USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1001 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 50 MET CE :methyl 139:sc= -0.517 (180deg=-0.526) USER MOD Set 1.2: A 101 HIS : no HD1:sc= -0.126 K(o=-0.64,f=-1.3) USER MOD Set 2.1: A 2 SER OG : rot 180:sc= 0.0181 USER MOD Set 2.2: A 5 SER OG : rot 170:sc= -0.0954 USER MOD Single : A 1 GLY N :NH3+ -111:sc= 0.0348 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -3.09! K(o=-3.1!,f=-1.5) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 19 GLN : amide:sc= -0.0949 K(o=-0.095,f=-1.9!) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 63:sc= 0.168 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 CYS SG : rot -170:sc= -0.422 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot -87:sc= -0.738 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -146:sc= -0.56 (180deg=-2.18!) USER MOD Single : A 44 LYS NZ :NH3+ -146:sc= -1.42 (180deg=-3.22!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HD1:sc= -0.281 X(o=-0.28,f=-0.013) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 ASN : amide:sc= -0.0336 K(o=-0.034,f=-0.61) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.201 X(o=-0.2,f=-0.2) USER MOD Single : A 67 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.15) USER MOD Single : A 69 GLN : amide:sc= -0.149 K(o=-0.15,f=-1.9!) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 170:sc= 0.31 (180deg=0.272) USER MOD Single : A 75 MET CE :methyl 153:sc= -0.774 (180deg=-1.17) USER MOD Single : A 76 THR OG1 : rot 131:sc= 0.364 USER MOD Single : A 80 THR OG1 : rot 36:sc= 0.519 USER MOD Single : A 87 ASN : amide:sc= -0.266 K(o=-0.27,f=-1.9!) USER MOD Single : A 89 THR OG1 : rot 12:sc= 0.366 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0613 USER MOD Single : A 97 THR OG1 : rot 76:sc= 0.571 USER MOD Single : A 98 HIS : no HE2:sc= -0.421 K(o=-0.42,f=-1.9) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 HIS : no HD1:sc= -6.48! C(o=-6.5!,f=-5.1!) USER MOD Single : A 112 GLN : amide:sc= -0.191 K(o=-0.19,f=-3.1!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ -163:sc= -0.0111 (180deg=-0.161) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -54:sc= 0.147 USER MOD Single : A 119 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0172) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 125 SER OG : rot 41:sc= 0.949 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= -0.165 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -1.476 -3.402 -19.744 1.00 0.00 N ATOM 2 CA GLY A 1 -0.038 -3.415 -19.549 1.00 0.00 C ATOM 3 C GLY A 1 0.700 -4.047 -20.712 1.00 0.00 C ATOM 4 O GLY A 1 0.134 -4.854 -21.450 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.798 -2.423 -19.884 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.718 -3.970 -20.581 1.00 0.00 H new ATOM 0 H3 GLY A 1 -1.944 -3.804 -18.906 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.316 -2.393 -19.411 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.196 -3.960 -18.635 1.00 0.00 H new ATOM 8 N SER A 2 1.966 -3.679 -20.878 1.00 0.00 N ATOM 9 CA SER A 2 2.781 -4.211 -21.964 1.00 0.00 C ATOM 10 C SER A 2 2.825 -5.735 -21.912 1.00 0.00 C ATOM 11 O SER A 2 3.059 -6.325 -20.858 1.00 0.00 O ATOM 12 CB SER A 2 4.201 -3.645 -21.889 1.00 0.00 C ATOM 13 OG SER A 2 4.947 -3.986 -23.044 1.00 0.00 O ATOM 0 H SER A 2 2.450 -3.014 -20.274 1.00 0.00 H new ATOM 0 HA SER A 2 2.327 -3.909 -22.908 1.00 0.00 H new ATOM 0 HB2 SER A 2 4.159 -2.561 -21.786 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.703 -4.030 -21.001 1.00 0.00 H new ATOM 0 HG SER A 2 5.850 -3.612 -22.973 1.00 0.00 H new ATOM 19 N SER A 3 2.599 -6.366 -23.060 1.00 0.00 N ATOM 20 CA SER A 3 2.609 -7.822 -23.147 1.00 0.00 C ATOM 21 C SER A 3 4.035 -8.360 -23.092 1.00 0.00 C ATOM 22 O SER A 3 4.969 -7.725 -23.580 1.00 0.00 O ATOM 23 CB SER A 3 1.928 -8.282 -24.437 1.00 0.00 C ATOM 24 OG SER A 3 1.922 -9.695 -24.535 1.00 0.00 O ATOM 0 H SER A 3 2.407 -5.892 -23.943 1.00 0.00 H new ATOM 0 HA SER A 3 2.058 -8.216 -22.293 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.904 -7.908 -24.465 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.446 -7.857 -25.297 1.00 0.00 H new ATOM 0 HG SER A 3 1.480 -9.963 -25.367 1.00 0.00 H new ATOM 30 N GLY A 4 4.195 -9.536 -22.493 1.00 0.00 N ATOM 31 CA GLY A 4 5.510 -10.141 -22.384 1.00 0.00 C ATOM 32 C GLY A 4 6.577 -9.141 -21.985 1.00 0.00 C ATOM 33 O GLY A 4 7.317 -8.640 -22.832 1.00 0.00 O ATOM 0 H GLY A 4 3.437 -10.081 -22.081 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.477 -10.945 -21.649 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.779 -10.593 -23.339 1.00 0.00 H new ATOM 37 N SER A 5 6.656 -8.847 -20.691 1.00 0.00 N ATOM 38 CA SER A 5 7.637 -7.896 -20.181 1.00 0.00 C ATOM 39 C SER A 5 7.974 -8.191 -18.723 1.00 0.00 C ATOM 40 O SER A 5 7.084 -8.317 -17.882 1.00 0.00 O ATOM 41 CB SER A 5 7.108 -6.466 -20.314 1.00 0.00 C ATOM 42 OG SER A 5 6.776 -6.168 -21.660 1.00 0.00 O ATOM 0 H SER A 5 6.052 -9.254 -19.977 1.00 0.00 H new ATOM 0 HA SER A 5 8.546 -7.997 -20.773 1.00 0.00 H new ATOM 0 HB2 SER A 5 6.228 -6.340 -19.683 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.860 -5.762 -19.957 1.00 0.00 H new ATOM 0 HG SER A 5 6.298 -5.313 -21.698 1.00 0.00 H new ATOM 48 N SER A 6 9.266 -8.301 -18.432 1.00 0.00 N ATOM 49 CA SER A 6 9.722 -8.586 -17.076 1.00 0.00 C ATOM 50 C SER A 6 11.187 -8.195 -16.903 1.00 0.00 C ATOM 51 O SER A 6 11.871 -7.861 -17.869 1.00 0.00 O ATOM 52 CB SER A 6 9.538 -10.070 -16.755 1.00 0.00 C ATOM 53 OG SER A 6 10.367 -10.877 -17.574 1.00 0.00 O ATOM 0 H SER A 6 10.015 -8.197 -19.116 1.00 0.00 H new ATOM 0 HA SER A 6 9.121 -7.995 -16.385 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.773 -10.250 -15.706 1.00 0.00 H new ATOM 0 HB3 SER A 6 8.495 -10.350 -16.901 1.00 0.00 H new ATOM 0 HG SER A 6 10.231 -11.821 -17.347 1.00 0.00 H new ATOM 59 N GLY A 7 11.662 -8.239 -15.661 1.00 0.00 N ATOM 60 CA GLY A 7 13.041 -7.887 -15.382 1.00 0.00 C ATOM 61 C GLY A 7 13.905 -9.102 -15.107 1.00 0.00 C ATOM 62 O GLY A 7 13.393 -10.200 -14.891 1.00 0.00 O ATOM 0 H GLY A 7 11.116 -8.512 -14.844 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.451 -7.338 -16.229 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.075 -7.218 -14.522 1.00 0.00 H new ATOM 66 N SER A 8 15.220 -8.905 -15.115 1.00 0.00 N ATOM 67 CA SER A 8 16.157 -9.995 -14.870 1.00 0.00 C ATOM 68 C SER A 8 17.247 -9.564 -13.893 1.00 0.00 C ATOM 69 O SER A 8 17.987 -8.613 -14.149 1.00 0.00 O ATOM 70 CB SER A 8 16.789 -10.459 -16.184 1.00 0.00 C ATOM 71 OG SER A 8 15.819 -11.041 -17.038 1.00 0.00 O ATOM 0 H SER A 8 15.660 -8.001 -15.288 1.00 0.00 H new ATOM 0 HA SER A 8 15.604 -10.824 -14.429 1.00 0.00 H new ATOM 0 HB2 SER A 8 17.258 -9.612 -16.685 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.577 -11.183 -15.977 1.00 0.00 H new ATOM 0 HG SER A 8 16.247 -11.328 -17.872 1.00 0.00 H new ATOM 77 N LEU A 9 17.341 -10.271 -12.772 1.00 0.00 N ATOM 78 CA LEU A 9 18.341 -9.963 -11.755 1.00 0.00 C ATOM 79 C LEU A 9 19.451 -11.009 -11.749 1.00 0.00 C ATOM 80 O LEU A 9 19.196 -12.200 -11.925 1.00 0.00 O ATOM 81 CB LEU A 9 17.686 -9.890 -10.375 1.00 0.00 C ATOM 82 CG LEU A 9 17.099 -8.535 -9.981 1.00 0.00 C ATOM 83 CD1 LEU A 9 15.951 -8.161 -10.905 1.00 0.00 C ATOM 84 CD2 LEU A 9 16.635 -8.555 -8.532 1.00 0.00 C ATOM 0 H LEU A 9 16.737 -11.061 -12.544 1.00 0.00 H new ATOM 0 HA LEU A 9 18.781 -8.995 -11.994 1.00 0.00 H new ATOM 0 HB2 LEU A 9 16.891 -10.634 -10.333 1.00 0.00 H new ATOM 0 HB3 LEU A 9 18.427 -10.173 -9.628 1.00 0.00 H new ATOM 0 HG LEU A 9 17.879 -7.780 -10.081 1.00 0.00 H new ATOM 0 HD11 LEU A 9 15.546 -7.193 -10.609 1.00 0.00 H new ATOM 0 HD12 LEU A 9 16.314 -8.104 -11.931 1.00 0.00 H new ATOM 0 HD13 LEU A 9 15.169 -8.917 -10.838 1.00 0.00 H new ATOM 0 HD21 LEU A 9 16.220 -7.582 -8.269 1.00 0.00 H new ATOM 0 HD22 LEU A 9 15.871 -9.322 -8.405 1.00 0.00 H new ATOM 0 HD23 LEU A 9 17.482 -8.776 -7.882 1.00 0.00 H new ATOM 96 N GLU A 10 20.684 -10.554 -11.544 1.00 0.00 N ATOM 97 CA GLU A 10 21.833 -11.452 -11.514 1.00 0.00 C ATOM 98 C GLU A 10 22.006 -12.067 -10.129 1.00 0.00 C ATOM 99 O GLU A 10 22.618 -13.124 -9.980 1.00 0.00 O ATOM 100 CB GLU A 10 23.105 -10.701 -11.914 1.00 0.00 C ATOM 101 CG GLU A 10 23.346 -9.438 -11.104 1.00 0.00 C ATOM 102 CD GLU A 10 24.671 -8.778 -11.433 1.00 0.00 C ATOM 103 OE1 GLU A 10 25.709 -9.468 -11.375 1.00 0.00 O ATOM 104 OE2 GLU A 10 24.668 -7.570 -11.750 1.00 0.00 O ATOM 0 H GLU A 10 20.912 -9.571 -11.397 1.00 0.00 H new ATOM 0 HA GLU A 10 21.654 -12.255 -12.229 1.00 0.00 H new ATOM 0 HB2 GLU A 10 23.961 -11.366 -11.798 1.00 0.00 H new ATOM 0 HB3 GLU A 10 23.045 -10.439 -12.970 1.00 0.00 H new ATOM 0 HG2 GLU A 10 22.537 -8.732 -11.290 1.00 0.00 H new ATOM 0 HG3 GLU A 10 23.319 -9.681 -10.042 1.00 0.00 H new ATOM 111 N ASN A 11 21.464 -11.397 -9.118 1.00 0.00 N ATOM 112 CA ASN A 11 21.559 -11.876 -7.744 1.00 0.00 C ATOM 113 C ASN A 11 20.517 -11.201 -6.858 1.00 0.00 C ATOM 114 O ASN A 11 19.896 -10.213 -7.254 1.00 0.00 O ATOM 115 CB ASN A 11 22.961 -11.619 -7.188 1.00 0.00 C ATOM 116 CG ASN A 11 23.246 -10.142 -6.997 1.00 0.00 C ATOM 117 OD1 ASN A 11 24.044 -9.553 -7.726 1.00 0.00 O ATOM 118 ND2 ASN A 11 22.591 -9.535 -6.014 1.00 0.00 N ATOM 0 H ASN A 11 20.954 -10.520 -9.224 1.00 0.00 H new ATOM 0 HA ASN A 11 21.367 -12.949 -7.746 1.00 0.00 H new ATOM 0 HB2 ASN A 11 23.070 -12.134 -6.233 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.701 -12.044 -7.866 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.740 -8.541 -5.839 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.938 -10.062 -5.434 1.00 0.00 H new ATOM 125 N LEU A 12 20.330 -11.739 -5.658 1.00 0.00 N ATOM 126 CA LEU A 12 19.363 -11.188 -4.715 1.00 0.00 C ATOM 127 C LEU A 12 19.984 -10.062 -3.894 1.00 0.00 C ATOM 128 O LEU A 12 20.675 -10.309 -2.906 1.00 0.00 O ATOM 129 CB LEU A 12 18.846 -12.287 -3.785 1.00 0.00 C ATOM 130 CG LEU A 12 17.680 -13.122 -4.316 1.00 0.00 C ATOM 131 CD1 LEU A 12 18.156 -14.070 -5.406 1.00 0.00 C ATOM 132 CD2 LEU A 12 17.018 -13.895 -3.185 1.00 0.00 C ATOM 0 H LEU A 12 20.835 -12.556 -5.315 1.00 0.00 H new ATOM 0 HA LEU A 12 18.528 -10.780 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 12 19.673 -12.959 -3.555 1.00 0.00 H new ATOM 0 HB3 LEU A 12 18.539 -11.826 -2.846 1.00 0.00 H new ATOM 0 HG LEU A 12 16.941 -12.447 -4.747 1.00 0.00 H new ATOM 0 HD11 LEU A 12 17.313 -14.656 -5.772 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.582 -13.495 -6.228 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.914 -14.740 -5.000 1.00 0.00 H new ATOM 0 HD21 LEU A 12 16.191 -14.483 -3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 12 17.748 -14.560 -2.723 1.00 0.00 H new ATOM 0 HD23 LEU A 12 16.641 -13.196 -2.439 1.00 0.00 H new ATOM 144 N ALA A 13 19.731 -8.825 -4.309 1.00 0.00 N ATOM 145 CA ALA A 13 20.262 -7.661 -3.610 1.00 0.00 C ATOM 146 C ALA A 13 19.309 -7.199 -2.512 1.00 0.00 C ATOM 147 O ALA A 13 19.355 -6.047 -2.080 1.00 0.00 O ATOM 148 CB ALA A 13 20.526 -6.530 -4.593 1.00 0.00 C ATOM 0 H ALA A 13 19.162 -8.603 -5.126 1.00 0.00 H new ATOM 0 HA ALA A 13 21.204 -7.947 -3.141 1.00 0.00 H new ATOM 0 HB1 ALA A 13 20.922 -5.667 -4.057 1.00 0.00 H new ATOM 0 HB2 ALA A 13 21.250 -6.858 -5.339 1.00 0.00 H new ATOM 0 HB3 ALA A 13 19.595 -6.253 -5.088 1.00 0.00 H new ATOM 154 N THR A 14 18.445 -8.105 -2.065 1.00 0.00 N ATOM 155 CA THR A 14 17.480 -7.789 -1.019 1.00 0.00 C ATOM 156 C THR A 14 16.862 -6.413 -1.238 1.00 0.00 C ATOM 157 O THR A 14 16.811 -5.592 -0.323 1.00 0.00 O ATOM 158 CB THR A 14 18.130 -7.831 0.376 1.00 0.00 C ATOM 159 OG1 THR A 14 19.043 -8.931 0.459 1.00 0.00 O ATOM 160 CG2 THR A 14 17.073 -7.961 1.462 1.00 0.00 C ATOM 0 H THR A 14 18.394 -9.063 -2.411 1.00 0.00 H new ATOM 0 HA THR A 14 16.699 -8.547 -1.071 1.00 0.00 H new ATOM 0 HB THR A 14 18.672 -6.897 0.528 1.00 0.00 H new ATOM 0 HG1 THR A 14 19.453 -8.949 1.349 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.556 -7.989 2.439 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.397 -7.107 1.416 1.00 0.00 H new ATOM 0 HG23 THR A 14 16.507 -8.880 1.311 1.00 0.00 H new ATOM 168 N ALA A 15 16.392 -6.167 -2.457 1.00 0.00 N ATOM 169 CA ALA A 15 15.775 -4.891 -2.795 1.00 0.00 C ATOM 170 C ALA A 15 14.638 -4.559 -1.834 1.00 0.00 C ATOM 171 O ALA A 15 13.974 -5.443 -1.292 1.00 0.00 O ATOM 172 CB ALA A 15 15.267 -4.914 -4.229 1.00 0.00 C ATOM 0 H ALA A 15 16.427 -6.835 -3.227 1.00 0.00 H new ATOM 0 HA ALA A 15 16.533 -4.113 -2.702 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.808 -3.954 -4.468 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.100 -5.097 -4.907 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.528 -5.707 -4.340 1.00 0.00 H new ATOM 178 N PRO A 16 14.408 -3.256 -1.616 1.00 0.00 N ATOM 179 CA PRO A 16 13.351 -2.778 -0.719 1.00 0.00 C ATOM 180 C PRO A 16 11.956 -3.031 -1.280 1.00 0.00 C ATOM 181 O PRO A 16 11.086 -3.562 -0.591 1.00 0.00 O ATOM 182 CB PRO A 16 13.623 -1.275 -0.621 1.00 0.00 C ATOM 183 CG PRO A 16 14.342 -0.936 -1.880 1.00 0.00 C ATOM 184 CD PRO A 16 15.161 -2.149 -2.229 1.00 0.00 C ATOM 0 HA PRO A 16 13.368 -3.292 0.242 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.695 -0.710 -0.531 1.00 0.00 H new ATOM 0 HB3 PRO A 16 14.227 -1.038 0.255 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.639 -0.697 -2.678 1.00 0.00 H new ATOM 0 HG3 PRO A 16 14.978 -0.062 -1.743 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.254 -2.275 -3.308 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.172 -2.080 -1.828 1.00 0.00 H new ATOM 192 N VAL A 17 11.750 -2.649 -2.537 1.00 0.00 N ATOM 193 CA VAL A 17 10.461 -2.836 -3.191 1.00 0.00 C ATOM 194 C VAL A 17 9.856 -4.190 -2.836 1.00 0.00 C ATOM 195 O VAL A 17 8.639 -4.326 -2.720 1.00 0.00 O ATOM 196 CB VAL A 17 10.588 -2.728 -4.722 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.034 -4.055 -5.316 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.271 -2.276 -5.335 1.00 0.00 C ATOM 0 H VAL A 17 12.460 -2.208 -3.122 1.00 0.00 H new ATOM 0 HA VAL A 17 9.805 -2.043 -2.831 1.00 0.00 H new ATOM 0 HB VAL A 17 11.346 -1.980 -4.954 1.00 0.00 H new ATOM 0 HG11 VAL A 17 11.118 -3.959 -6.399 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.002 -4.333 -4.900 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.302 -4.826 -5.076 1.00 0.00 H new ATOM 0 HG21 VAL A 17 9.379 -2.205 -6.417 1.00 0.00 H new ATOM 0 HG22 VAL A 17 8.491 -2.998 -5.095 1.00 0.00 H new ATOM 0 HG23 VAL A 17 8.998 -1.300 -4.933 1.00 0.00 H new ATOM 208 N ASN A 18 10.715 -5.189 -2.665 1.00 0.00 N ATOM 209 CA ASN A 18 10.266 -6.534 -2.324 1.00 0.00 C ATOM 210 C ASN A 18 9.659 -6.565 -0.924 1.00 0.00 C ATOM 211 O ASN A 18 8.571 -7.102 -0.721 1.00 0.00 O ATOM 212 CB ASN A 18 11.432 -7.521 -2.409 1.00 0.00 C ATOM 213 CG ASN A 18 11.983 -7.645 -3.816 1.00 0.00 C ATOM 214 OD1 ASN A 18 11.385 -7.154 -4.774 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.128 -8.305 -3.947 1.00 0.00 N ATOM 0 H ASN A 18 11.726 -5.093 -2.757 1.00 0.00 H new ATOM 0 HA ASN A 18 9.499 -6.827 -3.041 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.227 -7.198 -1.737 1.00 0.00 H new ATOM 0 HB3 ASN A 18 11.101 -8.500 -2.064 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.547 -8.422 -4.870 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.589 -8.695 -3.125 1.00 0.00 H new ATOM 222 N GLN A 19 10.372 -5.986 0.037 1.00 0.00 N ATOM 223 CA GLN A 19 9.903 -5.948 1.417 1.00 0.00 C ATOM 224 C GLN A 19 8.499 -5.359 1.499 1.00 0.00 C ATOM 225 O GLN A 19 7.762 -5.616 2.452 1.00 0.00 O ATOM 226 CB GLN A 19 10.864 -5.129 2.282 1.00 0.00 C ATOM 227 CG GLN A 19 12.312 -5.578 2.173 1.00 0.00 C ATOM 228 CD GLN A 19 13.152 -5.127 3.352 1.00 0.00 C ATOM 229 OE1 GLN A 19 12.623 -4.740 4.395 1.00 0.00 O ATOM 230 NE2 GLN A 19 14.470 -5.176 3.194 1.00 0.00 N ATOM 0 H GLN A 19 11.275 -5.537 -0.115 1.00 0.00 H new ATOM 0 HA GLN A 19 9.870 -6.971 1.791 1.00 0.00 H new ATOM 0 HB2 GLN A 19 10.795 -4.080 1.994 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.549 -5.195 3.323 1.00 0.00 H new ATOM 0 HG2 GLN A 19 12.347 -6.665 2.101 1.00 0.00 H new ATOM 0 HG3 GLN A 19 12.743 -5.184 1.253 1.00 0.00 H new ATOM 0 HE21 GLN A 19 14.866 -5.503 2.313 1.00 0.00 H new ATOM 0 HE22 GLN A 19 15.086 -4.886 3.954 1.00 0.00 H new ATOM 239 N ILE A 20 8.134 -4.568 0.496 1.00 0.00 N ATOM 240 CA ILE A 20 6.818 -3.943 0.455 1.00 0.00 C ATOM 241 C ILE A 20 5.785 -4.879 -0.164 1.00 0.00 C ATOM 242 O ILE A 20 4.701 -5.072 0.385 1.00 0.00 O ATOM 243 CB ILE A 20 6.844 -2.626 -0.342 1.00 0.00 C ATOM 244 CG1 ILE A 20 7.909 -1.684 0.223 1.00 0.00 C ATOM 245 CG2 ILE A 20 5.475 -1.963 -0.316 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.224 -0.515 -0.684 1.00 0.00 C ATOM 0 H ILE A 20 8.732 -4.345 -0.300 1.00 0.00 H new ATOM 0 HA ILE A 20 6.539 -3.728 1.486 1.00 0.00 H new ATOM 0 HB ILE A 20 7.097 -2.851 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 20 7.572 -1.305 1.188 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.823 -2.249 0.405 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.510 -1.033 -0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.738 -2.632 -0.761 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.194 -1.748 0.715 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.987 0.110 -0.220 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.592 -0.886 -1.641 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.321 0.074 -0.846 1.00 0.00 H new ATOM 258 N GLN A 21 6.130 -5.457 -1.310 1.00 0.00 N ATOM 259 CA GLN A 21 5.232 -6.374 -2.003 1.00 0.00 C ATOM 260 C GLN A 21 4.637 -7.390 -1.034 1.00 0.00 C ATOM 261 O GLN A 21 3.494 -7.818 -1.194 1.00 0.00 O ATOM 262 CB GLN A 21 5.976 -7.098 -3.126 1.00 0.00 C ATOM 263 CG GLN A 21 6.486 -6.169 -4.216 1.00 0.00 C ATOM 264 CD GLN A 21 6.592 -6.853 -5.565 1.00 0.00 C ATOM 265 OE1 GLN A 21 6.906 -8.041 -5.648 1.00 0.00 O ATOM 266 NE2 GLN A 21 6.330 -6.106 -6.630 1.00 0.00 N ATOM 0 H GLN A 21 7.024 -5.307 -1.778 1.00 0.00 H new ATOM 0 HA GLN A 21 4.418 -5.790 -2.433 1.00 0.00 H new ATOM 0 HB2 GLN A 21 6.819 -7.642 -2.700 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.312 -7.838 -3.572 1.00 0.00 H new ATOM 0 HG2 GLN A 21 5.818 -5.312 -4.299 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.465 -5.784 -3.931 1.00 0.00 H new ATOM 0 HE21 GLN A 21 6.074 -5.126 -6.515 1.00 0.00 H new ATOM 0 HE22 GLN A 21 6.385 -6.512 -7.564 1.00 0.00 H new ATOM 275 N GLU A 22 5.419 -7.771 -0.029 1.00 0.00 N ATOM 276 CA GLU A 22 4.968 -8.738 0.965 1.00 0.00 C ATOM 277 C GLU A 22 3.941 -8.113 1.905 1.00 0.00 C ATOM 278 O GLU A 22 2.943 -8.741 2.260 1.00 0.00 O ATOM 279 CB GLU A 22 6.157 -9.267 1.770 1.00 0.00 C ATOM 280 CG GLU A 22 7.260 -9.859 0.908 1.00 0.00 C ATOM 281 CD GLU A 22 8.125 -10.848 1.666 1.00 0.00 C ATOM 282 OE1 GLU A 22 7.572 -11.622 2.475 1.00 0.00 O ATOM 283 OE2 GLU A 22 9.355 -10.847 1.449 1.00 0.00 O ATOM 0 H GLU A 22 6.367 -7.425 0.118 1.00 0.00 H new ATOM 0 HA GLU A 22 4.496 -9.568 0.439 1.00 0.00 H new ATOM 0 HB2 GLU A 22 6.571 -8.455 2.368 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.804 -10.027 2.467 1.00 0.00 H new ATOM 0 HG2 GLU A 22 6.815 -10.357 0.046 1.00 0.00 H new ATOM 0 HG3 GLU A 22 7.887 -9.054 0.523 1.00 0.00 H new ATOM 290 N THR A 23 4.194 -6.871 2.307 1.00 0.00 N ATOM 291 CA THR A 23 3.294 -6.161 3.206 1.00 0.00 C ATOM 292 C THR A 23 1.918 -5.977 2.576 1.00 0.00 C ATOM 293 O THR A 23 0.895 -6.119 3.246 1.00 0.00 O ATOM 294 CB THR A 23 3.858 -4.780 3.591 1.00 0.00 C ATOM 295 OG1 THR A 23 5.234 -4.901 3.969 1.00 0.00 O ATOM 296 CG2 THR A 23 3.064 -4.171 4.737 1.00 0.00 C ATOM 0 H THR A 23 5.015 -6.337 2.024 1.00 0.00 H new ATOM 0 HA THR A 23 3.200 -6.771 4.105 1.00 0.00 H new ATOM 0 HB THR A 23 3.776 -4.124 2.724 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.586 -4.019 4.211 1.00 0.00 H new ATOM 0 HG21 THR A 23 3.481 -3.196 4.991 1.00 0.00 H new ATOM 0 HG22 THR A 23 2.023 -4.053 4.436 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.118 -4.827 5.606 1.00 0.00 H new ATOM 304 N ILE A 24 1.901 -5.662 1.286 1.00 0.00 N ATOM 305 CA ILE A 24 0.650 -5.462 0.565 1.00 0.00 C ATOM 306 C ILE A 24 -0.009 -6.794 0.225 1.00 0.00 C ATOM 307 O ILE A 24 -1.193 -6.846 -0.106 1.00 0.00 O ATOM 308 CB ILE A 24 0.870 -4.665 -0.734 1.00 0.00 C ATOM 309 CG1 ILE A 24 1.961 -5.321 -1.582 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.235 -3.222 -0.416 1.00 0.00 C ATOM 311 CD1 ILE A 24 2.079 -4.738 -2.973 1.00 0.00 C ATOM 0 H ILE A 24 2.739 -5.540 0.718 1.00 0.00 H new ATOM 0 HA ILE A 24 -0.006 -4.893 1.224 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.059 -4.667 -1.305 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.918 -5.217 -1.071 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.756 -6.389 -1.661 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.387 -2.672 -1.345 1.00 0.00 H new ATOM 0 HG22 ILE A 24 0.428 -2.759 0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.152 -3.200 0.173 1.00 0.00 H new ATOM 0 HD11 ILE A 24 2.872 -5.251 -3.517 1.00 0.00 H new ATOM 0 HD12 ILE A 24 1.135 -4.866 -3.502 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.315 -3.676 -2.904 1.00 0.00 H new ATOM 323 N SER A 25 0.767 -7.870 0.312 1.00 0.00 N ATOM 324 CA SER A 25 0.259 -9.204 0.011 1.00 0.00 C ATOM 325 C SER A 25 -0.552 -9.753 1.181 1.00 0.00 C ATOM 326 O SER A 25 -1.700 -10.165 1.016 1.00 0.00 O ATOM 327 CB SER A 25 1.416 -10.152 -0.311 1.00 0.00 C ATOM 328 OG SER A 25 0.937 -11.431 -0.688 1.00 0.00 O ATOM 0 H SER A 25 1.749 -7.844 0.588 1.00 0.00 H new ATOM 0 HA SER A 25 -0.394 -9.130 -0.859 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.019 -9.734 -1.117 1.00 0.00 H new ATOM 0 HB3 SER A 25 2.067 -10.246 0.559 1.00 0.00 H new ATOM 0 HG SER A 25 1.695 -12.018 -0.890 1.00 0.00 H new ATOM 334 N ASP A 26 0.054 -9.755 2.364 1.00 0.00 N ATOM 335 CA ASP A 26 -0.611 -10.252 3.563 1.00 0.00 C ATOM 336 C ASP A 26 -1.800 -9.370 3.929 1.00 0.00 C ATOM 337 O ASP A 26 -2.845 -9.864 4.350 1.00 0.00 O ATOM 338 CB ASP A 26 0.375 -10.311 4.731 1.00 0.00 C ATOM 339 CG ASP A 26 -0.115 -11.198 5.858 1.00 0.00 C ATOM 340 OD1 ASP A 26 -0.813 -10.684 6.756 1.00 0.00 O ATOM 341 OD2 ASP A 26 0.199 -12.407 5.842 1.00 0.00 O ATOM 0 H ASP A 26 1.004 -9.418 2.518 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.977 -11.257 3.356 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.336 -10.681 4.373 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.543 -9.304 5.112 1.00 0.00 H new ATOM 346 N ASN A 27 -1.632 -8.061 3.768 1.00 0.00 N ATOM 347 CA ASN A 27 -2.692 -7.110 4.084 1.00 0.00 C ATOM 348 C ASN A 27 -3.588 -6.872 2.872 1.00 0.00 C ATOM 349 O ASN A 27 -3.395 -7.475 1.816 1.00 0.00 O ATOM 350 CB ASN A 27 -2.091 -5.785 4.557 1.00 0.00 C ATOM 351 CG ASN A 27 -1.280 -5.939 5.829 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.571 -6.796 6.664 1.00 0.00 O ATOM 353 ND2 ASN A 27 -0.257 -5.107 5.983 1.00 0.00 N ATOM 0 H ASN A 27 -0.773 -7.635 3.421 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.299 -7.532 4.885 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.455 -5.377 3.771 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.892 -5.065 4.725 1.00 0.00 H new ATOM 0 HD21 ASN A 27 0.324 -5.163 6.819 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.052 -4.412 5.265 1.00 0.00 H new ATOM 360 N CYS A 28 -4.566 -5.987 3.032 1.00 0.00 N ATOM 361 CA CYS A 28 -5.492 -5.668 1.952 1.00 0.00 C ATOM 362 C CYS A 28 -5.343 -4.211 1.521 1.00 0.00 C ATOM 363 O CYS A 28 -5.455 -3.888 0.338 1.00 0.00 O ATOM 364 CB CYS A 28 -6.933 -5.936 2.391 1.00 0.00 C ATOM 365 SG CYS A 28 -7.100 -7.276 3.614 1.00 0.00 S ATOM 0 H CYS A 28 -4.738 -5.478 3.899 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.254 -6.307 1.102 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.350 -5.021 2.811 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -7.529 -6.184 1.513 1.00 0.00 H new ATOM 370 N VAL A 29 -5.090 -3.336 2.489 1.00 0.00 N ATOM 371 CA VAL A 29 -4.924 -1.915 2.210 1.00 0.00 C ATOM 372 C VAL A 29 -3.677 -1.363 2.892 1.00 0.00 C ATOM 373 O VAL A 29 -3.535 -1.448 4.112 1.00 0.00 O ATOM 374 CB VAL A 29 -6.150 -1.105 2.673 1.00 0.00 C ATOM 375 CG1 VAL A 29 -5.946 0.377 2.398 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.411 -1.613 1.991 1.00 0.00 C ATOM 0 H VAL A 29 -4.996 -3.586 3.473 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.818 -1.815 1.130 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.267 -1.238 3.749 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.822 0.933 2.732 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.066 0.729 2.936 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.803 0.532 1.329 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.268 -1.030 2.329 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.307 -1.511 0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.564 -2.662 2.244 1.00 0.00 H new ATOM 386 N VAL A 30 -2.775 -0.797 2.097 1.00 0.00 N ATOM 387 CA VAL A 30 -1.540 -0.229 2.624 1.00 0.00 C ATOM 388 C VAL A 30 -1.395 1.236 2.225 1.00 0.00 C ATOM 389 O VAL A 30 -1.174 1.552 1.056 1.00 0.00 O ATOM 390 CB VAL A 30 -0.308 -1.009 2.129 1.00 0.00 C ATOM 391 CG1 VAL A 30 0.972 -0.366 2.640 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.391 -2.465 2.560 1.00 0.00 C ATOM 0 H VAL A 30 -2.876 -0.720 1.085 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.595 -0.303 3.710 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.293 -0.976 1.040 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.832 -0.931 2.280 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.034 0.660 2.277 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.969 -0.365 3.730 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.488 -3.001 2.202 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.431 -2.521 3.648 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.289 -2.918 2.140 1.00 0.00 H new ATOM 402 N ILE A 31 -1.520 2.125 3.205 1.00 0.00 N ATOM 403 CA ILE A 31 -1.401 3.556 2.956 1.00 0.00 C ATOM 404 C ILE A 31 -0.014 4.066 3.335 1.00 0.00 C ATOM 405 O ILE A 31 0.319 4.173 4.515 1.00 0.00 O ATOM 406 CB ILE A 31 -2.460 4.354 3.739 1.00 0.00 C ATOM 407 CG1 ILE A 31 -3.853 3.771 3.494 1.00 0.00 C ATOM 408 CG2 ILE A 31 -2.417 5.822 3.343 1.00 0.00 C ATOM 409 CD1 ILE A 31 -4.913 4.327 4.419 1.00 0.00 C ATOM 0 H ILE A 31 -1.703 1.879 4.178 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.562 3.705 1.888 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.237 4.279 4.803 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -4.144 3.968 2.462 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.811 2.688 3.613 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.171 6.373 3.905 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.431 6.230 3.564 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.618 5.917 2.276 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.875 3.869 4.188 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.646 4.107 5.453 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.984 5.406 4.284 1.00 0.00 H new ATOM 421 N PHE A 32 0.790 4.381 2.325 1.00 0.00 N ATOM 422 CA PHE A 32 2.141 4.882 2.552 1.00 0.00 C ATOM 423 C PHE A 32 2.179 6.405 2.464 1.00 0.00 C ATOM 424 O PHE A 32 2.042 6.979 1.384 1.00 0.00 O ATOM 425 CB PHE A 32 3.109 4.277 1.533 1.00 0.00 C ATOM 426 CG PHE A 32 3.542 2.879 1.873 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.389 2.643 2.944 1.00 0.00 C ATOM 428 CD2 PHE A 32 3.102 1.801 1.122 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.788 1.358 3.260 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.497 0.515 1.433 1.00 0.00 C ATOM 431 CZ PHE A 32 4.343 0.293 2.503 1.00 0.00 C ATOM 0 H PHE A 32 0.530 4.298 1.342 1.00 0.00 H new ATOM 0 HA PHE A 32 2.448 4.586 3.555 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.635 4.273 0.551 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.991 4.914 1.459 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.741 3.473 3.539 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.442 1.969 0.283 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.447 1.187 4.098 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.145 -0.317 0.841 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.655 -0.712 2.746 1.00 0.00 H new ATOM 441 N SER A 33 2.365 7.053 3.610 1.00 0.00 N ATOM 442 CA SER A 33 2.416 8.509 3.664 1.00 0.00 C ATOM 443 C SER A 33 3.771 8.986 4.180 1.00 0.00 C ATOM 444 O SER A 33 4.565 8.198 4.693 1.00 0.00 O ATOM 445 CB SER A 33 1.299 9.047 4.560 1.00 0.00 C ATOM 446 OG SER A 33 1.322 8.425 5.833 1.00 0.00 O ATOM 0 H SER A 33 2.483 6.593 4.513 1.00 0.00 H new ATOM 0 HA SER A 33 2.276 8.891 2.653 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.410 10.125 4.677 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.333 8.875 4.085 1.00 0.00 H new ATOM 0 HG SER A 33 0.600 8.787 6.387 1.00 0.00 H new ATOM 452 N LYS A 34 4.027 10.282 4.039 1.00 0.00 N ATOM 453 CA LYS A 34 5.284 10.867 4.490 1.00 0.00 C ATOM 454 C LYS A 34 5.038 12.170 5.244 1.00 0.00 C ATOM 455 O LYS A 34 5.810 13.122 5.129 1.00 0.00 O ATOM 456 CB LYS A 34 6.209 11.122 3.298 1.00 0.00 C ATOM 457 CG LYS A 34 5.823 12.342 2.479 1.00 0.00 C ATOM 458 CD LYS A 34 6.268 12.206 1.033 1.00 0.00 C ATOM 459 CE LYS A 34 6.432 13.565 0.370 1.00 0.00 C ATOM 460 NZ LYS A 34 7.346 13.503 -0.804 1.00 0.00 N ATOM 0 H LYS A 34 3.380 10.948 3.616 1.00 0.00 H new ATOM 0 HA LYS A 34 5.762 10.160 5.168 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.229 11.246 3.661 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.205 10.245 2.651 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.742 12.480 2.517 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.273 13.233 2.917 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.212 11.663 0.991 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.537 11.616 0.480 1.00 0.00 H new ATOM 0 HE2 LYS A 34 5.457 13.934 0.052 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.821 14.279 1.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 7.431 14.449 -1.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.284 13.175 -0.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.962 12.841 -1.508 1.00 0.00 H new ATOM 474 N THR A 35 3.958 12.205 6.018 1.00 0.00 N ATOM 475 CA THR A 35 3.610 13.391 6.792 1.00 0.00 C ATOM 476 C THR A 35 4.073 14.661 6.088 1.00 0.00 C ATOM 477 O THR A 35 4.639 15.558 6.713 1.00 0.00 O ATOM 478 CB THR A 35 4.230 13.344 8.201 1.00 0.00 C ATOM 479 OG1 THR A 35 5.657 13.425 8.112 1.00 0.00 O ATOM 480 CG2 THR A 35 3.834 12.065 8.924 1.00 0.00 C ATOM 0 H THR A 35 3.309 11.426 6.126 1.00 0.00 H new ATOM 0 HA THR A 35 2.524 13.403 6.881 1.00 0.00 H new ATOM 0 HB THR A 35 3.853 14.195 8.768 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.912 14.287 7.722 1.00 0.00 H new ATOM 0 HG21 THR A 35 4.284 12.054 9.917 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.749 12.020 9.017 1.00 0.00 H new ATOM 0 HG23 THR A 35 4.185 11.203 8.357 1.00 0.00 H new ATOM 488 N SER A 36 3.827 14.733 4.783 1.00 0.00 N ATOM 489 CA SER A 36 4.221 15.894 3.994 1.00 0.00 C ATOM 490 C SER A 36 3.041 16.429 3.189 1.00 0.00 C ATOM 491 O SER A 36 2.857 17.641 3.068 1.00 0.00 O ATOM 492 CB SER A 36 5.371 15.530 3.053 1.00 0.00 C ATOM 493 OG SER A 36 5.773 16.649 2.282 1.00 0.00 O ATOM 0 H SER A 36 3.357 14.001 4.251 1.00 0.00 H new ATOM 0 HA SER A 36 4.554 16.673 4.680 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.217 15.161 3.633 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.061 14.721 2.391 1.00 0.00 H new ATOM 0 HG SER A 36 6.510 16.391 1.690 1.00 0.00 H new ATOM 499 N CYS A 37 2.245 15.518 2.640 1.00 0.00 N ATOM 500 CA CYS A 37 1.082 15.898 1.845 1.00 0.00 C ATOM 501 C CYS A 37 -0.188 15.859 2.688 1.00 0.00 C ATOM 502 O CYS A 37 -0.472 14.865 3.356 1.00 0.00 O ATOM 503 CB CYS A 37 0.937 14.968 0.640 1.00 0.00 C ATOM 504 SG CYS A 37 0.175 15.745 -0.804 1.00 0.00 S ATOM 0 H CYS A 37 2.383 14.511 2.731 1.00 0.00 H new ATOM 0 HA CYS A 37 1.231 16.918 1.492 1.00 0.00 H new ATOM 0 HB2 CYS A 37 1.923 14.596 0.361 1.00 0.00 H new ATOM 0 HB3 CYS A 37 0.340 14.104 0.931 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.097 14.836 -1.693 1.00 0.00 H new ATOM 510 N SER A 38 -0.949 16.949 2.653 1.00 0.00 N ATOM 511 CA SER A 38 -2.186 17.043 3.418 1.00 0.00 C ATOM 512 C SER A 38 -3.079 15.834 3.156 1.00 0.00 C ATOM 513 O SER A 38 -3.697 15.294 4.074 1.00 0.00 O ATOM 514 CB SER A 38 -2.934 18.329 3.063 1.00 0.00 C ATOM 515 OG SER A 38 -2.158 19.473 3.377 1.00 0.00 O ATOM 0 H SER A 38 -0.730 17.779 2.103 1.00 0.00 H new ATOM 0 HA SER A 38 -1.929 17.061 4.477 1.00 0.00 H new ATOM 0 HB2 SER A 38 -3.177 18.331 2.000 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.878 18.366 3.606 1.00 0.00 H new ATOM 0 HG SER A 38 -2.657 20.282 3.139 1.00 0.00 H new ATOM 521 N TYR A 39 -3.142 15.414 1.897 1.00 0.00 N ATOM 522 CA TYR A 39 -3.961 14.271 1.512 1.00 0.00 C ATOM 523 C TYR A 39 -3.748 13.102 2.469 1.00 0.00 C ATOM 524 O TYR A 39 -4.595 12.215 2.581 1.00 0.00 O ATOM 525 CB TYR A 39 -3.633 13.840 0.082 1.00 0.00 C ATOM 526 CG TYR A 39 -4.007 14.869 -0.962 1.00 0.00 C ATOM 527 CD1 TYR A 39 -5.296 15.384 -1.026 1.00 0.00 C ATOM 528 CD2 TYR A 39 -3.072 15.326 -1.882 1.00 0.00 C ATOM 529 CE1 TYR A 39 -5.643 16.323 -1.978 1.00 0.00 C ATOM 530 CE2 TYR A 39 -3.409 16.266 -2.836 1.00 0.00 C ATOM 531 CZ TYR A 39 -4.696 16.761 -2.881 1.00 0.00 C ATOM 532 OH TYR A 39 -5.037 17.698 -3.829 1.00 0.00 O ATOM 0 H TYR A 39 -2.635 15.848 1.126 1.00 0.00 H new ATOM 0 HA TYR A 39 -5.007 14.573 1.562 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.565 13.633 0.010 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -4.154 12.908 -0.136 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -6.039 15.044 -0.320 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.064 14.940 -1.851 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -6.650 16.712 -2.015 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -2.669 16.612 -3.543 1.00 0.00 H new ATOM 0 HH TYR A 39 -4.256 17.899 -4.386 1.00 0.00 H new ATOM 542 N CYS A 40 -2.611 13.108 3.156 1.00 0.00 N ATOM 543 CA CYS A 40 -2.285 12.048 4.104 1.00 0.00 C ATOM 544 C CYS A 40 -3.472 11.747 5.012 1.00 0.00 C ATOM 545 O CYS A 40 -3.830 10.587 5.222 1.00 0.00 O ATOM 546 CB CYS A 40 -1.071 12.444 4.945 1.00 0.00 C ATOM 547 SG CYS A 40 -1.352 13.869 6.022 1.00 0.00 S ATOM 0 H CYS A 40 -1.900 13.835 3.075 1.00 0.00 H new ATOM 0 HA CYS A 40 -2.047 11.148 3.537 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.773 11.593 5.557 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.237 12.665 4.279 1.00 0.00 H new ATOM 0 HG CYS A 40 -1.100 14.964 5.368 1.00 0.00 H new ATOM 553 N THR A 41 -4.081 12.799 5.551 1.00 0.00 N ATOM 554 CA THR A 41 -5.226 12.648 6.440 1.00 0.00 C ATOM 555 C THR A 41 -6.465 12.208 5.669 1.00 0.00 C ATOM 556 O THR A 41 -7.278 11.433 6.172 1.00 0.00 O ATOM 557 CB THR A 41 -5.537 13.960 7.184 1.00 0.00 C ATOM 558 OG1 THR A 41 -6.206 13.677 8.418 1.00 0.00 O ATOM 559 CG2 THR A 41 -6.402 14.875 6.331 1.00 0.00 C ATOM 0 H THR A 41 -3.800 13.766 5.387 1.00 0.00 H new ATOM 0 HA THR A 41 -4.962 11.881 7.168 1.00 0.00 H new ATOM 0 HB THR A 41 -4.594 14.466 7.390 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.399 14.516 8.886 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.608 15.795 6.878 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.877 15.113 5.406 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.341 14.374 6.097 1.00 0.00 H new ATOM 567 N MET A 42 -6.604 12.708 4.445 1.00 0.00 N ATOM 568 CA MET A 42 -7.744 12.364 3.604 1.00 0.00 C ATOM 569 C MET A 42 -7.894 10.851 3.482 1.00 0.00 C ATOM 570 O MET A 42 -9.002 10.321 3.542 1.00 0.00 O ATOM 571 CB MET A 42 -7.587 12.987 2.216 1.00 0.00 C ATOM 572 CG MET A 42 -8.193 14.376 2.101 1.00 0.00 C ATOM 573 SD MET A 42 -9.921 14.341 1.588 1.00 0.00 S ATOM 574 CE MET A 42 -9.815 13.334 0.110 1.00 0.00 C ATOM 0 H MET A 42 -5.941 13.353 4.014 1.00 0.00 H new ATOM 0 HA MET A 42 -8.643 12.763 4.074 1.00 0.00 H new ATOM 0 HB2 MET A 42 -6.527 13.041 1.969 1.00 0.00 H new ATOM 0 HB3 MET A 42 -8.054 12.334 1.479 1.00 0.00 H new ATOM 0 HG2 MET A 42 -8.114 14.883 3.063 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.617 14.961 1.384 1.00 0.00 H new ATOM 0 HE1 MET A 42 -10.550 13.677 -0.618 1.00 0.00 H new ATOM 0 HE2 MET A 42 -8.816 13.418 -0.317 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.015 12.293 0.364 1.00 0.00 H new ATOM 584 N ALA A 43 -6.770 10.162 3.311 1.00 0.00 N ATOM 585 CA ALA A 43 -6.777 8.710 3.182 1.00 0.00 C ATOM 586 C ALA A 43 -7.048 8.041 4.525 1.00 0.00 C ATOM 587 O ALA A 43 -8.018 7.298 4.676 1.00 0.00 O ATOM 588 CB ALA A 43 -5.454 8.226 2.606 1.00 0.00 C ATOM 0 H ALA A 43 -5.844 10.586 3.259 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.581 8.434 2.500 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.472 7.140 2.515 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.301 8.670 1.622 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.640 8.521 3.268 1.00 0.00 H new ATOM 594 N LYS A 44 -6.185 8.309 5.499 1.00 0.00 N ATOM 595 CA LYS A 44 -6.331 7.733 6.831 1.00 0.00 C ATOM 596 C LYS A 44 -7.758 7.901 7.342 1.00 0.00 C ATOM 597 O LYS A 44 -8.343 6.971 7.898 1.00 0.00 O ATOM 598 CB LYS A 44 -5.349 8.390 7.803 1.00 0.00 C ATOM 599 CG LYS A 44 -3.904 8.337 7.337 1.00 0.00 C ATOM 600 CD LYS A 44 -3.129 9.565 7.784 1.00 0.00 C ATOM 601 CE LYS A 44 -3.050 9.654 9.300 1.00 0.00 C ATOM 602 NZ LYS A 44 -4.309 10.185 9.891 1.00 0.00 N ATOM 0 H LYS A 44 -5.377 8.922 5.391 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.110 6.668 6.766 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.637 9.431 7.949 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.427 7.899 8.773 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.426 7.440 7.732 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.874 8.262 6.250 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -2.122 9.532 7.368 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.608 10.462 7.390 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.844 8.666 9.711 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.217 10.297 9.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -4.085 10.754 10.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.797 10.779 9.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -4.926 9.393 10.163 1.00 0.00 H new ATOM 616 N LYS A 45 -8.314 9.093 7.151 1.00 0.00 N ATOM 617 CA LYS A 45 -9.674 9.383 7.590 1.00 0.00 C ATOM 618 C LYS A 45 -10.693 8.644 6.728 1.00 0.00 C ATOM 619 O LYS A 45 -11.630 8.032 7.244 1.00 0.00 O ATOM 620 CB LYS A 45 -9.940 10.889 7.534 1.00 0.00 C ATOM 621 CG LYS A 45 -11.382 11.263 7.829 1.00 0.00 C ATOM 622 CD LYS A 45 -11.603 12.762 7.718 1.00 0.00 C ATOM 623 CE LYS A 45 -12.999 13.156 8.176 1.00 0.00 C ATOM 624 NZ LYS A 45 -13.985 13.098 7.062 1.00 0.00 N ATOM 0 H LYS A 45 -7.843 9.874 6.695 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.778 9.040 8.619 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.289 11.391 8.250 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -9.672 11.260 6.545 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -12.043 10.744 7.134 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.648 10.928 8.832 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -10.860 13.286 8.320 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -11.456 13.077 6.685 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -13.319 12.492 8.979 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.975 14.165 8.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -14.924 13.373 7.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -13.694 13.751 6.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -14.027 12.129 6.686 1.00 0.00 H new ATOM 638 N LEU A 46 -10.504 8.702 5.415 1.00 0.00 N ATOM 639 CA LEU A 46 -11.406 8.037 4.481 1.00 0.00 C ATOM 640 C LEU A 46 -11.769 6.640 4.977 1.00 0.00 C ATOM 641 O LEU A 46 -12.941 6.336 5.204 1.00 0.00 O ATOM 642 CB LEU A 46 -10.764 7.948 3.096 1.00 0.00 C ATOM 643 CG LEU A 46 -11.469 7.042 2.086 1.00 0.00 C ATOM 644 CD1 LEU A 46 -12.841 7.599 1.737 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.622 6.881 0.832 1.00 0.00 C ATOM 0 H LEU A 46 -9.734 9.203 4.972 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.319 8.628 4.413 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.711 8.953 2.677 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.739 7.597 3.215 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.602 6.059 2.539 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.328 6.941 1.017 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.448 7.662 2.640 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.731 8.593 1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -11.139 6.233 0.124 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.457 7.857 0.376 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.662 6.437 1.096 1.00 0.00 H new ATOM 657 N PHE A 47 -10.757 5.796 5.144 1.00 0.00 N ATOM 658 CA PHE A 47 -10.970 4.432 5.614 1.00 0.00 C ATOM 659 C PHE A 47 -11.536 4.427 7.031 1.00 0.00 C ATOM 660 O PHE A 47 -12.468 3.682 7.337 1.00 0.00 O ATOM 661 CB PHE A 47 -9.657 3.646 5.575 1.00 0.00 C ATOM 662 CG PHE A 47 -9.208 3.300 4.184 1.00 0.00 C ATOM 663 CD1 PHE A 47 -9.633 2.130 3.575 1.00 0.00 C ATOM 664 CD2 PHE A 47 -8.359 4.144 3.485 1.00 0.00 C ATOM 665 CE1 PHE A 47 -9.222 1.809 2.295 1.00 0.00 C ATOM 666 CE2 PHE A 47 -7.945 3.828 2.205 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.376 2.658 1.610 1.00 0.00 C ATOM 0 H PHE A 47 -9.782 6.032 4.961 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.692 3.955 4.951 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.878 4.230 6.065 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.775 2.727 6.149 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.293 1.461 4.107 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -8.017 5.059 3.946 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.562 0.895 1.831 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -7.285 4.495 1.670 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.052 2.408 0.611 1.00 0.00 H new ATOM 677 N HIS A 48 -10.965 5.263 7.893 1.00 0.00 N ATOM 678 CA HIS A 48 -11.412 5.355 9.278 1.00 0.00 C ATOM 679 C HIS A 48 -12.932 5.461 9.353 1.00 0.00 C ATOM 680 O HIS A 48 -13.582 4.707 10.077 1.00 0.00 O ATOM 681 CB HIS A 48 -10.771 6.562 9.964 1.00 0.00 C ATOM 682 CG HIS A 48 -11.576 7.099 11.108 1.00 0.00 C ATOM 683 ND1 HIS A 48 -11.961 8.419 11.203 1.00 0.00 N ATOM 684 CD2 HIS A 48 -12.069 6.484 12.208 1.00 0.00 C ATOM 685 CE1 HIS A 48 -12.655 8.594 12.313 1.00 0.00 C ATOM 686 NE2 HIS A 48 -12.736 7.435 12.941 1.00 0.00 N ATOM 0 H HIS A 48 -10.193 5.886 7.657 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.103 4.446 9.794 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -9.782 6.281 10.327 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -10.627 7.354 9.229 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -11.959 5.440 12.462 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -13.083 9.526 12.650 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -13.216 7.273 13.826 1.00 0.00 H new ATOM 694 N ASP A 49 -13.492 6.402 8.600 1.00 0.00 N ATOM 695 CA ASP A 49 -14.936 6.606 8.581 1.00 0.00 C ATOM 696 C ASP A 49 -15.651 5.378 8.027 1.00 0.00 C ATOM 697 O ASP A 49 -16.736 5.020 8.485 1.00 0.00 O ATOM 698 CB ASP A 49 -15.287 7.837 7.744 1.00 0.00 C ATOM 699 CG ASP A 49 -16.784 8.023 7.586 1.00 0.00 C ATOM 700 OD1 ASP A 49 -17.459 7.061 7.165 1.00 0.00 O ATOM 701 OD2 ASP A 49 -17.279 9.130 7.884 1.00 0.00 O ATOM 0 H ASP A 49 -12.968 7.035 7.995 1.00 0.00 H new ATOM 0 HA ASP A 49 -15.269 6.766 9.606 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -14.861 8.724 8.212 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -14.829 7.745 6.759 1.00 0.00 H new ATOM 706 N MET A 50 -15.037 4.738 7.037 1.00 0.00 N ATOM 707 CA MET A 50 -15.615 3.549 6.421 1.00 0.00 C ATOM 708 C MET A 50 -15.455 2.334 7.328 1.00 0.00 C ATOM 709 O MET A 50 -15.988 1.262 7.044 1.00 0.00 O ATOM 710 CB MET A 50 -14.957 3.280 5.066 1.00 0.00 C ATOM 711 CG MET A 50 -15.062 4.447 4.097 1.00 0.00 C ATOM 712 SD MET A 50 -13.673 4.524 2.950 1.00 0.00 S ATOM 713 CE MET A 50 -13.715 2.874 2.255 1.00 0.00 C ATOM 0 H MET A 50 -14.140 5.023 6.644 1.00 0.00 H new ATOM 0 HA MET A 50 -16.679 3.729 6.270 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.905 3.042 5.223 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.418 2.401 4.615 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.990 4.363 3.532 1.00 0.00 H new ATOM 0 HG3 MET A 50 -15.115 5.379 4.660 1.00 0.00 H new ATOM 0 HE1 MET A 50 -13.525 2.926 1.183 1.00 0.00 H new ATOM 0 HE2 MET A 50 -12.950 2.260 2.730 1.00 0.00 H new ATOM 0 HE3 MET A 50 -14.695 2.431 2.429 1.00 0.00 H new ATOM 723 N ASN A 51 -14.716 2.508 8.419 1.00 0.00 N ATOM 724 CA ASN A 51 -14.485 1.424 9.366 1.00 0.00 C ATOM 725 C ASN A 51 -13.815 0.236 8.682 1.00 0.00 C ATOM 726 O ASN A 51 -14.089 -0.918 9.009 1.00 0.00 O ATOM 727 CB ASN A 51 -15.806 0.983 10.001 1.00 0.00 C ATOM 728 CG ASN A 51 -16.127 1.757 11.264 1.00 0.00 C ATOM 729 OD1 ASN A 51 -16.833 2.765 11.225 1.00 0.00 O ATOM 730 ND2 ASN A 51 -15.609 1.288 12.393 1.00 0.00 N ATOM 0 H ASN A 51 -14.267 3.389 8.669 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.820 1.793 10.146 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.614 1.116 9.282 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.757 -0.081 10.233 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -15.791 1.767 13.275 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -15.029 0.449 12.378 1.00 0.00 H new ATOM 737 N VAL A 52 -12.934 0.528 7.730 1.00 0.00 N ATOM 738 CA VAL A 52 -12.223 -0.514 7.000 1.00 0.00 C ATOM 739 C VAL A 52 -10.778 -0.627 7.471 1.00 0.00 C ATOM 740 O VAL A 52 -9.927 0.178 7.094 1.00 0.00 O ATOM 741 CB VAL A 52 -12.238 -0.248 5.483 1.00 0.00 C ATOM 742 CG1 VAL A 52 -11.412 -1.292 4.749 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.667 -0.222 4.961 1.00 0.00 C ATOM 0 H VAL A 52 -12.696 1.478 7.447 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.742 -1.451 7.202 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.790 0.729 5.299 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.435 -1.087 3.679 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.382 -1.256 5.104 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -11.826 -2.282 4.938 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.659 -0.033 3.888 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.143 -1.183 5.157 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -14.224 0.568 5.464 1.00 0.00 H new ATOM 753 N ASN A 53 -10.507 -1.632 8.297 1.00 0.00 N ATOM 754 CA ASN A 53 -9.163 -1.850 8.821 1.00 0.00 C ATOM 755 C ASN A 53 -8.108 -1.487 7.780 1.00 0.00 C ATOM 756 O ASN A 53 -7.977 -2.155 6.755 1.00 0.00 O ATOM 757 CB ASN A 53 -8.991 -3.309 9.250 1.00 0.00 C ATOM 758 CG ASN A 53 -7.689 -3.544 9.990 1.00 0.00 C ATOM 759 OD1 ASN A 53 -6.614 -3.556 9.390 1.00 0.00 O ATOM 760 ND2 ASN A 53 -7.780 -3.732 11.302 1.00 0.00 N ATOM 0 H ASN A 53 -11.200 -2.308 8.618 1.00 0.00 H new ATOM 0 HA ASN A 53 -9.029 -1.204 9.689 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.826 -3.598 9.888 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.026 -3.950 8.369 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -6.938 -3.895 11.854 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -8.692 -3.714 11.758 1.00 0.00 H new ATOM 767 N TYR A 54 -7.360 -0.423 8.051 1.00 0.00 N ATOM 768 CA TYR A 54 -6.318 0.031 7.138 1.00 0.00 C ATOM 769 C TYR A 54 -4.941 -0.070 7.789 1.00 0.00 C ATOM 770 O TYR A 54 -4.825 -0.322 8.988 1.00 0.00 O ATOM 771 CB TYR A 54 -6.584 1.473 6.703 1.00 0.00 C ATOM 772 CG TYR A 54 -6.433 2.480 7.821 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.424 2.634 8.782 1.00 0.00 C ATOM 774 CD2 TYR A 54 -5.299 3.278 7.915 1.00 0.00 C ATOM 775 CE1 TYR A 54 -7.291 3.553 9.805 1.00 0.00 C ATOM 776 CE2 TYR A 54 -5.157 4.199 8.935 1.00 0.00 C ATOM 777 CZ TYR A 54 -6.155 4.333 9.877 1.00 0.00 C ATOM 778 OH TYR A 54 -6.017 5.250 10.893 1.00 0.00 O ATOM 0 H TYR A 54 -7.456 0.141 8.895 1.00 0.00 H new ATOM 0 HA TYR A 54 -6.333 -0.615 6.260 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.899 1.733 5.896 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.594 1.541 6.298 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -8.314 2.025 8.729 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.516 3.176 7.178 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -8.071 3.660 10.544 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.269 4.811 8.994 1.00 0.00 H new ATOM 0 HH TYR A 54 -5.160 5.716 10.799 1.00 0.00 H new ATOM 788 N LYS A 55 -3.900 0.129 6.988 1.00 0.00 N ATOM 789 CA LYS A 55 -2.530 0.063 7.483 1.00 0.00 C ATOM 790 C LYS A 55 -1.697 1.218 6.935 1.00 0.00 C ATOM 791 O LYS A 55 -1.320 1.223 5.763 1.00 0.00 O ATOM 792 CB LYS A 55 -1.889 -1.271 7.095 1.00 0.00 C ATOM 793 CG LYS A 55 -0.372 -1.264 7.177 1.00 0.00 C ATOM 794 CD LYS A 55 0.108 -1.198 8.617 1.00 0.00 C ATOM 795 CE LYS A 55 1.479 -1.838 8.777 1.00 0.00 C ATOM 796 NZ LYS A 55 1.384 -3.313 8.958 1.00 0.00 N ATOM 0 H LYS A 55 -3.979 0.337 5.993 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.559 0.143 8.570 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.276 -2.054 7.747 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.188 -1.526 6.078 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.023 -2.162 6.702 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.019 -0.411 6.623 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.151 -0.158 8.940 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.609 -1.704 9.264 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.087 -1.618 7.900 1.00 0.00 H new ATOM 0 HE3 LYS A 55 1.987 -1.399 9.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.339 -3.712 9.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.825 -3.523 9.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.922 -3.736 8.128 1.00 0.00 H new ATOM 810 N VAL A 56 -1.413 2.195 7.790 1.00 0.00 N ATOM 811 CA VAL A 56 -0.623 3.354 7.392 1.00 0.00 C ATOM 812 C VAL A 56 0.845 3.170 7.761 1.00 0.00 C ATOM 813 O VAL A 56 1.173 2.822 8.896 1.00 0.00 O ATOM 814 CB VAL A 56 -1.148 4.644 8.049 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.467 4.878 9.388 1.00 0.00 C ATOM 816 CG2 VAL A 56 -0.944 5.833 7.123 1.00 0.00 C ATOM 0 H VAL A 56 -1.718 2.207 8.763 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.715 3.444 6.310 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.217 4.530 8.228 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.851 5.794 9.836 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.669 4.037 10.051 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.609 4.971 9.238 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.320 6.737 7.603 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.119 5.951 6.911 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.484 5.665 6.191 1.00 0.00 H new ATOM 826 N VAL A 57 1.727 3.409 6.795 1.00 0.00 N ATOM 827 CA VAL A 57 3.161 3.272 7.018 1.00 0.00 C ATOM 828 C VAL A 57 3.902 4.547 6.632 1.00 0.00 C ATOM 829 O VAL A 57 4.168 4.789 5.455 1.00 0.00 O ATOM 830 CB VAL A 57 3.743 2.091 6.219 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.223 1.918 6.524 1.00 0.00 C ATOM 832 CG2 VAL A 57 2.975 0.814 6.520 1.00 0.00 C ATOM 0 H VAL A 57 1.473 3.698 5.850 1.00 0.00 H new ATOM 0 HA VAL A 57 3.299 3.084 8.083 1.00 0.00 H new ATOM 0 HB VAL A 57 3.639 2.308 5.156 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.617 1.079 5.951 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.759 2.827 6.252 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.355 1.724 7.588 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.400 -0.010 5.947 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.045 0.590 7.584 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.928 0.945 6.245 1.00 0.00 H new ATOM 842 N GLU A 58 4.232 5.359 7.631 1.00 0.00 N ATOM 843 CA GLU A 58 4.942 6.611 7.395 1.00 0.00 C ATOM 844 C GLU A 58 6.373 6.346 6.937 1.00 0.00 C ATOM 845 O GLU A 58 7.117 5.606 7.582 1.00 0.00 O ATOM 846 CB GLU A 58 4.951 7.465 8.665 1.00 0.00 C ATOM 847 CG GLU A 58 3.664 8.243 8.884 1.00 0.00 C ATOM 848 CD GLU A 58 3.489 8.687 10.323 1.00 0.00 C ATOM 849 OE1 GLU A 58 4.309 8.283 11.173 1.00 0.00 O ATOM 850 OE2 GLU A 58 2.530 9.439 10.599 1.00 0.00 O ATOM 0 H GLU A 58 4.019 5.173 8.611 1.00 0.00 H new ATOM 0 HA GLU A 58 4.420 7.152 6.606 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.126 6.820 9.526 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.785 8.165 8.616 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.658 9.118 8.234 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.815 7.624 8.593 1.00 0.00 H new ATOM 857 N LEU A 59 6.752 6.955 5.819 1.00 0.00 N ATOM 858 CA LEU A 59 8.094 6.786 5.272 1.00 0.00 C ATOM 859 C LEU A 59 9.014 7.914 5.728 1.00 0.00 C ATOM 860 O LEU A 59 10.142 7.673 6.159 1.00 0.00 O ATOM 861 CB LEU A 59 8.042 6.741 3.744 1.00 0.00 C ATOM 862 CG LEU A 59 7.155 5.655 3.135 1.00 0.00 C ATOM 863 CD1 LEU A 59 6.965 5.895 1.645 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.754 4.278 3.382 1.00 0.00 C ATOM 0 H LEU A 59 6.149 7.570 5.273 1.00 0.00 H new ATOM 0 HA LEU A 59 8.494 5.843 5.643 1.00 0.00 H new ATOM 0 HB2 LEU A 59 7.696 7.710 3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 59 9.057 6.606 3.370 1.00 0.00 H new ATOM 0 HG LEU A 59 6.178 5.697 3.617 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.331 5.112 1.228 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.493 6.865 1.490 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.935 5.880 1.147 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.110 3.517 2.942 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.743 4.224 2.926 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.839 4.105 4.455 1.00 0.00 H new ATOM 876 N ASP A 60 8.523 9.145 5.633 1.00 0.00 N ATOM 877 CA ASP A 60 9.300 10.311 6.038 1.00 0.00 C ATOM 878 C ASP A 60 9.697 10.215 7.508 1.00 0.00 C ATOM 879 O ASP A 60 10.647 10.864 7.949 1.00 0.00 O ATOM 880 CB ASP A 60 8.500 11.592 5.796 1.00 0.00 C ATOM 881 CG ASP A 60 8.851 12.689 6.783 1.00 0.00 C ATOM 882 OD1 ASP A 60 8.429 12.591 7.954 1.00 0.00 O ATOM 883 OD2 ASP A 60 9.549 13.644 6.383 1.00 0.00 O ATOM 0 H ASP A 60 7.591 9.361 5.279 1.00 0.00 H new ATOM 0 HA ASP A 60 10.208 10.339 5.436 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.685 11.947 4.782 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.435 11.371 5.867 1.00 0.00 H new ATOM 888 N LEU A 61 8.965 9.402 8.261 1.00 0.00 N ATOM 889 CA LEU A 61 9.240 9.221 9.683 1.00 0.00 C ATOM 890 C LEU A 61 10.191 8.050 9.908 1.00 0.00 C ATOM 891 O LEU A 61 11.039 8.088 10.801 1.00 0.00 O ATOM 892 CB LEU A 61 7.937 8.989 10.449 1.00 0.00 C ATOM 893 CG LEU A 61 7.003 10.195 10.567 1.00 0.00 C ATOM 894 CD1 LEU A 61 7.791 11.447 10.918 1.00 0.00 C ATOM 895 CD2 LEU A 61 6.227 10.396 9.274 1.00 0.00 C ATOM 0 H LEU A 61 8.177 8.857 7.911 1.00 0.00 H new ATOM 0 HA LEU A 61 9.716 10.129 10.055 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.393 8.179 9.963 1.00 0.00 H new ATOM 0 HB3 LEU A 61 8.186 8.648 11.454 1.00 0.00 H new ATOM 0 HG LEU A 61 6.290 10.002 11.369 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.111 12.295 10.998 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.302 11.301 11.870 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.527 11.644 10.138 1.00 0.00 H new ATOM 0 HD21 LEU A 61 5.568 11.258 9.376 1.00 0.00 H new ATOM 0 HD22 LEU A 61 6.924 10.567 8.454 1.00 0.00 H new ATOM 0 HD23 LEU A 61 5.632 9.507 9.065 1.00 0.00 H new ATOM 907 N LEU A 62 10.047 7.012 9.093 1.00 0.00 N ATOM 908 CA LEU A 62 10.895 5.830 9.202 1.00 0.00 C ATOM 909 C LEU A 62 12.365 6.196 9.024 1.00 0.00 C ATOM 910 O LEU A 62 12.690 7.280 8.542 1.00 0.00 O ATOM 911 CB LEU A 62 10.487 4.788 8.158 1.00 0.00 C ATOM 912 CG LEU A 62 9.256 3.946 8.496 1.00 0.00 C ATOM 913 CD1 LEU A 62 8.668 3.331 7.236 1.00 0.00 C ATOM 914 CD2 LEU A 62 9.612 2.862 9.504 1.00 0.00 C ATOM 0 H LEU A 62 9.351 6.964 8.349 1.00 0.00 H new ATOM 0 HA LEU A 62 10.763 5.409 10.199 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.303 5.301 7.214 1.00 0.00 H new ATOM 0 HB3 LEU A 62 11.329 4.115 7.997 1.00 0.00 H new ATOM 0 HG LEU A 62 8.505 4.598 8.942 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.793 2.735 7.496 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.376 4.123 6.547 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.413 2.693 6.761 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.724 2.272 9.733 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.380 2.213 9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 62 9.987 3.324 10.418 1.00 0.00 H new ATOM 926 N GLU A 63 13.248 5.283 9.415 1.00 0.00 N ATOM 927 CA GLU A 63 14.684 5.510 9.297 1.00 0.00 C ATOM 928 C GLU A 63 15.162 5.242 7.873 1.00 0.00 C ATOM 929 O GLU A 63 16.125 5.850 7.405 1.00 0.00 O ATOM 930 CB GLU A 63 15.446 4.618 10.279 1.00 0.00 C ATOM 931 CG GLU A 63 15.444 3.148 9.894 1.00 0.00 C ATOM 932 CD GLU A 63 16.101 2.270 10.941 1.00 0.00 C ATOM 933 OE1 GLU A 63 15.719 2.374 12.126 1.00 0.00 O ATOM 934 OE2 GLU A 63 16.996 1.479 10.576 1.00 0.00 O ATOM 0 H GLU A 63 12.995 4.380 9.816 1.00 0.00 H new ATOM 0 HA GLU A 63 14.882 6.555 9.538 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.477 4.965 10.348 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.007 4.726 11.271 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.417 2.818 9.741 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.963 3.024 8.944 1.00 0.00 H new ATOM 941 N TYR A 64 14.482 4.328 7.189 1.00 0.00 N ATOM 942 CA TYR A 64 14.839 3.977 5.820 1.00 0.00 C ATOM 943 C TYR A 64 13.786 4.481 4.837 1.00 0.00 C ATOM 944 O TYR A 64 13.523 3.849 3.814 1.00 0.00 O ATOM 945 CB TYR A 64 14.996 2.462 5.684 1.00 0.00 C ATOM 946 CG TYR A 64 14.120 1.675 6.633 1.00 0.00 C ATOM 947 CD1 TYR A 64 12.754 1.551 6.408 1.00 0.00 C ATOM 948 CD2 TYR A 64 14.658 1.056 7.755 1.00 0.00 C ATOM 949 CE1 TYR A 64 11.950 0.834 7.273 1.00 0.00 C ATOM 950 CE2 TYR A 64 13.861 0.335 8.624 1.00 0.00 C ATOM 951 CZ TYR A 64 12.508 0.228 8.378 1.00 0.00 C ATOM 952 OH TYR A 64 11.711 -0.488 9.242 1.00 0.00 O ATOM 0 H TYR A 64 13.681 3.817 7.560 1.00 0.00 H new ATOM 0 HA TYR A 64 15.789 4.456 5.585 1.00 0.00 H new ATOM 0 HB2 TYR A 64 14.761 2.171 4.660 1.00 0.00 H new ATOM 0 HB3 TYR A 64 16.038 2.196 5.860 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.314 2.023 5.542 1.00 0.00 H new ATOM 0 HD2 TYR A 64 15.717 1.140 7.951 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.890 0.749 7.084 1.00 0.00 H new ATOM 0 HE2 TYR A 64 14.295 -0.142 9.490 1.00 0.00 H new ATOM 0 HH TYR A 64 12.260 -0.852 9.968 1.00 0.00 H new ATOM 962 N GLY A 65 13.188 5.625 5.155 1.00 0.00 N ATOM 963 CA GLY A 65 12.171 6.195 4.291 1.00 0.00 C ATOM 964 C GLY A 65 12.693 6.491 2.899 1.00 0.00 C ATOM 965 O GLY A 65 12.053 6.154 1.904 1.00 0.00 O ATOM 0 H GLY A 65 13.390 6.167 5.995 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.330 5.506 4.221 1.00 0.00 H new ATOM 0 HA3 GLY A 65 11.793 7.115 4.737 1.00 0.00 H new ATOM 969 N ASN A 66 13.859 7.125 2.828 1.00 0.00 N ATOM 970 CA ASN A 66 14.466 7.468 1.547 1.00 0.00 C ATOM 971 C ASN A 66 14.497 6.258 0.618 1.00 0.00 C ATOM 972 O ASN A 66 14.514 6.402 -0.604 1.00 0.00 O ATOM 973 CB ASN A 66 15.884 8.001 1.757 1.00 0.00 C ATOM 974 CG ASN A 66 15.941 9.096 2.804 1.00 0.00 C ATOM 975 OD1 ASN A 66 15.145 10.034 2.781 1.00 0.00 O ATOM 976 ND2 ASN A 66 16.887 8.981 3.730 1.00 0.00 N ATOM 0 H ASN A 66 14.402 7.412 3.642 1.00 0.00 H new ATOM 0 HA ASN A 66 13.859 8.245 1.082 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.537 7.181 2.057 1.00 0.00 H new ATOM 0 HB3 ASN A 66 16.268 8.385 0.812 1.00 0.00 H new ATOM 0 HD21 ASN A 66 16.974 9.688 4.460 1.00 0.00 H new ATOM 0 HD22 ASN A 66 17.526 8.186 3.711 1.00 0.00 H new ATOM 983 N GLN A 67 14.505 5.067 1.207 1.00 0.00 N ATOM 984 CA GLN A 67 14.534 3.832 0.432 1.00 0.00 C ATOM 985 C GLN A 67 13.147 3.492 -0.103 1.00 0.00 C ATOM 986 O GLN A 67 12.884 3.619 -1.298 1.00 0.00 O ATOM 987 CB GLN A 67 15.060 2.680 1.290 1.00 0.00 C ATOM 988 CG GLN A 67 16.552 2.761 1.570 1.00 0.00 C ATOM 989 CD GLN A 67 17.388 2.691 0.308 1.00 0.00 C ATOM 990 OE1 GLN A 67 17.464 1.649 -0.343 1.00 0.00 O ATOM 991 NE2 GLN A 67 18.021 3.804 -0.046 1.00 0.00 N ATOM 0 H GLN A 67 14.492 4.931 2.218 1.00 0.00 H new ATOM 0 HA GLN A 67 15.203 3.980 -0.416 1.00 0.00 H new ATOM 0 HB2 GLN A 67 14.521 2.668 2.237 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.844 1.737 0.789 1.00 0.00 H new ATOM 0 HG2 GLN A 67 16.769 3.692 2.094 1.00 0.00 H new ATOM 0 HG3 GLN A 67 16.837 1.947 2.236 1.00 0.00 H new ATOM 0 HE21 GLN A 67 17.930 4.646 0.523 1.00 0.00 H new ATOM 0 HE22 GLN A 67 18.598 3.817 -0.887 1.00 0.00 H new ATOM 1000 N PHE A 68 12.264 3.058 0.791 1.00 0.00 N ATOM 1001 CA PHE A 68 10.904 2.698 0.408 1.00 0.00 C ATOM 1002 C PHE A 68 10.254 3.814 -0.406 1.00 0.00 C ATOM 1003 O PHE A 68 9.259 3.593 -1.096 1.00 0.00 O ATOM 1004 CB PHE A 68 10.062 2.403 1.652 1.00 0.00 C ATOM 1005 CG PHE A 68 10.395 1.091 2.302 1.00 0.00 C ATOM 1006 CD1 PHE A 68 10.548 -0.056 1.540 1.00 0.00 C ATOM 1007 CD2 PHE A 68 10.554 1.004 3.676 1.00 0.00 C ATOM 1008 CE1 PHE A 68 10.853 -1.265 2.136 1.00 0.00 C ATOM 1009 CE2 PHE A 68 10.860 -0.202 4.278 1.00 0.00 C ATOM 1010 CZ PHE A 68 11.010 -1.338 3.506 1.00 0.00 C ATOM 0 H PHE A 68 12.466 2.947 1.785 1.00 0.00 H new ATOM 0 HA PHE A 68 10.953 1.802 -0.211 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.204 3.205 2.376 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.007 2.406 1.377 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.428 -0.005 0.468 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.437 1.889 4.284 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.968 -2.152 1.531 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.982 -0.256 5.350 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.250 -2.282 3.973 1.00 0.00 H new ATOM 1020 N GLN A 69 10.825 5.011 -0.319 1.00 0.00 N ATOM 1021 CA GLN A 69 10.301 6.161 -1.046 1.00 0.00 C ATOM 1022 C GLN A 69 10.562 6.024 -2.542 1.00 0.00 C ATOM 1023 O GLN A 69 9.733 6.414 -3.365 1.00 0.00 O ATOM 1024 CB GLN A 69 10.932 7.453 -0.522 1.00 0.00 C ATOM 1025 CG GLN A 69 10.155 8.090 0.618 1.00 0.00 C ATOM 1026 CD GLN A 69 10.348 9.592 0.688 1.00 0.00 C ATOM 1027 OE1 GLN A 69 11.104 10.170 -0.095 1.00 0.00 O ATOM 1028 NE2 GLN A 69 9.665 10.235 1.628 1.00 0.00 N ATOM 0 H GLN A 69 11.650 5.210 0.247 1.00 0.00 H new ATOM 0 HA GLN A 69 9.224 6.200 -0.886 1.00 0.00 H new ATOM 0 HB2 GLN A 69 11.947 7.241 -0.185 1.00 0.00 H new ATOM 0 HB3 GLN A 69 11.010 8.168 -1.341 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.094 7.869 0.498 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.469 7.643 1.561 1.00 0.00 H new ATOM 0 HE21 GLN A 69 9.050 9.717 2.256 1.00 0.00 H new ATOM 0 HE22 GLN A 69 9.756 11.247 1.722 1.00 0.00 H new ATOM 1037 N ASP A 70 11.718 5.469 -2.888 1.00 0.00 N ATOM 1038 CA ASP A 70 12.088 5.280 -4.285 1.00 0.00 C ATOM 1039 C ASP A 70 11.467 4.004 -4.844 1.00 0.00 C ATOM 1040 O ASP A 70 10.919 3.999 -5.945 1.00 0.00 O ATOM 1041 CB ASP A 70 13.610 5.228 -4.430 1.00 0.00 C ATOM 1042 CG ASP A 70 14.061 5.388 -5.868 1.00 0.00 C ATOM 1043 OD1 ASP A 70 13.624 6.358 -6.523 1.00 0.00 O ATOM 1044 OD2 ASP A 70 14.852 4.545 -6.339 1.00 0.00 O ATOM 0 H ASP A 70 12.415 5.142 -2.219 1.00 0.00 H new ATOM 0 HA ASP A 70 11.706 6.128 -4.854 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.057 6.015 -3.823 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.977 4.278 -4.041 1.00 0.00 H new ATOM 1049 N ALA A 71 11.560 2.922 -4.077 1.00 0.00 N ATOM 1050 CA ALA A 71 11.006 1.640 -4.495 1.00 0.00 C ATOM 1051 C ALA A 71 9.514 1.755 -4.785 1.00 0.00 C ATOM 1052 O ALA A 71 8.991 1.086 -5.678 1.00 0.00 O ATOM 1053 CB ALA A 71 11.259 0.584 -3.429 1.00 0.00 C ATOM 0 H ALA A 71 12.014 2.908 -3.163 1.00 0.00 H new ATOM 0 HA ALA A 71 11.506 1.339 -5.416 1.00 0.00 H new ATOM 0 HB1 ALA A 71 10.840 -0.368 -3.754 1.00 0.00 H new ATOM 0 HB2 ALA A 71 12.332 0.474 -3.273 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.786 0.889 -2.495 1.00 0.00 H new ATOM 1059 N LEU A 72 8.832 2.605 -4.026 1.00 0.00 N ATOM 1060 CA LEU A 72 7.397 2.806 -4.201 1.00 0.00 C ATOM 1061 C LEU A 72 7.116 3.681 -5.419 1.00 0.00 C ATOM 1062 O LEU A 72 6.287 3.339 -6.263 1.00 0.00 O ATOM 1063 CB LEU A 72 6.795 3.446 -2.949 1.00 0.00 C ATOM 1064 CG LEU A 72 6.553 2.508 -1.766 1.00 0.00 C ATOM 1065 CD1 LEU A 72 6.289 3.305 -0.498 1.00 0.00 C ATOM 1066 CD2 LEU A 72 5.392 1.569 -2.059 1.00 0.00 C ATOM 0 H LEU A 72 9.249 3.166 -3.283 1.00 0.00 H new ATOM 0 HA LEU A 72 6.935 1.832 -4.361 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.456 4.248 -2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.846 3.907 -3.222 1.00 0.00 H new ATOM 0 HG LEU A 72 7.450 1.908 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 72 6.119 2.621 0.333 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.151 3.935 -0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.408 3.931 -0.639 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.234 0.909 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.489 2.152 -2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.620 0.973 -2.942 1.00 0.00 H new ATOM 1078 N TYR A 73 7.811 4.809 -5.504 1.00 0.00 N ATOM 1079 CA TYR A 73 7.636 5.733 -6.618 1.00 0.00 C ATOM 1080 C TYR A 73 7.654 4.989 -7.951 1.00 0.00 C ATOM 1081 O TYR A 73 7.059 5.434 -8.932 1.00 0.00 O ATOM 1082 CB TYR A 73 8.733 6.799 -6.602 1.00 0.00 C ATOM 1083 CG TYR A 73 8.883 7.533 -7.915 1.00 0.00 C ATOM 1084 CD1 TYR A 73 8.154 8.687 -8.176 1.00 0.00 C ATOM 1085 CD2 TYR A 73 9.756 7.074 -8.894 1.00 0.00 C ATOM 1086 CE1 TYR A 73 8.288 9.360 -9.375 1.00 0.00 C ATOM 1087 CE2 TYR A 73 9.898 7.742 -10.095 1.00 0.00 C ATOM 1088 CZ TYR A 73 9.161 8.884 -10.331 1.00 0.00 C ATOM 1089 OH TYR A 73 9.298 9.553 -11.526 1.00 0.00 O ATOM 0 H TYR A 73 8.501 5.106 -4.814 1.00 0.00 H new ATOM 0 HA TYR A 73 6.666 6.218 -6.505 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.515 7.521 -5.815 1.00 0.00 H new ATOM 0 HB3 TYR A 73 9.682 6.328 -6.348 1.00 0.00 H new ATOM 0 HD1 TYR A 73 7.471 9.064 -7.429 1.00 0.00 H new ATOM 0 HD2 TYR A 73 10.334 6.180 -8.713 1.00 0.00 H new ATOM 0 HE1 TYR A 73 7.712 10.254 -9.563 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.582 7.372 -10.845 1.00 0.00 H new ATOM 0 HH TYR A 73 9.953 9.088 -12.088 1.00 0.00 H new ATOM 1099 N LYS A 74 8.342 3.853 -7.977 1.00 0.00 N ATOM 1100 CA LYS A 74 8.438 3.044 -9.186 1.00 0.00 C ATOM 1101 C LYS A 74 7.156 2.250 -9.413 1.00 0.00 C ATOM 1102 O LYS A 74 6.586 2.273 -10.503 1.00 0.00 O ATOM 1103 CB LYS A 74 9.631 2.090 -9.093 1.00 0.00 C ATOM 1104 CG LYS A 74 10.975 2.798 -9.066 1.00 0.00 C ATOM 1105 CD LYS A 74 12.073 1.891 -8.536 1.00 0.00 C ATOM 1106 CE LYS A 74 13.160 2.686 -7.830 1.00 0.00 C ATOM 1107 NZ LYS A 74 14.237 3.107 -8.767 1.00 0.00 N ATOM 0 H LYS A 74 8.842 3.471 -7.174 1.00 0.00 H new ATOM 0 HA LYS A 74 8.583 3.716 -10.032 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.531 1.483 -8.193 1.00 0.00 H new ATOM 0 HB3 LYS A 74 9.606 1.407 -9.942 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.231 3.132 -10.071 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.905 3.689 -8.442 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.645 1.165 -7.845 1.00 0.00 H new ATOM 0 HD3 LYS A 74 12.510 1.327 -9.360 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.720 3.567 -7.363 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.590 2.083 -7.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.867 3.784 -8.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 14.785 2.274 -9.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 13.813 3.558 -9.603 1.00 0.00 H new ATOM 1121 N MET A 75 6.707 1.550 -8.376 1.00 0.00 N ATOM 1122 CA MET A 75 5.490 0.752 -8.463 1.00 0.00 C ATOM 1123 C MET A 75 4.287 1.629 -8.792 1.00 0.00 C ATOM 1124 O MET A 75 3.290 1.155 -9.338 1.00 0.00 O ATOM 1125 CB MET A 75 5.248 0.007 -7.148 1.00 0.00 C ATOM 1126 CG MET A 75 6.435 -0.829 -6.696 1.00 0.00 C ATOM 1127 SD MET A 75 5.946 -2.235 -5.680 1.00 0.00 S ATOM 1128 CE MET A 75 5.214 -1.400 -4.275 1.00 0.00 C ATOM 0 H MET A 75 7.168 1.519 -7.466 1.00 0.00 H new ATOM 0 HA MET A 75 5.618 0.026 -9.266 1.00 0.00 H new ATOM 0 HB2 MET A 75 5.006 0.730 -6.369 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.379 -0.642 -7.262 1.00 0.00 H new ATOM 0 HG2 MET A 75 6.976 -1.189 -7.571 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.124 -0.200 -6.132 1.00 0.00 H new ATOM 0 HE1 MET A 75 4.469 -2.048 -3.814 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.990 -1.164 -3.547 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.737 -0.478 -4.608 1.00 0.00 H new ATOM 1138 N THR A 76 4.385 2.912 -8.457 1.00 0.00 N ATOM 1139 CA THR A 76 3.304 3.855 -8.716 1.00 0.00 C ATOM 1140 C THR A 76 3.631 4.753 -9.904 1.00 0.00 C ATOM 1141 O THR A 76 2.735 5.239 -10.592 1.00 0.00 O ATOM 1142 CB THR A 76 3.019 4.735 -7.485 1.00 0.00 C ATOM 1143 OG1 THR A 76 4.021 5.751 -7.366 1.00 0.00 O ATOM 1144 CG2 THR A 76 2.988 3.896 -6.216 1.00 0.00 C ATOM 0 H THR A 76 5.203 3.322 -8.005 1.00 0.00 H new ATOM 0 HA THR A 76 2.417 3.264 -8.944 1.00 0.00 H new ATOM 0 HB THR A 76 2.043 5.202 -7.618 1.00 0.00 H new ATOM 0 HG1 THR A 76 3.590 6.621 -7.231 1.00 0.00 H new ATOM 0 HG21 THR A 76 2.785 4.539 -5.360 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.205 3.142 -6.297 1.00 0.00 H new ATOM 0 HG23 THR A 76 3.952 3.405 -6.081 1.00 0.00 H new ATOM 1152 N GLY A 77 4.922 4.969 -10.140 1.00 0.00 N ATOM 1153 CA GLY A 77 5.344 5.808 -11.246 1.00 0.00 C ATOM 1154 C GLY A 77 5.391 7.277 -10.874 1.00 0.00 C ATOM 1155 O GLY A 77 6.009 8.080 -11.571 1.00 0.00 O ATOM 0 H GLY A 77 5.683 4.578 -9.585 1.00 0.00 H new ATOM 0 HA2 GLY A 77 6.330 5.490 -11.583 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.661 5.670 -12.084 1.00 0.00 H new ATOM 1159 N GLU A 78 4.735 7.628 -9.773 1.00 0.00 N ATOM 1160 CA GLU A 78 4.703 9.011 -9.312 1.00 0.00 C ATOM 1161 C GLU A 78 5.024 9.096 -7.822 1.00 0.00 C ATOM 1162 O GLU A 78 4.858 8.124 -7.085 1.00 0.00 O ATOM 1163 CB GLU A 78 3.331 9.632 -9.585 1.00 0.00 C ATOM 1164 CG GLU A 78 3.379 11.131 -9.829 1.00 0.00 C ATOM 1165 CD GLU A 78 3.729 11.478 -11.262 1.00 0.00 C ATOM 1166 OE1 GLU A 78 3.217 10.803 -12.179 1.00 0.00 O ATOM 1167 OE2 GLU A 78 4.517 12.425 -11.467 1.00 0.00 O ATOM 0 H GLU A 78 4.219 6.975 -9.184 1.00 0.00 H new ATOM 0 HA GLU A 78 5.462 9.567 -9.862 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.887 9.145 -10.454 1.00 0.00 H new ATOM 0 HB3 GLU A 78 2.676 9.431 -8.738 1.00 0.00 H new ATOM 0 HG2 GLU A 78 2.412 11.567 -9.580 1.00 0.00 H new ATOM 0 HG3 GLU A 78 4.113 11.581 -9.161 1.00 0.00 H new ATOM 1174 N ARG A 79 5.485 10.264 -7.388 1.00 0.00 N ATOM 1175 CA ARG A 79 5.831 10.476 -5.988 1.00 0.00 C ATOM 1176 C ARG A 79 4.721 11.230 -5.261 1.00 0.00 C ATOM 1177 O ARG A 79 4.987 12.099 -4.429 1.00 0.00 O ATOM 1178 CB ARG A 79 7.146 11.251 -5.877 1.00 0.00 C ATOM 1179 CG ARG A 79 7.112 12.609 -6.559 1.00 0.00 C ATOM 1180 CD ARG A 79 6.665 13.702 -5.601 1.00 0.00 C ATOM 1181 NE ARG A 79 7.281 14.989 -5.914 1.00 0.00 N ATOM 1182 CZ ARG A 79 7.219 16.047 -5.113 1.00 0.00 C ATOM 1183 NH1 ARG A 79 6.573 15.972 -3.958 1.00 0.00 N ATOM 1184 NH2 ARG A 79 7.805 17.184 -5.468 1.00 0.00 N ATOM 0 H ARG A 79 5.628 11.078 -7.986 1.00 0.00 H new ATOM 0 HA ARG A 79 5.951 9.500 -5.518 1.00 0.00 H new ATOM 0 HB2 ARG A 79 7.389 11.389 -4.823 1.00 0.00 H new ATOM 0 HB3 ARG A 79 7.947 10.655 -6.313 1.00 0.00 H new ATOM 0 HG2 ARG A 79 8.102 12.847 -6.948 1.00 0.00 H new ATOM 0 HG3 ARG A 79 6.435 12.572 -7.412 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.580 13.799 -5.643 1.00 0.00 H new ATOM 0 HD3 ARG A 79 6.920 13.416 -4.581 1.00 0.00 H new ATOM 0 HE ARG A 79 7.786 15.080 -6.795 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.122 15.100 -3.682 1.00 0.00 H new ATOM 0 HH12 ARG A 79 6.527 16.786 -3.345 1.00 0.00 H new ATOM 0 HH21 ARG A 79 8.303 17.245 -6.356 1.00 0.00 H new ATOM 0 HH22 ARG A 79 7.757 17.996 -4.853 1.00 0.00 H new ATOM 1198 N THR A 80 3.476 10.893 -5.581 1.00 0.00 N ATOM 1199 CA THR A 80 2.326 11.538 -4.961 1.00 0.00 C ATOM 1200 C THR A 80 1.832 10.743 -3.758 1.00 0.00 C ATOM 1201 O THR A 80 1.458 9.577 -3.882 1.00 0.00 O ATOM 1202 CB THR A 80 1.167 11.705 -5.962 1.00 0.00 C ATOM 1203 OG1 THR A 80 0.728 10.422 -6.422 1.00 0.00 O ATOM 1204 CG2 THR A 80 1.596 12.554 -7.149 1.00 0.00 C ATOM 0 H THR A 80 3.238 10.176 -6.267 1.00 0.00 H new ATOM 0 HA THR A 80 2.657 12.523 -4.632 1.00 0.00 H new ATOM 0 HB THR A 80 0.346 12.209 -5.452 1.00 0.00 H new ATOM 0 HG1 THR A 80 0.785 9.775 -5.689 1.00 0.00 H new ATOM 0 HG21 THR A 80 0.761 12.658 -7.842 1.00 0.00 H new ATOM 0 HG22 THR A 80 1.903 13.540 -6.799 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.432 12.073 -7.657 1.00 0.00 H new ATOM 1212 N VAL A 81 1.831 11.382 -2.592 1.00 0.00 N ATOM 1213 CA VAL A 81 1.381 10.735 -1.366 1.00 0.00 C ATOM 1214 C VAL A 81 0.113 11.391 -0.832 1.00 0.00 C ATOM 1215 O VAL A 81 -0.207 12.536 -1.154 1.00 0.00 O ATOM 1216 CB VAL A 81 2.467 10.780 -0.275 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.360 9.552 -0.359 1.00 0.00 C ATOM 1218 CG2 VAL A 81 3.289 12.055 -0.395 1.00 0.00 C ATOM 0 H VAL A 81 2.137 12.347 -2.471 1.00 0.00 H new ATOM 0 HA VAL A 81 1.171 9.695 -1.616 1.00 0.00 H new ATOM 0 HB VAL A 81 1.979 10.779 0.699 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.121 9.602 0.420 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.758 8.654 -0.221 1.00 0.00 H new ATOM 0 HG13 VAL A 81 3.842 9.519 -1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.052 12.071 0.383 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.768 12.088 -1.373 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.636 12.921 -0.281 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.629 10.651 0.006 1.00 0.00 N ATOM 1229 CA PRO A 82 -0.259 9.287 0.396 1.00 0.00 C ATOM 1230 C PRO A 82 -0.395 8.297 -0.756 1.00 0.00 C ATOM 1231 O PRO A 82 -0.754 8.675 -1.872 1.00 0.00 O ATOM 1232 CB PRO A 82 -1.257 8.953 1.508 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.435 9.822 1.233 1.00 0.00 C ATOM 1234 CD PRO A 82 -1.887 11.088 0.635 1.00 0.00 C ATOM 0 HA PRO A 82 0.784 9.221 0.706 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.531 7.898 1.491 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.836 9.157 2.492 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -3.127 9.334 0.547 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -2.988 10.031 2.149 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.573 11.518 -0.095 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.713 11.849 1.395 1.00 0.00 H new ATOM 1242 N ARG A 83 -0.108 7.030 -0.479 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.198 5.986 -1.493 1.00 0.00 C ATOM 1244 C ARG A 83 -1.042 4.816 -0.996 1.00 0.00 C ATOM 1245 O ARG A 83 -0.652 4.107 -0.068 1.00 0.00 O ATOM 1246 CB ARG A 83 1.200 5.495 -1.874 1.00 0.00 C ATOM 1247 CG ARG A 83 2.086 6.578 -2.466 1.00 0.00 C ATOM 1248 CD ARG A 83 3.559 6.285 -2.228 1.00 0.00 C ATOM 1249 NE ARG A 83 4.420 7.340 -2.755 1.00 0.00 N ATOM 1250 CZ ARG A 83 5.690 7.500 -2.399 1.00 0.00 C ATOM 1251 NH1 ARG A 83 6.243 6.677 -1.519 1.00 0.00 N ATOM 1252 NH2 ARG A 83 6.408 8.484 -2.923 1.00 0.00 N ATOM 0 H ARG A 83 0.189 6.701 0.440 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.680 6.410 -2.374 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.685 5.084 -0.989 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.106 4.681 -2.593 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.898 6.658 -3.537 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.830 7.541 -2.024 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.738 6.172 -1.159 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.820 5.336 -2.697 1.00 0.00 H new ATOM 0 HE ARG A 83 4.025 7.990 -3.434 1.00 0.00 H new ATOM 0 HH11 ARG A 83 5.693 5.919 -1.114 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.218 6.802 -1.247 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.985 9.119 -3.600 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.383 8.606 -2.649 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.199 4.622 -1.619 1.00 0.00 N ATOM 1267 CA ILE A 84 -3.098 3.539 -1.240 1.00 0.00 C ATOM 1268 C ILE A 84 -2.931 2.337 -2.165 1.00 0.00 C ATOM 1269 O ILE A 84 -2.889 2.482 -3.387 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.569 3.992 -1.267 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -4.784 5.157 -0.299 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.488 2.830 -0.918 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.533 6.513 -0.921 1.00 0.00 C ATOM 0 H ILE A 84 -2.536 5.201 -2.388 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.834 3.252 -0.222 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.811 4.331 -2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.806 5.122 0.077 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.124 5.032 0.559 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.525 3.166 -0.941 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.351 2.027 -1.642 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.248 2.463 0.080 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.704 7.292 -0.178 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.503 6.567 -1.272 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.211 6.659 -1.762 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.837 1.151 -1.573 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.676 -0.077 -2.344 1.00 0.00 C ATOM 1287 C PHE A 85 -3.709 -1.119 -1.928 1.00 0.00 C ATOM 1288 O PHE A 85 -3.761 -1.532 -0.770 1.00 0.00 O ATOM 1289 CB PHE A 85 -1.265 -0.639 -2.158 1.00 0.00 C ATOM 1290 CG PHE A 85 -0.230 0.047 -3.004 1.00 0.00 C ATOM 1291 CD1 PHE A 85 0.336 1.243 -2.596 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.176 -0.506 -4.208 1.00 0.00 C ATOM 1293 CE1 PHE A 85 1.288 1.876 -3.373 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.128 0.122 -4.989 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.685 1.315 -4.571 1.00 0.00 C ATOM 0 H PHE A 85 -2.869 1.014 -0.563 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.829 0.161 -3.397 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.982 -0.550 -1.109 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.272 -1.702 -2.397 1.00 0.00 H new ATOM 0 HD1 PHE A 85 0.030 1.686 -1.660 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -0.256 -1.438 -4.540 1.00 0.00 H new ATOM 0 HE1 PHE A 85 1.721 2.809 -3.043 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.436 -0.320 -5.925 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.429 1.808 -5.179 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.533 -1.541 -2.883 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.565 -2.535 -2.618 1.00 0.00 C ATOM 1307 C VAL A 86 -5.164 -3.902 -3.160 1.00 0.00 C ATOM 1308 O VAL A 86 -4.937 -4.064 -4.358 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.913 -2.124 -3.240 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.906 -3.275 -3.173 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.467 -0.891 -2.544 1.00 0.00 C ATOM 0 H VAL A 86 -4.505 -1.209 -3.847 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.676 -2.595 -1.535 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.749 -1.878 -4.289 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.852 -2.966 -3.617 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.510 -4.130 -3.722 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -8.068 -3.555 -2.132 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.419 -0.615 -2.996 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.617 -1.107 -1.486 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.762 -0.066 -2.650 1.00 0.00 H new ATOM 1321 N ASN A 87 -5.078 -4.884 -2.268 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.703 -6.239 -2.657 1.00 0.00 C ATOM 1323 C ASN A 87 -3.423 -6.232 -3.488 1.00 0.00 C ATOM 1324 O ASN A 87 -3.272 -7.019 -4.421 1.00 0.00 O ATOM 1325 CB ASN A 87 -5.835 -6.896 -3.449 1.00 0.00 C ATOM 1326 CG ASN A 87 -5.737 -8.410 -3.451 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -4.661 -8.973 -3.246 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -6.862 -9.075 -3.684 1.00 0.00 N ATOM 0 H ASN A 87 -5.263 -4.767 -1.272 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.522 -6.814 -1.749 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.793 -6.597 -3.024 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -5.815 -6.532 -4.476 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.858 -10.095 -3.698 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.731 -8.566 -3.849 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.503 -5.338 -3.140 1.00 0.00 N ATOM 1336 CA GLY A 88 -1.248 -5.245 -3.863 1.00 0.00 C ATOM 1337 C GLY A 88 -1.417 -4.642 -5.243 1.00 0.00 C ATOM 1338 O GLY A 88 -0.836 -5.125 -6.216 1.00 0.00 O ATOM 0 H GLY A 88 -2.604 -4.676 -2.370 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.546 -4.640 -3.289 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.811 -6.239 -3.955 1.00 0.00 H new ATOM 1342 N THR A 89 -2.216 -3.583 -5.331 1.00 0.00 N ATOM 1343 CA THR A 89 -2.462 -2.915 -6.602 1.00 0.00 C ATOM 1344 C THR A 89 -2.765 -1.435 -6.396 1.00 0.00 C ATOM 1345 O THR A 89 -3.453 -1.058 -5.447 1.00 0.00 O ATOM 1346 CB THR A 89 -3.634 -3.566 -7.362 1.00 0.00 C ATOM 1347 OG1 THR A 89 -3.205 -4.791 -7.967 1.00 0.00 O ATOM 1348 CG2 THR A 89 -4.174 -2.628 -8.431 1.00 0.00 C ATOM 0 H THR A 89 -2.704 -3.170 -4.536 1.00 0.00 H new ATOM 0 HA THR A 89 -1.553 -3.018 -7.194 1.00 0.00 H new ATOM 0 HB THR A 89 -4.431 -3.773 -6.648 1.00 0.00 H new ATOM 0 HG1 THR A 89 -2.325 -5.039 -7.615 1.00 0.00 H new ATOM 0 HG21 THR A 89 -5.000 -3.110 -8.954 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.527 -1.709 -7.964 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.382 -2.393 -9.142 1.00 0.00 H new ATOM 1356 N PHE A 90 -2.248 -0.600 -7.291 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.464 0.840 -7.207 1.00 0.00 C ATOM 1358 C PHE A 90 -3.788 1.231 -7.855 1.00 0.00 C ATOM 1359 O PHE A 90 -3.911 1.246 -9.080 1.00 0.00 O ATOM 1360 CB PHE A 90 -1.312 1.590 -7.880 1.00 0.00 C ATOM 1361 CG PHE A 90 -1.252 3.046 -7.518 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -1.983 3.982 -8.231 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -0.464 3.479 -6.463 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -1.928 5.323 -7.900 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -0.406 4.818 -6.127 1.00 0.00 C ATOM 1366 CZ PHE A 90 -1.140 5.741 -6.846 1.00 0.00 C ATOM 0 H PHE A 90 -1.677 -0.895 -8.083 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.501 1.115 -6.153 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.370 1.116 -7.604 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.411 1.497 -8.961 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.603 3.660 -9.055 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.111 2.761 -5.897 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -2.501 6.043 -8.465 1.00 0.00 H new ATOM 0 HE2 PHE A 90 0.212 5.142 -5.303 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.098 6.788 -6.584 1.00 0.00 H new ATOM 1376 N ILE A 91 -4.777 1.545 -7.025 1.00 0.00 N ATOM 1377 CA ILE A 91 -6.092 1.936 -7.516 1.00 0.00 C ATOM 1378 C ILE A 91 -6.212 3.453 -7.618 1.00 0.00 C ATOM 1379 O ILE A 91 -7.093 3.972 -8.302 1.00 0.00 O ATOM 1380 CB ILE A 91 -7.215 1.404 -6.606 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -7.253 2.190 -5.294 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -7.017 -0.080 -6.335 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -6.111 1.861 -4.359 1.00 0.00 C ATOM 0 H ILE A 91 -4.692 1.536 -6.009 1.00 0.00 H new ATOM 0 HA ILE A 91 -6.201 1.497 -8.508 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.170 1.537 -7.115 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.233 3.257 -5.518 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -8.197 1.989 -4.787 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -7.818 -0.442 -5.691 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.034 -0.627 -7.277 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.057 -0.235 -5.843 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.202 2.455 -3.450 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -6.143 0.802 -4.105 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.164 2.089 -4.848 1.00 0.00 H new ATOM 1395 N GLY A 92 -5.317 4.160 -6.934 1.00 0.00 N ATOM 1396 CA GLY A 92 -5.339 5.610 -6.962 1.00 0.00 C ATOM 1397 C GLY A 92 -4.948 6.222 -5.631 1.00 0.00 C ATOM 1398 O GLY A 92 -4.974 5.551 -4.600 1.00 0.00 O ATOM 0 H GLY A 92 -4.577 3.754 -6.361 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.659 5.966 -7.736 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.338 5.950 -7.235 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.582 7.500 -5.654 1.00 0.00 N ATOM 1403 CA GLY A 93 -4.186 8.180 -4.434 1.00 0.00 C ATOM 1404 C GLY A 93 -5.374 8.562 -3.573 1.00 0.00 C ATOM 1405 O GLY A 93 -6.496 8.123 -3.821 1.00 0.00 O ATOM 0 H GLY A 93 -4.553 8.076 -6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.519 7.535 -3.862 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.622 9.077 -4.688 1.00 0.00 H new ATOM 1409 N ALA A 94 -5.126 9.381 -2.556 1.00 0.00 N ATOM 1410 CA ALA A 94 -6.183 9.823 -1.655 1.00 0.00 C ATOM 1411 C ALA A 94 -7.454 10.164 -2.426 1.00 0.00 C ATOM 1412 O ALA A 94 -8.478 9.493 -2.286 1.00 0.00 O ATOM 1413 CB ALA A 94 -5.718 11.022 -0.843 1.00 0.00 C ATOM 0 H ALA A 94 -4.202 9.752 -2.336 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.411 9.004 -0.973 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.518 11.341 -0.175 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.842 10.746 -0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.460 11.839 -1.516 1.00 0.00 H new ATOM 1419 N THR A 95 -7.383 11.212 -3.241 1.00 0.00 N ATOM 1420 CA THR A 95 -8.528 11.644 -4.032 1.00 0.00 C ATOM 1421 C THR A 95 -9.225 10.455 -4.684 1.00 0.00 C ATOM 1422 O THR A 95 -10.345 10.102 -4.316 1.00 0.00 O ATOM 1423 CB THR A 95 -8.109 12.643 -5.127 1.00 0.00 C ATOM 1424 OG1 THR A 95 -7.093 13.520 -4.628 1.00 0.00 O ATOM 1425 CG2 THR A 95 -9.303 13.459 -5.600 1.00 0.00 C ATOM 0 H THR A 95 -6.544 11.777 -3.370 1.00 0.00 H new ATOM 0 HA THR A 95 -9.219 12.136 -3.347 1.00 0.00 H new ATOM 0 HB THR A 95 -7.717 12.078 -5.973 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.831 14.151 -5.331 1.00 0.00 H new ATOM 0 HG21 THR A 95 -8.983 14.158 -6.373 1.00 0.00 H new ATOM 0 HG22 THR A 95 -10.062 12.791 -6.006 1.00 0.00 H new ATOM 0 HG23 THR A 95 -9.720 14.014 -4.760 1.00 0.00 H new ATOM 1433 N ASP A 96 -8.556 9.842 -5.654 1.00 0.00 N ATOM 1434 CA ASP A 96 -9.111 8.691 -6.357 1.00 0.00 C ATOM 1435 C ASP A 96 -9.745 7.710 -5.376 1.00 0.00 C ATOM 1436 O ASP A 96 -10.956 7.485 -5.401 1.00 0.00 O ATOM 1437 CB ASP A 96 -8.021 7.988 -7.168 1.00 0.00 C ATOM 1438 CG ASP A 96 -7.528 8.830 -8.328 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -8.348 9.562 -8.920 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -6.322 8.758 -8.642 1.00 0.00 O ATOM 0 H ASP A 96 -7.628 10.123 -5.972 1.00 0.00 H new ATOM 0 HA ASP A 96 -9.885 9.049 -7.036 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -7.182 7.750 -6.514 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -8.408 7.042 -7.548 1.00 0.00 H new ATOM 1445 N THR A 97 -8.920 7.126 -4.513 1.00 0.00 N ATOM 1446 CA THR A 97 -9.400 6.168 -3.525 1.00 0.00 C ATOM 1447 C THR A 97 -10.726 6.616 -2.923 1.00 0.00 C ATOM 1448 O THR A 97 -11.646 5.814 -2.755 1.00 0.00 O ATOM 1449 CB THR A 97 -8.376 5.969 -2.392 1.00 0.00 C ATOM 1450 OG1 THR A 97 -7.072 5.750 -2.942 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.764 4.791 -1.512 1.00 0.00 C ATOM 0 H THR A 97 -7.916 7.300 -4.478 1.00 0.00 H new ATOM 0 HA THR A 97 -9.543 5.222 -4.046 1.00 0.00 H new ATOM 0 HB THR A 97 -8.365 6.871 -1.781 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.704 6.601 -3.261 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.026 4.670 -0.719 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.744 4.974 -1.071 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.801 3.883 -2.114 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.820 7.902 -2.600 1.00 0.00 N ATOM 1460 CA HIS A 98 -12.037 8.457 -2.018 1.00 0.00 C ATOM 1461 C HIS A 98 -13.202 8.359 -2.997 1.00 0.00 C ATOM 1462 O HIS A 98 -14.307 7.964 -2.625 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.815 9.915 -1.615 1.00 0.00 C ATOM 1464 CG HIS A 98 -13.033 10.569 -1.039 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -14.090 9.859 -0.509 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -13.359 11.877 -0.911 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -15.013 10.701 -0.081 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.594 11.932 -0.313 1.00 0.00 N ATOM 0 H HIS A 98 -10.068 8.579 -2.731 1.00 0.00 H new ATOM 0 HA HIS A 98 -12.283 7.875 -1.130 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -11.007 9.963 -0.885 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.488 10.479 -2.489 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -14.150 8.842 -0.456 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.759 12.720 -1.221 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.951 10.429 0.380 1.00 0.00 H new ATOM 1476 N ARG A 99 -12.948 8.722 -4.250 1.00 0.00 N ATOM 1477 CA ARG A 99 -13.976 8.677 -5.283 1.00 0.00 C ATOM 1478 C ARG A 99 -14.424 7.241 -5.541 1.00 0.00 C ATOM 1479 O ARG A 99 -15.618 6.963 -5.658 1.00 0.00 O ATOM 1480 CB ARG A 99 -13.456 9.302 -6.578 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.542 9.554 -7.612 1.00 0.00 C ATOM 1482 CD ARG A 99 -13.967 9.627 -9.018 1.00 0.00 C ATOM 1483 NE ARG A 99 -14.747 10.507 -9.883 1.00 0.00 N ATOM 1484 CZ ARG A 99 -14.743 11.831 -9.780 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -14.003 12.425 -8.854 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -15.480 12.564 -10.605 1.00 0.00 N ATOM 0 H ARG A 99 -12.039 9.051 -4.574 1.00 0.00 H new ATOM 0 HA ARG A 99 -14.834 9.250 -4.932 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -12.963 10.246 -6.344 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -12.700 8.646 -7.010 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.285 8.758 -7.562 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -15.058 10.486 -7.380 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -12.938 9.984 -8.971 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.938 8.627 -9.450 1.00 0.00 H new ATOM 0 HE ARG A 99 -15.327 10.082 -10.606 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.435 11.865 -8.218 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -14.002 13.442 -8.777 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -16.050 12.111 -11.319 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -15.476 13.581 -10.525 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.459 6.333 -5.631 1.00 0.00 N ATOM 1501 CA LEU A 100 -13.753 4.926 -5.877 1.00 0.00 C ATOM 1502 C LEU A 100 -14.862 4.432 -4.954 1.00 0.00 C ATOM 1503 O LEU A 100 -15.842 3.839 -5.406 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.494 4.079 -5.678 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.377 4.287 -6.701 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -10.138 3.499 -6.307 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -11.846 3.886 -8.092 1.00 0.00 C ATOM 0 H LEU A 100 -12.466 6.546 -5.537 1.00 0.00 H new ATOM 0 HA LEU A 100 -14.092 4.826 -6.908 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.094 4.286 -4.686 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -12.782 3.028 -5.692 1.00 0.00 H new ATOM 0 HG LEU A 100 -11.119 5.346 -6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.354 3.660 -7.047 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.789 3.834 -5.330 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.381 2.438 -6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -11.038 4.041 -8.807 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.133 2.834 -8.090 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -12.704 4.495 -8.376 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.702 4.683 -3.658 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.692 4.266 -2.671 1.00 0.00 C ATOM 1521 C HIS A 101 -17.063 4.852 -2.996 1.00 0.00 C ATOM 1522 O HIS A 101 -18.084 4.175 -2.874 1.00 0.00 O ATOM 1523 CB HIS A 101 -15.259 4.697 -1.270 1.00 0.00 C ATOM 1524 CG HIS A 101 -16.193 4.246 -0.189 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -16.513 2.922 0.025 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.875 4.952 0.743 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -17.353 2.833 1.040 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.589 4.051 1.494 1.00 0.00 N ATOM 0 H HIS A 101 -13.897 5.173 -3.267 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.765 3.179 -2.702 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -14.264 4.300 -1.068 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.181 5.784 -1.241 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.860 6.024 0.872 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -17.775 1.920 1.432 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -18.202 4.284 2.275 1.00 0.00 H new ATOM 1536 N LYS A 102 -17.078 6.115 -3.409 1.00 0.00 N ATOM 1537 CA LYS A 102 -18.323 6.793 -3.751 1.00 0.00 C ATOM 1538 C LYS A 102 -19.076 6.032 -4.838 1.00 0.00 C ATOM 1539 O LYS A 102 -20.188 5.555 -4.616 1.00 0.00 O ATOM 1540 CB LYS A 102 -18.037 8.222 -4.220 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.458 9.113 -3.134 1.00 0.00 C ATOM 1542 CD LYS A 102 -18.550 9.849 -2.376 1.00 0.00 C ATOM 1543 CE LYS A 102 -19.236 8.942 -1.366 1.00 0.00 C ATOM 1544 NZ LYS A 102 -20.011 9.719 -0.359 1.00 0.00 N ATOM 0 H LYS A 102 -16.242 6.690 -3.515 1.00 0.00 H new ATOM 0 HA LYS A 102 -18.946 6.828 -2.857 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.342 8.188 -5.059 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -18.961 8.667 -4.589 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -16.875 8.509 -2.439 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.774 9.835 -3.580 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -18.121 10.709 -1.862 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.287 10.234 -3.081 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -19.904 8.257 -1.888 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -18.488 8.333 -0.858 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -20.463 9.065 0.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -19.370 10.355 0.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.742 10.281 -0.841 1.00 0.00 H new ATOM 1558 N GLU A 103 -18.461 5.922 -6.012 1.00 0.00 N ATOM 1559 CA GLU A 103 -19.075 5.218 -7.131 1.00 0.00 C ATOM 1560 C GLU A 103 -19.308 3.749 -6.789 1.00 0.00 C ATOM 1561 O GLU A 103 -20.257 3.132 -7.270 1.00 0.00 O ATOM 1562 CB GLU A 103 -18.193 5.329 -8.377 1.00 0.00 C ATOM 1563 CG GLU A 103 -18.153 6.726 -8.972 1.00 0.00 C ATOM 1564 CD GLU A 103 -17.804 6.722 -10.448 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -18.700 6.435 -11.269 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -16.635 7.006 -10.781 1.00 0.00 O ATOM 0 H GLU A 103 -17.540 6.311 -6.212 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.040 5.683 -7.334 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -17.178 5.023 -8.122 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -18.556 4.632 -9.132 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -19.123 7.204 -8.833 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.421 7.326 -8.431 1.00 0.00 H new ATOM 1573 N GLY A 104 -18.434 3.197 -5.953 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.561 1.805 -5.561 1.00 0.00 C ATOM 1575 C GLY A 104 -17.579 0.906 -6.286 1.00 0.00 C ATOM 1576 O GLY A 104 -17.967 -0.103 -6.875 1.00 0.00 O ATOM 0 H GLY A 104 -17.641 3.688 -5.540 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.403 1.718 -4.486 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.577 1.465 -5.763 1.00 0.00 H new ATOM 1580 N LYS A 105 -16.302 1.273 -6.245 1.00 0.00 N ATOM 1581 CA LYS A 105 -15.260 0.493 -6.903 1.00 0.00 C ATOM 1582 C LYS A 105 -14.102 0.219 -5.950 1.00 0.00 C ATOM 1583 O LYS A 105 -13.046 -0.262 -6.362 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.751 1.230 -8.144 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.841 1.554 -9.150 1.00 0.00 C ATOM 1586 CD LYS A 105 -15.417 2.668 -10.093 1.00 0.00 C ATOM 1587 CE LYS A 105 -16.551 3.074 -11.022 1.00 0.00 C ATOM 1588 NZ LYS A 105 -16.613 2.209 -12.232 1.00 0.00 N ATOM 0 H LYS A 105 -15.964 2.106 -5.763 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.691 -0.461 -7.206 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -14.268 2.157 -7.833 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.989 0.621 -8.630 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -16.083 0.661 -9.726 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -16.748 1.848 -8.623 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -15.093 3.533 -9.514 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -14.561 2.340 -10.683 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -17.498 3.017 -10.486 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -16.418 4.113 -11.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -17.399 2.518 -12.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.719 2.283 -12.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -16.765 1.221 -11.945 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.306 0.527 -4.674 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.279 0.313 -3.661 1.00 0.00 C ATOM 1604 C LEU A 106 -13.660 -0.837 -2.733 1.00 0.00 C ATOM 1605 O LEU A 106 -12.862 -1.743 -2.489 1.00 0.00 O ATOM 1606 CB LEU A 106 -13.062 1.590 -2.847 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.817 1.617 -1.960 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.369 3.049 -1.713 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -12.085 0.905 -0.642 1.00 0.00 C ATOM 0 H LEU A 106 -15.174 0.926 -4.316 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.351 0.053 -4.170 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -13.010 2.432 -3.537 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.937 1.748 -2.216 1.00 0.00 H new ATOM 0 HG LEU A 106 -11.015 1.091 -2.477 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.482 3.049 -1.080 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.135 3.526 -2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.168 3.600 -1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -11.188 0.934 -0.024 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.902 1.402 -0.119 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -12.357 -0.132 -0.838 1.00 0.00 H new ATOM 1621 N LEU A 107 -14.885 -0.794 -2.221 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.374 -1.834 -1.321 1.00 0.00 C ATOM 1623 C LEU A 107 -15.317 -3.203 -1.989 1.00 0.00 C ATOM 1624 O LEU A 107 -14.900 -4.196 -1.392 1.00 0.00 O ATOM 1625 CB LEU A 107 -16.808 -1.525 -0.886 1.00 0.00 C ATOM 1626 CG LEU A 107 -17.228 -2.076 0.477 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -17.643 -3.534 0.359 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -16.100 -1.921 1.487 1.00 0.00 C ATOM 0 H LEU A 107 -15.557 -0.051 -2.413 1.00 0.00 H new ATOM 0 HA LEU A 107 -14.730 -1.853 -0.442 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -16.938 -0.443 -0.874 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.489 -1.919 -1.641 1.00 0.00 H new ATOM 0 HG LEU A 107 -18.085 -1.503 0.830 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -17.939 -3.909 1.339 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.483 -3.619 -0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -16.805 -4.122 -0.016 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -16.418 -2.319 2.451 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.223 -2.468 1.140 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -15.850 -0.865 1.594 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.744 -3.261 -3.260 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.749 -4.503 -4.038 1.00 0.00 C ATOM 1642 C PRO A 108 -14.425 -5.253 -3.941 1.00 0.00 C ATOM 1643 O PRO A 108 -14.363 -6.459 -4.184 1.00 0.00 O ATOM 1644 CB PRO A 108 -15.988 -4.022 -5.472 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.713 -2.730 -5.322 1.00 0.00 C ATOM 1646 CD PRO A 108 -16.255 -2.117 -4.034 1.00 0.00 C ATOM 0 HA PRO A 108 -16.500 -5.206 -3.679 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -15.048 -3.888 -6.007 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.577 -4.743 -6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.499 -2.068 -6.161 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.791 -2.892 -5.310 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.480 -1.369 -4.201 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -17.074 -1.618 -3.516 1.00 0.00 H new ATOM 1654 N LEU A 109 -13.367 -4.533 -3.584 1.00 0.00 N ATOM 1655 CA LEU A 109 -12.043 -5.130 -3.455 1.00 0.00 C ATOM 1656 C LEU A 109 -11.724 -5.435 -1.995 1.00 0.00 C ATOM 1657 O LEU A 109 -11.210 -6.506 -1.671 1.00 0.00 O ATOM 1658 CB LEU A 109 -10.980 -4.196 -4.036 1.00 0.00 C ATOM 1659 CG LEU A 109 -11.289 -3.602 -5.411 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -10.480 -2.334 -5.638 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -11.010 -4.619 -6.507 1.00 0.00 C ATOM 0 H LEU A 109 -13.401 -3.534 -3.379 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.038 -6.066 -4.013 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.823 -3.376 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -10.040 -4.744 -4.102 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.348 -3.344 -5.445 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.713 -1.925 -6.621 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.730 -1.601 -4.872 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.416 -2.566 -5.584 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -11.236 -4.178 -7.478 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.960 -4.909 -6.475 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.634 -5.499 -6.354 1.00 0.00 H new ATOM 1673 N VAL A 110 -12.034 -4.488 -1.116 1.00 0.00 N ATOM 1674 CA VAL A 110 -11.784 -4.656 0.311 1.00 0.00 C ATOM 1675 C VAL A 110 -12.253 -6.024 0.793 1.00 0.00 C ATOM 1676 O VAL A 110 -11.580 -6.677 1.592 1.00 0.00 O ATOM 1677 CB VAL A 110 -12.488 -3.563 1.137 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -12.468 -3.916 2.616 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -11.837 -2.210 0.894 1.00 0.00 C ATOM 0 H VAL A 110 -12.459 -3.595 -1.367 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.707 -4.572 0.456 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.528 -3.503 0.817 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -12.970 -3.133 3.184 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -12.984 -4.864 2.771 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.436 -4.005 2.955 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.347 -1.449 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.788 -2.253 1.186 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -11.909 -1.956 -0.164 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.412 -6.453 0.303 1.00 0.00 N ATOM 1690 CA HIS A 111 -13.971 -7.745 0.683 1.00 0.00 C ATOM 1691 C HIS A 111 -13.205 -8.885 0.020 1.00 0.00 C ATOM 1692 O HIS A 111 -12.940 -9.913 0.645 1.00 0.00 O ATOM 1693 CB HIS A 111 -15.449 -7.818 0.299 1.00 0.00 C ATOM 1694 CG HIS A 111 -16.334 -6.970 1.160 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -17.665 -6.743 0.879 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -16.072 -6.293 2.303 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -18.183 -5.962 1.810 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -17.237 -5.675 2.687 1.00 0.00 N ATOM 0 H HIS A 111 -13.982 -5.925 -0.358 1.00 0.00 H new ATOM 0 HA HIS A 111 -13.878 -7.849 1.764 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -15.562 -7.508 -0.740 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -15.781 -8.854 0.360 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -15.123 -6.247 2.817 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -19.206 -5.617 1.848 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -17.353 -5.090 3.514 1.00 0.00 H new ATOM 1706 N GLN A 112 -12.852 -8.697 -1.247 1.00 0.00 N ATOM 1707 CA GLN A 112 -12.117 -9.711 -1.994 1.00 0.00 C ATOM 1708 C GLN A 112 -10.922 -10.217 -1.194 1.00 0.00 C ATOM 1709 O GLN A 112 -10.418 -11.314 -1.438 1.00 0.00 O ATOM 1710 CB GLN A 112 -11.646 -9.145 -3.335 1.00 0.00 C ATOM 1711 CG GLN A 112 -12.733 -9.108 -4.396 1.00 0.00 C ATOM 1712 CD GLN A 112 -12.961 -10.459 -5.045 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -12.811 -11.501 -4.406 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -13.326 -10.449 -6.322 1.00 0.00 N ATOM 0 H GLN A 112 -13.063 -7.852 -1.778 1.00 0.00 H new ATOM 0 HA GLN A 112 -12.789 -10.549 -2.177 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -11.267 -8.135 -3.180 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -10.813 -9.746 -3.701 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.664 -8.764 -3.945 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -12.463 -8.382 -5.163 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -13.439 -9.562 -6.813 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -13.494 -11.328 -6.811 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.473 -9.412 -0.237 1.00 0.00 N ATOM 1724 CA CYS A 113 -9.336 -9.778 0.599 1.00 0.00 C ATOM 1725 C CYS A 113 -9.689 -10.944 1.518 1.00 0.00 C ATOM 1726 O CYS A 113 -9.024 -11.980 1.506 1.00 0.00 O ATOM 1727 CB CYS A 113 -8.883 -8.577 1.433 1.00 0.00 C ATOM 1728 SG CYS A 113 -7.563 -8.959 2.629 1.00 0.00 S ATOM 0 H CYS A 113 -10.879 -8.502 -0.021 1.00 0.00 H new ATOM 0 HA CYS A 113 -8.521 -10.088 -0.055 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -8.534 -7.792 0.761 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -9.742 -8.177 1.972 1.00 0.00 H new ATOM 1733 N TYR A 114 -10.740 -10.768 2.311 1.00 0.00 N ATOM 1734 CA TYR A 114 -11.181 -11.804 3.237 1.00 0.00 C ATOM 1735 C TYR A 114 -11.786 -12.985 2.485 1.00 0.00 C ATOM 1736 O TYR A 114 -11.715 -14.128 2.939 1.00 0.00 O ATOM 1737 CB TYR A 114 -12.203 -11.235 4.223 1.00 0.00 C ATOM 1738 CG TYR A 114 -13.599 -11.129 3.653 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -14.344 -12.267 3.370 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -14.174 -9.890 3.399 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -15.620 -12.174 2.849 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -15.450 -9.787 2.880 1.00 0.00 C ATOM 1743 CZ TYR A 114 -16.169 -10.932 2.606 1.00 0.00 C ATOM 1744 OH TYR A 114 -17.440 -10.836 2.088 1.00 0.00 O ATOM 0 H TYR A 114 -11.302 -9.917 2.331 1.00 0.00 H new ATOM 0 HA TYR A 114 -10.310 -12.156 3.790 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -12.229 -11.866 5.111 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -11.875 -10.247 4.544 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -13.918 -13.241 3.561 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -13.613 -8.992 3.611 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -16.185 -13.069 2.633 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -15.882 -8.816 2.690 1.00 0.00 H new ATOM 0 HH TYR A 114 -17.678 -9.892 1.978 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.381 -12.702 1.331 1.00 0.00 N ATOM 1755 CA LEU A 115 -12.998 -13.740 0.513 1.00 0.00 C ATOM 1756 C LEU A 115 -12.145 -15.004 0.502 1.00 0.00 C ATOM 1757 O LEU A 115 -10.968 -14.969 0.145 1.00 0.00 O ATOM 1758 CB LEU A 115 -13.202 -13.236 -0.917 1.00 0.00 C ATOM 1759 CG LEU A 115 -14.555 -12.587 -1.213 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -15.551 -13.628 -1.699 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -15.086 -11.873 0.021 1.00 0.00 C ATOM 0 H LEU A 115 -12.449 -11.762 0.941 1.00 0.00 H new ATOM 0 HA LEU A 115 -13.968 -13.982 0.948 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -12.418 -12.513 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -13.067 -14.075 -1.599 1.00 0.00 H new ATOM 0 HG LEU A 115 -14.417 -11.849 -2.003 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -16.508 -13.148 -1.905 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -15.175 -14.093 -2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -15.685 -14.390 -0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -16.049 -11.417 -0.209 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -15.208 -12.591 0.832 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -14.382 -11.099 0.325 1.00 0.00 H new ATOM 1773 N LYS A 116 -12.748 -16.121 0.895 1.00 0.00 N ATOM 1774 CA LYS A 116 -12.046 -17.399 0.927 1.00 0.00 C ATOM 1775 C LYS A 116 -10.629 -17.228 1.464 1.00 0.00 C ATOM 1776 O LYS A 116 -9.666 -17.714 0.871 1.00 0.00 O ATOM 1777 CB LYS A 116 -12.002 -18.016 -0.473 1.00 0.00 C ATOM 1778 CG LYS A 116 -11.299 -17.144 -1.499 1.00 0.00 C ATOM 1779 CD LYS A 116 -11.039 -17.902 -2.790 1.00 0.00 C ATOM 1780 CE LYS A 116 -9.694 -18.611 -2.760 1.00 0.00 C ATOM 1781 NZ LYS A 116 -8.559 -17.653 -2.869 1.00 0.00 N ATOM 0 H LYS A 116 -13.722 -16.167 1.196 1.00 0.00 H new ATOM 0 HA LYS A 116 -12.590 -18.067 1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -11.497 -18.980 -0.420 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -13.021 -18.208 -0.809 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -11.908 -16.264 -1.709 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -10.354 -16.787 -1.089 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -11.832 -18.632 -2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -11.068 -17.210 -3.631 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.603 -19.178 -1.833 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -9.643 -19.329 -3.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -7.694 -18.168 -3.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -8.774 -16.942 -3.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.415 -17.180 -1.954 1.00 0.00 H new ATOM 1795 N LYS A 117 -10.508 -16.535 2.591 1.00 0.00 N ATOM 1796 CA LYS A 117 -9.209 -16.301 3.211 1.00 0.00 C ATOM 1797 C LYS A 117 -8.287 -17.500 3.010 1.00 0.00 C ATOM 1798 O LYS A 117 -8.715 -18.649 3.118 1.00 0.00 O ATOM 1799 CB LYS A 117 -9.377 -16.018 4.705 1.00 0.00 C ATOM 1800 CG LYS A 117 -9.592 -14.549 5.026 1.00 0.00 C ATOM 1801 CD LYS A 117 -9.060 -14.195 6.404 1.00 0.00 C ATOM 1802 CE LYS A 117 -9.362 -12.749 6.764 1.00 0.00 C ATOM 1803 NZ LYS A 117 -8.528 -12.274 7.903 1.00 0.00 N ATOM 0 H LYS A 117 -11.295 -16.125 3.094 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.757 -15.432 2.732 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.224 -16.591 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -8.492 -16.371 5.235 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -9.095 -13.935 4.275 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.656 -14.317 4.975 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -9.504 -14.856 7.148 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -7.983 -14.361 6.433 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.186 -12.114 5.896 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.417 -12.652 7.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -8.764 -11.284 8.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.715 -12.863 8.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -7.522 -12.343 7.649 1.00 0.00 H new ATOM 1817 N SER A 118 -7.020 -17.224 2.719 1.00 0.00 N ATOM 1818 CA SER A 118 -6.038 -18.280 2.501 1.00 0.00 C ATOM 1819 C SER A 118 -5.332 -18.642 3.804 1.00 0.00 C ATOM 1820 O SER A 118 -4.146 -18.974 3.810 1.00 0.00 O ATOM 1821 CB SER A 118 -5.011 -17.843 1.456 1.00 0.00 C ATOM 1822 OG SER A 118 -4.296 -18.955 0.947 1.00 0.00 O ATOM 0 H SER A 118 -6.649 -16.278 2.629 1.00 0.00 H new ATOM 0 HA SER A 118 -6.564 -19.162 2.136 1.00 0.00 H new ATOM 0 HB2 SER A 118 -5.516 -17.327 0.639 1.00 0.00 H new ATOM 0 HB3 SER A 118 -4.315 -17.132 1.901 1.00 0.00 H new ATOM 0 HG SER A 118 -3.904 -19.460 1.690 1.00 0.00 H new ATOM 1828 N LYS A 119 -6.069 -18.576 4.908 1.00 0.00 N ATOM 1829 CA LYS A 119 -5.517 -18.898 6.218 1.00 0.00 C ATOM 1830 C LYS A 119 -6.629 -19.181 7.223 1.00 0.00 C ATOM 1831 O LYS A 119 -7.788 -18.837 6.993 1.00 0.00 O ATOM 1832 CB LYS A 119 -4.641 -17.748 6.721 1.00 0.00 C ATOM 1833 CG LYS A 119 -3.782 -18.116 7.919 1.00 0.00 C ATOM 1834 CD LYS A 119 -2.913 -16.951 8.361 1.00 0.00 C ATOM 1835 CE LYS A 119 -3.659 -16.029 9.312 1.00 0.00 C ATOM 1836 NZ LYS A 119 -3.616 -16.526 10.715 1.00 0.00 N ATOM 0 H LYS A 119 -7.051 -18.302 4.921 1.00 0.00 H new ATOM 0 HA LYS A 119 -4.906 -19.795 6.117 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.994 -17.414 5.910 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.280 -16.906 6.987 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.422 -18.428 8.745 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.150 -18.967 7.667 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -2.015 -17.330 8.849 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.586 -16.387 7.487 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -3.223 -15.031 9.267 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -4.697 -15.938 8.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -4.047 -15.821 11.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -4.143 -17.420 10.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -2.628 -16.685 10.997 1.00 0.00 H new ATOM 1850 N ARG A 120 -6.267 -19.809 8.337 1.00 0.00 N ATOM 1851 CA ARG A 120 -7.235 -20.138 9.377 1.00 0.00 C ATOM 1852 C ARG A 120 -6.958 -19.342 10.649 1.00 0.00 C ATOM 1853 O ARG A 120 -6.221 -19.790 11.527 1.00 0.00 O ATOM 1854 CB ARG A 120 -7.198 -21.636 9.682 1.00 0.00 C ATOM 1855 CG ARG A 120 -8.530 -22.194 10.157 1.00 0.00 C ATOM 1856 CD ARG A 120 -8.461 -23.699 10.366 1.00 0.00 C ATOM 1857 NE ARG A 120 -9.772 -24.271 10.660 1.00 0.00 N ATOM 1858 CZ ARG A 120 -10.678 -24.549 9.728 1.00 0.00 C ATOM 1859 NH1 ARG A 120 -10.416 -24.309 8.451 1.00 0.00 N ATOM 1860 NH2 ARG A 120 -11.849 -25.069 10.074 1.00 0.00 N ATOM 0 H ARG A 120 -5.311 -20.100 8.543 1.00 0.00 H new ATOM 0 HA ARG A 120 -8.227 -19.873 9.012 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -6.888 -22.173 8.786 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -6.442 -21.824 10.444 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -8.817 -21.709 11.090 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -9.304 -21.962 9.426 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -8.052 -24.171 9.473 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -7.777 -23.920 11.185 1.00 0.00 H new ATOM 0 HE ARG A 120 -10.005 -24.468 11.633 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -9.517 -23.910 8.181 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -11.113 -24.523 7.738 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -12.054 -25.256 11.056 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -12.544 -25.282 9.358 1.00 0.00 H new ATOM 1874 N LYS A 121 -7.553 -18.157 10.741 1.00 0.00 N ATOM 1875 CA LYS A 121 -7.372 -17.298 11.905 1.00 0.00 C ATOM 1876 C LYS A 121 -8.576 -17.385 12.837 1.00 0.00 C ATOM 1877 O LYS A 121 -9.705 -17.588 12.391 1.00 0.00 O ATOM 1878 CB LYS A 121 -7.158 -15.848 11.465 1.00 0.00 C ATOM 1879 CG LYS A 121 -6.653 -14.944 12.576 1.00 0.00 C ATOM 1880 CD LYS A 121 -7.009 -13.489 12.317 1.00 0.00 C ATOM 1881 CE LYS A 121 -6.155 -12.549 13.153 1.00 0.00 C ATOM 1882 NZ LYS A 121 -6.697 -12.384 14.530 1.00 0.00 N ATOM 0 H LYS A 121 -8.165 -17.770 10.023 1.00 0.00 H new ATOM 0 HA LYS A 121 -6.490 -17.641 12.446 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.446 -15.829 10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -8.098 -15.450 11.083 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -7.082 -15.261 13.527 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -5.571 -15.045 12.665 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -6.873 -13.263 11.260 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -8.062 -13.325 12.545 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -5.137 -12.935 13.207 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -6.102 -11.576 12.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -6.087 -11.736 15.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -7.659 -11.992 14.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.724 -13.309 15.005 1.00 0.00 H new ATOM 1896 N GLU A 122 -8.327 -17.227 14.134 1.00 0.00 N ATOM 1897 CA GLU A 122 -9.392 -17.287 15.128 1.00 0.00 C ATOM 1898 C GLU A 122 -10.190 -15.986 15.151 1.00 0.00 C ATOM 1899 O GLU A 122 -9.682 -14.927 14.780 1.00 0.00 O ATOM 1900 CB GLU A 122 -8.810 -17.565 16.515 1.00 0.00 C ATOM 1901 CG GLU A 122 -9.757 -18.320 17.433 1.00 0.00 C ATOM 1902 CD GLU A 122 -9.033 -19.039 18.555 1.00 0.00 C ATOM 1903 OE1 GLU A 122 -8.359 -20.052 18.273 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -9.141 -18.589 19.715 1.00 0.00 O ATOM 0 H GLU A 122 -7.398 -17.057 14.520 1.00 0.00 H new ATOM 0 HA GLU A 122 -10.064 -18.100 14.854 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -7.890 -18.139 16.405 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -8.541 -16.618 16.983 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.477 -17.622 17.859 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.323 -19.045 16.848 1.00 0.00 H new ATOM 1911 N PHE A 123 -11.441 -16.074 15.588 1.00 0.00 N ATOM 1912 CA PHE A 123 -12.310 -14.905 15.658 1.00 0.00 C ATOM 1913 C PHE A 123 -12.395 -14.375 17.086 1.00 0.00 C ATOM 1914 O PHE A 123 -13.175 -14.872 17.898 1.00 0.00 O ATOM 1915 CB PHE A 123 -13.710 -15.253 15.147 1.00 0.00 C ATOM 1916 CG PHE A 123 -14.674 -14.102 15.209 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -14.653 -13.111 14.242 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -15.601 -14.013 16.235 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -15.538 -12.051 14.296 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -16.489 -12.956 16.294 1.00 0.00 C ATOM 1921 CZ PHE A 123 -16.457 -11.973 15.324 1.00 0.00 C ATOM 0 H PHE A 123 -11.876 -16.942 15.899 1.00 0.00 H new ATOM 0 HA PHE A 123 -11.882 -14.127 15.025 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -13.636 -15.600 14.116 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -14.107 -16.081 15.734 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -13.936 -13.167 13.436 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -15.630 -14.778 16.997 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -15.511 -11.285 13.535 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -17.208 -12.898 17.098 1.00 0.00 H new ATOM 0 HZ PHE A 123 -17.149 -11.145 15.369 1.00 0.00 H new ATOM 1931 N GLN A 124 -11.586 -13.364 17.385 1.00 0.00 N ATOM 1932 CA GLN A 124 -11.569 -12.767 18.715 1.00 0.00 C ATOM 1933 C GLN A 124 -12.960 -12.288 19.115 1.00 0.00 C ATOM 1934 O GLN A 124 -13.710 -11.768 18.289 1.00 0.00 O ATOM 1935 CB GLN A 124 -10.582 -11.599 18.760 1.00 0.00 C ATOM 1936 CG GLN A 124 -10.898 -10.496 17.763 1.00 0.00 C ATOM 1937 CD GLN A 124 -9.707 -9.599 17.489 1.00 0.00 C ATOM 1938 OE1 GLN A 124 -9.029 -9.148 18.412 1.00 0.00 O ATOM 1939 NE2 GLN A 124 -9.446 -9.334 16.214 1.00 0.00 N ATOM 0 H GLN A 124 -10.934 -12.941 16.724 1.00 0.00 H new ATOM 0 HA GLN A 124 -11.250 -13.531 19.424 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -10.576 -11.178 19.765 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -9.578 -11.975 18.566 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -11.235 -10.943 16.827 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -11.723 -9.893 18.143 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -10.034 -9.729 15.480 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -8.657 -8.735 15.969 1.00 0.00 H new ATOM 1948 N SER A 125 -13.299 -12.467 20.388 1.00 0.00 N ATOM 1949 CA SER A 125 -14.603 -12.057 20.897 1.00 0.00 C ATOM 1950 C SER A 125 -14.454 -11.243 22.179 1.00 0.00 C ATOM 1951 O SER A 125 -14.322 -11.799 23.268 1.00 0.00 O ATOM 1952 CB SER A 125 -15.481 -13.282 21.156 1.00 0.00 C ATOM 1953 OG SER A 125 -14.896 -14.133 22.126 1.00 0.00 O ATOM 0 H SER A 125 -12.689 -12.893 21.086 1.00 0.00 H new ATOM 0 HA SER A 125 -15.080 -11.431 20.143 1.00 0.00 H new ATOM 0 HB2 SER A 125 -16.466 -12.962 21.495 1.00 0.00 H new ATOM 0 HB3 SER A 125 -15.627 -13.832 20.226 1.00 0.00 H new ATOM 0 HG SER A 125 -14.503 -13.591 22.842 1.00 0.00 H new ATOM 1959 N GLY A 126 -14.477 -9.921 22.039 1.00 0.00 N ATOM 1960 CA GLY A 126 -14.344 -9.051 23.193 1.00 0.00 C ATOM 1961 C GLY A 126 -15.530 -8.123 23.360 1.00 0.00 C ATOM 1962 O GLY A 126 -16.391 -8.328 24.216 1.00 0.00 O ATOM 0 H GLY A 126 -14.585 -9.437 21.148 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -14.233 -9.659 24.091 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -13.434 -8.459 23.094 1.00 0.00 H new ATOM 1966 N PRO A 127 -15.586 -7.073 22.527 1.00 0.00 N ATOM 1967 CA PRO A 127 -16.671 -6.088 22.567 1.00 0.00 C ATOM 1968 C PRO A 127 -17.997 -6.666 22.085 1.00 0.00 C ATOM 1969 O PRO A 127 -18.288 -6.663 20.889 1.00 0.00 O ATOM 1970 CB PRO A 127 -16.189 -4.990 21.616 1.00 0.00 C ATOM 1971 CG PRO A 127 -15.259 -5.681 20.680 1.00 0.00 C ATOM 1972 CD PRO A 127 -14.595 -6.766 21.482 1.00 0.00 C ATOM 0 HA PRO A 127 -16.866 -5.738 23.581 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -17.023 -4.535 21.081 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -15.684 -4.191 22.158 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -15.799 -6.099 19.831 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -14.522 -4.986 20.278 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -14.373 -7.640 20.869 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -13.651 -6.429 21.910 1.00 0.00 H new ATOM 1980 N SER A 128 -18.798 -7.160 23.023 1.00 0.00 N ATOM 1981 CA SER A 128 -20.093 -7.745 22.692 1.00 0.00 C ATOM 1982 C SER A 128 -21.180 -6.675 22.660 1.00 0.00 C ATOM 1983 O SER A 128 -20.965 -5.543 23.094 1.00 0.00 O ATOM 1984 CB SER A 128 -20.460 -8.830 23.706 1.00 0.00 C ATOM 1985 OG SER A 128 -19.821 -10.056 23.395 1.00 0.00 O ATOM 0 H SER A 128 -18.574 -7.167 24.018 1.00 0.00 H new ATOM 0 HA SER A 128 -20.019 -8.193 21.701 1.00 0.00 H new ATOM 0 HB2 SER A 128 -20.171 -8.509 24.707 1.00 0.00 H new ATOM 0 HB3 SER A 128 -21.541 -8.972 23.716 1.00 0.00 H new ATOM 0 HG SER A 128 -20.070 -10.732 24.059 1.00 0.00 H new ATOM 1991 N SER A 129 -22.347 -7.042 22.141 1.00 0.00 N ATOM 1992 CA SER A 129 -23.468 -6.113 22.047 1.00 0.00 C ATOM 1993 C SER A 129 -23.766 -5.483 23.404 1.00 0.00 C ATOM 1994 O SER A 129 -23.747 -4.262 23.552 1.00 0.00 O ATOM 1995 CB SER A 129 -24.711 -6.833 21.522 1.00 0.00 C ATOM 1996 OG SER A 129 -25.032 -7.952 22.330 1.00 0.00 O ATOM 0 H SER A 129 -22.541 -7.976 21.779 1.00 0.00 H new ATOM 0 HA SER A 129 -23.195 -5.321 21.350 1.00 0.00 H new ATOM 0 HB2 SER A 129 -25.554 -6.142 21.501 1.00 0.00 H new ATOM 0 HB3 SER A 129 -24.540 -7.159 20.496 1.00 0.00 H new ATOM 0 HG SER A 129 -25.831 -8.394 21.974 1.00 0.00 H new ATOM 2002 N GLY A 130 -24.042 -6.327 24.394 1.00 0.00 N ATOM 2003 CA GLY A 130 -24.341 -5.836 25.726 1.00 0.00 C ATOM 2004 C GLY A 130 -25.354 -6.701 26.450 1.00 0.00 C ATOM 2005 O GLY A 130 -25.565 -7.857 26.085 1.00 0.00 O ATOM 0 H GLY A 130 -24.064 -7.342 24.297 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -23.421 -5.794 26.309 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -24.722 -4.817 25.657 1.00 0.00 H new TER 2009 GLY A 130