USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1329 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 21 GLN : amide:sc= -7.38! C(o=-14!,f=-23!) USER MOD Set 1.2: A 106 ASN :FLIP amide:sc= -6.29! C(o=-22!,f=-14!) USER MOD Set 2.1: A 31 LYS NZ :NH3+ 148:sc= -0.0383 (180deg=-0.515) USER MOD Set 2.2: A 41 LYS NZ :NH3+ -178:sc= -0.013 (180deg=-0.0163) USER MOD Set 3.1: A 22 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= -1.25 USER MOD Single : A 4 HIS :FLIP no HD1:sc= -3.7! C(o=-5.4!,f=-3.7!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.236 K(o=-0.24,f=-2.4!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HE2:sc= -9.18! C(o=-9.2!,f=-9.2!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot -100:sc= 0.983 USER MOD Single : A 34 SER OG : rot 180:sc= -1.26 USER MOD Single : A 36 ASN : amide:sc= -0.0867 X(o=-0.087,f=-0.45) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot -44:sc= -1.91! USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0.00348 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 38:sc= 0.00233 USER MOD Single : A 63 HIS :FLIP no HE2:sc= 0.101 F(o=-0.54,f=0.1) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot -30:sc= -1.23! USER MOD Single : A 69 MET CE :methyl 178:sc= 0 (180deg=-0.00218) USER MOD Single : A 72 THR OG1 : rot -160:sc= 0 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc=-0.000734 USER MOD Single : A 80 LYS NZ :NH3+ 167:sc= 0.716 (180deg=0.604) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 HIS :FLIP no HE2:sc= -1.01 F(o=-1.7!,f=-1) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 178:sc= -2.31! USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -116:sc= -2.75! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= -4.22! C(o=-4.2!,f=-5.5!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 62:sc= -4.91! USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -132:sc= 0.83 (180deg=-0.355) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 HIS : no HE2:sc= -7.66! C(o=-7.7!,f=-8.7!) USER MOD Single : A 127 HIS : no HD1:sc= -0.0826 X(o=-0.083,f=-0.36) USER MOD Single : A 132 SER OG : rot -86:sc= 0.0559 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 170:sc= 0.00237 (180deg=0.000734) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.202 K(o=-0.2,f=-1) USER MOD Single : A 148 TYR OH : rot 70:sc= -1.22 USER MOD Single : A 152 SER OG : rot -98:sc= 0.887 USER MOD Single : A 157 SER OG : rot 180:sc= -0.0765 USER MOD Single : A 158 GLN : amide:sc= -0.06 K(o=-0.06,f=-1.5) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot -160:sc= -0.522 USER MOD Single : A 166 SER OG : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 2 -13.862 11.618 2.996 1.00 0.00 N ATOM 15 CA VAL A 2 -13.725 10.396 3.771 1.00 0.00 C ATOM 16 C VAL A 2 -13.363 10.751 5.214 1.00 0.00 C ATOM 17 O VAL A 2 -12.191 10.934 5.537 1.00 0.00 O ATOM 18 CB VAL A 2 -12.704 9.469 3.109 1.00 0.00 C ATOM 19 CG1 VAL A 2 -13.343 8.676 1.967 1.00 0.00 C ATOM 20 CG2 VAL A 2 -11.487 10.255 2.618 1.00 0.00 C ATOM 0 HA VAL A 2 -14.669 9.852 3.797 1.00 0.00 H new ATOM 0 HB VAL A 2 -12.361 8.757 3.860 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -12.596 8.025 1.513 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -14.162 8.072 2.357 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -13.727 9.366 1.216 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -10.777 9.572 2.152 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -11.805 11.001 1.890 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -11.010 10.753 3.463 1.00 0.00 H new ATOM 30 N TYR A 3 -14.393 10.838 6.044 1.00 0.00 N ATOM 31 CA TYR A 3 -14.198 11.168 7.446 1.00 0.00 C ATOM 32 C TYR A 3 -14.605 9.999 8.346 1.00 0.00 C ATOM 33 O TYR A 3 -15.567 9.291 8.053 1.00 0.00 O ATOM 34 CB TYR A 3 -15.115 12.359 7.731 1.00 0.00 C ATOM 35 CG TYR A 3 -14.765 13.121 9.010 1.00 0.00 C ATOM 36 CD1 TYR A 3 -13.586 13.834 9.088 1.00 0.00 C ATOM 37 CD2 TYR A 3 -15.630 13.097 10.086 1.00 0.00 C ATOM 38 CE1 TYR A 3 -13.257 14.552 10.292 1.00 0.00 C ATOM 39 CE2 TYR A 3 -15.301 13.815 11.290 1.00 0.00 C ATOM 40 CZ TYR A 3 -14.131 14.507 11.334 1.00 0.00 C ATOM 41 OH TYR A 3 -13.820 15.185 12.471 1.00 0.00 O ATOM 0 H TYR A 3 -15.364 10.686 5.773 1.00 0.00 H new ATOM 0 HA TYR A 3 -13.150 11.391 7.646 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -15.072 13.047 6.887 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -16.143 12.004 7.801 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -12.910 13.853 8.246 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -16.553 12.540 10.025 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -12.337 15.113 10.366 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -15.968 13.804 12.139 1.00 0.00 H new ATOM 0 HH TYR A 3 -14.535 15.064 13.130 1.00 0.00 H new ATOM 51 N HIS A 4 -13.852 9.833 9.423 1.00 0.00 N ATOM 52 CA HIS A 4 -14.123 8.763 10.368 1.00 0.00 C ATOM 53 C HIS A 4 -13.618 9.163 11.756 1.00 0.00 C ATOM 54 O HIS A 4 -12.826 10.095 11.887 1.00 0.00 O ATOM 55 CB HIS A 4 -13.525 7.442 9.878 1.00 0.00 C ATOM 56 CG HIS A 4 -13.954 7.055 8.483 1.00 0.00 C ATOM 57 ND1 HIS A 4 -13.634 7.592 7.271 1.00 0.00 N flip ATOM 58 CD2 HIS A 4 -14.813 6.000 8.228 1.00 0.00 C flip ATOM 59 CE1 HIS A 4 -14.262 6.902 6.327 1.00 0.00 C flip ATOM 60 NE2 HIS A 4 -14.994 5.915 6.918 1.00 0.00 N flip ATOM 0 H HIS A 4 -13.054 10.422 9.662 1.00 0.00 H new ATOM 0 HA HIS A 4 -15.199 8.603 10.443 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -12.438 7.514 9.906 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -13.809 6.648 10.568 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -15.260 5.356 8.971 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -14.203 7.091 5.265 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -15.578 5.231 6.436 1.00 0.00 H new ATOM 68 N ASP A 5 -14.097 8.438 12.756 1.00 0.00 N ATOM 69 CA ASP A 5 -13.704 8.706 14.129 1.00 0.00 C ATOM 70 C ASP A 5 -12.954 7.495 14.686 1.00 0.00 C ATOM 71 O ASP A 5 -13.335 6.353 14.431 1.00 0.00 O ATOM 72 CB ASP A 5 -14.928 8.952 15.014 1.00 0.00 C ATOM 73 CG ASP A 5 -14.653 9.748 16.291 1.00 0.00 C ATOM 74 OD1 ASP A 5 -14.933 10.966 16.272 1.00 0.00 O ATOM 75 OD2 ASP A 5 -14.169 9.120 17.258 1.00 0.00 O ATOM 0 H ASP A 5 -14.753 7.666 12.643 1.00 0.00 H new ATOM 0 HA ASP A 5 -13.072 9.594 14.132 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -15.680 9.481 14.429 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -15.358 7.989 15.290 1.00 0.00 H new ATOM 81 N GLY A 6 -11.901 7.784 15.436 1.00 0.00 N ATOM 82 CA GLY A 6 -11.094 6.733 16.031 1.00 0.00 C ATOM 83 C GLY A 6 -10.198 6.070 14.983 1.00 0.00 C ATOM 84 O GLY A 6 -9.590 6.752 14.159 1.00 0.00 O ATOM 0 H GLY A 6 -11.588 8.732 15.645 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -10.479 7.149 16.829 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -11.743 5.985 16.486 1.00 0.00 H new ATOM 88 N ALA A 7 -10.145 4.747 15.047 1.00 0.00 N ATOM 89 CA ALA A 7 -9.334 3.985 14.114 1.00 0.00 C ATOM 90 C ALA A 7 -10.200 3.551 12.929 1.00 0.00 C ATOM 91 O ALA A 7 -11.390 3.855 12.881 1.00 0.00 O ATOM 92 CB ALA A 7 -8.702 2.796 14.840 1.00 0.00 C ATOM 0 H ALA A 7 -10.651 4.184 15.731 1.00 0.00 H new ATOM 0 HA ALA A 7 -8.522 4.597 13.722 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.093 2.224 14.140 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -8.075 3.159 15.654 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.487 2.157 15.244 1.00 0.00 H new ATOM 98 N CYS A 8 -9.567 2.846 12.002 1.00 0.00 N ATOM 99 CA CYS A 8 -10.265 2.368 10.820 1.00 0.00 C ATOM 100 C CYS A 8 -11.602 1.769 11.261 1.00 0.00 C ATOM 101 O CYS A 8 -11.732 1.294 12.389 1.00 0.00 O ATOM 102 CB CYS A 8 -9.421 1.362 10.034 1.00 0.00 C ATOM 103 SG CYS A 8 -8.077 2.102 9.036 1.00 0.00 S ATOM 0 H CYS A 8 -8.579 2.595 12.045 1.00 0.00 H new ATOM 0 HA CYS A 8 -10.447 3.200 10.140 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -8.985 0.650 10.734 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -10.077 0.797 9.372 1.00 0.00 H new ATOM 109 N PRO A 9 -12.587 1.812 10.325 1.00 0.00 N ATOM 110 CA PRO A 9 -13.910 1.279 10.606 1.00 0.00 C ATOM 111 C PRO A 9 -13.902 -0.251 10.578 1.00 0.00 C ATOM 112 O PRO A 9 -12.839 -0.870 10.585 1.00 0.00 O ATOM 113 CB PRO A 9 -14.812 1.888 9.546 1.00 0.00 C ATOM 114 CG PRO A 9 -13.889 2.366 8.437 1.00 0.00 C ATOM 115 CD PRO A 9 -12.470 2.366 8.980 1.00 0.00 C ATOM 0 HA PRO A 9 -14.263 1.534 11.605 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -15.525 1.154 9.171 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -15.392 2.715 9.955 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.965 1.712 7.568 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -14.172 3.366 8.109 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -11.809 1.762 8.359 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.054 3.373 9.002 1.00 0.00 H new ATOM 123 N GLU A 10 -15.100 -0.816 10.548 1.00 0.00 N ATOM 124 CA GLU A 10 -15.245 -2.261 10.519 1.00 0.00 C ATOM 125 C GLU A 10 -14.707 -2.822 9.200 1.00 0.00 C ATOM 126 O GLU A 10 -15.214 -2.493 8.129 1.00 0.00 O ATOM 127 CB GLU A 10 -16.703 -2.671 10.735 1.00 0.00 C ATOM 128 CG GLU A 10 -16.967 -3.002 12.205 1.00 0.00 C ATOM 129 CD GLU A 10 -18.465 -2.956 12.517 1.00 0.00 C ATOM 130 OE1 GLU A 10 -19.080 -4.044 12.510 1.00 0.00 O ATOM 131 OE2 GLU A 10 -18.960 -1.833 12.754 1.00 0.00 O ATOM 0 H GLU A 10 -15.979 -0.299 10.543 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.659 -2.682 11.336 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -17.363 -1.864 10.416 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -16.937 -3.537 10.116 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.574 -3.993 12.435 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -16.437 -2.294 12.842 1.00 0.00 H new ATOM 139 N VAL A 11 -13.689 -3.661 9.322 1.00 0.00 N ATOM 140 CA VAL A 11 -13.077 -4.270 8.154 1.00 0.00 C ATOM 141 C VAL A 11 -12.188 -5.434 8.598 1.00 0.00 C ATOM 142 O VAL A 11 -11.141 -5.223 9.208 1.00 0.00 O ATOM 143 CB VAL A 11 -12.319 -3.213 7.348 1.00 0.00 C ATOM 144 CG1 VAL A 11 -13.268 -2.437 6.433 1.00 0.00 C ATOM 145 CG2 VAL A 11 -11.551 -2.266 8.272 1.00 0.00 C ATOM 0 H VAL A 11 -13.273 -3.933 10.212 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.841 -4.678 7.492 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.593 -3.728 6.718 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.704 -1.692 5.871 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.749 -3.126 5.739 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.028 -1.939 7.035 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.021 -1.525 7.674 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.250 -1.762 8.939 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.834 -2.836 8.862 1.00 0.00 H new ATOM 155 N LYS A 12 -12.639 -6.637 8.274 1.00 0.00 N ATOM 156 CA LYS A 12 -11.898 -7.835 8.631 1.00 0.00 C ATOM 157 C LYS A 12 -10.712 -7.999 7.679 1.00 0.00 C ATOM 158 O LYS A 12 -10.896 -8.257 6.490 1.00 0.00 O ATOM 159 CB LYS A 12 -12.828 -9.049 8.670 1.00 0.00 C ATOM 160 CG LYS A 12 -12.250 -10.155 9.556 1.00 0.00 C ATOM 161 CD LYS A 12 -12.766 -11.529 9.124 1.00 0.00 C ATOM 162 CE LYS A 12 -12.902 -12.466 10.326 1.00 0.00 C ATOM 163 NZ LYS A 12 -14.312 -12.878 10.505 1.00 0.00 N ATOM 0 H LYS A 12 -13.508 -6.808 7.768 1.00 0.00 H new ATOM 0 HA LYS A 12 -11.489 -7.744 9.637 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -13.806 -8.750 9.047 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.978 -9.429 7.659 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.161 -10.138 9.502 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -12.520 -9.971 10.596 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.732 -11.420 8.632 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -12.084 -11.965 8.394 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -12.275 -13.346 10.181 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -12.546 -11.966 11.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -14.387 -13.514 11.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.902 -12.037 10.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -14.640 -13.374 9.652 1.00 0.00 H new ATOM 177 N PRO A 13 -9.488 -7.838 8.251 1.00 0.00 N ATOM 178 CA PRO A 13 -8.272 -7.966 7.466 1.00 0.00 C ATOM 179 C PRO A 13 -7.972 -9.433 7.154 1.00 0.00 C ATOM 180 O PRO A 13 -8.734 -10.321 7.535 1.00 0.00 O ATOM 181 CB PRO A 13 -7.191 -7.304 8.305 1.00 0.00 C ATOM 182 CG PRO A 13 -7.741 -7.245 9.721 1.00 0.00 C ATOM 183 CD PRO A 13 -9.232 -7.533 9.655 1.00 0.00 C ATOM 0 HA PRO A 13 -8.349 -7.487 6.490 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -6.264 -7.876 8.270 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.964 -6.305 7.932 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.239 -7.975 10.356 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -7.561 -6.264 10.160 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.502 -8.371 10.298 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -9.816 -6.675 9.987 1.00 0.00 H new ATOM 191 N VAL A 14 -6.861 -9.643 6.464 1.00 0.00 N ATOM 192 CA VAL A 14 -6.451 -10.988 6.097 1.00 0.00 C ATOM 193 C VAL A 14 -6.376 -11.855 7.355 1.00 0.00 C ATOM 194 O VAL A 14 -5.801 -11.446 8.362 1.00 0.00 O ATOM 195 CB VAL A 14 -5.131 -10.940 5.324 1.00 0.00 C ATOM 196 CG1 VAL A 14 -5.312 -10.248 3.971 1.00 0.00 C ATOM 197 CG2 VAL A 14 -4.038 -10.255 6.148 1.00 0.00 C ATOM 0 H VAL A 14 -6.232 -8.904 6.149 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.185 -11.443 5.432 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.816 -11.966 5.136 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.359 -10.227 3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.044 -10.795 3.378 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -5.662 -9.228 4.128 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.110 -10.234 5.576 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.344 -9.235 6.381 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.881 -10.807 7.074 1.00 0.00 H new ATOM 207 N ASP A 15 -6.965 -13.038 7.255 1.00 0.00 N ATOM 208 CA ASP A 15 -6.972 -13.967 8.373 1.00 0.00 C ATOM 209 C ASP A 15 -5.543 -14.439 8.647 1.00 0.00 C ATOM 210 O ASP A 15 -5.126 -14.531 9.801 1.00 0.00 O ATOM 211 CB ASP A 15 -7.825 -15.198 8.061 1.00 0.00 C ATOM 212 CG ASP A 15 -7.757 -15.681 6.611 1.00 0.00 C ATOM 213 OD1 ASP A 15 -8.518 -15.123 5.790 1.00 0.00 O ATOM 214 OD2 ASP A 15 -6.946 -16.597 6.355 1.00 0.00 O ATOM 0 H ASP A 15 -7.440 -13.374 6.418 1.00 0.00 H new ATOM 0 HA ASP A 15 -7.388 -13.450 9.238 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -7.513 -16.013 8.715 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -8.863 -14.973 8.305 1.00 0.00 H new ATOM 220 N ASN A 16 -4.831 -14.725 7.567 1.00 0.00 N ATOM 221 CA ASN A 16 -3.457 -15.186 7.677 1.00 0.00 C ATOM 222 C ASN A 16 -2.721 -14.896 6.367 1.00 0.00 C ATOM 223 O ASN A 16 -2.597 -15.772 5.513 1.00 0.00 O ATOM 224 CB ASN A 16 -3.400 -16.694 7.926 1.00 0.00 C ATOM 225 CG ASN A 16 -1.974 -17.143 8.248 1.00 0.00 C ATOM 226 OD1 ASN A 16 -1.023 -16.383 8.169 1.00 0.00 O ATOM 227 ND2 ASN A 16 -1.877 -18.419 8.613 1.00 0.00 N ATOM 0 H ASN A 16 -5.179 -14.647 6.612 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.992 -14.664 8.514 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.062 -16.955 8.751 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -3.762 -17.225 7.046 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -0.966 -18.815 8.847 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -2.713 -19.001 8.659 1.00 0.00 H new ATOM 234 N PHE A 17 -2.250 -13.662 6.251 1.00 0.00 N ATOM 235 CA PHE A 17 -1.529 -13.245 5.061 1.00 0.00 C ATOM 236 C PHE A 17 -0.197 -13.989 4.938 1.00 0.00 C ATOM 237 O PHE A 17 0.404 -14.363 5.944 1.00 0.00 O ATOM 238 CB PHE A 17 -1.252 -11.748 5.207 1.00 0.00 C ATOM 239 CG PHE A 17 -1.458 -10.948 3.919 1.00 0.00 C ATOM 240 CD1 PHE A 17 -1.642 -11.597 2.738 1.00 0.00 C ATOM 241 CD2 PHE A 17 -1.458 -9.589 3.955 1.00 0.00 C ATOM 242 CE1 PHE A 17 -1.834 -10.855 1.543 1.00 0.00 C ATOM 243 CE2 PHE A 17 -1.649 -8.846 2.760 1.00 0.00 C ATOM 244 CZ PHE A 17 -1.833 -9.495 1.579 1.00 0.00 C ATOM 0 H PHE A 17 -2.354 -12.938 6.962 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.120 -13.464 4.172 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.902 -11.343 5.982 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.226 -11.610 5.548 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.642 -12.677 2.709 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -1.313 -9.074 4.893 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.981 -11.370 0.605 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -1.648 -7.766 2.789 1.00 0.00 H new ATOM 0 HZ PHE A 17 -1.978 -8.931 0.670 1.00 0.00 H new ATOM 254 N ASP A 18 0.225 -14.180 3.697 1.00 0.00 N ATOM 255 CA ASP A 18 1.474 -14.872 3.429 1.00 0.00 C ATOM 256 C ASP A 18 2.423 -13.932 2.684 1.00 0.00 C ATOM 257 O ASP A 18 2.012 -13.237 1.756 1.00 0.00 O ATOM 258 CB ASP A 18 1.244 -16.105 2.553 1.00 0.00 C ATOM 259 CG ASP A 18 1.546 -17.444 3.228 1.00 0.00 C ATOM 260 OD1 ASP A 18 1.802 -17.417 4.452 1.00 0.00 O ATOM 261 OD2 ASP A 18 1.514 -18.464 2.506 1.00 0.00 O ATOM 0 H ASP A 18 -0.276 -13.867 2.865 1.00 0.00 H new ATOM 0 HA ASP A 18 1.899 -15.183 4.383 1.00 0.00 H new ATOM 0 HB2 ASP A 18 0.205 -16.108 2.222 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.863 -16.018 1.660 1.00 0.00 H new ATOM 267 N TRP A 19 3.675 -13.940 3.118 1.00 0.00 N ATOM 268 CA TRP A 19 4.686 -13.097 2.503 1.00 0.00 C ATOM 269 C TRP A 19 5.104 -13.746 1.182 1.00 0.00 C ATOM 270 O TRP A 19 5.559 -13.062 0.267 1.00 0.00 O ATOM 271 CB TRP A 19 5.862 -12.868 3.455 1.00 0.00 C ATOM 272 CG TRP A 19 5.509 -12.040 4.692 1.00 0.00 C ATOM 273 CD1 TRP A 19 5.687 -12.365 5.980 1.00 0.00 C ATOM 274 CD2 TRP A 19 4.906 -10.729 4.706 1.00 0.00 C ATOM 275 NE1 TRP A 19 5.245 -11.363 6.820 1.00 0.00 N ATOM 276 CE2 TRP A 19 4.755 -10.336 6.020 1.00 0.00 C ATOM 277 CE3 TRP A 19 4.502 -9.902 3.643 1.00 0.00 C ATOM 278 CZ2 TRP A 19 4.198 -9.107 6.394 1.00 0.00 C ATOM 279 CZ3 TRP A 19 3.948 -8.677 4.034 1.00 0.00 C ATOM 280 CH2 TRP A 19 3.789 -8.267 5.352 1.00 0.00 C ATOM 0 H TRP A 19 4.012 -14.517 3.888 1.00 0.00 H new ATOM 0 HA TRP A 19 4.285 -12.106 2.292 1.00 0.00 H new ATOM 0 HB2 TRP A 19 6.250 -13.835 3.776 1.00 0.00 H new ATOM 0 HB3 TRP A 19 6.664 -12.367 2.912 1.00 0.00 H new ATOM 0 HD1 TRP A 19 6.122 -13.294 6.318 1.00 0.00 H new ATOM 0 HE1 TRP A 19 5.273 -11.374 7.840 1.00 0.00 H new ATOM 0 HE3 TRP A 19 4.610 -10.189 2.607 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 4.090 -8.823 7.430 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 3.621 -8.003 3.256 1.00 0.00 H new ATOM 0 HH2 TRP A 19 3.352 -7.304 5.571 1.00 0.00 H new ATOM 291 N SER A 20 4.934 -15.059 1.125 1.00 0.00 N ATOM 292 CA SER A 20 5.287 -15.808 -0.069 1.00 0.00 C ATOM 293 C SER A 20 4.496 -15.285 -1.269 1.00 0.00 C ATOM 294 O SER A 20 5.073 -14.743 -2.210 1.00 0.00 O ATOM 295 CB SER A 20 5.032 -17.304 0.124 1.00 0.00 C ATOM 296 OG SER A 20 6.114 -17.948 0.792 1.00 0.00 O ATOM 0 H SER A 20 4.557 -15.623 1.886 1.00 0.00 H new ATOM 0 HA SER A 20 6.352 -15.670 -0.257 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.116 -17.445 0.698 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.875 -17.773 -0.847 1.00 0.00 H new ATOM 0 HG SER A 20 5.912 -18.901 0.898 1.00 0.00 H new ATOM 302 N GLN A 21 3.185 -15.465 -1.197 1.00 0.00 N ATOM 303 CA GLN A 21 2.308 -15.018 -2.265 1.00 0.00 C ATOM 304 C GLN A 21 2.459 -13.511 -2.481 1.00 0.00 C ATOM 305 O GLN A 21 3.420 -13.062 -3.105 1.00 0.00 O ATOM 306 CB GLN A 21 0.852 -15.386 -1.970 1.00 0.00 C ATOM 307 CG GLN A 21 0.546 -15.257 -0.477 1.00 0.00 C ATOM 308 CD GLN A 21 -0.796 -14.558 -0.251 1.00 0.00 C ATOM 309 OE1 GLN A 21 -0.894 -13.342 -0.215 1.00 0.00 O ATOM 310 NE2 GLN A 21 -1.822 -15.391 -0.101 1.00 0.00 N ATOM 0 H GLN A 21 2.709 -15.915 -0.415 1.00 0.00 H new ATOM 0 HA GLN A 21 2.598 -15.528 -3.184 1.00 0.00 H new ATOM 0 HB2 GLN A 21 0.187 -14.736 -2.539 1.00 0.00 H new ATOM 0 HB3 GLN A 21 0.658 -16.407 -2.298 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.527 -16.246 -0.019 1.00 0.00 H new ATOM 0 HG3 GLN A 21 1.340 -14.694 0.013 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -1.671 -16.399 -0.142 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -2.760 -15.022 0.055 1.00 0.00 H new ATOM 319 N TYR A 22 1.496 -12.770 -1.952 1.00 0.00 N ATOM 320 CA TYR A 22 1.511 -11.322 -2.078 1.00 0.00 C ATOM 321 C TYR A 22 2.884 -10.754 -1.717 1.00 0.00 C ATOM 322 O TYR A 22 3.167 -10.500 -0.547 1.00 0.00 O ATOM 323 CB TYR A 22 0.477 -10.801 -1.078 1.00 0.00 C ATOM 324 CG TYR A 22 0.855 -9.468 -0.429 1.00 0.00 C ATOM 325 CD1 TYR A 22 1.283 -8.416 -1.214 1.00 0.00 C ATOM 326 CD2 TYR A 22 0.769 -9.318 0.940 1.00 0.00 C ATOM 327 CE1 TYR A 22 1.639 -7.161 -0.604 1.00 0.00 C ATOM 328 CE2 TYR A 22 1.125 -8.063 1.550 1.00 0.00 C ATOM 329 CZ TYR A 22 1.543 -7.047 0.748 1.00 0.00 C ATOM 330 OH TYR A 22 1.879 -5.862 1.324 1.00 0.00 O ATOM 0 H TYR A 22 0.700 -13.145 -1.435 1.00 0.00 H new ATOM 0 HA TYR A 22 1.289 -11.024 -3.103 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -0.480 -10.687 -1.587 1.00 0.00 H new ATOM 0 HB3 TYR A 22 0.335 -11.547 -0.296 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.351 -8.534 -2.285 1.00 0.00 H new ATOM 0 HD2 TYR A 22 0.435 -10.141 1.554 1.00 0.00 H new ATOM 0 HE1 TYR A 22 1.974 -6.330 -1.206 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.062 -7.931 2.620 1.00 0.00 H new ATOM 0 HH TYR A 22 1.761 -5.925 2.295 1.00 0.00 H new ATOM 340 N HIS A 23 3.702 -10.570 -2.743 1.00 0.00 N ATOM 341 CA HIS A 23 5.039 -10.036 -2.548 1.00 0.00 C ATOM 342 C HIS A 23 5.726 -9.866 -3.904 1.00 0.00 C ATOM 343 O HIS A 23 5.093 -10.016 -4.948 1.00 0.00 O ATOM 344 CB HIS A 23 5.840 -10.915 -1.584 1.00 0.00 C ATOM 345 CG HIS A 23 6.420 -12.155 -2.221 1.00 0.00 C ATOM 346 ND1 HIS A 23 7.267 -13.018 -1.547 1.00 0.00 N ATOM 347 CD2 HIS A 23 6.265 -12.669 -3.475 1.00 0.00 C ATOM 348 CE1 HIS A 23 7.601 -14.002 -2.369 1.00 0.00 C ATOM 349 NE2 HIS A 23 6.980 -13.783 -3.563 1.00 0.00 N ATOM 0 H HIS A 23 3.464 -10.781 -3.712 1.00 0.00 H new ATOM 0 HA HIS A 23 4.977 -9.051 -2.084 1.00 0.00 H new ATOM 0 HB2 HIS A 23 6.651 -10.324 -1.159 1.00 0.00 H new ATOM 0 HB3 HIS A 23 5.194 -11.212 -0.757 1.00 0.00 H new ATOM 0 HD1 HIS A 23 7.581 -12.914 -0.582 1.00 0.00 H new ATOM 0 HD2 HIS A 23 5.662 -12.242 -4.263 1.00 0.00 H new ATOM 0 HE1 HIS A 23 8.251 -14.832 -2.134 1.00 0.00 H new ATOM 357 N GLY A 24 7.013 -9.554 -3.845 1.00 0.00 N ATOM 358 CA GLY A 24 7.793 -9.362 -5.056 1.00 0.00 C ATOM 359 C GLY A 24 7.436 -8.037 -5.733 1.00 0.00 C ATOM 360 O GLY A 24 7.154 -7.047 -5.059 1.00 0.00 O ATOM 0 H GLY A 24 7.535 -9.429 -2.977 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.856 -9.376 -4.815 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.611 -10.187 -5.745 1.00 0.00 H new ATOM 364 N LYS A 25 7.459 -8.061 -7.058 1.00 0.00 N ATOM 365 CA LYS A 25 7.141 -6.874 -7.833 1.00 0.00 C ATOM 366 C LYS A 25 5.623 -6.753 -7.974 1.00 0.00 C ATOM 367 O LYS A 25 4.958 -7.696 -8.400 1.00 0.00 O ATOM 368 CB LYS A 25 7.883 -6.894 -9.171 1.00 0.00 C ATOM 369 CG LYS A 25 9.029 -5.880 -9.178 1.00 0.00 C ATOM 370 CD LYS A 25 9.777 -5.907 -10.512 1.00 0.00 C ATOM 371 CE LYS A 25 10.457 -7.260 -10.731 1.00 0.00 C ATOM 372 NZ LYS A 25 11.920 -7.087 -10.881 1.00 0.00 N ATOM 0 H LYS A 25 7.693 -8.884 -7.614 1.00 0.00 H new ATOM 0 HA LYS A 25 7.485 -5.978 -7.316 1.00 0.00 H new ATOM 0 HB2 LYS A 25 8.276 -7.893 -9.358 1.00 0.00 H new ATOM 0 HB3 LYS A 25 7.188 -6.668 -9.980 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.635 -4.880 -8.998 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.720 -6.102 -8.365 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.081 -5.709 -11.327 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.524 -5.113 -10.531 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.247 -7.920 -9.889 1.00 0.00 H new ATOM 0 HE3 LYS A 25 10.048 -7.739 -11.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.366 -8.015 -11.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 12.115 -6.475 -11.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.308 -6.650 -10.021 1.00 0.00 H new ATOM 386 N TRP A 26 5.117 -5.585 -7.607 1.00 0.00 N ATOM 387 CA TRP A 26 3.689 -5.328 -7.687 1.00 0.00 C ATOM 388 C TRP A 26 3.493 -3.901 -8.201 1.00 0.00 C ATOM 389 O TRP A 26 4.334 -3.033 -7.971 1.00 0.00 O ATOM 390 CB TRP A 26 3.012 -5.576 -6.338 1.00 0.00 C ATOM 391 CG TRP A 26 2.665 -7.043 -6.075 1.00 0.00 C ATOM 392 CD1 TRP A 26 3.506 -8.064 -5.862 1.00 0.00 C ATOM 393 CD2 TRP A 26 1.342 -7.615 -6.006 1.00 0.00 C ATOM 394 NE1 TRP A 26 2.825 -9.247 -5.662 1.00 0.00 N ATOM 395 CE2 TRP A 26 1.467 -8.965 -5.752 1.00 0.00 C ATOM 396 CE3 TRP A 26 0.081 -7.011 -6.154 1.00 0.00 C ATOM 397 CZ2 TRP A 26 0.370 -9.826 -5.623 1.00 0.00 C ATOM 398 CZ3 TRP A 26 -1.005 -7.884 -6.022 1.00 0.00 C ATOM 399 CH2 TRP A 26 -0.896 -9.246 -5.766 1.00 0.00 C ATOM 0 H TRP A 26 5.671 -4.805 -7.253 1.00 0.00 H new ATOM 0 HA TRP A 26 3.211 -6.017 -8.384 1.00 0.00 H new ATOM 0 HB2 TRP A 26 3.668 -5.221 -5.543 1.00 0.00 H new ATOM 0 HB3 TRP A 26 2.099 -4.983 -6.287 1.00 0.00 H new ATOM 0 HD1 TRP A 26 4.582 -7.972 -5.849 1.00 0.00 H new ATOM 0 HE1 TRP A 26 3.241 -10.160 -5.481 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -0.040 -5.957 -6.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 0.494 -10.880 -5.424 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -1.997 -7.471 -6.126 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.784 -9.854 -5.678 1.00 0.00 H new ATOM 410 N TRP A 27 2.378 -3.702 -8.889 1.00 0.00 N ATOM 411 CA TRP A 27 2.061 -2.394 -9.438 1.00 0.00 C ATOM 412 C TRP A 27 0.748 -1.924 -8.811 1.00 0.00 C ATOM 413 O TRP A 27 0.001 -2.726 -8.252 1.00 0.00 O ATOM 414 CB TRP A 27 2.011 -2.439 -10.967 1.00 0.00 C ATOM 415 CG TRP A 27 2.977 -1.469 -11.650 1.00 0.00 C ATOM 416 CD1 TRP A 27 2.958 -0.129 -11.622 1.00 0.00 C ATOM 417 CD2 TRP A 27 4.113 -1.820 -12.468 1.00 0.00 C ATOM 418 NE1 TRP A 27 3.994 0.407 -12.360 1.00 0.00 N ATOM 419 CE2 TRP A 27 4.719 -0.654 -12.890 1.00 0.00 C ATOM 420 CE3 TRP A 27 4.613 -3.081 -12.839 1.00 0.00 C ATOM 421 CZ2 TRP A 27 5.856 -0.633 -13.706 1.00 0.00 C ATOM 422 CZ3 TRP A 27 5.750 -3.043 -13.654 1.00 0.00 C ATOM 423 CH2 TRP A 27 6.372 -1.878 -14.088 1.00 0.00 C ATOM 0 H TRP A 27 1.683 -4.424 -9.079 1.00 0.00 H new ATOM 0 HA TRP A 27 2.841 -1.673 -9.193 1.00 0.00 H new ATOM 0 HB2 TRP A 27 2.236 -3.453 -11.298 1.00 0.00 H new ATOM 0 HB3 TRP A 27 0.996 -2.215 -11.294 1.00 0.00 H new ATOM 0 HD1 TRP A 27 2.224 0.458 -11.089 1.00 0.00 H new ATOM 0 HE1 TRP A 27 4.191 1.399 -12.492 1.00 0.00 H new ATOM 0 HE3 TRP A 27 4.156 -4.006 -12.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 6.311 0.293 -14.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 6.174 -3.985 -13.968 1.00 0.00 H new ATOM 0 HH2 TRP A 27 7.249 -1.933 -14.716 1.00 0.00 H new ATOM 434 N GLU A 28 0.506 -0.626 -8.924 1.00 0.00 N ATOM 435 CA GLU A 28 -0.705 -0.040 -8.375 1.00 0.00 C ATOM 436 C GLU A 28 -1.807 -0.008 -9.435 1.00 0.00 C ATOM 437 O GLU A 28 -1.523 0.053 -10.630 1.00 0.00 O ATOM 438 CB GLU A 28 -0.434 1.361 -7.824 1.00 0.00 C ATOM 439 CG GLU A 28 -0.246 1.327 -6.306 1.00 0.00 C ATOM 440 CD GLU A 28 0.425 2.608 -5.807 1.00 0.00 C ATOM 441 OE1 GLU A 28 -0.045 3.691 -6.216 1.00 0.00 O ATOM 442 OE2 GLU A 28 1.393 2.475 -5.027 1.00 0.00 O ATOM 0 H GLU A 28 1.128 0.036 -9.388 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.043 -0.662 -7.546 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.458 1.775 -8.295 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.263 2.022 -8.076 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.214 1.206 -5.819 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.360 0.464 -6.030 1.00 0.00 H new ATOM 450 N VAL A 29 -3.043 -0.051 -8.959 1.00 0.00 N ATOM 451 CA VAL A 29 -4.190 -0.028 -9.851 1.00 0.00 C ATOM 452 C VAL A 29 -5.183 1.033 -9.371 1.00 0.00 C ATOM 453 O VAL A 29 -5.033 2.214 -9.682 1.00 0.00 O ATOM 454 CB VAL A 29 -4.807 -1.425 -9.946 1.00 0.00 C ATOM 455 CG1 VAL A 29 -4.373 -2.129 -11.233 1.00 0.00 C ATOM 456 CG2 VAL A 29 -4.456 -2.264 -8.716 1.00 0.00 C ATOM 0 H VAL A 29 -3.275 -0.102 -7.967 1.00 0.00 H new ATOM 0 HA VAL A 29 -3.884 0.247 -10.860 1.00 0.00 H new ATOM 0 HB VAL A 29 -5.891 -1.312 -9.975 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.825 -3.120 -11.276 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.697 -1.545 -12.094 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.287 -2.225 -11.247 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.907 -3.252 -8.809 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.373 -2.365 -8.641 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -4.838 -1.774 -7.820 1.00 0.00 H new ATOM 466 N ALA A 30 -6.174 0.574 -8.622 1.00 0.00 N ATOM 467 CA ALA A 30 -7.191 1.469 -8.096 1.00 0.00 C ATOM 468 C ALA A 30 -6.766 1.958 -6.710 1.00 0.00 C ATOM 469 O ALA A 30 -7.218 1.430 -5.695 1.00 0.00 O ATOM 470 CB ALA A 30 -8.541 0.749 -8.072 1.00 0.00 C ATOM 0 H ALA A 30 -6.295 -0.406 -8.367 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.300 2.345 -8.735 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.304 1.420 -7.678 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.811 0.448 -9.084 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.471 -0.134 -7.437 1.00 0.00 H new ATOM 476 N LYS A 31 -5.902 2.962 -6.711 1.00 0.00 N ATOM 477 CA LYS A 31 -5.411 3.529 -5.466 1.00 0.00 C ATOM 478 C LYS A 31 -6.059 4.897 -5.244 1.00 0.00 C ATOM 479 O LYS A 31 -6.325 5.625 -6.199 1.00 0.00 O ATOM 480 CB LYS A 31 -3.882 3.564 -5.460 1.00 0.00 C ATOM 481 CG LYS A 31 -3.359 4.810 -6.180 1.00 0.00 C ATOM 482 CD LYS A 31 -2.956 4.483 -7.619 1.00 0.00 C ATOM 483 CE LYS A 31 -2.442 5.730 -8.341 1.00 0.00 C ATOM 484 NZ LYS A 31 -3.077 5.856 -9.672 1.00 0.00 N ATOM 0 H LYS A 31 -5.529 3.398 -7.554 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.695 2.900 -4.622 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.518 3.554 -4.432 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.492 2.669 -5.945 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.127 5.583 -6.181 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.501 5.213 -5.641 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.183 3.714 -7.618 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.812 4.074 -8.156 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.655 6.617 -7.744 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.359 5.673 -8.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -3.179 6.862 -9.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -2.484 5.386 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.015 5.408 -9.653 1.00 0.00 H new ATOM 498 N TYR A 32 -6.294 5.206 -3.977 1.00 0.00 N ATOM 499 CA TYR A 32 -6.905 6.473 -3.616 1.00 0.00 C ATOM 500 C TYR A 32 -6.022 7.649 -4.041 1.00 0.00 C ATOM 501 O TYR A 32 -4.808 7.620 -3.846 1.00 0.00 O ATOM 502 CB TYR A 32 -7.024 6.466 -2.091 1.00 0.00 C ATOM 503 CG TYR A 32 -8.422 6.116 -1.577 1.00 0.00 C ATOM 504 CD1 TYR A 32 -8.777 4.795 -1.388 1.00 0.00 C ATOM 505 CD2 TYR A 32 -9.328 7.120 -1.303 1.00 0.00 C ATOM 506 CE1 TYR A 32 -10.093 4.466 -0.905 1.00 0.00 C ATOM 507 CE2 TYR A 32 -10.644 6.790 -0.820 1.00 0.00 C ATOM 508 CZ TYR A 32 -10.961 5.479 -0.645 1.00 0.00 C ATOM 509 OH TYR A 32 -12.204 5.168 -0.188 1.00 0.00 O ATOM 0 H TYR A 32 -6.072 4.600 -3.187 1.00 0.00 H new ATOM 0 HA TYR A 32 -7.870 6.587 -4.110 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -6.309 5.751 -1.684 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -6.744 7.448 -1.711 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -8.068 4.009 -1.602 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -9.050 8.153 -1.451 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -10.384 3.437 -0.753 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -11.363 7.566 -0.602 1.00 0.00 H new ATOM 0 HH TYR A 32 -12.846 5.216 -0.927 1.00 0.00 H new ATOM 519 N PRO A 33 -6.683 8.681 -4.629 1.00 0.00 N ATOM 520 CA PRO A 33 -5.972 9.864 -5.083 1.00 0.00 C ATOM 521 C PRO A 33 -5.569 10.749 -3.901 1.00 0.00 C ATOM 522 O PRO A 33 -5.547 10.293 -2.759 1.00 0.00 O ATOM 523 CB PRO A 33 -6.927 10.554 -6.043 1.00 0.00 C ATOM 524 CG PRO A 33 -8.305 9.989 -5.737 1.00 0.00 C ATOM 525 CD PRO A 33 -8.121 8.750 -4.876 1.00 0.00 C ATOM 0 HA PRO A 33 -5.033 9.624 -5.581 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -6.908 11.635 -5.903 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.647 10.361 -7.079 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -8.914 10.728 -5.216 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.828 9.738 -6.660 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -8.680 8.829 -3.943 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -8.479 7.856 -5.387 1.00 0.00 H new ATOM 533 N SER A 34 -5.261 11.998 -4.217 1.00 0.00 N ATOM 534 CA SER A 34 -4.861 12.951 -3.196 1.00 0.00 C ATOM 535 C SER A 34 -5.505 14.312 -3.468 1.00 0.00 C ATOM 536 O SER A 34 -6.224 14.476 -4.453 1.00 0.00 O ATOM 537 CB SER A 34 -3.338 13.088 -3.137 1.00 0.00 C ATOM 538 OG SER A 34 -2.891 14.326 -3.683 1.00 0.00 O ATOM 0 H SER A 34 -5.280 12.372 -5.166 1.00 0.00 H new ATOM 0 HA SER A 34 -5.204 12.580 -2.230 1.00 0.00 H new ATOM 0 HB2 SER A 34 -3.007 13.008 -2.102 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.879 12.264 -3.683 1.00 0.00 H new ATOM 0 HG SER A 34 -1.914 14.375 -3.625 1.00 0.00 H new ATOM 544 N PRO A 35 -5.217 15.278 -2.555 1.00 0.00 N ATOM 545 CA PRO A 35 -5.760 16.619 -2.687 1.00 0.00 C ATOM 546 C PRO A 35 -5.038 17.397 -3.789 1.00 0.00 C ATOM 547 O PRO A 35 -5.678 18.006 -4.645 1.00 0.00 O ATOM 548 CB PRO A 35 -5.597 17.246 -1.312 1.00 0.00 C ATOM 549 CG PRO A 35 -4.554 16.407 -0.592 1.00 0.00 C ATOM 550 CD PRO A 35 -4.370 15.119 -1.377 1.00 0.00 C ATOM 0 HA PRO A 35 -6.807 16.621 -2.989 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -5.276 18.284 -1.392 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -6.542 17.246 -0.768 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -3.611 16.949 -0.521 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -4.875 16.191 0.427 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -3.327 14.971 -1.657 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -4.668 14.251 -0.789 1.00 0.00 H new ATOM 558 N ASN A 36 -3.715 17.351 -3.732 1.00 0.00 N ATOM 559 CA ASN A 36 -2.899 18.044 -4.714 1.00 0.00 C ATOM 560 C ASN A 36 -2.701 17.142 -5.934 1.00 0.00 C ATOM 561 O ASN A 36 -2.007 17.513 -6.879 1.00 0.00 O ATOM 562 CB ASN A 36 -1.519 18.379 -4.146 1.00 0.00 C ATOM 563 CG ASN A 36 -1.039 19.745 -4.643 1.00 0.00 C ATOM 564 OD1 ASN A 36 -1.758 20.730 -4.620 1.00 0.00 O ATOM 565 ND2 ASN A 36 0.213 19.747 -5.091 1.00 0.00 N ATOM 0 H ASN A 36 -3.188 16.844 -3.021 1.00 0.00 H new ATOM 0 HA ASN A 36 -3.411 18.967 -4.986 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.560 18.378 -3.057 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.805 17.610 -4.439 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.627 20.610 -5.444 1.00 0.00 H new ATOM 0 HD22 ASN A 36 0.759 18.886 -5.082 1.00 0.00 H new ATOM 572 N GLY A 37 -3.324 15.973 -5.874 1.00 0.00 N ATOM 573 CA GLY A 37 -3.225 15.015 -6.962 1.00 0.00 C ATOM 574 C GLY A 37 -1.766 14.803 -7.374 1.00 0.00 C ATOM 575 O GLY A 37 -1.311 15.362 -8.370 1.00 0.00 O ATOM 0 H GLY A 37 -3.899 15.668 -5.089 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -3.662 14.065 -6.656 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -3.800 15.369 -7.817 1.00 0.00 H new ATOM 579 N LYS A 38 -1.075 13.992 -6.586 1.00 0.00 N ATOM 580 CA LYS A 38 0.322 13.699 -6.856 1.00 0.00 C ATOM 581 C LYS A 38 0.510 12.184 -6.962 1.00 0.00 C ATOM 582 O LYS A 38 0.280 11.458 -5.996 1.00 0.00 O ATOM 583 CB LYS A 38 1.221 14.358 -5.808 1.00 0.00 C ATOM 584 CG LYS A 38 0.684 14.117 -4.396 1.00 0.00 C ATOM 585 CD LYS A 38 1.825 13.826 -3.418 1.00 0.00 C ATOM 586 CE LYS A 38 2.353 15.118 -2.792 1.00 0.00 C ATOM 587 NZ LYS A 38 1.472 15.556 -1.687 1.00 0.00 N ATOM 0 H LYS A 38 -1.457 13.529 -5.761 1.00 0.00 H new ATOM 0 HA LYS A 38 0.622 14.126 -7.813 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.232 13.960 -5.889 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.284 15.429 -5.999 1.00 0.00 H new ATOM 0 HG2 LYS A 38 0.127 14.992 -4.061 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.014 13.280 -4.406 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.475 13.155 -2.634 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.634 13.313 -3.939 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.365 14.961 -2.418 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.411 15.899 -3.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.845 16.434 -1.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 0.514 15.725 -2.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.438 14.817 -0.957 1.00 0.00 H new ATOM 601 N TYR A 39 0.925 11.752 -8.143 1.00 0.00 N ATOM 602 CA TYR A 39 1.146 10.336 -8.387 1.00 0.00 C ATOM 603 C TYR A 39 1.960 10.121 -9.665 1.00 0.00 C ATOM 604 O TYR A 39 2.159 11.052 -10.443 1.00 0.00 O ATOM 605 CB TYR A 39 -0.242 9.719 -8.571 1.00 0.00 C ATOM 606 CG TYR A 39 -1.067 9.649 -7.285 1.00 0.00 C ATOM 607 CD1 TYR A 39 -0.861 8.621 -6.388 1.00 0.00 C ATOM 608 CD2 TYR A 39 -2.019 10.613 -7.023 1.00 0.00 C ATOM 609 CE1 TYR A 39 -1.638 8.555 -5.177 1.00 0.00 C ATOM 610 CE2 TYR A 39 -2.796 10.547 -5.812 1.00 0.00 C ATOM 611 CZ TYR A 39 -2.567 9.522 -4.949 1.00 0.00 C ATOM 612 OH TYR A 39 -3.300 9.459 -3.805 1.00 0.00 O ATOM 0 H TYR A 39 1.114 12.357 -8.942 1.00 0.00 H new ATOM 0 HA TYR A 39 1.698 9.885 -7.562 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -0.791 10.300 -9.312 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -0.130 8.712 -8.974 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -0.117 7.866 -6.594 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.181 11.417 -7.726 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -1.486 7.756 -4.466 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.544 11.295 -5.594 1.00 0.00 H new ATOM 0 HH TYR A 39 -3.598 8.537 -3.658 1.00 0.00 H new ATOM 622 N GLY A 40 2.409 8.887 -9.841 1.00 0.00 N ATOM 623 CA GLY A 40 3.198 8.537 -11.010 1.00 0.00 C ATOM 624 C GLY A 40 3.543 7.046 -11.012 1.00 0.00 C ATOM 625 O GLY A 40 4.143 6.543 -10.063 1.00 0.00 O ATOM 0 H GLY A 40 2.241 8.117 -9.193 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.644 8.787 -11.915 1.00 0.00 H new ATOM 0 HA3 GLY A 40 4.115 9.126 -11.024 1.00 0.00 H new ATOM 629 N LYS A 41 3.151 6.382 -12.089 1.00 0.00 N ATOM 630 CA LYS A 41 3.411 4.959 -12.227 1.00 0.00 C ATOM 631 C LYS A 41 4.817 4.756 -12.797 1.00 0.00 C ATOM 632 O LYS A 41 5.726 5.533 -12.510 1.00 0.00 O ATOM 633 CB LYS A 41 2.310 4.290 -13.052 1.00 0.00 C ATOM 634 CG LYS A 41 1.991 2.895 -12.511 1.00 0.00 C ATOM 635 CD LYS A 41 0.480 2.677 -12.415 1.00 0.00 C ATOM 636 CE LYS A 41 0.004 2.774 -10.964 1.00 0.00 C ATOM 637 NZ LYS A 41 0.139 4.161 -10.465 1.00 0.00 N ATOM 0 H LYS A 41 2.655 6.803 -12.875 1.00 0.00 H new ATOM 0 HA LYS A 41 3.387 4.471 -11.253 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.411 4.906 -13.033 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.624 4.217 -14.093 1.00 0.00 H new ATOM 0 HG2 LYS A 41 2.430 2.139 -13.162 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.443 2.770 -11.527 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -0.038 3.420 -13.022 1.00 0.00 H new ATOM 0 HD3 LYS A 41 0.223 1.699 -12.821 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -1.036 2.456 -10.894 1.00 0.00 H new ATOM 0 HE3 LYS A 41 0.586 2.098 -10.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -0.156 4.202 -9.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 1.131 4.464 -10.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.462 4.793 -11.031 1.00 0.00 H new ATOM 651 N CYS A 42 4.951 3.707 -13.595 1.00 0.00 N ATOM 652 CA CYS A 42 6.230 3.392 -14.208 1.00 0.00 C ATOM 653 C CYS A 42 7.253 3.163 -13.094 1.00 0.00 C ATOM 654 O CYS A 42 8.279 3.839 -13.041 1.00 0.00 O ATOM 655 CB CYS A 42 6.677 4.487 -15.179 1.00 0.00 C ATOM 656 SG CYS A 42 5.483 4.865 -16.512 1.00 0.00 S ATOM 0 H CYS A 42 4.195 3.064 -13.831 1.00 0.00 H new ATOM 0 HA CYS A 42 6.137 2.485 -14.805 1.00 0.00 H new ATOM 0 HB2 CYS A 42 6.869 5.399 -14.613 1.00 0.00 H new ATOM 0 HB3 CYS A 42 7.622 4.188 -15.631 1.00 0.00 H new ATOM 662 N GLY A 43 6.938 2.208 -12.232 1.00 0.00 N ATOM 663 CA GLY A 43 7.817 1.881 -11.122 1.00 0.00 C ATOM 664 C GLY A 43 7.781 0.383 -10.816 1.00 0.00 C ATOM 665 O GLY A 43 7.022 -0.362 -11.434 1.00 0.00 O ATOM 0 H GLY A 43 6.086 1.650 -12.280 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.837 2.182 -11.360 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.517 2.444 -10.238 1.00 0.00 H new ATOM 669 N TRP A 44 8.611 -0.014 -9.862 1.00 0.00 N ATOM 670 CA TRP A 44 8.683 -1.410 -9.466 1.00 0.00 C ATOM 671 C TRP A 44 9.192 -1.467 -8.025 1.00 0.00 C ATOM 672 O TRP A 44 10.173 -0.808 -7.682 1.00 0.00 O ATOM 673 CB TRP A 44 9.551 -2.212 -10.439 1.00 0.00 C ATOM 674 CG TRP A 44 10.748 -1.435 -10.990 1.00 0.00 C ATOM 675 CD1 TRP A 44 11.962 -1.292 -10.441 1.00 0.00 C ATOM 676 CD2 TRP A 44 10.797 -0.695 -12.228 1.00 0.00 C ATOM 677 NE1 TRP A 44 12.787 -0.518 -11.232 1.00 0.00 N ATOM 678 CE2 TRP A 44 12.055 -0.143 -12.353 1.00 0.00 C ATOM 679 CE3 TRP A 44 9.810 -0.499 -13.211 1.00 0.00 C ATOM 680 CZ2 TRP A 44 12.444 0.641 -13.446 1.00 0.00 C ATOM 681 CZ3 TRP A 44 10.214 0.287 -14.297 1.00 0.00 C ATOM 682 CH2 TRP A 44 11.477 0.850 -14.437 1.00 0.00 C ATOM 0 H TRP A 44 9.239 0.607 -9.352 1.00 0.00 H new ATOM 0 HA TRP A 44 7.697 -1.873 -9.506 1.00 0.00 H new ATOM 0 HB2 TRP A 44 9.913 -3.107 -9.934 1.00 0.00 H new ATOM 0 HB3 TRP A 44 8.932 -2.545 -11.272 1.00 0.00 H new ATOM 0 HD1 TRP A 44 12.258 -1.728 -9.498 1.00 0.00 H new ATOM 0 HE1 TRP A 44 13.755 -0.267 -11.031 1.00 0.00 H new ATOM 0 HE3 TRP A 44 8.819 -0.921 -13.134 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 13.436 1.062 -13.521 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 9.494 0.469 -15.081 1.00 0.00 H new ATOM 0 HH2 TRP A 44 11.712 1.446 -15.306 1.00 0.00 H new ATOM 693 N ALA A 45 8.503 -2.261 -7.219 1.00 0.00 N ATOM 694 CA ALA A 45 8.874 -2.413 -5.822 1.00 0.00 C ATOM 695 C ALA A 45 8.859 -3.898 -5.453 1.00 0.00 C ATOM 696 O ALA A 45 7.859 -4.583 -5.663 1.00 0.00 O ATOM 697 CB ALA A 45 7.926 -1.586 -4.950 1.00 0.00 C ATOM 0 H ALA A 45 7.690 -2.806 -7.506 1.00 0.00 H new ATOM 0 HA ALA A 45 9.884 -2.041 -5.650 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.204 -1.699 -3.902 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.995 -0.535 -5.232 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.903 -1.933 -5.094 1.00 0.00 H new ATOM 703 N GLU A 46 9.979 -4.351 -4.909 1.00 0.00 N ATOM 704 CA GLU A 46 10.107 -5.742 -4.509 1.00 0.00 C ATOM 705 C GLU A 46 10.180 -5.851 -2.985 1.00 0.00 C ATOM 706 O GLU A 46 10.517 -4.883 -2.305 1.00 0.00 O ATOM 707 CB GLU A 46 11.328 -6.391 -5.164 1.00 0.00 C ATOM 708 CG GLU A 46 12.583 -5.544 -4.943 1.00 0.00 C ATOM 709 CD GLU A 46 13.055 -4.911 -6.254 1.00 0.00 C ATOM 710 OE1 GLU A 46 12.865 -5.567 -7.301 1.00 0.00 O ATOM 711 OE2 GLU A 46 13.595 -3.787 -6.179 1.00 0.00 O ATOM 0 H GLU A 46 10.806 -3.779 -4.736 1.00 0.00 H new ATOM 0 HA GLU A 46 9.223 -6.281 -4.851 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.480 -7.388 -4.751 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.150 -6.513 -6.233 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.375 -4.763 -4.212 1.00 0.00 H new ATOM 0 HG3 GLU A 46 13.377 -6.165 -4.528 1.00 0.00 H new ATOM 719 N TYR A 47 9.858 -7.039 -2.492 1.00 0.00 N ATOM 720 CA TYR A 47 9.883 -7.287 -1.061 1.00 0.00 C ATOM 721 C TYR A 47 10.994 -8.273 -0.695 1.00 0.00 C ATOM 722 O TYR A 47 11.063 -9.369 -1.248 1.00 0.00 O ATOM 723 CB TYR A 47 8.529 -7.912 -0.718 1.00 0.00 C ATOM 724 CG TYR A 47 7.350 -6.944 -0.831 1.00 0.00 C ATOM 725 CD1 TYR A 47 7.051 -6.360 -2.045 1.00 0.00 C ATOM 726 CD2 TYR A 47 6.586 -6.654 0.282 1.00 0.00 C ATOM 727 CE1 TYR A 47 5.941 -5.448 -2.151 1.00 0.00 C ATOM 728 CE2 TYR A 47 5.476 -5.743 0.176 1.00 0.00 C ATOM 729 CZ TYR A 47 5.208 -5.185 -1.035 1.00 0.00 C ATOM 730 OH TYR A 47 4.160 -4.324 -1.136 1.00 0.00 O ATOM 0 H TYR A 47 9.579 -7.840 -3.059 1.00 0.00 H new ATOM 0 HA TYR A 47 10.067 -6.362 -0.514 1.00 0.00 H new ATOM 0 HB2 TYR A 47 8.354 -8.760 -1.380 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.568 -8.303 0.299 1.00 0.00 H new ATOM 0 HD1 TYR A 47 7.649 -6.587 -2.915 1.00 0.00 H new ATOM 0 HD2 TYR A 47 6.821 -7.111 1.232 1.00 0.00 H new ATOM 0 HE1 TYR A 47 5.696 -4.984 -3.095 1.00 0.00 H new ATOM 0 HE2 TYR A 47 4.870 -5.508 1.039 1.00 0.00 H new ATOM 0 HH TYR A 47 3.727 -4.232 -0.262 1.00 0.00 H new ATOM 740 N THR A 48 11.836 -7.848 0.236 1.00 0.00 N ATOM 741 CA THR A 48 12.940 -8.679 0.682 1.00 0.00 C ATOM 742 C THR A 48 12.610 -9.326 2.029 1.00 0.00 C ATOM 743 O THR A 48 12.552 -8.644 3.051 1.00 0.00 O ATOM 744 CB THR A 48 14.201 -7.813 0.716 1.00 0.00 C ATOM 745 OG1 THR A 48 14.525 -7.618 -0.657 1.00 0.00 O ATOM 746 CG2 THR A 48 15.410 -8.561 1.282 1.00 0.00 C ATOM 0 H THR A 48 11.775 -6.938 0.693 1.00 0.00 H new ATOM 0 HA THR A 48 13.116 -9.506 -0.006 1.00 0.00 H new ATOM 0 HB THR A 48 14.013 -6.922 1.315 1.00 0.00 H new ATOM 0 HG1 THR A 48 15.331 -7.064 -0.728 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.278 -7.901 1.284 1.00 0.00 H new ATOM 0 HG22 THR A 48 15.195 -8.881 2.302 1.00 0.00 H new ATOM 0 HG23 THR A 48 15.619 -9.434 0.664 1.00 0.00 H new ATOM 754 N PRO A 49 12.398 -10.668 1.986 1.00 0.00 N ATOM 755 CA PRO A 49 12.076 -11.415 3.190 1.00 0.00 C ATOM 756 C PRO A 49 13.316 -11.604 4.066 1.00 0.00 C ATOM 757 O PRO A 49 14.305 -12.190 3.629 1.00 0.00 O ATOM 758 CB PRO A 49 11.492 -12.728 2.695 1.00 0.00 C ATOM 759 CG PRO A 49 11.936 -12.862 1.247 1.00 0.00 C ATOM 760 CD PRO A 49 12.460 -11.509 0.793 1.00 0.00 C ATOM 0 HA PRO A 49 11.363 -10.894 3.830 1.00 0.00 H new ATOM 0 HB2 PRO A 49 11.852 -13.565 3.293 1.00 0.00 H new ATOM 0 HB3 PRO A 49 10.405 -12.725 2.772 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.711 -13.622 1.154 1.00 0.00 H new ATOM 0 HG3 PRO A 49 11.103 -13.179 0.620 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.480 -11.586 0.415 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.851 -11.099 -0.013 1.00 0.00 H new ATOM 768 N GLU A 50 13.222 -11.097 5.287 1.00 0.00 N ATOM 769 CA GLU A 50 14.323 -11.203 6.228 1.00 0.00 C ATOM 770 C GLU A 50 13.792 -11.281 7.661 1.00 0.00 C ATOM 771 O GLU A 50 14.250 -10.549 8.537 1.00 0.00 O ATOM 772 CB GLU A 50 15.297 -10.034 6.067 1.00 0.00 C ATOM 773 CG GLU A 50 16.678 -10.527 5.631 1.00 0.00 C ATOM 774 CD GLU A 50 17.765 -9.518 6.009 1.00 0.00 C ATOM 775 OE1 GLU A 50 18.054 -8.650 5.157 1.00 0.00 O ATOM 776 OE2 GLU A 50 18.281 -9.638 7.141 1.00 0.00 O ATOM 0 H GLU A 50 12.400 -10.612 5.646 1.00 0.00 H new ATOM 0 HA GLU A 50 14.870 -12.121 6.014 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.908 -9.331 5.330 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.381 -9.493 7.010 1.00 0.00 H new ATOM 0 HG2 GLU A 50 16.890 -11.488 6.100 1.00 0.00 H new ATOM 0 HG3 GLU A 50 16.687 -10.690 4.553 1.00 0.00 H new ATOM 784 N GLY A 51 12.832 -12.174 7.855 1.00 0.00 N ATOM 785 CA GLY A 51 12.234 -12.356 9.166 1.00 0.00 C ATOM 786 C GLY A 51 10.727 -12.091 9.123 1.00 0.00 C ATOM 787 O GLY A 51 10.143 -11.984 8.046 1.00 0.00 O ATOM 0 H GLY A 51 12.454 -12.779 7.126 1.00 0.00 H new ATOM 0 HA2 GLY A 51 12.418 -13.372 9.516 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.705 -11.682 9.881 1.00 0.00 H new ATOM 791 N LYS A 52 10.142 -11.993 10.307 1.00 0.00 N ATOM 792 CA LYS A 52 8.715 -11.742 10.418 1.00 0.00 C ATOM 793 C LYS A 52 8.343 -10.542 9.545 1.00 0.00 C ATOM 794 O LYS A 52 7.222 -10.458 9.044 1.00 0.00 O ATOM 795 CB LYS A 52 8.311 -11.584 11.885 1.00 0.00 C ATOM 796 CG LYS A 52 7.997 -12.942 12.517 1.00 0.00 C ATOM 797 CD LYS A 52 6.774 -12.851 13.432 1.00 0.00 C ATOM 798 CE LYS A 52 6.779 -13.978 14.467 1.00 0.00 C ATOM 799 NZ LYS A 52 6.344 -13.471 15.788 1.00 0.00 N ATOM 0 H LYS A 52 10.630 -12.083 11.198 1.00 0.00 H new ATOM 0 HA LYS A 52 8.148 -12.595 10.046 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.116 -11.099 12.437 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.439 -10.935 11.958 1.00 0.00 H new ATOM 0 HG2 LYS A 52 7.816 -13.678 11.734 1.00 0.00 H new ATOM 0 HG3 LYS A 52 8.858 -13.289 13.088 1.00 0.00 H new ATOM 0 HD2 LYS A 52 6.766 -11.886 13.939 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.864 -12.905 12.835 1.00 0.00 H new ATOM 0 HE2 LYS A 52 6.116 -14.780 14.143 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.780 -14.403 14.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 6.353 -14.249 16.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.992 -12.721 16.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 5.381 -13.087 15.712 1.00 0.00 H new ATOM 813 N SER A 53 9.303 -9.643 9.390 1.00 0.00 N ATOM 814 CA SER A 53 9.091 -8.452 8.586 1.00 0.00 C ATOM 815 C SER A 53 9.683 -8.650 7.189 1.00 0.00 C ATOM 816 O SER A 53 10.548 -9.503 6.993 1.00 0.00 O ATOM 817 CB SER A 53 9.705 -7.220 9.254 1.00 0.00 C ATOM 818 OG SER A 53 10.292 -7.533 10.514 1.00 0.00 O ATOM 0 H SER A 53 10.231 -9.716 9.808 1.00 0.00 H new ATOM 0 HA SER A 53 8.017 -8.286 8.497 1.00 0.00 H new ATOM 0 HB2 SER A 53 10.462 -6.791 8.598 1.00 0.00 H new ATOM 0 HB3 SER A 53 8.935 -6.461 9.391 1.00 0.00 H new ATOM 0 HG SER A 53 10.674 -6.721 10.908 1.00 0.00 H new ATOM 824 N VAL A 54 9.195 -7.848 6.255 1.00 0.00 N ATOM 825 CA VAL A 54 9.665 -7.924 4.882 1.00 0.00 C ATOM 826 C VAL A 54 9.964 -6.514 4.371 1.00 0.00 C ATOM 827 O VAL A 54 9.071 -5.670 4.309 1.00 0.00 O ATOM 828 CB VAL A 54 8.644 -8.669 4.020 1.00 0.00 C ATOM 829 CG1 VAL A 54 8.853 -10.183 4.108 1.00 0.00 C ATOM 830 CG2 VAL A 54 7.215 -8.289 4.410 1.00 0.00 C ATOM 0 H VAL A 54 8.478 -7.142 6.422 1.00 0.00 H new ATOM 0 HA VAL A 54 10.593 -8.493 4.827 1.00 0.00 H new ATOM 0 HB VAL A 54 8.798 -8.369 2.984 1.00 0.00 H new ATOM 0 HG11 VAL A 54 8.114 -10.689 3.486 1.00 0.00 H new ATOM 0 HG12 VAL A 54 9.855 -10.433 3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 54 8.739 -10.506 5.143 1.00 0.00 H new ATOM 0 HG21 VAL A 54 6.510 -8.833 3.782 1.00 0.00 H new ATOM 0 HG22 VAL A 54 7.043 -8.546 5.455 1.00 0.00 H new ATOM 0 HG23 VAL A 54 7.073 -7.217 4.271 1.00 0.00 H new ATOM 840 N LYS A 55 11.223 -6.301 4.017 1.00 0.00 N ATOM 841 CA LYS A 55 11.650 -5.007 3.513 1.00 0.00 C ATOM 842 C LYS A 55 10.929 -4.714 2.195 1.00 0.00 C ATOM 843 O LYS A 55 10.600 -5.633 1.446 1.00 0.00 O ATOM 844 CB LYS A 55 13.175 -4.951 3.404 1.00 0.00 C ATOM 845 CG LYS A 55 13.809 -4.614 4.755 1.00 0.00 C ATOM 846 CD LYS A 55 14.846 -5.667 5.152 1.00 0.00 C ATOM 847 CE LYS A 55 14.856 -5.883 6.667 1.00 0.00 C ATOM 848 NZ LYS A 55 15.905 -5.055 7.302 1.00 0.00 N ATOM 0 H LYS A 55 11.961 -7.003 4.069 1.00 0.00 H new ATOM 0 HA LYS A 55 11.374 -4.217 4.211 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.553 -5.910 3.050 1.00 0.00 H new ATOM 0 HB3 LYS A 55 13.463 -4.202 2.666 1.00 0.00 H new ATOM 0 HG2 LYS A 55 14.282 -3.633 4.704 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.034 -4.555 5.520 1.00 0.00 H new ATOM 0 HD2 LYS A 55 14.625 -6.608 4.648 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.835 -5.352 4.819 1.00 0.00 H new ATOM 0 HE2 LYS A 55 13.881 -5.628 7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.031 -6.936 6.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.898 -5.214 8.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.835 -5.318 6.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 15.721 -4.050 7.106 1.00 0.00 H new ATOM 862 N VAL A 56 10.704 -3.431 1.953 1.00 0.00 N ATOM 863 CA VAL A 56 10.028 -3.006 0.739 1.00 0.00 C ATOM 864 C VAL A 56 10.710 -1.749 0.195 1.00 0.00 C ATOM 865 O VAL A 56 10.962 -0.803 0.939 1.00 0.00 O ATOM 866 CB VAL A 56 8.536 -2.805 1.014 1.00 0.00 C ATOM 867 CG1 VAL A 56 7.870 -2.025 -0.120 1.00 0.00 C ATOM 868 CG2 VAL A 56 7.836 -4.146 1.243 1.00 0.00 C ATOM 0 H VAL A 56 10.978 -2.672 2.577 1.00 0.00 H new ATOM 0 HA VAL A 56 10.103 -3.775 -0.030 1.00 0.00 H new ATOM 0 HB VAL A 56 8.439 -2.217 1.926 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.810 -1.896 0.100 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.342 -1.047 -0.216 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.982 -2.575 -1.054 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.777 -3.975 1.436 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.947 -4.770 0.357 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.285 -4.649 2.100 1.00 0.00 H new ATOM 878 N SER A 57 10.988 -1.780 -1.100 1.00 0.00 N ATOM 879 CA SER A 57 11.635 -0.655 -1.754 1.00 0.00 C ATOM 880 C SER A 57 10.829 -0.228 -2.982 1.00 0.00 C ATOM 881 O SER A 57 10.651 -1.011 -3.914 1.00 0.00 O ATOM 882 CB SER A 57 13.070 -1.003 -2.155 1.00 0.00 C ATOM 883 OG SER A 57 13.660 -1.946 -1.265 1.00 0.00 O ATOM 0 H SER A 57 10.777 -2.567 -1.714 1.00 0.00 H new ATOM 0 HA SER A 57 11.674 0.175 -1.048 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.075 -1.407 -3.167 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.672 -0.095 -2.172 1.00 0.00 H new ATOM 0 HG SER A 57 14.575 -2.143 -1.556 1.00 0.00 H new ATOM 889 N ARG A 58 10.363 1.011 -2.943 1.00 0.00 N ATOM 890 CA ARG A 58 9.580 1.551 -4.041 1.00 0.00 C ATOM 891 C ARG A 58 10.428 2.515 -4.874 1.00 0.00 C ATOM 892 O ARG A 58 11.234 3.268 -4.329 1.00 0.00 O ATOM 893 CB ARG A 58 8.342 2.287 -3.526 1.00 0.00 C ATOM 894 CG ARG A 58 7.089 1.852 -4.287 1.00 0.00 C ATOM 895 CD ARG A 58 5.868 2.660 -3.841 1.00 0.00 C ATOM 896 NE ARG A 58 5.183 3.235 -5.021 1.00 0.00 N ATOM 897 CZ ARG A 58 3.981 3.824 -4.978 1.00 0.00 C ATOM 898 NH1 ARG A 58 3.323 3.920 -3.814 1.00 0.00 N ATOM 899 NH2 ARG A 58 3.436 4.317 -6.098 1.00 0.00 N ATOM 0 H ARG A 58 10.513 1.657 -2.168 1.00 0.00 H new ATOM 0 HA ARG A 58 9.259 0.714 -4.661 1.00 0.00 H new ATOM 0 HB2 ARG A 58 8.213 2.088 -2.462 1.00 0.00 H new ATOM 0 HB3 ARG A 58 8.483 3.362 -3.635 1.00 0.00 H new ATOM 0 HG2 ARG A 58 7.245 1.984 -5.358 1.00 0.00 H new ATOM 0 HG3 ARG A 58 6.908 0.790 -4.120 1.00 0.00 H new ATOM 0 HD2 ARG A 58 5.181 2.020 -3.287 1.00 0.00 H new ATOM 0 HD3 ARG A 58 6.176 3.457 -3.165 1.00 0.00 H new ATOM 0 HE ARG A 58 5.656 3.179 -5.923 1.00 0.00 H new ATOM 0 HH11 ARG A 58 3.738 3.544 -2.961 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.408 4.369 -3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 58 3.936 4.244 -6.984 1.00 0.00 H new ATOM 0 HH22 ARG A 58 2.521 4.766 -6.065 1.00 0.00 H new ATOM 913 N TYR A 59 10.217 2.461 -6.181 1.00 0.00 N ATOM 914 CA TYR A 59 10.952 3.320 -7.094 1.00 0.00 C ATOM 915 C TYR A 59 10.127 3.621 -8.347 1.00 0.00 C ATOM 916 O TYR A 59 9.680 2.704 -9.035 1.00 0.00 O ATOM 917 CB TYR A 59 12.202 2.536 -7.496 1.00 0.00 C ATOM 918 CG TYR A 59 13.272 3.384 -8.187 1.00 0.00 C ATOM 919 CD1 TYR A 59 13.078 3.818 -9.483 1.00 0.00 C ATOM 920 CD2 TYR A 59 14.432 3.714 -7.515 1.00 0.00 C ATOM 921 CE1 TYR A 59 14.085 4.616 -10.133 1.00 0.00 C ATOM 922 CE2 TYR A 59 15.439 4.511 -8.166 1.00 0.00 C ATOM 923 CZ TYR A 59 15.216 4.923 -9.442 1.00 0.00 C ATOM 924 OH TYR A 59 16.167 5.677 -10.057 1.00 0.00 O ATOM 0 H TYR A 59 9.548 1.836 -6.630 1.00 0.00 H new ATOM 0 HA TYR A 59 11.191 4.271 -6.618 1.00 0.00 H new ATOM 0 HB2 TYR A 59 12.634 2.079 -6.606 1.00 0.00 H new ATOM 0 HB3 TYR A 59 11.911 1.724 -8.162 1.00 0.00 H new ATOM 0 HD1 TYR A 59 12.171 3.559 -10.009 1.00 0.00 H new ATOM 0 HD2 TYR A 59 14.584 3.374 -6.501 1.00 0.00 H new ATOM 0 HE1 TYR A 59 13.946 4.963 -11.146 1.00 0.00 H new ATOM 0 HE2 TYR A 59 16.351 4.776 -7.652 1.00 0.00 H new ATOM 0 HH TYR A 59 15.735 6.359 -10.612 1.00 0.00 H new ATOM 934 N ASP A 60 9.951 4.908 -8.607 1.00 0.00 N ATOM 935 CA ASP A 60 9.189 5.340 -9.766 1.00 0.00 C ATOM 936 C ASP A 60 9.332 6.855 -9.929 1.00 0.00 C ATOM 937 O ASP A 60 10.082 7.494 -9.192 1.00 0.00 O ATOM 938 CB ASP A 60 7.702 5.022 -9.596 1.00 0.00 C ATOM 939 CG ASP A 60 7.345 4.258 -8.320 1.00 0.00 C ATOM 940 OD1 ASP A 60 7.885 4.641 -7.260 1.00 0.00 O ATOM 941 OD2 ASP A 60 6.541 3.307 -8.434 1.00 0.00 O ATOM 0 H ASP A 60 10.323 5.666 -8.035 1.00 0.00 H new ATOM 0 HA ASP A 60 9.574 4.813 -10.639 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.142 5.957 -9.610 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.370 4.439 -10.455 1.00 0.00 H new ATOM 947 N VAL A 61 8.603 7.385 -10.900 1.00 0.00 N ATOM 948 CA VAL A 61 8.640 8.812 -11.170 1.00 0.00 C ATOM 949 C VAL A 61 7.249 9.406 -10.940 1.00 0.00 C ATOM 950 O VAL A 61 6.273 8.965 -11.546 1.00 0.00 O ATOM 951 CB VAL A 61 9.172 9.064 -12.582 1.00 0.00 C ATOM 952 CG1 VAL A 61 8.085 8.815 -13.630 1.00 0.00 C ATOM 953 CG2 VAL A 61 9.742 10.478 -12.709 1.00 0.00 C ATOM 0 H VAL A 61 7.983 6.852 -11.510 1.00 0.00 H new ATOM 0 HA VAL A 61 9.325 9.313 -10.485 1.00 0.00 H new ATOM 0 HB VAL A 61 9.982 8.358 -12.765 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.489 9.001 -14.625 1.00 0.00 H new ATOM 0 HG12 VAL A 61 7.746 7.781 -13.564 1.00 0.00 H new ATOM 0 HG13 VAL A 61 7.245 9.485 -13.449 1.00 0.00 H new ATOM 0 HG21 VAL A 61 10.113 10.631 -13.722 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.960 11.206 -12.495 1.00 0.00 H new ATOM 0 HG23 VAL A 61 10.560 10.606 -12.000 1.00 0.00 H new ATOM 963 N ILE A 62 7.201 10.398 -10.063 1.00 0.00 N ATOM 964 CA ILE A 62 5.946 11.057 -9.746 1.00 0.00 C ATOM 965 C ILE A 62 5.730 12.226 -10.710 1.00 0.00 C ATOM 966 O ILE A 62 6.385 13.261 -10.593 1.00 0.00 O ATOM 967 CB ILE A 62 5.911 11.463 -8.271 1.00 0.00 C ATOM 968 CG1 ILE A 62 5.201 10.403 -7.427 1.00 0.00 C ATOM 969 CG2 ILE A 62 5.285 12.848 -8.098 1.00 0.00 C ATOM 970 CD1 ILE A 62 5.880 10.240 -6.066 1.00 0.00 C ATOM 0 H ILE A 62 8.012 10.761 -9.562 1.00 0.00 H new ATOM 0 HA ILE A 62 5.111 10.370 -9.884 1.00 0.00 H new ATOM 0 HB ILE A 62 6.938 11.527 -7.910 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.158 10.685 -7.285 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.205 9.450 -7.956 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.272 13.112 -7.041 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.871 13.584 -8.649 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.265 12.837 -8.481 1.00 0.00 H new ATOM 0 HD11 ILE A 62 5.355 9.481 -5.486 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.916 9.934 -6.211 1.00 0.00 H new ATOM 0 HD13 ILE A 62 5.853 11.189 -5.530 1.00 0.00 H new ATOM 982 N HIS A 63 4.810 12.020 -11.641 1.00 0.00 N ATOM 983 CA HIS A 63 4.500 13.044 -12.625 1.00 0.00 C ATOM 984 C HIS A 63 5.772 13.818 -12.979 1.00 0.00 C ATOM 985 O HIS A 63 5.754 15.045 -13.056 1.00 0.00 O ATOM 986 CB HIS A 63 3.373 13.951 -12.129 1.00 0.00 C ATOM 987 CG HIS A 63 2.028 13.654 -12.748 1.00 0.00 C ATOM 988 ND1 HIS A 63 0.930 13.025 -12.237 1.00 0.00 N flip ATOM 989 CD2 HIS A 63 1.703 14.015 -14.044 1.00 0.00 C flip ATOM 990 CE1 HIS A 63 -0.014 13.006 -13.169 1.00 0.00 C flip ATOM 991 NE2 HIS A 63 0.463 13.619 -14.291 1.00 0.00 N flip ATOM 0 H HIS A 63 4.270 11.160 -11.735 1.00 0.00 H new ATOM 0 HA HIS A 63 4.135 12.576 -13.539 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.293 13.854 -11.046 1.00 0.00 H new ATOM 0 HB3 HIS A 63 3.637 14.988 -12.338 1.00 0.00 H new ATOM 0 HD1 HIS A 63 0.849 12.636 -11.298 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.351 14.532 -14.737 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -0.998 12.576 -13.058 1.00 0.00 H new ATOM 999 N GLY A 64 6.845 13.068 -13.184 1.00 0.00 N ATOM 1000 CA GLY A 64 8.123 13.669 -13.527 1.00 0.00 C ATOM 1001 C GLY A 64 8.918 14.023 -12.269 1.00 0.00 C ATOM 1002 O GLY A 64 9.636 15.021 -12.244 1.00 0.00 O ATOM 0 H GLY A 64 6.856 12.050 -13.119 1.00 0.00 H new ATOM 0 HA2 GLY A 64 8.699 12.979 -14.144 1.00 0.00 H new ATOM 0 HA3 GLY A 64 7.958 14.567 -14.122 1.00 0.00 H new ATOM 1006 N LYS A 65 8.763 13.185 -11.254 1.00 0.00 N ATOM 1007 CA LYS A 65 9.457 13.398 -9.995 1.00 0.00 C ATOM 1008 C LYS A 65 9.947 12.053 -9.455 1.00 0.00 C ATOM 1009 O LYS A 65 9.171 11.292 -8.878 1.00 0.00 O ATOM 1010 CB LYS A 65 8.568 14.167 -9.016 1.00 0.00 C ATOM 1011 CG LYS A 65 9.407 15.069 -8.107 1.00 0.00 C ATOM 1012 CD LYS A 65 9.280 14.642 -6.644 1.00 0.00 C ATOM 1013 CE LYS A 65 10.647 14.625 -5.957 1.00 0.00 C ATOM 1014 NZ LYS A 65 11.137 16.005 -5.743 1.00 0.00 N ATOM 0 H LYS A 65 8.167 12.358 -11.278 1.00 0.00 H new ATOM 0 HA LYS A 65 10.338 14.022 -10.146 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.848 14.770 -9.569 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.996 13.465 -8.410 1.00 0.00 H new ATOM 0 HG2 LYS A 65 10.453 15.028 -8.412 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.084 16.104 -8.217 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.613 15.326 -6.118 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.829 13.651 -6.588 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.574 14.107 -5.001 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.360 14.070 -6.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 12.066 15.975 -5.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 11.226 16.488 -6.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.464 16.523 -5.143 1.00 0.00 H new ATOM 1028 N GLU A 66 11.231 11.800 -9.660 1.00 0.00 N ATOM 1029 CA GLU A 66 11.833 10.560 -9.201 1.00 0.00 C ATOM 1030 C GLU A 66 11.709 10.442 -7.680 1.00 0.00 C ATOM 1031 O GLU A 66 12.337 11.198 -6.942 1.00 0.00 O ATOM 1032 CB GLU A 66 13.295 10.465 -9.641 1.00 0.00 C ATOM 1033 CG GLU A 66 13.405 9.901 -11.059 1.00 0.00 C ATOM 1034 CD GLU A 66 13.465 8.373 -11.039 1.00 0.00 C ATOM 1035 OE1 GLU A 66 12.685 7.785 -10.258 1.00 0.00 O ATOM 1036 OE2 GLU A 66 14.289 7.827 -11.803 1.00 0.00 O ATOM 0 H GLU A 66 11.872 12.433 -10.138 1.00 0.00 H new ATOM 0 HA GLU A 66 11.296 9.727 -9.656 1.00 0.00 H new ATOM 0 HB2 GLU A 66 13.755 11.452 -9.602 1.00 0.00 H new ATOM 0 HB3 GLU A 66 13.846 9.829 -8.949 1.00 0.00 H new ATOM 0 HG2 GLU A 66 12.550 10.227 -11.651 1.00 0.00 H new ATOM 0 HG3 GLU A 66 14.298 10.297 -11.543 1.00 0.00 H new ATOM 1044 N TYR A 67 10.894 9.486 -7.258 1.00 0.00 N ATOM 1045 CA TYR A 67 10.680 9.259 -5.839 1.00 0.00 C ATOM 1046 C TYR A 67 10.903 7.788 -5.479 1.00 0.00 C ATOM 1047 O TYR A 67 10.645 6.901 -6.291 1.00 0.00 O ATOM 1048 CB TYR A 67 9.218 9.620 -5.570 1.00 0.00 C ATOM 1049 CG TYR A 67 8.212 8.639 -6.175 1.00 0.00 C ATOM 1050 CD1 TYR A 67 7.891 8.718 -7.515 1.00 0.00 C ATOM 1051 CD2 TYR A 67 7.627 7.674 -5.382 1.00 0.00 C ATOM 1052 CE1 TYR A 67 6.945 7.794 -8.085 1.00 0.00 C ATOM 1053 CE2 TYR A 67 6.680 6.750 -5.951 1.00 0.00 C ATOM 1054 CZ TYR A 67 6.386 6.856 -7.275 1.00 0.00 C ATOM 1055 OH TYR A 67 5.493 5.983 -7.813 1.00 0.00 O ATOM 0 H TYR A 67 10.374 8.860 -7.874 1.00 0.00 H new ATOM 0 HA TYR A 67 11.374 9.855 -5.246 1.00 0.00 H new ATOM 0 HB2 TYR A 67 9.059 9.669 -4.493 1.00 0.00 H new ATOM 0 HB3 TYR A 67 9.022 10.616 -5.967 1.00 0.00 H new ATOM 0 HD1 TYR A 67 8.349 9.473 -8.136 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.879 7.611 -4.334 1.00 0.00 H new ATOM 0 HE1 TYR A 67 6.685 7.845 -9.132 1.00 0.00 H new ATOM 0 HE2 TYR A 67 6.214 5.991 -5.341 1.00 0.00 H new ATOM 0 HH TYR A 67 5.022 6.414 -8.557 1.00 0.00 H new ATOM 1065 N PHE A 68 11.382 7.576 -4.262 1.00 0.00 N ATOM 1066 CA PHE A 68 11.643 6.229 -3.785 1.00 0.00 C ATOM 1067 C PHE A 68 11.510 6.151 -2.263 1.00 0.00 C ATOM 1068 O PHE A 68 12.301 6.749 -1.536 1.00 0.00 O ATOM 1069 CB PHE A 68 13.082 5.886 -4.178 1.00 0.00 C ATOM 1070 CG PHE A 68 13.934 5.359 -3.022 1.00 0.00 C ATOM 1071 CD1 PHE A 68 13.629 4.167 -2.441 1.00 0.00 C ATOM 1072 CD2 PHE A 68 14.995 6.081 -2.574 1.00 0.00 C ATOM 1073 CE1 PHE A 68 14.419 3.678 -1.368 1.00 0.00 C ATOM 1074 CE2 PHE A 68 15.786 5.592 -1.501 1.00 0.00 C ATOM 1075 CZ PHE A 68 15.481 4.400 -0.921 1.00 0.00 C ATOM 0 H PHE A 68 11.596 8.315 -3.592 1.00 0.00 H new ATOM 0 HA PHE A 68 10.926 5.534 -4.222 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.063 5.139 -4.972 1.00 0.00 H new ATOM 0 HB3 PHE A 68 13.557 6.776 -4.590 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.786 3.593 -2.796 1.00 0.00 H new ATOM 0 HD2 PHE A 68 15.237 7.027 -3.035 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.177 2.732 -0.906 1.00 0.00 H new ATOM 0 HE2 PHE A 68 16.629 6.166 -1.146 1.00 0.00 H new ATOM 0 HZ PHE A 68 16.082 4.027 -0.105 1.00 0.00 H new ATOM 1085 N MET A 69 10.504 5.408 -1.827 1.00 0.00 N ATOM 1086 CA MET A 69 10.257 5.243 -0.404 1.00 0.00 C ATOM 1087 C MET A 69 10.335 3.769 -0.001 1.00 0.00 C ATOM 1088 O MET A 69 9.620 2.933 -0.551 1.00 0.00 O ATOM 1089 CB MET A 69 8.873 5.795 -0.059 1.00 0.00 C ATOM 1090 CG MET A 69 8.809 6.242 1.403 1.00 0.00 C ATOM 1091 SD MET A 69 7.110 6.322 1.944 1.00 0.00 S ATOM 1092 CE MET A 69 6.977 8.069 2.289 1.00 0.00 C ATOM 0 H MET A 69 9.850 4.913 -2.434 1.00 0.00 H new ATOM 0 HA MET A 69 11.023 5.791 0.145 1.00 0.00 H new ATOM 0 HB2 MET A 69 8.641 6.637 -0.711 1.00 0.00 H new ATOM 0 HB3 MET A 69 8.117 5.032 -0.243 1.00 0.00 H new ATOM 0 HG2 MET A 69 9.366 5.545 2.029 1.00 0.00 H new ATOM 0 HG3 MET A 69 9.281 7.218 1.514 1.00 0.00 H new ATOM 0 HE1 MET A 69 5.960 8.301 2.607 1.00 0.00 H new ATOM 0 HE2 MET A 69 7.675 8.337 3.082 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.214 8.637 1.389 1.00 0.00 H new ATOM 1102 N GLU A 70 11.209 3.496 0.956 1.00 0.00 N ATOM 1103 CA GLU A 70 11.389 2.138 1.440 1.00 0.00 C ATOM 1104 C GLU A 70 10.686 1.956 2.786 1.00 0.00 C ATOM 1105 O GLU A 70 10.315 2.933 3.434 1.00 0.00 O ATOM 1106 CB GLU A 70 12.874 1.786 1.545 1.00 0.00 C ATOM 1107 CG GLU A 70 13.667 2.933 2.175 1.00 0.00 C ATOM 1108 CD GLU A 70 14.843 2.401 2.996 1.00 0.00 C ATOM 1109 OE1 GLU A 70 14.867 2.697 4.210 1.00 0.00 O ATOM 1110 OE2 GLU A 70 15.691 1.710 2.391 1.00 0.00 O ATOM 0 H GLU A 70 11.801 4.192 1.410 1.00 0.00 H new ATOM 0 HA GLU A 70 10.937 1.454 0.721 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.996 0.883 2.144 1.00 0.00 H new ATOM 0 HB3 GLU A 70 13.270 1.567 0.554 1.00 0.00 H new ATOM 0 HG2 GLU A 70 14.036 3.597 1.393 1.00 0.00 H new ATOM 0 HG3 GLU A 70 13.012 3.525 2.814 1.00 0.00 H new ATOM 1118 N GLY A 71 10.524 0.697 3.168 1.00 0.00 N ATOM 1119 CA GLY A 71 9.872 0.375 4.426 1.00 0.00 C ATOM 1120 C GLY A 71 9.850 -1.137 4.660 1.00 0.00 C ATOM 1121 O GLY A 71 10.480 -1.893 3.922 1.00 0.00 O ATOM 0 H GLY A 71 10.833 -0.112 2.628 1.00 0.00 H new ATOM 0 HA2 GLY A 71 10.395 0.866 5.247 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.853 0.761 4.421 1.00 0.00 H new ATOM 1125 N THR A 72 9.117 -1.533 5.690 1.00 0.00 N ATOM 1126 CA THR A 72 9.004 -2.942 6.031 1.00 0.00 C ATOM 1127 C THR A 72 7.587 -3.262 6.511 1.00 0.00 C ATOM 1128 O THR A 72 6.958 -2.449 7.186 1.00 0.00 O ATOM 1129 CB THR A 72 10.084 -3.266 7.065 1.00 0.00 C ATOM 1130 OG1 THR A 72 9.687 -4.526 7.598 1.00 0.00 O ATOM 1131 CG2 THR A 72 10.044 -2.323 8.269 1.00 0.00 C ATOM 0 H THR A 72 8.595 -0.903 6.300 1.00 0.00 H new ATOM 0 HA THR A 72 9.169 -3.575 5.159 1.00 0.00 H new ATOM 0 HB THR A 72 11.065 -3.211 6.594 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.121 -4.666 8.466 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.831 -2.597 8.972 1.00 0.00 H new ATOM 0 HG22 THR A 72 10.198 -1.298 7.933 1.00 0.00 H new ATOM 0 HG23 THR A 72 9.074 -2.402 8.761 1.00 0.00 H new ATOM 1139 N ALA A 73 7.127 -4.449 6.144 1.00 0.00 N ATOM 1140 CA ALA A 73 5.796 -4.887 6.528 1.00 0.00 C ATOM 1141 C ALA A 73 5.905 -5.875 7.692 1.00 0.00 C ATOM 1142 O ALA A 73 6.658 -6.845 7.619 1.00 0.00 O ATOM 1143 CB ALA A 73 5.087 -5.492 5.315 1.00 0.00 C ATOM 0 H ALA A 73 7.652 -5.121 5.585 1.00 0.00 H new ATOM 0 HA ALA A 73 5.197 -4.042 6.867 1.00 0.00 H new ATOM 0 HB1 ALA A 73 4.089 -5.820 5.604 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.009 -4.742 4.528 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.658 -6.345 4.948 1.00 0.00 H new ATOM 1149 N TYR A 74 5.143 -5.593 8.739 1.00 0.00 N ATOM 1150 CA TYR A 74 5.145 -6.445 9.916 1.00 0.00 C ATOM 1151 C TYR A 74 3.757 -6.496 10.558 1.00 0.00 C ATOM 1152 O TYR A 74 2.998 -5.531 10.481 1.00 0.00 O ATOM 1153 CB TYR A 74 6.126 -5.802 10.899 1.00 0.00 C ATOM 1154 CG TYR A 74 6.229 -6.531 12.241 1.00 0.00 C ATOM 1155 CD1 TYR A 74 5.297 -6.290 13.230 1.00 0.00 C ATOM 1156 CD2 TYR A 74 7.253 -7.429 12.461 1.00 0.00 C ATOM 1157 CE1 TYR A 74 5.395 -6.975 14.493 1.00 0.00 C ATOM 1158 CE2 TYR A 74 7.350 -8.115 13.724 1.00 0.00 C ATOM 1159 CZ TYR A 74 6.416 -7.854 14.677 1.00 0.00 C ATOM 1160 OH TYR A 74 6.508 -8.502 15.870 1.00 0.00 O ATOM 0 H TYR A 74 4.521 -4.787 8.797 1.00 0.00 H new ATOM 0 HA TYR A 74 5.425 -7.465 9.652 1.00 0.00 H new ATOM 0 HB2 TYR A 74 7.114 -5.766 10.440 1.00 0.00 H new ATOM 0 HB3 TYR A 74 5.821 -4.771 11.079 1.00 0.00 H new ATOM 0 HD1 TYR A 74 4.495 -5.588 13.057 1.00 0.00 H new ATOM 0 HD2 TYR A 74 7.982 -7.618 11.687 1.00 0.00 H new ATOM 0 HE1 TYR A 74 4.674 -6.795 15.276 1.00 0.00 H new ATOM 0 HE2 TYR A 74 8.146 -8.820 13.910 1.00 0.00 H new ATOM 0 HH TYR A 74 7.285 -9.099 15.859 1.00 0.00 H new ATOM 1170 N PRO A 75 3.461 -7.661 11.194 1.00 0.00 N ATOM 1171 CA PRO A 75 2.178 -7.850 11.849 1.00 0.00 C ATOM 1172 C PRO A 75 2.115 -7.075 13.166 1.00 0.00 C ATOM 1173 O PRO A 75 2.918 -7.311 14.068 1.00 0.00 O ATOM 1174 CB PRO A 75 2.050 -9.353 12.037 1.00 0.00 C ATOM 1175 CG PRO A 75 3.458 -9.911 11.906 1.00 0.00 C ATOM 1176 CD PRO A 75 4.336 -8.824 11.305 1.00 0.00 C ATOM 0 HA PRO A 75 1.345 -7.463 11.262 1.00 0.00 H new ATOM 0 HB2 PRO A 75 1.625 -9.590 13.013 1.00 0.00 H new ATOM 0 HB3 PRO A 75 1.387 -9.785 11.287 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.840 -10.215 12.880 1.00 0.00 H new ATOM 0 HG3 PRO A 75 3.460 -10.797 11.272 1.00 0.00 H new ATOM 0 HD2 PRO A 75 5.196 -8.613 11.940 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.724 -9.122 10.331 1.00 0.00 H new ATOM 1184 N VAL A 76 1.153 -6.166 13.236 1.00 0.00 N ATOM 1185 CA VAL A 76 0.975 -5.355 14.429 1.00 0.00 C ATOM 1186 C VAL A 76 0.638 -6.264 15.613 1.00 0.00 C ATOM 1187 O VAL A 76 1.270 -6.180 16.664 1.00 0.00 O ATOM 1188 CB VAL A 76 -0.086 -4.282 14.178 1.00 0.00 C ATOM 1189 CG1 VAL A 76 -1.096 -4.231 15.326 1.00 0.00 C ATOM 1190 CG2 VAL A 76 0.561 -2.913 13.955 1.00 0.00 C ATOM 0 H VAL A 76 0.489 -5.973 12.486 1.00 0.00 H new ATOM 0 HA VAL A 76 1.898 -4.830 14.675 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.625 -4.550 13.269 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.839 -3.460 15.123 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.591 -5.198 15.418 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.578 -3.999 16.256 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -0.215 -2.168 13.779 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.137 -2.635 14.837 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.222 -2.960 13.090 1.00 0.00 H new ATOM 1200 N GLY A 77 -0.358 -7.112 15.402 1.00 0.00 N ATOM 1201 CA GLY A 77 -0.787 -8.035 16.438 1.00 0.00 C ATOM 1202 C GLY A 77 -0.671 -9.485 15.964 1.00 0.00 C ATOM 1203 O GLY A 77 0.391 -9.911 15.512 1.00 0.00 O ATOM 0 H GLY A 77 -0.880 -7.179 14.528 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.180 -7.891 17.332 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -1.819 -7.821 16.716 1.00 0.00 H new ATOM 1207 N ASP A 78 -1.778 -10.204 16.082 1.00 0.00 N ATOM 1208 CA ASP A 78 -1.813 -11.597 15.671 1.00 0.00 C ATOM 1209 C ASP A 78 -1.120 -11.742 14.315 1.00 0.00 C ATOM 1210 O ASP A 78 -1.591 -11.208 13.312 1.00 0.00 O ATOM 1211 CB ASP A 78 -3.254 -12.090 15.520 1.00 0.00 C ATOM 1212 CG ASP A 78 -3.681 -13.156 16.531 1.00 0.00 C ATOM 1213 OD1 ASP A 78 -4.072 -12.755 17.648 1.00 0.00 O ATOM 1214 OD2 ASP A 78 -3.608 -14.349 16.163 1.00 0.00 O ATOM 0 H ASP A 78 -2.657 -9.848 16.456 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.307 -12.187 16.435 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.926 -11.236 15.609 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.381 -12.492 14.515 1.00 0.00 H new ATOM 1220 N SER A 79 -0.011 -12.466 14.328 1.00 0.00 N ATOM 1221 CA SER A 79 0.753 -12.688 13.112 1.00 0.00 C ATOM 1222 C SER A 79 -0.185 -13.085 11.970 1.00 0.00 C ATOM 1223 O SER A 79 -0.077 -12.562 10.862 1.00 0.00 O ATOM 1224 CB SER A 79 1.820 -13.764 13.320 1.00 0.00 C ATOM 1225 OG SER A 79 1.255 -15.002 13.744 1.00 0.00 O ATOM 0 H SER A 79 0.377 -12.907 15.162 1.00 0.00 H new ATOM 0 HA SER A 79 1.259 -11.758 12.852 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.368 -13.915 12.390 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.541 -13.421 14.063 1.00 0.00 H new ATOM 0 HG SER A 79 1.968 -15.663 13.864 1.00 0.00 H new ATOM 1231 N LYS A 80 -1.085 -14.007 12.280 1.00 0.00 N ATOM 1232 CA LYS A 80 -2.042 -14.480 11.294 1.00 0.00 C ATOM 1233 C LYS A 80 -2.824 -13.289 10.736 1.00 0.00 C ATOM 1234 O LYS A 80 -2.558 -12.833 9.624 1.00 0.00 O ATOM 1235 CB LYS A 80 -2.930 -15.574 11.890 1.00 0.00 C ATOM 1236 CG LYS A 80 -2.113 -16.825 12.219 1.00 0.00 C ATOM 1237 CD LYS A 80 -2.155 -17.128 13.718 1.00 0.00 C ATOM 1238 CE LYS A 80 -3.519 -17.689 14.126 1.00 0.00 C ATOM 1239 NZ LYS A 80 -3.903 -17.194 15.467 1.00 0.00 N ATOM 0 H LYS A 80 -1.172 -14.439 13.200 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.525 -14.944 10.454 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.413 -15.203 12.794 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -3.723 -15.828 11.186 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.504 -17.676 11.661 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -1.080 -16.683 11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -1.373 -17.844 13.970 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.948 -16.219 14.282 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -4.272 -17.397 13.395 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.484 -18.778 14.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.909 -17.397 15.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -3.326 -17.669 16.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -3.744 -16.167 15.517 1.00 0.00 H new ATOM 1253 N ILE A 81 -3.772 -12.819 11.532 1.00 0.00 N ATOM 1254 CA ILE A 81 -4.595 -11.690 11.132 1.00 0.00 C ATOM 1255 C ILE A 81 -3.718 -10.648 10.435 1.00 0.00 C ATOM 1256 O ILE A 81 -2.513 -10.585 10.675 1.00 0.00 O ATOM 1257 CB ILE A 81 -5.370 -11.140 12.331 1.00 0.00 C ATOM 1258 CG1 ILE A 81 -6.853 -11.504 12.239 1.00 0.00 C ATOM 1259 CG2 ILE A 81 -5.157 -9.632 12.476 1.00 0.00 C ATOM 1260 CD1 ILE A 81 -7.042 -13.019 12.152 1.00 0.00 C ATOM 0 H ILE A 81 -3.989 -13.200 12.453 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.350 -12.005 10.412 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.980 -11.608 13.235 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.381 -11.118 13.111 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -7.294 -11.028 11.363 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.719 -9.266 13.336 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.096 -9.427 12.621 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.504 -9.127 11.574 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -8.105 -13.250 12.088 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -6.534 -13.399 11.266 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.622 -13.490 13.041 1.00 0.00 H new ATOM 1272 N GLY A 82 -4.357 -9.856 9.586 1.00 0.00 N ATOM 1273 CA GLY A 82 -3.650 -8.820 8.853 1.00 0.00 C ATOM 1274 C GLY A 82 -2.898 -7.889 9.807 1.00 0.00 C ATOM 1275 O GLY A 82 -1.856 -8.257 10.346 1.00 0.00 O ATOM 0 H GLY A 82 -5.356 -9.911 9.390 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.947 -9.277 8.156 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.358 -8.243 8.258 1.00 0.00 H new ATOM 1279 N LYS A 83 -3.457 -6.701 9.987 1.00 0.00 N ATOM 1280 CA LYS A 83 -2.853 -5.715 10.866 1.00 0.00 C ATOM 1281 C LYS A 83 -1.349 -5.648 10.593 1.00 0.00 C ATOM 1282 O LYS A 83 -0.541 -5.814 11.506 1.00 0.00 O ATOM 1283 CB LYS A 83 -3.201 -6.014 12.326 1.00 0.00 C ATOM 1284 CG LYS A 83 -3.667 -4.749 13.049 1.00 0.00 C ATOM 1285 CD LYS A 83 -5.086 -4.920 13.594 1.00 0.00 C ATOM 1286 CE LYS A 83 -5.565 -3.643 14.288 1.00 0.00 C ATOM 1287 NZ LYS A 83 -7.025 -3.699 14.525 1.00 0.00 N ATOM 0 H LYS A 83 -4.322 -6.399 9.539 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.258 -4.724 10.663 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.984 -6.771 12.369 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.330 -6.427 12.834 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.984 -4.521 13.868 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.637 -3.902 12.364 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.765 -5.171 12.779 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -5.111 -5.752 14.298 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -5.041 -3.519 15.236 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -5.323 -2.776 13.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -7.334 -2.825 14.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -7.521 -3.796 13.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.248 -4.516 15.129 1.00 0.00 H new ATOM 1301 N ILE A 84 -1.019 -5.405 9.334 1.00 0.00 N ATOM 1302 CA ILE A 84 0.374 -5.314 8.929 1.00 0.00 C ATOM 1303 C ILE A 84 0.740 -3.846 8.701 1.00 0.00 C ATOM 1304 O ILE A 84 0.324 -3.246 7.711 1.00 0.00 O ATOM 1305 CB ILE A 84 0.640 -6.209 7.718 1.00 0.00 C ATOM 1306 CG1 ILE A 84 -0.416 -7.311 7.608 1.00 0.00 C ATOM 1307 CG2 ILE A 84 2.060 -6.778 7.757 1.00 0.00 C ATOM 1308 CD1 ILE A 84 -1.640 -6.823 6.831 1.00 0.00 C ATOM 0 H ILE A 84 -1.692 -5.268 8.580 1.00 0.00 H new ATOM 0 HA ILE A 84 1.025 -5.686 9.720 1.00 0.00 H new ATOM 0 HB ILE A 84 0.563 -5.598 6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.012 -8.181 7.110 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.718 -7.631 8.605 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.223 -7.411 6.884 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.780 -5.960 7.751 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.190 -7.369 8.663 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.375 -7.626 6.768 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.080 -5.968 7.345 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.339 -6.527 5.826 1.00 0.00 H new ATOM 1320 N TYR A 85 1.514 -3.310 9.633 1.00 0.00 N ATOM 1321 CA TYR A 85 1.940 -1.924 9.546 1.00 0.00 C ATOM 1322 C TYR A 85 3.217 -1.794 8.714 1.00 0.00 C ATOM 1323 O TYR A 85 4.105 -2.642 8.796 1.00 0.00 O ATOM 1324 CB TYR A 85 2.234 -1.482 10.981 1.00 0.00 C ATOM 1325 CG TYR A 85 3.677 -1.728 11.425 1.00 0.00 C ATOM 1326 CD1 TYR A 85 4.673 -0.846 11.054 1.00 0.00 C ATOM 1327 CD2 TYR A 85 3.984 -2.831 12.195 1.00 0.00 C ATOM 1328 CE1 TYR A 85 6.031 -1.078 11.472 1.00 0.00 C ATOM 1329 CE2 TYR A 85 5.343 -3.062 12.613 1.00 0.00 C ATOM 1330 CZ TYR A 85 6.299 -2.174 12.230 1.00 0.00 C ATOM 1331 OH TYR A 85 7.582 -2.393 12.625 1.00 0.00 O ATOM 0 H TYR A 85 1.857 -3.811 10.453 1.00 0.00 H new ATOM 0 HA TYR A 85 1.171 -1.316 9.070 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.012 -0.419 11.075 1.00 0.00 H new ATOM 0 HB3 TYR A 85 1.562 -2.009 11.658 1.00 0.00 H new ATOM 0 HD1 TYR A 85 4.433 0.017 10.451 1.00 0.00 H new ATOM 0 HD2 TYR A 85 3.205 -3.521 12.484 1.00 0.00 H new ATOM 0 HE1 TYR A 85 6.819 -0.396 11.189 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.597 -3.921 13.217 1.00 0.00 H new ATOM 0 HH TYR A 85 7.624 -3.212 13.161 1.00 0.00 H new ATOM 1341 N HIS A 86 3.270 -0.726 7.932 1.00 0.00 N ATOM 1342 CA HIS A 86 4.424 -0.475 7.085 1.00 0.00 C ATOM 1343 C HIS A 86 5.150 0.782 7.568 1.00 0.00 C ATOM 1344 O HIS A 86 4.544 1.846 7.689 1.00 0.00 O ATOM 1345 CB HIS A 86 4.010 -0.393 5.614 1.00 0.00 C ATOM 1346 CG HIS A 86 4.889 0.508 4.779 1.00 0.00 C ATOM 1347 ND1 HIS A 86 5.057 1.861 4.804 1.00 0.00 N flip ATOM 1348 CD2 HIS A 86 5.718 0.030 3.779 1.00 0.00 C flip ATOM 1349 CE1 HIS A 86 5.942 2.192 3.872 1.00 0.00 C flip ATOM 1350 NE2 HIS A 86 6.353 1.057 3.235 1.00 0.00 N flip ATOM 0 H HIS A 86 2.533 -0.024 7.867 1.00 0.00 H new ATOM 0 HA HIS A 86 5.123 -1.308 7.159 1.00 0.00 H new ATOM 0 HB2 HIS A 86 4.024 -1.396 5.186 1.00 0.00 H new ATOM 0 HB3 HIS A 86 2.982 -0.036 5.556 1.00 0.00 H new ATOM 0 HD1 HIS A 86 4.583 2.509 5.433 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.828 -1.005 3.491 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.281 3.194 3.654 1.00 0.00 H new ATOM 1358 N SER A 87 6.438 0.618 7.830 1.00 0.00 N ATOM 1359 CA SER A 87 7.254 1.726 8.297 1.00 0.00 C ATOM 1360 C SER A 87 7.742 2.555 7.107 1.00 0.00 C ATOM 1361 O SER A 87 8.297 2.011 6.154 1.00 0.00 O ATOM 1362 CB SER A 87 8.443 1.227 9.120 1.00 0.00 C ATOM 1363 OG SER A 87 8.593 1.952 10.337 1.00 0.00 O ATOM 0 H SER A 87 6.937 -0.266 7.728 1.00 0.00 H new ATOM 0 HA SER A 87 6.640 2.354 8.942 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.310 0.168 9.343 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.355 1.317 8.530 1.00 0.00 H new ATOM 0 HG SER A 87 9.362 1.602 10.834 1.00 0.00 H new ATOM 1369 N ARG A 88 7.518 3.857 7.201 1.00 0.00 N ATOM 1370 CA ARG A 88 7.928 4.766 6.144 1.00 0.00 C ATOM 1371 C ARG A 88 8.839 5.858 6.707 1.00 0.00 C ATOM 1372 O ARG A 88 8.375 6.766 7.394 1.00 0.00 O ATOM 1373 CB ARG A 88 6.715 5.417 5.477 1.00 0.00 C ATOM 1374 CG ARG A 88 5.767 6.010 6.521 1.00 0.00 C ATOM 1375 CD ARG A 88 5.351 7.432 6.139 1.00 0.00 C ATOM 1376 NE ARG A 88 5.828 8.391 7.160 1.00 0.00 N ATOM 1377 CZ ARG A 88 5.528 9.697 7.163 1.00 0.00 C ATOM 1378 NH1 ARG A 88 4.751 10.208 6.198 1.00 0.00 N ATOM 1379 NH2 ARG A 88 6.006 10.492 8.129 1.00 0.00 N ATOM 0 H ARG A 88 7.058 4.305 7.993 1.00 0.00 H new ATOM 0 HA ARG A 88 8.470 4.185 5.398 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.047 6.200 4.796 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.185 4.677 4.878 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.882 5.381 6.613 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.254 6.019 7.496 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.764 7.691 5.164 1.00 0.00 H new ATOM 0 HD3 ARG A 88 4.266 7.491 6.051 1.00 0.00 H new ATOM 0 HE ARG A 88 6.423 8.036 7.909 1.00 0.00 H new ATOM 0 HH11 ARG A 88 4.388 9.603 5.461 1.00 0.00 H new ATOM 0 HH12 ARG A 88 4.523 11.202 6.200 1.00 0.00 H new ATOM 0 HH21 ARG A 88 6.599 10.103 8.863 1.00 0.00 H new ATOM 0 HH22 ARG A 88 5.778 11.486 8.131 1.00 0.00 H new ATOM 1393 N THR A 89 10.121 5.733 6.395 1.00 0.00 N ATOM 1394 CA THR A 89 11.102 6.699 6.861 1.00 0.00 C ATOM 1395 C THR A 89 11.161 7.899 5.914 1.00 0.00 C ATOM 1396 O THR A 89 10.923 7.760 4.715 1.00 0.00 O ATOM 1397 CB THR A 89 12.442 5.976 7.012 1.00 0.00 C ATOM 1398 OG1 THR A 89 12.463 5.054 5.925 1.00 0.00 O ATOM 1399 CG2 THR A 89 12.492 5.087 8.256 1.00 0.00 C ATOM 0 H THR A 89 10.503 4.978 5.826 1.00 0.00 H new ATOM 0 HA THR A 89 10.825 7.107 7.833 1.00 0.00 H new ATOM 0 HB THR A 89 13.247 6.710 7.059 1.00 0.00 H new ATOM 0 HG1 THR A 89 13.299 4.543 5.945 1.00 0.00 H new ATOM 0 HG21 THR A 89 13.464 4.598 8.315 1.00 0.00 H new ATOM 0 HG22 THR A 89 12.339 5.697 9.146 1.00 0.00 H new ATOM 0 HG23 THR A 89 11.709 4.331 8.195 1.00 0.00 H new ATOM 1407 N VAL A 90 11.480 9.050 6.488 1.00 0.00 N ATOM 1408 CA VAL A 90 11.574 10.273 5.709 1.00 0.00 C ATOM 1409 C VAL A 90 12.603 11.204 6.353 1.00 0.00 C ATOM 1410 O VAL A 90 12.284 11.936 7.289 1.00 0.00 O ATOM 1411 CB VAL A 90 10.191 10.914 5.573 1.00 0.00 C ATOM 1412 CG1 VAL A 90 10.303 12.362 5.094 1.00 0.00 C ATOM 1413 CG2 VAL A 90 9.297 10.095 4.639 1.00 0.00 C ATOM 0 H VAL A 90 11.676 9.161 7.483 1.00 0.00 H new ATOM 0 HA VAL A 90 11.918 10.057 4.698 1.00 0.00 H new ATOM 0 HB VAL A 90 9.727 10.922 6.559 1.00 0.00 H new ATOM 0 HG11 VAL A 90 9.306 12.794 5.006 1.00 0.00 H new ATOM 0 HG12 VAL A 90 10.886 12.939 5.812 1.00 0.00 H new ATOM 0 HG13 VAL A 90 10.797 12.387 4.122 1.00 0.00 H new ATOM 0 HG21 VAL A 90 8.320 10.572 4.560 1.00 0.00 H new ATOM 0 HG22 VAL A 90 9.756 10.041 3.652 1.00 0.00 H new ATOM 0 HG23 VAL A 90 9.178 9.088 5.040 1.00 0.00 H new ATOM 1423 N GLY A 91 13.817 11.147 5.825 1.00 0.00 N ATOM 1424 CA GLY A 91 14.895 11.976 6.337 1.00 0.00 C ATOM 1425 C GLY A 91 15.083 11.765 7.840 1.00 0.00 C ATOM 1426 O GLY A 91 15.784 10.845 8.259 1.00 0.00 O ATOM 0 H GLY A 91 14.078 10.540 5.048 1.00 0.00 H new ATOM 0 HA2 GLY A 91 15.821 11.738 5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 91 14.677 13.025 6.138 1.00 0.00 H new ATOM 1430 N GLY A 92 14.445 12.633 8.612 1.00 0.00 N ATOM 1431 CA GLY A 92 14.533 12.554 10.060 1.00 0.00 C ATOM 1432 C GLY A 92 13.143 12.423 10.687 1.00 0.00 C ATOM 1433 O GLY A 92 12.888 12.970 11.758 1.00 0.00 O ATOM 0 H GLY A 92 13.865 13.395 8.261 1.00 0.00 H new ATOM 0 HA2 GLY A 92 15.146 11.699 10.345 1.00 0.00 H new ATOM 0 HA3 GLY A 92 15.028 13.445 10.447 1.00 0.00 H new ATOM 1437 N TYR A 93 12.282 11.694 9.993 1.00 0.00 N ATOM 1438 CA TYR A 93 10.925 11.484 10.468 1.00 0.00 C ATOM 1439 C TYR A 93 10.451 10.062 10.164 1.00 0.00 C ATOM 1440 O TYR A 93 10.013 9.774 9.051 1.00 0.00 O ATOM 1441 CB TYR A 93 10.050 12.476 9.698 1.00 0.00 C ATOM 1442 CG TYR A 93 9.006 13.185 10.563 1.00 0.00 C ATOM 1443 CD1 TYR A 93 9.407 13.991 11.609 1.00 0.00 C ATOM 1444 CD2 TYR A 93 7.662 13.019 10.296 1.00 0.00 C ATOM 1445 CE1 TYR A 93 8.424 14.659 12.422 1.00 0.00 C ATOM 1446 CE2 TYR A 93 6.679 13.687 11.109 1.00 0.00 C ATOM 1447 CZ TYR A 93 7.109 14.474 12.132 1.00 0.00 C ATOM 1448 OH TYR A 93 6.180 15.105 12.900 1.00 0.00 O ATOM 0 H TYR A 93 12.498 11.241 9.105 1.00 0.00 H new ATOM 0 HA TYR A 93 10.870 11.628 11.547 1.00 0.00 H new ATOM 0 HB2 TYR A 93 10.691 13.225 9.233 1.00 0.00 H new ATOM 0 HB3 TYR A 93 9.541 11.947 8.892 1.00 0.00 H new ATOM 0 HD1 TYR A 93 10.459 14.121 11.818 1.00 0.00 H new ATOM 0 HD2 TYR A 93 7.348 12.388 9.478 1.00 0.00 H new ATOM 0 HE1 TYR A 93 8.725 15.293 13.243 1.00 0.00 H new ATOM 0 HE2 TYR A 93 5.624 13.566 10.911 1.00 0.00 H new ATOM 0 HH TYR A 93 5.282 14.882 12.577 1.00 0.00 H new ATOM 1458 N THR A 94 10.554 9.209 11.173 1.00 0.00 N ATOM 1459 CA THR A 94 10.142 7.824 11.027 1.00 0.00 C ATOM 1460 C THR A 94 8.836 7.573 11.785 1.00 0.00 C ATOM 1461 O THR A 94 8.748 7.843 12.981 1.00 0.00 O ATOM 1462 CB THR A 94 11.296 6.935 11.495 1.00 0.00 C ATOM 1463 OG1 THR A 94 12.329 7.179 10.545 1.00 0.00 O ATOM 1464 CG2 THR A 94 10.988 5.444 11.337 1.00 0.00 C ATOM 0 H THR A 94 10.917 9.451 12.095 1.00 0.00 H new ATOM 0 HA THR A 94 9.929 7.583 9.986 1.00 0.00 H new ATOM 0 HB THR A 94 11.520 7.150 12.540 1.00 0.00 H new ATOM 0 HG1 THR A 94 13.128 6.668 10.792 1.00 0.00 H new ATOM 0 HG21 THR A 94 11.839 4.858 11.684 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.108 5.190 11.928 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.797 5.221 10.287 1.00 0.00 H new ATOM 1472 N LYS A 95 7.856 7.061 11.056 1.00 0.00 N ATOM 1473 CA LYS A 95 6.559 6.771 11.644 1.00 0.00 C ATOM 1474 C LYS A 95 6.097 5.384 11.193 1.00 0.00 C ATOM 1475 O LYS A 95 6.339 4.985 10.055 1.00 0.00 O ATOM 1476 CB LYS A 95 5.563 7.886 11.320 1.00 0.00 C ATOM 1477 CG LYS A 95 6.043 9.229 11.874 1.00 0.00 C ATOM 1478 CD LYS A 95 5.562 9.434 13.312 1.00 0.00 C ATOM 1479 CE LYS A 95 6.023 10.787 13.857 1.00 0.00 C ATOM 1480 NZ LYS A 95 5.197 11.186 15.019 1.00 0.00 N ATOM 0 H LYS A 95 7.934 6.839 10.063 1.00 0.00 H new ATOM 0 HA LYS A 95 6.631 6.745 12.731 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.433 7.960 10.240 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.588 7.642 11.743 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.132 9.271 11.842 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.674 10.039 11.245 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.474 9.375 13.347 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.945 8.633 13.945 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.071 10.729 14.151 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.952 11.544 13.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 5.523 12.106 15.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.201 11.261 14.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 5.286 10.472 15.770 1.00 0.00 H new ATOM 1494 N LYS A 96 5.442 4.687 12.109 1.00 0.00 N ATOM 1495 CA LYS A 96 4.944 3.352 11.820 1.00 0.00 C ATOM 1496 C LYS A 96 3.479 3.442 11.388 1.00 0.00 C ATOM 1497 O LYS A 96 2.606 3.747 12.199 1.00 0.00 O ATOM 1498 CB LYS A 96 5.178 2.423 13.013 1.00 0.00 C ATOM 1499 CG LYS A 96 6.632 2.490 13.483 1.00 0.00 C ATOM 1500 CD LYS A 96 7.119 1.118 13.954 1.00 0.00 C ATOM 1501 CE LYS A 96 7.086 1.019 15.480 1.00 0.00 C ATOM 1502 NZ LYS A 96 8.372 1.470 16.058 1.00 0.00 N ATOM 0 H LYS A 96 5.244 5.021 13.052 1.00 0.00 H new ATOM 0 HA LYS A 96 5.495 2.911 10.990 1.00 0.00 H new ATOM 0 HB2 LYS A 96 4.514 2.702 13.831 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.929 1.399 12.735 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.265 2.845 12.670 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.723 3.211 14.296 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.493 0.338 13.522 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.134 0.946 13.597 1.00 0.00 H new ATOM 0 HE2 LYS A 96 6.271 1.628 15.872 1.00 0.00 H new ATOM 0 HE3 LYS A 96 6.887 -0.010 15.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 8.332 1.396 17.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 9.143 0.872 15.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 8.546 2.459 15.788 1.00 0.00 H new ATOM 1516 N THR A 97 3.255 3.169 10.111 1.00 0.00 N ATOM 1517 CA THR A 97 1.910 3.215 9.561 1.00 0.00 C ATOM 1518 C THR A 97 1.261 1.831 9.624 1.00 0.00 C ATOM 1519 O THR A 97 1.893 0.829 9.292 1.00 0.00 O ATOM 1520 CB THR A 97 1.999 3.781 8.142 1.00 0.00 C ATOM 1521 OG1 THR A 97 2.615 5.054 8.314 1.00 0.00 O ATOM 1522 CG2 THR A 97 0.624 4.109 7.556 1.00 0.00 C ATOM 0 H THR A 97 3.981 2.915 9.441 1.00 0.00 H new ATOM 0 HA THR A 97 1.264 3.869 10.147 1.00 0.00 H new ATOM 0 HB THR A 97 2.508 3.065 7.497 1.00 0.00 H new ATOM 0 HG1 THR A 97 2.713 5.490 7.442 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.743 4.507 6.548 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.019 3.203 7.519 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.129 4.851 8.183 1.00 0.00 H new ATOM 1530 N VAL A 98 0.007 1.820 10.051 1.00 0.00 N ATOM 1531 CA VAL A 98 -0.735 0.575 10.162 1.00 0.00 C ATOM 1532 C VAL A 98 -1.593 0.386 8.910 1.00 0.00 C ATOM 1533 O VAL A 98 -2.390 1.255 8.562 1.00 0.00 O ATOM 1534 CB VAL A 98 -1.552 0.566 11.455 1.00 0.00 C ATOM 1535 CG1 VAL A 98 -2.457 -0.666 11.523 1.00 0.00 C ATOM 1536 CG2 VAL A 98 -0.640 0.646 12.681 1.00 0.00 C ATOM 0 H VAL A 98 -0.514 2.653 10.324 1.00 0.00 H new ATOM 0 HA VAL A 98 -0.053 -0.273 10.220 1.00 0.00 H new ATOM 0 HB VAL A 98 -2.190 1.450 11.455 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -3.027 -0.648 12.452 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -3.143 -0.661 10.676 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.846 -1.568 11.489 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -1.246 0.638 13.587 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.035 -0.210 12.689 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -0.058 1.567 12.642 1.00 0.00 H new ATOM 1546 N PHE A 99 -1.402 -0.757 8.267 1.00 0.00 N ATOM 1547 CA PHE A 99 -2.149 -1.072 7.061 1.00 0.00 C ATOM 1548 C PHE A 99 -2.943 -2.369 7.232 1.00 0.00 C ATOM 1549 O PHE A 99 -2.364 -3.451 7.306 1.00 0.00 O ATOM 1550 CB PHE A 99 -1.128 -1.258 5.938 1.00 0.00 C ATOM 1551 CG PHE A 99 -1.722 -1.147 4.532 1.00 0.00 C ATOM 1552 CD1 PHE A 99 -1.859 0.072 3.946 1.00 0.00 C ATOM 1553 CD2 PHE A 99 -2.113 -2.269 3.869 1.00 0.00 C ATOM 1554 CE1 PHE A 99 -2.410 0.174 2.641 1.00 0.00 C ATOM 1555 CE2 PHE A 99 -2.664 -2.166 2.565 1.00 0.00 C ATOM 1556 CZ PHE A 99 -2.801 -0.947 1.978 1.00 0.00 C ATOM 0 H PHE A 99 -0.740 -1.476 8.559 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.855 -0.271 6.840 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.341 -0.512 6.049 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.658 -2.235 6.047 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.549 0.962 4.473 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.004 -3.237 4.335 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -2.519 1.142 2.175 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.975 -3.056 2.039 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.220 -0.869 0.986 1.00 0.00 H new ATOM 1566 N ASN A 100 -4.258 -2.216 7.288 1.00 0.00 N ATOM 1567 CA ASN A 100 -5.138 -3.361 7.448 1.00 0.00 C ATOM 1568 C ASN A 100 -5.567 -3.866 6.069 1.00 0.00 C ATOM 1569 O ASN A 100 -6.316 -3.193 5.363 1.00 0.00 O ATOM 1570 CB ASN A 100 -6.400 -2.982 8.226 1.00 0.00 C ATOM 1571 CG ASN A 100 -6.090 -2.785 9.711 1.00 0.00 C ATOM 1572 OD1 ASN A 100 -6.211 -3.689 10.522 1.00 0.00 O ATOM 1573 ND2 ASN A 100 -5.684 -1.558 10.021 1.00 0.00 N ATOM 0 H ASN A 100 -4.735 -1.317 7.225 1.00 0.00 H new ATOM 0 HA ASN A 100 -4.594 -4.130 7.996 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.824 -2.066 7.815 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -7.152 -3.762 8.108 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.452 -1.326 10.987 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.605 -0.848 9.293 1.00 0.00 H new ATOM 1580 N VAL A 101 -5.074 -5.047 5.726 1.00 0.00 N ATOM 1581 CA VAL A 101 -5.397 -5.650 4.444 1.00 0.00 C ATOM 1582 C VAL A 101 -6.766 -6.328 4.535 1.00 0.00 C ATOM 1583 O VAL A 101 -6.868 -7.472 4.977 1.00 0.00 O ATOM 1584 CB VAL A 101 -4.282 -6.608 4.021 1.00 0.00 C ATOM 1585 CG1 VAL A 101 -4.711 -7.451 2.818 1.00 0.00 C ATOM 1586 CG2 VAL A 101 -2.989 -5.847 3.723 1.00 0.00 C ATOM 0 H VAL A 101 -4.453 -5.603 6.314 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.463 -4.887 3.668 1.00 0.00 H new ATOM 0 HB VAL A 101 -4.088 -7.285 4.853 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.900 -8.124 2.537 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.593 -8.035 3.079 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.945 -6.795 1.979 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.213 -6.552 3.425 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -3.163 -5.136 2.916 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.668 -5.311 4.616 1.00 0.00 H new ATOM 1596 N LEU A 102 -7.783 -5.594 4.109 1.00 0.00 N ATOM 1597 CA LEU A 102 -9.141 -6.111 4.136 1.00 0.00 C ATOM 1598 C LEU A 102 -9.121 -7.605 3.808 1.00 0.00 C ATOM 1599 O LEU A 102 -9.060 -8.441 4.708 1.00 0.00 O ATOM 1600 CB LEU A 102 -10.045 -5.291 3.214 1.00 0.00 C ATOM 1601 CG LEU A 102 -11.071 -4.391 3.906 1.00 0.00 C ATOM 1602 CD1 LEU A 102 -11.803 -3.512 2.890 1.00 0.00 C ATOM 1603 CD2 LEU A 102 -12.040 -5.216 4.754 1.00 0.00 C ATOM 0 H LEU A 102 -7.694 -4.646 3.743 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.567 -6.010 5.134 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.414 -4.668 2.580 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.578 -5.978 2.557 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.538 -3.724 4.584 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.526 -2.882 3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.083 -2.883 2.367 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -12.322 -4.144 2.170 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.759 -4.552 5.235 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.570 -5.924 4.116 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -11.483 -5.761 5.516 1.00 0.00 H new ATOM 1615 N SER A 103 -9.173 -7.895 2.516 1.00 0.00 N ATOM 1616 CA SER A 103 -9.161 -9.274 2.058 1.00 0.00 C ATOM 1617 C SER A 103 -8.568 -9.352 0.650 1.00 0.00 C ATOM 1618 O SER A 103 -9.273 -9.149 -0.337 1.00 0.00 O ATOM 1619 CB SER A 103 -10.569 -9.872 2.074 1.00 0.00 C ATOM 1620 OG SER A 103 -10.660 -11.001 2.939 1.00 0.00 O ATOM 0 H SER A 103 -9.224 -7.199 1.772 1.00 0.00 H new ATOM 0 HA SER A 103 -8.541 -9.855 2.740 1.00 0.00 H new ATOM 0 HB2 SER A 103 -11.282 -9.112 2.394 1.00 0.00 H new ATOM 0 HB3 SER A 103 -10.849 -10.167 1.063 1.00 0.00 H new ATOM 0 HG SER A 103 -11.575 -11.353 2.923 1.00 0.00 H new ATOM 1626 N THR A 104 -7.277 -9.647 0.602 1.00 0.00 N ATOM 1627 CA THR A 104 -6.580 -9.754 -0.669 1.00 0.00 C ATOM 1628 C THR A 104 -6.629 -11.195 -1.183 1.00 0.00 C ATOM 1629 O THR A 104 -6.567 -12.140 -0.399 1.00 0.00 O ATOM 1630 CB THR A 104 -5.158 -9.226 -0.475 1.00 0.00 C ATOM 1631 OG1 THR A 104 -4.660 -9.074 -1.801 1.00 0.00 O ATOM 1632 CG2 THR A 104 -4.228 -10.265 0.156 1.00 0.00 C ATOM 0 H THR A 104 -6.695 -9.815 1.423 1.00 0.00 H new ATOM 0 HA THR A 104 -7.063 -9.151 -1.438 1.00 0.00 H new ATOM 0 HB THR A 104 -5.185 -8.335 0.152 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.905 -9.684 -1.939 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.231 -9.839 0.271 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.615 -10.554 1.133 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.175 -11.144 -0.487 1.00 0.00 H new ATOM 1640 N ASP A 105 -6.739 -11.316 -2.498 1.00 0.00 N ATOM 1641 CA ASP A 105 -6.797 -12.625 -3.127 1.00 0.00 C ATOM 1642 C ASP A 105 -5.379 -13.080 -3.478 1.00 0.00 C ATOM 1643 O ASP A 105 -5.170 -14.227 -3.869 1.00 0.00 O ATOM 1644 CB ASP A 105 -7.612 -12.579 -4.420 1.00 0.00 C ATOM 1645 CG ASP A 105 -9.115 -12.805 -4.245 1.00 0.00 C ATOM 1646 OD1 ASP A 105 -9.790 -12.970 -5.284 1.00 0.00 O ATOM 1647 OD2 ASP A 105 -9.556 -12.808 -3.075 1.00 0.00 O ATOM 0 H ASP A 105 -6.789 -10.529 -3.145 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.269 -13.315 -2.428 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.458 -11.610 -4.894 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -7.223 -13.334 -5.104 1.00 0.00 H new ATOM 1653 N ASN A 106 -4.440 -12.157 -3.325 1.00 0.00 N ATOM 1654 CA ASN A 106 -3.048 -12.449 -3.621 1.00 0.00 C ATOM 1655 C ASN A 106 -2.966 -13.268 -4.911 1.00 0.00 C ATOM 1656 O ASN A 106 -2.082 -14.110 -5.061 1.00 0.00 O ATOM 1657 CB ASN A 106 -2.407 -13.268 -2.499 1.00 0.00 C ATOM 1658 CG ASN A 106 -3.118 -14.611 -2.325 1.00 0.00 C ATOM 1659 OD1 ASN A 106 -3.987 -14.637 -1.319 1.00 0.00 O flip ATOM 1660 ND2 ASN A 106 -2.894 -15.562 -3.057 1.00 0.00 N flip ATOM 0 H ASN A 106 -4.616 -11.206 -3.000 1.00 0.00 H new ATOM 0 HA ASN A 106 -2.519 -11.502 -3.724 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -1.354 -13.437 -2.723 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -2.448 -12.707 -1.565 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -2.214 -15.475 -3.812 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -3.387 -16.443 -2.914 1.00 0.00 H new ATOM 1667 N LYS A 107 -3.901 -12.993 -5.809 1.00 0.00 N ATOM 1668 CA LYS A 107 -3.945 -13.693 -7.081 1.00 0.00 C ATOM 1669 C LYS A 107 -3.471 -12.755 -8.193 1.00 0.00 C ATOM 1670 O LYS A 107 -2.625 -13.126 -9.005 1.00 0.00 O ATOM 1671 CB LYS A 107 -5.339 -14.277 -7.323 1.00 0.00 C ATOM 1672 CG LYS A 107 -5.252 -15.739 -7.766 1.00 0.00 C ATOM 1673 CD LYS A 107 -5.568 -15.880 -9.256 1.00 0.00 C ATOM 1674 CE LYS A 107 -7.079 -15.860 -9.500 1.00 0.00 C ATOM 1675 NZ LYS A 107 -7.403 -16.502 -10.793 1.00 0.00 N ATOM 0 H LYS A 107 -4.634 -12.295 -5.681 1.00 0.00 H new ATOM 0 HA LYS A 107 -3.264 -14.544 -7.070 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.931 -14.204 -6.411 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -5.855 -13.693 -8.085 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.253 -16.125 -7.564 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -5.950 -16.341 -7.184 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.096 -15.069 -9.810 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -5.147 -16.812 -9.634 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.591 -16.380 -8.690 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.440 -14.832 -9.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -8.432 -16.480 -10.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.930 -15.989 -11.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -7.076 -17.489 -10.782 1.00 0.00 H new ATOM 1689 N ASN A 108 -4.036 -11.557 -8.193 1.00 0.00 N ATOM 1690 CA ASN A 108 -3.682 -10.562 -9.191 1.00 0.00 C ATOM 1691 C ASN A 108 -3.842 -9.164 -8.591 1.00 0.00 C ATOM 1692 O ASN A 108 -2.975 -8.308 -8.762 1.00 0.00 O ATOM 1693 CB ASN A 108 -4.595 -10.659 -10.414 1.00 0.00 C ATOM 1694 CG ASN A 108 -5.767 -11.607 -10.150 1.00 0.00 C ATOM 1695 OD1 ASN A 108 -6.695 -11.299 -9.420 1.00 0.00 O ATOM 1696 ND2 ASN A 108 -5.674 -12.773 -10.781 1.00 0.00 N ATOM 0 H ASN A 108 -4.737 -11.253 -7.517 1.00 0.00 H new ATOM 0 HA ASN A 108 -2.651 -10.743 -9.496 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -4.974 -9.669 -10.669 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -4.023 -11.012 -11.272 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -6.407 -13.474 -10.668 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -4.870 -12.967 -11.378 1.00 0.00 H new ATOM 1703 N TYR A 109 -4.957 -8.975 -7.901 1.00 0.00 N ATOM 1704 CA TYR A 109 -5.243 -7.695 -7.275 1.00 0.00 C ATOM 1705 C TYR A 109 -5.119 -7.790 -5.753 1.00 0.00 C ATOM 1706 O TYR A 109 -5.380 -8.841 -5.170 1.00 0.00 O ATOM 1707 CB TYR A 109 -6.691 -7.362 -7.638 1.00 0.00 C ATOM 1708 CG TYR A 109 -7.717 -7.848 -6.612 1.00 0.00 C ATOM 1709 CD1 TYR A 109 -7.982 -9.197 -6.487 1.00 0.00 C ATOM 1710 CD2 TYR A 109 -8.377 -6.938 -5.811 1.00 0.00 C ATOM 1711 CE1 TYR A 109 -8.948 -9.655 -5.522 1.00 0.00 C ATOM 1712 CE2 TYR A 109 -9.342 -7.396 -4.845 1.00 0.00 C ATOM 1713 CZ TYR A 109 -9.580 -8.732 -4.749 1.00 0.00 C ATOM 1714 OH TYR A 109 -10.492 -9.164 -3.837 1.00 0.00 O ATOM 0 H TYR A 109 -5.674 -9.687 -7.761 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.541 -6.934 -7.618 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.788 -6.282 -7.750 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.923 -7.805 -8.607 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.465 -9.909 -7.113 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.170 -5.883 -5.909 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -9.165 -10.707 -5.415 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.865 -6.695 -4.211 1.00 0.00 H new ATOM 0 HH TYR A 109 -10.863 -8.395 -3.356 1.00 0.00 H new ATOM 1724 N ILE A 110 -4.721 -6.678 -5.154 1.00 0.00 N ATOM 1725 CA ILE A 110 -4.560 -6.622 -3.711 1.00 0.00 C ATOM 1726 C ILE A 110 -5.513 -5.573 -3.135 1.00 0.00 C ATOM 1727 O ILE A 110 -5.479 -4.411 -3.537 1.00 0.00 O ATOM 1728 CB ILE A 110 -3.093 -6.386 -3.344 1.00 0.00 C ATOM 1729 CG1 ILE A 110 -2.408 -7.698 -2.954 1.00 0.00 C ATOM 1730 CG2 ILE A 110 -2.965 -5.325 -2.250 1.00 0.00 C ATOM 1731 CD1 ILE A 110 -0.894 -7.605 -3.151 1.00 0.00 C ATOM 0 H ILE A 110 -4.505 -5.808 -5.641 1.00 0.00 H new ATOM 0 HA ILE A 110 -4.828 -7.578 -3.261 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.578 -6.003 -4.225 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -2.629 -7.932 -1.913 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.807 -8.514 -3.556 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -1.913 -5.177 -2.008 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -3.392 -4.386 -2.602 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.499 -5.655 -1.359 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.431 -8.550 -2.867 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -0.676 -7.395 -4.198 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.495 -6.804 -2.529 1.00 0.00 H new ATOM 1743 N ILE A 111 -6.342 -6.020 -2.203 1.00 0.00 N ATOM 1744 CA ILE A 111 -7.303 -5.135 -1.568 1.00 0.00 C ATOM 1745 C ILE A 111 -6.874 -4.875 -0.123 1.00 0.00 C ATOM 1746 O ILE A 111 -6.758 -5.808 0.671 1.00 0.00 O ATOM 1747 CB ILE A 111 -8.719 -5.700 -1.698 1.00 0.00 C ATOM 1748 CG1 ILE A 111 -9.695 -4.627 -2.185 1.00 0.00 C ATOM 1749 CG2 ILE A 111 -9.177 -6.338 -0.385 1.00 0.00 C ATOM 1750 CD1 ILE A 111 -9.439 -4.278 -3.652 1.00 0.00 C ATOM 0 H ILE A 111 -6.368 -6.985 -1.872 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.323 -4.169 -2.073 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.705 -6.488 -2.451 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -10.719 -4.980 -2.065 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -9.593 -3.732 -1.571 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -10.186 -6.732 -0.504 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -8.500 -7.150 -0.119 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -9.171 -5.588 0.406 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -10.146 -3.513 -3.973 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.422 -3.902 -3.764 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -9.566 -5.170 -4.266 1.00 0.00 H new ATOM 1762 N GLY A 112 -6.651 -3.604 0.175 1.00 0.00 N ATOM 1763 CA GLY A 112 -6.237 -3.210 1.511 1.00 0.00 C ATOM 1764 C GLY A 112 -6.985 -1.956 1.970 1.00 0.00 C ATOM 1765 O GLY A 112 -7.525 -1.217 1.149 1.00 0.00 O ATOM 0 H GLY A 112 -6.749 -2.833 -0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -6.425 -4.026 2.209 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -5.163 -3.022 1.522 1.00 0.00 H new ATOM 1769 N TYR A 113 -6.991 -1.755 3.279 1.00 0.00 N ATOM 1770 CA TYR A 113 -7.663 -0.604 3.856 1.00 0.00 C ATOM 1771 C TYR A 113 -6.777 0.084 4.897 1.00 0.00 C ATOM 1772 O TYR A 113 -6.320 -0.552 5.846 1.00 0.00 O ATOM 1773 CB TYR A 113 -8.914 -1.148 4.549 1.00 0.00 C ATOM 1774 CG TYR A 113 -9.879 -0.065 5.033 1.00 0.00 C ATOM 1775 CD1 TYR A 113 -9.674 1.252 4.674 1.00 0.00 C ATOM 1776 CD2 TYR A 113 -10.954 -0.404 5.829 1.00 0.00 C ATOM 1777 CE1 TYR A 113 -10.583 2.272 5.131 1.00 0.00 C ATOM 1778 CE2 TYR A 113 -11.862 0.616 6.286 1.00 0.00 C ATOM 1779 CZ TYR A 113 -11.632 1.904 5.914 1.00 0.00 C ATOM 1780 OH TYR A 113 -12.490 2.867 6.344 1.00 0.00 O ATOM 0 H TYR A 113 -6.541 -2.370 3.957 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.898 0.129 3.084 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -9.441 -1.807 3.859 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -8.609 -1.756 5.401 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.833 1.518 4.051 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -11.114 -1.435 6.109 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -10.435 3.306 4.858 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -12.707 0.364 6.910 1.00 0.00 H new ATOM 0 HH TYR A 113 -12.922 3.289 5.572 1.00 0.00 H new ATOM 1790 N SER A 114 -6.561 1.373 4.684 1.00 0.00 N ATOM 1791 CA SER A 114 -5.737 2.154 5.592 1.00 0.00 C ATOM 1792 C SER A 114 -6.489 3.413 6.029 1.00 0.00 C ATOM 1793 O SER A 114 -7.542 3.733 5.480 1.00 0.00 O ATOM 1794 CB SER A 114 -4.404 2.530 4.942 1.00 0.00 C ATOM 1795 OG SER A 114 -3.428 2.911 5.908 1.00 0.00 O ATOM 0 H SER A 114 -6.942 1.897 3.896 1.00 0.00 H new ATOM 0 HA SER A 114 -5.522 1.544 6.469 1.00 0.00 H new ATOM 0 HB2 SER A 114 -4.031 1.684 4.364 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.561 3.351 4.242 1.00 0.00 H new ATOM 0 HG SER A 114 -2.591 3.142 5.454 1.00 0.00 H new ATOM 1801 N CYS A 115 -5.918 4.094 7.012 1.00 0.00 N ATOM 1802 CA CYS A 115 -6.521 5.311 7.528 1.00 0.00 C ATOM 1803 C CYS A 115 -5.421 6.154 8.176 1.00 0.00 C ATOM 1804 O CYS A 115 -4.597 5.634 8.928 1.00 0.00 O ATOM 1805 CB CYS A 115 -7.659 5.009 8.504 1.00 0.00 C ATOM 1806 SG CYS A 115 -8.760 3.637 7.999 1.00 0.00 S ATOM 0 H CYS A 115 -5.044 3.826 7.465 1.00 0.00 H new ATOM 0 HA CYS A 115 -6.973 5.872 6.710 1.00 0.00 H new ATOM 0 HB2 CYS A 115 -7.230 4.772 9.478 1.00 0.00 H new ATOM 0 HB3 CYS A 115 -8.259 5.910 8.630 1.00 0.00 H new ATOM 1812 N ARG A 116 -5.443 7.441 7.862 1.00 0.00 N ATOM 1813 CA ARG A 116 -4.458 8.361 8.405 1.00 0.00 C ATOM 1814 C ARG A 116 -5.101 9.267 9.458 1.00 0.00 C ATOM 1815 O ARG A 116 -5.950 10.095 9.133 1.00 0.00 O ATOM 1816 CB ARG A 116 -3.846 9.227 7.302 1.00 0.00 C ATOM 1817 CG ARG A 116 -4.874 10.216 6.748 1.00 0.00 C ATOM 1818 CD ARG A 116 -4.502 10.657 5.331 1.00 0.00 C ATOM 1819 NE ARG A 116 -3.714 11.909 5.381 1.00 0.00 N ATOM 1820 CZ ARG A 116 -3.393 12.637 4.303 1.00 0.00 C ATOM 1821 NH1 ARG A 116 -3.788 12.243 3.086 1.00 0.00 N ATOM 1822 NH2 ARG A 116 -2.675 13.760 4.444 1.00 0.00 N ATOM 0 H ARG A 116 -6.128 7.869 7.238 1.00 0.00 H new ATOM 0 HA ARG A 116 -3.668 7.767 8.865 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -2.988 9.771 7.696 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -3.478 8.591 6.497 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -5.861 9.754 6.742 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -4.934 11.087 7.400 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -3.926 9.874 4.837 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -5.405 10.809 4.740 1.00 0.00 H new ATOM 0 HE ARG A 116 -3.396 12.238 6.293 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -4.334 11.388 2.979 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -3.543 12.798 2.266 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -2.374 14.060 5.371 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -2.430 14.315 3.624 1.00 0.00 H new ATOM 1836 N TYR A 117 -4.671 9.078 10.697 1.00 0.00 N ATOM 1837 CA TYR A 117 -5.194 9.868 11.798 1.00 0.00 C ATOM 1838 C TYR A 117 -4.814 11.342 11.645 1.00 0.00 C ATOM 1839 O TYR A 117 -3.638 11.672 11.508 1.00 0.00 O ATOM 1840 CB TYR A 117 -4.538 9.313 13.064 1.00 0.00 C ATOM 1841 CG TYR A 117 -5.442 9.341 14.298 1.00 0.00 C ATOM 1842 CD1 TYR A 117 -6.306 8.293 14.544 1.00 0.00 C ATOM 1843 CD2 TYR A 117 -5.394 10.414 15.164 1.00 0.00 C ATOM 1844 CE1 TYR A 117 -7.157 8.319 15.705 1.00 0.00 C ATOM 1845 CE2 TYR A 117 -6.246 10.440 16.325 1.00 0.00 C ATOM 1846 CZ TYR A 117 -7.085 9.391 16.539 1.00 0.00 C ATOM 1847 OH TYR A 117 -7.889 9.416 17.636 1.00 0.00 O ATOM 0 H TYR A 117 -3.967 8.390 10.962 1.00 0.00 H new ATOM 0 HA TYR A 117 -6.282 9.808 11.830 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -4.226 8.285 12.878 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -3.636 9.887 13.275 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -6.344 7.454 13.866 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -4.718 11.234 14.971 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -7.837 7.505 15.909 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -6.219 11.274 17.011 1.00 0.00 H new ATOM 0 HH TYR A 117 -7.729 10.241 18.140 1.00 0.00 H new ATOM 1857 N ASP A 118 -5.833 12.189 11.674 1.00 0.00 N ATOM 1858 CA ASP A 118 -5.621 13.620 11.540 1.00 0.00 C ATOM 1859 C ASP A 118 -5.999 14.312 12.851 1.00 0.00 C ATOM 1860 O ASP A 118 -7.175 14.568 13.105 1.00 0.00 O ATOM 1861 CB ASP A 118 -6.494 14.204 10.428 1.00 0.00 C ATOM 1862 CG ASP A 118 -8.000 14.135 10.684 1.00 0.00 C ATOM 1863 OD1 ASP A 118 -8.430 13.116 11.267 1.00 0.00 O ATOM 1864 OD2 ASP A 118 -8.688 15.102 10.292 1.00 0.00 O ATOM 0 H ASP A 118 -6.808 11.911 11.788 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.571 13.784 11.298 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -6.214 15.246 10.277 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -6.274 13.677 9.500 1.00 0.00 H new ATOM 1870 N GLU A 119 -4.980 14.595 13.649 1.00 0.00 N ATOM 1871 CA GLU A 119 -5.190 15.252 14.927 1.00 0.00 C ATOM 1872 C GLU A 119 -6.017 16.526 14.740 1.00 0.00 C ATOM 1873 O GLU A 119 -6.614 17.028 15.691 1.00 0.00 O ATOM 1874 CB GLU A 119 -3.857 15.560 15.612 1.00 0.00 C ATOM 1875 CG GLU A 119 -3.886 15.142 17.083 1.00 0.00 C ATOM 1876 CD GLU A 119 -2.676 14.271 17.429 1.00 0.00 C ATOM 1877 OE1 GLU A 119 -2.482 13.261 16.720 1.00 0.00 O ATOM 1878 OE2 GLU A 119 -1.973 14.636 18.396 1.00 0.00 O ATOM 0 H GLU A 119 -4.006 14.381 13.435 1.00 0.00 H new ATOM 0 HA GLU A 119 -5.745 14.573 15.574 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -3.051 15.037 15.098 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.644 16.626 15.538 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -3.894 16.029 17.717 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -4.805 14.594 17.291 1.00 0.00 H new ATOM 1886 N ASP A 120 -6.026 17.011 13.507 1.00 0.00 N ATOM 1887 CA ASP A 120 -6.770 18.216 13.182 1.00 0.00 C ATOM 1888 C ASP A 120 -8.230 18.038 13.605 1.00 0.00 C ATOM 1889 O ASP A 120 -8.739 18.800 14.425 1.00 0.00 O ATOM 1890 CB ASP A 120 -6.744 18.491 11.677 1.00 0.00 C ATOM 1891 CG ASP A 120 -6.914 19.960 11.285 1.00 0.00 C ATOM 1892 OD1 ASP A 120 -7.863 20.581 11.810 1.00 0.00 O ATOM 1893 OD2 ASP A 120 -6.092 20.428 10.469 1.00 0.00 O ATOM 0 H ASP A 120 -5.530 16.591 12.721 1.00 0.00 H new ATOM 0 HA ASP A 120 -6.307 19.050 13.709 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -5.798 18.130 11.273 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -7.535 17.910 11.203 1.00 0.00 H new ATOM 1899 N LYS A 121 -8.862 17.028 13.026 1.00 0.00 N ATOM 1900 CA LYS A 121 -10.253 16.741 13.333 1.00 0.00 C ATOM 1901 C LYS A 121 -10.320 15.621 14.373 1.00 0.00 C ATOM 1902 O LYS A 121 -11.404 15.145 14.708 1.00 0.00 O ATOM 1903 CB LYS A 121 -11.032 16.437 12.052 1.00 0.00 C ATOM 1904 CG LYS A 121 -11.876 17.640 11.625 1.00 0.00 C ATOM 1905 CD LYS A 121 -11.184 18.427 10.510 1.00 0.00 C ATOM 1906 CE LYS A 121 -10.764 19.815 10.997 1.00 0.00 C ATOM 1907 NZ LYS A 121 -9.940 20.496 9.973 1.00 0.00 N ATOM 0 H LYS A 121 -8.437 16.398 12.346 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.735 17.615 13.772 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -10.338 16.174 11.254 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -11.678 15.573 12.211 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -12.853 17.300 11.282 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -12.048 18.291 12.482 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -10.308 17.879 10.163 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -11.857 18.525 9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -11.649 20.413 11.217 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -10.200 19.726 11.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -9.089 20.893 10.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -9.660 19.812 9.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -10.491 21.263 9.537 1.00 0.00 H new ATOM 1921 N LYS A 122 -9.149 15.234 14.856 1.00 0.00 N ATOM 1922 CA LYS A 122 -9.061 14.180 15.852 1.00 0.00 C ATOM 1923 C LYS A 122 -9.225 12.822 15.167 1.00 0.00 C ATOM 1924 O LYS A 122 -8.381 11.940 15.318 1.00 0.00 O ATOM 1925 CB LYS A 122 -10.065 14.424 16.981 1.00 0.00 C ATOM 1926 CG LYS A 122 -9.350 14.606 18.321 1.00 0.00 C ATOM 1927 CD LYS A 122 -10.107 13.900 19.447 1.00 0.00 C ATOM 1928 CE LYS A 122 -9.276 13.868 20.731 1.00 0.00 C ATOM 1929 NZ LYS A 122 -10.157 13.911 21.920 1.00 0.00 N ATOM 0 H LYS A 122 -8.252 15.632 14.576 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.078 14.183 16.324 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -10.659 15.310 16.759 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -10.757 13.584 17.045 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.337 14.208 18.254 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.261 15.668 18.548 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.051 14.413 19.633 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.352 12.882 19.143 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.667 12.964 20.755 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -8.590 14.715 20.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -9.577 13.889 22.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -10.720 14.786 21.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.794 13.089 21.910 1.00 0.00 H new ATOM 1943 N GLY A 123 -10.317 12.696 14.427 1.00 0.00 N ATOM 1944 CA GLY A 123 -10.602 11.460 13.718 1.00 0.00 C ATOM 1945 C GLY A 123 -9.481 11.122 12.733 1.00 0.00 C ATOM 1946 O GLY A 123 -8.303 11.263 13.056 1.00 0.00 O ATOM 0 H GLY A 123 -11.015 13.429 14.303 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.721 10.646 14.433 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -11.546 11.554 13.182 1.00 0.00 H new ATOM 1950 N HIS A 124 -9.888 10.683 11.551 1.00 0.00 N ATOM 1951 CA HIS A 124 -8.933 10.324 10.517 1.00 0.00 C ATOM 1952 C HIS A 124 -9.609 10.394 9.146 1.00 0.00 C ATOM 1953 O HIS A 124 -10.821 10.584 9.057 1.00 0.00 O ATOM 1954 CB HIS A 124 -8.312 8.955 10.802 1.00 0.00 C ATOM 1955 CG HIS A 124 -9.194 7.789 10.423 1.00 0.00 C ATOM 1956 ND1 HIS A 124 -9.495 6.760 11.298 1.00 0.00 N ATOM 1957 CD2 HIS A 124 -9.838 7.502 9.255 1.00 0.00 C ATOM 1958 CE1 HIS A 124 -10.283 5.897 10.674 1.00 0.00 C ATOM 1959 NE2 HIS A 124 -10.494 6.358 9.408 1.00 0.00 N ATOM 0 H HIS A 124 -10.866 10.568 11.287 1.00 0.00 H new ATOM 0 HA HIS A 124 -8.110 11.039 10.514 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -7.369 8.875 10.260 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -8.076 8.889 11.864 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -9.166 6.680 12.260 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -9.818 8.103 8.358 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -10.687 4.988 11.094 1.00 0.00 H new ATOM 1967 N TRP A 125 -8.797 10.236 8.112 1.00 0.00 N ATOM 1968 CA TRP A 125 -9.301 10.279 6.750 1.00 0.00 C ATOM 1969 C TRP A 125 -8.974 8.942 6.082 1.00 0.00 C ATOM 1970 O TRP A 125 -8.136 8.187 6.573 1.00 0.00 O ATOM 1971 CB TRP A 125 -8.733 11.480 5.992 1.00 0.00 C ATOM 1972 CG TRP A 125 -9.091 12.833 6.612 1.00 0.00 C ATOM 1973 CD1 TRP A 125 -8.425 13.508 7.559 1.00 0.00 C ATOM 1974 CD2 TRP A 125 -10.234 13.652 6.288 1.00 0.00 C ATOM 1975 NE1 TRP A 125 -9.053 14.698 7.868 1.00 0.00 N ATOM 1976 CE2 TRP A 125 -10.188 14.788 7.070 1.00 0.00 C ATOM 1977 CE3 TRP A 125 -11.273 13.440 5.364 1.00 0.00 C ATOM 1978 CZ2 TRP A 125 -11.152 15.801 7.008 1.00 0.00 C ATOM 1979 CZ3 TRP A 125 -12.229 14.462 5.315 1.00 0.00 C ATOM 1980 CH2 TRP A 125 -12.196 15.611 6.095 1.00 0.00 C ATOM 0 H TRP A 125 -7.792 10.078 8.190 1.00 0.00 H new ATOM 0 HA TRP A 125 -10.382 10.416 6.744 1.00 0.00 H new ATOM 0 HB2 TRP A 125 -7.648 11.388 5.947 1.00 0.00 H new ATOM 0 HB3 TRP A 125 -9.098 11.454 4.965 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -7.512 13.164 8.022 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -8.742 15.385 8.555 1.00 0.00 H new ATOM 0 HE3 TRP A 125 -11.329 12.559 4.742 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -11.094 16.681 7.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 -13.050 14.349 4.622 1.00 0.00 H new ATOM 0 HH2 TRP A 125 -12.973 16.355 5.997 1.00 0.00 H new ATOM 1991 N ASP A 126 -9.653 8.689 4.973 1.00 0.00 N ATOM 1992 CA ASP A 126 -9.445 7.456 4.233 1.00 0.00 C ATOM 1993 C ASP A 126 -8.395 7.691 3.144 1.00 0.00 C ATOM 1994 O ASP A 126 -8.418 8.716 2.466 1.00 0.00 O ATOM 1995 CB ASP A 126 -10.736 6.997 3.552 1.00 0.00 C ATOM 1996 CG ASP A 126 -10.666 5.617 2.896 1.00 0.00 C ATOM 1997 OD1 ASP A 126 -11.747 5.107 2.530 1.00 0.00 O ATOM 1998 OD2 ASP A 126 -9.533 5.103 2.775 1.00 0.00 O ATOM 0 H ASP A 126 -10.348 9.317 4.569 1.00 0.00 H new ATOM 0 HA ASP A 126 -9.117 6.692 4.938 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -11.537 6.991 4.292 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -11.009 7.730 2.793 1.00 0.00 H new ATOM 2004 N HIS A 127 -7.500 6.723 3.012 1.00 0.00 N ATOM 2005 CA HIS A 127 -6.444 6.811 2.018 1.00 0.00 C ATOM 2006 C HIS A 127 -5.638 5.511 2.009 1.00 0.00 C ATOM 2007 O HIS A 127 -4.753 5.318 2.841 1.00 0.00 O ATOM 2008 CB HIS A 127 -5.573 8.046 2.258 1.00 0.00 C ATOM 2009 CG HIS A 127 -4.181 7.937 1.685 1.00 0.00 C ATOM 2010 ND1 HIS A 127 -3.938 7.608 0.362 1.00 0.00 N ATOM 2011 CD2 HIS A 127 -2.960 8.118 2.266 1.00 0.00 C ATOM 2012 CE1 HIS A 127 -2.628 7.594 0.168 1.00 0.00 C ATOM 2013 NE2 HIS A 127 -2.024 7.909 1.350 1.00 0.00 N ATOM 0 H HIS A 127 -7.484 5.874 3.577 1.00 0.00 H new ATOM 0 HA HIS A 127 -6.882 6.934 1.027 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -6.066 8.916 1.824 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -5.500 8.223 3.331 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -2.785 8.386 3.297 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -2.126 7.372 -0.762 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -1.018 7.973 1.504 1.00 0.00 H new ATOM 2021 N VAL A 128 -5.973 4.651 1.058 1.00 0.00 N ATOM 2022 CA VAL A 128 -5.291 3.375 0.929 1.00 0.00 C ATOM 2023 C VAL A 128 -4.661 3.276 -0.462 1.00 0.00 C ATOM 2024 O VAL A 128 -4.783 4.196 -1.269 1.00 0.00 O ATOM 2025 CB VAL A 128 -6.262 2.231 1.228 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -7.205 1.989 0.047 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -5.507 0.952 1.597 1.00 0.00 C ATOM 0 H VAL A 128 -6.708 4.813 0.370 1.00 0.00 H new ATOM 0 HA VAL A 128 -4.484 3.298 1.657 1.00 0.00 H new ATOM 0 HB VAL A 128 -6.867 2.522 2.086 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -7.885 1.171 0.286 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -7.781 2.893 -0.150 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -6.622 1.730 -0.837 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -6.221 0.155 1.805 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -4.865 0.657 0.768 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.897 1.132 2.482 1.00 0.00 H new ATOM 2037 N TRP A 129 -4.002 2.151 -0.699 1.00 0.00 N ATOM 2038 CA TRP A 129 -3.352 1.920 -1.978 1.00 0.00 C ATOM 2039 C TRP A 129 -3.710 0.507 -2.442 1.00 0.00 C ATOM 2040 O TRP A 129 -3.782 -0.416 -1.632 1.00 0.00 O ATOM 2041 CB TRP A 129 -1.843 2.152 -1.877 1.00 0.00 C ATOM 2042 CG TRP A 129 -1.164 1.351 -0.765 1.00 0.00 C ATOM 2043 CD1 TRP A 129 -0.888 0.040 -0.742 1.00 0.00 C ATOM 2044 CD2 TRP A 129 -0.683 1.866 0.495 1.00 0.00 C ATOM 2045 NE1 TRP A 129 -0.267 -0.326 0.434 1.00 0.00 N ATOM 2046 CE2 TRP A 129 -0.138 0.820 1.211 1.00 0.00 C ATOM 2047 CE3 TRP A 129 -0.707 3.173 1.012 1.00 0.00 C ATOM 2048 CZ2 TRP A 129 0.423 0.972 2.484 1.00 0.00 C ATOM 2049 CZ3 TRP A 129 -0.143 3.309 2.286 1.00 0.00 C ATOM 2050 CH2 TRP A 129 0.410 2.266 3.020 1.00 0.00 C ATOM 0 H TRP A 129 -3.904 1.390 -0.027 1.00 0.00 H new ATOM 0 HA TRP A 129 -3.706 2.632 -2.724 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -1.381 1.894 -2.830 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -1.659 3.213 -1.710 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -1.122 -0.644 -1.544 1.00 0.00 H new ATOM 0 HE1 TRP A 129 0.041 -1.265 0.687 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -1.127 4.007 0.469 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 0.843 0.137 3.024 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -0.137 4.294 2.730 1.00 0.00 H new ATOM 0 HH2 TRP A 129 0.827 2.452 3.998 1.00 0.00 H new ATOM 2061 N VAL A 130 -3.925 0.382 -3.743 1.00 0.00 N ATOM 2062 CA VAL A 130 -4.274 -0.904 -4.324 1.00 0.00 C ATOM 2063 C VAL A 130 -3.141 -1.369 -5.240 1.00 0.00 C ATOM 2064 O VAL A 130 -2.560 -0.568 -5.971 1.00 0.00 O ATOM 2065 CB VAL A 130 -5.621 -0.805 -5.042 1.00 0.00 C ATOM 2066 CG1 VAL A 130 -5.908 -2.075 -5.846 1.00 0.00 C ATOM 2067 CG2 VAL A 130 -6.751 -0.516 -4.052 1.00 0.00 C ATOM 0 H VAL A 130 -3.864 1.150 -4.412 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.391 -1.657 -3.544 1.00 0.00 H new ATOM 0 HB VAL A 130 -5.567 0.030 -5.741 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -6.871 -1.979 -6.347 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.125 -2.219 -6.590 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -5.932 -2.933 -5.174 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -7.697 -0.451 -4.589 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.805 -1.319 -3.317 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.556 0.428 -3.543 1.00 0.00 H new ATOM 2077 N LEU A 131 -2.859 -2.662 -5.171 1.00 0.00 N ATOM 2078 CA LEU A 131 -1.806 -3.243 -5.986 1.00 0.00 C ATOM 2079 C LEU A 131 -2.418 -4.248 -6.963 1.00 0.00 C ATOM 2080 O LEU A 131 -3.522 -4.743 -6.740 1.00 0.00 O ATOM 2081 CB LEU A 131 -0.709 -3.837 -5.099 1.00 0.00 C ATOM 2082 CG LEU A 131 -0.502 -3.158 -3.744 1.00 0.00 C ATOM 2083 CD1 LEU A 131 0.890 -3.463 -3.185 1.00 0.00 C ATOM 2084 CD2 LEU A 131 -0.764 -1.654 -3.838 1.00 0.00 C ATOM 0 H LEU A 131 -3.342 -3.324 -4.563 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.319 -2.473 -6.584 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -0.939 -4.888 -4.925 1.00 0.00 H new ATOM 0 HB3 LEU A 131 0.232 -3.803 -5.648 1.00 0.00 H new ATOM 0 HG LEU A 131 -1.228 -3.568 -3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 131 1.011 -2.968 -2.221 1.00 0.00 H new ATOM 0 HD12 LEU A 131 1.003 -4.540 -3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.648 -3.098 -3.878 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -0.610 -1.196 -2.861 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.078 -1.210 -4.559 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.791 -1.483 -4.161 1.00 0.00 H new ATOM 2096 N SER A 132 -1.675 -4.521 -8.025 1.00 0.00 N ATOM 2097 CA SER A 132 -2.131 -5.458 -9.037 1.00 0.00 C ATOM 2098 C SER A 132 -0.931 -6.151 -9.687 1.00 0.00 C ATOM 2099 O SER A 132 0.152 -5.575 -9.771 1.00 0.00 O ATOM 2100 CB SER A 132 -2.976 -4.754 -10.100 1.00 0.00 C ATOM 2101 OG SER A 132 -3.000 -5.475 -11.328 1.00 0.00 O ATOM 0 H SER A 132 -0.760 -4.109 -8.207 1.00 0.00 H new ATOM 0 HA SER A 132 -2.757 -6.207 -8.552 1.00 0.00 H new ATOM 0 HB2 SER A 132 -3.995 -4.633 -9.731 1.00 0.00 H new ATOM 0 HB3 SER A 132 -2.579 -3.754 -10.275 1.00 0.00 H new ATOM 0 HG SER A 132 -2.227 -5.218 -11.873 1.00 0.00 H new ATOM 2107 N ARG A 133 -1.166 -7.378 -10.130 1.00 0.00 N ATOM 2108 CA ARG A 133 -0.118 -8.155 -10.770 1.00 0.00 C ATOM 2109 C ARG A 133 0.590 -7.316 -11.835 1.00 0.00 C ATOM 2110 O ARG A 133 1.816 -7.216 -11.838 1.00 0.00 O ATOM 2111 CB ARG A 133 -0.688 -9.417 -11.421 1.00 0.00 C ATOM 2112 CG ARG A 133 -0.097 -10.677 -10.785 1.00 0.00 C ATOM 2113 CD ARG A 133 -0.262 -11.886 -11.707 1.00 0.00 C ATOM 2114 NE ARG A 133 0.326 -13.088 -11.076 1.00 0.00 N ATOM 2115 CZ ARG A 133 0.415 -14.284 -11.674 1.00 0.00 C ATOM 2116 NH1 ARG A 133 -0.046 -14.444 -12.922 1.00 0.00 N ATOM 2117 NH2 ARG A 133 0.964 -15.319 -11.025 1.00 0.00 N ATOM 0 H ARG A 133 -2.066 -7.853 -10.058 1.00 0.00 H new ATOM 0 HA ARG A 133 0.595 -8.447 -9.999 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.773 -9.427 -11.315 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -0.472 -9.409 -12.489 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.960 -10.519 -10.572 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -0.589 -10.872 -9.832 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -1.319 -12.054 -11.914 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.224 -11.693 -12.664 1.00 0.00 H new ATOM 0 HE ARG A 133 0.686 -13.001 -10.126 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.464 -13.656 -13.416 1.00 0.00 H new ATOM 0 HH12 ARG A 133 0.021 -15.354 -13.378 1.00 0.00 H new ATOM 0 HH21 ARG A 133 1.315 -15.197 -10.075 1.00 0.00 H new ATOM 0 HH22 ARG A 133 1.031 -16.229 -11.481 1.00 0.00 H new ATOM 2131 N SER A 134 -0.212 -6.734 -12.715 1.00 0.00 N ATOM 2132 CA SER A 134 0.323 -5.906 -13.783 1.00 0.00 C ATOM 2133 C SER A 134 0.115 -4.427 -13.452 1.00 0.00 C ATOM 2134 O SER A 134 -0.312 -4.087 -12.350 1.00 0.00 O ATOM 2135 CB SER A 134 -0.330 -6.247 -15.124 1.00 0.00 C ATOM 2136 OG SER A 134 -0.369 -7.653 -15.356 1.00 0.00 O ATOM 0 H SER A 134 -1.228 -6.819 -12.710 1.00 0.00 H new ATOM 0 HA SER A 134 1.391 -6.106 -13.869 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.344 -5.848 -15.146 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.221 -5.762 -15.930 1.00 0.00 H new ATOM 0 HG SER A 134 -0.794 -7.830 -16.221 1.00 0.00 H new ATOM 2142 N MET A 135 0.426 -3.586 -14.428 1.00 0.00 N ATOM 2143 CA MET A 135 0.279 -2.151 -14.255 1.00 0.00 C ATOM 2144 C MET A 135 -1.198 -1.752 -14.221 1.00 0.00 C ATOM 2145 O MET A 135 -1.547 -0.693 -13.702 1.00 0.00 O ATOM 2146 CB MET A 135 0.978 -1.423 -15.405 1.00 0.00 C ATOM 2147 CG MET A 135 0.581 -2.022 -16.755 1.00 0.00 C ATOM 2148 SD MET A 135 0.163 -0.720 -17.902 1.00 0.00 S ATOM 2149 CE MET A 135 1.571 -0.806 -18.996 1.00 0.00 C ATOM 0 H MET A 135 0.779 -3.871 -15.341 1.00 0.00 H new ATOM 0 HA MET A 135 0.735 -1.870 -13.306 1.00 0.00 H new ATOM 0 HB2 MET A 135 0.718 -0.365 -15.382 1.00 0.00 H new ATOM 0 HB3 MET A 135 2.059 -1.488 -15.278 1.00 0.00 H new ATOM 0 HG2 MET A 135 1.402 -2.619 -17.153 1.00 0.00 H new ATOM 0 HG3 MET A 135 -0.269 -2.693 -16.629 1.00 0.00 H new ATOM 0 HE1 MET A 135 1.470 -0.054 -19.778 1.00 0.00 H new ATOM 0 HE2 MET A 135 2.484 -0.621 -18.430 1.00 0.00 H new ATOM 0 HE3 MET A 135 1.620 -1.796 -19.449 1.00 0.00 H new ATOM 2159 N VAL A 136 -2.026 -2.621 -14.781 1.00 0.00 N ATOM 2160 CA VAL A 136 -3.457 -2.373 -14.822 1.00 0.00 C ATOM 2161 C VAL A 136 -4.203 -3.648 -14.424 1.00 0.00 C ATOM 2162 O VAL A 136 -3.687 -4.752 -14.593 1.00 0.00 O ATOM 2163 CB VAL A 136 -3.858 -1.851 -16.203 1.00 0.00 C ATOM 2164 CG1 VAL A 136 -5.035 -2.648 -16.769 1.00 0.00 C ATOM 2165 CG2 VAL A 136 -4.183 -0.357 -16.151 1.00 0.00 C ATOM 0 H VAL A 136 -1.733 -3.499 -15.211 1.00 0.00 H new ATOM 0 HA VAL A 136 -3.732 -1.599 -14.105 1.00 0.00 H new ATOM 0 HB VAL A 136 -3.008 -1.986 -16.872 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -5.300 -2.257 -17.751 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -4.754 -3.697 -16.860 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -5.891 -2.558 -16.100 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.465 -0.011 -17.145 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -5.009 -0.188 -15.460 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.307 0.194 -15.810 1.00 0.00 H new ATOM 2175 N LEU A 137 -5.406 -3.454 -13.904 1.00 0.00 N ATOM 2176 CA LEU A 137 -6.228 -4.574 -13.481 1.00 0.00 C ATOM 2177 C LEU A 137 -6.774 -5.295 -14.715 1.00 0.00 C ATOM 2178 O LEU A 137 -7.162 -4.655 -15.691 1.00 0.00 O ATOM 2179 CB LEU A 137 -7.315 -4.106 -12.511 1.00 0.00 C ATOM 2180 CG LEU A 137 -7.085 -4.437 -11.035 1.00 0.00 C ATOM 2181 CD1 LEU A 137 -8.314 -4.083 -10.196 1.00 0.00 C ATOM 2182 CD2 LEU A 137 -6.673 -5.900 -10.859 1.00 0.00 C ATOM 0 H LEU A 137 -5.831 -2.537 -13.766 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.630 -5.297 -12.927 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -7.420 -3.025 -12.608 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -8.263 -4.548 -12.818 1.00 0.00 H new ATOM 0 HG LEU A 137 -6.260 -3.824 -10.672 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.124 -4.328 -9.151 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -8.522 -3.017 -10.287 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -9.173 -4.651 -10.552 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -6.516 -6.109 -9.801 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -7.460 -6.548 -11.244 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -5.749 -6.086 -11.407 1.00 0.00 H new ATOM 2194 N THR A 138 -6.788 -6.617 -14.631 1.00 0.00 N ATOM 2195 CA THR A 138 -7.280 -7.432 -15.729 1.00 0.00 C ATOM 2196 C THR A 138 -7.817 -8.765 -15.205 1.00 0.00 C ATOM 2197 O THR A 138 -7.980 -8.942 -13.999 1.00 0.00 O ATOM 2198 CB THR A 138 -6.147 -7.590 -16.746 1.00 0.00 C ATOM 2199 OG1 THR A 138 -5.305 -8.588 -16.175 1.00 0.00 O ATOM 2200 CG2 THR A 138 -5.254 -6.350 -16.825 1.00 0.00 C ATOM 0 H THR A 138 -6.466 -7.144 -13.819 1.00 0.00 H new ATOM 0 HA THR A 138 -8.121 -6.954 -16.230 1.00 0.00 H new ATOM 0 HB THR A 138 -6.568 -7.797 -17.730 1.00 0.00 H new ATOM 0 HG1 THR A 138 -4.545 -8.754 -16.770 1.00 0.00 H new ATOM 0 HG21 THR A 138 -4.467 -6.515 -17.561 1.00 0.00 H new ATOM 0 HG22 THR A 138 -5.853 -5.489 -17.121 1.00 0.00 H new ATOM 0 HG23 THR A 138 -4.805 -6.162 -15.850 1.00 0.00 H new ATOM 2208 N GLY A 139 -8.076 -9.669 -16.138 1.00 0.00 N ATOM 2209 CA GLY A 139 -8.591 -10.982 -15.786 1.00 0.00 C ATOM 2210 C GLY A 139 -9.582 -10.888 -14.624 1.00 0.00 C ATOM 2211 O GLY A 139 -10.143 -9.823 -14.366 1.00 0.00 O ATOM 0 H GLY A 139 -7.939 -9.519 -17.137 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.081 -11.429 -16.651 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -7.766 -11.639 -15.513 1.00 0.00 H new ATOM 2215 N GLU A 140 -9.768 -12.015 -13.953 1.00 0.00 N ATOM 2216 CA GLU A 140 -10.681 -12.073 -12.825 1.00 0.00 C ATOM 2217 C GLU A 140 -10.358 -10.963 -11.823 1.00 0.00 C ATOM 2218 O GLU A 140 -11.227 -10.535 -11.064 1.00 0.00 O ATOM 2219 CB GLU A 140 -10.637 -13.448 -12.154 1.00 0.00 C ATOM 2220 CG GLU A 140 -12.026 -14.089 -12.127 1.00 0.00 C ATOM 2221 CD GLU A 140 -12.087 -15.304 -13.056 1.00 0.00 C ATOM 2222 OE1 GLU A 140 -13.105 -15.420 -13.771 1.00 0.00 O ATOM 2223 OE2 GLU A 140 -11.114 -16.088 -13.030 1.00 0.00 O ATOM 0 H GLU A 140 -9.301 -12.896 -14.169 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.695 -11.918 -13.195 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -9.944 -14.096 -12.690 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -10.259 -13.348 -11.137 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -12.271 -14.392 -11.109 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.774 -13.357 -12.430 1.00 0.00 H new ATOM 2231 N ALA A 141 -9.107 -10.529 -11.852 1.00 0.00 N ATOM 2232 CA ALA A 141 -8.659 -9.477 -10.956 1.00 0.00 C ATOM 2233 C ALA A 141 -9.608 -8.282 -11.064 1.00 0.00 C ATOM 2234 O ALA A 141 -9.988 -7.692 -10.054 1.00 0.00 O ATOM 2235 CB ALA A 141 -7.212 -9.105 -11.288 1.00 0.00 C ATOM 0 H ALA A 141 -8.389 -10.887 -12.482 1.00 0.00 H new ATOM 0 HA ALA A 141 -8.678 -9.820 -9.922 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -6.876 -8.316 -10.616 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -6.574 -9.981 -11.167 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -7.154 -8.753 -12.318 1.00 0.00 H new ATOM 2241 N LYS A 142 -9.963 -7.959 -12.299 1.00 0.00 N ATOM 2242 CA LYS A 142 -10.861 -6.845 -12.553 1.00 0.00 C ATOM 2243 C LYS A 142 -12.188 -7.090 -11.832 1.00 0.00 C ATOM 2244 O LYS A 142 -12.793 -6.158 -11.305 1.00 0.00 O ATOM 2245 CB LYS A 142 -11.012 -6.611 -14.057 1.00 0.00 C ATOM 2246 CG LYS A 142 -10.076 -5.499 -14.536 1.00 0.00 C ATOM 2247 CD LYS A 142 -10.605 -4.851 -15.817 1.00 0.00 C ATOM 2248 CE LYS A 142 -10.439 -5.788 -17.015 1.00 0.00 C ATOM 2249 NZ LYS A 142 -9.510 -5.201 -18.007 1.00 0.00 N ATOM 0 H LYS A 142 -9.645 -8.449 -13.135 1.00 0.00 H new ATOM 0 HA LYS A 142 -10.445 -5.921 -12.150 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -10.793 -7.533 -14.596 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -12.044 -6.346 -14.286 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -9.975 -4.743 -13.757 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -9.081 -5.908 -14.715 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -11.658 -4.597 -15.692 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -10.072 -3.918 -16.004 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -10.060 -6.753 -16.679 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -11.408 -5.970 -17.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -9.276 -5.914 -18.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -9.961 -4.383 -18.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -8.640 -4.894 -17.528 1.00 0.00 H new ATOM 2263 N THR A 143 -12.601 -8.349 -11.832 1.00 0.00 N ATOM 2264 CA THR A 143 -13.845 -8.728 -11.184 1.00 0.00 C ATOM 2265 C THR A 143 -13.667 -8.759 -9.665 1.00 0.00 C ATOM 2266 O THR A 143 -14.572 -8.381 -8.922 1.00 0.00 O ATOM 2267 CB THR A 143 -14.294 -10.067 -11.771 1.00 0.00 C ATOM 2268 OG1 THR A 143 -14.593 -9.767 -13.132 1.00 0.00 O ATOM 2269 CG2 THR A 143 -15.629 -10.542 -11.192 1.00 0.00 C ATOM 0 H THR A 143 -12.096 -9.119 -12.270 1.00 0.00 H new ATOM 0 HA THR A 143 -14.629 -7.995 -11.372 1.00 0.00 H new ATOM 0 HB THR A 143 -13.529 -10.820 -11.584 1.00 0.00 H new ATOM 0 HG1 THR A 143 -14.891 -10.581 -13.589 1.00 0.00 H new ATOM 0 HG21 THR A 143 -15.902 -11.496 -11.642 1.00 0.00 H new ATOM 0 HG22 THR A 143 -15.535 -10.663 -10.113 1.00 0.00 H new ATOM 0 HG23 THR A 143 -16.402 -9.805 -11.408 1.00 0.00 H new ATOM 2277 N ALA A 144 -12.494 -9.214 -9.247 1.00 0.00 N ATOM 2278 CA ALA A 144 -12.186 -9.299 -7.830 1.00 0.00 C ATOM 2279 C ALA A 144 -12.392 -7.928 -7.184 1.00 0.00 C ATOM 2280 O ALA A 144 -13.006 -7.823 -6.123 1.00 0.00 O ATOM 2281 CB ALA A 144 -10.760 -9.821 -7.648 1.00 0.00 C ATOM 0 H ALA A 144 -11.746 -9.527 -9.866 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.856 -10.001 -7.333 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -10.529 -9.885 -6.585 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -10.674 -10.810 -8.098 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.059 -9.141 -8.132 1.00 0.00 H new ATOM 2287 N VAL A 145 -11.867 -6.910 -7.850 1.00 0.00 N ATOM 2288 CA VAL A 145 -11.986 -5.550 -7.354 1.00 0.00 C ATOM 2289 C VAL A 145 -13.438 -5.087 -7.489 1.00 0.00 C ATOM 2290 O VAL A 145 -14.005 -4.531 -6.550 1.00 0.00 O ATOM 2291 CB VAL A 145 -10.997 -4.639 -8.085 1.00 0.00 C ATOM 2292 CG1 VAL A 145 -11.555 -3.220 -8.218 1.00 0.00 C ATOM 2293 CG2 VAL A 145 -9.638 -4.630 -7.384 1.00 0.00 C ATOM 0 H VAL A 145 -11.358 -7.000 -8.729 1.00 0.00 H new ATOM 0 HA VAL A 145 -11.728 -5.505 -6.296 1.00 0.00 H new ATOM 0 HB VAL A 145 -10.853 -5.038 -9.089 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -10.833 -2.593 -8.741 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -12.488 -3.247 -8.782 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -11.742 -2.808 -7.226 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -8.954 -3.975 -7.924 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -9.758 -4.267 -6.363 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -9.232 -5.641 -7.364 1.00 0.00 H new ATOM 2303 N GLU A 146 -13.997 -5.334 -8.664 1.00 0.00 N ATOM 2304 CA GLU A 146 -15.372 -4.950 -8.934 1.00 0.00 C ATOM 2305 C GLU A 146 -16.304 -5.529 -7.868 1.00 0.00 C ATOM 2306 O GLU A 146 -17.028 -4.789 -7.203 1.00 0.00 O ATOM 2307 CB GLU A 146 -15.800 -5.392 -10.335 1.00 0.00 C ATOM 2308 CG GLU A 146 -15.598 -4.266 -11.351 1.00 0.00 C ATOM 2309 CD GLU A 146 -16.890 -3.471 -11.553 1.00 0.00 C ATOM 2310 OE1 GLU A 146 -17.248 -3.260 -12.731 1.00 0.00 O ATOM 2311 OE2 GLU A 146 -17.490 -3.092 -10.524 1.00 0.00 O ATOM 0 H GLU A 146 -13.523 -5.795 -9.440 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.439 -3.863 -8.896 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.223 -6.266 -10.636 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.848 -5.691 -10.322 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.807 -3.600 -11.008 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.272 -4.685 -12.303 1.00 0.00 H new ATOM 2319 N ASN A 147 -16.256 -6.846 -7.737 1.00 0.00 N ATOM 2320 CA ASN A 147 -17.086 -7.533 -6.763 1.00 0.00 C ATOM 2321 C ASN A 147 -16.868 -6.910 -5.383 1.00 0.00 C ATOM 2322 O ASN A 147 -17.823 -6.499 -4.725 1.00 0.00 O ATOM 2323 CB ASN A 147 -16.721 -9.016 -6.675 1.00 0.00 C ATOM 2324 CG ASN A 147 -17.926 -9.899 -7.008 1.00 0.00 C ATOM 2325 OD1 ASN A 147 -19.071 -9.538 -6.790 1.00 0.00 O ATOM 2326 ND2 ASN A 147 -17.605 -11.071 -7.547 1.00 0.00 N ATOM 0 H ASN A 147 -15.654 -7.456 -8.290 1.00 0.00 H new ATOM 0 HA ASN A 147 -18.125 -7.436 -7.078 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -15.904 -9.235 -7.363 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -16.363 -9.247 -5.672 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -18.338 -11.731 -7.805 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -16.626 -11.310 -7.702 1.00 0.00 H new ATOM 2333 N TYR A 148 -15.605 -6.859 -4.985 1.00 0.00 N ATOM 2334 CA TYR A 148 -15.249 -6.293 -3.695 1.00 0.00 C ATOM 2335 C TYR A 148 -15.776 -4.862 -3.560 1.00 0.00 C ATOM 2336 O TYR A 148 -16.408 -4.522 -2.562 1.00 0.00 O ATOM 2337 CB TYR A 148 -13.720 -6.266 -3.654 1.00 0.00 C ATOM 2338 CG TYR A 148 -13.142 -5.276 -2.641 1.00 0.00 C ATOM 2339 CD1 TYR A 148 -12.890 -5.682 -1.346 1.00 0.00 C ATOM 2340 CD2 TYR A 148 -12.873 -3.977 -3.021 1.00 0.00 C ATOM 2341 CE1 TYR A 148 -12.346 -4.751 -0.392 1.00 0.00 C ATOM 2342 CE2 TYR A 148 -12.329 -3.046 -2.067 1.00 0.00 C ATOM 2343 CZ TYR A 148 -12.092 -3.478 -0.800 1.00 0.00 C ATOM 2344 OH TYR A 148 -11.578 -2.599 0.101 1.00 0.00 O ATOM 0 H TYR A 148 -14.816 -7.200 -5.533 1.00 0.00 H new ATOM 0 HA TYR A 148 -15.679 -6.883 -2.885 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -13.355 -7.266 -3.418 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -13.345 -6.016 -4.646 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -13.101 -6.698 -1.048 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -13.071 -3.659 -4.034 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -12.144 -5.056 0.624 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -12.114 -2.027 -2.352 1.00 0.00 H new ATOM 0 HH TYR A 148 -10.653 -2.848 0.310 1.00 0.00 H new ATOM 2354 N LEU A 149 -15.496 -4.064 -4.580 1.00 0.00 N ATOM 2355 CA LEU A 149 -15.934 -2.678 -4.587 1.00 0.00 C ATOM 2356 C LEU A 149 -17.451 -2.626 -4.397 1.00 0.00 C ATOM 2357 O LEU A 149 -17.942 -1.981 -3.472 1.00 0.00 O ATOM 2358 CB LEU A 149 -15.449 -1.970 -5.854 1.00 0.00 C ATOM 2359 CG LEU A 149 -13.959 -1.623 -5.900 1.00 0.00 C ATOM 2360 CD1 LEU A 149 -13.583 -0.998 -7.244 1.00 0.00 C ATOM 2361 CD2 LEU A 149 -13.568 -0.728 -4.722 1.00 0.00 C ATOM 0 H LEU A 149 -14.972 -4.350 -5.407 1.00 0.00 H new ATOM 0 HA LEU A 149 -15.489 -2.134 -3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -15.681 -2.602 -6.711 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -16.020 -1.049 -5.973 1.00 0.00 H new ATOM 0 HG LEU A 149 -13.390 -2.548 -5.805 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -12.519 -0.761 -7.250 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -13.803 -1.702 -8.047 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.159 -0.085 -7.394 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -12.504 -0.496 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -14.143 0.197 -4.761 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -13.777 -1.246 -3.786 1.00 0.00 H new ATOM 2373 N ILE A 150 -18.151 -3.315 -5.286 1.00 0.00 N ATOM 2374 CA ILE A 150 -19.602 -3.356 -5.227 1.00 0.00 C ATOM 2375 C ILE A 150 -20.045 -3.503 -3.770 1.00 0.00 C ATOM 2376 O ILE A 150 -20.906 -2.759 -3.301 1.00 0.00 O ATOM 2377 CB ILE A 150 -20.146 -4.450 -6.148 1.00 0.00 C ATOM 2378 CG1 ILE A 150 -19.905 -4.098 -7.618 1.00 0.00 C ATOM 2379 CG2 ILE A 150 -21.623 -4.726 -5.859 1.00 0.00 C ATOM 2380 CD1 ILE A 150 -20.221 -5.289 -8.525 1.00 0.00 C ATOM 0 H ILE A 150 -17.740 -3.849 -6.051 1.00 0.00 H new ATOM 0 HA ILE A 150 -20.024 -2.422 -5.597 1.00 0.00 H new ATOM 0 HB ILE A 150 -19.601 -5.372 -5.944 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -20.526 -3.247 -7.899 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -18.867 -3.795 -7.758 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -21.985 -5.507 -6.527 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -21.737 -5.052 -4.825 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -22.201 -3.816 -6.019 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -20.042 -5.013 -9.564 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -19.581 -6.130 -8.257 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -21.266 -5.574 -8.401 1.00 0.00 H new ATOM 2392 N GLY A 151 -19.437 -4.466 -3.094 1.00 0.00 N ATOM 2393 CA GLY A 151 -19.758 -4.720 -1.700 1.00 0.00 C ATOM 2394 C GLY A 151 -18.804 -3.967 -0.772 1.00 0.00 C ATOM 2395 O GLY A 151 -18.434 -4.472 0.287 1.00 0.00 O ATOM 0 H GLY A 151 -18.723 -5.080 -3.486 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -20.785 -4.414 -1.498 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -19.698 -5.790 -1.498 1.00 0.00 H new ATOM 2399 N SER A 152 -18.433 -2.770 -1.202 1.00 0.00 N ATOM 2400 CA SER A 152 -17.529 -1.941 -0.422 1.00 0.00 C ATOM 2401 C SER A 152 -18.272 -1.332 0.768 1.00 0.00 C ATOM 2402 O SER A 152 -19.281 -0.651 0.592 1.00 0.00 O ATOM 2403 CB SER A 152 -16.912 -0.838 -1.284 1.00 0.00 C ATOM 2404 OG SER A 152 -17.901 -0.106 -2.004 1.00 0.00 O ATOM 0 H SER A 152 -18.742 -2.354 -2.081 1.00 0.00 H new ATOM 0 HA SER A 152 -16.720 -2.571 -0.052 1.00 0.00 H new ATOM 0 HB2 SER A 152 -16.347 -0.156 -0.649 1.00 0.00 H new ATOM 0 HB3 SER A 152 -16.205 -1.280 -1.986 1.00 0.00 H new ATOM 0 HG SER A 152 -17.965 -0.454 -2.918 1.00 0.00 H new ATOM 2410 N PRO A 153 -17.730 -1.606 1.985 1.00 0.00 N ATOM 2411 CA PRO A 153 -18.331 -1.093 3.204 1.00 0.00 C ATOM 2412 C PRO A 153 -18.041 0.400 3.373 1.00 0.00 C ATOM 2413 O PRO A 153 -18.856 1.136 3.925 1.00 0.00 O ATOM 2414 CB PRO A 153 -17.744 -1.942 4.320 1.00 0.00 C ATOM 2415 CG PRO A 153 -16.494 -2.585 3.741 1.00 0.00 C ATOM 2416 CD PRO A 153 -16.536 -2.409 2.232 1.00 0.00 C ATOM 0 HA PRO A 153 -19.419 -1.163 3.198 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -17.502 -1.331 5.190 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.455 -2.699 4.650 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -15.599 -2.120 4.155 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -16.453 -3.643 4.001 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -15.639 -1.908 1.867 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -16.594 -3.371 1.723 1.00 0.00 H new ATOM 2424 N VAL A 154 -16.875 0.801 2.887 1.00 0.00 N ATOM 2425 CA VAL A 154 -16.467 2.193 2.976 1.00 0.00 C ATOM 2426 C VAL A 154 -15.692 2.575 1.713 1.00 0.00 C ATOM 2427 O VAL A 154 -15.908 3.646 1.149 1.00 0.00 O ATOM 2428 CB VAL A 154 -15.667 2.421 4.260 1.00 0.00 C ATOM 2429 CG1 VAL A 154 -16.593 2.507 5.475 1.00 0.00 C ATOM 2430 CG2 VAL A 154 -14.612 1.330 4.451 1.00 0.00 C ATOM 0 H VAL A 154 -16.200 0.187 2.431 1.00 0.00 H new ATOM 0 HA VAL A 154 -17.339 2.844 3.031 1.00 0.00 H new ATOM 0 HB VAL A 154 -15.148 3.375 4.166 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -15.999 2.669 6.374 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -17.288 3.336 5.345 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -17.152 1.577 5.573 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -14.058 1.517 5.371 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -15.101 0.358 4.513 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -13.924 1.337 3.606 1.00 0.00 H new ATOM 2440 N VAL A 155 -14.806 1.677 1.307 1.00 0.00 N ATOM 2441 CA VAL A 155 -13.998 1.907 0.122 1.00 0.00 C ATOM 2442 C VAL A 155 -14.911 2.282 -1.047 1.00 0.00 C ATOM 2443 O VAL A 155 -15.415 1.408 -1.751 1.00 0.00 O ATOM 2444 CB VAL A 155 -13.131 0.680 -0.167 1.00 0.00 C ATOM 2445 CG1 VAL A 155 -13.995 -0.569 -0.358 1.00 0.00 C ATOM 2446 CG2 VAL A 155 -12.232 0.916 -1.382 1.00 0.00 C ATOM 0 H VAL A 155 -14.630 0.789 1.778 1.00 0.00 H new ATOM 0 HA VAL A 155 -13.314 2.741 0.282 1.00 0.00 H new ATOM 0 HB VAL A 155 -12.488 0.514 0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -13.354 -1.427 -0.562 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -14.572 -0.754 0.548 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -14.675 -0.416 -1.196 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -11.627 0.028 -1.565 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -12.849 1.121 -2.257 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -11.579 1.767 -1.191 1.00 0.00 H new ATOM 2456 N ASP A 156 -15.096 3.583 -1.218 1.00 0.00 N ATOM 2457 CA ASP A 156 -15.939 4.084 -2.290 1.00 0.00 C ATOM 2458 C ASP A 156 -15.133 4.128 -3.590 1.00 0.00 C ATOM 2459 O ASP A 156 -14.342 5.046 -3.803 1.00 0.00 O ATOM 2460 CB ASP A 156 -16.428 5.503 -1.989 1.00 0.00 C ATOM 2461 CG ASP A 156 -15.449 6.369 -1.194 1.00 0.00 C ATOM 2462 OD1 ASP A 156 -14.263 5.978 -1.136 1.00 0.00 O ATOM 2463 OD2 ASP A 156 -15.908 7.402 -0.662 1.00 0.00 O ATOM 0 H ASP A 156 -14.677 4.305 -0.632 1.00 0.00 H new ATOM 0 HA ASP A 156 -16.797 3.418 -2.383 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -16.649 6.003 -2.932 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -17.365 5.439 -1.436 1.00 0.00 H new ATOM 2469 N SER A 157 -15.361 3.125 -4.424 1.00 0.00 N ATOM 2470 CA SER A 157 -14.665 3.038 -5.697 1.00 0.00 C ATOM 2471 C SER A 157 -14.702 4.392 -6.408 1.00 0.00 C ATOM 2472 O SER A 157 -13.699 4.831 -6.968 1.00 0.00 O ATOM 2473 CB SER A 157 -15.279 1.955 -6.587 1.00 0.00 C ATOM 2474 OG SER A 157 -16.459 2.409 -7.243 1.00 0.00 O ATOM 0 H SER A 157 -16.018 2.366 -4.244 1.00 0.00 H new ATOM 0 HA SER A 157 -13.628 2.766 -5.501 1.00 0.00 H new ATOM 0 HB2 SER A 157 -14.548 1.641 -7.332 1.00 0.00 H new ATOM 0 HB3 SER A 157 -15.515 1.079 -5.982 1.00 0.00 H new ATOM 0 HG SER A 157 -16.820 1.690 -7.803 1.00 0.00 H new ATOM 2480 N GLN A 158 -15.869 5.017 -6.361 1.00 0.00 N ATOM 2481 CA GLN A 158 -16.050 6.313 -6.994 1.00 0.00 C ATOM 2482 C GLN A 158 -14.955 7.281 -6.542 1.00 0.00 C ATOM 2483 O GLN A 158 -14.698 8.285 -7.204 1.00 0.00 O ATOM 2484 CB GLN A 158 -17.440 6.879 -6.696 1.00 0.00 C ATOM 2485 CG GLN A 158 -18.414 6.569 -7.835 1.00 0.00 C ATOM 2486 CD GLN A 158 -19.518 7.625 -7.916 1.00 0.00 C ATOM 2487 OE1 GLN A 158 -19.651 8.487 -7.063 1.00 0.00 O ATOM 2488 NE2 GLN A 158 -20.299 7.510 -8.985 1.00 0.00 N ATOM 0 H GLN A 158 -16.699 4.650 -5.895 1.00 0.00 H new ATOM 0 HA GLN A 158 -15.971 6.183 -8.073 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -17.817 6.456 -5.765 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -17.374 7.957 -6.552 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -17.873 6.530 -8.780 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -18.858 5.585 -7.681 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -20.132 6.764 -9.661 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -21.065 8.167 -9.130 1.00 0.00 H new ATOM 2497 N LYS A 159 -14.340 6.946 -5.417 1.00 0.00 N ATOM 2498 CA LYS A 159 -13.279 7.774 -4.869 1.00 0.00 C ATOM 2499 C LYS A 159 -11.930 7.276 -5.390 1.00 0.00 C ATOM 2500 O LYS A 159 -11.105 8.068 -5.843 1.00 0.00 O ATOM 2501 CB LYS A 159 -13.370 7.820 -3.342 1.00 0.00 C ATOM 2502 CG LYS A 159 -13.674 9.237 -2.854 1.00 0.00 C ATOM 2503 CD LYS A 159 -12.384 10.014 -2.587 1.00 0.00 C ATOM 2504 CE LYS A 159 -12.152 11.078 -3.661 1.00 0.00 C ATOM 2505 NZ LYS A 159 -12.469 12.425 -3.135 1.00 0.00 N ATOM 0 H LYS A 159 -14.556 6.113 -4.870 1.00 0.00 H new ATOM 0 HA LYS A 159 -13.389 8.806 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -14.149 7.139 -3.000 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -12.432 7.475 -2.908 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -14.271 9.762 -3.600 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -14.270 9.191 -1.943 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -12.437 10.487 -1.607 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -11.539 9.326 -2.563 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -11.115 11.046 -3.994 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -12.773 10.866 -4.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -12.306 13.135 -3.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -13.465 12.456 -2.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -11.859 12.631 -2.319 1.00 0.00 H new ATOM 2519 N LEU A 160 -11.746 5.966 -5.308 1.00 0.00 N ATOM 2520 CA LEU A 160 -10.511 5.354 -5.766 1.00 0.00 C ATOM 2521 C LEU A 160 -10.203 5.836 -7.185 1.00 0.00 C ATOM 2522 O LEU A 160 -11.013 6.529 -7.799 1.00 0.00 O ATOM 2523 CB LEU A 160 -10.588 3.831 -5.637 1.00 0.00 C ATOM 2524 CG LEU A 160 -10.763 3.287 -4.218 1.00 0.00 C ATOM 2525 CD1 LEU A 160 -11.626 2.023 -4.218 1.00 0.00 C ATOM 2526 CD2 LEU A 160 -9.406 3.054 -3.549 1.00 0.00 C ATOM 0 H LEU A 160 -12.432 5.312 -4.931 1.00 0.00 H new ATOM 0 HA LEU A 160 -9.677 5.663 -5.136 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -11.419 3.476 -6.246 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -9.678 3.404 -6.059 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.289 4.037 -3.627 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -11.735 1.657 -3.197 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -12.609 2.254 -4.627 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.149 1.257 -4.829 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -9.559 2.667 -2.541 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -8.832 2.333 -4.131 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -8.859 3.996 -3.497 1.00 0.00 H new ATOM 2538 N VAL A 161 -9.030 5.449 -7.666 1.00 0.00 N ATOM 2539 CA VAL A 161 -8.605 5.833 -9.001 1.00 0.00 C ATOM 2540 C VAL A 161 -7.679 4.755 -9.566 1.00 0.00 C ATOM 2541 O VAL A 161 -6.703 4.370 -8.923 1.00 0.00 O ATOM 2542 CB VAL A 161 -7.958 7.219 -8.966 1.00 0.00 C ATOM 2543 CG1 VAL A 161 -6.951 7.383 -10.107 1.00 0.00 C ATOM 2544 CG2 VAL A 161 -9.019 8.321 -9.008 1.00 0.00 C ATOM 0 H VAL A 161 -8.361 4.873 -7.155 1.00 0.00 H new ATOM 0 HA VAL A 161 -9.463 5.907 -9.669 1.00 0.00 H new ATOM 0 HB VAL A 161 -7.416 7.312 -8.025 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -6.506 8.377 -10.059 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -6.169 6.630 -10.013 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -7.461 7.259 -11.063 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -8.532 9.296 -8.982 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -9.601 8.231 -9.925 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -9.680 8.223 -8.147 1.00 0.00 H new ATOM 2554 N TYR A 162 -8.016 4.297 -10.763 1.00 0.00 N ATOM 2555 CA TYR A 162 -7.227 3.271 -11.422 1.00 0.00 C ATOM 2556 C TYR A 162 -5.894 3.837 -11.915 1.00 0.00 C ATOM 2557 O TYR A 162 -5.772 5.040 -12.143 1.00 0.00 O ATOM 2558 CB TYR A 162 -8.051 2.815 -12.628 1.00 0.00 C ATOM 2559 CG TYR A 162 -8.893 1.564 -12.368 1.00 0.00 C ATOM 2560 CD1 TYR A 162 -9.800 1.547 -11.328 1.00 0.00 C ATOM 2561 CD2 TYR A 162 -8.746 0.454 -13.174 1.00 0.00 C ATOM 2562 CE1 TYR A 162 -10.593 0.370 -11.084 1.00 0.00 C ATOM 2563 CE2 TYR A 162 -9.539 -0.723 -12.930 1.00 0.00 C ATOM 2564 CZ TYR A 162 -10.423 -0.707 -11.897 1.00 0.00 C ATOM 2565 OH TYR A 162 -11.172 -1.819 -11.666 1.00 0.00 O ATOM 0 H TYR A 162 -8.826 4.618 -11.294 1.00 0.00 H new ATOM 0 HA TYR A 162 -7.006 2.455 -10.734 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -8.710 3.628 -12.933 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -7.378 2.620 -13.463 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -9.915 2.416 -10.697 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -8.036 0.468 -13.988 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -11.307 0.343 -10.274 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -9.434 -1.599 -13.553 1.00 0.00 H new ATOM 0 HH TYR A 162 -10.946 -2.509 -12.325 1.00 0.00 H new ATOM 2575 N SER A 163 -4.927 2.943 -12.066 1.00 0.00 N ATOM 2576 CA SER A 163 -3.608 3.339 -12.528 1.00 0.00 C ATOM 2577 C SER A 163 -3.734 4.350 -13.670 1.00 0.00 C ATOM 2578 O SER A 163 -4.799 4.483 -14.271 1.00 0.00 O ATOM 2579 CB SER A 163 -2.796 2.124 -12.983 1.00 0.00 C ATOM 2580 OG SER A 163 -3.552 1.264 -13.832 1.00 0.00 O ATOM 0 H SER A 163 -5.031 1.946 -11.876 1.00 0.00 H new ATOM 0 HA SER A 163 -3.080 3.805 -11.696 1.00 0.00 H new ATOM 0 HB2 SER A 163 -1.904 2.461 -13.510 1.00 0.00 H new ATOM 0 HB3 SER A 163 -2.458 1.566 -12.110 1.00 0.00 H new ATOM 0 HG SER A 163 -3.138 0.376 -13.850 1.00 0.00 H new ATOM 2586 N ASP A 164 -2.632 5.036 -13.935 1.00 0.00 N ATOM 2587 CA ASP A 164 -2.606 6.031 -14.994 1.00 0.00 C ATOM 2588 C ASP A 164 -1.418 6.970 -14.776 1.00 0.00 C ATOM 2589 O ASP A 164 -1.408 7.755 -13.829 1.00 0.00 O ATOM 2590 CB ASP A 164 -3.883 6.874 -14.988 1.00 0.00 C ATOM 2591 CG ASP A 164 -4.368 7.304 -13.603 1.00 0.00 C ATOM 2592 OD1 ASP A 164 -5.454 7.921 -13.548 1.00 0.00 O ATOM 2593 OD2 ASP A 164 -3.642 7.006 -12.629 1.00 0.00 O ATOM 0 H ASP A 164 -1.750 4.923 -13.435 1.00 0.00 H new ATOM 0 HA ASP A 164 -2.523 5.508 -15.947 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -3.714 7.767 -15.590 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -4.677 6.307 -15.474 1.00 0.00 H new ATOM 2599 N PHE A 165 -0.446 6.858 -15.669 1.00 0.00 N ATOM 2600 CA PHE A 165 0.744 7.688 -15.587 1.00 0.00 C ATOM 2601 C PHE A 165 0.868 8.593 -16.814 1.00 0.00 C ATOM 2602 O PHE A 165 1.013 9.807 -16.683 1.00 0.00 O ATOM 2603 CB PHE A 165 1.947 6.742 -15.542 1.00 0.00 C ATOM 2604 CG PHE A 165 1.938 5.673 -16.636 1.00 0.00 C ATOM 2605 CD1 PHE A 165 1.160 4.566 -16.500 1.00 0.00 C ATOM 2606 CD2 PHE A 165 2.710 5.829 -17.745 1.00 0.00 C ATOM 2607 CE1 PHE A 165 1.152 3.574 -17.515 1.00 0.00 C ATOM 2608 CE2 PHE A 165 2.702 4.837 -18.761 1.00 0.00 C ATOM 2609 CZ PHE A 165 1.923 3.730 -18.624 1.00 0.00 C ATOM 0 H PHE A 165 -0.458 6.205 -16.453 1.00 0.00 H new ATOM 0 HA PHE A 165 0.693 8.324 -14.704 1.00 0.00 H new ATOM 0 HB2 PHE A 165 2.861 7.329 -15.629 1.00 0.00 H new ATOM 0 HB3 PHE A 165 1.975 6.252 -14.569 1.00 0.00 H new ATOM 0 HD1 PHE A 165 0.548 4.442 -15.619 1.00 0.00 H new ATOM 0 HD2 PHE A 165 3.329 6.707 -17.853 1.00 0.00 H new ATOM 0 HE1 PHE A 165 0.534 2.695 -17.406 1.00 0.00 H new ATOM 0 HE2 PHE A 165 3.314 4.961 -19.642 1.00 0.00 H new ATOM 0 HZ PHE A 165 1.917 2.975 -19.396 1.00 0.00 H new ATOM 2619 N SER A 166 0.806 7.966 -17.980 1.00 0.00 N ATOM 2620 CA SER A 166 0.910 8.700 -19.230 1.00 0.00 C ATOM 2621 C SER A 166 2.366 9.090 -19.490 1.00 0.00 C ATOM 2622 O SER A 166 3.123 9.335 -18.552 1.00 0.00 O ATOM 2623 CB SER A 166 0.022 9.946 -19.212 1.00 0.00 C ATOM 2624 OG SER A 166 -0.604 10.174 -20.472 1.00 0.00 O ATOM 0 H SER A 166 0.685 6.959 -18.085 1.00 0.00 H new ATOM 0 HA SER A 166 0.566 8.052 -20.036 1.00 0.00 H new ATOM 0 HB2 SER A 166 -0.742 9.836 -18.442 1.00 0.00 H new ATOM 0 HB3 SER A 166 0.622 10.815 -18.943 1.00 0.00 H new ATOM 0 HG SER A 166 -1.163 10.977 -20.419 1.00 0.00 H new ATOM 2630 N GLU A 167 2.715 9.134 -20.767 1.00 0.00 N ATOM 2631 CA GLU A 167 4.067 9.490 -21.162 1.00 0.00 C ATOM 2632 C GLU A 167 4.549 10.706 -20.369 1.00 0.00 C ATOM 2633 O GLU A 167 5.721 10.788 -20.002 1.00 0.00 O ATOM 2634 CB GLU A 167 4.149 9.750 -22.667 1.00 0.00 C ATOM 2635 CG GLU A 167 4.708 8.531 -23.405 1.00 0.00 C ATOM 2636 CD GLU A 167 3.703 8.003 -24.431 1.00 0.00 C ATOM 2637 OE1 GLU A 167 3.184 6.891 -24.195 1.00 0.00 O ATOM 2638 OE2 GLU A 167 3.478 8.722 -25.427 1.00 0.00 O ATOM 0 H GLU A 167 2.084 8.929 -21.542 1.00 0.00 H new ATOM 0 HA GLU A 167 4.723 8.649 -20.936 1.00 0.00 H new ATOM 0 HB2 GLU A 167 3.158 9.990 -23.053 1.00 0.00 H new ATOM 0 HB3 GLU A 167 4.783 10.616 -22.856 1.00 0.00 H new ATOM 0 HG2 GLU A 167 5.638 8.800 -23.906 1.00 0.00 H new ATOM 0 HG3 GLU A 167 4.948 7.746 -22.688 1.00 0.00 H new ATOM 2646 N ALA A 168 3.621 11.620 -20.126 1.00 0.00 N ATOM 2647 CA ALA A 168 3.937 12.828 -19.383 1.00 0.00 C ATOM 2648 C ALA A 168 4.531 12.446 -18.026 1.00 0.00 C ATOM 2649 O ALA A 168 5.444 13.108 -17.536 1.00 0.00 O ATOM 2650 CB ALA A 168 2.678 13.688 -19.248 1.00 0.00 C ATOM 0 H ALA A 168 2.650 11.548 -20.431 1.00 0.00 H new ATOM 0 HA ALA A 168 4.682 13.421 -19.913 1.00 0.00 H new ATOM 0 HB1 ALA A 168 2.915 14.594 -18.691 1.00 0.00 H new ATOM 0 HB2 ALA A 168 2.313 13.956 -20.239 1.00 0.00 H new ATOM 0 HB3 ALA A 168 1.909 13.126 -18.718 1.00 0.00 H new ATOM 2656 N ALA A 169 3.988 11.380 -17.457 1.00 0.00 N ATOM 2657 CA ALA A 169 4.453 10.902 -16.166 1.00 0.00 C ATOM 2658 C ALA A 169 5.687 10.019 -16.368 1.00 0.00 C ATOM 2659 O ALA A 169 6.745 10.287 -15.802 1.00 0.00 O ATOM 2660 CB ALA A 169 3.318 10.163 -15.456 1.00 0.00 C ATOM 0 H ALA A 169 3.230 10.834 -17.866 1.00 0.00 H new ATOM 0 HA ALA A 169 4.746 11.738 -15.530 1.00 0.00 H new ATOM 0 HB1 ALA A 169 3.667 9.804 -14.488 1.00 0.00 H new ATOM 0 HB2 ALA A 169 2.477 10.841 -15.310 1.00 0.00 H new ATOM 0 HB3 ALA A 169 3.000 9.316 -16.063 1.00 0.00 H new ATOM 2666 N CYS A 170 5.509 8.985 -17.177 1.00 0.00 N ATOM 2667 CA CYS A 170 6.594 8.061 -17.460 1.00 0.00 C ATOM 2668 C CYS A 170 7.840 8.877 -17.813 1.00 0.00 C ATOM 2669 O CYS A 170 8.919 8.631 -17.277 1.00 0.00 O ATOM 2670 CB CYS A 170 6.224 7.077 -18.572 1.00 0.00 C ATOM 2671 SG CYS A 170 6.523 5.317 -18.170 1.00 0.00 S ATOM 0 H CYS A 170 4.630 8.767 -17.645 1.00 0.00 H new ATOM 0 HA CYS A 170 6.796 7.453 -16.578 1.00 0.00 H new ATOM 0 HB2 CYS A 170 5.169 7.205 -18.815 1.00 0.00 H new ATOM 0 HB3 CYS A 170 6.791 7.332 -19.467 1.00 0.00 H new ATOM 2677 N LYS A 171 7.648 9.832 -18.711 1.00 0.00 N ATOM 2678 CA LYS A 171 8.742 10.685 -19.141 1.00 0.00 C ATOM 2679 C LYS A 171 9.441 11.270 -17.912 1.00 0.00 C ATOM 2680 O LYS A 171 8.860 12.080 -17.190 1.00 0.00 O ATOM 2681 CB LYS A 171 8.241 11.744 -20.125 1.00 0.00 C ATOM 2682 CG LYS A 171 9.409 12.519 -20.739 1.00 0.00 C ATOM 2683 CD LYS A 171 9.715 13.781 -19.930 1.00 0.00 C ATOM 2684 CE LYS A 171 11.194 14.157 -20.039 1.00 0.00 C ATOM 2685 NZ LYS A 171 11.396 15.166 -21.102 1.00 0.00 N ATOM 0 H LYS A 171 6.751 10.034 -19.152 1.00 0.00 H new ATOM 0 HA LYS A 171 9.486 10.104 -19.685 1.00 0.00 H new ATOM 0 HB2 LYS A 171 7.662 11.266 -20.915 1.00 0.00 H new ATOM 0 HB3 LYS A 171 7.572 12.434 -19.612 1.00 0.00 H new ATOM 0 HG2 LYS A 171 10.293 11.883 -20.775 1.00 0.00 H new ATOM 0 HG3 LYS A 171 9.169 12.791 -21.767 1.00 0.00 H new ATOM 0 HD2 LYS A 171 9.099 14.606 -20.289 1.00 0.00 H new ATOM 0 HD3 LYS A 171 9.453 13.619 -18.884 1.00 0.00 H new ATOM 0 HE2 LYS A 171 11.547 14.550 -19.085 1.00 0.00 H new ATOM 0 HE3 LYS A 171 11.786 13.268 -20.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 12.405 15.410 -21.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 11.078 14.778 -22.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 10.846 16.020 -20.879 1.00 0.00 H new ATOM 2699 N VAL A 172 10.677 10.838 -17.711 1.00 0.00 N ATOM 2700 CA VAL A 172 11.460 11.308 -16.582 1.00 0.00 C ATOM 2701 C VAL A 172 12.269 12.536 -17.004 1.00 0.00 C ATOM 2702 O VAL A 172 12.750 12.609 -18.134 1.00 0.00 O ATOM 2703 CB VAL A 172 12.334 10.174 -16.042 1.00 0.00 C ATOM 2704 CG1 VAL A 172 13.080 10.609 -14.779 1.00 0.00 C ATOM 2705 CG2 VAL A 172 11.501 8.917 -15.781 1.00 0.00 C ATOM 0 H VAL A 172 11.156 10.167 -18.312 1.00 0.00 H new ATOM 0 HA VAL A 172 10.806 11.614 -15.765 1.00 0.00 H new ATOM 0 HB VAL A 172 13.077 9.933 -16.803 1.00 0.00 H new ATOM 0 HG11 VAL A 172 13.693 9.784 -14.416 1.00 0.00 H new ATOM 0 HG12 VAL A 172 13.718 11.462 -15.009 1.00 0.00 H new ATOM 0 HG13 VAL A 172 12.360 10.891 -14.010 1.00 0.00 H new ATOM 0 HG21 VAL A 172 12.146 8.126 -15.398 1.00 0.00 H new ATOM 0 HG22 VAL A 172 10.726 9.140 -15.048 1.00 0.00 H new ATOM 0 HG23 VAL A 172 11.037 8.588 -16.711 1.00 0.00 H new