1.368 14.550 -12.719 1.00 0.00 C ATOM 870 OD1 ASN A 60 1.951 14.030 -13.663 1.00 0.00 O ATOM 871 ND2 ASN A 60 1.632 15.799 -12.389 1.00 0.00 N ATOM 0 H ASN A 60 -2.815 13.263 -13.033 1.00 0.00 H new ATOM 0 HA ASN A 60 -0.308 13.193 -13.787 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -0.095 14.394 -11.147 1.00 0.00 H new ATOM 0 HB3 ASN A 60 0.873 12.950 -11.365 1.00 0.00 H new ATOM 0 HD21 ASN A 60 2.321 16.332 -12.919 1.00 0.00 H new ATOM 0 HD22 ASN A 60 1.147 16.232 -11.603 1.00 0.00 H new ATOM 878 N GLN A 61 -0.111 10.832 -12.167 1.00 0.00 N ATOM 879 CA GLN A 61 -0.212 9.372 -12.158 1.00 0.00 C ATOM 880 C GLN A 61 -0.022 8.900 -10.709 1.00 0.00 C ATOM 881 O GLN A 61 0.321 9.698 -9.826 1.00 0.00 O ATOM 882 CB GLN A 61 0.892 8.814 -13.100 1.00 0.00 C ATOM 883 CG GLN A 61 0.407 7.947 -14.282 1.00 0.00 C ATOM 884 CD GLN A 61 0.616 6.445 -14.062 1.00 0.00 C ATOM 885 OE1 GLN A 61 0.615 5.966 -12.936 1.00 0.00 O ATOM 886 NE2 GLN A 61 0.826 5.655 -15.104 1.00 0.00 N ATOM 0 H GLN A 61 0.828 11.159 -11.940 1.00 0.00 H new ATOM 0 HA GLN A 61 -1.179 9.017 -12.513 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.457 9.655 -13.502 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.585 8.221 -12.502 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.653 8.138 -14.452 1.00 0.00 H new ATOM 0 HG3 GLN A 61 0.934 8.251 -15.186 1.00 0.00 H new ATOM 0 HE21 GLN A 61 0.829 6.044 -16.047 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.985 4.657 -14.964 1.00 0.00 H new ATOM 895 N TYR A 62 -0.263 7.627 -10.421 1.00 0.00 N ATOM 896 CA TYR A 62 0.150 7.032 -9.163 1.00 0.00 C ATOM 897 C TYR A 62 1.651 6.746 -9.196 1.00 0.00 C ATOM 898 O TYR A 62 2.202 6.324 -10.210 1.00 0.00 O ATOM 899 CB TYR A 62 -0.649 5.757 -8.898 1.00 0.00 C ATOM 900 CG TYR A 62 -0.847 4.827 -10.085 1.00 0.00 C ATOM 901 CD1 TYR A 62 -1.832 5.104 -11.057 1.00 0.00 C ATOM 902 CD2 TYR A 62 -0.053 3.672 -10.210 1.00 0.00 C ATOM 903 CE1 TYR A 62 -1.966 4.269 -12.178 1.00 0.00 C ATOM 904 CE2 TYR A 62 -0.209 2.813 -11.308 1.00 0.00 C ATOM 905 CZ TYR A 62 -1.152 3.123 -12.311 1.00 0.00 C ATOM 906 OH TYR A 62 -1.263 2.334 -13.416 1.00 0.00 O ATOM 0 H TYR A 62 -0.746 6.985 -11.049 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.049 7.729 -8.349 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.150 5.199 -8.106 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.631 6.041 -8.518 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.483 5.958 -10.939 1.00 0.00 H new ATOM 0 HD2 TYR A 62 0.683 3.445 -9.453 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.694 4.504 -12.941 1.00 0.00 H new ATOM 0 HE2 TYR A 62 0.390 1.918 -11.385 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.130 1.877 -13.406 1.00 0.00 H new ATOM 916 N TYR A 63 2.303 6.940 -8.055 1.00 0.00 N ATOM 917 CA TYR A 63 3.603 6.391 -7.718 1.00 0.00 C ATOM 918 C TYR A 63 3.557 6.009 -6.247 1.00 0.00 C ATOM 919 O TYR A 63 3.349 6.874 -5.393 1.00 0.00 O ATOM 920 CB TYR A 63 4.729 7.397 -7.987 1.00 0.00 C ATOM 921 CG TYR A 63 5.072 7.511 -9.455 1.00 0.00 C ATOM 922 CD1 TYR A 63 5.563 6.382 -10.132 1.00 0.00 C ATOM 923 CD2 TYR A 63 4.880 8.721 -10.149 1.00 0.00 C ATOM 924 CE1 TYR A 63 5.778 6.435 -11.514 1.00 0.00 C ATOM 925 CE2 TYR A 63 5.077 8.776 -11.543 1.00 0.00 C ATOM 926 CZ TYR A 63 5.490 7.615 -12.233 1.00 0.00 C ATOM 927 OH TYR A 63 5.606 7.640 -13.588 1.00 0.00 O ATOM 0 H TYR A 63 1.916 7.514 -7.305 1.00 0.00 H new ATOM 0 HA TYR A 63 3.816 5.521 -8.340 1.00 0.00 H new ATOM 0 HB2 TYR A 63 4.433 8.376 -7.610 1.00 0.00 H new ATOM 0 HB3 TYR A 63 5.618 7.097 -7.433 1.00 0.00 H new ATOM 0 HD1 TYR A 63 5.774 5.474 -9.587 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.581 9.609 -9.612 1.00 0.00 H new ATOM 0 HE1 TYR A 63 6.166 5.570 -12.032 1.00 0.00 H new ATOM 0 HE2 TYR A 63 4.913 9.699 -12.080 1.00 0.00 H new ATOM 0 HH TYR A 63 5.368 8.531 -13.920 1.00 0.00 H new ATOM 937 N GLY A 64 3.735 4.727 -5.948 1.00 0.00 N ATOM 938 CA GLY A 64 4.082 4.270 -4.626 1.00 0.00 C ATOM 939 C GLY A 64 4.729 2.900 -4.745 1.00 0.00 C ATOM 940 O GLY A 64 4.529 2.196 -5.738 1.00 0.00 O ATOM 0 H GLY A 64 3.639 3.975 -6.631 1.00 0.00 H new ATOM 0 HA2 GLY A 64 4.766 4.972 -4.150 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.193 4.216 -3.998 1.00 0.00 H new ATOM 944 N ILE A 65 5.497 2.545 -3.722 1.00 0.00 N ATOM 945 CA ILE A 65 6.051 1.228 -3.475 1.00 0.00 C ATOM 946 C ILE A 65 5.752 0.992 -1.995 1.00 0.00 C ATOM 947 O ILE A 65 5.821 1.928 -1.200 1.00 0.00 O ATOM 948 CB ILE A 65 7.574 1.183 -3.789 1.00 0.00 C ATOM 949 CG1 ILE A 65 7.927 1.596 -5.239 1.00 0.00 C ATOM 950 CG2 ILE A 65 8.134 -0.231 -3.545 1.00 0.00 C ATOM 951 CD1 ILE A 65 8.264 3.084 -5.396 1.00 0.00 C ATOM 0 H ILE A 65 5.764 3.214 -3.000 1.00 0.00 H new ATOM 0 HA ILE A 65 5.623 0.454 -4.112 1.00 0.00 H new ATOM 0 HB ILE A 65 8.027 1.911 -3.115 1.00 0.00 H new ATOM 0 HG12 ILE A 65 8.776 1.003 -5.579 1.00 0.00 H new ATOM 0 HG13 ILE A 65 7.088 1.353 -5.890 1.00 0.00 H new ATOM 0 HG21 ILE A 65 9.201 -0.244 -3.770 1.00 0.00 H new ATOM 0 HG22 ILE A 65 7.980 -0.509 -2.502 1.00 0.00 H new ATOM 0 HG23 ILE A 65 7.619 -0.943 -4.190 1.00 0.00 H new ATOM 0 HD11 ILE A 65 8.500 3.295 -6.439 1.00 0.00 H new ATOM 0 HD12 ILE A 65 7.408 3.685 -5.089 1.00 0.00 H new ATOM 0 HD13 ILE A 65 9.123 3.330 -4.772 1.00 0.00 H new ATOM 963 N THR A 66 5.439 -0.237 -1.616 1.00 0.00 N ATOM 964 CA THR A 66 5.484 -0.745 -0.264 1.00 0.00 C ATOM 965 C THR A 66 6.050 -2.156 -0.417 1.00 0.00 C ATOM 966 O THR A 66 5.881 -2.751 -1.489 1.00 0.00 O ATOM 967 CB THR A 66 4.103 -0.664 0.410 1.00 0.00 C ATOM 968 OG1 THR A 66 3.651 0.680 0.441 1.00 0.00 O ATOM 969 CG2 THR A 66 4.111 -1.178 1.848 1.00 0.00 C ATOM 0 H THR A 66 5.130 -0.942 -2.285 1.00 0.00 H new ATOM 0 HA THR A 66 6.112 -0.161 0.409 1.00 0.00 H new ATOM 0 HB THR A 66 3.443 -1.295 -0.184 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.809 0.731 0.941 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.109 -1.095 2.270 1.00 0.00 H new ATOM 0 HG22 THR A 66 4.424 -2.222 1.860 1.00 0.00 H new ATOM 0 HG23 THR A 66 4.805 -0.584 2.443 1.00 0.00 H new ATOM 977 N ALA A 67 6.798 -2.639 0.574 1.00 0.00 N ATOM 978 CA ALA A 67 7.653 -3.806 0.435 1.00 0.00 C ATOM 979 C ALA A 67 7.844 -4.503 1.777 1.00 0.00 C ATOM 980 O ALA A 67 7.893 -3.846 2.823 1.00 0.00 O ATOM 981 CB ALA A 67 9.017 -3.330 -0.075 1.00 0.00 C ATOM 0 H ALA A 67 6.824 -2.223 1.505 1.00 0.00 H new ATOM 0 HA ALA A 67 7.193 -4.512 -0.257 1.00 0.00 H new ATOM 0 HB1 ALA A 67 9.682 -4.186 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.893 -2.836 -1.039 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.448 -2.629 0.640 1.00 0.00 H new ATOM 987 N GLY A 68 8.039 -5.818 1.714 1.00 0.00 N ATOM 988 CA GLY A 68 8.521 -6.661 2.794 1.00 0.00 C ATOM 989 C GLY A 68 8.118 -8.123 2.567 1.00 0.00 C ATOM 990 O GLY A 68 7.227 -8.409 1.760 1.00 0.00 O ATOM 0 H GLY A 68 7.854 -6.347 0.862 1.00 0.00 H new ATOM 0 HA2 GLY A 68 9.606 -6.585 2.864 1.00 0.00 H new ATOM 0 HA3 GLY A 68 8.115 -6.311 3.743 1.00 0.00 H new ATOM 994 N PRO A 69 8.755 -9.072 3.273 1.00 0.00 N ATOM 995 CA PRO A 69 8.294 -10.453 3.332 1.00 0.00 C ATOM 996 C PRO A 69 7.042 -10.566 4.217 1.00 0.00 C ATOM 997 O PRO A 69 6.676 -9.621 4.917 1.00 0.00 O ATOM 998 CB PRO A 69 9.478 -11.234 3.906 1.00 0.00 C ATOM 999 CG PRO A 69 10.164 -10.218 4.815 1.00 0.00 C ATOM 1000 CD PRO A 69 9.929 -8.882 4.112 1.00 0.00 C ATOM 0 HA PRO A 69 7.999 -10.842 2.358 1.00 0.00 H new ATOM 0 HB2 PRO A 69 9.149 -12.112 4.461 1.00 0.00 H new ATOM 0 HB3 PRO A 69 10.146 -11.586 3.120 1.00 0.00 H new ATOM 0 HG2 PRO A 69 9.735 -10.224 5.817 1.00 0.00 H new ATOM 0 HG3 PRO A 69 11.227 -10.432 4.923 1.00 0.00 H new ATOM 0 HD2 PRO A 69 9.766 -8.083 4.836 1.00 0.00 H new ATOM 0 HD3 PRO A 69 10.795 -8.598 3.514 1.00 0.00 H new ATOM 1008 N ALA A 70 6.419 -11.747 4.238 1.00 0.00 N ATOM 1009 CA ALA A 70 5.447 -12.148 5.244 1.00 0.00 C ATOM 1010 C ALA A 70 5.669 -13.607 5.624 1.00 0.00 C ATOM 1011 O ALA A 70 6.197 -14.398 4.839 1.00 0.00 O ATOM 1012 CB ALA A 70 4.019 -11.908 4.746 1.00 0.00 C ATOM 0 H ALA A 70 6.585 -12.466 3.534 1.00 0.00 H new ATOM 0 HA ALA A 70 5.585 -11.537 6.136 1.00 0.00 H new ATOM 0 HB1 ALA A 70 3.309 -12.215 5.514 1.00 0.00 H new ATOM 0 HB2 ALA A 70 3.883 -10.849 4.529 1.00 0.00 H new ATOM 0 HB3 ALA A 70 3.847 -12.489 3.840 1.00 0.00 H new ATOM 1018 N TYR A 71 5.270 -13.973 6.843 1.00 0.00 N ATOM 1019 CA TYR A 71 5.709 -15.211 7.473 1.00 0.00 C ATOM 1020 C TYR A 71 4.631 -15.700 8.432 1.00 0.00 C ATOM 1021 O TYR A 71 3.877 -14.885 8.975 1.00 0.00 O ATOM 1022 CB TYR A 71 7.010 -14.907 8.225 1.00 0.00 C ATOM 1023 CG TYR A 71 7.881 -16.101 8.538 1.00 0.00 C ATOM 1024 CD1 TYR A 71 8.457 -16.843 7.488 1.00 0.00 C ATOM 1025 CD2 TYR A 71 8.203 -16.406 9.873 1.00 0.00 C ATOM 1026 CE1 TYR A 71 9.371 -17.871 7.774 1.00 0.00 C ATOM 1027 CE2 TYR A 71 9.130 -17.421 10.160 1.00 0.00 C ATOM 1028 CZ TYR A 71 9.724 -18.155 9.110 1.00 0.00 C ATOM 1029 OH TYR A 71 10.693 -19.072 9.363 1.00 0.00 O ATOM 0 H TYR A 71 4.635 -13.418 7.417 1.00 0.00 H new ATOM 0 HA TYR A 71 5.881 -15.993 6.734 1.00 0.00 H new ATOM 0 HB2 TYR A 71 7.593 -14.200 7.634 1.00 0.00 H new ATOM 0 HB3 TYR A 71 6.759 -14.409 9.161 1.00 0.00 H new ATOM 0 HD1 TYR A 71 8.196 -16.622 6.464 1.00 0.00 H new ATOM 0 HD2 TYR A 71 7.736 -15.859 10.679 1.00 0.00 H new ATOM 0 HE1 TYR A 71 9.805 -18.445 6.969 1.00 0.00 H new ATOM 0 HE2 TYR A 71 9.389 -17.641 11.185 1.00 0.00 H new ATOM 0 HH TYR A 71 10.821 -19.154 10.331 1.00 0.00 H new ATOM 1039 N ARG A 72 4.554 -17.011 8.645 1.00 0.00 N ATOM 1040 CA ARG A 72 3.603 -17.613 9.571 1.00 0.00 C ATOM 1041 C ARG A 72 4.149 -17.530 10.992 1.00 0.00 C ATOM 1042 O ARG A 72 5.365 -17.524 11.175 1.00 0.00 O ATOM 1043 CB ARG A 72 3.330 -19.066 9.164 1.00 0.00 C ATOM 1044 CG ARG A 72 2.037 -19.579 9.816 1.00 0.00 C ATOM 1045 CD ARG A 72 1.077 -20.152 8.781 1.00 0.00 C ATOM 1046 NE ARG A 72 1.443 -21.505 8.358 1.00 0.00 N ATOM 1047 CZ ARG A 72 0.776 -22.201 7.434 1.00 0.00 C ATOM 1048 NH1 ARG A 72 -0.213 -21.625 6.751 1.00 0.00 N ATOM 1049 NH2 ARG A 72 1.109 -23.466 7.205 1.00 0.00 N ATOM 0 H ARG A 72 5.155 -17.689 8.176 1.00 0.00 H new ATOM 0 HA ARG A 72 2.659 -17.069 9.535 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.249 -19.136 8.079 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.168 -19.696 9.462 1.00 0.00 H new ATOM 0 HG2 ARG A 72 2.279 -20.345 10.552 1.00 0.00 H new ATOM 0 HG3 ARG A 72 1.551 -18.764 10.352 1.00 0.00 H new ATOM 0 HD2 ARG A 72 0.069 -20.166 9.195 1.00 0.00 H new ATOM 0 HD3 ARG A 72 1.055 -19.497 7.910 1.00 0.00 H new ATOM 0 HE ARG A 72 2.255 -21.941 8.795 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.460 -20.653 6.934 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -0.722 -22.157 6.045 1.00 0.00 H new ATOM 0 HH21 ARG A 72 1.868 -23.897 7.733 1.00 0.00 H new ATOM 0 HH22 ARG A 72 0.606 -24.006 6.501 1.00 0.00 H new ATOM 1063 N ILE A 73 3.264 -17.439 11.987 1.00 0.00 N ATOM 1064 CA ILE A 73 3.632 -17.719 13.363 1.00 0.00 C ATOM 1065 C ILE A 73 3.655 -19.255 13.476 1.00 0.00 C ATOM 1066 O ILE A 73 4.587 -19.868 12.955 1.00 0.00 O ATOM 1067 CB ILE A 73 2.727 -16.983 14.384 1.00 0.00 C ATOM 1068 CG1 ILE A 73 2.476 -15.490 14.088 1.00 0.00 C ATOM 1069 CG2 ILE A 73 3.422 -17.039 15.753 1.00 0.00 C ATOM 1070 CD1 ILE A 73 1.353 -15.185 13.090 1.00 0.00 C ATOM 0 H ILE A 73 2.288 -17.173 11.858 1.00 0.00 H new ATOM 0 HA ILE A 73 4.615 -17.325 13.621 1.00 0.00 H new ATOM 0 HB ILE A 73 1.762 -17.488 14.339 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.248 -14.987 15.027 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.401 -15.054 13.709 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.808 -16.528 16.494 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.558 -18.079 16.050 1.00 0.00 H new ATOM 0 HG23 ILE A 73 4.394 -16.550 15.688 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.266 -14.106 12.959 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.582 -15.650 12.131 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.411 -15.581 13.470 1.00 0.00 H new ATOM 1082 N ASN A 74 2.648 -19.902 14.078 1.00 0.00 N ATOM 1083 CA ASN A 74 2.609 -21.363 14.225 1.00 0.00 C ATOM 1084 C ASN A 74 1.200 -21.943 14.047 1.00 0.00 C ATOM 1085 O ASN A 74 1.020 -23.158 14.159 1.00 0.00 O ATOM 1086 CB ASN A 74 3.200 -21.779 15.585 1.00 0.00 C ATOM 1087 CG ASN A 74 4.018 -23.067 15.490 1.00 0.00 C ATOM 1088 OD1 ASN A 74 5.222 -23.051 15.720 1.00 0.00 O ATOM 1089 ND2 ASN A 74 3.420 -24.198 15.171 1.00 0.00 N ATOM 0 H ASN A 74 1.838 -19.427 14.477 1.00 0.00 H new ATOM 0 HA ASN A 74 3.220 -21.779 13.424 1.00 0.00 H new ATOM 0 HB2 ASN A 74 3.832 -20.976 15.965 1.00 0.00 H new ATOM 0 HB3 ASN A 74 2.392 -21.916 16.304 1.00 0.00 H new ATOM 0 HD21 ASN A 74 3.959 -25.062 15.115 1.00 0.00 H new ATOM 0 HD22 ASN A 74 2.418 -24.209 14.980 1.00 0.00 H new ATOM 1096 N ASP A 75 0.201 -21.103 13.774 1.00 0.00 N ATOM 1097 CA ASP A 75 -1.154 -21.539 13.455 1.00 0.00 C ATOM 1098 C ASP A 75 -1.380 -21.139 12.002 1.00 0.00 C ATOM 1099 O ASP A 75 -0.635 -21.600 11.136 1.00 0.00 O ATOM 1100 CB ASP A 75 -2.200 -20.973 14.428 1.00 0.00 C ATOM 1101 CG ASP A 75 -2.077 -21.487 15.857 1.00 0.00 C ATOM 1102 OD1 ASP A 75 -2.582 -22.599 16.142 1.00 0.00 O ATOM 1103 OD2 ASP A 75 -1.529 -20.739 16.698 1.00 0.00 O ATOM 0 H ASP A 75 0.314 -20.089 13.769 1.00 0.00 H new ATOM 0 HA ASP A 75 -1.270 -22.616 13.573 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -2.118 -19.886 14.438 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.195 -21.214 14.053 1.00 0.00 H new ATOM 1108 N TRP A 76 -2.364 -20.279 11.711 1.00 0.00 N ATOM 1109 CA TRP A 76 -2.844 -20.079 10.352 1.00 0.00 C ATOM 1110 C TRP A 76 -2.927 -18.625 9.906 1.00 0.00 C ATOM 1111 O TRP A 76 -3.078 -18.416 8.700 1.00 0.00 O ATOM 1112 CB TRP A 76 -4.170 -20.834 10.158 1.00 0.00 C ATOM 1113 CG TRP A 76 -4.090 -22.208 9.551 1.00 0.00 C ATOM 1114 CD1 TRP A 76 -2.974 -22.910 9.233 1.00 0.00 C ATOM 1115 CD2 TRP A 76 -5.202 -23.050 9.132 1.00 0.00 C ATOM 1116 NE1 TRP A 76 -3.319 -24.092 8.612 1.00 0.00 N ATOM 1117 CE2 TRP A 76 -4.682 -24.217 8.497 1.00 0.00 C ATOM 1118 CE3 TRP A 76 -6.605 -22.924 9.191 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 -5.511 -25.190 7.918 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 -7.445 -23.899 8.624 1.00 0.00 C ATOM 1121 CH2 TRP A 76 -6.904 -25.025 7.982 1.00 0.00 C ATOM 0 H TRP A 76 -2.842 -19.710 12.410 1.00 0.00 H new ATOM 0 HA TRP A 76 -2.088 -20.499 9.689 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -4.656 -20.921 11.130 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -4.819 -20.223 9.530 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -1.963 -22.590 9.436 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -2.648 -24.785 8.280 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.041 -22.065 9.679 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -5.084 -26.054 7.430 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -8.517 -23.781 8.683 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -7.558 -25.762 7.539 1.00 0.00 H new ATOM 1132 N ALA A 77 -2.758 -17.618 10.767 1.00 0.00 N ATOM 1133 CA ALA A 77 -2.510 -16.269 10.260 1.00 0.00 C ATOM 1134 C ALA A 77 -1.056 -16.158 9.784 1.00 0.00 C ATOM 1135 O ALA A 77 -0.201 -16.924 10.230 1.00 0.00 O ATOM 1136 CB ALA A 77 -2.802 -15.222 11.333 1.00 0.00 C ATOM 0 H ALA A 77 -2.787 -17.705 11.783 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.178 -16.082 9.419 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.610 -14.227 10.932 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -3.846 -15.295 11.638 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -2.159 -15.396 12.196 1.00 0.00 H new ATOM 1142 N SER A 78 -0.766 -15.177 8.934 1.00 0.00 N ATOM 1143 CA SER A 78 0.578 -14.713 8.620 1.00 0.00 C ATOM 1144 C SER A 78 0.499 -13.188 8.632 1.00 0.00 C ATOM 1145 O SER A 78 -0.362 -12.623 7.951 1.00 0.00 O ATOM 1146 CB SER A 78 1.032 -15.227 7.248 1.00 0.00 C ATOM 1147 OG SER A 78 1.086 -16.642 7.179 1.00 0.00 O ATOM 0 H SER A 78 -1.489 -14.666 8.427 1.00 0.00 H new ATOM 0 HA SER A 78 1.307 -15.083 9.341 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.350 -14.857 6.483 1.00 0.00 H new ATOM 0 HB3 SER A 78 2.017 -14.819 7.021 1.00 0.00 H new ATOM 0 HG SER A 78 1.379 -16.915 6.285 1.00 0.00 H new ATOM 1153 N ILE A 79 1.343 -12.527 9.423 1.00 0.00 N ATOM 1154 CA ILE A 79 1.379 -11.076 9.599 1.00 0.00 C ATOM 1155 C ILE A 79 2.851 -10.684 9.579 1.00 0.00 C ATOM 1156 O ILE A 79 3.667 -11.454 10.075 1.00 0.00 O ATOM 1157 CB ILE A 79 0.742 -10.700 10.963 1.00 0.00 C ATOM 1158 CG1 ILE A 79 -0.715 -11.193 11.138 1.00 0.00 C ATOM 1159 CG2 ILE A 79 0.776 -9.190 11.252 1.00 0.00 C ATOM 1160 CD1 ILE A 79 -0.805 -12.416 12.051 1.00 0.00 C ATOM 0 H ILE A 79 2.049 -13.007 9.981 1.00 0.00 H new ATOM 0 HA ILE A 79 0.822 -10.559 8.817 1.00 0.00 H new ATOM 0 HB ILE A 79 1.374 -11.223 11.681 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.322 -10.388 11.551 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -1.133 -11.439 10.162 1.00 0.00 H new ATOM 0 HG21 ILE A 79 0.315 -8.994 12.220 1.00 0.00 H new ATOM 0 HG22 ILE A 79 1.810 -8.845 11.266 1.00 0.00 H new ATOM 0 HG23 ILE A 79 0.227 -8.658 10.475 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.846 -12.725 12.143 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -0.221 -13.232 11.625 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -0.412 -12.164 13.036 1.00 0.00 H new ATOM 1172 N TYR A 80 3.192 -9.500 9.067 1.00 0.00 N ATOM 1173 CA TYR A 80 4.522 -8.900 9.136 1.00 0.00 C ATOM 1174 C TYR A 80 4.391 -7.371 9.165 1.00 0.00 C ATOM 1175 O TYR A 80 3.282 -6.831 9.064 1.00 0.00 O ATOM 1176 CB TYR A 80 5.373 -9.379 7.945 1.00 0.00 C ATOM 1177 CG TYR A 80 6.701 -10.001 8.349 1.00 0.00 C ATOM 1178 CD1 TYR A 80 6.729 -11.182 9.115 1.00 0.00 C ATOM 1179 CD2 TYR A 80 7.916 -9.405 7.965 1.00 0.00 C ATOM 1180 CE1 TYR A 80 7.941 -11.744 9.532 1.00 0.00 C ATOM 1181 CE2 TYR A 80 9.140 -9.974 8.364 1.00 0.00 C ATOM 1182 CZ TYR A 80 9.154 -11.145 9.154 1.00 0.00 C ATOM 1183 OH TYR A 80 10.320 -11.730 9.534 1.00 0.00 O ATOM 0 H TYR A 80 2.521 -8.911 8.574 1.00 0.00 H new ATOM 0 HA TYR A 80 5.027 -9.213 10.050 1.00 0.00 H new ATOM 0 HB2 TYR A 80 4.801 -10.108 7.372 1.00 0.00 H new ATOM 0 HB3 TYR A 80 5.565 -8.534 7.284 1.00 0.00 H new ATOM 0 HD1 TYR A 80 5.800 -11.662 9.385 1.00 0.00 H new ATOM 0 HD2 TYR A 80 7.910 -8.509 7.363 1.00 0.00 H new ATOM 0 HE1 TYR A 80 7.944 -12.635 10.142 1.00 0.00 H new ATOM 0 HE2 TYR A 80 10.071 -9.514 8.066 1.00 0.00 H new ATOM 0 HH TYR A 80 11.075 -11.203 9.199 1.00 0.00 H new ATOM 1193 N GLY A 81 5.505 -6.659 9.336 1.00 0.00 N ATOM 1194 CA GLY A 81 5.574 -5.214 9.154 1.00 0.00 C ATOM 1195 C GLY A 81 6.106 -4.946 7.753 1.00 0.00 C ATOM 1196 O GLY A 81 7.033 -5.641 7.326 1.00 0.00 O ATOM 0 H GLY A 81 6.395 -7.077 9.608 1.00 0.00 H new ATOM 0 HA2 GLY A 81 4.589 -4.766 9.281 1.00 0.00 H new ATOM 0 HA3 GLY A 81 6.227 -4.765 9.903 1.00 0.00 H new ATOM 1200 N VAL A 82 5.547 -3.964 7.043 1.00 0.00 N ATOM 1201 CA VAL A 82 6.029 -3.569 5.716 1.00 0.00 C ATOM 1202 C VAL A 82 6.199 -2.043 5.645 1.00 0.00 C ATOM 1203 O VAL A 82 5.627 -1.308 6.456 1.00 0.00 O ATOM 1204 CB VAL A 82 5.136 -4.167 4.602 1.00 0.00 C ATOM 1205 CG1 VAL A 82 5.061 -5.694 4.682 1.00 0.00 C ATOM 1206 CG2 VAL A 82 3.704 -3.639 4.589 1.00 0.00 C ATOM 0 H VAL A 82 4.748 -3.420 7.370 1.00 0.00 H new ATOM 0 HA VAL A 82 7.020 -3.989 5.542 1.00 0.00 H new ATOM 0 HB VAL A 82 5.629 -3.848 3.684 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.424 -6.069 3.881 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.062 -6.113 4.577 1.00 0.00 H new ATOM 0 HG13 VAL A 82 4.644 -5.988 5.645 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.150 -4.111 3.778 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.223 -3.869 5.539 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.716 -2.559 4.441 1.00 0.00 H new ATOM 1216 N VAL A 83 7.007 -1.569 4.692 1.00 0.00 N ATOM 1217 CA VAL A 83 7.491 -0.187 4.606 1.00 0.00 C ATOM 1218 C VAL A 83 7.127 0.392 3.258 1.00 0.00 C ATOM 1219 O VAL A 83 7.295 -0.305 2.254 1.00 0.00 O ATOM 1220 CB VAL A 83 9.016 -0.125 4.819 1.00 0.00 C ATOM 1221 CG1 VAL A 83 9.274 -0.257 6.312 1.00 0.00 C ATOM 1222 CG2 VAL A 83 9.831 -1.188 4.056 1.00 0.00 C ATOM 0 H VAL A 83 7.354 -2.156 3.934 1.00 0.00 H new ATOM 0 HA VAL A 83 7.017 0.400 5.392 1.00 0.00 H new ATOM 0 HB VAL A 83 9.356 0.828 4.412 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.347 -0.217 6.501 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.782 0.560 6.840 1.00 0.00 H new ATOM 0 HG13 VAL A 83 8.878 -1.209 6.667 1.00 0.00 H new ATOM 0 HG21 VAL A 83 10.891 -1.059 4.273 1.00 0.00 H new ATOM 0 HG22 VAL A 83 9.515 -2.183 4.370 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.664 -1.075 2.985 1.00 0.00 H new ATOM 1232 N GLY A 84 6.625 1.627 3.231 1.00 0.00 N ATOM 1233 CA GLY A 84 6.034 2.233 2.052 1.00 0.00 C ATOM 1234 C GLY A 84 6.616 3.597 1.727 1.00 0.00 C ATOM 1235 O GLY A 84 7.355 4.196 2.514 1.00 0.00 O ATOM 0 H GLY A 84 6.621 2.240 4.046 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.179 1.570 1.199 1.00 0.00 H new ATOM 0 HA3 GLY A 84 4.959 2.330 2.201 1.00 0.00 H new ATOM 1239 N VAL A 85 6.290 4.072 0.535 1.00 0.00 N ATOM 1240 CA VAL A 85 6.537 5.401 0.022 1.00 0.00 C ATOM 1241 C VAL A 85 5.437 5.695 -0.998 1.00 0.00 C ATOM 1242 O VAL A 85 4.906 4.779 -1.642 1.00 0.00 O ATOM 1243 CB VAL A 85 7.963 5.501 -0.566 1.00 0.00 C ATOM 1244 CG1 VAL A 85 8.155 4.625 -1.812 1.00 0.00 C ATOM 1245 CG2 VAL A 85 8.332 6.954 -0.898 1.00 0.00 C ATOM 0 H VAL A 85 5.808 3.488 -0.149 1.00 0.00 H new ATOM 0 HA VAL A 85 6.500 6.154 0.810 1.00 0.00 H new ATOM 0 HB VAL A 85 8.631 5.128 0.210 1.00 0.00 H new ATOM 0 HG11 VAL A 85 9.175 4.736 -2.181 1.00 0.00 H new ATOM 0 HG12 VAL A 85 7.974 3.581 -1.555 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.453 4.935 -2.586 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.341 6.988 -1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 85 7.628 7.350 -1.630 1.00 0.00 H new ATOM 0 HG23 VAL A 85 8.289 7.557 0.009 1.00 0.00 H new ATOM 1255 N GLY A 86 5.083 6.960 -1.157 1.00 0.00 N ATOM 1256 CA GLY A 86 4.363 7.490 -2.298 1.00 0.00 C ATOM 1257 C GLY A 86 5.108 8.709 -2.819 1.00 0.00 C ATOM 1258 O GLY A 86 5.891 9.311 -2.073 1.00 0.00 O ATOM 0 H GLY A 86 5.300 7.675 -0.462 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.282 6.734 -3.079 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.347 7.762 -2.011 1.00 0.00 H new ATOM 1262 N TYR A 87 4.873 9.069 -4.079 1.00 0.00 N ATOM 1263 CA TYR A 87 5.408 10.283 -4.685 1.00 0.00 C ATOM 1264 C TYR A 87 4.277 11.094 -5.315 1.00 0.00 C ATOM 1265 O TYR A 87 3.655 10.654 -6.289 1.00 0.00 O ATOM 1266 CB TYR A 87 6.480 9.931 -5.735 1.00 0.00 C ATOM 1267 CG TYR A 87 7.805 10.644 -5.557 1.00 0.00 C ATOM 1268 CD1 TYR A 87 7.854 12.045 -5.400 1.00 0.00 C ATOM 1269 CD2 TYR A 87 9.001 9.903 -5.581 1.00 0.00 C ATOM 1270 CE1 TYR A 87 9.087 12.696 -5.222 1.00 0.00 C ATOM 1271 CE2 TYR A 87 10.233 10.545 -5.393 1.00 0.00 C ATOM 1272 CZ TYR A 87 10.279 11.941 -5.188 1.00 0.00 C ATOM 1273 OH TYR A 87 11.467 12.558 -4.962 1.00 0.00 O ATOM 0 H TYR A 87 4.298 8.517 -4.715 1.00 0.00 H new ATOM 0 HA TYR A 87 5.878 10.888 -3.910 1.00 0.00 H new ATOM 0 HB2 TYR A 87 6.656 8.856 -5.707 1.00 0.00 H new ATOM 0 HB3 TYR A 87 6.088 10.164 -6.725 1.00 0.00 H new ATOM 0 HD1 TYR A 87 6.940 12.620 -5.417 1.00 0.00 H new ATOM 0 HD2 TYR A 87 8.970 8.836 -5.745 1.00 0.00 H new ATOM 0 HE1 TYR A 87 9.122 13.770 -5.112 1.00 0.00 H new ATOM 0 HE2 TYR A 87 11.148 9.971 -5.405 1.00 0.00 H new ATOM 0 HH TYR A 87 12.187 11.894 -4.970 1.00 0.00 H new ATOM 1283 N GLY A 88 4.043 12.302 -4.810 1.00 0.00 N ATOM 1284 CA GLY A 88 3.200 13.314 -5.427 1.00 0.00 C ATOM 1285 C GLY A 88 4.009 14.088 -6.459 1.00 0.00 C ATOM 1286 O GLY A 88 4.931 14.798 -6.066 1.00 0.00 O ATOM 0 H GLY A 88 4.451 12.611 -3.928 1.00 0.00 H new ATOM 0 HA2 GLY A 88 2.338 12.845 -5.902 1.00 0.00 H new ATOM 0 HA3 GLY A 88 2.814 13.994 -4.667 1.00 0.00 H new ATOM 1290 N LYS A 89 3.695 13.955 -7.758 1.00 0.00 N ATOM 1291 CA LYS A 89 4.347 14.723 -8.828 1.00 0.00 C ATOM 1292 C LYS A 89 4.283 16.232 -8.575 1.00 0.00 C ATOM 1293 O LYS A 89 5.305 16.909 -8.545 1.00 0.00 O ATOM 1294 CB LYS A 89 3.656 14.412 -10.164 1.00 0.00 C ATOM 1295 CG LYS A 89 4.260 13.254 -10.961 1.00 0.00 C ATOM 1296 CD LYS A 89 5.436 13.727 -11.807 1.00 0.00 C ATOM 1297 CE LYS A 89 5.877 12.658 -12.804 1.00 0.00 C ATOM 1298 NZ LYS A 89 6.939 13.183 -13.674 1.00 0.00 N ATOM 0 H LYS A 89 2.980 13.310 -8.095 1.00 0.00 H new ATOM 0 HA LYS A 89 5.397 14.431 -8.854 1.00 0.00 H new ATOM 0 HB2 LYS A 89 2.607 14.188 -9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 89 3.680 15.309 -10.783 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.590 12.471 -10.278 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.498 12.815 -11.605 1.00 0.00 H new ATOM 0 HD2 LYS A 89 5.157 14.633 -12.344 1.00 0.00 H new ATOM 0 HD3 LYS A 89 6.272 13.986 -11.157 1.00 0.00 H new ATOM 0 HE2 LYS A 89 6.236 11.778 -12.270 1.00 0.00 H new ATOM 0 HE3 LYS A 89 5.027 12.340 -13.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 7.231 12.447 -14.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 6.583 14.009 -14.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 7.755 13.465 -13.094 1.00 0.00 H new ATOM 1312 N PHE A 90 3.063 16.755 -8.464 1.00 0.00 N ATOM 1313 CA PHE A 90 2.763 18.164 -8.270 1.00 0.00 C ATOM 1314 C PHE A 90 1.502 18.239 -7.424 1.00 0.00 C ATOM 1315 O PHE A 90 1.588 18.699 -6.288 1.00 0.00 O ATOM 1316 CB PHE A 90 2.608 18.898 -9.613 1.00 0.00 C ATOM 1317 CG PHE A 90 3.868 19.568 -10.122 1.00 0.00 C ATOM 1318 CD1 PHE A 90 4.435 20.635 -9.397 1.00 0.00 C ATOM 1319 CD2 PHE A 90 4.452 19.164 -11.338 1.00 0.00 C ATOM 1320 CE1 PHE A 90 5.578 21.292 -9.883 1.00 0.00 C ATOM 1321 CE2 PHE A 90 5.588 19.831 -11.829 1.00 0.00 C ATOM 1322 CZ PHE A 90 6.152 20.895 -11.103 1.00 0.00 C ATOM 0 H PHE A 90 2.223 16.179 -8.509 1.00 0.00 H new ATOM 0 HA PHE A 90 3.584 18.667 -7.759 1.00 0.00 H new ATOM 0 HB2 PHE A 90 2.265 18.185 -10.363 1.00 0.00 H new ATOM 0 HB3 PHE A 90 1.828 19.653 -9.510 1.00 0.00 H new ATOM 0 HD1 PHE A 90 3.989 20.949 -8.465 1.00 0.00 H new ATOM 0 HD2 PHE A 90 4.027 18.341 -11.894 1.00 0.00 H new ATOM 0 HE1 PHE A 90 6.016 22.102 -9.319 1.00 0.00 H new ATOM 0 HE2 PHE A 90 6.029 19.525 -12.766 1.00 0.00 H new ATOM 0 HZ PHE A 90 7.025 21.406 -11.482 1.00 0.00 H new ATOM 1332 N GLN A 91 0.349 17.745 -7.913 1.00 0.00 N ATOM 1333 CA GLN A 91 -0.931 17.787 -7.220 1.00 0.00 C ATOM 1334 C GLN A 91 -1.471 19.222 -7.240 1.00 0.00 C ATOM 1335 O GLN A 91 -2.555 19.440 -7.775 1.00 0.00 O ATOM 1336 CB GLN A 91 -0.828 17.170 -5.808 1.00 0.00 C ATOM 1337 CG GLN A 91 -2.090 16.424 -5.371 1.00 0.00 C ATOM 1338 CD GLN A 91 -2.193 16.340 -3.852 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -3.207 16.720 -3.283 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -1.213 15.809 -3.148 1.00 0.00 N ATOM 0 H GLN A 91 0.292 17.296 -8.827 1.00 0.00 H new ATOM 0 HA GLN A 91 -1.659 17.165 -7.741 1.00 0.00 H new ATOM 0 HB2 GLN A 91 0.017 16.483 -5.782 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -0.617 17.962 -5.089 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -2.969 16.931 -5.769 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -2.084 15.419 -5.792 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -0.364 15.490 -3.615 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -1.303 15.717 -2.136 1.00 0.00 H new ATOM 1349 N THR A 92 -0.727 20.210 -6.748 1.00 0.00 N ATOM 1350 CA THR A 92 -0.995 21.608 -6.990 1.00 0.00 C ATOM 1351 C THR A 92 -0.747 21.841 -8.476 1.00 0.00 C ATOM 1352 O THR A 92 0.382 21.716 -8.952 1.00 0.00 O ATOM 1353 CB THR A 92 -0.164 22.508 -6.049 1.00 0.00 C ATOM 1354 OG1 THR A 92 -0.478 23.871 -6.259 1.00 0.00 O ATOM 1355 CG2 THR A 92 1.362 22.358 -6.124 1.00 0.00 C ATOM 0 H THR A 92 0.091 20.049 -6.161 1.00 0.00 H new ATOM 0 HA THR A 92 -2.025 21.879 -6.760 1.00 0.00 H new ATOM 0 HB THR A 92 -0.452 22.160 -5.057 1.00 0.00 H new ATOM 0 HG1 THR A 92 0.283 24.320 -6.683 1.00 0.00 H new ATOM 0 HG21 THR A 92 1.830 23.042 -5.416 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.640 21.334 -5.876 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.701 22.591 -7.133 1.00 0.00 H new ATOM 1363 N THR A 93 -1.803 22.152 -9.212 1.00 0.00 N ATOM 1364 CA THR A 93 -1.681 22.659 -10.572 1.00 0.00 C ATOM 1365 C THR A 93 -2.320 24.046 -10.629 1.00 0.00 C ATOM 1366 O THR A 93 -3.440 24.205 -11.100 1.00 0.00 O ATOM 1367 CB THR A 93 -2.196 21.630 -11.593 1.00 0.00 C ATOM 1368 OG1 THR A 93 -3.487 21.141 -11.305 1.00 0.00 O ATOM 1369 CG2 THR A 93 -1.272 20.418 -11.693 1.00 0.00 C ATOM 0 H THR A 93 -2.765 22.061 -8.886 1.00 0.00 H new ATOM 0 HA THR A 93 -0.639 22.795 -10.862 1.00 0.00 H new ATOM 0 HB THR A 93 -2.224 22.182 -12.533 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.415 20.323 -10.769 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.671 19.715 -12.424 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.279 20.742 -12.005 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.205 19.930 -10.720 1.00 0.00 H new ATOM 1377 N GLU A 94 -1.614 25.037 -10.064 1.00 0.00 N ATOM 1378 CA GLU A 94 -1.859 26.481 -10.217 1.00 0.00 C ATOM 1379 C GLU A 94 -3.292 26.933 -9.851 1.00 0.00 C ATOM 1380 O GLU A 94 -3.724 28.034 -10.192 1.00 0.00 O ATOM 1381 CB GLU A 94 -1.349 26.922 -11.606 1.00 0.00 C ATOM 1382 CG GLU A 94 0.190 26.816 -11.653 1.00 0.00 C ATOM 1383 CD GLU A 94 0.760 26.810 -13.070 1.00 0.00 C ATOM 1384 OE1 GLU A 94 0.576 25.795 -13.781 1.00 0.00 O ATOM 1385 OE2 GLU A 94 1.482 27.762 -13.442 1.00 0.00 O ATOM 0 H GLU A 94 -0.817 24.845 -9.458 1.00 0.00 H new ATOM 0 HA GLU A 94 -1.282 27.021 -9.467 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -1.790 26.296 -12.382 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.659 27.947 -11.809 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.620 27.652 -11.101 1.00 0.00 H new ATOM 0 HG3 GLU A 94 0.499 25.904 -11.142 1.00 0.00 H new ATOM 1392 N TYR A 95 -4.010 26.107 -9.088 1.00 0.00 N ATOM 1393 CA TYR A 95 -5.354 26.339 -8.576 1.00 0.00 C ATOM 1394 C TYR A 95 -5.385 26.291 -7.043 1.00 0.00 C ATOM 1395 O TYR A 95 -5.806 27.276 -6.440 1.00 0.00 O ATOM 1396 CB TYR A 95 -6.359 25.369 -9.222 1.00 0.00 C ATOM 1397 CG TYR A 95 -7.006 25.893 -10.490 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -8.006 26.879 -10.395 1.00 0.00 C ATOM 1399 CD2 TYR A 95 -6.636 25.399 -11.755 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -8.645 27.371 -11.546 1.00 0.00 C ATOM 1401 CE2 TYR A 95 -7.276 25.880 -12.913 1.00 0.00 C ATOM 1402 CZ TYR A 95 -8.291 26.860 -12.813 1.00 0.00 C ATOM 1403 OH TYR A 95 -8.929 27.294 -13.935 1.00 0.00 O ATOM 0 H TYR A 95 -3.641 25.202 -8.795 1.00 0.00 H new ATOM 0 HA TYR A 95 -5.660 27.347 -8.856 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.848 24.433 -9.449 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -7.140 25.138 -8.498 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -8.286 27.262 -9.425 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -5.861 24.651 -11.837 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -9.403 28.136 -11.461 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -6.991 25.499 -13.882 1.00 0.00 H new ATOM 0 HH TYR A 95 -8.558 26.838 -14.719 1.00 0.00 H new ATOM 1413 N PRO A 96 -4.956 25.213 -6.353 1.00 0.00 N ATOM 1414 CA PRO A 96 -5.135 25.105 -4.907 1.00 0.00 C ATOM 1415 C PRO A 96 -4.045 25.847 -4.116 1.00 0.00 C ATOM 1416 O PRO A 96 -3.434 25.265 -3.221 1.00 0.00 O ATOM 1417 CB PRO A 96 -5.179 23.601 -4.640 1.00 0.00 C ATOM 1418 CG PRO A 96 -4.171 23.070 -5.655 1.00 0.00 C ATOM 1419 CD PRO A 96 -4.430 23.956 -6.875 1.00 0.00 C ATOM 0 HA PRO A 96 -6.048 25.592 -4.565 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -4.893 23.360 -3.616 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.175 23.187 -4.799 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -3.146 23.164 -5.296 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -4.336 22.016 -5.877 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -3.512 24.121 -7.439 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.142 23.487 -7.554 1.00 0.00 H new ATOM 1427 N THR A 97 -3.832 27.128 -4.425 1.00 0.00 N ATOM 1428 CA THR A 97 -2.919 28.056 -3.759 1.00 0.00 C ATOM 1429 C THR A 97 -1.527 27.437 -3.532 1.00 0.00 C ATOM 1430 O THR A 97 -1.176 27.135 -2.387 1.00 0.00 O ATOM 1431 CB THR A 97 -3.579 28.613 -2.473 1.00 0.00 C ATOM 1432 OG1 THR A 97 -3.800 27.582 -1.528 1.00 0.00 O ATOM 1433 CG2 THR A 97 -4.923 29.303 -2.746 1.00 0.00 C ATOM 0 H THR A 97 -4.326 27.573 -5.199 1.00 0.00 H new ATOM 0 HA THR A 97 -2.735 28.907 -4.415 1.00 0.00 H new ATOM 0 HB THR A 97 -2.879 29.350 -2.079 1.00 0.00 H new ATOM 0 HG1 THR A 97 -2.975 27.067 -1.406 1.00 0.00 H new ATOM 0 HG21 THR A 97 -5.339 29.673 -1.809 1.00 0.00 H new ATOM 0 HG22 THR A 97 -4.771 30.138 -3.431 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.615 28.589 -3.193 1.00 0.00 H new ATOM 1441 N TYR A 98 -0.777 27.228 -4.628 1.00 0.00 N ATOM 1442 CA TYR A 98 0.616 26.760 -4.694 1.00 0.00 C ATOM 1443 C TYR A 98 0.992 25.829 -3.535 1.00 0.00 C ATOM 1444 O TYR A 98 1.826 26.155 -2.681 1.00 0.00 O ATOM 1445 CB TYR A 98 1.553 27.968 -4.811 1.00 0.00 C ATOM 1446 CG TYR A 98 1.485 28.679 -6.148 1.00 0.00 C ATOM 1447 CD1 TYR A 98 1.990 28.044 -7.299 1.00 0.00 C ATOM 1448 CD2 TYR A 98 0.951 29.979 -6.241 1.00 0.00 C ATOM 1449 CE1 TYR A 98 1.972 28.711 -8.536 1.00 0.00 C ATOM 1450 CE2 TYR A 98 0.944 30.657 -7.473 1.00 0.00 C ATOM 1451 CZ TYR A 98 1.463 30.028 -8.626 1.00 0.00 C ATOM 1452 OH TYR A 98 1.501 30.719 -9.798 1.00 0.00 O ATOM 0 H TYR A 98 -1.158 27.395 -5.559 1.00 0.00 H new ATOM 0 HA TYR A 98 0.728 26.145 -5.587 1.00 0.00 H new ATOM 0 HB2 TYR A 98 1.311 28.679 -4.021 1.00 0.00 H new ATOM 0 HB3 TYR A 98 2.577 27.637 -4.640 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.391 27.044 -7.231 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.545 30.457 -5.362 1.00 0.00 H new ATOM 0 HE1 TYR A 98 2.348 28.217 -9.420 1.00 0.00 H new ATOM 0 HE2 TYR A 98 0.542 31.657 -7.537 1.00 0.00 H new ATOM 0 HH TYR A 98 1.105 31.606 -9.668 1.00 0.00 H new ATOM 1462 N LYS A 99 0.305 24.684 -3.449 1.00 0.00 N ATOM 1463 CA LYS A 99 0.257 23.949 -2.191 1.00 0.00 C ATOM 1464 C LYS A 99 1.537 23.160 -1.918 1.00 0.00 C ATOM 1465 O LYS A 99 2.032 23.209 -0.791 1.00 0.00 O ATOM 1466 CB LYS A 99 -1.008 23.074 -2.102 1.00 0.00 C ATOM 1467 CG LYS A 99 -1.494 22.922 -0.649 1.00 0.00 C ATOM 1468 CD LYS A 99 -2.070 24.207 -0.016 1.00 0.00 C ATOM 1469 CE LYS A 99 -2.375 23.971 1.471 1.00 0.00 C ATOM 1470 NZ LYS A 99 -2.680 25.220 2.207 1.00 0.00 N ATOM 0 H LYS A 99 -0.212 24.258 -4.218 1.00 0.00 H new ATOM 0 HA LYS A 99 0.194 24.688 -1.392 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -1.800 23.517 -2.706 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -0.800 22.090 -2.521 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -2.258 22.145 -0.617 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -0.661 22.576 -0.037 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.358 25.026 -0.124 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -2.979 24.504 -0.539 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.221 23.289 1.558 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -1.521 23.481 1.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.877 24.996 3.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.865 25.864 2.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -3.512 25.678 1.784 1.00 0.00 H new ATOM 1484 N ASN A 100 2.047 22.415 -2.902 1.00 0.00 N ATOM 1485 CA ASN A 100 3.157 21.478 -2.726 1.00 0.00 C ATOM 1486 C ASN A 100 3.938 21.311 -4.033 1.00 0.00 C ATOM 1487 O ASN A 100 3.890 20.259 -4.668 1.00 0.00 O ATOM 1488 CB ASN A 100 2.588 20.137 -2.239 1.00 0.00 C ATOM 1489 CG ASN A 100 3.668 19.127 -1.885 1.00 0.00 C ATOM 1490 OD1 ASN A 100 3.635 17.983 -2.332 1.00 0.00 O ATOM 1491 ND2 ASN A 100 4.563 19.470 -0.977 1.00 0.00 N ATOM 0 H ASN A 100 1.694 22.447 -3.858 1.00 0.00 H new ATOM 0 HA ASN A 100 3.856 21.864 -1.984 1.00 0.00 H new ATOM 0 HB2 ASN A 100 1.960 20.311 -1.365 1.00 0.00 H new ATOM 0 HB3 ASN A 100 1.946 19.718 -3.014 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.236 18.782 -0.639 1.00 0.00 H new ATOM 0 HD22 ASN A 100 4.581 20.423 -0.613 1.00 0.00 H new ATOM 1498 N ASP A 101 4.587 22.385 -4.473 1.00 0.00 N ATOM 1499 CA ASP A 101 5.243 22.495 -5.776 1.00 0.00 C ATOM 1500 C ASP A 101 6.459 21.568 -5.824 1.00 0.00 C ATOM 1501 O ASP A 101 6.541 20.660 -6.654 1.00 0.00 O ATOM 1502 CB ASP A 101 5.654 23.952 -6.047 1.00 0.00 C ATOM 1503 CG ASP A 101 4.447 24.871 -6.217 1.00 0.00 C ATOM 1504 OD1 ASP A 101 3.983 25.409 -5.186 1.00 0.00 O ATOM 1505 OD2 ASP A 101 3.969 25.053 -7.357 1.00 0.00 O ATOM 0 H ASP A 101 4.675 23.234 -3.914 1.00 0.00 H new ATOM 0 HA ASP A 101 4.543 22.191 -6.555 1.00 0.00 H new ATOM 0 HB2 ASP A 101 6.270 24.313 -5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.269 23.993 -6.946 1.00 0.00 H new ATOM 1510 N THR A 102 7.411 21.793 -4.921 1.00 0.00 N ATOM 1511 CA THR A 102 8.653 21.051 -4.775 1.00 0.00 C ATOM 1512 C THR A 102 8.329 19.629 -4.288 1.00 0.00 C ATOM 1513 O THR A 102 8.100 19.435 -3.086 1.00 0.00 O ATOM 1514 CB THR A 102 9.545 21.841 -3.791 1.00 0.00 C ATOM 1515 OG1 THR A 102 9.620 23.200 -4.194 1.00 0.00 O ATOM 1516 CG2 THR A 102 10.965 21.290 -3.669 1.00 0.00 C ATOM 0 H THR A 102 7.328 22.542 -4.234 1.00 0.00 H new ATOM 0 HA THR A 102 9.191 20.944 -5.717 1.00 0.00 H new ATOM 0 HB THR A 102 9.074 21.741 -2.813 1.00 0.00 H new ATOM 0 HG1 THR A 102 10.185 23.697 -3.566 1.00 0.00 H new ATOM 0 HG21 THR A 102 11.531 21.896 -2.961 1.00 0.00 H new ATOM 0 HG22 THR A 102 10.926 20.260 -3.315 1.00 0.00 H new ATOM 0 HG23 THR A 102 11.452 21.321 -4.644 1.00 0.00 H new ATOM 1524 N SER A 103 8.250 18.647 -5.193 1.00 0.00 N ATOM 1525 CA SER A 103 7.866 17.286 -4.827 1.00 0.00 C ATOM 1526 C SER A 103 8.924 16.635 -3.929 1.00 0.00 C ATOM 1527 O SER A 103 10.096 17.027 -3.913 1.00 0.00 O ATOM 1528 CB SER A 103 7.522 16.442 -6.065 1.00 0.00 C ATOM 1529 OG SER A 103 8.429 16.578 -7.148 1.00 0.00 O ATOM 0 H SER A 103 8.448 18.774 -6.186 1.00 0.00 H new ATOM 0 HA SER A 103 6.951 17.339 -4.237 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.482 15.393 -5.772 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.524 16.716 -6.408 1.00 0.00 H new ATOM 0 HG SER A 103 8.139 16.009 -7.891 1.00 0.00 H new ATOM 1535 N ASP A 104 8.510 15.644 -3.142 1.00 0.00 N ATOM 1536 CA ASP A 104 9.323 15.018 -2.105 1.00 0.00 C ATOM 1537 C ASP A 104 8.793 13.606 -1.845 1.00 0.00 C ATOM 1538 O ASP A 104 7.688 13.279 -2.288 1.00 0.00 O ATOM 1539 CB ASP A 104 9.224 15.897 -0.858 1.00 0.00 C ATOM 1540 CG ASP A 104 10.032 15.372 0.321 1.00 0.00 C ATOM 1541 OD1 ASP A 104 11.275 15.293 0.208 1.00 0.00 O ATOM 1542 OD2 ASP A 104 9.418 15.068 1.362 1.00 0.00 O ATOM 0 H ASP A 104 7.574 15.244 -3.211 1.00 0.00 H new ATOM 0 HA ASP A 104 10.368 14.930 -2.401 1.00 0.00 H new ATOM 0 HB2 ASP A 104 9.566 16.902 -1.104 1.00 0.00 H new ATOM 0 HB3 ASP A 104 8.178 15.979 -0.563 1.00 0.00 H new ATOM 1547 N TYR A 105 9.546 12.768 -1.137 1.00 0.00 N ATOM 1548 CA TYR A 105 9.140 11.411 -0.799 1.00 0.00 C ATOM 1549 C TYR A 105 8.161 11.431 0.379 1.00 0.00 C ATOM 1550 O TYR A 105 8.420 12.064 1.403 1.00 0.00 O ATOM 1551 CB TYR A 105 10.381 10.539 -0.520 1.00 0.00 C ATOM 1552 CG TYR A 105 11.189 10.834 0.743 1.00 0.00 C ATOM 1553 CD1 TYR A 105 11.895 12.045 0.901 1.00 0.00 C ATOM 1554 CD2 TYR A 105 11.273 9.861 1.759 1.00 0.00 C ATOM 1555 CE1 TYR A 105 12.647 12.297 2.061 1.00 0.00 C ATOM 1556 CE2 TYR A 105 12.041 10.093 2.915 1.00 0.00 C ATOM 1557 CZ TYR A 105 12.729 11.316 3.071 1.00 0.00 C ATOM 1558 OH TYR A 105 13.503 11.526 4.167 1.00 0.00 O ATOM 0 H TYR A 105 10.467 13.018 -0.778 1.00 0.00 H new ATOM 0 HA TYR A 105 8.617 10.964 -1.644 1.00 0.00 H new ATOM 0 HB2 TYR A 105 10.057 9.499 -0.475 1.00 0.00 H new ATOM 0 HB3 TYR A 105 11.051 10.627 -1.375 1.00 0.00 H new ATOM 0 HD1 TYR A 105 11.857 12.789 0.119 1.00 0.00 H new ATOM 0 HD2 TYR A 105 10.742 8.927 1.649 1.00 0.00 H new ATOM 0 HE1 TYR A 105 13.161 13.240 2.179 1.00 0.00 H new ATOM 0 HE2 TYR A 105 12.104 9.336 3.683 1.00 0.00 H new ATOM 0 HH TYR A 105 13.444 10.750 4.763 1.00 0.00 H new ATOM 1568 N GLY A 106 7.039 10.723 0.259 1.00 0.00 N ATOM 1569 CA GLY A 106 6.092 10.522 1.344 1.00 0.00 C ATOM 1570 C GLY A 106 6.277 9.119 1.897 1.00 0.00 C ATOM 1571 O GLY A 106 5.540 8.225 1.471 1.00 0.00 O ATOM 0 H GLY A 106 6.762 10.267 -0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 106 6.253 11.262 2.128 1.00 0.00 H new ATOM 0 HA3 GLY A 106 5.072 10.655 0.985 1.00 0.00 H new ATOM 1575 N PHE A 107 7.250 8.906 2.787 1.00 0.00 N ATOM 1576 CA PHE A 107 7.577 7.592 3.337 1.00 0.00 C ATOM 1577 C PHE A 107 6.477 7.196 4.322 1.00 0.00 C ATOM 1578 O PHE A 107 5.852 8.068 4.947 1.00 0.00 O ATOM 1579 CB PHE A 107 8.942 7.635 4.052 1.00 0.00 C ATOM 1580 CG PHE A 107 9.620 6.284 4.257 1.00 0.00 C ATOM 1581 CD1 PHE A 107 9.216 5.416 5.294 1.00 0.00 C ATOM 1582 CD2 PHE A 107 10.670 5.887 3.406 1.00 0.00 C ATOM 1583 CE1 PHE A 107 9.821 4.154 5.452 1.00 0.00 C ATOM 1584 CE2 PHE A 107 11.306 4.645 3.593 1.00 0.00 C ATOM 1585 CZ PHE A 107 10.881 3.776 4.613 1.00 0.00 C ATOM 0 H PHE A 107 7.840 9.654 3.150 1.00 0.00 H new ATOM 0 HA PHE A 107 7.640 6.858 2.533 1.00 0.00 H new ATOM 0 HB2 PHE A 107 9.613 8.275 3.479 1.00 0.00 H new ATOM 0 HB3 PHE A 107 8.808 8.106 5.026 1.00 0.00 H new ATOM 0 HD1 PHE A 107 8.435 5.723 5.974 1.00 0.00 H new ATOM 0 HD2 PHE A 107 10.989 6.539 2.606 1.00 0.00 H new ATOM 0 HE1 PHE A 107 9.470 3.478 6.218 1.00 0.00 H new ATOM 0 HE2 PHE A 107 12.125 4.358 2.950 1.00 0.00 H new ATOM 0 HZ PHE A 107 11.368 2.822 4.750 1.00 0.00 H new ATOM 1595 N SER A 108 6.241 5.897 4.480 1.00 0.00 N ATOM 1596 CA SER A 108 5.183 5.363 5.309 1.00 0.00 C ATOM 1597 C SER A 108 5.609 4.041 5.950 1.00 0.00 C ATOM 1598 O SER A 108 6.580 3.405 5.530 1.00 0.00 O ATOM 1599 CB SER A 108 3.908 5.267 4.455 1.00 0.00 C ATOM 1600 OG SER A 108 4.110 4.619 3.215 1.00 0.00 O ATOM 0 H SER A 108 6.797 5.175 4.021 1.00 0.00 H new ATOM 0 HA SER A 108 4.969 6.023 6.149 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.143 4.730 5.016 1.00 0.00 H new ATOM 0 HB3 SER A 108 3.525 6.271 4.274 1.00 0.00 H new ATOM 0 HG SER A 108 3.313 4.727 2.656 1.00 0.00 H new ATOM 1606 N TYR A 109 4.893 3.631 6.994 1.00 0.00 N ATOM 1607 CA TYR A 109 5.104 2.388 7.724 1.00 0.00 C ATOM 1608 C TYR A 109 3.723 1.841 8.072 1.00 0.00 C ATOM 1609 O TYR A 109 2.772 2.624 8.187 1.00 0.00 O ATOM 1610 CB TYR A 109 5.928 2.679 8.992 1.00 0.00 C ATOM 1611 CG TYR A 109 6.637 1.479 9.593 1.00 0.00 C ATOM 1612 CD1 TYR A 109 5.954 0.559 10.412 1.00 0.00 C ATOM 1613 CD2 TYR A 109 8.011 1.300 9.349 1.00 0.00 C ATOM 1614 CE1 TYR A 109 6.633 -0.547 10.956 1.00 0.00 C ATOM 1615 CE2 TYR A 109 8.695 0.198 9.883 1.00 0.00 C ATOM 1616 CZ TYR A 109 8.008 -0.735 10.686 1.00 0.00 C ATOM 1617 OH TYR A 109 8.683 -1.784 11.223 1.00 0.00 O ATOM 0 H TYR A 109 4.119 4.180 7.368 1.00 0.00 H new ATOM 0 HA TYR A 109 5.656 1.656 7.134 1.00 0.00 H new ATOM 0 HB2 TYR A 109 6.672 3.439 8.755 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.266 3.105 9.746 1.00 0.00 H new ATOM 0 HD1 TYR A 109 4.905 0.703 10.623 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.545 2.018 8.744 1.00 0.00 H new ATOM 0 HE1 TYR A 109 6.104 -1.252 11.580 1.00 0.00 H new ATOM 0 HE2 TYR A 109 9.747 0.064 9.679 1.00 0.00 H new ATOM 0 HH TYR A 109 9.618 -1.756 10.929 1.00 0.00 H new ATOM 1627 N GLY A 110 3.610 0.529 8.272 1.00 0.00 N ATOM 1628 CA GLY A 110 2.343 -0.118 8.554 1.00 0.00 C ATOM 1629 C GLY A 110 2.529 -1.618 8.743 1.00 0.00 C ATOM 1630 O GLY A 110 3.540 -2.045 9.313 1.00 0.00 O ATOM 0 H GLY A 110 4.402 -0.113 8.241 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.902 0.314 9.452 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.646 0.066 7.736 1.00 0.00 H new ATOM 1634 N ALA A 111 1.543 -2.424 8.348 1.00 0.00 N ATOM 1635 CA ALA A 111 1.600 -3.879 8.432 1.00 0.00 C ATOM 1636 C ALA A 111 1.016 -4.506 7.169 1.00 0.00 C ATOM 1637 O ALA A 111 0.206 -3.896 6.468 1.00 0.00 O ATOM 1638 CB ALA A 111 0.846 -4.374 9.674 1.00 0.00 C ATOM 0 H ALA A 111 0.669 -2.076 7.954 1.00 0.00 H new ATOM 0 HA ALA A 111 2.644 -4.181 8.519 1.00 0.00 H new ATOM 0 HB1 ALA A 111 0.898 -5.462 9.722 1.00 0.00 H new ATOM 0 HB2 ALA A 111 1.301 -3.949 10.569 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -0.197 -4.063 9.614 1.00 0.00 H new ATOM 1644 N GLY A 112 1.387 -5.758 6.915 1.00 0.00 N ATOM 1645 CA GLY A 112 0.880 -6.566 5.821 1.00 0.00 C ATOM 1646 C GLY A 112 0.591 -7.953 6.348 1.00 0.00 C ATOM 1647 O GLY A 112 1.389 -8.505 7.108 1.00 0.00 O ATOM 0 H GLY A 112 2.073 -6.250 7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.025 -6.121 5.408 1.00 0.00 H new ATOM 0 HA3 GLY A 112 1.610 -6.612 5.013 1.00 0.00 H new ATOM 1651 N LEU A 113 -0.574 -8.498 6.007 1.00 0.00 N ATOM 1652 CA LEU A 113 -1.062 -9.728 6.602 1.00 0.00 C ATOM 1653 C LEU A 113 -2.109 -10.357 5.707 1.00 0.00 C ATOM 1654 O LEU A 113 -2.923 -9.643 5.117 1.00 0.00 O ATOM 1655 CB LEU A 113 -1.625 -9.478 8.014 1.00 0.00 C ATOM 1656 CG LEU A 113 -2.781 -8.479 8.242 1.00 0.00 C ATOM 1657 CD1 LEU A 113 -3.129 -8.527 9.734 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -2.437 -7.012 7.943 1.00 0.00 C ATOM 0 H LEU A 113 -1.202 -8.096 5.311 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.225 -10.419 6.700 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -1.954 -10.442 8.402 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.792 -9.151 8.637 1.00 0.00 H new ATOM 0 HG LEU A 113 -3.581 -8.776 7.564 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -3.944 -7.833 9.940 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -3.435 -9.538 10.004 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.255 -8.244 10.321 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -3.310 -6.388 8.132 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -1.616 -6.693 8.585 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -2.140 -6.913 6.899 1.00 0.00 H new ATOM 1670 N GLN A 114 -2.113 -11.691 5.644 1.00 0.00 N ATOM 1671 CA GLN A 114 -3.116 -12.426 4.896 1.00 0.00 C ATOM 1672 C GLN A 114 -3.511 -13.713 5.605 1.00 0.00 C ATOM 1673 O GLN A 114 -2.692 -14.390 6.235 1.00 0.00 O ATOM 1674 CB GLN A 114 -2.673 -12.648 3.439 1.00 0.00 C ATOM 1675 CG GLN A 114 -1.824 -13.876 3.073 1.00 0.00 C ATOM 1676 CD GLN A 114 -0.343 -13.782 3.436 1.00 0.00 C ATOM 1677 OE1 GLN A 114 0.321 -12.783 3.172 1.00 0.00 O ATOM 1678 NE2 GLN A 114 0.233 -14.853 3.954 1.00 0.00 N ATOM 0 H GLN A 114 -1.423 -12.281 6.109 1.00 0.00 H new ATOM 0 HA GLN A 114 -4.020 -11.818 4.852 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.575 -12.683 2.828 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -2.114 -11.764 3.132 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -2.247 -14.750 3.569 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -1.907 -14.047 2.000 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -0.326 -15.678 4.170 1.00 0.00 H new ATOM 0 HE22 GLN A 114 1.236 -14.854 4.137 1.00 0.00 H new ATOM 1687 N PHE A 115 -4.784 -14.063 5.476 1.00 0.00 N ATOM 1688 CA PHE A 115 -5.358 -15.350 5.815 1.00 0.00 C ATOM 1689 C PHE A 115 -6.351 -15.654 4.702 1.00 0.00 C ATOM 1690 O PHE A 115 -7.310 -14.903 4.547 1.00 0.00 O ATOM 1691 CB PHE A 115 -6.021 -15.261 7.195 1.00 0.00 C ATOM 1692 CG PHE A 115 -6.847 -16.477 7.560 1.00 0.00 C ATOM 1693 CD1 PHE A 115 -6.262 -17.757 7.562 1.00 0.00 C ATOM 1694 CD2 PHE A 115 -8.207 -16.332 7.893 1.00 0.00 C ATOM 1695 CE1 PHE A 115 -7.034 -18.889 7.873 1.00 0.00 C ATOM 1696 CE2 PHE A 115 -8.972 -17.463 8.221 1.00 0.00 C ATOM 1697 CZ PHE A 115 -8.390 -18.742 8.201 1.00 0.00 C ATOM 0 H PHE A 115 -5.481 -13.415 5.110 1.00 0.00 H new ATOM 0 HA PHE A 115 -4.620 -16.149 5.885 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -5.248 -15.120 7.950 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -6.660 -14.378 7.224 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -5.215 -17.870 7.323 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -8.661 -15.352 7.896 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.584 -19.871 7.860 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -10.012 -17.349 8.490 1.00 0.00 H new ATOM 0 HZ PHE A 115 -8.986 -19.611 8.438 1.00 0.00 H new ATOM 1707 N ASN A 116 -6.095 -16.651 3.855 1.00 0.00 N ATOM 1708 CA ASN A 116 -7.066 -17.069 2.843 1.00 0.00 C ATOM 1709 C ASN A 116 -8.180 -17.850 3.550 1.00 0.00 C ATOM 1710 O ASN A 116 -7.882 -18.879 4.155 1.00 0.00 O ATOM 1711 CB ASN A 116 -6.408 -17.854 1.685 1.00 0.00 C ATOM 1712 CG ASN A 116 -6.829 -19.323 1.573 1.00 0.00 C ATOM 1713 OD1 ASN A 116 -7.893 -19.650 1.057 1.00 0.00 O ATOM 1714 ND2 ASN A 116 -5.986 -20.244 1.998 1.00 0.00 N ATOM 0 H ASN A 116 -5.225 -17.184 3.849 1.00 0.00 H new ATOM 0 HA ASN A 116 -7.500 -16.194 2.360 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -6.644 -17.352 0.747 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -5.326 -17.811 1.806 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -6.218 -21.232 1.898 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -5.102 -19.968 2.426 1.00 0.00 H new ATOM 1721 N PRO A 117 -9.439 -17.383 3.532 1.00 0.00 N ATOM 1722 CA PRO A 117 -10.541 -18.166 4.055 1.00 0.00 C ATOM 1723 C PRO A 117 -10.955 -19.257 3.062 1.00 0.00 C ATOM 1724 O PRO A 117 -11.436 -20.301 3.499 1.00 0.00 O ATOM 1725 CB PRO A 117 -11.671 -17.154 4.268 1.00 0.00 C ATOM 1726 CG PRO A 117 -11.440 -16.132 3.156 1.00 0.00 C ATOM 1727 CD PRO A 117 -9.915 -16.092 3.057 1.00 0.00 C ATOM 0 HA PRO A 117 -10.278 -18.684 4.977 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -12.652 -17.623 4.187 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -11.619 -16.694 5.255 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -11.900 -16.442 2.218 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -11.856 -15.157 3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -9.597 -15.915 2.030 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.508 -15.281 3.661 1.00 0.00 H new ATOM 1735 N MET A 118 -10.860 -19.005 1.748 1.00 0.00 N ATOM 1736 CA MET A 118 -11.483 -19.820 0.717 1.00 0.00 C ATOM 1737 C MET A 118 -10.781 -19.634 -0.634 1.00 0.00 C ATOM 1738 O MET A 118 -10.212 -18.585 -0.921 1.00 0.00 O ATOM 1739 CB MET A 118 -12.948 -19.386 0.573 1.00 0.00 C ATOM 1740 CG MET A 118 -13.840 -19.769 1.758 1.00 0.00 C ATOM 1741 SD MET A 118 -15.614 -19.628 1.438 1.00 0.00 S ATOM 1742 CE MET A 118 -16.209 -20.285 3.020 1.00 0.00 C ATOM 0 H MET A 118 -10.337 -18.213 1.375 1.00 0.00 H new ATOM 0 HA MET A 118 -11.408 -20.868 1.006 1.00 0.00 H new ATOM 0 HB2 MET A 118 -12.983 -18.304 0.442 1.00 0.00 H new ATOM 0 HB3 MET A 118 -13.359 -19.830 -0.334 1.00 0.00 H new ATOM 0 HG2 MET A 118 -13.616 -20.796 2.048 1.00 0.00 H new ATOM 0 HG3 MET A 118 -13.585 -19.135 2.608 1.00 0.00 H new ATOM 0 HE1 MET A 118 -17.299 -20.284 3.028 1.00 0.00 H new ATOM 0 HE2 MET A 118 -15.847 -21.305 3.150 1.00 0.00 H new ATOM 0 HE3 MET A 118 -15.840 -19.662 3.835 1.00 0.00 H new ATOM 1752 N GLU A 119 -10.943 -20.589 -1.546 1.00 0.00 N ATOM 1753 CA GLU A 119 -10.279 -20.659 -2.848 1.00 0.00 C ATOM 1754 C GLU A 119 -11.146 -19.971 -3.906 1.00 0.00 C ATOM 1755 O GLU A 119 -11.384 -20.472 -5.004 1.00 0.00 O ATOM 1756 CB GLU A 119 -9.923 -22.117 -3.182 1.00 0.00 C ATOM 1757 CG GLU A 119 -9.081 -22.726 -2.050 1.00 0.00 C ATOM 1758 CD GLU A 119 -8.175 -23.857 -2.523 1.00 0.00 C ATOM 1759 OE1 GLU A 119 -8.712 -24.910 -2.927 1.00 0.00 O ATOM 1760 OE2 GLU A 119 -6.937 -23.705 -2.417 1.00 0.00 O ATOM 0 H GLU A 119 -11.573 -21.376 -1.390 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.333 -20.118 -2.826 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -10.834 -22.699 -3.322 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.370 -22.159 -4.120 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.471 -21.944 -1.598 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.746 -23.102 -1.272 1.00 0.00 H new ATOM 1767 N ASN A 120 -11.687 -18.824 -3.502 1.00 0.00 N ATOM 1768 CA ASN A 120 -12.641 -18.007 -4.238 1.00 0.00 C ATOM 1769 C ASN A 120 -12.675 -16.570 -3.700 1.00 0.00 C ATOM 1770 O ASN A 120 -13.256 -15.718 -4.361 1.00 0.00 O ATOM 1771 CB ASN A 120 -14.047 -18.647 -4.218 1.00 0.00 C ATOM 1772 CG ASN A 120 -14.527 -18.824 -2.793 1.00 0.00 C ATOM 1773 OD1 ASN A 120 -14.653 -19.939 -2.291 1.00 0.00 O ATOM 1774 ND2 ASN A 120 -14.653 -17.718 -2.091 1.00 0.00 N ATOM 0 H ASN A 120 -11.455 -18.418 -2.596 1.00 0.00 H new ATOM 0 HA ASN A 120 -12.310 -17.960 -5.276 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -14.747 -18.019 -4.769 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -14.021 -19.613 -4.722 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -14.862 -17.768 -1.094 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -14.541 -16.811 -2.544 1.00 0.00 H new ATOM 1781 N VAL A 121 -12.109 -16.287 -2.511 1.00 0.00 N ATOM 1782 CA VAL A 121 -11.802 -14.946 -2.023 1.00 0.00 C ATOM 1783 C VAL A 121 -10.512 -15.093 -1.226 1.00 0.00 C ATOM 1784 O VAL A 121 -10.474 -15.847 -0.254 1.00 0.00 O ATOM 1785 CB VAL A 121 -12.937 -14.246 -1.222 1.00 0.00 C ATOM 1786 CG1 VAL A 121 -14.251 -14.139 -2.001 1.00 0.00 C ATOM 1787 CG2 VAL A 121 -13.275 -14.839 0.151 1.00 0.00 C ATOM 0 H VAL A 121 -11.847 -17.017 -1.848 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.690 -14.267 -2.868 1.00 0.00 H new ATOM 0 HB VAL A 121 -12.491 -13.265 -1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -15.000 -13.641 -1.385 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -14.088 -13.562 -2.911 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.602 -15.138 -2.262 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -14.080 -14.264 0.608 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -13.592 -15.875 0.032 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -12.393 -14.801 0.791 1.00 0.00 H new ATOM 1797 N ALA A 122 -9.440 -14.427 -1.651 1.00 0.00 N ATOM 1798 CA ALA A 122 -8.336 -14.176 -0.744 1.00 0.00 C ATOM 1799 C ALA A 122 -8.850 -13.218 0.326 1.00 0.00 C ATOM 1800 O ALA A 122 -9.854 -12.528 0.111 1.00 0.00 O ATOM 1801 CB ALA A 122 -7.173 -13.535 -1.501 1.00 0.00 C ATOM 0 H ALA A 122 -9.318 -14.061 -2.595 1.00 0.00 H new ATOM 0 HA ALA A 122 -7.978 -15.104 -0.299 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -6.349 -13.350 -0.812 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -6.841 -14.206 -2.293 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -7.499 -12.591 -1.938 1.00 0.00 H new ATOM 1807 N LEU A 123 -8.120 -13.110 1.436 1.00 0.00 N ATOM 1808 CA LEU A 123 -8.282 -11.980 2.324 1.00 0.00 C ATOM 1809 C LEU A 123 -6.897 -11.522 2.761 1.00 0.00 C ATOM 1810 O LEU A 123 -6.191 -12.207 3.513 1.00 0.00 O ATOM 1811 CB LEU A 123 -9.196 -12.342 3.515 1.00 0.00 C ATOM 1812 CG LEU A 123 -10.218 -11.258 3.903 1.00 0.00 C ATOM 1813 CD1 LEU A 123 -9.638 -9.845 3.859 1.00 0.00 C ATOM 1814 CD2 LEU A 123 -11.457 -11.340 3.005 1.00 0.00 C ATOM 0 H LEU A 123 -7.419 -13.789 1.732 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.778 -11.155 1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.735 -13.259 3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.571 -12.557 4.381 1.00 0.00 H new ATOM 0 HG LEU A 123 -10.498 -11.457 4.937 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.407 -9.127 4.143 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -8.801 -9.773 4.554 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.291 -9.625 2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -12.168 -10.566 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -11.163 -11.193 1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -11.922 -12.320 3.115 1.00 0.00 H new ATOM 1826 N ASP A 124 -6.553 -10.312 2.344 1.00 0.00 N ATOM 1827 CA ASP A 124 -5.330 -9.580 2.637 1.00 0.00 C ATOM 1828 C ASP A 124 -5.740 -8.244 3.213 1.00 0.00 C ATOM 1829 O ASP A 124 -6.759 -7.686 2.797 1.00 0.00 O ATOM 1830 CB ASP A 124 -4.538 -9.288 1.352 1.00 0.00 C ATOM 1831 CG ASP A 124 -3.155 -9.900 1.379 1.00 0.00 C ATOM 1832 OD1 ASP A 124 -3.034 -11.048 0.907 1.00 0.00 O ATOM 1833 OD2 ASP A 124 -2.191 -9.217 1.779 1.00 0.00 O ATOM 0 H ASP A 124 -7.175 -9.772 1.742 1.00 0.00 H new ATOM 0 HA ASP A 124 -4.713 -10.170 3.315 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.087 -9.674 0.493 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.453 -8.210 1.217 1.00 0.00 H new ATOM 1838 N PHE A 125 -4.905 -7.696 4.086 1.00 0.00 N ATOM 1839 CA PHE A 125 -4.999 -6.325 4.555 1.00 0.00 C ATOM 1840 C PHE A 125 -3.621 -5.695 4.396 1.00 0.00 C ATOM 1841 O PHE A 125 -2.601 -6.386 4.460 1.00 0.00 O ATOM 1842 CB PHE A 125 -5.482 -6.287 6.018 1.00 0.00 C ATOM 1843 CG PHE A 125 -6.964 -5.989 6.176 1.00 0.00 C ATOM 1844 CD1 PHE A 125 -7.940 -6.880 5.683 1.00 0.00 C ATOM 1845 CD2 PHE A 125 -7.370 -4.787 6.784 1.00 0.00 C ATOM 1846 CE1 PHE A 125 -9.308 -6.575 5.806 1.00 0.00 C ATOM 1847 CE2 PHE A 125 -8.736 -4.466 6.865 1.00 0.00 C ATOM 1848 CZ PHE A 125 -9.707 -5.363 6.391 1.00 0.00 C ATOM 0 H PHE A 125 -4.124 -8.208 4.496 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.729 -5.762 3.974 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -5.264 -7.247 6.486 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.911 -5.532 6.558 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -7.636 -7.801 5.209 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -6.632 -4.111 7.189 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -10.051 -7.273 5.450 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -9.041 -3.523 7.295 1.00 0.00 H new ATOM 0 HZ PHE A 125 -10.756 -5.121 6.476 1.00 0.00 H new ATOM 1858 N SER A 126 -3.605 -4.383 4.198 1.00 0.00 N ATOM 1859 CA SER A 126 -2.569 -3.514 4.722 1.00 0.00 C ATOM 1860 C SER A 126 -3.199 -2.179 5.085 1.00 0.00 C ATOM 1861 O SER A 126 -4.338 -1.880 4.704 1.00 0.00 O ATOM 1862 CB SER A 126 -1.429 -3.315 3.719 1.00 0.00 C ATOM 1863 OG SER A 126 -0.455 -4.324 3.892 1.00 0.00 O ATOM 0 H SER A 126 -4.320 -3.891 3.663 1.00 0.00 H new ATOM 0 HA SER A 126 -2.132 -3.979 5.606 1.00 0.00 H new ATOM 0 HB2 SER A 126 -1.819 -3.344 2.702 1.00 0.00 H new ATOM 0 HB3 SER A 126 -0.977 -2.333 3.859 1.00 0.00 H new ATOM 0 HG SER A 126 -0.020 -4.213 4.763 1.00 0.00 H new ATOM 1869 N TYR A 127 -2.444 -1.392 5.830 1.00 0.00 N ATOM 1870 CA TYR A 127 -2.584 0.037 5.997 1.00 0.00 C ATOM 1871 C TYR A 127 -1.156 0.551 6.089 1.00 0.00 C ATOM 1872 O TYR A 127 -0.309 -0.174 6.611 1.00 0.00 O ATOM 1873 CB TYR A 127 -3.385 0.346 7.271 1.00 0.00 C ATOM 1874 CG TYR A 127 -2.952 -0.469 8.481 1.00 0.00 C ATOM 1875 CD1 TYR A 127 -1.808 -0.106 9.218 1.00 0.00 C ATOM 1876 CD2 TYR A 127 -3.659 -1.635 8.821 1.00 0.00 C ATOM 1877 CE1 TYR A 127 -1.348 -0.915 10.271 1.00 0.00 C ATOM 1878 CE2 TYR A 127 -3.217 -2.440 9.880 1.00 0.00 C ATOM 1879 CZ TYR A 127 -2.056 -2.090 10.604 1.00 0.00 C ATOM 1880 OH TYR A 127 -1.652 -2.876 11.641 1.00 0.00 O ATOM 0 H TYR A 127 -1.663 -1.764 6.371 1.00 0.00 H new ATOM 0 HA TYR A 127 -3.127 0.511 5.180 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.285 1.406 7.504 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.442 0.160 7.079 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -1.279 0.803 8.972 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.543 -1.911 8.266 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -0.460 -0.640 10.821 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -3.767 -3.332 10.143 1.00 0.00 H new ATOM 0 HH TYR A 127 -2.258 -3.642 11.726 1.00 0.00 H new ATOM 1890 N GLU A 128 -0.850 1.741 5.583 1.00 0.00 N ATOM 1891 CA GLU A 128 0.349 2.461 5.989 1.00 0.00 C ATOM 1892 C GLU A 128 0.031 3.949 6.175 1.00 0.00 C ATOM 1893 O GLU A 128 -0.950 4.455 5.628 1.00 0.00 O ATOM 1894 CB GLU A 128 1.560 2.168 5.073 1.00 0.00 C ATOM 1895 CG GLU A 128 1.368 2.265 3.546 1.00 0.00 C ATOM 1896 CD GLU A 128 1.119 0.934 2.813 1.00 0.00 C ATOM 1897 OE1 GLU A 128 0.825 -0.113 3.438 1.00 0.00 O ATOM 1898 OE2 GLU A 128 1.227 0.923 1.561 1.00 0.00 O ATOM 0 H GLU A 128 -1.418 2.227 4.889 1.00 0.00 H new ATOM 0 HA GLU A 128 0.670 2.089 6.962 1.00 0.00 H new ATOM 0 HB2 GLU A 128 2.360 2.855 5.351 1.00 0.00 H new ATOM 0 HB3 GLU A 128 1.911 1.161 5.300 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.528 2.930 3.347 1.00 0.00 H new ATOM 0 HG3 GLU A 128 2.254 2.733 3.117 1.00 0.00 H new ATOM 1905 N GLN A 129 0.875 4.663 6.923 1.00 0.00 N ATOM 1906 CA GLN A 129 0.676 6.061 7.300 1.00 0.00 C ATOM 1907 C GLN A 129 1.867 6.894 6.827 1.00 0.00 C ATOM 1908 O GLN A 129 3.005 6.660 7.243 1.00 0.00 O ATOM 1909 CB GLN A 129 0.401 6.144 8.812 1.00 0.00 C ATOM 1910 CG GLN A 129 -1.116 6.114 9.062 1.00 0.00 C ATOM 1911 CD GLN A 129 -1.500 6.016 10.539 1.00 0.00 C ATOM 1912 OE1 GLN A 129 -0.663 5.856 11.426 1.00 0.00 O ATOM 1913 NE2 GLN A 129 -2.776 6.106 10.865 1.00 0.00 N ATOM 0 H GLN A 129 1.741 4.271 7.293 1.00 0.00 H new ATOM 0 HA GLN A 129 -0.199 6.486 6.807 1.00 0.00 H new ATOM 0 HB2 GLN A 129 0.881 5.311 9.326 1.00 0.00 H new ATOM 0 HB3 GLN A 129 0.829 7.060 9.220 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -1.561 7.015 8.640 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -1.545 5.266 8.528 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -3.480 6.239 10.139 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -3.058 6.043 11.843 1.00 0.00 H new ATOM 1922 N SER A 130 1.611 7.812 5.894 1.00 0.00 N ATOM 1923 CA SER A 130 2.587 8.598 5.154 1.00 0.00 C ATOM 1924 C SER A 130 2.734 10.014 5.702 1.00 0.00 C ATOM 1925 O SER A 130 1.727 10.716 5.823 1.00 0.00 O ATOM 1926 CB SER A 130 2.156 8.652 3.684 1.00 0.00 C ATOM 1927 OG SER A 130 0.801 9.068 3.551 1.00 0.00 O ATOM 0 H SER A 130 0.654 8.037 5.621 1.00 0.00 H new ATOM 0 HA SER A 130 3.559 8.117 5.258 1.00 0.00 H new ATOM 0 HB2 SER A 130 2.803 9.339 3.139 1.00 0.00 H new ATOM 0 HB3 SER A 130 2.282 7.669 3.231 1.00 0.00 H new ATOM 0 HG SER A 130 0.557 9.635 4.312 1.00 0.00 H new ATOM 1933 N ARG A 131 3.971 10.465 5.943 1.00 0.00 N ATOM 1934 CA ARG A 131 4.267 11.854 6.299 1.00 0.00 C ATOM 1935 C ARG A 131 4.803 12.567 5.065 1.00 0.00 C ATOM 1936 O ARG A 131 5.905 12.258 4.605 1.00 0.00 O ATOM 1937 CB ARG A 131 5.270 11.935 7.471 1.00 0.00 C ATOM 1938 CG ARG A 131 4.584 12.151 8.828 1.00 0.00 C ATOM 1939 CD ARG A 131 3.790 10.933 9.313 1.00 0.00 C ATOM 1940 NE ARG A 131 2.832 11.298 10.367 1.00 0.00 N ATOM 1941 CZ ARG A 131 2.971 11.250 11.696 1.00 0.00 C ATOM 1942 NH1 ARG A 131 4.093 10.840 12.279 1.00 0.00 N ATOM 1943 NH2 ARG A 131 1.950 11.655 12.430 1.00 0.00 N ATOM 0 H ARG A 131 4.799 9.871 5.896 1.00 0.00 H new ATOM 0 HA ARG A 131 3.353 12.343 6.636 1.00 0.00 H new ATOM 0 HB2 ARG A 131 5.855 11.016 7.507 1.00 0.00 H new ATOM 0 HB3 ARG A 131 5.970 12.751 7.289 1.00 0.00 H new ATOM 0 HG2 ARG A 131 5.340 12.402 9.572 1.00 0.00 H new ATOM 0 HG3 ARG A 131 3.913 13.007 8.755 1.00 0.00 H new ATOM 0 HD2 ARG A 131 3.256 10.488 8.473 1.00 0.00 H new ATOM 0 HD3 ARG A 131 4.478 10.176 9.691 1.00 0.00 H new ATOM 0 HE ARG A 131 1.929 11.638 10.036 1.00 0.00 H new ATOM 0 HH11 ARG A 131 4.887 10.548 11.709 1.00 0.00 H new ATOM 0 HH12 ARG A 131 4.160 10.818 13.297 1.00 0.00 H new ATOM 0 HH21 ARG A 131 1.098 11.988 11.979 1.00 0.00 H new ATOM 0 HH22 ARG A 131 2.014 11.635 13.448 1.00 0.00 H new ATOM 1957 N ILE A 132 4.045 13.512 4.523 1.00 0.00 N ATOM 1958 CA ILE A 132 4.471 14.406 3.455 1.00 0.00 C ATOM 1959 C ILE A 132 4.851 15.714 4.167 1.00 0.00 C ATOM 1960 O ILE A 132 4.059 16.651 4.282 1.00 0.00 O ATOM 1961 CB ILE A 132 3.365 14.483 2.364 1.00 0.00 C ATOM 1962 CG1 ILE A 132 3.371 13.237 1.445 1.00 0.00 C ATOM 1963 CG2 ILE A 132 3.480 15.707 1.436 1.00 0.00 C ATOM 1964 CD1 ILE A 132 2.873 11.937 2.078 1.00 0.00 C ATOM 0 H ILE A 132 3.086 13.682 4.825 1.00 0.00 H new ATOM 0 HA ILE A 132 5.340 14.076 2.886 1.00 0.00 H new ATOM 0 HB ILE A 132 2.443 14.553 2.941 1.00 0.00 H new ATOM 0 HG12 ILE A 132 2.756 13.451 0.571 1.00 0.00 H new ATOM 0 HG13 ILE A 132 4.388 13.078 1.088 1.00 0.00 H new ATOM 0 HG21 ILE A 132 2.672 15.686 0.704 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.410 16.620 2.028 1.00 0.00 H new ATOM 0 HG23 ILE A 132 4.439 15.682 0.918 1.00 0.00 H new ATOM 0 HD11 ILE A 132 2.922 11.133 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 132 3.500 11.686 2.934 1.00 0.00 H new ATOM 0 HD13 ILE A 132 1.842 12.065 2.408 1.00 0.00 H new ATOM 1976 N ARG A 133 6.065 15.763 4.716 1.00 0.00 N ATOM 1977 CA ARG A 133 6.523 16.742 5.703 1.00 0.00 C ATOM 1978 C ARG A 133 5.543 16.742 6.878 1.00 0.00 C ATOM 1979 O ARG A 133 5.569 15.789 7.660 1.00 0.00 O ATOM 1980 CB ARG A 133 6.781 18.116 5.047 1.00 0.00 C ATOM 1981 CG ARG A 133 8.133 18.207 4.323 1.00 0.00 C ATOM 1982 CD ARG A 133 8.175 19.437 3.403 1.00 0.00 C ATOM 1983 NE ARG A 133 9.549 19.919 3.161 1.00 0.00 N ATOM 1984 CZ ARG A 133 10.199 20.854 3.875 1.00 0.00 C ATOM 1985 NH1 ARG A 133 9.634 21.440 4.924 1.00 0.00 N ATOM 1986 NH2 ARG A 133 11.417 21.224 3.498 1.00 0.00 N ATOM 0 H ARG A 133 6.791 15.089 4.473 1.00 0.00 H new ATOM 0 HA ARG A 133 7.495 16.469 6.113 1.00 0.00 H new ATOM 0 HB2 ARG A 133 5.982 18.325 4.335 1.00 0.00 H new ATOM 0 HB3 ARG A 133 6.736 18.890 5.814 1.00 0.00 H new ATOM 0 HG2 ARG A 133 8.939 18.266 5.054 1.00 0.00 H new ATOM 0 HG3 ARG A 133 8.299 17.303 3.737 1.00 0.00 H new ATOM 0 HD2 ARG A 133 7.708 19.189 2.450 1.00 0.00 H new ATOM 0 HD3 ARG A 133 7.586 20.239 3.848 1.00 0.00 H new ATOM 0 HE ARG A 133 10.053 19.503 2.378 1.00 0.00 H new ATOM 0 HH11 ARG A 133 8.687 21.183 5.203 1.00 0.00 H new ATOM 0 HH12 ARG A 133 10.147 22.147 5.451 1.00 0.00 H new ATOM 0 HH21 ARG A 133 11.847 20.800 2.676 1.00 0.00 H new ATOM 0 HH22 ARG A 133 11.922 21.932 4.030 1.00 0.00 H new ATOM 2000 N SER A 134 4.648 17.726 6.971 1.00 0.00 N ATOM 2001 CA SER A 134 3.628 17.813 8.010 1.00 0.00 C ATOM 2002 C SER A 134 2.232 17.455 7.484 1.00 0.00 C ATOM 2003 O SER A 134 1.263 17.566 8.237 1.00 0.00 O ATOM 2004 CB SER A 134 3.647 19.215 8.631 1.00 0.00 C ATOM 2005 OG SER A 134 4.916 19.502 9.191 1.00 0.00 O ATOM 0 H SER A 134 4.614 18.501 6.309 1.00 0.00 H new ATOM 0 HA SER A 134 3.863 17.078 8.780 1.00 0.00 H new ATOM 0 HB2 SER A 134 3.404 19.957 7.871 1.00 0.00 H new ATOM 0 HB3 SER A 134 2.880 19.286 9.402 1.00 0.00 H new ATOM 0 HG SER A 134 4.906 20.401 9.580 1.00 0.00 H new ATOM 2011 N VAL A 135 2.092 17.048 6.220 1.00 0.00 N ATOM 2012 CA VAL A 135 0.821 16.559 5.693 1.00 0.00 C ATOM 2013 C VAL A 135 0.748 15.098 6.112 1.00 0.00 C ATOM 2014 O VAL A 135 1.549 14.278 5.653 1.00 0.00 O ATOM 2015 CB VAL A 135 0.726 16.782 4.169 1.00 0.00 C ATOM 2016 CG1 VAL A 135 -0.459 16.053 3.513 1.00 0.00 C ATOM 2017 CG2 VAL A 135 0.629 18.281 3.866 1.00 0.00 C ATOM 0 H VAL A 135 2.852 17.049 5.540 1.00 0.00 H new ATOM 0 HA VAL A 135 -0.037 17.101 6.089 1.00 0.00 H new ATOM 0 HB VAL A 135 1.635 16.359 3.741 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -0.463 16.255 2.442 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -0.363 14.980 3.679 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -1.392 16.406 3.952 1.00 0.00 H new ATOM 0 HG21 VAL A 135 0.562 18.431 2.788 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -0.259 18.692 4.345 1.00 0.00 H new ATOM 0 HG23 VAL A 135 1.515 18.788 4.249 1.00 0.00 H new ATOM 2027 N ASP A 136 -0.163 14.784 7.028 1.00 0.00 N ATOM 2028 CA ASP A 136 -0.416 13.422 7.464 1.00 0.00 C ATOM 2029 C ASP A 136 -1.549 12.865 6.602 1.00 0.00 C ATOM 2030 O ASP A 136 -2.589 13.514 6.439 1.00 0.00 O ATOM 2031 CB ASP A 136 -0.742 13.405 8.963 1.00 0.00 C ATOM 2032 CG ASP A 136 -0.703 11.985 9.527 1.00 0.00 C ATOM 2033 OD1 ASP A 136 -1.315 11.064 8.958 1.00 0.00 O ATOM 2034 OD2 ASP A 136 0.064 11.751 10.488 1.00 0.00 O ATOM 0 H ASP A 136 -0.750 15.478 7.491 1.00 0.00 H new ATOM 0 HA ASP A 136 0.462 12.789 7.337 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -0.028 14.031 9.499 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -1.730 13.836 9.127 1.00 0.00 H new ATOM 2039 N VAL A 137 -1.309 11.707 5.990 1.00 0.00 N ATOM 2040 CA VAL A 137 -2.281 10.904 5.257 1.00 0.00 C ATOM 2041 C VAL A 137 -2.076 9.465 5.737 1.00 0.00 C ATOM 2042 O VAL A 137 -0.933 9.060 5.990 1.00 0.00 O ATOM 2043 CB VAL A 137 -2.058 11.086 3.731 1.00 0.00 C ATOM 2044 CG1 VAL A 137 -2.612 9.945 2.860 1.00 0.00 C ATOM 2045 CG2 VAL A 137 -2.663 12.396 3.199 1.00 0.00 C ATOM 0 H VAL A 137 -0.381 11.283 5.993 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.314 11.202 5.439 1.00 0.00 H new ATOM 0 HB VAL A 137 -0.971 11.094 3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.411 10.158 1.810 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -2.131 9.008 3.139 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -3.688 9.860 3.013 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.479 12.473 2.127 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -3.737 12.402 3.384 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -2.203 13.243 3.708 1.00 0.00 H new ATOM 2055 N GLY A 138 -3.152 8.680 5.797 1.00 0.00 N ATOM 2056 CA GLY A 138 -3.105 7.241 6.009 1.00 0.00 C ATOM 2057 C GLY A 138 -3.930 6.556 4.932 1.00 0.00 C ATOM 2058 O GLY A 138 -4.907 7.130 4.446 1.00 0.00 O ATOM 0 H GLY A 138 -4.101 9.040 5.697 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -2.074 6.889 5.975 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -3.494 6.993 6.996 1.00 0.00 H new ATOM 2062 N THR A 139 -3.549 5.331 4.582 1.00 0.00 N ATOM 2063 CA THR A 139 -4.256 4.484 3.639 1.00 0.00 C ATOM 2064 C THR A 139 -4.597 3.189 4.358 1.00 0.00 C ATOM 2065 O THR A 139 -3.794 2.696 5.149 1.00 0.00 O ATOM 2066 CB THR A 139 -3.402 4.282 2.366 1.00 0.00 C ATOM 2067 OG1 THR A 139 -4.083 3.512 1.391 1.00 0.00 O ATOM 2068 CG2 THR A 139 -2.037 3.624 2.588 1.00 0.00 C ATOM 0 H THR A 139 -2.711 4.890 4.962 1.00 0.00 H new ATOM 0 HA THR A 139 -5.186 4.939 3.297 1.00 0.00 H new ATOM 0 HB THR A 139 -3.230 5.303 2.026 1.00 0.00 H new ATOM 0 HG1 THR A 139 -3.513 3.407 0.601 1.00 0.00 H new ATOM 0 HG21 THR A 139 -1.519 3.529 1.633 1.00 0.00 H new ATOM 0 HG22 THR A 139 -1.442 4.239 3.263 1.00 0.00 H new ATOM 0 HG23 THR A 139 -2.176 2.635 3.025 1.00 0.00 H new ATOM 2076 N TRP A 140 -5.736 2.596 4.016 1.00 0.00 N ATOM 2077 CA TRP A 140 -6.108 1.246 4.392 1.00 0.00 C ATOM 2078 C TRP A 140 -6.683 0.604 3.137 1.00 0.00 C ATOM 2079 O TRP A 140 -7.574 1.155 2.481 1.00 0.00 O ATOM 2080 CB TRP A 140 -7.065 1.262 5.590 1.00 0.00 C ATOM 2081 CG TRP A 140 -8.220 2.212 5.512 1.00 0.00 C ATOM 2082 CD1 TRP A 140 -9.434 1.926 4.996 1.00 0.00 C ATOM 2083 CD2 TRP A 140 -8.295 3.592 5.979 1.00 0.00 C ATOM 2084 NE1 TRP A 140 -10.244 3.038 5.078 1.00 0.00 N ATOM 2085 CE2 TRP A 140 -9.608 4.081 5.715 1.00 0.00 C ATOM 2086 CE3 TRP A 140 -7.400 4.477 6.617 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 -10.022 5.367 6.093 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 -7.792 5.781 6.971 1.00 0.00 C ATOM 2089 CH2 TRP A 140 -9.099 6.228 6.712 1.00 0.00 C ATOM 0 H TRP A 140 -6.446 3.062 3.451 1.00 0.00 H new ATOM 0 HA TRP A 140 -5.260 0.654 4.736 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -7.460 0.255 5.724 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -6.488 1.499 6.484 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -9.726 0.972 4.582 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -11.195 3.083 4.713 1.00 0.00 H new ATOM 0 HE3 TRP A 140 -6.396 4.147 6.838 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -11.036 5.691 5.911 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 -7.083 6.444 7.445 1.00 0.00 H new ATOM 0 HH2 TRP A 140 -9.393 7.230 6.988 1.00 0.00 H new ATOM 2100 N ILE A 141 -6.111 -0.524 2.728 1.00 0.00 N ATOM 2101 CA ILE A 141 -6.376 -1.123 1.428 1.00 0.00 C ATOM 2102 C ILE A 141 -7.021 -2.487 1.644 1.00 0.00 C ATOM 2103 O ILE A 141 -6.627 -3.233 2.551 1.00 0.00 O ATOM 2104 CB ILE A 141 -5.091 -1.127 0.568 1.00 0.00 C ATOM 2105 CG1 ILE A 141 -4.075 -2.204 1.004 1.00 0.00 C ATOM 2106 CG2 ILE A 141 -4.452 0.279 0.597 1.00 0.00 C ATOM 2107 CD1 ILE A 141 -2.794 -2.210 0.168 1.00 0.00 C ATOM 0 H ILE A 141 -5.446 -1.051 3.295 1.00 0.00 H new ATOM 0 HA ILE A 141 -7.089 -0.536 0.850 1.00 0.00 H new ATOM 0 HB ILE A 141 -5.378 -1.383 -0.452 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -3.815 -2.044 2.051 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.547 -3.185 0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.546 0.279 -0.009 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -5.157 1.007 0.196 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -4.202 0.544 1.624 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -2.127 -2.992 0.531 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -3.042 -2.400 -0.876 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -2.299 -1.242 0.253 1.00 0.00 H new ATOM 2119 N ALA A 142 -8.012 -2.803 0.814 1.00 0.00 N ATOM 2120 CA ALA A 142 -8.681 -4.090 0.826 1.00 0.00 C ATOM 2121 C ALA A 142 -7.904 -5.000 -0.117 1.00 0.00 C ATOM 2122 O ALA A 142 -7.547 -4.567 -1.216 1.00 0.00 O ATOM 2123 CB ALA A 142 -10.123 -3.915 0.334 1.00 0.00 C ATOM 0 H ALA A 142 -8.373 -2.161 0.108 1.00 0.00 H new ATOM 0 HA ALA A 142 -8.714 -4.517 1.828 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -10.630 -4.880 0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -10.650 -3.223 0.991 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -10.115 -3.517 -0.681 1.00 0.00 H new ATOM 2129 N GLY A 143 -7.633 -6.237 0.294 1.00 0.00 N ATOM 2130 CA GLY A 143 -6.969 -7.243 -0.517 1.00 0.00 C ATOM 2131 C GLY A 143 -7.885 -8.444 -0.677 1.00 0.00 C ATOM 2132 O GLY A 143 -7.666 -9.486 -0.068 1.00 0.00 O ATOM 0 H GLY A 143 -7.878 -6.572 1.226 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -6.717 -6.831 -1.494 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -6.033 -7.545 -0.048 1.00 0.00 H new ATOM 2136 N VAL A 144 -8.909 -8.307 -1.506 1.00 0.00 N ATOM 2137 CA VAL A 144 -9.839 -9.370 -1.857 1.00 0.00 C ATOM 2138 C VAL A 144 -9.525 -9.850 -3.281 1.00 0.00 C ATOM 2139 O VAL A 144 -8.731 -9.239 -4.000 1.00 0.00 O ATOM 2140 CB VAL A 144 -11.286 -8.873 -1.635 1.00 0.00 C ATOM 2141 CG1 VAL A 144 -11.620 -8.929 -0.140 1.00 0.00 C ATOM 2142 CG2 VAL A 144 -11.559 -7.446 -2.139 1.00 0.00 C ATOM 0 H VAL A 144 -9.123 -7.423 -1.968 1.00 0.00 H new ATOM 0 HA VAL A 144 -9.730 -10.244 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 144 -11.917 -9.539 -2.224 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -12.640 -8.579 0.018 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -11.530 -9.956 0.215 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -10.928 -8.292 0.411 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -12.598 -7.183 -1.941 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -10.903 -6.746 -1.622 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -11.370 -7.396 -3.211 1.00 0.00 H new ATOM 2152 N GLY A 145 -10.098 -10.974 -3.699 1.00 0.00 N ATOM 2153 CA GLY A 145 -9.842 -11.576 -4.997 1.00 0.00 C ATOM 2154 C GLY A 145 -10.303 -13.018 -4.965 1.00 0.00 C ATOM 2155 O GLY A 145 -11.509 -13.241 -4.953 1.00 0.00 O ATOM 0 H GLY A 145 -10.765 -11.499 -3.133 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -10.370 -11.028 -5.778 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -8.779 -11.525 -5.234 1.00 0.00 H new ATOM 2159 N TYR A 146 -9.369 -13.965 -4.890 1.00 0.00 N ATOM 2160 CA TYR A 146 -9.539 -15.417 -5.027 1.00 0.00 C ATOM 2161 C TYR A 146 -8.297 -16.094 -4.406 1.00 0.00 C ATOM 2162 O TYR A 146 -7.279 -15.438 -4.162 1.00 0.00 O ATOM 2163 CB TYR A 146 -9.676 -15.797 -6.526 1.00 0.00 C ATOM 2164 CG TYR A 146 -11.008 -16.339 -7.005 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -12.072 -15.452 -7.256 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -11.150 -17.704 -7.330 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -13.287 -15.927 -7.773 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -12.378 -18.190 -7.818 1.00 0.00 C ATOM 2169 CZ TYR A 146 -13.458 -17.302 -8.029 1.00 0.00 C ATOM 2170 OH TYR A 146 -14.669 -17.748 -8.460 1.00 0.00 O ATOM 0 H TYR A 146 -8.394 -13.720 -4.718 1.00 0.00 H new ATOM 0 HA TYR A 146 -10.443 -15.749 -4.516 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -9.444 -14.911 -7.117 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -8.912 -16.541 -6.753 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -11.952 -14.399 -7.049 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -10.315 -18.378 -7.204 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -14.093 -15.237 -7.975 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -12.495 -19.242 -8.031 1.00 0.00 H new ATOM 0 HH TYR A 146 -14.632 -18.718 -8.594 1.00 0.00 H new ATOM 2180 N ARG A 147 -8.322 -17.410 -4.181 1.00 0.00 N ATOM 2181 CA ARG A 147 -7.105 -18.180 -3.870 1.00 0.00 C ATOM 2182 C ARG A 147 -7.155 -19.504 -4.621 1.00 0.00 C ATOM 2183 O ARG A 147 -8.246 -19.936 -4.986 1.00 0.00 O ATOM 2184 CB ARG A 147 -6.941 -18.319 -2.341 1.00 0.00 C ATOM 2185 CG ARG A 147 -5.712 -19.125 -1.877 1.00 0.00 C ATOM 2186 CD ARG A 147 -6.026 -20.613 -1.639 1.00 0.00 C ATOM 2187 NE ARG A 147 -4.820 -21.347 -1.244 1.00 0.00 N ATOM 2188 CZ ARG A 147 -4.745 -22.433 -0.470 1.00 0.00 C ATOM 2189 NH1 ARG A 147 -5.830 -23.025 -0.003 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -3.559 -22.923 -0.141 1.00 0.00 N ATOM 0 H ARG A 147 -9.174 -17.971 -4.208 1.00 0.00 H new ATOM 0 HA ARG A 147 -6.209 -17.660 -4.210 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.884 -17.321 -1.907 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.837 -18.791 -1.938 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -4.925 -19.040 -2.626 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -5.324 -18.689 -0.956 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -6.785 -20.709 -0.863 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -6.442 -21.051 -2.547 1.00 0.00 H new ATOM 0 HE ARG A 147 -3.935 -20.987 -1.602 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -6.752 -22.654 -0.232 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -5.746 -23.853 0.586 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -2.709 -22.471 -0.478 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -3.496 -23.752 0.450 1.00 0.00 H new ATOM 2204 N PHE A 148 -6.002 -20.132 -4.833 1.00 0.00 N ATOM 2205 CA PHE A 148 -5.813 -21.341 -5.599 1.00 0.00 C ATOM 2206 C PHE A 148 -4.663 -22.153 -5.007 1.00 0.00 C ATOM 2207 O PHE A 148 -4.615 -23.364 -5.318 1.00 0.00 O ATOM 2208 CB PHE A 148 -5.504 -20.954 -7.050 1.00 0.00 C ATOM 2209 CG PHE A 148 -6.588 -20.174 -7.768 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -7.716 -20.832 -8.291 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -6.450 -18.787 -7.947 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -8.671 -20.109 -9.029 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -7.396 -18.068 -8.697 1.00 0.00 C ATOM 2214 CZ PHE A 148 -8.505 -18.731 -9.249 1.00 0.00 C ATOM 0 H PHE A 148 -5.126 -19.781 -4.447 1.00 0.00 H new ATOM 0 HA PHE A 148 -6.715 -21.952 -5.568 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -4.588 -20.363 -7.062 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -5.303 -21.864 -7.614 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -7.849 -21.891 -8.126 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -5.611 -18.270 -7.505 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -9.537 -20.616 -9.429 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -7.271 -17.006 -8.849 1.00 0.00 H new ATOM 0 HZ PHE A 148 -9.226 -18.185 -9.839 1.00 0.00 H new TER 2224 PHE A 148