USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=46 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 109 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 129 GLN : amide:sc= 0 X(o=0,f=0.41) USER MOD Set 2.1: A 108 SER OG : rot 140:sc= 0 USER MOD Set 2.2: A 130 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 92 THR OG1 : rot -133:sc= 0.803 USER MOD Set 3.2: A 100 ASN :FLIP amide:sc= 1.53 F(o=2.2,f=2.9) USER MOD Set 3.3: A 102 THR OG1 : rot 106:sc= 0.602 USER MOD Set 4.1: A 25 ASN : amide:sc= 1.55 K(o=3.2,f=-9.5!) USER MOD Set 4.2: A 42 SER OG : rot -89:sc= 1.1 USER MOD Set 4.3: A 66 THR OG1 : rot -77:sc= 0.553 USER MOD Set 5.1: A 60 ASN : amide:sc= 1.15 K(o=2.6,f=-2.9!) USER MOD Set 5.2: A 63 TYR OH : rot 1:sc= 1.44 USER MOD Set 6.1: A 6 THR OG1 : rot 179:sc= -0.409! USER MOD Set 6.2: A 27 LYS NZ :NH3+ 137:sc= 0.387 (180deg=-0.105) USER MOD Single : A 1 ALA N :NH3+ 139:sc= 0.0169 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 145:sc= 1.31 USER MOD Single : A 3 SER OG : rot -173:sc= 0.58 USER MOD Single : A 4 THR OG1 : rot -15:sc= 0.435 USER MOD Single : A 9 TYR OH : rot -20:sc=-0.00577 USER MOD Single : A 11 GLN :FLIP amide:sc= -1.35! C(o=-2.2!,f=-1.4!) USER MOD Single : A 12 SER OG : rot 38:sc= 0.0665 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= 0.964 K(o=0.96,f=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.138 X(o=-0.14,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 176:sc=-0.00188 (180deg=-0.0123) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) 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 34 ASN : amide:sc= 0.875 K(o=0.87,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -100:sc= 0.0762 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -110:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.0204 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.448 K(o=-0.45,f=-5.8!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 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= 0.932 K(o=0.93,f=-0.001) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 10: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= -0.0698 K(o=-0.07,f=-4.9!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 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 103 SER OG : rot 180:sc= 0.0025 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0.154 X(o=0.15,f=0) USER MOD Single : A 116 ASN : amide:sc= -0.242 K(o=-0.24,f=-3.2!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0.241 X(o=0.24,f=-0.012) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= -0.0281 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -6.807 -25.471 -2.279 1.00 0.00 N ATOM 2 CA ALA A 1 -6.928 -24.022 -2.042 1.00 0.00 C ATOM 3 C ALA A 1 -6.025 -23.592 -0.907 1.00 0.00 C ATOM 4 O ALA A 1 -5.928 -24.282 0.112 1.00 0.00 O ATOM 5 CB ALA A 1 -8.365 -23.607 -1.738 1.00 0.00 C ATOM 0 H1 ALA A 1 -7.748 -25.872 -2.464 1.00 0.00 H new ATOM 0 H2 ALA A 1 -6.192 -25.638 -3.101 1.00 0.00 H new ATOM 0 H3 ALA A 1 -6.395 -25.927 -1.440 1.00 0.00 H new ATOM 0 HA ALA A 1 -6.622 -23.524 -2.962 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.405 -22.531 -1.570 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.005 -23.867 -2.581 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -8.713 -24.127 -0.845 1.00 0.00 H new ATOM 11 N THR A 2 -5.416 -22.417 -1.059 1.00 0.00 N ATOM 12 CA THR A 2 -4.314 -22.006 -0.199 1.00 0.00 C ATOM 13 C THR A 2 -4.757 -20.781 0.593 1.00 0.00 C ATOM 14 O THR A 2 -5.389 -19.871 0.033 1.00 0.00 O ATOM 15 CB THR A 2 -3.081 -21.741 -1.079 1.00 0.00 C ATOM 16 OG1 THR A 2 -2.907 -22.823 -1.965 1.00 0.00 O ATOM 17 CG2 THR A 2 -1.788 -21.569 -0.280 1.00 0.00 C ATOM 0 H THR A 2 -5.670 -21.733 -1.772 1.00 0.00 H new ATOM 0 HA THR A 2 -4.041 -22.780 0.518 1.00 0.00 H new ATOM 0 HB THR A 2 -3.270 -20.805 -1.606 1.00 0.00 H new ATOM 0 HG1 THR A 2 -2.572 -22.492 -2.824 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.959 -21.385 -0.964 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.891 -20.724 0.401 1.00 0.00 H new ATOM 0 HG23 THR A 2 -1.591 -22.475 0.293 1.00 0.00 H new ATOM 25 N SER A 3 -4.410 -20.724 1.877 1.00 0.00 N ATOM 26 CA SER A 3 -4.772 -19.635 2.764 1.00 0.00 C ATOM 27 C SER A 3 -3.484 -18.902 3.140 1.00 0.00 C ATOM 28 O SER A 3 -2.521 -19.525 3.594 1.00 0.00 O ATOM 29 CB SER A 3 -5.570 -20.169 3.961 1.00 0.00 C ATOM 30 OG SER A 3 -6.265 -21.381 3.669 1.00 0.00 O ATOM 0 H SER A 3 -3.858 -21.451 2.333 1.00 0.00 H new ATOM 0 HA SER A 3 -5.436 -18.916 2.283 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.892 -20.338 4.797 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.287 -19.413 4.280 1.00 0.00 H new ATOM 0 HG SER A 3 -6.840 -21.619 4.426 1.00 0.00 H new ATOM 36 N THR A 4 -3.374 -17.600 2.879 1.00 0.00 N ATOM 37 CA THR A 4 -2.282 -16.792 3.420 1.00 0.00 C ATOM 38 C THR A 4 -2.821 -15.381 3.617 1.00 0.00 C ATOM 39 O THR A 4 -3.344 -14.790 2.665 1.00 0.00 O ATOM 40 CB THR A 4 -1.049 -16.805 2.494 1.00 0.00 C ATOM 41 OG1 THR A 4 -0.729 -18.126 2.087 1.00 0.00 O ATOM 42 CG2 THR A 4 0.184 -16.210 3.184 1.00 0.00 C ATOM 0 H THR A 4 -4.030 -17.081 2.295 1.00 0.00 H new ATOM 0 HA THR A 4 -1.942 -17.205 4.370 1.00 0.00 H new ATOM 0 HB THR A 4 -1.310 -16.198 1.627 1.00 0.00 H new ATOM 0 HG1 THR A 4 -1.201 -18.768 2.658 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.032 -16.237 2.500 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.021 -15.178 3.468 1.00 0.00 H new ATOM 0 HG23 THR A 4 0.418 -16.792 4.075 1.00 0.00 H new ATOM 50 N VAL A 5 -2.706 -14.862 4.839 1.00 0.00 N ATOM 51 CA VAL A 5 -3.088 -13.501 5.171 1.00 0.00 C ATOM 52 C VAL A 5 -1.857 -12.753 5.674 1.00 0.00 C ATOM 53 O VAL A 5 -1.123 -13.261 6.526 1.00 0.00 O ATOM 54 CB VAL A 5 -4.266 -13.548 6.159 1.00 0.00 C ATOM 55 CG1 VAL A 5 -3.935 -14.052 7.565 1.00 0.00 C ATOM 56 CG2 VAL A 5 -4.953 -12.192 6.226 1.00 0.00 C ATOM 0 H VAL A 5 -2.339 -15.387 5.633 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.443 -12.944 4.304 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.941 -14.301 5.751 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -4.837 -14.043 8.176 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -3.547 -15.069 7.505 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -3.184 -13.403 8.017 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -5.785 -12.240 6.929 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -4.239 -11.439 6.559 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -5.328 -11.925 5.238 1.00 0.00 H new ATOM 66 N THR A 6 -1.637 -11.553 5.144 1.00 0.00 N ATOM 67 CA THR A 6 -0.548 -10.689 5.559 1.00 0.00 C ATOM 68 C THR A 6 -1.075 -9.255 5.615 1.00 0.00 C ATOM 69 O THR A 6 -2.104 -8.936 5.010 1.00 0.00 O ATOM 70 CB THR A 6 0.657 -10.836 4.601 1.00 0.00 C ATOM 71 OG1 THR A 6 0.947 -12.181 4.286 1.00 0.00 O ATOM 72 CG2 THR A 6 1.922 -10.235 5.202 1.00 0.00 C ATOM 0 H THR A 6 -2.218 -11.154 4.407 1.00 0.00 H new ATOM 0 HA THR A 6 -0.188 -10.971 6.549 1.00 0.00 H new ATOM 0 HB THR A 6 0.363 -10.305 3.695 1.00 0.00 H new ATOM 0 HG1 THR A 6 1.703 -12.215 3.663 1.00 0.00 H new ATOM 0 HG21 THR A 6 2.750 -10.355 4.503 1.00 0.00 H new ATOM 0 HG22 THR A 6 1.764 -9.174 5.398 1.00 0.00 H new ATOM 0 HG23 THR A 6 2.159 -10.745 6.136 1.00 0.00 H new ATOM 80 N GLY A 7 -0.341 -8.381 6.288 1.00 0.00 N ATOM 81 CA GLY A 7 -0.559 -6.956 6.343 1.00 0.00 C ATOM 82 C GLY A 7 0.674 -6.295 6.946 1.00 0.00 C ATOM 83 O GLY A 7 1.509 -6.958 7.570 1.00 0.00 O ATOM 0 H GLY A 7 0.467 -8.671 6.839 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.747 -6.564 5.344 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.440 -6.732 6.944 1.00 0.00 H new ATOM 87 N GLY A 8 0.789 -4.988 6.761 1.00 0.00 N ATOM 88 CA GLY A 8 1.924 -4.195 7.195 1.00 0.00 C ATOM 89 C GLY A 8 1.903 -2.871 6.447 1.00 0.00 C ATOM 90 O GLY A 8 1.477 -2.796 5.296 1.00 0.00 O ATOM 0 H GLY A 8 0.072 -4.436 6.290 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.877 -4.023 8.270 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.855 -4.727 6.998 1.00 0.00 H new ATOM 94 N TYR A 9 2.234 -1.799 7.153 1.00 0.00 N ATOM 95 CA TYR A 9 2.246 -0.424 6.677 1.00 0.00 C ATOM 96 C TYR A 9 3.280 0.331 7.503 1.00 0.00 C ATOM 97 O TYR A 9 3.696 -0.152 8.562 1.00 0.00 O ATOM 98 CB TYR A 9 0.846 0.166 6.788 1.00 0.00 C ATOM 99 CG TYR A 9 0.506 1.315 5.861 1.00 0.00 C ATOM 100 CD1 TYR A 9 1.081 2.580 6.038 1.00 0.00 C ATOM 101 CD2 TYR A 9 -0.390 1.116 4.798 1.00 0.00 C ATOM 102 CE1 TYR A 9 0.877 3.590 5.087 1.00 0.00 C ATOM 103 CE2 TYR A 9 -0.633 2.121 3.857 1.00 0.00 C ATOM 104 CZ TYR A 9 0.033 3.353 3.984 1.00 0.00 C ATOM 105 OH TYR A 9 -0.122 4.304 3.037 1.00 0.00 O ATOM 0 H TYR A 9 2.518 -1.871 8.130 1.00 0.00 H new ATOM 0 HA TYR A 9 2.524 -0.355 5.625 1.00 0.00 H new ATOM 0 HB2 TYR A 9 0.127 -0.634 6.613 1.00 0.00 H new ATOM 0 HB3 TYR A 9 0.702 0.505 7.814 1.00 0.00 H new ATOM 0 HD1 TYR A 9 1.685 2.778 6.911 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -0.901 0.169 4.706 1.00 0.00 H new ATOM 0 HE1 TYR A 9 1.365 4.547 5.200 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -1.323 1.953 3.043 1.00 0.00 H new ATOM 0 HH TYR A 9 0.138 5.175 3.403 1.00 0.00 H new ATOM 115 N ALA A 10 3.764 1.452 6.992 1.00 0.00 N ATOM 116 CA ALA A 10 4.662 2.352 7.696 1.00 0.00 C ATOM 117 C ALA A 10 4.489 3.753 7.139 1.00 0.00 C ATOM 118 O ALA A 10 3.745 3.971 6.185 1.00 0.00 O ATOM 119 CB ALA A 10 6.117 1.913 7.644 1.00 0.00 C ATOM 0 H ALA A 10 3.536 1.769 6.050 1.00 0.00 H new ATOM 0 HA ALA A 10 4.394 2.334 8.752 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.733 2.629 8.189 1.00 0.00 H new ATOM 0 HB2 ALA A 10 6.216 0.928 8.100 1.00 0.00 H new ATOM 0 HB3 ALA A 10 6.446 1.867 6.606 1.00 0.00 H new ATOM 125 N GLN A 11 5.165 4.709 7.754 1.00 0.00 N ATOM 126 CA GLN A 11 4.899 6.119 7.567 1.00 0.00 C ATOM 127 C GLN A 11 5.929 6.654 6.587 1.00 0.00 C ATOM 128 O GLN A 11 7.115 6.357 6.736 1.00 0.00 O ATOM 129 CB GLN A 11 4.879 6.877 8.911 1.00 0.00 C ATOM 130 CG GLN A 11 6.191 6.933 9.723 1.00 0.00 C ATOM 131 CD GLN A 11 6.616 5.579 10.287 1.00 0.00 C ATOM 132 OE1 GLN A 11 7.588 4.917 9.682 1.00 0.00 O flip ATOM 133 NE2 GLN A 11 6.062 5.108 11.278 1.00 0.00 N flip ATOM 0 H GLN A 11 5.926 4.520 8.407 1.00 0.00 H new ATOM 0 HA GLN A 11 3.903 6.273 7.151 1.00 0.00 H new ATOM 0 HB2 GLN A 11 4.563 7.901 8.714 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.114 6.423 9.541 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.987 7.319 9.086 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.071 7.639 10.545 1.00 0.00 H new ATOM 0 HE21 GLN A 11 5.313 5.626 11.738 1.00 0.00 H new ATOM 0 HE22 GLN A 11 6.351 4.199 11.640 1.00 0.00 H new ATOM 142 N SER A 12 5.490 7.423 5.596 1.00 0.00 N ATOM 143 CA SER A 12 6.380 7.918 4.567 1.00 0.00 C ATOM 144 C SER A 12 7.049 9.179 5.080 1.00 0.00 C ATOM 145 O SER A 12 6.355 10.099 5.515 1.00 0.00 O ATOM 146 CB SER A 12 5.572 8.206 3.292 1.00 0.00 C ATOM 147 OG SER A 12 4.357 8.896 3.565 1.00 0.00 O ATOM 0 H SER A 12 4.518 7.715 5.489 1.00 0.00 H new ATOM 0 HA SER A 12 7.144 7.179 4.327 1.00 0.00 H new ATOM 0 HB2 SER A 12 6.178 8.799 2.607 1.00 0.00 H new ATOM 0 HB3 SER A 12 5.348 7.266 2.787 1.00 0.00 H new ATOM 0 HG SER A 12 4.504 9.544 4.285 1.00 0.00 H new ATOM 153 N ASP A 13 8.376 9.273 4.991 1.00 0.00 N ATOM 154 CA ASP A 13 9.070 10.452 5.480 1.00 0.00 C ATOM 155 C ASP A 13 9.424 11.273 4.258 1.00 0.00 C ATOM 156 O ASP A 13 10.326 10.931 3.494 1.00 0.00 O ATOM 157 CB ASP A 13 10.324 10.091 6.295 1.00 0.00 C ATOM 158 CG ASP A 13 10.051 10.105 7.795 1.00 0.00 C ATOM 159 OD1 ASP A 13 9.543 11.132 8.310 1.00 0.00 O ATOM 160 OD2 ASP A 13 10.398 9.116 8.478 1.00 0.00 O ATOM 0 H ASP A 13 8.980 8.555 4.590 1.00 0.00 H new ATOM 0 HA ASP A 13 8.434 11.013 6.164 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.677 9.103 6.000 1.00 0.00 H new ATOM 0 HB3 ASP A 13 11.122 10.797 6.065 1.00 0.00 H new ATOM 165 N ALA A 14 8.692 12.376 4.097 1.00 0.00 N ATOM 166 CA ALA A 14 8.970 13.371 3.076 1.00 0.00 C ATOM 167 C ALA A 14 10.219 14.159 3.472 1.00 0.00 C ATOM 168 O ALA A 14 10.182 14.828 4.512 1.00 0.00 O ATOM 169 CB ALA A 14 7.744 14.269 2.916 1.00 0.00 C ATOM 0 H ALA A 14 7.885 12.600 4.679 1.00 0.00 H new ATOM 0 HA ALA A 14 9.169 12.901 2.113 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.941 15.021 2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 14 6.887 13.665 2.619 1.00 0.00 H new ATOM 0 HB3 ALA A 14 7.529 14.763 3.863 1.00 0.00 H new ATOM 175 N GLN A 15 11.291 14.072 2.674 1.00 0.00 N ATOM 176 CA GLN A 15 12.664 14.527 2.930 1.00 0.00 C ATOM 177 C GLN A 15 13.319 13.935 4.192 1.00 0.00 C ATOM 178 O GLN A 15 14.447 13.444 4.119 1.00 0.00 O ATOM 179 CB GLN A 15 12.784 16.060 2.847 1.00 0.00 C ATOM 180 CG GLN A 15 14.240 16.464 2.552 1.00 0.00 C ATOM 181 CD GLN A 15 14.466 17.973 2.549 1.00 0.00 C ATOM 182 OE1 GLN A 15 14.236 18.637 3.558 1.00 0.00 O ATOM 183 NE2 GLN A 15 14.950 18.551 1.463 1.00 0.00 N ATOM 0 H GLN A 15 11.213 13.644 1.752 1.00 0.00 H new ATOM 0 HA GLN A 15 13.258 14.112 2.116 1.00 0.00 H new ATOM 0 HB2 GLN A 15 12.127 16.442 2.065 1.00 0.00 H new ATOM 0 HB3 GLN A 15 12.457 16.509 3.785 1.00 0.00 H new ATOM 0 HG2 GLN A 15 14.893 16.009 3.297 1.00 0.00 H new ATOM 0 HG3 GLN A 15 14.531 16.059 1.583 1.00 0.00 H new ATOM 0 HE21 GLN A 15 15.138 17.994 0.630 1.00 0.00 H new ATOM 0 HE22 GLN A 15 15.135 19.554 1.459 1.00 0.00 H new ATOM 192 N GLY A 16 12.661 13.988 5.351 1.00 0.00 N ATOM 193 CA GLY A 16 13.188 13.442 6.592 1.00 0.00 C ATOM 194 C GLY A 16 12.333 13.791 7.800 1.00 0.00 C ATOM 195 O GLY A 16 12.163 12.958 8.688 1.00 0.00 O ATOM 0 H GLY A 16 11.740 14.416 5.450 1.00 0.00 H new ATOM 0 HA2 GLY A 16 13.260 12.358 6.505 1.00 0.00 H new ATOM 0 HA3 GLY A 16 14.199 13.817 6.748 1.00 0.00 H new ATOM 199 N GLN A 17 11.792 15.008 7.863 1.00 0.00 N ATOM 200 CA GLN A 17 10.634 15.339 8.677 1.00 0.00 C ATOM 201 C GLN A 17 9.896 16.497 8.023 1.00 0.00 C ATOM 202 O GLN A 17 10.408 17.613 7.965 1.00 0.00 O ATOM 203 CB GLN A 17 10.978 15.581 10.158 1.00 0.00 C ATOM 204 CG GLN A 17 10.468 14.423 11.040 1.00 0.00 C ATOM 205 CD GLN A 17 11.522 13.900 11.998 1.00 0.00 C ATOM 206 OE1 GLN A 17 11.441 14.152 13.201 1.00 0.00 O ATOM 207 NE2 GLN A 17 12.505 13.166 11.505 1.00 0.00 N ATOM 0 H GLN A 17 12.157 15.803 7.338 1.00 0.00 H new ATOM 0 HA GLN A 17 9.967 14.478 8.712 1.00 0.00 H new ATOM 0 HB2 GLN A 17 12.057 15.682 10.273 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.533 16.519 10.490 1.00 0.00 H new ATOM 0 HG2 GLN A 17 9.603 14.761 11.610 1.00 0.00 H new ATOM 0 HG3 GLN A 17 10.130 13.608 10.400 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.546 12.974 10.504 1.00 0.00 H new ATOM 0 HE22 GLN A 17 13.223 12.792 12.126 1.00 0.00 H new ATOM 216 N MET A 18 8.699 16.221 7.512 1.00 0.00 N ATOM 217 CA MET A 18 7.780 17.206 6.996 1.00 0.00 C ATOM 218 C MET A 18 6.386 16.634 7.248 1.00 0.00 C ATOM 219 O MET A 18 5.678 17.111 8.135 1.00 0.00 O ATOM 220 CB MET A 18 8.103 17.458 5.517 1.00 0.00 C ATOM 221 CG MET A 18 7.468 18.741 5.000 1.00 0.00 C ATOM 222 SD MET A 18 7.383 18.766 3.197 1.00 0.00 S ATOM 223 CE MET A 18 6.707 20.427 2.999 1.00 0.00 C ATOM 0 H MET A 18 8.339 15.269 7.448 1.00 0.00 H new ATOM 0 HA MET A 18 7.851 18.181 7.478 1.00 0.00 H new ATOM 0 HB2 MET A 18 9.184 17.512 5.387 1.00 0.00 H new ATOM 0 HB3 MET A 18 7.752 16.615 4.922 1.00 0.00 H new ATOM 0 HG2 MET A 18 6.464 18.842 5.413 1.00 0.00 H new ATOM 0 HG3 MET A 18 8.044 19.598 5.349 1.00 0.00 H new ATOM 0 HE1 MET A 18 6.576 20.643 1.939 1.00 0.00 H new ATOM 0 HE2 MET A 18 5.743 20.490 3.504 1.00 0.00 H new ATOM 0 HE3 MET A 18 7.393 21.153 3.435 1.00 0.00 H new ATOM 233 N ASN A 19 6.025 15.524 6.595 1.00 0.00 N ATOM 234 CA ASN A 19 4.718 14.880 6.689 1.00 0.00 C ATOM 235 C ASN A 19 4.950 13.383 6.787 1.00 0.00 C ATOM 236 O ASN A 19 5.852 12.874 6.125 1.00 0.00 O ATOM 237 CB ASN A 19 3.869 15.193 5.450 1.00 0.00 C ATOM 238 CG ASN A 19 3.507 16.663 5.415 1.00 0.00 C ATOM 239 OD1 ASN A 19 2.509 17.072 6.001 1.00 0.00 O ATOM 240 ND2 ASN A 19 4.338 17.481 4.796 1.00 0.00 N ATOM 0 H ASN A 19 6.661 15.035 5.965 1.00 0.00 H new ATOM 0 HA ASN A 19 4.182 15.249 7.563 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.419 14.926 4.548 1.00 0.00 H new ATOM 0 HB3 ASN A 19 2.962 14.589 5.461 1.00 0.00 H new ATOM 0 HD21 ASN A 19 4.159 18.485 4.796 1.00 0.00 H new ATOM 0 HD22 ASN A 19 5.159 17.109 4.318 1.00 0.00 H new ATOM 247 N LYS A 20 4.145 12.695 7.602 1.00 0.00 N ATOM 248 CA LYS A 20 4.227 11.259 7.867 1.00 0.00 C ATOM 249 C LYS A 20 2.837 10.661 7.745 1.00 0.00 C ATOM 250 O LYS A 20 2.068 10.717 8.701 1.00 0.00 O ATOM 251 CB LYS A 20 4.853 10.973 9.244 1.00 0.00 C ATOM 252 CG LYS A 20 6.368 10.746 9.125 1.00 0.00 C ATOM 253 CD LYS A 20 7.068 10.782 10.494 1.00 0.00 C ATOM 254 CE LYS A 20 7.728 12.141 10.765 1.00 0.00 C ATOM 255 NZ LYS A 20 6.777 13.267 10.744 1.00 0.00 N ATOM 0 H LYS A 20 3.387 13.144 8.116 1.00 0.00 H new ATOM 0 HA LYS A 20 4.883 10.792 7.132 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.659 11.809 9.916 1.00 0.00 H new ATOM 0 HB3 LYS A 20 4.384 10.094 9.685 1.00 0.00 H new ATOM 0 HG2 LYS A 20 6.553 9.783 8.649 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.799 11.510 8.478 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.342 10.568 11.278 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.823 9.997 10.536 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.222 12.110 11.736 1.00 0.00 H new ATOM 0 HE3 LYS A 20 8.503 12.316 10.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 7.273 14.145 11.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.374 13.363 9.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.013 13.089 11.427 1.00 0.00 H new ATOM 269 N MET A 21 2.515 10.122 6.577 1.00 0.00 N ATOM 270 CA MET A 21 1.278 9.396 6.342 1.00 0.00 C ATOM 271 C MET A 21 1.597 7.925 6.573 1.00 0.00 C ATOM 272 O MET A 21 2.395 7.358 5.828 1.00 0.00 O ATOM 273 CB MET A 21 0.768 9.683 4.920 1.00 0.00 C ATOM 274 CG MET A 21 -0.128 10.931 4.881 1.00 0.00 C ATOM 275 SD MET A 21 0.552 12.471 5.575 1.00 0.00 S ATOM 276 CE MET A 21 -0.889 13.549 5.367 1.00 0.00 C ATOM 0 H MET A 21 3.116 10.179 5.755 1.00 0.00 H new ATOM 0 HA MET A 21 0.477 9.704 7.014 1.00 0.00 H new ATOM 0 HB2 MET A 21 1.616 9.822 4.250 1.00 0.00 H new ATOM 0 HB3 MET A 21 0.210 8.822 4.552 1.00 0.00 H new ATOM 0 HG2 MET A 21 -0.398 11.120 3.842 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.051 10.700 5.413 1.00 0.00 H new ATOM 0 HE1 MET A 21 -0.655 14.546 5.742 1.00 0.00 H new ATOM 0 HE2 MET A 21 -1.148 13.610 4.310 1.00 0.00 H new ATOM 0 HE3 MET A 21 -1.732 13.141 5.924 1.00 0.00 H new ATOM 286 N GLY A 22 1.043 7.333 7.637 1.00 0.00 N ATOM 287 CA GLY A 22 1.159 5.918 7.967 1.00 0.00 C ATOM 288 C GLY A 22 -0.212 5.375 8.368 1.00 0.00 C ATOM 289 O GLY A 22 -1.054 6.146 8.847 1.00 0.00 O ATOM 0 H GLY A 22 0.482 7.850 8.314 1.00 0.00 H new ATOM 0 HA2 GLY A 22 1.545 5.364 7.111 1.00 0.00 H new ATOM 0 HA3 GLY A 22 1.869 5.781 8.782 1.00 0.00 H new ATOM 293 N GLY A 23 -0.425 4.061 8.230 1.00 0.00 N ATOM 294 CA GLY A 23 -1.686 3.421 8.587 1.00 0.00 C ATOM 295 C GLY A 23 -1.552 1.906 8.718 1.00 0.00 C ATOM 296 O GLY A 23 -0.758 1.451 9.541 1.00 0.00 O ATOM 0 H GLY A 23 0.276 3.415 7.867 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -2.046 3.834 9.529 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.435 3.653 7.830 1.00 0.00 H new ATOM 300 N PHE A 24 -2.314 1.133 7.934 1.00 0.00 N ATOM 301 CA PHE A 24 -2.262 -0.332 7.825 1.00 0.00 C ATOM 302 C PHE A 24 -2.707 -0.747 6.414 1.00 0.00 C ATOM 303 O PHE A 24 -3.533 -0.056 5.813 1.00 0.00 O ATOM 304 CB PHE A 24 -3.059 -1.059 8.925 1.00 0.00 C ATOM 305 CG PHE A 24 -2.119 -1.665 9.957 1.00 0.00 C ATOM 306 CD1 PHE A 24 -1.402 -2.838 9.641 1.00 0.00 C ATOM 307 CD2 PHE A 24 -1.855 -1.003 11.173 1.00 0.00 C ATOM 308 CE1 PHE A 24 -0.396 -3.307 10.504 1.00 0.00 C ATOM 309 CE2 PHE A 24 -0.860 -1.485 12.042 1.00 0.00 C ATOM 310 CZ PHE A 24 -0.116 -2.625 11.699 1.00 0.00 C ATOM 0 H PHE A 24 -3.025 1.536 7.323 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.230 -0.644 7.984 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.739 -0.360 9.411 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.672 -1.842 8.480 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.627 -3.378 8.733 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -2.420 -0.121 11.439 1.00 0.00 H new ATOM 0 HE1 PHE A 24 0.163 -4.195 10.247 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -0.668 -0.977 12.975 1.00 0.00 H new ATOM 0 HZ PHE A 24 0.669 -2.976 12.352 1.00 0.00 H new ATOM 320 N ASN A 25 -2.159 -1.854 5.894 1.00 0.00 N ATOM 321 CA ASN A 25 -2.520 -2.520 4.640 1.00 0.00 C ATOM 322 C ASN A 25 -2.807 -3.980 4.978 1.00 0.00 C ATOM 323 O ASN A 25 -2.248 -4.478 5.956 1.00 0.00 O ATOM 324 CB ASN A 25 -1.354 -2.502 3.633 1.00 0.00 C ATOM 325 CG ASN A 25 -1.839 -2.583 2.196 1.00 0.00 C ATOM 326 OD1 ASN A 25 -2.741 -3.340 1.850 1.00 0.00 O ATOM 327 ND2 ASN A 25 -1.245 -1.822 1.302 1.00 0.00 N ATOM 0 H ASN A 25 -1.400 -2.339 6.373 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.373 -2.007 4.196 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.773 -1.590 3.768 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.686 -3.339 3.837 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -1.535 -1.862 0.325 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.495 -1.192 1.586 1.00 0.00 H new ATOM 334 N LEU A 26 -3.590 -4.678 4.156 1.00 0.00 N ATOM 335 CA LEU A 26 -4.001 -6.064 4.344 1.00 0.00 C ATOM 336 C LEU A 26 -4.137 -6.738 2.984 1.00 0.00 C ATOM 337 O LEU A 26 -4.685 -6.131 2.057 1.00 0.00 O ATOM 338 CB LEU A 26 -5.376 -6.080 5.027 1.00 0.00 C ATOM 339 CG LEU A 26 -5.336 -5.856 6.547 1.00 0.00 C ATOM 340 CD1 LEU A 26 -6.772 -5.661 7.026 1.00 0.00 C ATOM 341 CD2 LEU A 26 -4.701 -7.045 7.275 1.00 0.00 C ATOM 0 H LEU A 26 -3.971 -4.271 3.302 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.262 -6.588 4.950 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.001 -5.309 4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.856 -7.038 4.826 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.726 -4.980 6.768 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.777 -5.499 8.104 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.208 -4.795 6.527 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.358 -6.549 6.790 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -4.690 -6.851 8.348 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.281 -7.946 7.075 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.680 -7.185 6.921 1.00 0.00 H new ATOM 353 N LYS A 27 -3.705 -7.996 2.866 1.00 0.00 N ATOM 354 CA LYS A 27 -3.872 -8.821 1.671 1.00 0.00 C ATOM 355 C LYS A 27 -4.566 -10.122 2.032 1.00 0.00 C ATOM 356 O LYS A 27 -4.407 -10.626 3.148 1.00 0.00 O ATOM 357 CB LYS A 27 -2.515 -9.063 0.975 1.00 0.00 C ATOM 358 CG LYS A 27 -1.543 -10.075 1.613 1.00 0.00 C ATOM 359 CD LYS A 27 -1.740 -11.542 1.177 1.00 0.00 C ATOM 360 CE LYS A 27 -0.567 -12.432 1.594 1.00 0.00 C ATOM 361 NZ LYS A 27 0.698 -12.111 0.891 1.00 0.00 N ATOM 0 H LYS A 27 -3.217 -8.480 3.620 1.00 0.00 H new ATOM 0 HA LYS A 27 -4.504 -8.291 0.958 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -2.717 -9.392 -0.044 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.000 -8.105 0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -0.523 -9.775 1.373 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.645 -10.018 2.697 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -2.660 -11.929 1.614 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -1.859 -11.585 0.094 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -0.411 -12.334 2.668 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -0.826 -13.473 1.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.485 -12.124 1.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.871 -12.817 0.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.626 -11.167 0.461 1.00 0.00 H new ATOM 375 N TYR A 28 -5.235 -10.713 1.047 1.00 0.00 N ATOM 376 CA TYR A 28 -5.668 -12.099 1.037 1.00 0.00 C ATOM 377 C TYR A 28 -5.524 -12.548 -0.409 1.00 0.00 C ATOM 378 O TYR A 28 -6.043 -11.874 -1.303 1.00 0.00 O ATOM 379 CB TYR A 28 -7.129 -12.223 1.503 1.00 0.00 C ATOM 380 CG TYR A 28 -7.300 -12.851 2.872 1.00 0.00 C ATOM 381 CD1 TYR A 28 -6.836 -14.161 3.103 1.00 0.00 C ATOM 382 CD2 TYR A 28 -7.959 -12.154 3.903 1.00 0.00 C ATOM 383 CE1 TYR A 28 -7.030 -14.768 4.354 1.00 0.00 C ATOM 384 CE2 TYR A 28 -8.136 -12.748 5.164 1.00 0.00 C ATOM 385 CZ TYR A 28 -7.658 -14.055 5.399 1.00 0.00 C ATOM 386 OH TYR A 28 -7.762 -14.623 6.629 1.00 0.00 O ATOM 0 H TYR A 28 -5.500 -10.213 0.198 1.00 0.00 H new ATOM 0 HA TYR A 28 -5.077 -12.713 1.717 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -7.579 -11.230 1.513 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -7.681 -12.816 0.774 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -6.330 -14.700 2.316 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -8.331 -11.156 3.723 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.698 -15.783 4.518 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -8.637 -12.205 5.952 1.00 0.00 H new ATOM 0 HH TYR A 28 -8.218 -14.005 7.237 1.00 0.00 H new ATOM 396 N ARG A 29 -4.819 -13.657 -0.650 1.00 0.00 N ATOM 397 CA ARG A 29 -4.653 -14.212 -1.994 1.00 0.00 C ATOM 398 C ARG A 29 -5.743 -15.253 -2.191 1.00 0.00 C ATOM 399 O ARG A 29 -6.045 -15.964 -1.230 1.00 0.00 O ATOM 400 CB ARG A 29 -3.233 -14.807 -2.151 1.00 0.00 C ATOM 401 CG ARG A 29 -3.031 -15.563 -3.480 1.00 0.00 C ATOM 402 CD ARG A 29 -1.590 -16.041 -3.709 1.00 0.00 C ATOM 403 NE ARG A 29 -1.491 -17.036 -4.798 1.00 0.00 N ATOM 404 CZ ARG A 29 -1.429 -18.373 -4.675 1.00 0.00 C ATOM 405 NH1 ARG A 29 -1.428 -18.978 -3.494 1.00 0.00 N ATOM 406 NH2 ARG A 29 -1.358 -19.135 -5.757 1.00 0.00 N ATOM 0 H ARG A 29 -4.349 -14.193 0.079 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.750 -13.443 -2.760 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -2.500 -14.003 -2.084 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.038 -15.486 -1.321 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -3.697 -16.425 -3.502 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -3.324 -14.913 -4.305 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -0.959 -15.184 -3.946 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -1.204 -16.476 -2.787 1.00 0.00 H new ATOM 0 HE ARG A 29 -1.467 -16.667 -5.749 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.475 -18.425 -2.638 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -1.380 -19.996 -3.442 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.350 -18.707 -6.683 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.311 -20.150 -5.664 1.00 0.00 H new ATOM 420 N TYR A 30 -6.311 -15.386 -3.392 1.00 0.00 N ATOM 421 CA TYR A 30 -7.145 -16.545 -3.697 1.00 0.00 C ATOM 422 C TYR A 30 -6.283 -17.520 -4.486 1.00 0.00 C ATOM 423 O TYR A 30 -5.396 -17.078 -5.213 1.00 0.00 O ATOM 424 CB TYR A 30 -8.379 -16.116 -4.501 1.00 0.00 C ATOM 425 CG TYR A 30 -9.604 -16.971 -4.241 1.00 0.00 C ATOM 426 CD1 TYR A 30 -10.232 -16.893 -2.985 1.00 0.00 C ATOM 427 CD2 TYR A 30 -10.165 -17.773 -5.253 1.00 0.00 C ATOM 428 CE1 TYR A 30 -11.432 -17.579 -2.743 1.00 0.00 C ATOM 429 CE2 TYR A 30 -11.380 -18.446 -5.024 1.00 0.00 C ATOM 430 CZ TYR A 30 -12.028 -18.338 -3.770 1.00 0.00 C ATOM 431 OH TYR A 30 -13.222 -18.956 -3.560 1.00 0.00 O ATOM 0 H TYR A 30 -6.210 -14.717 -4.155 1.00 0.00 H new ATOM 0 HA TYR A 30 -7.509 -17.018 -2.785 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -8.614 -15.079 -4.263 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.140 -16.153 -5.564 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.787 -16.300 -2.200 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -9.664 -17.872 -6.204 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -11.898 -17.525 -1.770 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -11.819 -19.046 -5.807 1.00 0.00 H new ATOM 0 HH TYR A 30 -13.490 -19.435 -4.372 1.00 0.00 H new ATOM 441 N GLU A 31 -6.519 -18.827 -4.374 1.00 0.00 N ATOM 442 CA GLU A 31 -6.006 -19.797 -5.328 1.00 0.00 C ATOM 443 C GLU A 31 -7.205 -20.653 -5.713 1.00 0.00 C ATOM 444 O GLU A 31 -7.866 -21.190 -4.820 1.00 0.00 O ATOM 445 CB GLU A 31 -4.862 -20.561 -4.662 1.00 0.00 C ATOM 446 CG GLU A 31 -4.217 -21.619 -5.569 1.00 0.00 C ATOM 447 CD GLU A 31 -2.743 -21.860 -5.218 1.00 0.00 C ATOM 448 OE1 GLU A 31 -2.290 -21.500 -4.107 1.00 0.00 O ATOM 449 OE2 GLU A 31 -1.977 -22.259 -6.119 1.00 0.00 O ATOM 0 H GLU A 31 -7.070 -19.237 -3.620 1.00 0.00 H new ATOM 0 HA GLU A 31 -5.582 -19.369 -6.236 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -4.098 -19.851 -4.346 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -5.237 -21.047 -3.761 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.768 -22.555 -5.481 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.294 -21.300 -6.608 1.00 0.00 H new ATOM 456 N GLU A 32 -7.576 -20.659 -6.994 1.00 0.00 N ATOM 457 CA GLU A 32 -8.711 -21.429 -7.481 1.00 0.00 C ATOM 458 C GLU A 32 -8.342 -22.908 -7.517 1.00 0.00 C ATOM 459 O GLU A 32 -7.190 -23.291 -7.291 1.00 0.00 O ATOM 460 CB GLU A 32 -9.145 -20.943 -8.872 1.00 0.00 C ATOM 461 CG GLU A 32 -9.780 -19.554 -8.808 1.00 0.00 C ATOM 462 CD GLU A 32 -10.611 -19.285 -10.060 1.00 0.00 C ATOM 463 OE1 GLU A 32 -10.051 -18.934 -11.121 1.00 0.00 O ATOM 464 OE2 GLU A 32 -11.851 -19.454 -9.974 1.00 0.00 O ATOM 0 H GLU A 32 -7.095 -20.128 -7.720 1.00 0.00 H new ATOM 0 HA GLU A 32 -9.553 -21.287 -6.804 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -8.281 -20.919 -9.536 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -9.856 -21.650 -9.300 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -10.411 -19.477 -7.923 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.002 -18.797 -8.712 1.00 0.00 H new ATOM 471 N ASP A 33 -9.322 -23.752 -7.817 1.00 0.00 N ATOM 472 CA ASP A 33 -9.160 -25.196 -7.822 1.00 0.00 C ATOM 473 C ASP A 33 -8.101 -25.632 -8.824 1.00 0.00 C ATOM 474 O ASP A 33 -7.136 -26.290 -8.444 1.00 0.00 O ATOM 475 CB ASP A 33 -10.495 -25.855 -8.137 1.00 0.00 C ATOM 476 CG ASP A 33 -10.425 -27.339 -7.806 1.00 0.00 C ATOM 477 OD1 ASP A 33 -10.013 -28.115 -8.688 1.00 0.00 O ATOM 478 OD2 ASP A 33 -10.779 -27.672 -6.644 1.00 0.00 O ATOM 0 H ASP A 33 -10.263 -23.446 -8.066 1.00 0.00 H new ATOM 0 HA ASP A 33 -8.824 -25.510 -6.834 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -11.290 -25.381 -7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -10.739 -25.719 -9.190 1.00 0.00 H new ATOM 483 N ASN A 34 -8.253 -25.203 -10.077 1.00 0.00 N ATOM 484 CA ASN A 34 -7.366 -25.549 -11.176 1.00 0.00 C ATOM 485 C ASN A 34 -7.164 -24.305 -12.034 1.00 0.00 C ATOM 486 O ASN A 34 -7.532 -24.246 -13.212 1.00 0.00 O ATOM 487 CB ASN A 34 -7.893 -26.782 -11.937 1.00 0.00 C ATOM 488 CG ASN A 34 -7.254 -28.042 -11.377 1.00 0.00 C ATOM 489 OD1 ASN A 34 -6.162 -28.401 -11.807 1.00 0.00 O ATOM 490 ND2 ASN A 34 -7.870 -28.714 -10.418 1.00 0.00 N ATOM 0 H ASN A 34 -9.018 -24.589 -10.358 1.00 0.00 H new ATOM 0 HA ASN A 34 -6.383 -25.854 -10.816 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -8.978 -26.841 -11.846 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -7.667 -26.690 -12.999 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -7.438 -29.548 -10.021 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -8.777 -28.398 -10.075 1.00 0.00 H new ATOM 497 N SER A 35 -6.616 -23.263 -11.414 1.00 0.00 N ATOM 498 CA SER A 35 -6.085 -22.093 -12.087 1.00 0.00 C ATOM 499 C SER A 35 -4.869 -21.681 -11.261 1.00 0.00 C ATOM 500 O SER A 35 -5.051 -21.306 -10.095 1.00 0.00 O ATOM 501 CB SER A 35 -7.139 -20.979 -12.190 1.00 0.00 C ATOM 502 OG SER A 35 -6.963 -20.283 -13.409 1.00 0.00 O ATOM 0 H SER A 35 -6.529 -23.213 -10.399 1.00 0.00 H new ATOM 0 HA SER A 35 -5.804 -22.300 -13.120 1.00 0.00 H new ATOM 0 HB2 SER A 35 -8.141 -21.405 -12.142 1.00 0.00 H new ATOM 0 HB3 SER A 35 -7.044 -20.293 -11.349 1.00 0.00 H new ATOM 0 HG SER A 35 -7.634 -19.573 -13.480 1.00 0.00 H new ATOM 508 N PRO A 36 -3.635 -21.832 -11.775 1.00 0.00 N ATOM 509 CA PRO A 36 -2.423 -21.563 -11.019 1.00 0.00 C ATOM 510 C PRO A 36 -2.197 -20.045 -10.954 1.00 0.00 C ATOM 511 O PRO A 36 -1.289 -19.491 -11.582 1.00 0.00 O ATOM 512 CB PRO A 36 -1.328 -22.344 -11.751 1.00 0.00 C ATOM 513 CG PRO A 36 -1.775 -22.296 -13.208 1.00 0.00 C ATOM 514 CD PRO A 36 -3.297 -22.390 -13.079 1.00 0.00 C ATOM 0 HA PRO A 36 -2.454 -21.882 -9.977 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -0.348 -21.885 -11.616 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -1.253 -23.369 -11.387 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -1.464 -21.374 -13.700 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -1.363 -23.122 -13.788 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -3.789 -21.836 -13.878 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -3.630 -23.425 -13.157 1.00 0.00 H new ATOM 522 N LEU A 37 -3.065 -19.346 -10.225 1.00 0.00 N ATOM 523 CA LEU A 37 -3.196 -17.899 -10.155 1.00 0.00 C ATOM 524 C LEU A 37 -3.488 -17.518 -8.708 1.00 0.00 C ATOM 525 O LEU A 37 -4.014 -18.319 -7.934 1.00 0.00 O ATOM 526 CB LEU A 37 -4.356 -17.428 -11.053 1.00 0.00 C ATOM 527 CG LEU A 37 -4.314 -15.919 -11.380 1.00 0.00 C ATOM 528 CD1 LEU A 37 -3.345 -15.624 -12.528 1.00 0.00 C ATOM 529 CD2 LEU A 37 -5.708 -15.388 -11.697 1.00 0.00 C ATOM 0 H LEU A 37 -3.744 -19.815 -9.625 1.00 0.00 H new ATOM 0 HA LEU A 37 -2.276 -17.426 -10.498 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -4.335 -17.993 -11.985 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.301 -17.658 -10.561 1.00 0.00 H new ATOM 0 HG LEU A 37 -3.948 -15.401 -10.494 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.339 -14.553 -12.733 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.342 -15.946 -12.249 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.664 -16.163 -13.420 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.649 -14.323 -11.923 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.113 -15.920 -12.558 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.360 -15.540 -10.837 1.00 0.00 H new ATOM 541 N GLY A 38 -3.163 -16.282 -8.354 1.00 0.00 N ATOM 542 CA GLY A 38 -3.895 -15.548 -7.347 1.00 0.00 C ATOM 543 C GLY A 38 -3.811 -14.061 -7.659 1.00 0.00 C ATOM 544 O GLY A 38 -3.146 -13.652 -8.618 1.00 0.00 O ATOM 0 H GLY A 38 -2.383 -15.765 -8.761 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -4.936 -15.871 -7.328 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.481 -15.749 -6.359 1.00 0.00 H new ATOM 548 N VAL A 39 -4.457 -13.254 -6.831 1.00 0.00 N ATOM 549 CA VAL A 39 -4.458 -11.797 -6.866 1.00 0.00 C ATOM 550 C VAL A 39 -4.416 -11.326 -5.424 1.00 0.00 C ATOM 551 O VAL A 39 -4.717 -12.126 -4.539 1.00 0.00 O ATOM 552 CB VAL A 39 -5.728 -11.264 -7.564 1.00 0.00 C ATOM 553 CG1 VAL A 39 -5.767 -11.758 -9.005 1.00 0.00 C ATOM 554 CG2 VAL A 39 -7.041 -11.700 -6.895 1.00 0.00 C ATOM 0 H VAL A 39 -5.030 -13.620 -6.070 1.00 0.00 H new ATOM 0 HA VAL A 39 -3.602 -11.426 -7.429 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.662 -10.178 -7.498 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.664 -11.380 -9.495 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.885 -11.400 -9.536 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.779 -12.848 -9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.885 -11.284 -7.445 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.107 -12.788 -6.897 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.064 -11.337 -5.867 1.00 0.00 H new ATOM 564 N ILE A 40 -4.112 -10.053 -5.182 1.00 0.00 N ATOM 565 CA ILE A 40 -4.511 -9.359 -3.972 1.00 0.00 C ATOM 566 C ILE A 40 -5.009 -7.983 -4.393 1.00 0.00 C ATOM 567 O ILE A 40 -4.600 -7.469 -5.442 1.00 0.00 O ATOM 568 CB ILE A 40 -3.394 -9.326 -2.892 1.00 0.00 C ATOM 569 CG1 ILE A 40 -2.103 -8.528 -3.178 1.00 0.00 C ATOM 570 CG2 ILE A 40 -2.921 -10.754 -2.571 1.00 0.00 C ATOM 571 CD1 ILE A 40 -2.183 -7.002 -3.084 1.00 0.00 C ATOM 0 H ILE A 40 -3.577 -9.474 -5.829 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.315 -9.898 -3.471 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.906 -8.804 -2.083 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.336 -8.869 -2.483 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.762 -8.786 -4.181 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -2.139 -10.716 -1.813 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.761 -11.340 -2.197 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.528 -11.219 -3.475 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.207 -6.572 -3.309 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.916 -6.631 -3.800 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.483 -6.715 -2.076 1.00 0.00 H new ATOM 583 N GLY A 41 -5.858 -7.375 -3.570 1.00 0.00 N ATOM 584 CA GLY A 41 -6.008 -5.933 -3.536 1.00 0.00 C ATOM 585 C GLY A 41 -5.150 -5.412 -2.390 1.00 0.00 C ATOM 586 O GLY A 41 -4.984 -6.103 -1.378 1.00 0.00 O ATOM 0 H GLY A 41 -6.458 -7.871 -2.911 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -5.694 -5.492 -4.482 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -7.053 -5.659 -3.388 1.00 0.00 H new ATOM 590 N SER A 42 -4.641 -4.190 -2.505 1.00 0.00 N ATOM 591 CA SER A 42 -3.830 -3.534 -1.491 1.00 0.00 C ATOM 592 C SER A 42 -4.535 -2.231 -1.130 1.00 0.00 C ATOM 593 O SER A 42 -5.049 -1.551 -2.018 1.00 0.00 O ATOM 594 CB SER A 42 -2.400 -3.395 -2.046 1.00 0.00 C ATOM 595 OG SER A 42 -1.696 -2.281 -1.534 1.00 0.00 O ATOM 0 H SER A 42 -4.787 -3.613 -3.333 1.00 0.00 H new ATOM 0 HA SER A 42 -3.726 -4.093 -0.561 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.841 -4.303 -1.817 1.00 0.00 H new ATOM 0 HB3 SER A 42 -2.448 -3.315 -3.132 1.00 0.00 H new ATOM 0 HG SER A 42 -1.862 -1.500 -2.102 1.00 0.00 H new ATOM 601 N PHE A 43 -4.598 -1.886 0.158 1.00 0.00 N ATOM 602 CA PHE A 43 -5.371 -0.749 0.635 1.00 0.00 C ATOM 603 C PHE A 43 -4.499 0.270 1.348 1.00 0.00 C ATOM 604 O PHE A 43 -3.684 -0.050 2.212 1.00 0.00 O ATOM 605 CB PHE A 43 -6.555 -1.188 1.503 1.00 0.00 C ATOM 606 CG PHE A 43 -7.837 -1.345 0.713 1.00 0.00 C ATOM 607 CD1 PHE A 43 -8.369 -0.244 0.010 1.00 0.00 C ATOM 608 CD2 PHE A 43 -8.491 -2.587 0.662 1.00 0.00 C ATOM 609 CE1 PHE A 43 -9.516 -0.400 -0.785 1.00 0.00 C ATOM 610 CE2 PHE A 43 -9.634 -2.741 -0.139 1.00 0.00 C ATOM 611 CZ PHE A 43 -10.144 -1.653 -0.867 1.00 0.00 C ATOM 0 H PHE A 43 -4.111 -2.392 0.898 1.00 0.00 H new ATOM 0 HA PHE A 43 -5.784 -0.256 -0.245 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.314 -2.135 1.986 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -6.710 -0.456 2.295 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -7.893 0.722 0.083 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -8.116 -3.421 1.237 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -9.914 0.442 -1.332 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -10.124 -3.702 -0.196 1.00 0.00 H new ATOM 0 HZ PHE A 43 -11.018 -1.780 -1.489 1.00 0.00 H new ATOM 621 N THR A 44 -4.748 1.522 0.993 1.00 0.00 N ATOM 622 CA THR A 44 -4.190 2.721 1.574 1.00 0.00 C ATOM 623 C THR A 44 -5.156 3.194 2.657 1.00 0.00 C ATOM 624 O THR A 44 -6.383 3.198 2.487 1.00 0.00 O ATOM 625 CB THR A 44 -3.992 3.786 0.476 1.00 0.00 C ATOM 626 OG1 THR A 44 -4.798 3.529 -0.669 1.00 0.00 O ATOM 627 CG2 THR A 44 -2.534 3.854 0.025 1.00 0.00 C ATOM 0 H THR A 44 -5.395 1.735 0.234 1.00 0.00 H new ATOM 0 HA THR A 44 -3.212 2.534 2.018 1.00 0.00 H new ATOM 0 HB THR A 44 -4.290 4.735 0.921 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.253 3.106 -1.365 1.00 0.00 H new ATOM 0 HG21 THR A 44 -2.428 4.614 -0.749 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.902 4.111 0.875 1.00 0.00 H new ATOM 0 HG23 THR A 44 -2.231 2.886 -0.373 1.00 0.00 H new ATOM 635 N TYR A 45 -4.604 3.510 3.819 1.00 0.00 N ATOM 636 CA TYR A 45 -5.293 4.126 4.934 1.00 0.00 C ATOM 637 C TYR A 45 -4.286 5.076 5.570 1.00 0.00 C ATOM 638 O TYR A 45 -3.095 4.741 5.576 1.00 0.00 O ATOM 639 CB TYR A 45 -5.716 2.990 5.867 1.00 0.00 C ATOM 640 CG TYR A 45 -6.733 3.312 6.935 1.00 0.00 C ATOM 641 CD1 TYR A 45 -7.997 3.832 6.593 1.00 0.00 C ATOM 642 CD2 TYR A 45 -6.454 2.970 8.268 1.00 0.00 C ATOM 643 CE1 TYR A 45 -8.973 4.017 7.587 1.00 0.00 C ATOM 644 CE2 TYR A 45 -7.421 3.160 9.266 1.00 0.00 C ATOM 645 CZ TYR A 45 -8.689 3.675 8.925 1.00 0.00 C ATOM 646 OH TYR A 45 -9.634 3.812 9.888 1.00 0.00 O ATOM 0 H TYR A 45 -3.619 3.334 4.015 1.00 0.00 H new ATOM 0 HA TYR A 45 -6.186 4.691 4.667 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.115 2.182 5.254 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -4.822 2.606 6.358 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -8.216 4.088 5.567 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -5.489 2.558 8.526 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -9.940 4.421 7.326 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -7.195 2.913 10.293 1.00 0.00 H new ATOM 0 HH TYR A 45 -9.265 3.528 10.751 1.00 0.00 H new ATOM 656 N THR A 46 -4.705 6.222 6.105 1.00 0.00 N ATOM 657 CA THR A 46 -3.809 7.023 6.928 1.00 0.00 C ATOM 658 C THR A 46 -4.551 7.572 8.145 1.00 0.00 C ATOM 659 O THR A 46 -5.765 7.797 8.097 1.00 0.00 O ATOM 660 CB THR A 46 -3.131 8.088 6.041 1.00 0.00 C ATOM 661 OG1 THR A 46 -1.836 8.364 6.515 1.00 0.00 O ATOM 662 CG2 THR A 46 -3.911 9.394 5.870 1.00 0.00 C ATOM 0 H THR A 46 -5.641 6.609 5.985 1.00 0.00 H new ATOM 0 HA THR A 46 -3.005 6.416 7.345 1.00 0.00 H new ATOM 0 HB THR A 46 -3.096 7.642 5.047 1.00 0.00 H new ATOM 0 HG1 THR A 46 -1.813 9.265 6.899 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.348 10.073 5.230 1.00 0.00 H new ATOM 0 HG22 THR A 46 -4.878 9.183 5.413 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.063 9.857 6.845 1.00 0.00 H new ATOM 670 N GLU A 47 -3.807 7.801 9.224 1.00 0.00 N ATOM 671 CA GLU A 47 -4.286 8.370 10.472 1.00 0.00 C ATOM 672 C GLU A 47 -3.086 9.095 11.090 1.00 0.00 C ATOM 673 O GLU A 47 -2.203 8.452 11.663 1.00 0.00 O ATOM 674 CB GLU A 47 -4.856 7.235 11.347 1.00 0.00 C ATOM 675 CG GLU A 47 -5.663 7.699 12.562 1.00 0.00 C ATOM 676 CD GLU A 47 -4.807 8.351 13.647 1.00 0.00 C ATOM 677 OE1 GLU A 47 -4.145 7.629 14.422 1.00 0.00 O ATOM 678 OE2 GLU A 47 -4.859 9.598 13.775 1.00 0.00 O ATOM 0 H GLU A 47 -2.811 7.584 9.249 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.099 9.086 10.350 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.492 6.603 10.727 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -4.030 6.614 11.694 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -6.423 8.408 12.234 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.187 6.844 12.988 1.00 0.00 H new ATOM 685 N LYS A 48 -2.983 10.413 10.889 1.00 0.00 N ATOM 686 CA LYS A 48 -1.932 11.234 11.498 1.00 0.00 C ATOM 687 C LYS A 48 -2.394 12.683 11.573 1.00 0.00 C ATOM 688 O LYS A 48 -3.020 13.173 10.628 1.00 0.00 O ATOM 689 CB LYS A 48 -0.630 11.161 10.669 1.00 0.00 C ATOM 690 CG LYS A 48 0.624 11.145 11.560 1.00 0.00 C ATOM 691 CD LYS A 48 1.010 9.706 11.935 1.00 0.00 C ATOM 692 CE LYS A 48 2.344 9.628 12.685 1.00 0.00 C ATOM 693 NZ LYS A 48 2.266 10.178 14.049 1.00 0.00 N ATOM 0 H LYS A 48 -3.626 10.941 10.299 1.00 0.00 H new ATOM 0 HA LYS A 48 -1.735 10.852 12.500 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.645 10.264 10.049 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.583 12.015 9.993 1.00 0.00 H new ATOM 0 HG2 LYS A 48 1.452 11.624 11.038 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.440 11.724 12.465 1.00 0.00 H new ATOM 0 HD2 LYS A 48 0.224 9.273 12.554 1.00 0.00 H new ATOM 0 HD3 LYS A 48 1.071 9.103 11.029 1.00 0.00 H new ATOM 0 HE2 LYS A 48 2.667 8.588 12.736 1.00 0.00 H new ATOM 0 HE3 LYS A 48 3.104 10.170 12.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.196 10.099 14.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.985 11.178 14.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.562 9.645 14.598 1.00 0.00 H new ATOM 707 N SER A 49 -2.033 13.390 12.637 1.00 0.00 N ATOM 708 CA SER A 49 -2.334 14.804 12.788 1.00 0.00 C ATOM 709 C SER A 49 -1.429 15.645 11.883 1.00 0.00 C ATOM 710 O SER A 49 -0.264 15.302 11.638 1.00 0.00 O ATOM 711 CB SER A 49 -2.136 15.206 14.254 1.00 0.00 C ATOM 712 OG SER A 49 -2.921 14.371 15.087 1.00 0.00 O ATOM 0 H SER A 49 -1.519 12.993 13.424 1.00 0.00 H new ATOM 0 HA SER A 49 -3.369 14.984 12.496 1.00 0.00 H new ATOM 0 HB2 SER A 49 -1.084 15.122 14.526 1.00 0.00 H new ATOM 0 HB3 SER A 49 -2.419 16.249 14.397 1.00 0.00 H new ATOM 0 HG SER A 49 -2.792 14.629 16.024 1.00 0.00 H new ATOM 718 N ARG A 50 -1.933 16.801 11.442 1.00 0.00 N ATOM 719 CA ARG A 50 -1.113 17.892 10.936 1.00 0.00 C ATOM 720 C ARG A 50 -0.990 18.873 12.096 1.00 0.00 C ATOM 721 O ARG A 50 -2.011 19.373 12.567 1.00 0.00 O ATOM 722 CB ARG A 50 -1.799 18.495 9.710 1.00 0.00 C ATOM 723 CG ARG A 50 -0.940 19.510 8.944 1.00 0.00 C ATOM 724 CD ARG A 50 0.002 18.849 7.927 1.00 0.00 C ATOM 725 NE ARG A 50 1.326 18.534 8.477 1.00 0.00 N ATOM 726 CZ ARG A 50 2.363 19.376 8.501 1.00 0.00 C ATOM 727 NH1 ARG A 50 2.199 20.665 8.225 1.00 0.00 N ATOM 728 NH2 ARG A 50 3.566 18.924 8.813 1.00 0.00 N ATOM 0 H ARG A 50 -2.933 17.002 11.428 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.120 17.584 10.609 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.080 17.689 9.032 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -2.721 18.982 10.027 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -1.592 20.212 8.425 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -0.350 20.089 9.655 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -0.458 17.932 7.560 1.00 0.00 H new ATOM 0 HD3 ARG A 50 0.121 19.511 7.070 1.00 0.00 H new ATOM 0 HE ARG A 50 1.465 17.603 8.870 1.00 0.00 H new ATOM 0 HH11 ARG A 50 1.273 21.023 7.991 1.00 0.00 H new ATOM 0 HH12 ARG A 50 2.999 21.297 8.247 1.00 0.00 H new ATOM 0 HH21 ARG A 50 3.699 17.937 9.034 1.00 0.00 H new ATOM 0 HH22 ARG A 50 4.361 19.562 8.833 1.00 0.00 H new ATOM 742 N THR A 51 0.231 19.072 12.586 1.00 0.00 N ATOM 743 CA THR A 51 0.585 19.642 13.879 1.00 0.00 C ATOM 744 C THR A 51 -0.445 19.220 14.932 1.00 0.00 C ATOM 745 O THR A 51 -0.407 18.066 15.368 1.00 0.00 O ATOM 746 CB THR A 51 0.840 21.158 13.755 1.00 0.00 C ATOM 747 OG1 THR A 51 1.742 21.418 12.698 1.00 0.00 O ATOM 748 CG2 THR A 51 1.448 21.742 15.029 1.00 0.00 C ATOM 0 H THR A 51 1.059 18.819 12.047 1.00 0.00 H new ATOM 0 HA THR A 51 1.534 19.242 14.234 1.00 0.00 H new ATOM 0 HB THR A 51 -0.129 21.622 13.570 1.00 0.00 H new ATOM 0 HG1 THR A 51 1.895 22.384 12.628 1.00 0.00 H new ATOM 0 HG21 THR A 51 1.611 22.812 14.897 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.768 21.579 15.865 1.00 0.00 H new ATOM 0 HG23 THR A 51 2.400 21.253 15.235 1.00 0.00 H new ATOM 756 N ALA A 52 -1.377 20.111 15.277 1.00 0.00 N ATOM 757 CA ALA A 52 -2.367 19.921 16.324 1.00 0.00 C ATOM 758 C ALA A 52 -3.796 20.070 15.804 1.00 0.00 C ATOM 759 O ALA A 52 -4.729 19.841 16.569 1.00 0.00 O ATOM 760 CB ALA A 52 -2.108 20.923 17.455 1.00 0.00 C ATOM 0 H ALA A 52 -1.461 21.016 14.814 1.00 0.00 H new ATOM 0 HA ALA A 52 -2.269 18.902 16.697 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -2.849 20.783 18.242 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.110 20.761 17.863 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -2.180 21.938 17.065 1.00 0.00 H new ATOM 766 N SER A 53 -3.977 20.453 14.539 1.00 0.00 N ATOM 767 CA SER A 53 -5.209 20.987 13.968 1.00 0.00 C ATOM 768 C SER A 53 -5.635 22.349 14.541 1.00 0.00 C ATOM 769 O SER A 53 -6.679 22.873 14.149 1.00 0.00 O ATOM 770 CB SER A 53 -6.351 19.966 14.007 1.00 0.00 C ATOM 771 OG SER A 53 -5.940 18.665 13.603 1.00 0.00 O ATOM 0 H SER A 53 -3.226 20.395 13.851 1.00 0.00 H new ATOM 0 HA SER A 53 -4.973 21.181 12.922 1.00 0.00 H new ATOM 0 HB2 SER A 53 -6.754 19.917 15.018 1.00 0.00 H new ATOM 0 HB3 SER A 53 -7.158 20.305 13.358 1.00 0.00 H new ATOM 0 HG SER A 53 -6.704 18.052 13.647 1.00 0.00 H new ATOM 777 N SER A 54 -4.835 22.948 15.429 1.00 0.00 N ATOM 778 CA SER A 54 -5.117 24.230 16.064 1.00 0.00 C ATOM 779 C SER A 54 -4.884 25.446 15.149 1.00 0.00 C ATOM 780 O SER A 54 -5.305 26.549 15.501 1.00 0.00 O ATOM 781 CB SER A 54 -4.271 24.327 17.337 1.00 0.00 C ATOM 782 OG SER A 54 -2.875 24.362 17.065 1.00 0.00 O ATOM 0 H SER A 54 -3.950 22.540 15.731 1.00 0.00 H new ATOM 0 HA SER A 54 -6.181 24.261 16.300 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.553 25.224 17.888 1.00 0.00 H new ATOM 0 HB3 SER A 54 -4.491 23.475 17.981 1.00 0.00 H new ATOM 0 HG SER A 54 -2.379 24.426 17.908 1.00 0.00 H new ATOM 788 N GLY A 55 -4.196 25.264 14.017 1.00 0.00 N ATOM 789 CA GLY A 55 -3.896 26.304 13.037 1.00 0.00 C ATOM 790 C GLY A 55 -3.555 25.627 11.717 1.00 0.00 C ATOM 791 O GLY A 55 -4.363 25.648 10.789 1.00 0.00 O ATOM 0 H GLY A 55 -3.821 24.353 13.752 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.751 26.969 12.914 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.062 26.918 13.377 1.00 0.00 H new ATOM 795 N ASP A 56 -2.434 24.904 11.699 1.00 0.00 N ATOM 796 CA ASP A 56 -2.115 23.874 10.733 1.00 0.00 C ATOM 797 C ASP A 56 -3.071 22.768 11.112 1.00 0.00 C ATOM 798 O ASP A 56 -2.941 22.151 12.173 1.00 0.00 O ATOM 799 CB ASP A 56 -0.698 23.281 10.867 1.00 0.00 C ATOM 800 CG ASP A 56 0.462 24.175 10.462 1.00 0.00 C ATOM 801 OD1 ASP A 56 0.819 25.053 11.279 1.00 0.00 O ATOM 802 OD2 ASP A 56 1.100 23.890 9.420 1.00 0.00 O ATOM 0 H ASP A 56 -1.697 25.033 12.392 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.181 24.281 9.724 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -0.551 22.984 11.905 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -0.652 22.373 10.266 1.00 0.00 H new ATOM 807 N TYR A 57 -4.050 22.579 10.254 1.00 0.00 N ATOM 808 CA TYR A 57 -4.612 21.272 9.956 1.00 0.00 C ATOM 809 C TYR A 57 -4.361 20.960 8.485 1.00 0.00 C ATOM 810 O TYR A 57 -4.183 21.859 7.658 1.00 0.00 O ATOM 811 CB TYR A 57 -6.105 21.148 10.307 1.00 0.00 C ATOM 812 CG TYR A 57 -7.062 22.077 9.602 1.00 0.00 C ATOM 813 CD1 TYR A 57 -7.081 23.429 9.972 1.00 0.00 C ATOM 814 CD2 TYR A 57 -8.014 21.583 8.687 1.00 0.00 C ATOM 815 CE1 TYR A 57 -8.039 24.290 9.431 1.00 0.00 C ATOM 816 CE2 TYR A 57 -8.995 22.445 8.161 1.00 0.00 C ATOM 817 CZ TYR A 57 -9.011 23.807 8.535 1.00 0.00 C ATOM 818 OH TYR A 57 -9.950 24.653 8.027 1.00 0.00 O ATOM 0 H TYR A 57 -4.488 23.339 9.733 1.00 0.00 H new ATOM 0 HA TYR A 57 -4.112 20.540 10.590 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -6.416 20.124 10.101 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.213 21.304 11.380 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.354 23.806 10.676 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -7.991 20.545 8.390 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -8.034 25.335 9.703 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -9.735 22.065 7.472 1.00 0.00 H new ATOM 0 HH TYR A 57 -10.544 24.159 7.424 1.00 0.00 H new ATOM 828 N ASN A 58 -4.390 19.669 8.168 1.00 0.00 N ATOM 829 CA ASN A 58 -4.746 19.173 6.845 1.00 0.00 C ATOM 830 C ASN A 58 -6.079 18.452 7.038 1.00 0.00 C ATOM 831 O ASN A 58 -6.423 18.071 8.164 1.00 0.00 O ATOM 832 CB ASN A 58 -3.657 18.225 6.304 1.00 0.00 C ATOM 833 CG ASN A 58 -3.740 17.947 4.798 1.00 0.00 C ATOM 834 OD1 ASN A 58 -4.767 18.102 4.141 1.00 0.00 O ATOM 835 ND2 ASN A 58 -2.646 17.502 4.207 1.00 0.00 N ATOM 0 H ASN A 58 -4.164 18.929 8.833 1.00 0.00 H new ATOM 0 HA ASN A 58 -4.830 19.975 6.111 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -2.679 18.652 6.528 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -3.721 17.277 6.839 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -2.656 17.289 3.210 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -1.791 17.372 4.748 1.00 0.00 H new ATOM 842 N LYS A 59 -6.815 18.228 5.960 1.00 0.00 N ATOM 843 CA LYS A 59 -7.766 17.143 5.873 1.00 0.00 C ATOM 844 C LYS A 59 -7.472 16.474 4.552 1.00 0.00 C ATOM 845 O LYS A 59 -7.718 17.068 3.497 1.00 0.00 O ATOM 846 CB LYS A 59 -9.215 17.655 5.924 1.00 0.00 C ATOM 847 CG LYS A 59 -9.757 17.654 7.356 1.00 0.00 C ATOM 848 CD LYS A 59 -11.288 17.733 7.362 1.00 0.00 C ATOM 849 CE LYS A 59 -11.789 17.150 8.680 1.00 0.00 C ATOM 850 NZ LYS A 59 -13.237 16.882 8.651 1.00 0.00 N ATOM 0 H LYS A 59 -6.765 18.801 5.118 1.00 0.00 H new ATOM 0 HA LYS A 59 -7.670 16.455 6.713 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -9.260 18.665 5.517 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -9.846 17.029 5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -9.434 16.749 7.871 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -9.343 18.499 7.906 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -11.616 18.767 7.254 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -11.701 17.178 6.519 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -11.254 16.225 8.894 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -11.565 17.843 9.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -13.535 16.487 9.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -13.751 17.769 8.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -13.449 16.201 7.894 1.00 0.00 H new ATOM 864 N ASN A 60 -7.021 15.230 4.584 1.00 0.00 N ATOM 865 CA ASN A 60 -7.087 14.334 3.447 1.00 0.00 C ATOM 866 C ASN A 60 -6.934 12.908 3.956 1.00 0.00 C ATOM 867 O ASN A 60 -6.433 12.679 5.063 1.00 0.00 O ATOM 868 CB ASN A 60 -6.016 14.692 2.393 1.00 0.00 C ATOM 869 CG ASN A 60 -6.647 14.896 1.024 1.00 0.00 C ATOM 870 OD1 ASN A 60 -6.348 14.165 0.088 1.00 0.00 O ATOM 871 ND2 ASN A 60 -7.495 15.896 0.869 1.00 0.00 N ATOM 0 H ASN A 60 -6.595 14.812 5.411 1.00 0.00 H new ATOM 0 HA ASN A 60 -8.050 14.434 2.946 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -5.492 15.599 2.695 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -5.272 13.897 2.340 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -7.915 16.072 -0.044 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -7.730 16.493 1.662 1.00 0.00 H new ATOM 878 N GLN A 61 -7.220 11.941 3.098 1.00 0.00 N ATOM 879 CA GLN A 61 -6.936 10.533 3.329 1.00 0.00 C ATOM 880 C GLN A 61 -5.855 10.145 2.329 1.00 0.00 C ATOM 881 O GLN A 61 -5.346 11.005 1.598 1.00 0.00 O ATOM 882 CB GLN A 61 -8.203 9.678 3.166 1.00 0.00 C ATOM 883 CG GLN A 61 -9.055 9.642 4.436 1.00 0.00 C ATOM 884 CD GLN A 61 -10.116 10.734 4.494 1.00 0.00 C ATOM 885 OE1 GLN A 61 -9.930 11.745 5.163 1.00 0.00 O ATOM 886 NE2 GLN A 61 -11.248 10.539 3.846 1.00 0.00 N ATOM 0 H GLN A 61 -7.668 12.118 2.199 1.00 0.00 H new ATOM 0 HA GLN A 61 -6.593 10.359 4.349 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.800 10.072 2.344 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -7.919 8.661 2.895 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -9.543 8.670 4.508 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -8.402 9.736 5.304 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.381 9.691 3.296 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -11.991 11.237 3.895 1.00 0.00 H new ATOM 895 N TYR A 62 -5.382 8.903 2.400 1.00 0.00 N ATOM 896 CA TYR A 62 -4.462 8.391 1.399 1.00 0.00 C ATOM 897 C TYR A 62 -5.241 7.403 0.539 1.00 0.00 C ATOM 898 O TYR A 62 -6.026 6.610 1.067 1.00 0.00 O ATOM 899 CB TYR A 62 -3.238 7.786 2.095 1.00 0.00 C ATOM 900 CG TYR A 62 -1.962 7.621 1.283 1.00 0.00 C ATOM 901 CD1 TYR A 62 -1.809 8.102 -0.037 1.00 0.00 C ATOM 902 CD2 TYR A 62 -0.852 7.057 1.934 1.00 0.00 C ATOM 903 CE1 TYR A 62 -0.568 8.003 -0.686 1.00 0.00 C ATOM 904 CE2 TYR A 62 0.383 6.924 1.283 1.00 0.00 C ATOM 905 CZ TYR A 62 0.523 7.396 -0.035 1.00 0.00 C ATOM 906 OH TYR A 62 1.721 7.330 -0.666 1.00 0.00 O ATOM 0 H TYR A 62 -5.621 8.240 3.137 1.00 0.00 H new ATOM 0 HA TYR A 62 -4.072 9.171 0.745 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -3.005 8.407 2.960 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -3.521 6.804 2.475 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.650 8.547 -0.548 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.952 6.720 2.955 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -0.450 8.393 -1.686 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.219 6.464 1.789 1.00 0.00 H new ATOM 0 HH TYR A 62 2.372 6.883 -0.086 1.00 0.00 H new ATOM 916 N TYR A 63 -5.038 7.469 -0.771 1.00 0.00 N ATOM 917 CA TYR A 63 -5.629 6.625 -1.794 1.00 0.00 C ATOM 918 C TYR A 63 -4.458 6.352 -2.724 1.00 0.00 C ATOM 919 O TYR A 63 -3.730 7.283 -3.080 1.00 0.00 O ATOM 920 CB TYR A 63 -6.814 7.309 -2.517 1.00 0.00 C ATOM 921 CG TYR A 63 -7.282 8.613 -1.894 1.00 0.00 C ATOM 922 CD1 TYR A 63 -6.513 9.768 -2.109 1.00 0.00 C ATOM 923 CD2 TYR A 63 -8.399 8.663 -1.041 1.00 0.00 C ATOM 924 CE1 TYR A 63 -6.812 10.963 -1.438 1.00 0.00 C ATOM 925 CE2 TYR A 63 -8.726 9.866 -0.389 1.00 0.00 C ATOM 926 CZ TYR A 63 -7.917 11.012 -0.563 1.00 0.00 C ATOM 927 OH TYR A 63 -8.188 12.149 0.132 1.00 0.00 O ATOM 0 H TYR A 63 -4.410 8.165 -1.172 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.073 5.715 -1.390 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.527 7.501 -3.551 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.654 6.614 -2.543 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.682 9.736 -2.798 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -9.003 7.781 -0.887 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.200 11.840 -1.590 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -9.598 9.914 0.246 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.532 12.839 -0.101 1.00 0.00 H new ATOM 937 N GLY A 64 -4.226 5.083 -3.024 1.00 0.00 N ATOM 938 CA GLY A 64 -3.042 4.606 -3.699 1.00 0.00 C ATOM 939 C GLY A 64 -3.431 3.349 -4.438 1.00 0.00 C ATOM 940 O GLY A 64 -3.412 2.280 -3.832 1.00 0.00 O ATOM 0 H GLY A 64 -4.882 4.337 -2.794 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.663 5.358 -4.391 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -2.246 4.402 -2.983 1.00 0.00 H new ATOM 944 N ILE A 65 -3.897 3.463 -5.681 1.00 0.00 N ATOM 945 CA ILE A 65 -4.604 2.356 -6.314 1.00 0.00 C ATOM 946 C ILE A 65 -3.571 1.345 -6.816 1.00 0.00 C ATOM 947 O ILE A 65 -2.850 1.606 -7.785 1.00 0.00 O ATOM 948 CB ILE A 65 -5.572 2.871 -7.402 1.00 0.00 C ATOM 949 CG1 ILE A 65 -6.530 3.971 -6.880 1.00 0.00 C ATOM 950 CG2 ILE A 65 -6.386 1.711 -7.997 1.00 0.00 C ATOM 951 CD1 ILE A 65 -7.378 3.601 -5.653 1.00 0.00 C ATOM 0 H ILE A 65 -3.799 4.297 -6.260 1.00 0.00 H new ATOM 0 HA ILE A 65 -5.243 1.839 -5.598 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.953 3.320 -8.179 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.939 4.853 -6.635 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.203 4.253 -7.690 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.062 2.095 -8.761 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.709 0.983 -8.444 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.966 1.231 -7.208 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -8.009 4.446 -5.378 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -8.006 2.742 -5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.722 3.352 -4.819 1.00 0.00 H new ATOM 963 N THR A 66 -3.529 0.191 -6.155 1.00 0.00 N ATOM 964 CA THR A 66 -2.488 -0.810 -6.213 1.00 0.00 C ATOM 965 C THR A 66 -3.049 -2.157 -6.680 1.00 0.00 C ATOM 966 O THR A 66 -4.050 -2.667 -6.152 1.00 0.00 O ATOM 967 CB THR A 66 -1.829 -0.922 -4.823 1.00 0.00 C ATOM 968 OG1 THR A 66 -2.792 -0.797 -3.789 1.00 0.00 O ATOM 969 CG2 THR A 66 -0.768 0.151 -4.584 1.00 0.00 C ATOM 0 H THR A 66 -4.280 -0.081 -5.521 1.00 0.00 H new ATOM 0 HA THR A 66 -1.734 -0.513 -6.942 1.00 0.00 H new ATOM 0 HB THR A 66 -1.360 -1.906 -4.805 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.029 0.147 -3.675 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.339 0.023 -3.590 1.00 0.00 H new ATOM 0 HG22 THR A 66 0.018 0.059 -5.334 1.00 0.00 H new ATOM 0 HG23 THR A 66 -1.225 1.138 -4.657 1.00 0.00 H new ATOM 977 N ALA A 67 -2.372 -2.733 -7.675 1.00 0.00 N ATOM 978 CA ALA A 67 -2.563 -4.095 -8.151 1.00 0.00 C ATOM 979 C ALA A 67 -1.969 -5.109 -7.158 1.00 0.00 C ATOM 980 O ALA A 67 -1.348 -4.736 -6.156 1.00 0.00 O ATOM 981 CB ALA A 67 -1.893 -4.225 -9.526 1.00 0.00 C ATOM 0 H ALA A 67 -1.645 -2.237 -8.190 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.628 -4.310 -8.237 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.025 -5.240 -9.901 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.349 -3.520 -10.221 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.829 -4.008 -9.434 1.00 0.00 H new ATOM 987 N GLY A 68 -2.102 -6.403 -7.463 1.00 0.00 N ATOM 988 CA GLY A 68 -1.454 -7.481 -6.743 1.00 0.00 C ATOM 989 C GLY A 68 -1.480 -8.816 -7.489 1.00 0.00 C ATOM 990 O GLY A 68 -1.800 -9.818 -6.843 1.00 0.00 O ATOM 0 H GLY A 68 -2.680 -6.728 -8.238 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -0.418 -7.204 -6.546 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.941 -7.605 -5.776 1.00 0.00 H new ATOM 994 N PRO A 69 -1.164 -8.914 -8.798 1.00 0.00 N ATOM 995 CA PRO A 69 -1.200 -10.197 -9.485 1.00 0.00 C ATOM 996 C PRO A 69 -0.167 -11.126 -8.850 1.00 0.00 C ATOM 997 O PRO A 69 0.951 -10.706 -8.535 1.00 0.00 O ATOM 998 CB PRO A 69 -0.886 -9.908 -10.955 1.00 0.00 C ATOM 999 CG PRO A 69 -0.032 -8.647 -10.894 1.00 0.00 C ATOM 1000 CD PRO A 69 -0.551 -7.914 -9.659 1.00 0.00 C ATOM 0 HA PRO A 69 -2.169 -10.691 -9.407 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -0.349 -10.734 -11.421 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -1.795 -9.750 -11.536 1.00 0.00 H new ATOM 0 HG2 PRO A 69 1.028 -8.886 -10.802 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -0.145 -8.043 -11.794 1.00 0.00 H new ATOM 0 HD2 PRO A 69 0.263 -7.406 -9.142 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -1.276 -7.150 -9.940 1.00 0.00 H new ATOM 1008 N ALA A 70 -0.536 -12.385 -8.634 1.00 0.00 N ATOM 1009 CA ALA A 70 0.372 -13.388 -8.115 1.00 0.00 C ATOM 1010 C ALA A 70 1.032 -14.057 -9.324 1.00 0.00 C ATOM 1011 O ALA A 70 0.330 -14.600 -10.187 1.00 0.00 O ATOM 1012 CB ALA A 70 -0.369 -14.348 -7.182 1.00 0.00 C ATOM 0 H ALA A 70 -1.477 -12.734 -8.816 1.00 0.00 H new ATOM 0 HA ALA A 70 1.157 -12.958 -7.494 1.00 0.00 H new ATOM 0 HB1 ALA A 70 0.327 -15.095 -6.801 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -0.794 -13.789 -6.348 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.169 -14.844 -7.731 1.00 0.00 H new ATOM 1018 N TYR A 71 2.359 -13.936 -9.442 1.00 0.00 N ATOM 1019 CA TYR A 71 3.131 -14.497 -10.538 1.00 0.00 C ATOM 1020 C TYR A 71 3.883 -15.717 -10.007 1.00 0.00 C ATOM 1021 O TYR A 71 4.898 -15.590 -9.312 1.00 0.00 O ATOM 1022 CB TYR A 71 4.048 -13.424 -11.152 1.00 0.00 C ATOM 1023 CG TYR A 71 4.127 -13.460 -12.665 1.00 0.00 C ATOM 1024 CD1 TYR A 71 4.415 -14.665 -13.336 1.00 0.00 C ATOM 1025 CD2 TYR A 71 3.915 -12.282 -13.408 1.00 0.00 C ATOM 1026 CE1 TYR A 71 4.495 -14.696 -14.737 1.00 0.00 C ATOM 1027 CE2 TYR A 71 3.997 -12.305 -14.810 1.00 0.00 C ATOM 1028 CZ TYR A 71 4.287 -13.514 -15.479 1.00 0.00 C ATOM 1029 OH TYR A 71 4.337 -13.556 -16.833 1.00 0.00 O ATOM 0 H TYR A 71 2.930 -13.435 -8.762 1.00 0.00 H new ATOM 0 HA TYR A 71 2.486 -14.827 -11.352 1.00 0.00 H new ATOM 0 HB2 TYR A 71 3.695 -12.441 -10.842 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.052 -13.545 -10.745 1.00 0.00 H new ATOM 0 HD1 TYR A 71 4.575 -15.570 -12.769 1.00 0.00 H new ATOM 0 HD2 TYR A 71 3.689 -11.358 -12.898 1.00 0.00 H new ATOM 0 HE1 TYR A 71 4.715 -15.623 -15.246 1.00 0.00 H new ATOM 0 HE2 TYR A 71 3.838 -11.399 -15.376 1.00 0.00 H new ATOM 0 HH TYR A 71 4.172 -12.660 -17.194 1.00 0.00 H new ATOM 1039 N ARG A 72 3.364 -16.909 -10.306 1.00 0.00 N ATOM 1040 CA ARG A 72 3.996 -18.161 -9.923 1.00 0.00 C ATOM 1041 C ARG A 72 5.082 -18.432 -10.950 1.00 0.00 C ATOM 1042 O ARG A 72 4.775 -18.470 -12.144 1.00 0.00 O ATOM 1043 CB ARG A 72 2.948 -19.282 -9.806 1.00 0.00 C ATOM 1044 CG ARG A 72 3.392 -20.473 -8.932 1.00 0.00 C ATOM 1045 CD ARG A 72 2.153 -21.256 -8.486 1.00 0.00 C ATOM 1046 NE ARG A 72 2.460 -22.484 -7.728 1.00 0.00 N ATOM 1047 CZ ARG A 72 1.934 -22.843 -6.548 1.00 0.00 C ATOM 1048 NH1 ARG A 72 1.342 -21.953 -5.759 1.00 0.00 N ATOM 1049 NH2 ARG A 72 2.004 -24.099 -6.127 1.00 0.00 N ATOM 0 H ARG A 72 2.492 -17.028 -10.822 1.00 0.00 H new ATOM 0 HA ARG A 72 4.454 -18.109 -8.935 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.030 -18.864 -9.392 1.00 0.00 H new ATOM 0 HB3 ARG A 72 2.710 -19.647 -10.805 1.00 0.00 H new ATOM 0 HG2 ARG A 72 4.065 -21.121 -9.493 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.945 -20.116 -8.063 1.00 0.00 H new ATOM 0 HD2 ARG A 72 1.528 -20.608 -7.871 1.00 0.00 H new ATOM 0 HD3 ARG A 72 1.567 -21.521 -9.366 1.00 0.00 H new ATOM 0 HE ARG A 72 3.139 -23.123 -8.142 1.00 0.00 H new ATOM 0 HH11 ARG A 72 1.281 -20.976 -6.047 1.00 0.00 H new ATOM 0 HH12 ARG A 72 0.948 -22.246 -4.865 1.00 0.00 H new ATOM 0 HH21 ARG A 72 2.462 -24.805 -6.703 1.00 0.00 H new ATOM 0 HH22 ARG A 72 1.600 -24.359 -5.227 1.00 0.00 H new ATOM 1063 N ILE A 73 6.328 -18.559 -10.503 1.00 0.00 N ATOM 1064 CA ILE A 73 7.523 -18.796 -11.320 1.00 0.00 C ATOM 1065 C ILE A 73 8.476 -19.805 -10.655 1.00 0.00 C ATOM 1066 O ILE A 73 9.506 -20.161 -11.222 1.00 0.00 O ATOM 1067 CB ILE A 73 8.252 -17.464 -11.624 1.00 0.00 C ATOM 1068 CG1 ILE A 73 8.522 -16.650 -10.336 1.00 0.00 C ATOM 1069 CG2 ILE A 73 7.462 -16.607 -12.627 1.00 0.00 C ATOM 1070 CD1 ILE A 73 9.707 -15.700 -10.500 1.00 0.00 C ATOM 0 H ILE A 73 6.547 -18.497 -9.509 1.00 0.00 H new ATOM 0 HA ILE A 73 7.195 -19.232 -12.264 1.00 0.00 H new ATOM 0 HB ILE A 73 9.211 -17.728 -12.070 1.00 0.00 H new ATOM 0 HG12 ILE A 73 7.632 -16.078 -10.075 1.00 0.00 H new ATOM 0 HG13 ILE A 73 8.716 -17.333 -9.509 1.00 0.00 H new ATOM 0 HG21 ILE A 73 8.002 -15.680 -12.818 1.00 0.00 H new ATOM 0 HG22 ILE A 73 7.343 -17.157 -13.561 1.00 0.00 H new ATOM 0 HG23 ILE A 73 6.480 -16.377 -12.214 1.00 0.00 H new ATOM 0 HD11 ILE A 73 9.862 -15.148 -9.573 1.00 0.00 H new ATOM 0 HD12 ILE A 73 10.604 -16.274 -10.735 1.00 0.00 H new ATOM 0 HD13 ILE A 73 9.502 -14.999 -11.309 1.00 0.00 H new ATOM 1082 N ASN A 74 8.157 -20.268 -9.446 1.00 0.00 N ATOM 1083 CA ASN A 74 8.790 -21.387 -8.758 1.00 0.00 C ATOM 1084 C ASN A 74 7.673 -22.052 -7.946 1.00 0.00 C ATOM 1085 O ASN A 74 6.596 -21.469 -7.789 1.00 0.00 O ATOM 1086 CB ASN A 74 9.918 -20.967 -7.783 1.00 0.00 C ATOM 1087 CG ASN A 74 10.828 -19.812 -8.194 1.00 0.00 C ATOM 1088 OD1 ASN A 74 11.951 -20.002 -8.652 1.00 0.00 O ATOM 1089 ND2 ASN A 74 10.417 -18.587 -7.920 1.00 0.00 N ATOM 0 H ASN A 74 7.410 -19.848 -8.893 1.00 0.00 H new ATOM 0 HA ASN A 74 9.258 -22.037 -9.497 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.456 -20.706 -6.831 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.546 -21.839 -7.604 1.00 0.00 H new ATOM 0 HD21 ASN A 74 11.034 -17.792 -8.089 1.00 0.00 H new ATOM 0 HD22 ASN A 74 9.483 -18.436 -7.540 1.00 0.00 H new ATOM 1096 N ASP A 75 7.932 -23.198 -7.323 1.00 0.00 N ATOM 1097 CA ASP A 75 6.946 -23.832 -6.436 1.00 0.00 C ATOM 1098 C ASP A 75 6.886 -23.147 -5.064 1.00 0.00 C ATOM 1099 O ASP A 75 5.943 -23.354 -4.306 1.00 0.00 O ATOM 1100 CB ASP A 75 7.270 -25.322 -6.253 1.00 0.00 C ATOM 1101 CG ASP A 75 6.125 -26.205 -6.719 1.00 0.00 C ATOM 1102 OD1 ASP A 75 6.011 -26.390 -7.952 1.00 0.00 O ATOM 1103 OD2 ASP A 75 5.389 -26.746 -5.866 1.00 0.00 O ATOM 0 H ASP A 75 8.810 -23.709 -7.411 1.00 0.00 H new ATOM 0 HA ASP A 75 5.971 -23.725 -6.910 1.00 0.00 H new ATOM 0 HB2 ASP A 75 8.172 -25.570 -6.812 1.00 0.00 H new ATOM 0 HB3 ASP A 75 7.481 -25.523 -5.203 1.00 0.00 H new ATOM 1108 N TRP A 76 7.890 -22.329 -4.732 1.00 0.00 N ATOM 1109 CA TRP A 76 8.183 -21.832 -3.387 1.00 0.00 C ATOM 1110 C TRP A 76 8.200 -20.302 -3.352 1.00 0.00 C ATOM 1111 O TRP A 76 7.356 -19.667 -2.719 1.00 0.00 O ATOM 1112 CB TRP A 76 9.525 -22.432 -2.922 1.00 0.00 C ATOM 1113 CG TRP A 76 10.615 -22.483 -3.961 1.00 0.00 C ATOM 1114 CD1 TRP A 76 11.560 -21.542 -4.190 1.00 0.00 C ATOM 1115 CD2 TRP A 76 10.884 -23.543 -4.923 1.00 0.00 C ATOM 1116 NE1 TRP A 76 12.354 -21.925 -5.252 1.00 0.00 N ATOM 1117 CE2 TRP A 76 11.979 -23.156 -5.746 1.00 0.00 C ATOM 1118 CE3 TRP A 76 10.322 -24.813 -5.158 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 12.450 -23.971 -6.786 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 10.809 -25.652 -6.177 1.00 0.00 C ATOM 1121 CH2 TRP A 76 11.861 -25.227 -7.003 1.00 0.00 C ATOM 0 H TRP A 76 8.550 -21.980 -5.427 1.00 0.00 H new ATOM 0 HA TRP A 76 7.396 -22.145 -2.700 1.00 0.00 H new ATOM 0 HB2 TRP A 76 9.886 -21.852 -2.072 1.00 0.00 H new ATOM 0 HB3 TRP A 76 9.344 -23.445 -2.563 1.00 0.00 H new ATOM 0 HD1 TRP A 76 11.676 -20.628 -3.626 1.00 0.00 H new ATOM 0 HE1 TRP A 76 13.122 -21.367 -5.625 1.00 0.00 H new ATOM 0 HE3 TRP A 76 9.500 -25.150 -4.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 13.260 -23.635 -7.416 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 10.371 -26.628 -6.324 1.00 0.00 H new ATOM 0 HH2 TRP A 76 12.216 -25.862 -7.801 1.00 0.00 H new ATOM 1132 N ALA A 77 9.176 -19.683 -4.010 1.00 0.00 N ATOM 1133 CA ALA A 77 9.308 -18.238 -4.089 1.00 0.00 C ATOM 1134 C ALA A 77 8.409 -17.740 -5.220 1.00 0.00 C ATOM 1135 O ALA A 77 8.217 -18.463 -6.199 1.00 0.00 O ATOM 1136 CB ALA A 77 10.773 -17.894 -4.362 1.00 0.00 C ATOM 0 H ALA A 77 9.909 -20.184 -4.511 1.00 0.00 H new ATOM 0 HA ALA A 77 9.007 -17.760 -3.157 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.887 -16.812 -4.424 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.394 -18.279 -3.553 1.00 0.00 H new ATOM 0 HB3 ALA A 77 11.083 -18.346 -5.304 1.00 0.00 H new ATOM 1142 N SER A 78 7.910 -16.512 -5.146 1.00 0.00 N ATOM 1143 CA SER A 78 7.183 -15.835 -6.220 1.00 0.00 C ATOM 1144 C SER A 78 7.682 -14.394 -6.288 1.00 0.00 C ATOM 1145 O SER A 78 8.337 -13.915 -5.354 1.00 0.00 O ATOM 1146 CB SER A 78 5.669 -15.854 -5.949 1.00 0.00 C ATOM 1147 OG SER A 78 5.127 -17.165 -5.899 1.00 0.00 O ATOM 0 H SER A 78 8.002 -15.938 -4.308 1.00 0.00 H new ATOM 0 HA SER A 78 7.358 -16.347 -7.166 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.469 -15.349 -5.004 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.160 -15.287 -6.728 1.00 0.00 H new ATOM 0 HG SER A 78 4.164 -17.114 -5.723 1.00 0.00 H new ATOM 1153 N ILE A 79 7.325 -13.667 -7.339 1.00 0.00 N ATOM 1154 CA ILE A 79 7.470 -12.217 -7.401 1.00 0.00 C ATOM 1155 C ILE A 79 6.099 -11.664 -7.759 1.00 0.00 C ATOM 1156 O ILE A 79 5.323 -12.356 -8.425 1.00 0.00 O ATOM 1157 CB ILE A 79 8.558 -11.803 -8.420 1.00 0.00 C ATOM 1158 CG1 ILE A 79 8.203 -12.247 -9.860 1.00 0.00 C ATOM 1159 CG2 ILE A 79 9.929 -12.339 -7.967 1.00 0.00 C ATOM 1160 CD1 ILE A 79 9.231 -11.824 -10.909 1.00 0.00 C ATOM 0 H ILE A 79 6.921 -14.072 -8.184 1.00 0.00 H new ATOM 0 HA ILE A 79 7.804 -11.810 -6.446 1.00 0.00 H new ATOM 0 HB ILE A 79 8.609 -10.715 -8.447 1.00 0.00 H new ATOM 0 HG12 ILE A 79 8.102 -13.332 -9.881 1.00 0.00 H new ATOM 0 HG13 ILE A 79 7.232 -11.832 -10.129 1.00 0.00 H new ATOM 0 HG21 ILE A 79 10.691 -12.044 -8.688 1.00 0.00 H new ATOM 0 HG22 ILE A 79 10.176 -11.926 -6.989 1.00 0.00 H new ATOM 0 HG23 ILE A 79 9.891 -13.426 -7.903 1.00 0.00 H new ATOM 0 HD11 ILE A 79 8.912 -12.171 -11.892 1.00 0.00 H new ATOM 0 HD12 ILE A 79 9.315 -10.737 -10.918 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.200 -12.261 -10.666 1.00 0.00 H new ATOM 1172 N TYR A 80 5.806 -10.433 -7.353 1.00 0.00 N ATOM 1173 CA TYR A 80 4.658 -9.697 -7.856 1.00 0.00 C ATOM 1174 C TYR A 80 5.211 -8.476 -8.579 1.00 0.00 C ATOM 1175 O TYR A 80 6.402 -8.165 -8.475 1.00 0.00 O ATOM 1176 CB TYR A 80 3.668 -9.400 -6.713 1.00 0.00 C ATOM 1177 CG TYR A 80 3.373 -10.622 -5.845 1.00 0.00 C ATOM 1178 CD1 TYR A 80 3.117 -11.866 -6.449 1.00 0.00 C ATOM 1179 CD2 TYR A 80 3.470 -10.558 -4.445 1.00 0.00 C ATOM 1180 CE1 TYR A 80 3.071 -13.045 -5.686 1.00 0.00 C ATOM 1181 CE2 TYR A 80 3.429 -11.720 -3.664 1.00 0.00 C ATOM 1182 CZ TYR A 80 3.275 -12.970 -4.293 1.00 0.00 C ATOM 1183 OH TYR A 80 3.431 -14.103 -3.568 1.00 0.00 O ATOM 0 H TYR A 80 6.359 -9.920 -6.666 1.00 0.00 H new ATOM 0 HA TYR A 80 4.063 -10.266 -8.570 1.00 0.00 H new ATOM 0 HB2 TYR A 80 4.073 -8.606 -6.086 1.00 0.00 H new ATOM 0 HB3 TYR A 80 2.735 -9.028 -7.136 1.00 0.00 H new ATOM 0 HD1 TYR A 80 2.953 -11.916 -7.515 1.00 0.00 H new ATOM 0 HD2 TYR A 80 3.578 -9.597 -3.963 1.00 0.00 H new ATOM 0 HE1 TYR A 80 2.882 -13.997 -6.161 1.00 0.00 H new ATOM 0 HE2 TYR A 80 3.515 -11.658 -2.589 1.00 0.00 H new ATOM 0 HH TYR A 80 3.531 -14.867 -4.173 1.00 0.00 H new ATOM 1193 N GLY A 81 4.373 -7.836 -9.381 1.00 0.00 N ATOM 1194 CA GLY A 81 4.752 -6.716 -10.215 1.00 0.00 C ATOM 1195 C GLY A 81 3.551 -5.807 -10.237 1.00 0.00 C ATOM 1196 O GLY A 81 2.668 -6.005 -11.069 1.00 0.00 O ATOM 0 H GLY A 81 3.389 -8.090 -9.469 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.625 -6.203 -9.811 1.00 0.00 H new ATOM 0 HA3 GLY A 81 5.013 -7.046 -11.221 1.00 0.00 H new ATOM 1200 N VAL A 82 3.482 -4.883 -9.288 1.00 0.00 N ATOM 1201 CA VAL A 82 2.361 -3.968 -9.126 1.00 0.00 C ATOM 1202 C VAL A 82 2.795 -2.557 -9.509 1.00 0.00 C ATOM 1203 O VAL A 82 3.928 -2.339 -9.953 1.00 0.00 O ATOM 1204 CB VAL A 82 1.781 -4.068 -7.698 1.00 0.00 C ATOM 1205 CG1 VAL A 82 1.462 -5.516 -7.331 1.00 0.00 C ATOM 1206 CG2 VAL A 82 2.688 -3.503 -6.610 1.00 0.00 C ATOM 0 H VAL A 82 4.219 -4.746 -8.596 1.00 0.00 H new ATOM 0 HA VAL A 82 1.549 -4.245 -9.798 1.00 0.00 H new ATOM 0 HB VAL A 82 0.877 -3.459 -7.733 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.055 -5.554 -6.320 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.730 -5.916 -8.032 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.373 -6.113 -7.378 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.204 -3.613 -5.639 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.634 -4.044 -6.608 1.00 0.00 H new ATOM 0 HG23 VAL A 82 2.875 -2.447 -6.804 1.00 0.00 H new ATOM 1216 N VAL A 83 1.886 -1.612 -9.325 1.00 0.00 N ATOM 1217 CA VAL A 83 2.079 -0.180 -9.414 1.00 0.00 C ATOM 1218 C VAL A 83 1.275 0.449 -8.287 1.00 0.00 C ATOM 1219 O VAL A 83 0.414 -0.222 -7.713 1.00 0.00 O ATOM 1220 CB VAL A 83 1.619 0.361 -10.779 1.00 0.00 C ATOM 1221 CG1 VAL A 83 2.598 -0.038 -11.875 1.00 0.00 C ATOM 1222 CG2 VAL A 83 0.209 -0.109 -11.168 1.00 0.00 C ATOM 0 H VAL A 83 0.922 -1.849 -9.092 1.00 0.00 H new ATOM 0 HA VAL A 83 3.137 0.066 -9.321 1.00 0.00 H new ATOM 0 HB VAL A 83 1.591 1.446 -10.678 1.00 0.00 H new ATOM 0 HG11 VAL A 83 2.253 0.355 -12.831 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.583 0.370 -11.649 1.00 0.00 H new ATOM 0 HG13 VAL A 83 2.659 -1.125 -11.930 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -0.058 0.306 -12.140 1.00 0.00 H new ATOM 0 HG22 VAL A 83 0.190 -1.198 -11.221 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.507 0.231 -10.420 1.00 0.00 H new ATOM 1232 N GLY A 84 1.526 1.723 -8.003 1.00 0.00 N ATOM 1233 CA GLY A 84 0.646 2.556 -7.202 1.00 0.00 C ATOM 1234 C GLY A 84 0.598 3.961 -7.789 1.00 0.00 C ATOM 1235 O GLY A 84 1.491 4.325 -8.563 1.00 0.00 O ATOM 0 H GLY A 84 2.361 2.210 -8.330 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.356 2.127 -7.178 1.00 0.00 H new ATOM 0 HA3 GLY A 84 1.002 2.593 -6.172 1.00 0.00 H new ATOM 1239 N VAL A 85 -0.410 4.751 -7.412 1.00 0.00 N ATOM 1240 CA VAL A 85 -0.480 6.187 -7.675 1.00 0.00 C ATOM 1241 C VAL A 85 -1.163 6.850 -6.482 1.00 0.00 C ATOM 1242 O VAL A 85 -2.331 6.611 -6.179 1.00 0.00 O ATOM 1243 CB VAL A 85 -1.180 6.514 -9.012 1.00 0.00 C ATOM 1244 CG1 VAL A 85 -2.608 5.974 -9.106 1.00 0.00 C ATOM 1245 CG2 VAL A 85 -1.255 8.030 -9.265 1.00 0.00 C ATOM 0 H VAL A 85 -1.220 4.399 -6.902 1.00 0.00 H new ATOM 0 HA VAL A 85 0.529 6.585 -7.788 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.560 6.022 -9.762 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -3.036 6.242 -10.072 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -2.594 4.889 -9.004 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.213 6.406 -8.309 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.755 8.216 -10.216 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.816 8.506 -8.461 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -0.247 8.444 -9.298 1.00 0.00 H new ATOM 1255 N GLY A 86 -0.425 7.722 -5.820 1.00 0.00 N ATOM 1256 CA GLY A 86 -0.824 8.406 -4.610 1.00 0.00 C ATOM 1257 C GLY A 86 -0.941 9.891 -4.898 1.00 0.00 C ATOM 1258 O GLY A 86 0.069 10.521 -5.224 1.00 0.00 O ATOM 0 H GLY A 86 0.512 7.983 -6.128 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.777 8.015 -4.253 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.093 8.232 -3.821 1.00 0.00 H new ATOM 1262 N TYR A 87 -2.145 10.441 -4.769 1.00 0.00 N ATOM 1263 CA TYR A 87 -2.446 11.856 -4.963 1.00 0.00 C ATOM 1264 C TYR A 87 -3.423 12.288 -3.871 1.00 0.00 C ATOM 1265 O TYR A 87 -4.200 11.474 -3.380 1.00 0.00 O ATOM 1266 CB TYR A 87 -3.031 12.034 -6.376 1.00 0.00 C ATOM 1267 CG TYR A 87 -3.694 13.368 -6.682 1.00 0.00 C ATOM 1268 CD1 TYR A 87 -3.080 14.578 -6.304 1.00 0.00 C ATOM 1269 CD2 TYR A 87 -4.937 13.399 -7.345 1.00 0.00 C ATOM 1270 CE1 TYR A 87 -3.722 15.805 -6.531 1.00 0.00 C ATOM 1271 CE2 TYR A 87 -5.573 14.626 -7.604 1.00 0.00 C ATOM 1272 CZ TYR A 87 -4.968 15.837 -7.195 1.00 0.00 C ATOM 1273 OH TYR A 87 -5.563 17.040 -7.415 1.00 0.00 O ATOM 0 H TYR A 87 -2.968 9.893 -4.517 1.00 0.00 H new ATOM 0 HA TYR A 87 -1.556 12.481 -4.886 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -2.229 11.880 -7.097 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -3.764 11.245 -6.542 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -2.107 14.561 -5.836 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -5.403 12.476 -7.656 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -3.263 16.724 -6.198 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -6.524 14.644 -8.116 1.00 0.00 H new ATOM 0 HH TYR A 87 -6.413 16.904 -7.882 1.00 0.00 H new ATOM 1283 N GLY A 88 -3.463 13.564 -3.505 1.00 0.00 N ATOM 1284 CA GLY A 88 -4.292 14.096 -2.432 1.00 0.00 C ATOM 1285 C GLY A 88 -3.728 15.450 -2.033 1.00 0.00 C ATOM 1286 O GLY A 88 -2.978 16.029 -2.817 1.00 0.00 O ATOM 0 H GLY A 88 -2.900 14.280 -3.963 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.326 14.196 -2.762 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -4.294 13.417 -1.579 1.00 0.00 H new ATOM 1290 N LYS A 89 -4.074 15.901 -0.817 1.00 0.00 N ATOM 1291 CA LYS A 89 -3.632 17.132 -0.139 1.00 0.00 C ATOM 1292 C LYS A 89 -4.431 18.313 -0.693 1.00 0.00 C ATOM 1293 O LYS A 89 -4.401 18.566 -1.894 1.00 0.00 O ATOM 1294 CB LYS A 89 -2.101 17.289 -0.275 1.00 0.00 C ATOM 1295 CG LYS A 89 -1.440 18.466 0.452 1.00 0.00 C ATOM 1296 CD LYS A 89 0.101 18.340 0.423 1.00 0.00 C ATOM 1297 CE LYS A 89 0.685 17.909 -0.941 1.00 0.00 C ATOM 1298 NZ LYS A 89 2.163 17.848 -0.932 1.00 0.00 N ATOM 0 H LYS A 89 -4.723 15.372 -0.234 1.00 0.00 H new ATOM 0 HA LYS A 89 -3.830 17.087 0.932 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -1.636 16.370 0.082 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.865 17.374 -1.336 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.741 19.403 -0.017 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -1.786 18.501 1.485 1.00 0.00 H new ATOM 0 HD2 LYS A 89 0.536 19.299 0.703 1.00 0.00 H new ATOM 0 HD3 LYS A 89 0.408 17.618 1.179 1.00 0.00 H new ATOM 0 HE2 LYS A 89 0.286 16.931 -1.210 1.00 0.00 H new ATOM 0 HE3 LYS A 89 0.358 18.609 -1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 2.504 17.554 -1.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 2.548 18.786 -0.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.478 17.160 -0.218 1.00 0.00 H new ATOM 1312 N PHE A 90 -5.191 19.010 0.159 1.00 0.00 N ATOM 1313 CA PHE A 90 -6.006 20.149 -0.262 1.00 0.00 C ATOM 1314 C PHE A 90 -5.927 21.256 0.785 1.00 0.00 C ATOM 1315 O PHE A 90 -5.493 22.362 0.467 1.00 0.00 O ATOM 1316 CB PHE A 90 -7.457 19.713 -0.553 1.00 0.00 C ATOM 1317 CG PHE A 90 -8.286 20.793 -1.230 1.00 0.00 C ATOM 1318 CD1 PHE A 90 -8.692 21.941 -0.518 1.00 0.00 C ATOM 1319 CD2 PHE A 90 -8.618 20.676 -2.594 1.00 0.00 C ATOM 1320 CE1 PHE A 90 -9.351 22.991 -1.178 1.00 0.00 C ATOM 1321 CE2 PHE A 90 -9.305 21.718 -3.245 1.00 0.00 C ATOM 1322 CZ PHE A 90 -9.647 22.885 -2.545 1.00 0.00 C ATOM 0 H PHE A 90 -5.257 18.800 1.155 1.00 0.00 H new ATOM 0 HA PHE A 90 -5.612 20.549 -1.196 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -7.442 18.826 -1.186 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -7.938 19.429 0.383 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -8.495 22.013 0.541 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -8.345 19.786 -3.141 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -9.630 23.881 -0.633 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -9.570 21.619 -4.287 1.00 0.00 H new ATOM 0 HZ PHE A 90 -10.137 23.700 -3.058 1.00 0.00 H new ATOM 1332 N GLN A 91 -6.359 20.969 2.017 1.00 0.00 N ATOM 1333 CA GLN A 91 -6.339 21.900 3.136 1.00 0.00 C ATOM 1334 C GLN A 91 -4.889 22.206 3.514 1.00 0.00 C ATOM 1335 O GLN A 91 -4.263 21.485 4.292 1.00 0.00 O ATOM 1336 CB GLN A 91 -7.114 21.341 4.345 1.00 0.00 C ATOM 1337 CG GLN A 91 -8.608 21.701 4.385 1.00 0.00 C ATOM 1338 CD GLN A 91 -9.502 20.923 3.421 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -9.048 20.168 2.567 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -10.812 21.025 3.576 1.00 0.00 N ATOM 0 H GLN A 91 -6.742 20.056 2.264 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.835 22.822 2.834 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.018 20.255 4.348 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -6.644 21.705 5.258 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -8.974 21.543 5.399 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -8.713 22.765 4.171 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -11.194 21.651 4.285 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -11.439 20.477 2.987 1.00 0.00 H new ATOM 1349 N THR A 92 -4.376 23.304 2.978 1.00 0.00 N ATOM 1350 CA THR A 92 -3.179 23.964 3.442 1.00 0.00 C ATOM 1351 C THR A 92 -3.656 25.221 4.149 1.00 0.00 C ATOM 1352 O THR A 92 -4.076 26.189 3.513 1.00 0.00 O ATOM 1353 CB THR A 92 -2.223 24.188 2.258 1.00 0.00 C ATOM 1354 OG1 THR A 92 -1.535 22.965 2.097 1.00 0.00 O ATOM 1355 CG2 THR A 92 -1.186 25.296 2.469 1.00 0.00 C ATOM 0 H THR A 92 -4.803 23.772 2.178 1.00 0.00 H new ATOM 0 HA THR A 92 -2.589 23.381 4.149 1.00 0.00 H new ATOM 0 HB THR A 92 -2.812 24.501 1.396 1.00 0.00 H new ATOM 0 HG1 THR A 92 -0.575 23.140 2.001 1.00 0.00 H new ATOM 0 HG21 THR A 92 -0.558 25.380 1.582 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.696 26.243 2.644 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.565 25.054 3.332 1.00 0.00 H new ATOM 1363 N THR A 93 -3.598 25.189 5.475 1.00 0.00 N ATOM 1364 CA THR A 93 -3.647 26.372 6.304 1.00 0.00 C ATOM 1365 C THR A 93 -2.265 26.456 6.942 1.00 0.00 C ATOM 1366 O THR A 93 -2.019 25.989 8.047 1.00 0.00 O ATOM 1367 CB THR A 93 -4.857 26.319 7.245 1.00 0.00 C ATOM 1368 OG1 THR A 93 -6.029 26.180 6.453 1.00 0.00 O ATOM 1369 CG2 THR A 93 -4.971 27.619 8.037 1.00 0.00 C ATOM 0 H THR A 93 -3.514 24.322 6.007 1.00 0.00 H new ATOM 0 HA THR A 93 -3.824 27.305 5.768 1.00 0.00 H new ATOM 0 HB THR A 93 -4.740 25.484 7.936 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.816 26.143 7.036 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.834 27.566 8.700 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.067 27.765 8.629 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.093 28.455 7.348 1.00 0.00 H new ATOM 1377 N GLU A 94 -1.341 26.976 6.142 1.00 0.00 N ATOM 1378 CA GLU A 94 0.041 27.284 6.475 1.00 0.00 C ATOM 1379 C GLU A 94 0.371 28.491 5.597 1.00 0.00 C ATOM 1380 O GLU A 94 0.788 29.534 6.088 1.00 0.00 O ATOM 1381 CB GLU A 94 0.955 26.081 6.157 1.00 0.00 C ATOM 1382 CG GLU A 94 2.430 26.309 6.554 1.00 0.00 C ATOM 1383 CD GLU A 94 3.422 25.346 5.876 1.00 0.00 C ATOM 1384 OE1 GLU A 94 3.037 24.570 4.970 1.00 0.00 O ATOM 1385 OE2 GLU A 94 4.639 25.413 6.176 1.00 0.00 O ATOM 0 H GLU A 94 -1.556 27.210 5.173 1.00 0.00 H new ATOM 0 HA GLU A 94 0.190 27.495 7.534 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.578 25.201 6.678 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.903 25.867 5.090 1.00 0.00 H new ATOM 0 HG2 GLU A 94 2.707 27.333 6.305 1.00 0.00 H new ATOM 0 HG3 GLU A 94 2.524 26.207 7.635 1.00 0.00 H new ATOM 1392 N TYR A 95 0.147 28.361 4.282 1.00 0.00 N ATOM 1393 CA TYR A 95 0.397 29.426 3.320 1.00 0.00 C ATOM 1394 C TYR A 95 -0.890 30.248 3.164 1.00 0.00 C ATOM 1395 O TYR A 95 -1.981 29.671 3.139 1.00 0.00 O ATOM 1396 CB TYR A 95 0.861 28.827 1.981 1.00 0.00 C ATOM 1397 CG TYR A 95 2.240 28.172 1.962 1.00 0.00 C ATOM 1398 CD1 TYR A 95 2.945 27.876 3.147 1.00 0.00 C ATOM 1399 CD2 TYR A 95 2.837 27.855 0.726 1.00 0.00 C ATOM 1400 CE1 TYR A 95 4.177 27.220 3.108 1.00 0.00 C ATOM 1401 CE2 TYR A 95 4.103 27.240 0.681 1.00 0.00 C ATOM 1402 CZ TYR A 95 4.768 26.888 1.877 1.00 0.00 C ATOM 1403 OH TYR A 95 5.990 26.286 1.854 1.00 0.00 O ATOM 0 H TYR A 95 -0.215 27.506 3.860 1.00 0.00 H new ATOM 0 HA TYR A 95 1.193 30.083 3.670 1.00 0.00 H new ATOM 0 HB2 TYR A 95 0.127 28.084 1.669 1.00 0.00 H new ATOM 0 HB3 TYR A 95 0.851 29.619 1.232 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.525 28.161 4.100 1.00 0.00 H new ATOM 0 HD2 TYR A 95 2.320 28.085 -0.194 1.00 0.00 H new ATOM 0 HE1 TYR A 95 4.679 26.966 4.030 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.568 27.036 -0.272 1.00 0.00 H new ATOM 0 HH TYR A 95 6.257 26.122 0.925 1.00 0.00 H new ATOM 1413 N PRO A 96 -0.799 31.580 3.004 1.00 0.00 N ATOM 1414 CA PRO A 96 -1.955 32.469 3.092 1.00 0.00 C ATOM 1415 C PRO A 96 -2.945 32.328 1.927 1.00 0.00 C ATOM 1416 O PRO A 96 -4.051 32.856 2.003 1.00 0.00 O ATOM 1417 CB PRO A 96 -1.367 33.884 3.169 1.00 0.00 C ATOM 1418 CG PRO A 96 -0.004 33.756 2.490 1.00 0.00 C ATOM 1419 CD PRO A 96 0.431 32.347 2.882 1.00 0.00 C ATOM 0 HA PRO A 96 -2.557 32.217 3.965 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -2.001 34.608 2.657 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.269 34.220 4.201 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -0.077 33.872 1.409 1.00 0.00 H new ATOM 0 HG3 PRO A 96 0.698 34.511 2.845 1.00 0.00 H new ATOM 0 HD2 PRO A 96 1.089 31.916 2.128 1.00 0.00 H new ATOM 0 HD3 PRO A 96 0.984 32.354 3.821 1.00 0.00 H new ATOM 1427 N THR A 97 -2.582 31.628 0.850 1.00 0.00 N ATOM 1428 CA THR A 97 -3.427 31.487 -0.331 1.00 0.00 C ATOM 1429 C THR A 97 -4.569 30.470 -0.093 1.00 0.00 C ATOM 1430 O THR A 97 -5.530 30.446 -0.866 1.00 0.00 O ATOM 1431 CB THR A 97 -2.492 31.214 -1.530 1.00 0.00 C ATOM 1432 OG1 THR A 97 -3.015 31.642 -2.768 1.00 0.00 O ATOM 1433 CG2 THR A 97 -2.012 29.768 -1.634 1.00 0.00 C ATOM 0 H THR A 97 -1.688 31.142 0.775 1.00 0.00 H new ATOM 0 HA THR A 97 -3.979 32.398 -0.562 1.00 0.00 H new ATOM 0 HB THR A 97 -1.620 31.829 -1.306 1.00 0.00 H new ATOM 0 HG1 THR A 97 -2.374 31.441 -3.481 1.00 0.00 H new ATOM 0 HG21 THR A 97 -1.361 29.662 -2.502 1.00 0.00 H new ATOM 0 HG22 THR A 97 -1.461 29.502 -0.732 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.871 29.106 -1.742 1.00 0.00 H new ATOM 1441 N TYR A 98 -4.511 29.670 0.991 1.00 0.00 N ATOM 1442 CA TYR A 98 -5.583 28.799 1.504 1.00 0.00 C ATOM 1443 C TYR A 98 -6.120 27.753 0.503 1.00 0.00 C ATOM 1444 O TYR A 98 -7.163 27.138 0.743 1.00 0.00 O ATOM 1445 CB TYR A 98 -6.704 29.662 2.133 1.00 0.00 C ATOM 1446 CG TYR A 98 -6.656 29.794 3.647 1.00 0.00 C ATOM 1447 CD1 TYR A 98 -5.613 30.509 4.266 1.00 0.00 C ATOM 1448 CD2 TYR A 98 -7.691 29.254 4.438 1.00 0.00 C ATOM 1449 CE1 TYR A 98 -5.612 30.712 5.658 1.00 0.00 C ATOM 1450 CE2 TYR A 98 -7.705 29.460 5.829 1.00 0.00 C ATOM 1451 CZ TYR A 98 -6.676 30.206 6.444 1.00 0.00 C ATOM 1452 OH TYR A 98 -6.723 30.421 7.787 1.00 0.00 O ATOM 0 H TYR A 98 -3.668 29.613 1.562 1.00 0.00 H new ATOM 0 HA TYR A 98 -5.131 28.180 2.279 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -6.658 30.660 1.697 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -7.667 29.236 1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -4.807 30.905 3.667 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -8.478 28.679 3.973 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -4.802 31.252 6.126 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -8.504 29.047 6.427 1.00 0.00 H new ATOM 0 HH TYR A 98 -7.526 30.000 8.158 1.00 0.00 H new ATOM 1462 N LYS A 99 -5.442 27.525 -0.622 1.00 0.00 N ATOM 1463 CA LYS A 99 -5.849 26.634 -1.706 1.00 0.00 C ATOM 1464 C LYS A 99 -4.569 25.983 -2.198 1.00 0.00 C ATOM 1465 O LYS A 99 -3.704 26.697 -2.716 1.00 0.00 O ATOM 1466 CB LYS A 99 -6.513 27.451 -2.834 1.00 0.00 C ATOM 1467 CG LYS A 99 -7.989 27.120 -3.087 1.00 0.00 C ATOM 1468 CD LYS A 99 -8.935 27.818 -2.109 1.00 0.00 C ATOM 1469 CE LYS A 99 -10.368 27.688 -2.631 1.00 0.00 C ATOM 1470 NZ LYS A 99 -11.262 28.685 -2.011 1.00 0.00 N ATOM 0 H LYS A 99 -4.549 27.980 -0.810 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.574 25.889 -1.378 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.429 28.511 -2.593 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.956 27.289 -3.757 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -8.251 27.408 -4.105 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -8.131 26.042 -3.014 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -8.852 27.370 -1.119 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -8.664 28.869 -2.007 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -10.375 27.815 -3.714 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -10.742 26.685 -2.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -12.225 28.569 -2.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -11.274 28.547 -0.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -10.918 29.642 -2.229 1.00 0.00 H new ATOM 1484 N ASN A 100 -4.366 24.686 -1.950 1.00 0.00 N ATOM 1485 CA ASN A 100 -3.123 24.041 -2.374 1.00 0.00 C ATOM 1486 C ASN A 100 -3.138 23.898 -3.896 1.00 0.00 C ATOM 1487 O ASN A 100 -2.377 24.582 -4.576 1.00 0.00 O ATOM 1488 CB ASN A 100 -2.865 22.723 -1.630 1.00 0.00 C ATOM 1489 CG ASN A 100 -1.372 22.456 -1.490 1.00 0.00 C ATOM 1490 OD1 ASN A 100 -0.605 22.382 -2.559 1.00 0.00 O flip ATOM 1491 ND2 ASN A 100 -0.880 22.348 -0.369 1.00 0.00 N flip ATOM 0 H ASN A 100 -5.028 24.076 -1.470 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.274 24.669 -2.102 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -3.325 22.763 -0.642 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -3.336 21.900 -2.168 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -1.476 22.406 0.457 1.00 0.00 H new ATOM 0 HD22 ASN A 100 0.124 22.201 -0.265 1.00 0.00 H new ATOM 1498 N ASP A 101 -4.057 23.085 -4.420 1.00 0.00 N ATOM 1499 CA ASP A 101 -4.350 22.883 -5.846 1.00 0.00 C ATOM 1500 C ASP A 101 -3.122 22.467 -6.651 1.00 0.00 C ATOM 1501 O ASP A 101 -2.923 22.897 -7.790 1.00 0.00 O ATOM 1502 CB ASP A 101 -5.088 24.083 -6.452 1.00 0.00 C ATOM 1503 CG ASP A 101 -6.462 24.242 -5.833 1.00 0.00 C ATOM 1504 OD1 ASP A 101 -7.326 23.377 -6.097 1.00 0.00 O ATOM 1505 OD2 ASP A 101 -6.660 25.224 -5.092 1.00 0.00 O ATOM 0 H ASP A 101 -4.656 22.513 -3.825 1.00 0.00 H new ATOM 0 HA ASP A 101 -5.034 22.036 -5.908 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -4.506 24.991 -6.293 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -5.183 23.950 -7.530 1.00 0.00 H new ATOM 1510 N THR A 102 -2.300 21.609 -6.058 1.00 0.00 N ATOM 1511 CA THR A 102 -1.163 20.996 -6.707 1.00 0.00 C ATOM 1512 C THR A 102 -1.566 19.575 -7.086 1.00 0.00 C ATOM 1513 O THR A 102 -1.514 18.663 -6.263 1.00 0.00 O ATOM 1514 CB THR A 102 0.059 21.062 -5.780 1.00 0.00 C ATOM 1515 OG1 THR A 102 0.270 22.401 -5.368 1.00 0.00 O ATOM 1516 CG2 THR A 102 1.327 20.547 -6.467 1.00 0.00 C ATOM 0 H THR A 102 -2.415 21.317 -5.087 1.00 0.00 H new ATOM 0 HA THR A 102 -0.875 21.522 -7.617 1.00 0.00 H new ATOM 0 HB THR A 102 -0.145 20.423 -4.921 1.00 0.00 H new ATOM 0 HG1 THR A 102 -0.012 22.505 -4.435 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.167 20.612 -5.776 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.182 19.509 -6.767 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.535 21.153 -7.348 1.00 0.00 H new ATOM 1524 N SER A 103 -1.938 19.390 -8.353 1.00 0.00 N ATOM 1525 CA SER A 103 -1.968 18.084 -8.988 1.00 0.00 C ATOM 1526 C SER A 103 -0.638 17.377 -8.709 1.00 0.00 C ATOM 1527 O SER A 103 0.427 17.907 -9.056 1.00 0.00 O ATOM 1528 CB SER A 103 -2.188 18.263 -10.492 1.00 0.00 C ATOM 1529 OG SER A 103 -3.337 19.048 -10.760 1.00 0.00 O ATOM 0 H SER A 103 -2.228 20.151 -8.967 1.00 0.00 H new ATOM 0 HA SER A 103 -2.782 17.478 -8.591 1.00 0.00 H new ATOM 0 HB2 SER A 103 -1.312 18.736 -10.935 1.00 0.00 H new ATOM 0 HB3 SER A 103 -2.296 17.286 -10.964 1.00 0.00 H new ATOM 0 HG SER A 103 -3.448 19.145 -11.729 1.00 0.00 H new ATOM 1535 N ASP A 104 -0.684 16.222 -8.047 1.00 0.00 N ATOM 1536 CA ASP A 104 0.481 15.393 -7.757 1.00 0.00 C ATOM 1537 C ASP A 104 0.244 14.038 -8.416 1.00 0.00 C ATOM 1538 O ASP A 104 -0.902 13.588 -8.518 1.00 0.00 O ATOM 1539 CB ASP A 104 0.740 15.296 -6.232 1.00 0.00 C ATOM 1540 CG ASP A 104 1.870 16.215 -5.745 1.00 0.00 C ATOM 1541 OD1 ASP A 104 2.872 16.358 -6.478 1.00 0.00 O ATOM 1542 OD2 ASP A 104 1.808 16.747 -4.611 1.00 0.00 O ATOM 0 H ASP A 104 -1.555 15.829 -7.689 1.00 0.00 H new ATOM 0 HA ASP A 104 1.390 15.835 -8.165 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -0.177 15.546 -5.699 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.985 14.265 -5.978 1.00 0.00 H new ATOM 1547 N TYR A 105 1.297 13.399 -8.926 1.00 0.00 N ATOM 1548 CA TYR A 105 1.183 12.131 -9.644 1.00 0.00 C ATOM 1549 C TYR A 105 2.384 11.268 -9.274 1.00 0.00 C ATOM 1550 O TYR A 105 3.497 11.500 -9.752 1.00 0.00 O ATOM 1551 CB TYR A 105 1.042 12.358 -11.164 1.00 0.00 C ATOM 1552 CG TYR A 105 -0.018 11.484 -11.815 1.00 0.00 C ATOM 1553 CD1 TYR A 105 0.171 10.093 -11.942 1.00 0.00 C ATOM 1554 CD2 TYR A 105 -1.224 12.063 -12.259 1.00 0.00 C ATOM 1555 CE1 TYR A 105 -0.846 9.288 -12.492 1.00 0.00 C ATOM 1556 CE2 TYR A 105 -2.250 11.264 -12.789 1.00 0.00 C ATOM 1557 CZ TYR A 105 -2.070 9.868 -12.901 1.00 0.00 C ATOM 1558 OH TYR A 105 -3.061 9.085 -13.404 1.00 0.00 O ATOM 0 H TYR A 105 2.253 13.747 -8.853 1.00 0.00 H new ATOM 0 HA TYR A 105 0.275 11.605 -9.350 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.799 13.405 -11.345 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.003 12.166 -11.642 1.00 0.00 H new ATOM 0 HD1 TYR A 105 1.098 9.643 -11.617 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -1.360 13.132 -12.191 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -0.691 8.225 -12.602 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -3.176 11.717 -13.111 1.00 0.00 H new ATOM 0 HH TYR A 105 -3.833 9.643 -13.635 1.00 0.00 H new ATOM 1568 N GLY A 106 2.188 10.331 -8.348 1.00 0.00 N ATOM 1569 CA GLY A 106 3.218 9.386 -7.951 1.00 0.00 C ATOM 1570 C GLY A 106 3.172 8.159 -8.852 1.00 0.00 C ATOM 1571 O GLY A 106 2.143 7.880 -9.463 1.00 0.00 O ATOM 0 H GLY A 106 1.305 10.209 -7.853 1.00 0.00 H new ATOM 0 HA2 GLY A 106 4.199 9.857 -8.013 1.00 0.00 H new ATOM 0 HA3 GLY A 106 3.072 9.091 -6.912 1.00 0.00 H new ATOM 1575 N PHE A 107 4.278 7.426 -8.924 1.00 0.00 N ATOM 1576 CA PHE A 107 4.357 6.117 -9.542 1.00 0.00 C ATOM 1577 C PHE A 107 5.229 5.270 -8.618 1.00 0.00 C ATOM 1578 O PHE A 107 6.434 5.526 -8.533 1.00 0.00 O ATOM 1579 CB PHE A 107 4.918 6.252 -10.967 1.00 0.00 C ATOM 1580 CG PHE A 107 4.871 4.983 -11.796 1.00 0.00 C ATOM 1581 CD1 PHE A 107 3.717 4.668 -12.540 1.00 0.00 C ATOM 1582 CD2 PHE A 107 5.987 4.127 -11.848 1.00 0.00 C ATOM 1583 CE1 PHE A 107 3.665 3.489 -13.306 1.00 0.00 C ATOM 1584 CE2 PHE A 107 5.942 2.960 -12.631 1.00 0.00 C ATOM 1585 CZ PHE A 107 4.780 2.635 -13.353 1.00 0.00 C ATOM 0 H PHE A 107 5.169 7.741 -8.540 1.00 0.00 H new ATOM 0 HA PHE A 107 3.385 5.636 -9.657 1.00 0.00 H new ATOM 0 HB2 PHE A 107 4.361 7.030 -11.489 1.00 0.00 H new ATOM 0 HB3 PHE A 107 5.953 6.589 -10.904 1.00 0.00 H new ATOM 0 HD1 PHE A 107 2.868 5.335 -12.522 1.00 0.00 H new ATOM 0 HD2 PHE A 107 6.878 4.367 -11.286 1.00 0.00 H new ATOM 0 HE1 PHE A 107 2.770 3.241 -13.857 1.00 0.00 H new ATOM 0 HE2 PHE A 107 6.804 2.310 -12.678 1.00 0.00 H new ATOM 0 HZ PHE A 107 4.744 1.731 -13.943 1.00 0.00 H new ATOM 1595 N SER A 108 4.633 4.323 -7.891 1.00 0.00 N ATOM 1596 CA SER A 108 5.384 3.193 -7.346 1.00 0.00 C ATOM 1597 C SER A 108 5.298 2.035 -8.341 1.00 0.00 C ATOM 1598 O SER A 108 4.434 2.048 -9.224 1.00 0.00 O ATOM 1599 CB SER A 108 4.834 2.763 -5.984 1.00 0.00 C ATOM 1600 OG SER A 108 4.998 3.797 -5.040 1.00 0.00 O ATOM 0 H SER A 108 3.638 4.317 -7.667 1.00 0.00 H new ATOM 0 HA SER A 108 6.422 3.490 -7.197 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.778 2.509 -6.075 1.00 0.00 H new ATOM 0 HB3 SER A 108 5.350 1.865 -5.643 1.00 0.00 H new ATOM 0 HG SER A 108 4.201 3.851 -4.472 1.00 0.00 H new ATOM 1606 N TYR A 109 6.166 1.035 -8.178 1.00 0.00 N ATOM 1607 CA TYR A 109 6.247 -0.151 -9.031 1.00 0.00 C ATOM 1608 C TYR A 109 6.667 -1.380 -8.214 1.00 0.00 C ATOM 1609 O TYR A 109 7.025 -1.258 -7.038 1.00 0.00 O ATOM 1610 CB TYR A 109 7.240 0.113 -10.177 1.00 0.00 C ATOM 1611 CG TYR A 109 8.638 0.519 -9.733 1.00 0.00 C ATOM 1612 CD1 TYR A 109 9.566 -0.444 -9.287 1.00 0.00 C ATOM 1613 CD2 TYR A 109 9.008 1.877 -9.761 1.00 0.00 C ATOM 1614 CE1 TYR A 109 10.851 -0.053 -8.869 1.00 0.00 C ATOM 1615 CE2 TYR A 109 10.297 2.272 -9.371 1.00 0.00 C ATOM 1616 CZ TYR A 109 11.229 1.307 -8.926 1.00 0.00 C ATOM 1617 OH TYR A 109 12.488 1.685 -8.568 1.00 0.00 O ATOM 0 H TYR A 109 6.854 1.029 -7.425 1.00 0.00 H new ATOM 0 HA TYR A 109 5.264 -0.357 -9.453 1.00 0.00 H new ATOM 0 HB2 TYR A 109 7.315 -0.787 -10.787 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.835 0.898 -10.815 1.00 0.00 H new ATOM 0 HD1 TYR A 109 9.289 -1.488 -9.266 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.295 2.620 -10.085 1.00 0.00 H new ATOM 0 HE1 TYR A 109 11.549 -0.793 -8.504 1.00 0.00 H new ATOM 0 HE2 TYR A 109 10.577 3.314 -9.411 1.00 0.00 H new ATOM 0 HH TYR A 109 12.579 2.656 -8.668 1.00 0.00 H new ATOM 1627 N GLY A 110 6.696 -2.551 -8.859 1.00 0.00 N ATOM 1628 CA GLY A 110 7.345 -3.773 -8.403 1.00 0.00 C ATOM 1629 C GLY A 110 6.609 -4.392 -7.222 1.00 0.00 C ATOM 1630 O GLY A 110 5.700 -5.191 -7.432 1.00 0.00 O ATOM 0 H GLY A 110 6.240 -2.672 -9.763 1.00 0.00 H new ATOM 0 HA2 GLY A 110 7.388 -4.491 -9.222 1.00 0.00 H new ATOM 0 HA3 GLY A 110 8.374 -3.554 -8.117 1.00 0.00 H new ATOM 1634 N ALA A 111 7.012 -3.991 -6.015 1.00 0.00 N ATOM 1635 CA ALA A 111 6.451 -4.270 -4.698 1.00 0.00 C ATOM 1636 C ALA A 111 5.610 -5.552 -4.577 1.00 0.00 C ATOM 1637 O ALA A 111 4.376 -5.501 -4.576 1.00 0.00 O ATOM 1638 CB ALA A 111 5.670 -3.037 -4.225 1.00 0.00 C ATOM 0 H ALA A 111 7.835 -3.394 -5.931 1.00 0.00 H new ATOM 0 HA ALA A 111 7.300 -4.474 -4.045 1.00 0.00 H new ATOM 0 HB1 ALA A 111 5.244 -3.231 -3.241 1.00 0.00 H new ATOM 0 HB2 ALA A 111 6.342 -2.181 -4.167 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.868 -2.822 -4.931 1.00 0.00 H new ATOM 1644 N GLY A 112 6.263 -6.696 -4.361 1.00 0.00 N ATOM 1645 CA GLY A 112 5.615 -7.751 -3.608 1.00 0.00 C ATOM 1646 C GLY A 112 6.429 -9.030 -3.609 1.00 0.00 C ATOM 1647 O GLY A 112 6.488 -9.733 -4.623 1.00 0.00 O ATOM 0 H GLY A 112 7.207 -6.904 -4.687 1.00 0.00 H new ATOM 0 HA2 GLY A 112 5.460 -7.421 -2.581 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.630 -7.947 -4.032 1.00 0.00 H new ATOM 1651 N LEU A 113 7.074 -9.338 -2.485 1.00 0.00 N ATOM 1652 CA LEU A 113 7.789 -10.594 -2.308 1.00 0.00 C ATOM 1653 C LEU A 113 7.191 -11.310 -1.095 1.00 0.00 C ATOM 1654 O LEU A 113 7.066 -10.690 -0.040 1.00 0.00 O ATOM 1655 CB LEU A 113 9.283 -10.292 -2.073 1.00 0.00 C ATOM 1656 CG LEU A 113 10.143 -9.831 -3.270 1.00 0.00 C ATOM 1657 CD1 LEU A 113 10.114 -10.854 -4.407 1.00 0.00 C ATOM 1658 CD2 LEU A 113 9.789 -8.448 -3.831 1.00 0.00 C ATOM 0 H LEU A 113 7.114 -8.722 -1.673 1.00 0.00 H new ATOM 0 HA LEU A 113 7.696 -11.227 -3.191 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.348 -9.523 -1.304 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.742 -11.192 -1.663 1.00 0.00 H new ATOM 0 HG LEU A 113 11.147 -9.749 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.730 -10.498 -5.233 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.504 -11.807 -4.049 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.088 -10.987 -4.750 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.448 -8.215 -4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.754 -8.448 -4.173 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.913 -7.696 -3.051 1.00 0.00 H new ATOM 1670 N GLN A 114 6.995 -12.631 -1.168 1.00 0.00 N ATOM 1671 CA GLN A 114 6.476 -13.476 -0.089 1.00 0.00 C ATOM 1672 C GLN A 114 7.548 -14.507 0.261 1.00 0.00 C ATOM 1673 O GLN A 114 8.087 -15.185 -0.623 1.00 0.00 O ATOM 1674 CB GLN A 114 5.162 -14.179 -0.497 1.00 0.00 C ATOM 1675 CG GLN A 114 4.381 -14.743 0.714 1.00 0.00 C ATOM 1676 CD GLN A 114 3.752 -16.112 0.449 1.00 0.00 C ATOM 1677 OE1 GLN A 114 2.554 -16.236 0.196 1.00 0.00 O ATOM 1678 NE2 GLN A 114 4.531 -17.178 0.526 1.00 0.00 N ATOM 0 H GLN A 114 7.202 -13.161 -2.015 1.00 0.00 H new ATOM 0 HA GLN A 114 6.246 -12.855 0.777 1.00 0.00 H new ATOM 0 HB2 GLN A 114 4.529 -13.472 -1.034 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.389 -14.992 -1.187 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.055 -14.820 1.567 1.00 0.00 H new ATOM 0 HG3 GLN A 114 3.596 -14.039 0.991 1.00 0.00 H new ATOM 0 HE21 GLN A 114 5.523 -17.070 0.736 1.00 0.00 H new ATOM 0 HE22 GLN A 114 4.139 -18.108 0.375 1.00 0.00 H new ATOM 1687 N PHE A 115 7.841 -14.633 1.550 1.00 0.00 N ATOM 1688 CA PHE A 115 8.709 -15.649 2.131 1.00 0.00 C ATOM 1689 C PHE A 115 7.824 -16.827 2.565 1.00 0.00 C ATOM 1690 O PHE A 115 6.596 -16.727 2.468 1.00 0.00 O ATOM 1691 CB PHE A 115 9.471 -15.013 3.310 1.00 0.00 C ATOM 1692 CG PHE A 115 10.952 -15.313 3.400 1.00 0.00 C ATOM 1693 CD1 PHE A 115 11.772 -15.282 2.253 1.00 0.00 C ATOM 1694 CD2 PHE A 115 11.527 -15.579 4.658 1.00 0.00 C ATOM 1695 CE1 PHE A 115 13.143 -15.567 2.359 1.00 0.00 C ATOM 1696 CE2 PHE A 115 12.898 -15.857 4.761 1.00 0.00 C ATOM 1697 CZ PHE A 115 13.703 -15.869 3.610 1.00 0.00 C ATOM 0 H PHE A 115 7.461 -13.998 2.252 1.00 0.00 H new ATOM 0 HA PHE A 115 9.448 -16.023 1.423 1.00 0.00 H new ATOM 0 HB2 PHE A 115 9.345 -13.932 3.254 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.000 -15.341 4.237 1.00 0.00 H new ATOM 0 HD1 PHE A 115 11.345 -15.039 1.291 1.00 0.00 H new ATOM 0 HD2 PHE A 115 10.911 -15.569 5.545 1.00 0.00 H new ATOM 0 HE1 PHE A 115 13.767 -15.554 1.477 1.00 0.00 H new ATOM 0 HE2 PHE A 115 13.335 -16.062 5.727 1.00 0.00 H new ATOM 0 HZ PHE A 115 14.753 -16.111 3.688 1.00 0.00 H new ATOM 1707 N ASN A 116 8.408 -17.958 2.983 1.00 0.00 N ATOM 1708 CA ASN A 116 7.613 -19.104 3.440 1.00 0.00 C ATOM 1709 C ASN A 116 6.742 -18.642 4.632 1.00 0.00 C ATOM 1710 O ASN A 116 7.300 -18.093 5.588 1.00 0.00 O ATOM 1711 CB ASN A 116 8.500 -20.320 3.794 1.00 0.00 C ATOM 1712 CG ASN A 116 7.947 -21.623 3.222 1.00 0.00 C ATOM 1713 OD1 ASN A 116 6.740 -21.863 3.224 1.00 0.00 O ATOM 1714 ND2 ASN A 116 8.782 -22.486 2.669 1.00 0.00 N ATOM 0 H ASN A 116 9.417 -18.103 3.014 1.00 0.00 H new ATOM 0 HA ASN A 116 6.966 -19.448 2.633 1.00 0.00 H new ATOM 0 HB2 ASN A 116 9.508 -20.156 3.412 1.00 0.00 H new ATOM 0 HB3 ASN A 116 8.580 -20.406 4.878 1.00 0.00 H new ATOM 0 HD21 ASN A 116 8.424 -23.343 2.248 1.00 0.00 H new ATOM 0 HD22 ASN A 116 9.784 -22.294 2.663 1.00 0.00 H new ATOM 1721 N PRO A 117 5.400 -18.729 4.571 1.00 0.00 N ATOM 1722 CA PRO A 117 4.518 -18.180 5.599 1.00 0.00 C ATOM 1723 C PRO A 117 4.444 -19.102 6.830 1.00 0.00 C ATOM 1724 O PRO A 117 4.809 -20.275 6.751 1.00 0.00 O ATOM 1725 CB PRO A 117 3.169 -18.037 4.888 1.00 0.00 C ATOM 1726 CG PRO A 117 3.156 -19.169 3.872 1.00 0.00 C ATOM 1727 CD PRO A 117 4.620 -19.287 3.476 1.00 0.00 C ATOM 0 HA PRO A 117 4.870 -17.228 5.997 1.00 0.00 H new ATOM 0 HB2 PRO A 117 2.339 -18.123 5.589 1.00 0.00 H new ATOM 0 HB3 PRO A 117 3.077 -17.066 4.402 1.00 0.00 H new ATOM 0 HG2 PRO A 117 2.779 -20.096 4.304 1.00 0.00 H new ATOM 0 HG3 PRO A 117 2.523 -18.936 3.016 1.00 0.00 H new ATOM 0 HD2 PRO A 117 4.890 -20.328 3.301 1.00 0.00 H new ATOM 0 HD3 PRO A 117 4.814 -18.747 2.549 1.00 0.00 H new ATOM 1735 N MET A 118 3.935 -18.610 7.966 1.00 0.00 N ATOM 1736 CA MET A 118 3.838 -19.382 9.207 1.00 0.00 C ATOM 1737 C MET A 118 2.465 -19.147 9.841 1.00 0.00 C ATOM 1738 O MET A 118 1.842 -18.101 9.639 1.00 0.00 O ATOM 1739 CB MET A 118 4.999 -18.982 10.135 1.00 0.00 C ATOM 1740 CG MET A 118 5.582 -20.130 10.967 1.00 0.00 C ATOM 1741 SD MET A 118 4.604 -20.716 12.377 1.00 0.00 S ATOM 1742 CE MET A 118 5.951 -21.443 13.355 1.00 0.00 C ATOM 0 H MET A 118 3.577 -17.658 8.049 1.00 0.00 H new ATOM 0 HA MET A 118 3.925 -20.451 9.014 1.00 0.00 H new ATOM 0 HB2 MET A 118 5.796 -18.549 9.531 1.00 0.00 H new ATOM 0 HB3 MET A 118 4.652 -18.201 10.812 1.00 0.00 H new ATOM 0 HG2 MET A 118 5.754 -20.976 10.301 1.00 0.00 H new ATOM 0 HG3 MET A 118 6.556 -19.815 11.340 1.00 0.00 H new ATOM 0 HE1 MET A 118 5.546 -21.863 14.276 1.00 0.00 H new ATOM 0 HE2 MET A 118 6.435 -22.232 12.778 1.00 0.00 H new ATOM 0 HE3 MET A 118 6.681 -20.671 13.598 1.00 0.00 H new ATOM 1752 N GLU A 119 1.996 -20.098 10.644 1.00 0.00 N ATOM 1753 CA GLU A 119 0.646 -20.223 11.204 1.00 0.00 C ATOM 1754 C GLU A 119 0.411 -19.249 12.361 1.00 0.00 C ATOM 1755 O GLU A 119 -0.498 -19.419 13.177 1.00 0.00 O ATOM 1756 CB GLU A 119 0.409 -21.672 11.648 1.00 0.00 C ATOM 1757 CG GLU A 119 0.463 -22.650 10.471 1.00 0.00 C ATOM 1758 CD GLU A 119 0.049 -24.046 10.925 1.00 0.00 C ATOM 1759 OE1 GLU A 119 0.813 -24.678 11.690 1.00 0.00 O ATOM 1760 OE2 GLU A 119 -1.066 -24.484 10.565 1.00 0.00 O ATOM 0 H GLU A 119 2.596 -20.865 10.947 1.00 0.00 H new ATOM 0 HA GLU A 119 -0.072 -19.962 10.426 1.00 0.00 H new ATOM 0 HB2 GLU A 119 1.160 -21.952 12.387 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -0.562 -21.747 12.137 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -0.198 -22.308 9.674 1.00 0.00 H new ATOM 0 HG3 GLU A 119 1.472 -22.678 10.058 1.00 0.00 H new ATOM 1767 N ASN A 120 1.237 -18.211 12.434 1.00 0.00 N ATOM 1768 CA ASN A 120 0.987 -17.053 13.256 1.00 0.00 C ATOM 1769 C ASN A 120 1.407 -15.790 12.549 1.00 0.00 C ATOM 1770 O ASN A 120 0.717 -14.787 12.682 1.00 0.00 O ATOM 1771 CB ASN A 120 1.693 -17.182 14.610 1.00 0.00 C ATOM 1772 CG ASN A 120 0.683 -16.986 15.713 1.00 0.00 C ATOM 1773 OD1 ASN A 120 0.766 -16.065 16.526 1.00 0.00 O ATOM 1774 ND2 ASN A 120 -0.317 -17.843 15.721 1.00 0.00 N ATOM 0 H ASN A 120 2.111 -18.159 11.911 1.00 0.00 H new ATOM 0 HA ASN A 120 -0.086 -16.995 13.439 1.00 0.00 H new ATOM 0 HB2 ASN A 120 2.161 -18.162 14.698 1.00 0.00 H new ATOM 0 HB3 ASN A 120 2.488 -16.441 14.692 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -1.057 -17.756 16.417 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -0.351 -18.593 15.031 1.00 0.00 H new ATOM 1781 N VAL A 121 2.507 -15.816 11.796 1.00 0.00 N ATOM 1782 CA VAL A 121 3.051 -14.630 11.161 1.00 0.00 C ATOM 1783 C VAL A 121 3.524 -14.989 9.754 1.00 0.00 C ATOM 1784 O VAL A 121 4.415 -15.821 9.572 1.00 0.00 O ATOM 1785 CB VAL A 121 4.137 -13.988 12.055 1.00 0.00 C ATOM 1786 CG1 VAL A 121 3.592 -13.643 13.444 1.00 0.00 C ATOM 1787 CG2 VAL A 121 5.368 -14.864 12.283 1.00 0.00 C ATOM 0 H VAL A 121 3.042 -16.665 11.613 1.00 0.00 H new ATOM 0 HA VAL A 121 2.284 -13.863 11.047 1.00 0.00 H new ATOM 0 HB VAL A 121 4.431 -13.099 11.498 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.383 -13.194 14.044 1.00 0.00 H new ATOM 0 HG12 VAL A 121 2.766 -12.938 13.346 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.238 -14.551 13.932 1.00 0.00 H new ATOM 0 HG21 VAL A 121 6.077 -14.336 12.920 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.068 -15.794 12.766 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.838 -15.088 11.325 1.00 0.00 H new ATOM 1797 N ALA A 122 2.896 -14.382 8.747 1.00 0.00 N ATOM 1798 CA ALA A 122 3.447 -14.358 7.401 1.00 0.00 C ATOM 1799 C ALA A 122 4.733 -13.541 7.390 1.00 0.00 C ATOM 1800 O ALA A 122 5.004 -12.800 8.333 1.00 0.00 O ATOM 1801 CB ALA A 122 2.422 -13.729 6.459 1.00 0.00 C ATOM 0 H ALA A 122 2.002 -13.900 8.843 1.00 0.00 H new ATOM 0 HA ALA A 122 3.671 -15.373 7.073 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.825 -13.706 5.446 1.00 0.00 H new ATOM 0 HB2 ALA A 122 1.506 -14.319 6.472 1.00 0.00 H new ATOM 0 HB3 ALA A 122 2.203 -12.712 6.786 1.00 0.00 H new ATOM 1807 N LEU A 123 5.474 -13.601 6.286 1.00 0.00 N ATOM 1808 CA LEU A 123 6.498 -12.627 5.961 1.00 0.00 C ATOM 1809 C LEU A 123 6.244 -12.270 4.504 1.00 0.00 C ATOM 1810 O LEU A 123 6.438 -13.110 3.621 1.00 0.00 O ATOM 1811 CB LEU A 123 7.912 -13.220 6.127 1.00 0.00 C ATOM 1812 CG LEU A 123 8.545 -13.254 7.530 1.00 0.00 C ATOM 1813 CD1 LEU A 123 8.677 -11.861 8.155 1.00 0.00 C ATOM 1814 CD2 LEU A 123 7.869 -14.227 8.505 1.00 0.00 C ATOM 0 H LEU A 123 5.375 -14.338 5.588 1.00 0.00 H new ATOM 0 HA LEU A 123 6.452 -11.761 6.621 1.00 0.00 H new ATOM 0 HB2 LEU A 123 7.886 -14.243 5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.583 -12.659 5.476 1.00 0.00 H new ATOM 0 HG LEU A 123 9.548 -13.643 7.357 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.129 -11.947 9.143 1.00 0.00 H new ATOM 0 HD12 LEU A 123 9.306 -11.236 7.521 1.00 0.00 H new ATOM 0 HD13 LEU A 123 7.690 -11.408 8.246 1.00 0.00 H new ATOM 0 HD21 LEU A 123 8.377 -14.188 9.469 1.00 0.00 H new ATOM 0 HD22 LEU A 123 6.824 -13.945 8.634 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.925 -15.240 8.106 1.00 0.00 H new ATOM 1826 N ASP A 124 5.878 -11.018 4.250 1.00 0.00 N ATOM 1827 CA ASP A 124 5.905 -10.411 2.922 1.00 0.00 C ATOM 1828 C ASP A 124 6.779 -9.153 3.019 1.00 0.00 C ATOM 1829 O ASP A 124 7.148 -8.732 4.119 1.00 0.00 O ATOM 1830 CB ASP A 124 4.497 -10.095 2.383 1.00 0.00 C ATOM 1831 CG ASP A 124 3.704 -11.303 1.861 1.00 0.00 C ATOM 1832 OD1 ASP A 124 2.980 -11.976 2.633 1.00 0.00 O ATOM 1833 OD2 ASP A 124 3.639 -11.477 0.624 1.00 0.00 O ATOM 0 H ASP A 124 5.547 -10.383 4.976 1.00 0.00 H new ATOM 0 HA ASP A 124 6.324 -11.115 2.203 1.00 0.00 H new ATOM 0 HB2 ASP A 124 3.921 -9.619 3.177 1.00 0.00 H new ATOM 0 HB3 ASP A 124 4.590 -9.367 1.577 1.00 0.00 H new ATOM 1838 N PHE A 125 7.145 -8.563 1.883 1.00 0.00 N ATOM 1839 CA PHE A 125 8.038 -7.413 1.783 1.00 0.00 C ATOM 1840 C PHE A 125 7.624 -6.610 0.552 1.00 0.00 C ATOM 1841 O PHE A 125 7.501 -7.192 -0.530 1.00 0.00 O ATOM 1842 CB PHE A 125 9.493 -7.905 1.635 1.00 0.00 C ATOM 1843 CG PHE A 125 10.474 -7.363 2.653 1.00 0.00 C ATOM 1844 CD1 PHE A 125 10.635 -8.016 3.891 1.00 0.00 C ATOM 1845 CD2 PHE A 125 11.275 -6.250 2.340 1.00 0.00 C ATOM 1846 CE1 PHE A 125 11.616 -7.576 4.797 1.00 0.00 C ATOM 1847 CE2 PHE A 125 12.245 -5.803 3.254 1.00 0.00 C ATOM 1848 CZ PHE A 125 12.426 -6.473 4.474 1.00 0.00 C ATOM 0 H PHE A 125 6.815 -8.886 0.973 1.00 0.00 H new ATOM 0 HA PHE A 125 7.974 -6.791 2.676 1.00 0.00 H new ATOM 0 HB2 PHE A 125 9.498 -8.993 1.696 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.847 -7.640 0.639 1.00 0.00 H new ATOM 0 HD1 PHE A 125 10.004 -8.855 4.144 1.00 0.00 H new ATOM 0 HD2 PHE A 125 11.145 -5.739 1.398 1.00 0.00 H new ATOM 0 HE1 PHE A 125 11.747 -8.085 5.740 1.00 0.00 H new ATOM 0 HE2 PHE A 125 12.852 -4.942 3.017 1.00 0.00 H new ATOM 0 HZ PHE A 125 13.187 -6.141 5.165 1.00 0.00 H new ATOM 1858 N SER A 126 7.446 -5.296 0.698 1.00 0.00 N ATOM 1859 CA SER A 126 7.156 -4.390 -0.399 1.00 0.00 C ATOM 1860 C SER A 126 7.877 -3.064 -0.173 1.00 0.00 C ATOM 1861 O SER A 126 8.372 -2.775 0.921 1.00 0.00 O ATOM 1862 CB SER A 126 5.645 -4.171 -0.487 1.00 0.00 C ATOM 1863 OG SER A 126 5.030 -5.114 -1.328 1.00 0.00 O ATOM 0 H SER A 126 7.502 -4.829 1.603 1.00 0.00 H new ATOM 0 HA SER A 126 7.506 -4.820 -1.337 1.00 0.00 H new ATOM 0 HB2 SER A 126 5.210 -4.235 0.510 1.00 0.00 H new ATOM 0 HB3 SER A 126 5.444 -3.166 -0.859 1.00 0.00 H new ATOM 0 HG SER A 126 4.065 -4.945 -1.359 1.00 0.00 H new ATOM 1869 N TYR A 127 7.932 -2.250 -1.222 1.00 0.00 N ATOM 1870 CA TYR A 127 8.490 -0.916 -1.214 1.00 0.00 C ATOM 1871 C TYR A 127 7.635 -0.094 -2.173 1.00 0.00 C ATOM 1872 O TYR A 127 7.689 -0.308 -3.380 1.00 0.00 O ATOM 1873 CB TYR A 127 9.982 -0.954 -1.597 1.00 0.00 C ATOM 1874 CG TYR A 127 10.398 -1.880 -2.737 1.00 0.00 C ATOM 1875 CD1 TYR A 127 10.417 -1.417 -4.067 1.00 0.00 C ATOM 1876 CD2 TYR A 127 10.842 -3.190 -2.459 1.00 0.00 C ATOM 1877 CE1 TYR A 127 10.871 -2.247 -5.106 1.00 0.00 C ATOM 1878 CE2 TYR A 127 11.291 -4.033 -3.494 1.00 0.00 C ATOM 1879 CZ TYR A 127 11.309 -3.561 -4.827 1.00 0.00 C ATOM 1880 OH TYR A 127 11.774 -4.335 -5.848 1.00 0.00 O ATOM 0 H TYR A 127 7.571 -2.520 -2.137 1.00 0.00 H new ATOM 0 HA TYR A 127 8.466 -0.459 -0.225 1.00 0.00 H new ATOM 0 HB2 TYR A 127 10.287 0.059 -1.859 1.00 0.00 H new ATOM 0 HB3 TYR A 127 10.549 -1.238 -0.710 1.00 0.00 H new ATOM 0 HD1 TYR A 127 10.080 -0.416 -4.290 1.00 0.00 H new ATOM 0 HD2 TYR A 127 10.838 -3.550 -1.441 1.00 0.00 H new ATOM 0 HE1 TYR A 127 10.885 -1.879 -6.121 1.00 0.00 H new ATOM 0 HE2 TYR A 127 11.621 -5.037 -3.270 1.00 0.00 H new ATOM 0 HH TYR A 127 12.039 -5.212 -5.499 1.00 0.00 H new ATOM 1890 N GLU A 128 6.823 0.825 -1.653 1.00 0.00 N ATOM 1891 CA GLU A 128 6.153 1.811 -2.491 1.00 0.00 C ATOM 1892 C GLU A 128 7.027 3.046 -2.375 1.00 0.00 C ATOM 1893 O GLU A 128 7.289 3.506 -1.258 1.00 0.00 O ATOM 1894 CB GLU A 128 4.743 2.140 -1.997 1.00 0.00 C ATOM 1895 CG GLU A 128 3.648 1.190 -2.495 1.00 0.00 C ATOM 1896 CD GLU A 128 2.298 1.914 -2.477 1.00 0.00 C ATOM 1897 OE1 GLU A 128 1.837 2.335 -1.385 1.00 0.00 O ATOM 1898 OE2 GLU A 128 1.725 2.169 -3.558 1.00 0.00 O ATOM 0 H GLU A 128 6.615 0.905 -0.658 1.00 0.00 H new ATOM 0 HA GLU A 128 6.034 1.443 -3.510 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.744 2.131 -0.907 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.492 3.155 -2.307 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.878 0.851 -3.505 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.606 0.303 -1.863 1.00 0.00 H new ATOM 1905 N GLN A 129 7.578 3.491 -3.500 1.00 0.00 N ATOM 1906 CA GLN A 129 8.481 4.622 -3.561 1.00 0.00 C ATOM 1907 C GLN A 129 8.049 5.554 -4.694 1.00 0.00 C ATOM 1908 O GLN A 129 8.258 5.241 -5.867 1.00 0.00 O ATOM 1909 CB GLN A 129 9.928 4.111 -3.665 1.00 0.00 C ATOM 1910 CG GLN A 129 10.172 3.023 -4.731 1.00 0.00 C ATOM 1911 CD GLN A 129 11.611 3.072 -5.220 1.00 0.00 C ATOM 1912 OE1 GLN A 129 12.511 2.527 -4.591 1.00 0.00 O ATOM 1913 NE2 GLN A 129 11.868 3.757 -6.325 1.00 0.00 N ATOM 0 H GLN A 129 7.402 3.063 -4.409 1.00 0.00 H new ATOM 0 HA GLN A 129 8.440 5.220 -2.651 1.00 0.00 H new ATOM 0 HB2 GLN A 129 10.580 4.958 -3.879 1.00 0.00 H new ATOM 0 HB3 GLN A 129 10.227 3.717 -2.694 1.00 0.00 H new ATOM 0 HG2 GLN A 129 9.957 2.040 -4.312 1.00 0.00 H new ATOM 0 HG3 GLN A 129 9.491 3.168 -5.570 1.00 0.00 H new ATOM 0 HE21 GLN A 129 11.107 4.204 -6.836 1.00 0.00 H new ATOM 0 HE22 GLN A 129 12.827 3.837 -6.664 1.00 0.00 H new ATOM 1922 N SER A 130 7.488 6.713 -4.351 1.00 0.00 N ATOM 1923 CA SER A 130 6.967 7.690 -5.302 1.00 0.00 C ATOM 1924 C SER A 130 7.830 8.942 -5.349 1.00 0.00 C ATOM 1925 O SER A 130 8.595 9.229 -4.419 1.00 0.00 O ATOM 1926 CB SER A 130 5.545 8.080 -4.924 1.00 0.00 C ATOM 1927 OG SER A 130 4.735 6.930 -4.904 1.00 0.00 O ATOM 0 H SER A 130 7.381 7.004 -3.379 1.00 0.00 H new ATOM 0 HA SER A 130 6.978 7.225 -6.288 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.536 8.562 -3.946 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.152 8.803 -5.639 1.00 0.00 H new ATOM 0 HG SER A 130 3.819 7.179 -4.659 1.00 0.00 H new ATOM 1933 N ARG A 131 7.693 9.706 -6.431 1.00 0.00 N ATOM 1934 CA ARG A 131 8.166 11.077 -6.501 1.00 0.00 C ATOM 1935 C ARG A 131 6.962 11.943 -6.840 1.00 0.00 C ATOM 1936 O ARG A 131 6.269 11.630 -7.810 1.00 0.00 O ATOM 1937 CB ARG A 131 9.306 11.169 -7.525 1.00 0.00 C ATOM 1938 CG ARG A 131 10.218 12.353 -7.190 1.00 0.00 C ATOM 1939 CD ARG A 131 11.528 12.262 -7.985 1.00 0.00 C ATOM 1940 NE ARG A 131 12.588 13.150 -7.479 1.00 0.00 N ATOM 1941 CZ ARG A 131 13.304 12.990 -6.354 1.00 0.00 C ATOM 1942 NH1 ARG A 131 13.045 12.030 -5.474 1.00 0.00 N ATOM 1943 NH2 ARG A 131 14.334 13.782 -6.107 1.00 0.00 N ATOM 0 H ARG A 131 7.246 9.383 -7.289 1.00 0.00 H new ATOM 0 HA ARG A 131 8.585 11.430 -5.559 1.00 0.00 H new ATOM 0 HB2 ARG A 131 9.882 10.244 -7.524 1.00 0.00 H new ATOM 0 HB3 ARG A 131 8.896 11.288 -8.528 1.00 0.00 H new ATOM 0 HG2 ARG A 131 9.709 13.289 -7.421 1.00 0.00 H new ATOM 0 HG3 ARG A 131 10.434 12.363 -6.122 1.00 0.00 H new ATOM 0 HD2 ARG A 131 11.886 11.233 -7.962 1.00 0.00 H new ATOM 0 HD3 ARG A 131 11.328 12.507 -9.028 1.00 0.00 H new ATOM 0 HE ARG A 131 12.801 13.973 -8.042 1.00 0.00 H new ATOM 0 HH11 ARG A 131 12.277 11.379 -5.640 1.00 0.00 H new ATOM 0 HH12 ARG A 131 13.614 11.943 -4.632 1.00 0.00 H new ATOM 0 HH21 ARG A 131 14.585 14.515 -6.771 1.00 0.00 H new ATOM 0 HH22 ARG A 131 14.878 13.660 -5.253 1.00 0.00 H new ATOM 1957 N ILE A 132 6.652 12.951 -6.024 1.00 0.00 N ATOM 1958 CA ILE A 132 5.463 13.791 -6.179 1.00 0.00 C ATOM 1959 C ILE A 132 5.852 15.244 -5.925 1.00 0.00 C ATOM 1960 O ILE A 132 6.262 15.582 -4.819 1.00 0.00 O ATOM 1961 CB ILE A 132 4.299 13.308 -5.272 1.00 0.00 C ATOM 1962 CG1 ILE A 132 4.690 12.961 -3.814 1.00 0.00 C ATOM 1963 CG2 ILE A 132 3.613 12.110 -5.942 1.00 0.00 C ATOM 1964 CD1 ILE A 132 3.473 12.675 -2.921 1.00 0.00 C ATOM 0 H ILE A 132 7.229 13.211 -5.224 1.00 0.00 H new ATOM 0 HA ILE A 132 5.085 13.710 -7.198 1.00 0.00 H new ATOM 0 HB ILE A 132 3.621 14.156 -5.175 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.345 12.090 -3.816 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.260 13.788 -3.389 1.00 0.00 H new ATOM 0 HG21 ILE A 132 2.793 11.762 -5.314 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.222 12.411 -6.914 1.00 0.00 H new ATOM 0 HG23 ILE A 132 4.335 11.305 -6.075 1.00 0.00 H new ATOM 0 HD11 ILE A 132 3.810 12.438 -1.912 1.00 0.00 H new ATOM 0 HD12 ILE A 132 2.829 13.554 -2.892 1.00 0.00 H new ATOM 0 HD13 ILE A 132 2.916 11.830 -3.325 1.00 0.00 H new ATOM 1976 N ARG A 133 5.796 16.104 -6.948 1.00 0.00 N ATOM 1977 CA ARG A 133 6.389 17.447 -6.932 1.00 0.00 C ATOM 1978 C ARG A 133 7.886 17.368 -6.593 1.00 0.00 C ATOM 1979 O ARG A 133 8.391 18.174 -5.815 1.00 0.00 O ATOM 1980 CB ARG A 133 5.603 18.402 -5.997 1.00 0.00 C ATOM 1981 CG ARG A 133 5.981 19.874 -6.251 1.00 0.00 C ATOM 1982 CD ARG A 133 6.153 20.700 -4.967 1.00 0.00 C ATOM 1983 NE ARG A 133 4.901 21.340 -4.542 1.00 0.00 N ATOM 1984 CZ ARG A 133 4.378 22.465 -5.051 1.00 0.00 C ATOM 1985 NH1 ARG A 133 4.939 23.090 -6.078 1.00 0.00 N ATOM 1986 NH2 ARG A 133 3.264 22.975 -4.557 1.00 0.00 N ATOM 0 H ARG A 133 5.329 15.882 -7.827 1.00 0.00 H new ATOM 0 HA ARG A 133 6.311 17.877 -7.930 1.00 0.00 H new ATOM 0 HB2 ARG A 133 4.533 18.267 -6.153 1.00 0.00 H new ATOM 0 HB3 ARG A 133 5.808 18.146 -4.957 1.00 0.00 H new ATOM 0 HG2 ARG A 133 6.910 19.908 -6.821 1.00 0.00 H new ATOM 0 HG3 ARG A 133 5.211 20.336 -6.869 1.00 0.00 H new ATOM 0 HD2 ARG A 133 6.517 20.054 -4.168 1.00 0.00 H new ATOM 0 HD3 ARG A 133 6.912 21.465 -5.129 1.00 0.00 H new ATOM 0 HE ARG A 133 4.381 20.887 -3.790 1.00 0.00 H new ATOM 0 HH11 ARG A 133 5.789 22.716 -6.500 1.00 0.00 H new ATOM 0 HH12 ARG A 133 4.520 23.944 -6.446 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.792 22.513 -3.780 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.876 23.831 -4.953 1.00 0.00 H new ATOM 2000 N SER A 134 8.605 16.386 -7.146 1.00 0.00 N ATOM 2001 CA SER A 134 9.994 16.064 -6.804 1.00 0.00 C ATOM 2002 C SER A 134 10.176 15.531 -5.375 1.00 0.00 C ATOM 2003 O SER A 134 11.282 15.100 -5.052 1.00 0.00 O ATOM 2004 CB SER A 134 10.948 17.239 -7.073 1.00 0.00 C ATOM 2005 OG SER A 134 10.792 17.748 -8.389 1.00 0.00 O ATOM 0 H SER A 134 8.224 15.774 -7.867 1.00 0.00 H new ATOM 0 HA SER A 134 10.261 15.247 -7.474 1.00 0.00 H new ATOM 0 HB2 SER A 134 10.761 18.033 -6.350 1.00 0.00 H new ATOM 0 HB3 SER A 134 11.978 16.913 -6.928 1.00 0.00 H new ATOM 0 HG SER A 134 11.412 18.495 -8.527 1.00 0.00 H new ATOM 2011 N VAL A 135 9.128 15.459 -4.546 1.00 0.00 N ATOM 2012 CA VAL A 135 9.287 15.116 -3.146 1.00 0.00 C ATOM 2013 C VAL A 135 9.394 13.600 -3.100 1.00 0.00 C ATOM 2014 O VAL A 135 8.582 12.878 -3.685 1.00 0.00 O ATOM 2015 CB VAL A 135 8.113 15.626 -2.283 1.00 0.00 C ATOM 2016 CG1 VAL A 135 8.430 15.463 -0.788 1.00 0.00 C ATOM 2017 CG2 VAL A 135 7.777 17.113 -2.490 1.00 0.00 C ATOM 0 H VAL A 135 8.164 15.635 -4.830 1.00 0.00 H new ATOM 0 HA VAL A 135 10.174 15.593 -2.729 1.00 0.00 H new ATOM 0 HB VAL A 135 7.262 15.023 -2.600 1.00 0.00 H new ATOM 0 HG11 VAL A 135 7.591 15.828 -0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 135 8.600 14.410 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL A 135 9.324 16.035 -0.541 1.00 0.00 H new ATOM 0 HG21 VAL A 135 6.942 17.390 -1.847 1.00 0.00 H new ATOM 0 HG22 VAL A 135 8.646 17.721 -2.238 1.00 0.00 H new ATOM 0 HG23 VAL A 135 7.505 17.283 -3.532 1.00 0.00 H new ATOM 2027 N ASP A 136 10.438 13.139 -2.428 1.00 0.00 N ATOM 2028 CA ASP A 136 10.691 11.773 -2.050 1.00 0.00 C ATOM 2029 C ASP A 136 9.667 11.400 -0.994 1.00 0.00 C ATOM 2030 O ASP A 136 9.737 11.883 0.131 1.00 0.00 O ATOM 2031 CB ASP A 136 12.126 11.669 -1.515 1.00 0.00 C ATOM 2032 CG ASP A 136 12.494 12.686 -0.421 1.00 0.00 C ATOM 2033 OD1 ASP A 136 12.524 13.914 -0.713 1.00 0.00 O ATOM 2034 OD2 ASP A 136 12.824 12.242 0.697 1.00 0.00 O ATOM 0 H ASP A 136 11.181 13.763 -2.113 1.00 0.00 H new ATOM 0 HA ASP A 136 10.600 11.088 -2.893 1.00 0.00 H new ATOM 0 HB2 ASP A 136 12.277 10.664 -1.120 1.00 0.00 H new ATOM 0 HB3 ASP A 136 12.817 11.791 -2.349 1.00 0.00 H new ATOM 2039 N VAL A 137 8.673 10.596 -1.368 1.00 0.00 N ATOM 2040 CA VAL A 137 7.649 10.118 -0.451 1.00 0.00 C ATOM 2041 C VAL A 137 7.433 8.643 -0.796 1.00 0.00 C ATOM 2042 O VAL A 137 6.761 8.325 -1.779 1.00 0.00 O ATOM 2043 CB VAL A 137 6.363 10.985 -0.536 1.00 0.00 C ATOM 2044 CG1 VAL A 137 5.431 10.679 0.644 1.00 0.00 C ATOM 2045 CG2 VAL A 137 6.629 12.498 -0.500 1.00 0.00 C ATOM 0 H VAL A 137 8.558 10.258 -2.323 1.00 0.00 H new ATOM 0 HA VAL A 137 7.953 10.207 0.592 1.00 0.00 H new ATOM 0 HB VAL A 137 5.917 10.728 -1.497 1.00 0.00 H new ATOM 0 HG11 VAL A 137 4.535 11.295 0.569 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.150 9.626 0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.945 10.898 1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 137 5.683 13.035 -0.564 1.00 0.00 H new ATOM 0 HG22 VAL A 137 7.131 12.757 0.432 1.00 0.00 H new ATOM 0 HG23 VAL A 137 7.262 12.776 -1.343 1.00 0.00 H new ATOM 2055 N GLY A 138 7.995 7.724 -0.013 1.00 0.00 N ATOM 2056 CA GLY A 138 7.733 6.293 -0.107 1.00 0.00 C ATOM 2057 C GLY A 138 7.322 5.779 1.264 1.00 0.00 C ATOM 2058 O GLY A 138 7.786 6.315 2.267 1.00 0.00 O ATOM 0 H GLY A 138 8.661 7.962 0.722 1.00 0.00 H new ATOM 0 HA2 GLY A 138 6.944 6.101 -0.834 1.00 0.00 H new ATOM 0 HA3 GLY A 138 8.623 5.769 -0.456 1.00 0.00 H new ATOM 2062 N THR A 139 6.467 4.761 1.308 1.00 0.00 N ATOM 2063 CA THR A 139 5.985 4.120 2.531 1.00 0.00 C ATOM 2064 C THR A 139 6.657 2.753 2.644 1.00 0.00 C ATOM 2065 O THR A 139 6.798 2.064 1.628 1.00 0.00 O ATOM 2066 CB THR A 139 4.453 3.948 2.488 1.00 0.00 C ATOM 2067 OG1 THR A 139 4.021 3.545 1.197 1.00 0.00 O ATOM 2068 CG2 THR A 139 3.673 5.213 2.835 1.00 0.00 C ATOM 0 H THR A 139 6.076 4.344 0.463 1.00 0.00 H new ATOM 0 HA THR A 139 6.229 4.740 3.393 1.00 0.00 H new ATOM 0 HB THR A 139 4.247 3.190 3.243 1.00 0.00 H new ATOM 0 HG1 THR A 139 3.047 3.441 1.196 1.00 0.00 H new ATOM 0 HG21 THR A 139 2.604 5.007 2.782 1.00 0.00 H new ATOM 0 HG22 THR A 139 3.931 5.534 3.844 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.926 6.002 2.127 1.00 0.00 H new ATOM 2076 N TRP A 140 7.010 2.328 3.860 1.00 0.00 N ATOM 2077 CA TRP A 140 7.688 1.048 4.066 1.00 0.00 C ATOM 2078 C TRP A 140 6.606 -0.027 4.279 1.00 0.00 C ATOM 2079 O TRP A 140 5.899 0.054 5.283 1.00 0.00 O ATOM 2080 CB TRP A 140 8.683 1.210 5.241 1.00 0.00 C ATOM 2081 CG TRP A 140 9.242 2.606 5.436 1.00 0.00 C ATOM 2082 CD1 TRP A 140 8.994 3.430 6.480 1.00 0.00 C ATOM 2083 CD2 TRP A 140 10.132 3.372 4.566 1.00 0.00 C ATOM 2084 NE1 TRP A 140 9.582 4.661 6.273 1.00 0.00 N ATOM 2085 CE2 TRP A 140 10.293 4.685 5.099 1.00 0.00 C ATOM 2086 CE3 TRP A 140 10.844 3.081 3.389 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 11.065 5.671 4.465 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 11.678 4.035 2.780 1.00 0.00 C ATOM 2089 CH2 TRP A 140 11.763 5.342 3.292 1.00 0.00 C ATOM 0 H TRP A 140 6.837 2.853 4.717 1.00 0.00 H new ATOM 0 HA TRP A 140 8.281 0.729 3.209 1.00 0.00 H new ATOM 0 HB2 TRP A 140 8.184 0.906 6.161 1.00 0.00 H new ATOM 0 HB3 TRP A 140 9.515 0.523 5.087 1.00 0.00 H new ATOM 0 HD1 TRP A 140 8.417 3.162 7.353 1.00 0.00 H new ATOM 0 HE1 TRP A 140 9.499 5.452 6.911 1.00 0.00 H new ATOM 0 HE3 TRP A 140 10.748 2.102 2.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 11.121 6.669 4.874 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 12.259 3.762 1.911 1.00 0.00 H new ATOM 0 HH2 TRP A 140 12.360 6.087 2.787 1.00 0.00 H new ATOM 2100 N ILE A 141 6.380 -0.981 3.361 1.00 0.00 N ATOM 2101 CA ILE A 141 5.288 -1.955 3.506 1.00 0.00 C ATOM 2102 C ILE A 141 5.929 -3.261 3.973 1.00 0.00 C ATOM 2103 O ILE A 141 6.641 -3.931 3.218 1.00 0.00 O ATOM 2104 CB ILE A 141 4.435 -2.108 2.218 1.00 0.00 C ATOM 2105 CG1 ILE A 141 3.466 -0.937 1.944 1.00 0.00 C ATOM 2106 CG2 ILE A 141 3.518 -3.347 2.300 1.00 0.00 C ATOM 2107 CD1 ILE A 141 4.135 0.373 1.551 1.00 0.00 C ATOM 0 H ILE A 141 6.937 -1.098 2.514 1.00 0.00 H new ATOM 0 HA ILE A 141 4.563 -1.611 4.243 1.00 0.00 H new ATOM 0 HB ILE A 141 5.186 -2.168 1.430 1.00 0.00 H new ATOM 0 HG12 ILE A 141 2.781 -1.231 1.149 1.00 0.00 H new ATOM 0 HG13 ILE A 141 2.864 -0.767 2.837 1.00 0.00 H new ATOM 0 HG21 ILE A 141 2.933 -3.428 1.384 1.00 0.00 H new ATOM 0 HG22 ILE A 141 4.127 -4.243 2.422 1.00 0.00 H new ATOM 0 HG23 ILE A 141 2.846 -3.246 3.152 1.00 0.00 H new ATOM 0 HD11 ILE A 141 3.373 1.133 1.380 1.00 0.00 H new ATOM 0 HD12 ILE A 141 4.798 0.698 2.353 1.00 0.00 H new ATOM 0 HD13 ILE A 141 4.713 0.227 0.639 1.00 0.00 H new ATOM 2119 N ALA A 142 5.635 -3.631 5.216 1.00 0.00 N ATOM 2120 CA ALA A 142 6.042 -4.882 5.827 1.00 0.00 C ATOM 2121 C ALA A 142 4.993 -5.955 5.558 1.00 0.00 C ATOM 2122 O ALA A 142 3.911 -5.666 5.041 1.00 0.00 O ATOM 2123 CB ALA A 142 6.190 -4.675 7.330 1.00 0.00 C ATOM 0 H ALA A 142 5.087 -3.043 5.844 1.00 0.00 H new ATOM 0 HA ALA A 142 6.993 -5.203 5.403 1.00 0.00 H new ATOM 0 HB1 ALA A 142 6.496 -5.611 7.798 1.00 0.00 H new ATOM 0 HB2 ALA A 142 6.944 -3.911 7.520 1.00 0.00 H new ATOM 0 HB3 ALA A 142 5.236 -4.355 7.749 1.00 0.00 H new ATOM 2129 N GLY A 143 5.314 -7.200 5.894 1.00 0.00 N ATOM 2130 CA GLY A 143 4.326 -8.245 6.043 1.00 0.00 C ATOM 2131 C GLY A 143 4.529 -8.976 7.363 1.00 0.00 C ATOM 2132 O GLY A 143 5.651 -9.387 7.659 1.00 0.00 O ATOM 0 H GLY A 143 6.271 -7.506 6.070 1.00 0.00 H new ATOM 0 HA2 GLY A 143 3.324 -7.816 6.007 1.00 0.00 H new ATOM 0 HA3 GLY A 143 4.402 -8.948 5.214 1.00 0.00 H new ATOM 2136 N VAL A 144 3.444 -9.131 8.119 1.00 0.00 N ATOM 2137 CA VAL A 144 3.168 -10.129 9.157 1.00 0.00 C ATOM 2138 C VAL A 144 1.652 -10.424 9.089 1.00 0.00 C ATOM 2139 O VAL A 144 0.953 -9.700 8.382 1.00 0.00 O ATOM 2140 CB VAL A 144 3.656 -9.661 10.548 1.00 0.00 C ATOM 2141 CG1 VAL A 144 5.093 -10.118 10.834 1.00 0.00 C ATOM 2142 CG2 VAL A 144 3.560 -8.143 10.777 1.00 0.00 C ATOM 0 H VAL A 144 2.653 -8.496 8.010 1.00 0.00 H new ATOM 0 HA VAL A 144 3.723 -11.051 8.985 1.00 0.00 H new ATOM 0 HB VAL A 144 2.967 -10.138 11.245 1.00 0.00 H new ATOM 0 HG11 VAL A 144 5.396 -9.768 11.821 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.141 -11.207 10.804 1.00 0.00 H new ATOM 0 HG13 VAL A 144 5.763 -9.704 10.081 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.922 -7.902 11.776 1.00 0.00 H new ATOM 0 HG22 VAL A 144 4.168 -7.624 10.036 1.00 0.00 H new ATOM 0 HG23 VAL A 144 2.522 -7.826 10.681 1.00 0.00 H new ATOM 2152 N GLY A 145 1.104 -11.470 9.732 1.00 0.00 N ATOM 2153 CA GLY A 145 -0.333 -11.751 9.579 1.00 0.00 C ATOM 2154 C GLY A 145 -0.824 -13.059 10.190 1.00 0.00 C ATOM 2155 O GLY A 145 -1.069 -13.094 11.396 1.00 0.00 O ATOM 0 H GLY A 145 1.612 -12.113 10.340 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.894 -10.930 10.026 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.571 -11.757 8.515 1.00 0.00 H new ATOM 2159 N TYR A 146 -1.062 -14.101 9.379 1.00 0.00 N ATOM 2160 CA TYR A 146 -1.417 -15.459 9.819 1.00 0.00 C ATOM 2161 C TYR A 146 -1.223 -16.458 8.664 1.00 0.00 C ATOM 2162 O TYR A 146 -0.981 -16.046 7.527 1.00 0.00 O ATOM 2163 CB TYR A 146 -2.875 -15.508 10.323 1.00 0.00 C ATOM 2164 CG TYR A 146 -3.079 -16.422 11.505 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -2.615 -16.031 12.774 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -3.734 -17.658 11.341 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -2.814 -16.866 13.882 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -3.886 -18.522 12.436 1.00 0.00 C ATOM 2169 CZ TYR A 146 -3.424 -18.128 13.709 1.00 0.00 C ATOM 2170 OH TYR A 146 -3.564 -18.978 14.756 1.00 0.00 O ATOM 0 H TYR A 146 -1.011 -14.018 8.364 1.00 0.00 H new ATOM 0 HA TYR A 146 -0.759 -15.735 10.643 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -3.190 -14.501 10.596 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -3.521 -15.834 9.508 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -2.105 -15.087 12.895 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -4.119 -17.941 10.372 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -2.502 -16.545 14.865 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -4.355 -19.486 12.304 1.00 0.00 H new ATOM 0 HH TYR A 146 -4.006 -19.799 14.454 1.00 0.00 H new ATOM 2180 N ARG A 147 -1.395 -17.766 8.896 1.00 0.00 N ATOM 2181 CA ARG A 147 -1.577 -18.753 7.819 1.00 0.00 C ATOM 2182 C ARG A 147 -2.645 -19.751 8.239 1.00 0.00 C ATOM 2183 O ARG A 147 -2.820 -19.983 9.437 1.00 0.00 O ATOM 2184 CB ARG A 147 -0.279 -19.532 7.527 1.00 0.00 C ATOM 2185 CG ARG A 147 -0.173 -20.028 6.078 1.00 0.00 C ATOM 2186 CD ARG A 147 0.433 -21.434 6.007 1.00 0.00 C ATOM 2187 NE ARG A 147 -0.619 -22.436 6.212 1.00 0.00 N ATOM 2188 CZ ARG A 147 -0.564 -23.604 6.855 1.00 0.00 C ATOM 2189 NH1 ARG A 147 0.543 -24.028 7.442 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -1.643 -24.364 6.887 1.00 0.00 N ATOM 0 H ARG A 147 -1.412 -18.171 9.832 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.867 -18.212 6.918 1.00 0.00 H new ATOM 0 HB2 ARG A 147 0.576 -18.893 7.747 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -0.219 -20.387 8.200 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -1.163 -20.034 5.621 1.00 0.00 H new ATOM 0 HG3 ARG A 147 0.440 -19.337 5.500 1.00 0.00 H new ATOM 0 HD2 ARG A 147 0.910 -21.586 5.039 1.00 0.00 H new ATOM 0 HD3 ARG A 147 1.208 -21.545 6.766 1.00 0.00 H new ATOM 0 HE ARG A 147 -1.525 -22.206 5.803 1.00 0.00 H new ATOM 0 HH11 ARG A 147 1.388 -23.457 7.411 1.00 0.00 H new ATOM 0 HH12 ARG A 147 0.552 -24.926 7.926 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -2.498 -24.055 6.425 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -1.621 -25.260 7.373 1.00 0.00 H new ATOM 2204 N PHE A 148 -3.296 -20.395 7.276 1.00 0.00 N ATOM 2205 CA PHE A 148 -4.022 -21.632 7.488 1.00 0.00 C ATOM 2206 C PHE A 148 -3.943 -22.431 6.197 1.00 0.00 C ATOM 2207 O PHE A 148 -4.408 -23.581 6.147 1.00 0.00 O ATOM 2208 CB PHE A 148 -5.441 -21.387 8.031 1.00 0.00 C ATOM 2209 CG PHE A 148 -6.357 -20.440 7.282 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -6.171 -19.043 7.361 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -7.473 -20.951 6.594 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -7.086 -18.175 6.738 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -8.371 -20.083 5.954 1.00 0.00 C ATOM 2214 CZ PHE A 148 -8.174 -18.694 6.020 1.00 0.00 C ATOM 0 H PHE A 148 -3.332 -20.063 6.312 1.00 0.00 H new ATOM 0 HA PHE A 148 -3.568 -22.230 8.278 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -5.943 -22.353 8.091 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -5.344 -21.015 9.051 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -5.326 -18.640 7.900 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -7.639 -22.017 6.558 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -6.951 -17.106 6.813 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -9.214 -20.483 5.410 1.00 0.00 H new ATOM 0 HZ PHE A 148 -8.859 -18.026 5.519 1.00 0.00 H new TER 2224 PHE A 148