USER MOD reduce.3.24.130724 H: found=0, std=0, add=1067, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1064 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 130 LYS NZ :NH3+ -164:sc= 1.23 (180deg=0) USER MOD Set 1.2: A 131 ASN : amide:sc= 1.04 K(o=2.3,f=-4.2) USER MOD Set 2.1: A 32 SER OG : rot 147:sc= 0.713 USER MOD Set 2.2: A 126 ASN : amide:sc= 0.627 K(o=1.3,f=-0.67) USER MOD Set 3.1: A 75 MET CE :methyl -147:sc= -0.658 (180deg=-2.75) USER MOD Set 3.2: A 95 MET CE :methyl -169:sc= -0.103 (180deg=-0.267) USER MOD Set 4.1: A 40 TYR OH : rot 120:sc= 0.147 USER MOD Set 4.2: A 42 GLN : amide:sc= 0.0457 X(o=0.19,f=-0.092) USER MOD Single : A 0 GLY N :NH3+ -102:sc= 0.046 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 30:sc= -0.229 USER MOD Single : A 6 THR OG1 : rot 82:sc= 0.995 USER MOD Single : A 10 THR OG1 : rot -56:sc= 1.59 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot -65:sc= 0.0268 USER MOD Single : A 29 THR OG1 : rot -170:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 ASN : amide:sc= 0.742 K(o=0.74,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.17) USER MOD Single : A 48 HIS : no HE2:sc= -0.0166 X(o=-0.017,f=-0.11) USER MOD Single : A 53 GLN : amide:sc= 0.243 K(o=0.24,f=-6.3!) USER MOD Single : A 58 TYR OH : rot 30:sc= -0.136 USER MOD Single : A 59 CYS SG : rot 180:sc=-0.00455 USER MOD Single : A 64 SER OG : rot 180:sc=0.000933 USER MOD Single : A 69 THR OG1 : rot -20:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -155:sc= 0 (180deg=-0.317) USER MOD Single : A 72 HIS : no HE2:sc= 0.011 K(o=0.011,f=-4.2!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot -78:sc= 0.648 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.436 X(o=-0.44,f=-0.037) USER MOD Single : A 102 ASN : amide:sc= 0.953 K(o=0.95,f=0) USER MOD Single : A 104 LYS NZ :NH3+ -109:sc= 0.0385 (180deg=0) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.815 X(o=-0.82,f=-1.1) USER MOD Single : A 115 ASN : amide:sc= -0.441 X(o=-0.44,f=0) USER MOD Single : A 117 TYR OH : rot 166:sc= 1.25 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 8 N GLY A 0 0.676 1.627 -2.828 1.00 0.00 N ATOM 9 CA GLY A 0 -0.009 2.597 -3.683 1.00 0.00 C ATOM 10 C GLY A 0 -0.268 3.913 -2.952 1.00 0.00 C ATOM 11 O GLY A 0 -0.233 3.969 -1.721 1.00 0.00 O ATOM 0 H1 GLY A 0 1.685 1.595 -3.078 1.00 0.00 H new ATOM 0 H2 GLY A 0 0.575 1.910 -1.832 1.00 0.00 H new ATOM 0 H3 GLY A 0 0.256 0.686 -2.965 1.00 0.00 H new ATOM 0 HA2 GLY A 0 0.593 2.787 -4.572 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -0.956 2.177 -4.023 1.00 0.00 H new ATOM 15 N ALA A 1 -0.506 4.980 -3.714 1.00 0.00 N ATOM 16 CA ALA A 1 -0.553 6.352 -3.205 1.00 0.00 C ATOM 17 C ALA A 1 -1.406 7.276 -4.102 1.00 0.00 C ATOM 18 O ALA A 1 -1.811 6.889 -5.203 1.00 0.00 O ATOM 19 CB ALA A 1 0.895 6.819 -3.077 1.00 0.00 C ATOM 0 H ALA A 1 -0.674 4.915 -4.718 1.00 0.00 H new ATOM 0 HA ALA A 1 -1.046 6.390 -2.233 1.00 0.00 H new ATOM 0 HB1 ALA A 1 0.916 7.841 -2.699 1.00 0.00 H new ATOM 0 HB2 ALA A 1 1.428 6.166 -2.386 1.00 0.00 H new ATOM 0 HB3 ALA A 1 1.377 6.783 -4.054 1.00 0.00 H new ATOM 25 N LEU A 2 -1.671 8.496 -3.627 1.00 0.00 N ATOM 26 CA LEU A 2 -2.533 9.486 -4.280 1.00 0.00 C ATOM 27 C LEU A 2 -1.691 10.676 -4.770 1.00 0.00 C ATOM 28 O LEU A 2 -0.717 11.057 -4.116 1.00 0.00 O ATOM 29 CB LEU A 2 -3.606 9.987 -3.292 1.00 0.00 C ATOM 30 CG LEU A 2 -4.603 9.007 -2.645 1.00 0.00 C ATOM 31 CD1 LEU A 2 -5.175 7.989 -3.627 1.00 0.00 C ATOM 32 CD2 LEU A 2 -4.022 8.318 -1.418 1.00 0.00 C ATOM 0 H LEU A 2 -1.279 8.833 -2.748 1.00 0.00 H new ATOM 0 HA LEU A 2 -3.022 9.015 -5.133 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -3.083 10.493 -2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.193 10.743 -3.813 1.00 0.00 H new ATOM 0 HG LEU A 2 -5.438 9.625 -2.316 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -5.869 7.330 -3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -5.701 8.511 -4.427 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -4.364 7.398 -4.052 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -4.763 7.638 -0.998 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -3.133 7.755 -1.703 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -3.754 9.067 -0.673 1.00 0.00 H new ATOM 44 N SER A 3 -2.042 11.269 -5.917 1.00 0.00 N ATOM 45 CA SER A 3 -1.289 12.405 -6.486 1.00 0.00 C ATOM 46 C SER A 3 -1.422 13.667 -5.625 1.00 0.00 C ATOM 47 O SER A 3 -2.387 13.793 -4.868 1.00 0.00 O ATOM 48 CB SER A 3 -1.751 12.679 -7.920 1.00 0.00 C ATOM 49 OG SER A 3 -0.877 13.595 -8.555 1.00 0.00 O ATOM 0 H SER A 3 -2.846 10.983 -6.476 1.00 0.00 H new ATOM 0 HA SER A 3 -0.234 12.132 -6.498 1.00 0.00 H new ATOM 0 HB2 SER A 3 -1.782 11.746 -8.483 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.765 13.080 -7.912 1.00 0.00 H new ATOM 0 HG SER A 3 -1.184 13.759 -9.471 1.00 0.00 H new ATOM 55 N TYR A 4 -0.498 14.624 -5.770 1.00 0.00 N ATOM 56 CA TYR A 4 -0.485 15.889 -5.017 1.00 0.00 C ATOM 57 C TYR A 4 -1.851 16.594 -5.015 1.00 0.00 C ATOM 58 O TYR A 4 -2.322 17.047 -3.972 1.00 0.00 O ATOM 59 CB TYR A 4 0.578 16.827 -5.613 1.00 0.00 C ATOM 60 CG TYR A 4 0.667 18.177 -4.920 1.00 0.00 C ATOM 61 CD1 TYR A 4 -0.164 19.237 -5.336 1.00 0.00 C ATOM 62 CD2 TYR A 4 1.552 18.364 -3.839 1.00 0.00 C ATOM 63 CE1 TYR A 4 -0.133 20.471 -4.660 1.00 0.00 C ATOM 64 CE2 TYR A 4 1.586 19.596 -3.156 1.00 0.00 C ATOM 65 CZ TYR A 4 0.740 20.652 -3.565 1.00 0.00 C ATOM 66 OH TYR A 4 0.771 21.843 -2.911 1.00 0.00 O ATOM 0 H TYR A 4 0.278 14.542 -6.427 1.00 0.00 H new ATOM 0 HA TYR A 4 -0.247 15.647 -3.981 1.00 0.00 H new ATOM 0 HB2 TYR A 4 1.551 16.338 -5.560 1.00 0.00 H new ATOM 0 HB3 TYR A 4 0.358 16.985 -6.669 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -0.827 19.102 -6.177 1.00 0.00 H new ATOM 0 HD2 TYR A 4 2.206 17.561 -3.533 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -0.776 21.278 -4.978 1.00 0.00 H new ATOM 0 HE2 TYR A 4 2.257 19.733 -2.321 1.00 0.00 H new ATOM 0 HH TYR A 4 -0.111 22.267 -2.961 1.00 0.00 H new ATOM 76 N GLU A 5 -2.500 16.640 -6.183 1.00 0.00 N ATOM 77 CA GLU A 5 -3.809 17.280 -6.395 1.00 0.00 C ATOM 78 C GLU A 5 -4.969 16.660 -5.590 1.00 0.00 C ATOM 79 O GLU A 5 -6.041 17.260 -5.499 1.00 0.00 O ATOM 80 CB GLU A 5 -4.125 17.304 -7.904 1.00 0.00 C ATOM 81 CG GLU A 5 -4.501 15.947 -8.529 1.00 0.00 C ATOM 82 CD GLU A 5 -6.009 15.617 -8.431 1.00 0.00 C ATOM 83 OE1 GLU A 5 -6.842 16.424 -8.910 1.00 0.00 O ATOM 84 OE2 GLU A 5 -6.362 14.524 -7.926 1.00 0.00 O ATOM 0 H GLU A 5 -2.121 16.222 -7.033 1.00 0.00 H new ATOM 0 HA GLU A 5 -3.725 18.296 -6.008 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -4.945 18.001 -8.074 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -3.257 17.699 -8.432 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -4.205 15.945 -9.578 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -3.932 15.159 -8.035 1.00 0.00 H new ATOM 91 N THR A 6 -4.768 15.473 -5.010 1.00 0.00 N ATOM 92 CA THR A 6 -5.779 14.745 -4.230 1.00 0.00 C ATOM 93 C THR A 6 -6.036 15.455 -2.904 1.00 0.00 C ATOM 94 O THR A 6 -5.164 15.477 -2.033 1.00 0.00 O ATOM 95 CB THR A 6 -5.344 13.306 -3.927 1.00 0.00 C ATOM 96 OG1 THR A 6 -4.866 12.691 -5.100 1.00 0.00 O ATOM 97 CG2 THR A 6 -6.499 12.468 -3.371 1.00 0.00 C ATOM 0 H THR A 6 -3.878 14.978 -5.070 1.00 0.00 H new ATOM 0 HA THR A 6 -6.685 14.720 -4.835 1.00 0.00 H new ATOM 0 HB THR A 6 -4.557 13.357 -3.175 1.00 0.00 H new ATOM 0 HG1 THR A 6 -3.932 12.949 -5.247 1.00 0.00 H new ATOM 0 HG21 THR A 6 -6.150 11.455 -3.169 1.00 0.00 H new ATOM 0 HG22 THR A 6 -6.862 12.917 -2.447 1.00 0.00 H new ATOM 0 HG23 THR A 6 -7.308 12.434 -4.101 1.00 0.00 H new ATOM 105 N GLU A 7 -7.229 16.022 -2.722 1.00 0.00 N ATOM 106 CA GLU A 7 -7.560 16.736 -1.486 1.00 0.00 C ATOM 107 C GLU A 7 -8.212 15.806 -0.456 1.00 0.00 C ATOM 108 O GLU A 7 -9.114 15.023 -0.776 1.00 0.00 O ATOM 109 CB GLU A 7 -8.457 17.949 -1.750 1.00 0.00 C ATOM 110 CG GLU A 7 -7.952 18.847 -2.890 1.00 0.00 C ATOM 111 CD GLU A 7 -8.724 20.178 -2.997 1.00 0.00 C ATOM 112 OE1 GLU A 7 -9.968 20.196 -2.825 1.00 0.00 O ATOM 113 OE2 GLU A 7 -8.091 21.219 -3.295 1.00 0.00 O ATOM 0 H GLU A 7 -7.981 16.002 -3.411 1.00 0.00 H new ATOM 0 HA GLU A 7 -6.618 17.098 -1.073 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -9.462 17.602 -1.989 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.532 18.541 -0.838 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.894 19.059 -2.737 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -8.036 18.308 -3.834 1.00 0.00 H new ATOM 120 N ILE A 8 -7.771 15.929 0.795 1.00 0.00 N ATOM 121 CA ILE A 8 -8.224 15.155 1.949 1.00 0.00 C ATOM 122 C ILE A 8 -8.947 16.115 2.891 1.00 0.00 C ATOM 123 O ILE A 8 -8.389 17.142 3.284 1.00 0.00 O ATOM 124 CB ILE A 8 -7.023 14.478 2.655 1.00 0.00 C ATOM 125 CG1 ILE A 8 -6.080 13.723 1.697 1.00 0.00 C ATOM 126 CG2 ILE A 8 -7.506 13.536 3.773 1.00 0.00 C ATOM 127 CD1 ILE A 8 -6.746 12.663 0.814 1.00 0.00 C ATOM 0 H ILE A 8 -7.050 16.607 1.043 1.00 0.00 H new ATOM 0 HA ILE A 8 -8.900 14.359 1.636 1.00 0.00 H new ATOM 0 HB ILE A 8 -6.438 15.291 3.085 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.587 14.451 1.052 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -5.301 13.241 2.287 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.645 13.072 4.255 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.071 14.106 4.510 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.144 12.762 3.346 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -5.994 12.193 0.180 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.214 11.906 1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.505 13.134 0.189 1.00 0.00 H new ATOM 139 N LEU A 9 -10.203 15.811 3.220 1.00 0.00 N ATOM 140 CA LEU A 9 -10.955 16.514 4.258 1.00 0.00 C ATOM 141 C LEU A 9 -10.276 16.340 5.633 1.00 0.00 C ATOM 142 O LEU A 9 -9.995 15.219 6.064 1.00 0.00 O ATOM 143 CB LEU A 9 -12.397 15.978 4.266 1.00 0.00 C ATOM 144 CG LEU A 9 -13.347 16.758 5.195 1.00 0.00 C ATOM 145 CD1 LEU A 9 -13.715 18.134 4.636 1.00 0.00 C ATOM 146 CD2 LEU A 9 -14.641 15.970 5.400 1.00 0.00 C ATOM 0 H LEU A 9 -10.731 15.064 2.769 1.00 0.00 H new ATOM 0 HA LEU A 9 -10.974 17.583 4.047 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.791 16.009 3.250 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -12.384 14.932 4.571 1.00 0.00 H new ATOM 0 HG LEU A 9 -12.816 16.896 6.137 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -14.386 18.641 5.330 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -12.810 18.728 4.507 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -14.211 18.015 3.673 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -15.307 16.529 6.058 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -15.129 15.814 4.438 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -14.412 15.005 5.851 1.00 0.00 H new ATOM 158 N THR A 10 -10.058 17.452 6.340 1.00 0.00 N ATOM 159 CA THR A 10 -9.398 17.499 7.657 1.00 0.00 C ATOM 160 C THR A 10 -10.195 18.354 8.648 1.00 0.00 C ATOM 161 O THR A 10 -10.816 19.342 8.259 1.00 0.00 O ATOM 162 CB THR A 10 -7.951 18.031 7.551 1.00 0.00 C ATOM 163 OG1 THR A 10 -7.930 19.342 7.031 1.00 0.00 O ATOM 164 CG2 THR A 10 -7.019 17.186 6.681 1.00 0.00 C ATOM 0 H THR A 10 -10.342 18.373 6.007 1.00 0.00 H new ATOM 0 HA THR A 10 -9.361 16.475 8.028 1.00 0.00 H new ATOM 0 HB THR A 10 -7.583 17.992 8.576 1.00 0.00 H new ATOM 0 HG1 THR A 10 -8.384 19.357 6.163 1.00 0.00 H new ATOM 0 HG21 THR A 10 -6.027 17.637 6.666 1.00 0.00 H new ATOM 0 HG22 THR A 10 -6.954 16.178 7.091 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.412 17.140 5.665 1.00 0.00 H new ATOM 172 N VAL A 11 -10.196 17.989 9.939 1.00 0.00 N ATOM 173 CA VAL A 11 -10.901 18.777 10.982 1.00 0.00 C ATOM 174 C VAL A 11 -10.136 20.059 11.338 1.00 0.00 C ATOM 175 O VAL A 11 -10.743 21.090 11.625 1.00 0.00 O ATOM 176 CB VAL A 11 -11.179 17.959 12.264 1.00 0.00 C ATOM 177 CG1 VAL A 11 -12.128 18.687 13.226 1.00 0.00 C ATOM 178 CG2 VAL A 11 -11.815 16.593 11.979 1.00 0.00 C ATOM 0 H VAL A 11 -9.721 17.158 10.293 1.00 0.00 H new ATOM 0 HA VAL A 11 -11.863 19.049 10.547 1.00 0.00 H new ATOM 0 HB VAL A 11 -10.194 17.829 12.712 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.292 18.072 14.111 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.686 19.638 13.522 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.081 18.869 12.729 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.985 16.068 12.919 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.766 16.734 11.465 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -11.147 16.005 11.350 1.00 0.00 H new ATOM 188 N GLU A 12 -8.800 20.019 11.274 1.00 0.00 N ATOM 189 CA GLU A 12 -7.929 21.175 11.550 1.00 0.00 C ATOM 190 C GLU A 12 -8.142 22.359 10.590 1.00 0.00 C ATOM 191 O GLU A 12 -8.005 23.512 11.013 1.00 0.00 O ATOM 192 CB GLU A 12 -6.453 20.738 11.493 1.00 0.00 C ATOM 193 CG GLU A 12 -5.895 20.292 12.850 1.00 0.00 C ATOM 194 CD GLU A 12 -5.853 21.445 13.873 1.00 0.00 C ATOM 195 OE1 GLU A 12 -5.016 22.370 13.726 1.00 0.00 O ATOM 196 OE2 GLU A 12 -6.650 21.434 14.842 1.00 0.00 O ATOM 0 H GLU A 12 -8.284 19.175 11.026 1.00 0.00 H new ATOM 0 HA GLU A 12 -8.198 21.526 12.546 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -6.352 19.919 10.781 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.852 21.565 11.116 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -6.508 19.482 13.244 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.890 19.893 12.714 1.00 0.00 H new ATOM 203 N TYR A 13 -8.494 22.093 9.324 1.00 0.00 N ATOM 204 CA TYR A 13 -8.613 23.123 8.280 1.00 0.00 C ATOM 205 C TYR A 13 -9.772 22.888 7.301 1.00 0.00 C ATOM 206 O TYR A 13 -10.584 23.794 7.086 1.00 0.00 O ATOM 207 CB TYR A 13 -7.298 23.187 7.483 1.00 0.00 C ATOM 208 CG TYR A 13 -6.094 23.716 8.246 1.00 0.00 C ATOM 209 CD1 TYR A 13 -6.098 25.045 8.715 1.00 0.00 C ATOM 210 CD2 TYR A 13 -4.966 22.898 8.462 1.00 0.00 C ATOM 211 CE1 TYR A 13 -4.985 25.554 9.411 1.00 0.00 C ATOM 212 CE2 TYR A 13 -3.847 23.405 9.154 1.00 0.00 C ATOM 213 CZ TYR A 13 -3.857 24.735 9.633 1.00 0.00 C ATOM 214 OH TYR A 13 -2.781 25.237 10.297 1.00 0.00 O ATOM 0 H TYR A 13 -8.706 21.152 8.993 1.00 0.00 H new ATOM 0 HA TYR A 13 -8.821 24.061 8.795 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -7.065 22.186 7.120 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -7.455 23.815 6.606 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -6.958 25.675 8.540 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -4.959 21.882 8.097 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -4.994 26.571 9.775 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.983 22.778 9.318 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.089 24.547 10.368 1.00 0.00 H new ATOM 224 N GLY A 14 -9.845 21.704 6.687 1.00 0.00 N ATOM 225 CA GLY A 14 -10.786 21.393 5.608 1.00 0.00 C ATOM 226 C GLY A 14 -10.122 20.621 4.467 1.00 0.00 C ATOM 227 O GLY A 14 -9.268 19.766 4.691 1.00 0.00 O ATOM 0 H GLY A 14 -9.240 20.920 6.931 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -11.614 20.807 6.008 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.210 22.319 5.220 1.00 0.00 H new ATOM 231 N LEU A 15 -10.555 20.909 3.241 1.00 0.00 N ATOM 232 CA LEU A 15 -10.100 20.289 1.993 1.00 0.00 C ATOM 233 C LEU A 15 -8.675 20.770 1.621 1.00 0.00 C ATOM 234 O LEU A 15 -8.502 21.902 1.161 1.00 0.00 O ATOM 235 CB LEU A 15 -11.103 20.686 0.885 1.00 0.00 C ATOM 236 CG LEU A 15 -12.586 20.387 1.175 1.00 0.00 C ATOM 237 CD1 LEU A 15 -13.452 20.994 0.075 1.00 0.00 C ATOM 238 CD2 LEU A 15 -12.856 18.890 1.222 1.00 0.00 C ATOM 0 H LEU A 15 -11.270 21.618 3.081 1.00 0.00 H new ATOM 0 HA LEU A 15 -10.057 19.206 2.108 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -10.999 21.754 0.695 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.822 20.170 -0.033 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.827 20.820 2.146 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.501 20.783 0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.298 22.073 0.045 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -13.176 20.561 -0.886 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.912 18.717 1.429 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.596 18.443 0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -12.253 18.436 2.009 1.00 0.00 H new ATOM 250 N LEU A 16 -7.652 19.926 1.810 1.00 0.00 N ATOM 251 CA LEU A 16 -6.241 20.248 1.515 1.00 0.00 C ATOM 252 C LEU A 16 -5.493 19.129 0.758 1.00 0.00 C ATOM 253 O LEU A 16 -5.769 17.951 0.994 1.00 0.00 O ATOM 254 CB LEU A 16 -5.515 20.540 2.841 1.00 0.00 C ATOM 255 CG LEU A 16 -5.760 21.954 3.392 1.00 0.00 C ATOM 256 CD1 LEU A 16 -5.253 22.013 4.828 1.00 0.00 C ATOM 257 CD2 LEU A 16 -5.021 23.022 2.582 1.00 0.00 C ATOM 0 H LEU A 16 -7.779 18.983 2.178 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.242 21.117 0.857 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.834 19.811 3.586 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -4.444 20.399 2.695 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.830 22.155 3.332 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.420 23.011 5.232 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.789 21.282 5.433 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.187 21.788 4.847 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.223 24.005 3.007 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -3.949 22.826 2.614 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.364 22.996 1.548 1.00 0.00 H new ATOM 269 N PRO A 17 -4.524 19.464 -0.124 1.00 0.00 N ATOM 270 CA PRO A 17 -3.769 18.493 -0.923 1.00 0.00 C ATOM 271 C PRO A 17 -2.889 17.579 -0.058 1.00 0.00 C ATOM 272 O PRO A 17 -2.068 18.051 0.734 1.00 0.00 O ATOM 273 CB PRO A 17 -2.936 19.324 -1.909 1.00 0.00 C ATOM 274 CG PRO A 17 -2.791 20.682 -1.232 1.00 0.00 C ATOM 275 CD PRO A 17 -4.084 20.819 -0.436 1.00 0.00 C ATOM 0 HA PRO A 17 -4.442 17.812 -1.444 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.964 18.866 -2.093 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -3.434 19.412 -2.874 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -1.915 20.717 -0.585 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -2.681 21.485 -1.961 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -3.919 21.393 0.476 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -4.841 21.349 -1.014 1.00 0.00 H new ATOM 283 N ILE A 18 -3.019 16.259 -0.248 1.00 0.00 N ATOM 284 CA ILE A 18 -2.237 15.243 0.476 1.00 0.00 C ATOM 285 C ILE A 18 -0.726 15.448 0.341 1.00 0.00 C ATOM 286 O ILE A 18 0.005 15.283 1.317 1.00 0.00 O ATOM 287 CB ILE A 18 -2.638 13.814 0.050 1.00 0.00 C ATOM 288 CG1 ILE A 18 -2.000 12.783 1.009 1.00 0.00 C ATOM 289 CG2 ILE A 18 -2.296 13.503 -1.419 1.00 0.00 C ATOM 290 CD1 ILE A 18 -2.602 11.380 0.895 1.00 0.00 C ATOM 0 H ILE A 18 -3.678 15.860 -0.917 1.00 0.00 H new ATOM 0 HA ILE A 18 -2.479 15.368 1.531 1.00 0.00 H new ATOM 0 HB ILE A 18 -3.724 13.745 0.120 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -0.930 12.727 0.808 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -2.114 13.135 2.034 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.603 12.484 -1.656 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -2.822 14.201 -2.071 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -1.221 13.603 -1.571 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.104 10.712 1.598 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -3.667 11.421 1.125 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -2.465 11.006 -0.120 1.00 0.00 H new ATOM 302 N GLY A 19 -0.250 15.866 -0.835 1.00 0.00 N ATOM 303 CA GLY A 19 1.182 16.012 -1.071 1.00 0.00 C ATOM 304 C GLY A 19 1.810 17.088 -0.189 1.00 0.00 C ATOM 305 O GLY A 19 2.908 16.891 0.318 1.00 0.00 O ATOM 0 H GLY A 19 -0.836 16.108 -1.634 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.677 15.059 -0.885 1.00 0.00 H new ATOM 0 HA3 GLY A 19 1.351 16.260 -2.119 1.00 0.00 H new ATOM 309 N LYS A 20 1.088 18.179 0.100 1.00 0.00 N ATOM 310 CA LYS A 20 1.552 19.234 1.012 1.00 0.00 C ATOM 311 C LYS A 20 1.556 18.767 2.471 1.00 0.00 C ATOM 312 O LYS A 20 2.450 19.136 3.228 1.00 0.00 O ATOM 313 CB LYS A 20 0.682 20.480 0.787 1.00 0.00 C ATOM 314 CG LYS A 20 1.131 21.698 1.610 1.00 0.00 C ATOM 315 CD LYS A 20 0.620 23.018 1.007 1.00 0.00 C ATOM 316 CE LYS A 20 1.453 23.468 -0.205 1.00 0.00 C ATOM 317 NZ LYS A 20 2.709 24.160 0.201 1.00 0.00 N ATOM 0 H LYS A 20 0.163 18.356 -0.293 1.00 0.00 H new ATOM 0 HA LYS A 20 2.590 19.484 0.793 1.00 0.00 H new ATOM 0 HB2 LYS A 20 0.700 20.740 -0.271 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.351 20.242 1.039 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.765 21.600 2.632 1.00 0.00 H new ATOM 0 HG3 LYS A 20 2.220 21.720 1.662 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.421 22.898 0.705 1.00 0.00 H new ATOM 0 HD3 LYS A 20 0.643 23.796 1.770 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.700 22.600 -0.817 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.856 24.136 -0.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.238 24.445 -0.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.475 25.003 0.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.292 23.515 0.772 1.00 0.00 H new ATOM 331 N ILE A 21 0.610 17.901 2.852 1.00 0.00 N ATOM 332 CA ILE A 21 0.545 17.307 4.194 1.00 0.00 C ATOM 333 C ILE A 21 1.729 16.368 4.416 1.00 0.00 C ATOM 334 O ILE A 21 2.339 16.420 5.476 1.00 0.00 O ATOM 335 CB ILE A 21 -0.810 16.604 4.441 1.00 0.00 C ATOM 336 CG1 ILE A 21 -1.968 17.630 4.419 1.00 0.00 C ATOM 337 CG2 ILE A 21 -0.833 15.804 5.755 1.00 0.00 C ATOM 338 CD1 ILE A 21 -3.348 17.009 4.175 1.00 0.00 C ATOM 0 H ILE A 21 -0.139 17.590 2.233 1.00 0.00 H new ATOM 0 HA ILE A 21 0.614 18.110 4.928 1.00 0.00 H new ATOM 0 HB ILE A 21 -0.945 15.890 3.629 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -1.984 18.164 5.369 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -1.771 18.368 3.642 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -1.808 15.332 5.877 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -0.059 15.037 5.727 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -0.648 16.476 6.593 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.105 17.793 4.174 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.352 16.499 3.212 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.569 16.292 4.966 1.00 0.00 H new ATOM 350 N VAL A 22 2.100 15.556 3.423 1.00 0.00 N ATOM 351 CA VAL A 22 3.229 14.616 3.525 1.00 0.00 C ATOM 352 C VAL A 22 4.589 15.310 3.370 1.00 0.00 C ATOM 353 O VAL A 22 5.493 15.052 4.167 1.00 0.00 O ATOM 354 CB VAL A 22 3.061 13.468 2.514 1.00 0.00 C ATOM 355 CG1 VAL A 22 4.187 12.437 2.581 1.00 0.00 C ATOM 356 CG2 VAL A 22 1.753 12.713 2.803 1.00 0.00 C ATOM 0 H VAL A 22 1.626 15.529 2.520 1.00 0.00 H new ATOM 0 HA VAL A 22 3.216 14.197 4.531 1.00 0.00 H new ATOM 0 HB VAL A 22 3.066 13.933 1.528 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.008 11.655 1.843 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.139 12.924 2.370 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.218 11.996 3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.636 11.900 2.086 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.784 12.304 3.813 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.910 13.399 2.715 1.00 0.00 H new ATOM 366 N GLU A 23 4.740 16.238 2.419 1.00 0.00 N ATOM 367 CA GLU A 23 6.008 16.951 2.173 1.00 0.00 C ATOM 368 C GLU A 23 6.404 17.857 3.347 1.00 0.00 C ATOM 369 O GLU A 23 7.598 18.058 3.593 1.00 0.00 O ATOM 370 CB GLU A 23 5.918 17.801 0.891 1.00 0.00 C ATOM 371 CG GLU A 23 5.888 16.974 -0.408 1.00 0.00 C ATOM 372 CD GLU A 23 7.274 16.625 -0.992 1.00 0.00 C ATOM 373 OE1 GLU A 23 8.301 16.647 -0.268 1.00 0.00 O ATOM 374 OE2 GLU A 23 7.337 16.334 -2.215 1.00 0.00 O ATOM 0 H GLU A 23 3.986 16.520 1.793 1.00 0.00 H new ATOM 0 HA GLU A 23 6.775 16.185 2.057 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.020 18.417 0.938 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.770 18.481 0.857 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.347 16.047 -0.218 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.322 17.526 -1.159 1.00 0.00 H new ATOM 381 N LYS A 24 5.409 18.367 4.093 1.00 0.00 N ATOM 382 CA LYS A 24 5.602 19.281 5.236 1.00 0.00 C ATOM 383 C LYS A 24 5.212 18.662 6.588 1.00 0.00 C ATOM 384 O LYS A 24 5.285 19.345 7.613 1.00 0.00 O ATOM 385 CB LYS A 24 4.866 20.615 4.990 1.00 0.00 C ATOM 386 CG LYS A 24 5.133 21.278 3.627 1.00 0.00 C ATOM 387 CD LYS A 24 6.620 21.577 3.371 1.00 0.00 C ATOM 388 CE LYS A 24 6.840 22.305 2.037 1.00 0.00 C ATOM 389 NZ LYS A 24 6.638 23.775 2.158 1.00 0.00 N ATOM 0 H LYS A 24 4.428 18.152 3.916 1.00 0.00 H new ATOM 0 HA LYS A 24 6.672 19.477 5.303 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.794 20.442 5.086 1.00 0.00 H new ATOM 0 HB3 LYS A 24 5.147 21.315 5.776 1.00 0.00 H new ATOM 0 HG2 LYS A 24 4.760 20.627 2.836 1.00 0.00 H new ATOM 0 HG3 LYS A 24 4.568 22.208 3.567 1.00 0.00 H new ATOM 0 HD2 LYS A 24 7.013 22.186 4.185 1.00 0.00 H new ATOM 0 HD3 LYS A 24 7.183 20.643 3.371 1.00 0.00 H new ATOM 0 HE2 LYS A 24 7.851 22.107 1.680 1.00 0.00 H new ATOM 0 HE3 LYS A 24 6.154 21.906 1.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 6.797 24.224 1.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 5.666 23.967 2.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 7.310 24.162 2.851 1.00 0.00 H new ATOM 403 N ARG A 25 4.831 17.375 6.595 1.00 0.00 N ATOM 404 CA ARG A 25 4.424 16.574 7.772 1.00 0.00 C ATOM 405 C ARG A 25 3.397 17.306 8.647 1.00 0.00 C ATOM 406 O ARG A 25 3.593 17.496 9.850 1.00 0.00 O ATOM 407 CB ARG A 25 5.665 16.130 8.553 1.00 0.00 C ATOM 408 CG ARG A 25 6.604 15.220 7.742 1.00 0.00 C ATOM 409 CD ARG A 25 8.050 15.602 8.068 1.00 0.00 C ATOM 410 NE ARG A 25 9.006 14.517 7.766 1.00 0.00 N ATOM 411 CZ ARG A 25 9.338 13.517 8.567 1.00 0.00 C ATOM 412 NH1 ARG A 25 8.777 13.336 9.732 1.00 0.00 N ATOM 413 NH2 ARG A 25 10.259 12.667 8.213 1.00 0.00 N ATOM 0 H ARG A 25 4.795 16.830 5.734 1.00 0.00 H new ATOM 0 HA ARG A 25 3.912 15.678 7.421 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.217 17.013 8.877 1.00 0.00 H new ATOM 0 HB3 ARG A 25 5.349 15.603 9.454 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.424 14.174 7.988 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.413 15.334 6.675 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.324 16.491 7.500 1.00 0.00 H new ATOM 0 HD3 ARG A 25 8.124 15.863 9.124 1.00 0.00 H new ATOM 0 HE ARG A 25 9.454 14.541 6.850 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.054 13.978 10.055 1.00 0.00 H new ATOM 0 HH12 ARG A 25 9.062 12.552 10.319 1.00 0.00 H new ATOM 0 HH21 ARG A 25 10.729 12.770 7.314 1.00 0.00 H new ATOM 0 HH22 ARG A 25 10.510 11.899 8.835 1.00 0.00 H new ATOM 427 N ILE A 26 2.342 17.799 8.001 1.00 0.00 N ATOM 428 CA ILE A 26 1.315 18.633 8.638 1.00 0.00 C ATOM 429 C ILE A 26 0.511 17.776 9.620 1.00 0.00 C ATOM 430 O ILE A 26 -0.117 16.790 9.232 1.00 0.00 O ATOM 431 CB ILE A 26 0.418 19.344 7.601 1.00 0.00 C ATOM 432 CG1 ILE A 26 1.291 20.160 6.620 1.00 0.00 C ATOM 433 CG2 ILE A 26 -0.600 20.255 8.312 1.00 0.00 C ATOM 434 CD1 ILE A 26 0.527 20.903 5.525 1.00 0.00 C ATOM 0 H ILE A 26 2.171 17.631 7.010 1.00 0.00 H new ATOM 0 HA ILE A 26 1.802 19.433 9.195 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.133 18.594 7.034 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.869 20.885 7.192 1.00 0.00 H new ATOM 0 HG13 ILE A 26 2.005 19.485 6.148 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.226 20.750 7.570 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -1.226 19.655 8.972 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.070 21.006 8.898 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.231 21.443 4.892 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.029 20.187 4.920 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.167 21.610 5.981 1.00 0.00 H new ATOM 446 N GLU A 27 0.564 18.136 10.903 1.00 0.00 N ATOM 447 CA GLU A 27 -0.193 17.486 11.977 1.00 0.00 C ATOM 448 C GLU A 27 -1.674 17.889 11.899 1.00 0.00 C ATOM 449 O GLU A 27 -2.067 18.963 12.365 1.00 0.00 O ATOM 450 CB GLU A 27 0.423 17.825 13.346 1.00 0.00 C ATOM 451 CG GLU A 27 1.749 17.087 13.565 1.00 0.00 C ATOM 452 CD GLU A 27 2.417 17.514 14.884 1.00 0.00 C ATOM 453 OE1 GLU A 27 3.137 18.543 14.903 1.00 0.00 O ATOM 454 OE2 GLU A 27 2.237 16.821 15.915 1.00 0.00 O ATOM 0 H GLU A 27 1.147 18.905 11.233 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.138 16.404 11.853 1.00 0.00 H new ATOM 0 HB2 GLU A 27 0.588 18.900 13.415 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.278 17.559 14.137 1.00 0.00 H new ATOM 0 HG2 GLU A 27 1.571 16.012 13.577 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.422 17.290 12.732 1.00 0.00 H new ATOM 461 N CYS A 28 -2.495 17.028 11.288 1.00 0.00 N ATOM 462 CA CYS A 28 -3.924 17.268 11.069 1.00 0.00 C ATOM 463 C CYS A 28 -4.792 16.032 11.336 1.00 0.00 C ATOM 464 O CYS A 28 -4.314 14.903 11.452 1.00 0.00 O ATOM 465 CB CYS A 28 -4.155 17.836 9.654 1.00 0.00 C ATOM 466 SG CYS A 28 -3.574 16.687 8.368 1.00 0.00 S ATOM 0 H CYS A 28 -2.178 16.129 10.926 1.00 0.00 H new ATOM 0 HA CYS A 28 -4.244 18.009 11.801 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -5.217 18.037 9.511 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -3.634 18.788 9.554 1.00 0.00 H new ATOM 0 HG CYS A 28 -2.283 16.560 8.451 1.00 0.00 H new ATOM 472 N THR A 29 -6.095 16.273 11.459 1.00 0.00 N ATOM 473 CA THR A 29 -7.132 15.260 11.733 1.00 0.00 C ATOM 474 C THR A 29 -7.758 14.767 10.424 1.00 0.00 C ATOM 475 O THR A 29 -7.792 15.517 9.455 1.00 0.00 O ATOM 476 CB THR A 29 -8.237 15.854 12.630 1.00 0.00 C ATOM 477 OG1 THR A 29 -7.799 16.976 13.369 1.00 0.00 O ATOM 478 CG2 THR A 29 -8.815 14.871 13.642 1.00 0.00 C ATOM 0 H THR A 29 -6.481 17.213 11.368 1.00 0.00 H new ATOM 0 HA THR A 29 -6.660 14.422 12.245 1.00 0.00 H new ATOM 0 HB THR A 29 -9.006 16.134 11.911 1.00 0.00 H new ATOM 0 HG1 THR A 29 -8.479 17.216 14.033 1.00 0.00 H new ATOM 0 HG21 THR A 29 -9.585 15.367 14.233 1.00 0.00 H new ATOM 0 HG22 THR A 29 -9.252 14.022 13.116 1.00 0.00 H new ATOM 0 HG23 THR A 29 -8.022 14.520 14.302 1.00 0.00 H new ATOM 486 N VAL A 30 -8.311 13.554 10.397 1.00 0.00 N ATOM 487 CA VAL A 30 -8.944 12.910 9.223 1.00 0.00 C ATOM 488 C VAL A 30 -10.261 12.227 9.621 1.00 0.00 C ATOM 489 O VAL A 30 -10.617 12.231 10.799 1.00 0.00 O ATOM 490 CB VAL A 30 -7.980 11.912 8.536 1.00 0.00 C ATOM 491 CG1 VAL A 30 -6.640 12.560 8.179 1.00 0.00 C ATOM 492 CG2 VAL A 30 -7.700 10.647 9.362 1.00 0.00 C ATOM 0 H VAL A 30 -8.336 12.959 11.225 1.00 0.00 H new ATOM 0 HA VAL A 30 -9.174 13.691 8.498 1.00 0.00 H new ATOM 0 HB VAL A 30 -8.507 11.615 7.629 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -5.996 11.823 7.699 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -6.809 13.393 7.497 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.160 12.926 9.086 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -7.017 9.998 8.814 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -7.249 10.927 10.314 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -8.635 10.118 9.545 1.00 0.00 H new ATOM 502 N TYR A 31 -10.968 11.619 8.661 1.00 0.00 N ATOM 503 CA TYR A 31 -12.280 10.977 8.842 1.00 0.00 C ATOM 504 C TYR A 31 -12.241 9.530 8.334 1.00 0.00 C ATOM 505 O TYR A 31 -11.732 9.285 7.241 1.00 0.00 O ATOM 506 CB TYR A 31 -13.352 11.740 8.052 1.00 0.00 C ATOM 507 CG TYR A 31 -13.660 13.147 8.524 1.00 0.00 C ATOM 508 CD1 TYR A 31 -12.827 14.224 8.160 1.00 0.00 C ATOM 509 CD2 TYR A 31 -14.818 13.377 9.291 1.00 0.00 C ATOM 510 CE1 TYR A 31 -13.146 15.531 8.577 1.00 0.00 C ATOM 511 CE2 TYR A 31 -15.164 14.690 9.671 1.00 0.00 C ATOM 512 CZ TYR A 31 -14.328 15.770 9.309 1.00 0.00 C ATOM 513 OH TYR A 31 -14.661 17.045 9.652 1.00 0.00 O ATOM 0 H TYR A 31 -10.631 11.557 7.700 1.00 0.00 H new ATOM 0 HA TYR A 31 -12.520 10.988 9.905 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -13.038 11.790 7.009 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -14.275 11.160 8.079 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -11.945 14.047 7.562 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -15.442 12.547 9.589 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -12.485 16.351 8.336 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -16.066 14.870 10.237 1.00 0.00 H new ATOM 0 HH TYR A 31 -15.504 17.040 10.152 1.00 0.00 H new ATOM 523 N SER A 32 -12.787 8.580 9.096 1.00 0.00 N ATOM 524 CA SER A 32 -12.756 7.136 8.773 1.00 0.00 C ATOM 525 C SER A 32 -13.825 6.348 9.547 1.00 0.00 C ATOM 526 O SER A 32 -14.242 6.794 10.611 1.00 0.00 O ATOM 527 CB SER A 32 -11.374 6.575 9.136 1.00 0.00 C ATOM 528 OG SER A 32 -11.273 5.234 8.699 1.00 0.00 O ATOM 0 H SER A 32 -13.272 8.786 9.969 1.00 0.00 H new ATOM 0 HA SER A 32 -12.960 7.028 7.708 1.00 0.00 H new ATOM 0 HB2 SER A 32 -10.593 7.178 8.673 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.221 6.629 10.214 1.00 0.00 H new ATOM 0 HG SER A 32 -10.349 5.046 8.431 1.00 0.00 H new ATOM 534 N VAL A 33 -14.279 5.185 9.054 1.00 0.00 N ATOM 535 CA VAL A 33 -15.186 4.298 9.817 1.00 0.00 C ATOM 536 C VAL A 33 -14.460 3.450 10.863 1.00 0.00 C ATOM 537 O VAL A 33 -13.331 2.996 10.653 1.00 0.00 O ATOM 538 CB VAL A 33 -16.023 3.335 8.955 1.00 0.00 C ATOM 539 CG1 VAL A 33 -17.060 4.082 8.126 1.00 0.00 C ATOM 540 CG2 VAL A 33 -15.176 2.430 8.062 1.00 0.00 C ATOM 0 H VAL A 33 -14.035 4.832 8.129 1.00 0.00 H new ATOM 0 HA VAL A 33 -15.854 5.012 10.298 1.00 0.00 H new ATOM 0 HB VAL A 33 -16.541 2.686 9.661 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -17.632 3.370 7.531 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -17.734 4.624 8.789 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -16.557 4.787 7.464 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -15.829 1.777 7.482 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -14.580 3.042 7.385 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -14.514 1.824 8.681 1.00 0.00 H new ATOM 550 N ASP A 34 -15.145 3.184 11.974 1.00 0.00 N ATOM 551 CA ASP A 34 -14.725 2.210 12.988 1.00 0.00 C ATOM 552 C ASP A 34 -15.134 0.763 12.621 1.00 0.00 C ATOM 553 O ASP A 34 -15.738 0.498 11.576 1.00 0.00 O ATOM 554 CB ASP A 34 -15.220 2.655 14.387 1.00 0.00 C ATOM 555 CG ASP A 34 -16.731 2.566 14.635 1.00 0.00 C ATOM 556 OD1 ASP A 34 -17.458 2.029 13.792 1.00 0.00 O ATOM 557 OD2 ASP A 34 -17.198 3.016 15.722 1.00 0.00 O ATOM 0 H ASP A 34 -16.025 3.647 12.202 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.636 2.190 13.019 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -14.714 2.048 15.138 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -14.907 3.687 14.548 1.00 0.00 H new ATOM 562 N ASN A 35 -14.811 -0.187 13.505 1.00 0.00 N ATOM 563 CA ASN A 35 -15.221 -1.600 13.400 1.00 0.00 C ATOM 564 C ASN A 35 -16.744 -1.792 13.274 1.00 0.00 C ATOM 565 O ASN A 35 -17.206 -2.742 12.636 1.00 0.00 O ATOM 566 CB ASN A 35 -14.699 -2.343 14.642 1.00 0.00 C ATOM 567 CG ASN A 35 -15.245 -3.758 14.800 1.00 0.00 C ATOM 568 OD1 ASN A 35 -16.080 -4.030 15.651 1.00 0.00 O ATOM 569 ND2 ASN A 35 -14.803 -4.699 13.994 1.00 0.00 N ATOM 0 H ASN A 35 -14.246 0.004 14.332 1.00 0.00 H new ATOM 0 HA ASN A 35 -14.793 -2.004 12.482 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -13.611 -2.389 14.593 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -14.954 -1.766 15.531 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -15.157 -5.652 14.080 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -14.107 -4.476 13.283 1.00 0.00 H new ATOM 576 N ASN A 36 -17.521 -0.895 13.887 1.00 0.00 N ATOM 577 CA ASN A 36 -18.978 -0.949 13.883 1.00 0.00 C ATOM 578 C ASN A 36 -19.595 -0.282 12.626 1.00 0.00 C ATOM 579 O ASN A 36 -20.797 -0.428 12.383 1.00 0.00 O ATOM 580 CB ASN A 36 -19.503 -0.317 15.189 1.00 0.00 C ATOM 581 CG ASN A 36 -19.507 -1.271 16.374 1.00 0.00 C ATOM 582 OD1 ASN A 36 -20.550 -1.700 16.850 1.00 0.00 O ATOM 583 ND2 ASN A 36 -18.358 -1.634 16.899 1.00 0.00 N ATOM 0 H ASN A 36 -17.146 -0.101 14.406 1.00 0.00 H new ATOM 0 HA ASN A 36 -19.289 -1.993 13.837 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -18.890 0.550 15.434 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -20.517 0.047 15.024 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -18.340 -2.269 17.697 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -17.484 -1.281 16.508 1.00 0.00 H new ATOM 590 N GLY A 37 -18.796 0.429 11.818 1.00 0.00 N ATOM 591 CA GLY A 37 -19.210 1.124 10.596 1.00 0.00 C ATOM 592 C GLY A 37 -19.559 2.610 10.789 1.00 0.00 C ATOM 593 O GLY A 37 -20.291 3.166 9.966 1.00 0.00 O ATOM 0 H GLY A 37 -17.800 0.539 12.009 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -18.409 1.045 9.860 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -20.077 0.612 10.179 1.00 0.00 H new ATOM 597 N ASN A 38 -19.078 3.261 11.857 1.00 0.00 N ATOM 598 CA ASN A 38 -19.415 4.646 12.208 1.00 0.00 C ATOM 599 C ASN A 38 -18.273 5.580 11.802 1.00 0.00 C ATOM 600 O ASN A 38 -17.143 5.383 12.253 1.00 0.00 O ATOM 601 CB ASN A 38 -19.631 4.777 13.729 1.00 0.00 C ATOM 602 CG ASN A 38 -20.577 3.762 14.336 1.00 0.00 C ATOM 603 OD1 ASN A 38 -21.753 3.676 14.003 1.00 0.00 O ATOM 604 ND2 ASN A 38 -20.097 2.991 15.283 1.00 0.00 N ATOM 0 H ASN A 38 -18.429 2.829 12.515 1.00 0.00 H new ATOM 0 HA ASN A 38 -20.329 4.917 11.681 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -18.665 4.691 14.226 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -20.011 5.776 13.941 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -20.704 2.315 15.747 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -19.117 3.068 15.555 1.00 0.00 H new ATOM 611 N ILE A 39 -18.544 6.596 10.977 1.00 0.00 N ATOM 612 CA ILE A 39 -17.533 7.581 10.573 1.00 0.00 C ATOM 613 C ILE A 39 -17.163 8.468 11.774 1.00 0.00 C ATOM 614 O ILE A 39 -17.988 9.238 12.274 1.00 0.00 O ATOM 615 CB ILE A 39 -17.979 8.377 9.325 1.00 0.00 C ATOM 616 CG1 ILE A 39 -18.217 7.400 8.148 1.00 0.00 C ATOM 617 CG2 ILE A 39 -16.891 9.400 8.957 1.00 0.00 C ATOM 618 CD1 ILE A 39 -18.767 8.014 6.860 1.00 0.00 C ATOM 0 H ILE A 39 -19.466 6.759 10.571 1.00 0.00 H new ATOM 0 HA ILE A 39 -16.625 7.062 10.266 1.00 0.00 H new ATOM 0 HB ILE A 39 -18.907 8.907 9.537 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -17.273 6.907 7.916 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -18.908 6.625 8.480 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -17.203 9.963 8.077 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -16.739 10.085 9.791 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -15.959 8.878 8.742 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -18.892 7.234 6.109 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -19.731 8.481 7.062 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -18.071 8.766 6.489 1.00 0.00 H new ATOM 630 N TYR A 40 -15.916 8.340 12.231 1.00 0.00 N ATOM 631 CA TYR A 40 -15.304 9.081 13.340 1.00 0.00 C ATOM 632 C TYR A 40 -14.120 9.945 12.857 1.00 0.00 C ATOM 633 O TYR A 40 -13.759 9.913 11.677 1.00 0.00 O ATOM 634 CB TYR A 40 -14.896 8.096 14.456 1.00 0.00 C ATOM 635 CG TYR A 40 -13.667 7.231 14.187 1.00 0.00 C ATOM 636 CD1 TYR A 40 -13.793 5.989 13.534 1.00 0.00 C ATOM 637 CD2 TYR A 40 -12.395 7.648 14.634 1.00 0.00 C ATOM 638 CE1 TYR A 40 -12.656 5.194 13.294 1.00 0.00 C ATOM 639 CE2 TYR A 40 -11.265 6.831 14.425 1.00 0.00 C ATOM 640 CZ TYR A 40 -11.392 5.602 13.752 1.00 0.00 C ATOM 641 OH TYR A 40 -10.310 4.797 13.578 1.00 0.00 O ATOM 0 H TYR A 40 -15.265 7.676 11.812 1.00 0.00 H new ATOM 0 HA TYR A 40 -16.036 9.776 13.752 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.718 8.668 15.367 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.741 7.436 14.654 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -14.766 5.645 13.216 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -12.287 8.597 15.138 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.756 4.264 12.754 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -10.297 7.150 14.783 1.00 0.00 H new ATOM 0 HH TYR A 40 -9.636 5.266 13.042 1.00 0.00 H new ATOM 651 N THR A 41 -13.508 10.719 13.765 1.00 0.00 N ATOM 652 CA THR A 41 -12.351 11.591 13.470 1.00 0.00 C ATOM 653 C THR A 41 -11.144 11.300 14.366 1.00 0.00 C ATOM 654 O THR A 41 -11.293 11.004 15.555 1.00 0.00 O ATOM 655 CB THR A 41 -12.700 13.087 13.568 1.00 0.00 C ATOM 656 OG1 THR A 41 -13.405 13.402 14.753 1.00 0.00 O ATOM 657 CG2 THR A 41 -13.545 13.554 12.387 1.00 0.00 C ATOM 0 H THR A 41 -13.804 10.761 14.740 1.00 0.00 H new ATOM 0 HA THR A 41 -12.083 11.358 12.440 1.00 0.00 H new ATOM 0 HB THR A 41 -11.740 13.602 13.568 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.602 14.362 14.771 1.00 0.00 H new ATOM 0 HG21 THR A 41 -13.768 14.615 12.496 1.00 0.00 H new ATOM 0 HG22 THR A 41 -12.995 13.393 11.460 1.00 0.00 H new ATOM 0 HG23 THR A 41 -14.476 12.988 12.360 1.00 0.00 H new ATOM 665 N GLN A 42 -9.937 11.383 13.790 1.00 0.00 N ATOM 666 CA GLN A 42 -8.669 11.064 14.468 1.00 0.00 C ATOM 667 C GLN A 42 -7.464 11.805 13.857 1.00 0.00 C ATOM 668 O GLN A 42 -7.496 12.112 12.663 1.00 0.00 O ATOM 669 CB GLN A 42 -8.435 9.546 14.389 1.00 0.00 C ATOM 670 CG GLN A 42 -8.157 9.033 12.961 1.00 0.00 C ATOM 671 CD GLN A 42 -8.170 7.511 12.855 1.00 0.00 C ATOM 672 OE1 GLN A 42 -8.757 6.946 11.941 1.00 0.00 O ATOM 673 NE2 GLN A 42 -7.523 6.796 13.755 1.00 0.00 N ATOM 0 H GLN A 42 -9.810 11.679 12.822 1.00 0.00 H new ATOM 0 HA GLN A 42 -8.752 11.394 15.503 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -7.593 9.284 15.030 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -9.310 9.032 14.786 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -8.904 9.444 12.282 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -7.187 9.405 12.631 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -7.032 7.261 14.519 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -7.514 5.778 13.687 1.00 0.00 H new ATOM 682 N PRO A 43 -6.388 12.082 14.617 1.00 0.00 N ATOM 683 CA PRO A 43 -5.160 12.671 14.080 1.00 0.00 C ATOM 684 C PRO A 43 -4.369 11.700 13.184 1.00 0.00 C ATOM 685 O PRO A 43 -4.431 10.478 13.345 1.00 0.00 O ATOM 686 CB PRO A 43 -4.347 13.090 15.309 1.00 0.00 C ATOM 687 CG PRO A 43 -4.808 12.122 16.395 1.00 0.00 C ATOM 688 CD PRO A 43 -6.272 11.867 16.052 1.00 0.00 C ATOM 0 HA PRO A 43 -5.388 13.514 13.428 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -3.275 13.007 15.127 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -4.544 14.126 15.586 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -4.227 11.200 16.383 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.699 12.554 17.390 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -6.565 10.852 16.320 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -6.926 12.543 16.603 1.00 0.00 H new ATOM 696 N VAL A 44 -3.591 12.254 12.249 1.00 0.00 N ATOM 697 CA VAL A 44 -2.579 11.529 11.463 1.00 0.00 C ATOM 698 C VAL A 44 -1.508 10.931 12.391 1.00 0.00 C ATOM 699 O VAL A 44 -1.098 11.567 13.368 1.00 0.00 O ATOM 700 CB VAL A 44 -1.965 12.458 10.389 1.00 0.00 C ATOM 701 CG1 VAL A 44 -1.175 13.640 10.965 1.00 0.00 C ATOM 702 CG2 VAL A 44 -1.051 11.697 9.423 1.00 0.00 C ATOM 0 H VAL A 44 -3.646 13.244 12.009 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.057 10.700 10.941 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.830 12.853 9.857 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -0.777 14.243 10.149 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.834 14.252 11.581 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.353 13.265 11.574 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.643 12.389 8.687 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.235 11.237 9.980 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.624 10.922 8.914 1.00 0.00 H new ATOM 712 N ALA A 45 -1.045 9.713 12.096 1.00 0.00 N ATOM 713 CA ALA A 45 0.022 9.063 12.858 1.00 0.00 C ATOM 714 C ALA A 45 1.409 9.417 12.293 1.00 0.00 C ATOM 715 O ALA A 45 2.282 9.869 13.036 1.00 0.00 O ATOM 716 CB ALA A 45 -0.200 7.546 12.845 1.00 0.00 C ATOM 0 H ALA A 45 -1.400 9.151 11.322 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.009 9.424 13.886 1.00 0.00 H new ATOM 0 HB1 ALA A 45 0.593 7.057 13.412 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -1.164 7.316 13.298 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.186 7.185 11.817 1.00 0.00 H new ATOM 722 N GLN A 46 1.598 9.220 10.982 1.00 0.00 N ATOM 723 CA GLN A 46 2.862 9.392 10.253 1.00 0.00 C ATOM 724 C GLN A 46 2.607 9.788 8.782 1.00 0.00 C ATOM 725 O GLN A 46 1.464 9.846 8.324 1.00 0.00 O ATOM 726 CB GLN A 46 3.690 8.085 10.308 1.00 0.00 C ATOM 727 CG GLN A 46 4.203 7.673 11.698 1.00 0.00 C ATOM 728 CD GLN A 46 5.125 8.700 12.370 1.00 0.00 C ATOM 729 OE1 GLN A 46 5.826 9.477 11.731 1.00 0.00 O ATOM 730 NE2 GLN A 46 5.182 8.728 13.687 1.00 0.00 N ATOM 0 H GLN A 46 0.837 8.922 10.371 1.00 0.00 H new ATOM 0 HA GLN A 46 3.421 10.195 10.732 1.00 0.00 H new ATOM 0 HB2 GLN A 46 3.079 7.274 9.912 1.00 0.00 H new ATOM 0 HB3 GLN A 46 4.547 8.192 9.643 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.347 7.493 12.348 1.00 0.00 H new ATOM 0 HG3 GLN A 46 4.739 6.728 11.608 1.00 0.00 H new ATOM 0 HE21 GLN A 46 4.606 8.089 14.236 1.00 0.00 H new ATOM 0 HE22 GLN A 46 5.802 9.388 14.157 1.00 0.00 H new ATOM 739 N TRP A 47 3.680 10.017 8.023 1.00 0.00 N ATOM 740 CA TRP A 47 3.645 10.489 6.633 1.00 0.00 C ATOM 741 C TRP A 47 4.638 9.692 5.771 1.00 0.00 C ATOM 742 O TRP A 47 5.774 9.454 6.198 1.00 0.00 O ATOM 743 CB TRP A 47 3.994 11.987 6.601 1.00 0.00 C ATOM 744 CG TRP A 47 3.151 12.886 7.456 1.00 0.00 C ATOM 745 CD1 TRP A 47 2.087 13.614 7.042 1.00 0.00 C ATOM 746 CD2 TRP A 47 3.298 13.174 8.881 1.00 0.00 C ATOM 747 NE1 TRP A 47 1.562 14.324 8.105 1.00 0.00 N ATOM 748 CE2 TRP A 47 2.262 14.077 9.267 1.00 0.00 C ATOM 749 CE3 TRP A 47 4.203 12.766 9.887 1.00 0.00 C ATOM 750 CZ2 TRP A 47 2.126 14.535 10.581 1.00 0.00 C ATOM 751 CZ3 TRP A 47 4.060 13.209 11.217 1.00 0.00 C ATOM 752 CH2 TRP A 47 3.019 14.088 11.566 1.00 0.00 C ATOM 0 H TRP A 47 4.629 9.875 8.368 1.00 0.00 H new ATOM 0 HA TRP A 47 2.645 10.340 6.226 1.00 0.00 H new ATOM 0 HB2 TRP A 47 5.034 12.102 6.906 1.00 0.00 H new ATOM 0 HB3 TRP A 47 3.924 12.332 5.569 1.00 0.00 H new ATOM 0 HD1 TRP A 47 1.706 13.636 6.032 1.00 0.00 H new ATOM 0 HE1 TRP A 47 0.760 14.950 8.039 1.00 0.00 H new ATOM 0 HE3 TRP A 47 5.017 12.104 9.632 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 1.338 15.229 10.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 4.754 12.872 11.973 1.00 0.00 H new ATOM 0 HH2 TRP A 47 2.908 14.418 12.588 1.00 0.00 H new ATOM 763 N HIS A 48 4.227 9.304 4.558 1.00 0.00 N ATOM 764 CA HIS A 48 5.031 8.487 3.638 1.00 0.00 C ATOM 765 C HIS A 48 5.009 9.050 2.200 1.00 0.00 C ATOM 766 O HIS A 48 3.956 9.350 1.629 1.00 0.00 O ATOM 767 CB HIS A 48 4.542 7.027 3.660 1.00 0.00 C ATOM 768 CG HIS A 48 4.271 6.455 5.035 1.00 0.00 C ATOM 769 ND1 HIS A 48 5.201 5.952 5.920 1.00 0.00 N ATOM 770 CD2 HIS A 48 3.045 6.346 5.635 1.00 0.00 C ATOM 771 CE1 HIS A 48 4.550 5.554 7.027 1.00 0.00 C ATOM 772 NE2 HIS A 48 3.228 5.776 6.904 1.00 0.00 N ATOM 0 H HIS A 48 3.312 9.552 4.181 1.00 0.00 H new ATOM 0 HA HIS A 48 6.065 8.520 3.980 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.628 6.959 3.070 1.00 0.00 H new ATOM 0 HB3 HIS A 48 5.288 6.404 3.166 1.00 0.00 H new ATOM 0 HD1 HIS A 48 6.207 5.892 5.762 1.00 0.00 H new ATOM 0 HD2 HIS A 48 2.101 6.647 5.206 1.00 0.00 H new ATOM 0 HE1 HIS A 48 5.022 5.117 7.894 1.00 0.00 H new ATOM 780 N ASP A 49 6.192 9.168 1.595 1.00 0.00 N ATOM 781 CA ASP A 49 6.414 9.720 0.253 1.00 0.00 C ATOM 782 C ASP A 49 6.868 8.590 -0.681 1.00 0.00 C ATOM 783 O ASP A 49 7.679 7.741 -0.289 1.00 0.00 O ATOM 784 CB ASP A 49 7.540 10.773 0.280 1.00 0.00 C ATOM 785 CG ASP A 49 7.383 11.911 1.299 1.00 0.00 C ATOM 786 OD1 ASP A 49 7.726 11.715 2.492 1.00 0.00 O ATOM 787 OD2 ASP A 49 7.017 13.036 0.883 1.00 0.00 O ATOM 0 H ASP A 49 7.059 8.870 2.043 1.00 0.00 H new ATOM 0 HA ASP A 49 5.485 10.176 -0.090 1.00 0.00 H new ATOM 0 HB2 ASP A 49 8.482 10.262 0.480 1.00 0.00 H new ATOM 0 HB3 ASP A 49 7.621 11.213 -0.714 1.00 0.00 H new ATOM 792 N ARG A 50 6.387 8.595 -1.930 1.00 0.00 N ATOM 793 CA ARG A 50 6.742 7.565 -2.926 1.00 0.00 C ATOM 794 C ARG A 50 7.694 8.064 -4.011 1.00 0.00 C ATOM 795 O ARG A 50 8.558 7.316 -4.469 1.00 0.00 O ATOM 796 CB ARG A 50 5.466 7.028 -3.570 1.00 0.00 C ATOM 797 CG ARG A 50 4.425 6.495 -2.566 1.00 0.00 C ATOM 798 CD ARG A 50 4.943 5.400 -1.624 1.00 0.00 C ATOM 799 NE ARG A 50 5.545 4.262 -2.353 1.00 0.00 N ATOM 800 CZ ARG A 50 5.842 3.071 -1.868 1.00 0.00 C ATOM 801 NH1 ARG A 50 5.625 2.749 -0.625 1.00 0.00 N ATOM 802 NH2 ARG A 50 6.361 2.176 -2.656 1.00 0.00 N ATOM 0 H ARG A 50 5.745 9.306 -2.281 1.00 0.00 H new ATOM 0 HA ARG A 50 7.272 6.777 -2.390 1.00 0.00 H new ATOM 0 HB2 ARG A 50 5.010 7.822 -4.162 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.731 6.227 -4.261 1.00 0.00 H new ATOM 0 HG2 ARG A 50 4.060 7.328 -1.966 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.572 6.104 -3.121 1.00 0.00 H new ATOM 0 HD2 ARG A 50 5.684 5.827 -0.949 1.00 0.00 H new ATOM 0 HD3 ARG A 50 4.121 5.038 -1.007 1.00 0.00 H new ATOM 0 HE ARG A 50 5.754 4.415 -3.340 1.00 0.00 H new ATOM 0 HH11 ARG A 50 5.211 3.429 0.013 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.869 1.817 -0.289 1.00 0.00 H new ATOM 0 HH21 ARG A 50 6.534 2.398 -3.636 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.595 1.252 -2.294 1.00 0.00 H new ATOM 816 N GLY A 51 7.528 9.319 -4.425 1.00 0.00 N ATOM 817 CA GLY A 51 8.389 10.016 -5.385 1.00 0.00 C ATOM 818 C GLY A 51 7.870 9.974 -6.823 1.00 0.00 C ATOM 819 O GLY A 51 7.678 11.034 -7.409 1.00 0.00 O ATOM 0 H GLY A 51 6.762 9.902 -4.089 1.00 0.00 H new ATOM 0 HA2 GLY A 51 8.494 11.056 -5.077 1.00 0.00 H new ATOM 0 HA3 GLY A 51 9.384 9.573 -5.355 1.00 0.00 H new ATOM 823 N GLU A 52 7.599 8.785 -7.380 1.00 0.00 N ATOM 824 CA GLU A 52 7.156 8.593 -8.780 1.00 0.00 C ATOM 825 C GLU A 52 6.692 7.144 -9.021 1.00 0.00 C ATOM 826 O GLU A 52 7.519 6.238 -9.157 1.00 0.00 O ATOM 827 CB GLU A 52 8.264 8.871 -9.824 1.00 0.00 C ATOM 828 CG GLU A 52 8.614 10.335 -10.124 1.00 0.00 C ATOM 829 CD GLU A 52 9.410 10.501 -11.438 1.00 0.00 C ATOM 830 OE1 GLU A 52 10.263 9.639 -11.767 1.00 0.00 O ATOM 831 OE2 GLU A 52 9.231 11.530 -12.137 1.00 0.00 O ATOM 0 H GLU A 52 7.681 7.909 -6.865 1.00 0.00 H new ATOM 0 HA GLU A 52 6.345 9.310 -8.910 1.00 0.00 H new ATOM 0 HB2 GLU A 52 9.173 8.371 -9.489 1.00 0.00 H new ATOM 0 HB3 GLU A 52 7.968 8.399 -10.761 1.00 0.00 H new ATOM 0 HG2 GLU A 52 7.695 10.919 -10.184 1.00 0.00 H new ATOM 0 HG3 GLU A 52 9.197 10.742 -9.297 1.00 0.00 H new ATOM 838 N GLN A 53 5.379 6.918 -9.107 1.00 0.00 N ATOM 839 CA GLN A 53 4.790 5.607 -9.441 1.00 0.00 C ATOM 840 C GLN A 53 3.700 5.699 -10.516 1.00 0.00 C ATOM 841 O GLN A 53 3.126 6.763 -10.745 1.00 0.00 O ATOM 842 CB GLN A 53 4.228 4.972 -8.165 1.00 0.00 C ATOM 843 CG GLN A 53 5.332 4.882 -7.106 1.00 0.00 C ATOM 844 CD GLN A 53 4.942 4.196 -5.821 1.00 0.00 C ATOM 845 OE1 GLN A 53 5.727 3.497 -5.194 1.00 0.00 O ATOM 846 NE2 GLN A 53 3.797 4.515 -5.263 1.00 0.00 N ATOM 0 H GLN A 53 4.682 7.645 -8.946 1.00 0.00 H new ATOM 0 HA GLN A 53 5.581 4.984 -9.859 1.00 0.00 H new ATOM 0 HB2 GLN A 53 3.396 5.566 -7.787 1.00 0.00 H new ATOM 0 HB3 GLN A 53 3.837 3.978 -8.383 1.00 0.00 H new ATOM 0 HG2 GLN A 53 6.183 4.353 -7.536 1.00 0.00 H new ATOM 0 HG3 GLN A 53 5.670 5.891 -6.871 1.00 0.00 H new ATOM 0 HE21 GLN A 53 3.128 5.097 -5.768 1.00 0.00 H new ATOM 0 HE22 GLN A 53 3.576 4.181 -4.325 1.00 0.00 H new ATOM 855 N GLU A 54 3.427 4.574 -11.184 1.00 0.00 N ATOM 856 CA GLU A 54 2.472 4.453 -12.294 1.00 0.00 C ATOM 857 C GLU A 54 1.035 4.880 -11.936 1.00 0.00 C ATOM 858 O GLU A 54 0.258 4.124 -11.348 1.00 0.00 O ATOM 859 CB GLU A 54 2.525 3.045 -12.921 1.00 0.00 C ATOM 860 CG GLU A 54 2.422 1.860 -11.941 1.00 0.00 C ATOM 861 CD GLU A 54 3.812 1.282 -11.618 1.00 0.00 C ATOM 862 OE1 GLU A 54 4.570 1.921 -10.848 1.00 0.00 O ATOM 863 OE2 GLU A 54 4.158 0.194 -12.141 1.00 0.00 O ATOM 0 H GLU A 54 3.881 3.689 -10.959 1.00 0.00 H new ATOM 0 HA GLU A 54 2.794 5.171 -13.048 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.715 2.962 -13.646 1.00 0.00 H new ATOM 0 HB3 GLU A 54 3.459 2.951 -13.475 1.00 0.00 H new ATOM 0 HG2 GLU A 54 1.938 2.187 -11.021 1.00 0.00 H new ATOM 0 HG3 GLU A 54 1.793 1.081 -12.372 1.00 0.00 H new ATOM 870 N VAL A 55 0.693 6.117 -12.304 1.00 0.00 N ATOM 871 CA VAL A 55 -0.593 6.757 -12.036 1.00 0.00 C ATOM 872 C VAL A 55 -1.571 6.560 -13.193 1.00 0.00 C ATOM 873 O VAL A 55 -1.219 6.629 -14.375 1.00 0.00 O ATOM 874 CB VAL A 55 -0.381 8.248 -11.685 1.00 0.00 C ATOM 875 CG1 VAL A 55 -0.904 9.261 -12.690 1.00 0.00 C ATOM 876 CG2 VAL A 55 -1.016 8.562 -10.327 1.00 0.00 C ATOM 0 H VAL A 55 1.332 6.723 -12.818 1.00 0.00 H new ATOM 0 HA VAL A 55 -1.050 6.276 -11.171 1.00 0.00 H new ATOM 0 HB VAL A 55 0.703 8.360 -11.683 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.696 10.269 -12.332 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.412 9.108 -13.650 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.980 9.133 -12.809 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.862 9.614 -10.088 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -2.085 8.352 -10.368 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.554 7.944 -9.558 1.00 0.00 H new ATOM 886 N PHE A 56 -2.830 6.376 -12.824 1.00 0.00 N ATOM 887 CA PHE A 56 -3.956 6.156 -13.724 1.00 0.00 C ATOM 888 C PHE A 56 -5.083 7.144 -13.394 1.00 0.00 C ATOM 889 O PHE A 56 -5.408 7.388 -12.228 1.00 0.00 O ATOM 890 CB PHE A 56 -4.424 4.696 -13.599 1.00 0.00 C ATOM 891 CG PHE A 56 -3.466 3.675 -14.192 1.00 0.00 C ATOM 892 CD1 PHE A 56 -2.280 3.322 -13.520 1.00 0.00 C ATOM 893 CD2 PHE A 56 -3.765 3.066 -15.425 1.00 0.00 C ATOM 894 CE1 PHE A 56 -1.378 2.411 -14.100 1.00 0.00 C ATOM 895 CE2 PHE A 56 -2.883 2.127 -15.989 1.00 0.00 C ATOM 896 CZ PHE A 56 -1.675 1.821 -15.342 1.00 0.00 C ATOM 0 H PHE A 56 -3.109 6.376 -11.843 1.00 0.00 H new ATOM 0 HA PHE A 56 -3.655 6.331 -14.757 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -4.575 4.465 -12.545 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -5.392 4.595 -14.089 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -2.061 3.753 -12.554 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -4.678 3.322 -15.942 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -0.458 2.165 -13.592 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -3.135 1.641 -16.920 1.00 0.00 H new ATOM 0 HZ PHE A 56 -0.976 1.135 -15.797 1.00 0.00 H new ATOM 906 N GLU A 57 -5.675 7.736 -14.431 1.00 0.00 N ATOM 907 CA GLU A 57 -6.854 8.592 -14.303 1.00 0.00 C ATOM 908 C GLU A 57 -8.033 7.799 -13.718 1.00 0.00 C ATOM 909 O GLU A 57 -8.332 6.692 -14.174 1.00 0.00 O ATOM 910 CB GLU A 57 -7.223 9.162 -15.683 1.00 0.00 C ATOM 911 CG GLU A 57 -8.186 10.348 -15.567 1.00 0.00 C ATOM 912 CD GLU A 57 -8.455 10.969 -16.950 1.00 0.00 C ATOM 913 OE1 GLU A 57 -9.331 10.457 -17.688 1.00 0.00 O ATOM 914 OE2 GLU A 57 -7.792 11.972 -17.306 1.00 0.00 O ATOM 0 H GLU A 57 -5.347 7.634 -15.391 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.628 9.414 -13.624 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.317 9.478 -16.200 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -7.680 8.380 -16.289 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -9.125 10.018 -15.122 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.765 11.101 -14.901 1.00 0.00 H new ATOM 921 N TYR A 58 -8.726 8.386 -12.742 1.00 0.00 N ATOM 922 CA TYR A 58 -9.912 7.823 -12.114 1.00 0.00 C ATOM 923 C TYR A 58 -11.039 8.863 -12.180 1.00 0.00 C ATOM 924 O TYR A 58 -11.113 9.794 -11.378 1.00 0.00 O ATOM 925 CB TYR A 58 -9.537 7.342 -10.699 1.00 0.00 C ATOM 926 CG TYR A 58 -10.674 6.960 -9.768 1.00 0.00 C ATOM 927 CD1 TYR A 58 -11.911 6.528 -10.281 1.00 0.00 C ATOM 928 CD2 TYR A 58 -10.466 6.983 -8.371 1.00 0.00 C ATOM 929 CE1 TYR A 58 -12.938 6.152 -9.408 1.00 0.00 C ATOM 930 CE2 TYR A 58 -11.506 6.623 -7.492 1.00 0.00 C ATOM 931 CZ TYR A 58 -12.754 6.224 -8.018 1.00 0.00 C ATOM 932 OH TYR A 58 -13.790 5.908 -7.204 1.00 0.00 O ATOM 0 H TYR A 58 -8.466 9.294 -12.358 1.00 0.00 H new ATOM 0 HA TYR A 58 -10.291 6.943 -12.633 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -8.879 6.479 -10.800 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -8.957 8.130 -10.218 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -12.068 6.487 -11.349 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.505 7.278 -7.975 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -13.879 5.804 -9.807 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -11.350 6.652 -6.424 1.00 0.00 H new ATOM 0 HH TYR A 58 -14.359 5.242 -7.643 1.00 0.00 H new ATOM 942 N CYS A 59 -11.904 8.722 -13.191 1.00 0.00 N ATOM 943 CA CYS A 59 -13.067 9.580 -13.403 1.00 0.00 C ATOM 944 C CYS A 59 -14.361 8.837 -13.036 1.00 0.00 C ATOM 945 O CYS A 59 -14.491 7.636 -13.288 1.00 0.00 O ATOM 946 CB CYS A 59 -13.080 10.026 -14.872 1.00 0.00 C ATOM 947 SG CYS A 59 -14.341 11.310 -15.146 1.00 0.00 S ATOM 0 H CYS A 59 -11.810 7.992 -13.897 1.00 0.00 H new ATOM 0 HA CYS A 59 -13.006 10.457 -12.759 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -12.098 10.409 -15.149 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -13.281 9.169 -15.515 1.00 0.00 H new ATOM 0 HG CYS A 59 -14.329 11.670 -16.395 1.00 0.00 H new ATOM 953 N LEU A 60 -15.340 9.560 -12.493 1.00 0.00 N ATOM 954 CA LEU A 60 -16.651 9.027 -12.098 1.00 0.00 C ATOM 955 C LEU A 60 -17.783 9.477 -13.028 1.00 0.00 C ATOM 956 O LEU A 60 -17.649 10.442 -13.782 1.00 0.00 O ATOM 957 CB LEU A 60 -16.947 9.448 -10.646 1.00 0.00 C ATOM 958 CG LEU A 60 -17.124 8.283 -9.662 1.00 0.00 C ATOM 959 CD1 LEU A 60 -15.891 7.402 -9.568 1.00 0.00 C ATOM 960 CD2 LEU A 60 -17.382 8.841 -8.271 1.00 0.00 C ATOM 0 H LEU A 60 -15.244 10.559 -12.309 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.606 7.941 -12.176 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -16.134 10.083 -10.294 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.852 10.055 -10.636 1.00 0.00 H new ATOM 0 HG LEU A 60 -17.956 7.684 -10.031 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -16.074 6.595 -8.858 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -15.670 6.980 -10.548 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -15.043 7.998 -9.230 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -17.509 8.019 -7.567 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -16.536 9.456 -7.963 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -18.286 9.449 -8.285 1.00 0.00 H new ATOM 972 N GLU A 61 -18.924 8.790 -12.929 1.00 0.00 N ATOM 973 CA GLU A 61 -20.113 9.053 -13.761 1.00 0.00 C ATOM 974 C GLU A 61 -20.783 10.413 -13.459 1.00 0.00 C ATOM 975 O GLU A 61 -21.482 10.968 -14.310 1.00 0.00 O ATOM 976 CB GLU A 61 -21.119 7.904 -13.573 1.00 0.00 C ATOM 977 CG GLU A 61 -20.632 6.530 -14.073 1.00 0.00 C ATOM 978 CD GLU A 61 -20.632 6.355 -15.609 1.00 0.00 C ATOM 979 OE1 GLU A 61 -20.832 7.333 -16.370 1.00 0.00 O ATOM 980 OE2 GLU A 61 -20.438 5.204 -16.073 1.00 0.00 O ATOM 0 H GLU A 61 -19.055 8.027 -12.264 1.00 0.00 H new ATOM 0 HA GLU A 61 -19.782 9.106 -14.798 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -21.363 7.824 -12.514 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -22.042 8.159 -14.095 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -19.620 6.364 -13.704 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -21.262 5.756 -13.634 1.00 0.00 H new ATOM 987 N ASP A 62 -20.545 10.977 -12.269 1.00 0.00 N ATOM 988 CA ASP A 62 -20.974 12.333 -11.878 1.00 0.00 C ATOM 989 C ASP A 62 -20.046 13.441 -12.422 1.00 0.00 C ATOM 990 O ASP A 62 -20.471 14.590 -12.568 1.00 0.00 O ATOM 991 CB ASP A 62 -21.039 12.404 -10.343 1.00 0.00 C ATOM 992 CG ASP A 62 -21.532 13.768 -9.828 1.00 0.00 C ATOM 993 OD1 ASP A 62 -22.731 14.087 -10.013 1.00 0.00 O ATOM 994 OD2 ASP A 62 -20.734 14.506 -9.202 1.00 0.00 O ATOM 0 H ASP A 62 -20.036 10.494 -11.529 1.00 0.00 H new ATOM 0 HA ASP A 62 -21.955 12.513 -12.318 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -21.702 11.621 -9.976 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -20.050 12.202 -9.933 1.00 0.00 H new ATOM 999 N GLY A 63 -18.787 13.103 -12.731 1.00 0.00 N ATOM 1000 CA GLY A 63 -17.767 14.023 -13.255 1.00 0.00 C ATOM 1001 C GLY A 63 -16.570 14.251 -12.319 1.00 0.00 C ATOM 1002 O GLY A 63 -15.631 14.952 -12.704 1.00 0.00 O ATOM 0 H GLY A 63 -18.439 12.151 -12.620 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -17.400 13.635 -14.205 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -18.236 14.984 -13.464 1.00 0.00 H new ATOM 1006 N SER A 64 -16.582 13.680 -11.106 1.00 0.00 N ATOM 1007 CA SER A 64 -15.454 13.728 -10.158 1.00 0.00 C ATOM 1008 C SER A 64 -14.176 13.151 -10.788 1.00 0.00 C ATOM 1009 O SER A 64 -14.234 12.121 -11.466 1.00 0.00 O ATOM 1010 CB SER A 64 -15.780 12.954 -8.867 1.00 0.00 C ATOM 1011 OG SER A 64 -17.088 13.233 -8.389 1.00 0.00 O ATOM 0 H SER A 64 -17.386 13.164 -10.749 1.00 0.00 H new ATOM 0 HA SER A 64 -15.287 14.776 -9.911 1.00 0.00 H new ATOM 0 HB2 SER A 64 -15.684 11.884 -9.053 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.052 13.211 -8.098 1.00 0.00 H new ATOM 0 HG SER A 64 -17.253 12.720 -7.570 1.00 0.00 H new ATOM 1017 N LEU A 65 -13.026 13.788 -10.540 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.733 13.448 -11.152 1.00 0.00 C ATOM 1019 C LEU A 65 -10.671 13.252 -10.057 1.00 0.00 C ATOM 1020 O LEU A 65 -10.479 14.114 -9.196 1.00 0.00 O ATOM 1021 CB LEU A 65 -11.340 14.560 -12.151 1.00 0.00 C ATOM 1022 CG LEU A 65 -10.477 14.147 -13.362 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -9.248 13.308 -13.017 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.303 13.375 -14.389 1.00 0.00 C ATOM 0 H LEU A 65 -12.965 14.574 -9.892 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.808 12.510 -11.701 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.256 15.014 -12.528 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.803 15.333 -11.602 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.122 15.094 -13.769 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -8.704 13.066 -13.930 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -8.599 13.872 -12.347 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -9.562 12.386 -12.527 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.669 13.097 -15.231 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -11.708 12.475 -13.927 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -12.122 14.002 -14.743 1.00 0.00 H new ATOM 1036 N ILE A 66 -10.018 12.092 -10.089 1.00 0.00 N ATOM 1037 CA ILE A 66 -9.096 11.567 -9.071 1.00 0.00 C ATOM 1038 C ILE A 66 -7.866 10.975 -9.788 1.00 0.00 C ATOM 1039 O ILE A 66 -7.970 10.502 -10.926 1.00 0.00 O ATOM 1040 CB ILE A 66 -9.834 10.510 -8.195 1.00 0.00 C ATOM 1041 CG1 ILE A 66 -11.185 11.017 -7.615 1.00 0.00 C ATOM 1042 CG2 ILE A 66 -8.928 10.044 -7.038 1.00 0.00 C ATOM 1043 CD1 ILE A 66 -12.121 9.917 -7.092 1.00 0.00 C ATOM 0 H ILE A 66 -10.122 11.449 -10.874 1.00 0.00 H new ATOM 0 HA ILE A 66 -8.756 12.358 -8.403 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.062 9.678 -8.861 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -10.976 11.712 -6.802 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.707 11.580 -8.389 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.458 9.306 -6.436 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.020 9.597 -7.444 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -8.664 10.899 -6.415 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -13.036 10.369 -6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -12.367 9.233 -7.904 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.625 9.367 -6.292 1.00 0.00 H new ATOM 1055 N ARG A 67 -6.689 10.990 -9.144 1.00 0.00 N ATOM 1056 CA ARG A 67 -5.428 10.448 -9.687 1.00 0.00 C ATOM 1057 C ARG A 67 -4.679 9.623 -8.637 1.00 0.00 C ATOM 1058 O ARG A 67 -4.181 10.157 -7.644 1.00 0.00 O ATOM 1059 CB ARG A 67 -4.559 11.591 -10.249 1.00 0.00 C ATOM 1060 CG ARG A 67 -5.186 12.191 -11.518 1.00 0.00 C ATOM 1061 CD ARG A 67 -4.251 13.183 -12.214 1.00 0.00 C ATOM 1062 NE ARG A 67 -4.713 13.452 -13.591 1.00 0.00 N ATOM 1063 CZ ARG A 67 -4.133 14.235 -14.482 1.00 0.00 C ATOM 1064 NH1 ARG A 67 -3.071 14.938 -14.201 1.00 0.00 N ATOM 1065 NH2 ARG A 67 -4.601 14.312 -15.694 1.00 0.00 N ATOM 0 H ARG A 67 -6.582 11.387 -8.211 1.00 0.00 H new ATOM 0 HA ARG A 67 -5.664 9.770 -10.507 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -4.443 12.369 -9.494 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -3.561 11.216 -10.475 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -5.440 11.388 -12.210 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -6.117 12.694 -11.258 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -4.213 14.114 -11.649 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -3.238 12.782 -12.236 1.00 0.00 H new ATOM 0 HE ARG A 67 -5.570 12.984 -13.884 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -2.662 14.893 -13.268 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -2.649 15.532 -14.915 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -5.420 13.766 -15.960 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -4.149 14.919 -16.378 1.00 0.00 H new ATOM 1079 N ALA A 68 -4.606 8.314 -8.872 1.00 0.00 N ATOM 1080 CA ALA A 68 -4.031 7.315 -7.967 1.00 0.00 C ATOM 1081 C ALA A 68 -3.315 6.199 -8.752 1.00 0.00 C ATOM 1082 O ALA A 68 -3.460 6.089 -9.973 1.00 0.00 O ATOM 1083 CB ALA A 68 -5.170 6.741 -7.110 1.00 0.00 C ATOM 0 H ALA A 68 -4.961 7.901 -9.735 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.281 7.782 -7.329 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -4.769 5.993 -6.426 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -5.635 7.544 -6.538 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -5.915 6.278 -7.757 1.00 0.00 H new ATOM 1089 N THR A 69 -2.542 5.357 -8.063 1.00 0.00 N ATOM 1090 CA THR A 69 -1.955 4.151 -8.674 1.00 0.00 C ATOM 1091 C THR A 69 -2.925 2.968 -8.658 1.00 0.00 C ATOM 1092 O THR A 69 -3.861 2.910 -7.857 1.00 0.00 O ATOM 1093 CB THR A 69 -0.644 3.724 -8.003 1.00 0.00 C ATOM 1094 OG1 THR A 69 -0.841 3.356 -6.661 1.00 0.00 O ATOM 1095 CG2 THR A 69 0.412 4.823 -8.024 1.00 0.00 C ATOM 0 H THR A 69 -2.305 5.484 -7.079 1.00 0.00 H new ATOM 0 HA THR A 69 -1.743 4.430 -9.706 1.00 0.00 H new ATOM 0 HB THR A 69 -0.294 2.871 -8.585 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.682 3.740 -6.337 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.319 4.466 -7.536 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.637 5.091 -9.056 1.00 0.00 H new ATOM 0 HG23 THR A 69 0.036 5.699 -7.495 1.00 0.00 H new ATOM 1103 N LYS A 70 -2.647 1.968 -9.505 1.00 0.00 N ATOM 1104 CA LYS A 70 -3.381 0.682 -9.546 1.00 0.00 C ATOM 1105 C LYS A 70 -3.183 -0.211 -8.314 1.00 0.00 C ATOM 1106 O LYS A 70 -3.867 -1.220 -8.169 1.00 0.00 O ATOM 1107 CB LYS A 70 -3.023 -0.092 -10.828 1.00 0.00 C ATOM 1108 CG LYS A 70 -3.879 0.388 -12.006 1.00 0.00 C ATOM 1109 CD LYS A 70 -3.403 -0.151 -13.364 1.00 0.00 C ATOM 1110 CE LYS A 70 -3.675 -1.628 -13.653 1.00 0.00 C ATOM 1111 NZ LYS A 70 -2.647 -2.550 -13.085 1.00 0.00 N ATOM 0 H LYS A 70 -1.896 2.024 -10.193 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.438 0.949 -9.543 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.967 0.046 -11.059 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -3.178 -1.159 -10.670 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -4.912 0.082 -11.844 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -3.870 1.478 -12.032 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.874 0.441 -14.149 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -2.329 0.018 -13.439 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.652 -1.894 -13.249 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -3.725 -1.775 -14.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -2.630 -3.432 -13.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -1.712 -2.097 -13.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -2.882 -2.764 -12.095 1.00 0.00 H new ATOM 1125 N ASP A 71 -2.264 0.161 -7.428 1.00 0.00 N ATOM 1126 CA ASP A 71 -1.905 -0.582 -6.219 1.00 0.00 C ATOM 1127 C ASP A 71 -2.567 0.001 -4.963 1.00 0.00 C ATOM 1128 O ASP A 71 -2.568 -0.652 -3.917 1.00 0.00 O ATOM 1129 CB ASP A 71 -0.380 -0.552 -6.058 1.00 0.00 C ATOM 1130 CG ASP A 71 0.345 -1.311 -7.180 1.00 0.00 C ATOM 1131 OD1 ASP A 71 0.364 -2.565 -7.146 1.00 0.00 O ATOM 1132 OD2 ASP A 71 0.909 -0.657 -8.090 1.00 0.00 O ATOM 0 H ASP A 71 -1.727 1.021 -7.534 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.264 -1.605 -6.329 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.040 0.483 -6.045 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.111 -0.988 -5.096 1.00 0.00 H new ATOM 1137 N HIS A 72 -3.141 1.211 -5.044 1.00 0.00 N ATOM 1138 CA HIS A 72 -3.924 1.750 -3.938 1.00 0.00 C ATOM 1139 C HIS A 72 -5.307 1.070 -3.958 1.00 0.00 C ATOM 1140 O HIS A 72 -5.944 1.003 -5.017 1.00 0.00 O ATOM 1141 CB HIS A 72 -4.071 3.273 -4.063 1.00 0.00 C ATOM 1142 CG HIS A 72 -4.396 3.921 -2.733 1.00 0.00 C ATOM 1143 ND1 HIS A 72 -5.373 3.570 -1.825 1.00 0.00 N ATOM 1144 CD2 HIS A 72 -3.644 4.883 -2.124 1.00 0.00 C ATOM 1145 CE1 HIS A 72 -5.182 4.284 -0.703 1.00 0.00 C ATOM 1146 NE2 HIS A 72 -4.132 5.100 -0.835 1.00 0.00 N ATOM 0 H HIS A 72 -3.075 1.824 -5.857 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.419 1.549 -2.993 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -3.146 3.696 -4.456 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.858 3.504 -4.781 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -6.114 2.886 -1.979 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.804 5.395 -2.569 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.793 4.209 0.184 1.00 0.00 H new ATOM 1154 N LYS A 73 -5.792 0.572 -2.814 1.00 0.00 N ATOM 1155 CA LYS A 73 -7.153 0.025 -2.713 1.00 0.00 C ATOM 1156 C LYS A 73 -8.164 1.114 -2.362 1.00 0.00 C ATOM 1157 O LYS A 73 -7.811 2.202 -1.905 1.00 0.00 O ATOM 1158 CB LYS A 73 -7.240 -1.169 -1.740 1.00 0.00 C ATOM 1159 CG LYS A 73 -6.251 -2.311 -2.024 1.00 0.00 C ATOM 1160 CD LYS A 73 -4.959 -2.173 -1.205 1.00 0.00 C ATOM 1161 CE LYS A 73 -4.057 -3.392 -1.415 1.00 0.00 C ATOM 1162 NZ LYS A 73 -2.821 -3.283 -0.596 1.00 0.00 N ATOM 0 H LYS A 73 -5.262 0.536 -1.943 1.00 0.00 H new ATOM 0 HA LYS A 73 -7.411 -0.362 -3.699 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -7.071 -0.806 -0.726 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -8.253 -1.570 -1.770 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -6.725 -3.266 -1.795 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -6.007 -2.323 -3.086 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.430 -1.267 -1.500 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -5.201 -2.071 -0.147 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -4.597 -4.300 -1.147 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -3.793 -3.477 -2.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -2.225 -4.120 -0.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -2.297 -2.428 -0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -3.076 -3.225 0.411 1.00 0.00 H new ATOM 1176 N PHE A 74 -9.440 0.821 -2.553 1.00 0.00 N ATOM 1177 CA PHE A 74 -10.533 1.714 -2.185 1.00 0.00 C ATOM 1178 C PHE A 74 -11.662 0.893 -1.554 1.00 0.00 C ATOM 1179 O PHE A 74 -11.997 -0.196 -2.021 1.00 0.00 O ATOM 1180 CB PHE A 74 -10.995 2.503 -3.417 1.00 0.00 C ATOM 1181 CG PHE A 74 -10.027 3.554 -3.953 1.00 0.00 C ATOM 1182 CD1 PHE A 74 -8.927 3.189 -4.761 1.00 0.00 C ATOM 1183 CD2 PHE A 74 -10.252 4.917 -3.670 1.00 0.00 C ATOM 1184 CE1 PHE A 74 -8.055 4.175 -5.258 1.00 0.00 C ATOM 1185 CE2 PHE A 74 -9.386 5.902 -4.180 1.00 0.00 C ATOM 1186 CZ PHE A 74 -8.283 5.530 -4.969 1.00 0.00 C ATOM 0 H PHE A 74 -9.753 -0.054 -2.973 1.00 0.00 H new ATOM 0 HA PHE A 74 -10.201 2.443 -1.445 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -11.206 1.794 -4.217 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -11.935 2.998 -3.173 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -8.755 2.149 -4.998 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -11.094 5.207 -3.058 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -7.208 3.889 -5.864 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -9.569 6.945 -3.965 1.00 0.00 H new ATOM 0 HZ PHE A 74 -7.613 6.285 -5.352 1.00 0.00 H new ATOM 1196 N MET A 75 -12.206 1.403 -0.448 1.00 0.00 N ATOM 1197 CA MET A 75 -13.272 0.772 0.324 1.00 0.00 C ATOM 1198 C MET A 75 -14.603 0.908 -0.429 1.00 0.00 C ATOM 1199 O MET A 75 -15.218 1.977 -0.483 1.00 0.00 O ATOM 1200 CB MET A 75 -13.302 1.388 1.728 1.00 0.00 C ATOM 1201 CG MET A 75 -14.166 0.590 2.707 1.00 0.00 C ATOM 1202 SD MET A 75 -13.981 1.119 4.434 1.00 0.00 S ATOM 1203 CE MET A 75 -14.921 2.666 4.404 1.00 0.00 C ATOM 0 H MET A 75 -11.906 2.295 -0.054 1.00 0.00 H new ATOM 0 HA MET A 75 -13.091 -0.296 0.444 1.00 0.00 H new ATOM 0 HB2 MET A 75 -12.285 1.449 2.115 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.681 2.408 1.664 1.00 0.00 H new ATOM 0 HG2 MET A 75 -15.212 0.685 2.416 1.00 0.00 H new ATOM 0 HG3 MET A 75 -13.908 -0.466 2.629 1.00 0.00 H new ATOM 0 HE1 MET A 75 -14.473 3.377 5.098 1.00 0.00 H new ATOM 0 HE2 MET A 75 -14.904 3.082 3.397 1.00 0.00 H new ATOM 0 HE3 MET A 75 -15.952 2.471 4.699 1.00 0.00 H new ATOM 1213 N THR A 76 -15.004 -0.186 -1.072 1.00 0.00 N ATOM 1214 CA THR A 76 -16.239 -0.287 -1.867 1.00 0.00 C ATOM 1215 C THR A 76 -17.495 -0.117 -1.013 1.00 0.00 C ATOM 1216 O THR A 76 -17.430 -0.101 0.218 1.00 0.00 O ATOM 1217 CB THR A 76 -16.310 -1.633 -2.603 1.00 0.00 C ATOM 1218 OG1 THR A 76 -16.162 -2.692 -1.689 1.00 0.00 O ATOM 1219 CG2 THR A 76 -15.215 -1.750 -3.654 1.00 0.00 C ATOM 0 H THR A 76 -14.469 -1.054 -1.058 1.00 0.00 H new ATOM 0 HA THR A 76 -16.205 0.527 -2.591 1.00 0.00 H new ATOM 0 HB THR A 76 -17.282 -1.685 -3.093 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.216 -2.788 -1.450 1.00 0.00 H new ATOM 0 HG21 THR A 76 -15.294 -2.714 -4.156 1.00 0.00 H new ATOM 0 HG22 THR A 76 -15.326 -0.950 -4.386 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.240 -1.670 -3.174 1.00 0.00 H new ATOM 1227 N VAL A 77 -18.665 -0.042 -1.653 1.00 0.00 N ATOM 1228 CA VAL A 77 -19.964 -0.011 -0.954 1.00 0.00 C ATOM 1229 C VAL A 77 -20.199 -1.181 0.019 1.00 0.00 C ATOM 1230 O VAL A 77 -20.894 -1.010 1.021 1.00 0.00 O ATOM 1231 CB VAL A 77 -21.145 0.066 -1.940 1.00 0.00 C ATOM 1232 CG1 VAL A 77 -21.223 1.465 -2.543 1.00 0.00 C ATOM 1233 CG2 VAL A 77 -21.077 -0.973 -3.069 1.00 0.00 C ATOM 0 H VAL A 77 -18.744 -0.001 -2.669 1.00 0.00 H new ATOM 0 HA VAL A 77 -19.916 0.898 -0.355 1.00 0.00 H new ATOM 0 HB VAL A 77 -22.041 -0.159 -1.362 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -22.060 1.515 -3.240 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -21.369 2.196 -1.748 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -20.296 1.685 -3.073 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -21.942 -0.857 -3.723 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -20.164 -0.825 -3.645 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -21.077 -1.976 -2.641 1.00 0.00 H new ATOM 1243 N ASP A 78 -19.603 -2.353 -0.238 1.00 0.00 N ATOM 1244 CA ASP A 78 -19.651 -3.522 0.657 1.00 0.00 C ATOM 1245 C ASP A 78 -18.599 -3.479 1.787 1.00 0.00 C ATOM 1246 O ASP A 78 -18.635 -4.307 2.701 1.00 0.00 O ATOM 1247 CB ASP A 78 -19.465 -4.803 -0.171 1.00 0.00 C ATOM 1248 CG ASP A 78 -20.684 -5.103 -1.054 1.00 0.00 C ATOM 1249 OD1 ASP A 78 -21.762 -5.438 -0.504 1.00 0.00 O ATOM 1250 OD2 ASP A 78 -20.569 -5.034 -2.301 1.00 0.00 O ATOM 0 H ASP A 78 -19.064 -2.520 -1.088 1.00 0.00 H new ATOM 0 HA ASP A 78 -20.627 -3.508 1.142 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -18.579 -4.703 -0.799 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -19.288 -5.644 0.499 1.00 0.00 H new ATOM 1255 N GLY A 79 -17.648 -2.540 1.728 1.00 0.00 N ATOM 1256 CA GLY A 79 -16.531 -2.422 2.672 1.00 0.00 C ATOM 1257 C GLY A 79 -15.282 -3.215 2.262 1.00 0.00 C ATOM 1258 O GLY A 79 -14.278 -3.180 2.974 1.00 0.00 O ATOM 0 H GLY A 79 -17.634 -1.822 1.003 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -16.264 -1.370 2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -16.860 -2.764 3.653 1.00 0.00 H new ATOM 1262 N GLN A 80 -15.314 -3.922 1.123 1.00 0.00 N ATOM 1263 CA GLN A 80 -14.153 -4.628 0.570 1.00 0.00 C ATOM 1264 C GLN A 80 -13.114 -3.608 0.093 1.00 0.00 C ATOM 1265 O GLN A 80 -13.452 -2.695 -0.666 1.00 0.00 O ATOM 1266 CB GLN A 80 -14.581 -5.542 -0.597 1.00 0.00 C ATOM 1267 CG GLN A 80 -15.548 -6.671 -0.208 1.00 0.00 C ATOM 1268 CD GLN A 80 -14.813 -7.868 0.388 1.00 0.00 C ATOM 1269 OE1 GLN A 80 -14.502 -8.844 -0.286 1.00 0.00 O ATOM 1270 NE2 GLN A 80 -14.477 -7.841 1.661 1.00 0.00 N ATOM 0 H GLN A 80 -16.156 -4.020 0.555 1.00 0.00 H new ATOM 0 HA GLN A 80 -13.713 -5.252 1.348 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -15.050 -4.929 -1.367 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -13.689 -5.983 -1.041 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -16.274 -6.295 0.513 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -16.107 -6.989 -1.088 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -14.727 -7.038 2.238 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -13.967 -8.624 2.070 1.00 0.00 H new ATOM 1279 N MET A 81 -11.862 -3.776 0.526 1.00 0.00 N ATOM 1280 CA MET A 81 -10.722 -2.919 0.177 1.00 0.00 C ATOM 1281 C MET A 81 -9.942 -3.540 -0.994 1.00 0.00 C ATOM 1282 O MET A 81 -9.023 -4.338 -0.806 1.00 0.00 O ATOM 1283 CB MET A 81 -9.874 -2.616 1.431 1.00 0.00 C ATOM 1284 CG MET A 81 -9.186 -3.821 2.103 1.00 0.00 C ATOM 1285 SD MET A 81 -9.461 -4.010 3.888 1.00 0.00 S ATOM 1286 CE MET A 81 -11.073 -4.846 3.882 1.00 0.00 C ATOM 0 H MET A 81 -11.603 -4.539 1.151 1.00 0.00 H new ATOM 0 HA MET A 81 -11.066 -1.947 -0.177 1.00 0.00 H new ATOM 0 HB2 MET A 81 -9.105 -1.893 1.157 1.00 0.00 H new ATOM 0 HB3 MET A 81 -10.516 -2.134 2.169 1.00 0.00 H new ATOM 0 HG2 MET A 81 -9.525 -4.730 1.606 1.00 0.00 H new ATOM 0 HG3 MET A 81 -8.113 -3.744 1.928 1.00 0.00 H new ATOM 0 HE1 MET A 81 -11.388 -5.036 4.908 1.00 0.00 H new ATOM 0 HE2 MET A 81 -11.810 -4.213 3.388 1.00 0.00 H new ATOM 0 HE3 MET A 81 -10.990 -5.792 3.347 1.00 0.00 H new ATOM 1296 N LEU A 82 -10.350 -3.206 -2.223 1.00 0.00 N ATOM 1297 CA LEU A 82 -9.837 -3.811 -3.462 1.00 0.00 C ATOM 1298 C LEU A 82 -9.095 -2.760 -4.312 1.00 0.00 C ATOM 1299 O LEU A 82 -9.477 -1.586 -4.280 1.00 0.00 O ATOM 1300 CB LEU A 82 -11.004 -4.438 -4.258 1.00 0.00 C ATOM 1301 CG LEU A 82 -11.938 -5.375 -3.462 1.00 0.00 C ATOM 1302 CD1 LEU A 82 -13.056 -5.896 -4.363 1.00 0.00 C ATOM 1303 CD2 LEU A 82 -11.215 -6.583 -2.859 1.00 0.00 C ATOM 0 H LEU A 82 -11.060 -2.493 -2.390 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.126 -4.596 -3.206 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.604 -3.632 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.587 -4.998 -5.095 1.00 0.00 H new ATOM 0 HG LEU A 82 -12.335 -4.774 -2.644 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -13.708 -6.556 -3.790 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -13.636 -5.056 -4.746 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -12.623 -6.449 -5.197 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -11.929 -7.199 -2.313 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -10.763 -7.172 -3.657 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -10.438 -6.239 -2.177 1.00 0.00 H new ATOM 1315 N PRO A 83 -8.043 -3.137 -5.065 1.00 0.00 N ATOM 1316 CA PRO A 83 -7.303 -2.215 -5.928 1.00 0.00 C ATOM 1317 C PRO A 83 -8.184 -1.684 -7.059 1.00 0.00 C ATOM 1318 O PRO A 83 -9.032 -2.404 -7.587 1.00 0.00 O ATOM 1319 CB PRO A 83 -6.110 -3.009 -6.469 1.00 0.00 C ATOM 1320 CG PRO A 83 -6.594 -4.455 -6.409 1.00 0.00 C ATOM 1321 CD PRO A 83 -7.492 -4.481 -5.176 1.00 0.00 C ATOM 0 HA PRO A 83 -6.971 -1.336 -5.376 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -5.857 -2.711 -7.487 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -5.218 -2.858 -5.862 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -7.141 -4.732 -7.310 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -5.762 -5.153 -6.314 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -8.284 -5.222 -5.283 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -6.925 -4.747 -4.284 1.00 0.00 H new ATOM 1329 N ILE A 84 -7.953 -0.440 -7.485 1.00 0.00 N ATOM 1330 CA ILE A 84 -8.720 0.186 -8.576 1.00 0.00 C ATOM 1331 C ILE A 84 -8.665 -0.582 -9.911 1.00 0.00 C ATOM 1332 O ILE A 84 -9.624 -0.559 -10.687 1.00 0.00 O ATOM 1333 CB ILE A 84 -8.326 1.669 -8.707 1.00 0.00 C ATOM 1334 CG1 ILE A 84 -9.284 2.371 -9.682 1.00 0.00 C ATOM 1335 CG2 ILE A 84 -6.865 1.840 -9.139 1.00 0.00 C ATOM 1336 CD1 ILE A 84 -9.426 3.863 -9.412 1.00 0.00 C ATOM 0 H ILE A 84 -7.233 0.164 -7.088 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.774 0.134 -8.302 1.00 0.00 H new ATOM 0 HB ILE A 84 -8.413 2.135 -7.725 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.926 2.225 -10.701 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -10.266 1.902 -9.618 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.631 2.902 -9.219 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.211 1.379 -8.399 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.713 1.361 -10.107 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -10.116 4.299 -10.134 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -9.812 4.015 -8.404 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -8.452 4.344 -9.504 1.00 0.00 H new ATOM 1348 N ASP A 85 -7.589 -1.343 -10.138 1.00 0.00 N ATOM 1349 CA ASP A 85 -7.466 -2.306 -11.241 1.00 0.00 C ATOM 1350 C ASP A 85 -8.595 -3.352 -11.246 1.00 0.00 C ATOM 1351 O ASP A 85 -9.106 -3.721 -12.306 1.00 0.00 O ATOM 1352 CB ASP A 85 -6.113 -3.016 -11.107 1.00 0.00 C ATOM 1353 CG ASP A 85 -5.923 -4.139 -12.142 1.00 0.00 C ATOM 1354 OD1 ASP A 85 -5.917 -3.849 -13.361 1.00 0.00 O ATOM 1355 OD2 ASP A 85 -5.726 -5.309 -11.735 1.00 0.00 O ATOM 0 H ASP A 85 -6.759 -1.307 -9.546 1.00 0.00 H new ATOM 0 HA ASP A 85 -7.539 -1.758 -12.180 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -5.312 -2.285 -11.219 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -6.025 -3.434 -10.104 1.00 0.00 H new ATOM 1360 N GLU A 86 -9.014 -3.803 -10.060 1.00 0.00 N ATOM 1361 CA GLU A 86 -10.134 -4.734 -9.905 1.00 0.00 C ATOM 1362 C GLU A 86 -11.472 -3.986 -9.984 1.00 0.00 C ATOM 1363 O GLU A 86 -12.399 -4.469 -10.628 1.00 0.00 O ATOM 1364 CB GLU A 86 -10.006 -5.495 -8.569 1.00 0.00 C ATOM 1365 CG GLU A 86 -10.815 -6.801 -8.513 1.00 0.00 C ATOM 1366 CD GLU A 86 -10.074 -7.980 -9.174 1.00 0.00 C ATOM 1367 OE1 GLU A 86 -9.983 -8.032 -10.425 1.00 0.00 O ATOM 1368 OE2 GLU A 86 -9.599 -8.886 -8.446 1.00 0.00 O ATOM 0 H GLU A 86 -8.583 -3.531 -9.176 1.00 0.00 H new ATOM 0 HA GLU A 86 -10.106 -5.458 -10.720 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -8.955 -5.723 -8.392 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -10.332 -4.843 -7.759 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -11.030 -7.048 -7.473 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -11.774 -6.653 -9.010 1.00 0.00 H new ATOM 1375 N ILE A 87 -11.584 -2.785 -9.396 1.00 0.00 N ATOM 1376 CA ILE A 87 -12.848 -2.033 -9.331 1.00 0.00 C ATOM 1377 C ILE A 87 -13.373 -1.699 -10.736 1.00 0.00 C ATOM 1378 O ILE A 87 -14.578 -1.779 -10.977 1.00 0.00 O ATOM 1379 CB ILE A 87 -12.676 -0.768 -8.455 1.00 0.00 C ATOM 1380 CG1 ILE A 87 -12.252 -1.184 -7.027 1.00 0.00 C ATOM 1381 CG2 ILE A 87 -13.987 0.036 -8.406 1.00 0.00 C ATOM 1382 CD1 ILE A 87 -11.802 -0.045 -6.110 1.00 0.00 C ATOM 0 H ILE A 87 -10.800 -2.307 -8.952 1.00 0.00 H new ATOM 0 HA ILE A 87 -13.603 -2.662 -8.859 1.00 0.00 H new ATOM 0 HB ILE A 87 -11.903 -0.136 -8.892 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -13.089 -1.697 -6.554 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -11.439 -1.906 -7.105 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -13.848 0.922 -7.786 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -14.266 0.340 -9.415 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -14.778 -0.583 -7.982 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -11.528 -0.449 -5.136 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -10.941 0.457 -6.550 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -12.617 0.669 -5.990 1.00 0.00 H new ATOM 1394 N PHE A 88 -12.475 -1.397 -11.676 1.00 0.00 N ATOM 1395 CA PHE A 88 -12.838 -1.139 -13.077 1.00 0.00 C ATOM 1396 C PHE A 88 -13.391 -2.380 -13.808 1.00 0.00 C ATOM 1397 O PHE A 88 -14.311 -2.259 -14.618 1.00 0.00 O ATOM 1398 CB PHE A 88 -11.624 -0.559 -13.815 1.00 0.00 C ATOM 1399 CG PHE A 88 -11.942 -0.063 -15.214 1.00 0.00 C ATOM 1400 CD1 PHE A 88 -12.494 1.219 -15.407 1.00 0.00 C ATOM 1401 CD2 PHE A 88 -11.718 -0.897 -16.326 1.00 0.00 C ATOM 1402 CE1 PHE A 88 -12.788 1.677 -16.705 1.00 0.00 C ATOM 1403 CE2 PHE A 88 -12.010 -0.439 -17.624 1.00 0.00 C ATOM 1404 CZ PHE A 88 -12.539 0.850 -17.814 1.00 0.00 C ATOM 0 H PHE A 88 -11.475 -1.324 -11.491 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.654 -0.416 -13.075 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -11.214 0.265 -13.231 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -10.848 -1.322 -13.877 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -12.692 1.853 -14.555 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -11.321 -1.891 -16.182 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -13.205 2.663 -16.849 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -11.828 -1.078 -18.475 1.00 0.00 H new ATOM 0 HZ PHE A 88 -12.754 1.204 -18.811 1.00 0.00 H new ATOM 1414 N GLU A 89 -12.873 -3.578 -13.512 1.00 0.00 N ATOM 1415 CA GLU A 89 -13.330 -4.839 -14.120 1.00 0.00 C ATOM 1416 C GLU A 89 -14.598 -5.398 -13.457 1.00 0.00 C ATOM 1417 O GLU A 89 -15.473 -5.933 -14.146 1.00 0.00 O ATOM 1418 CB GLU A 89 -12.218 -5.902 -14.051 1.00 0.00 C ATOM 1419 CG GLU A 89 -11.160 -5.687 -15.143 1.00 0.00 C ATOM 1420 CD GLU A 89 -10.295 -6.946 -15.347 1.00 0.00 C ATOM 1421 OE1 GLU A 89 -10.790 -7.935 -15.945 1.00 0.00 O ATOM 1422 OE2 GLU A 89 -9.106 -6.957 -14.944 1.00 0.00 O ATOM 0 H GLU A 89 -12.118 -3.703 -12.838 1.00 0.00 H new ATOM 0 HA GLU A 89 -13.572 -4.608 -15.158 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -11.742 -5.868 -13.071 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -12.656 -6.894 -14.158 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -11.651 -5.426 -16.080 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -10.522 -4.846 -14.872 1.00 0.00 H new ATOM 1429 N ARG A 90 -14.719 -5.255 -12.132 1.00 0.00 N ATOM 1430 CA ARG A 90 -15.912 -5.634 -11.356 1.00 0.00 C ATOM 1431 C ARG A 90 -17.068 -4.638 -11.514 1.00 0.00 C ATOM 1432 O ARG A 90 -18.206 -4.984 -11.197 1.00 0.00 O ATOM 1433 CB ARG A 90 -15.553 -5.739 -9.866 1.00 0.00 C ATOM 1434 CG ARG A 90 -14.445 -6.737 -9.518 1.00 0.00 C ATOM 1435 CD ARG A 90 -14.828 -8.200 -9.738 1.00 0.00 C ATOM 1436 NE ARG A 90 -14.013 -9.098 -8.896 1.00 0.00 N ATOM 1437 CZ ARG A 90 -14.190 -9.348 -7.608 1.00 0.00 C ATOM 1438 NH1 ARG A 90 -15.172 -8.828 -6.924 1.00 0.00 N ATOM 1439 NH2 ARG A 90 -13.371 -10.133 -6.968 1.00 0.00 N ATOM 0 H ARG A 90 -13.975 -4.864 -11.554 1.00 0.00 H new ATOM 0 HA ARG A 90 -16.245 -6.596 -11.746 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -15.252 -4.753 -9.513 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -16.451 -6.014 -9.313 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -13.565 -6.509 -10.119 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -14.163 -6.600 -8.474 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -15.884 -8.341 -9.508 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -14.693 -8.460 -10.788 1.00 0.00 H new ATOM 0 HE ARG A 90 -13.235 -9.574 -9.353 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -15.837 -8.204 -7.381 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -15.274 -9.045 -5.933 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -12.586 -10.560 -7.459 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -13.515 -10.320 -5.976 1.00 0.00 H new ATOM 1453 N GLU A 91 -16.783 -3.420 -11.985 1.00 0.00 N ATOM 1454 CA GLU A 91 -17.730 -2.297 -12.067 1.00 0.00 C ATOM 1455 C GLU A 91 -18.380 -1.964 -10.700 1.00 0.00 C ATOM 1456 O GLU A 91 -19.576 -1.663 -10.618 1.00 0.00 O ATOM 1457 CB GLU A 91 -18.747 -2.523 -13.210 1.00 0.00 C ATOM 1458 CG GLU A 91 -18.083 -2.822 -14.564 1.00 0.00 C ATOM 1459 CD GLU A 91 -19.129 -2.888 -15.694 1.00 0.00 C ATOM 1460 OE1 GLU A 91 -19.536 -1.819 -16.211 1.00 0.00 O ATOM 1461 OE2 GLU A 91 -19.546 -4.006 -16.084 1.00 0.00 O ATOM 0 H GLU A 91 -15.855 -3.178 -12.332 1.00 0.00 H new ATOM 0 HA GLU A 91 -17.169 -1.398 -12.324 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -19.404 -3.351 -12.944 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.375 -1.638 -13.309 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -17.348 -2.050 -14.790 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -17.545 -3.768 -14.507 1.00 0.00 H new ATOM 1468 N LEU A 92 -17.600 -2.060 -9.612 1.00 0.00 N ATOM 1469 CA LEU A 92 -18.064 -1.785 -8.240 1.00 0.00 C ATOM 1470 C LEU A 92 -18.048 -0.286 -7.891 1.00 0.00 C ATOM 1471 O LEU A 92 -17.174 0.471 -8.316 1.00 0.00 O ATOM 1472 CB LEU A 92 -17.214 -2.564 -7.218 1.00 0.00 C ATOM 1473 CG LEU A 92 -17.506 -4.072 -7.178 1.00 0.00 C ATOM 1474 CD1 LEU A 92 -16.481 -4.771 -6.283 1.00 0.00 C ATOM 1475 CD2 LEU A 92 -18.901 -4.401 -6.643 1.00 0.00 C ATOM 0 H LEU A 92 -16.619 -2.334 -9.659 1.00 0.00 H new ATOM 0 HA LEU A 92 -19.101 -2.118 -8.192 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.159 -2.415 -7.450 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -17.384 -2.146 -6.226 1.00 0.00 H new ATOM 0 HG LEU A 92 -17.447 -4.423 -8.208 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -16.690 -5.840 -6.256 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -15.479 -4.607 -6.680 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -16.542 -4.364 -5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -19.044 -5.482 -6.640 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -19.000 -4.019 -5.627 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -19.654 -3.937 -7.280 1.00 0.00 H new ATOM 1487 N ASP A 93 -19.006 0.125 -7.061 1.00 0.00 N ATOM 1488 CA ASP A 93 -19.134 1.497 -6.554 1.00 0.00 C ATOM 1489 C ASP A 93 -18.320 1.715 -5.256 1.00 0.00 C ATOM 1490 O ASP A 93 -18.055 0.763 -4.510 1.00 0.00 O ATOM 1491 CB ASP A 93 -20.617 1.793 -6.282 1.00 0.00 C ATOM 1492 CG ASP A 93 -21.581 1.357 -7.403 1.00 0.00 C ATOM 1493 OD1 ASP A 93 -21.472 1.854 -8.547 1.00 0.00 O ATOM 1494 OD2 ASP A 93 -22.474 0.517 -7.126 1.00 0.00 O ATOM 0 H ASP A 93 -19.733 -0.499 -6.712 1.00 0.00 H new ATOM 0 HA ASP A 93 -18.737 2.175 -7.310 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -20.909 1.295 -5.358 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -20.735 2.864 -6.117 1.00 0.00 H new ATOM 1499 N LEU A 94 -17.986 2.973 -4.926 1.00 0.00 N ATOM 1500 CA LEU A 94 -17.320 3.338 -3.662 1.00 0.00 C ATOM 1501 C LEU A 94 -18.267 3.964 -2.631 1.00 0.00 C ATOM 1502 O LEU A 94 -19.222 4.665 -2.977 1.00 0.00 O ATOM 1503 CB LEU A 94 -16.139 4.297 -3.904 1.00 0.00 C ATOM 1504 CG LEU A 94 -14.936 3.735 -4.676 1.00 0.00 C ATOM 1505 CD1 LEU A 94 -13.755 4.673 -4.416 1.00 0.00 C ATOM 1506 CD2 LEU A 94 -14.524 2.326 -4.245 1.00 0.00 C ATOM 0 H LEU A 94 -18.171 3.772 -5.532 1.00 0.00 H new ATOM 0 HA LEU A 94 -16.956 2.396 -3.251 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -16.513 5.167 -4.444 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -15.786 4.651 -2.936 1.00 0.00 H new ATOM 0 HG LEU A 94 -15.220 3.671 -5.726 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -12.877 4.308 -4.948 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -14.002 5.675 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -13.544 4.705 -3.347 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -13.668 2.000 -4.836 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -14.254 2.333 -3.189 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -15.356 1.640 -4.402 1.00 0.00 H new ATOM 1518 N MET A 95 -17.957 3.738 -1.351 1.00 0.00 N ATOM 1519 CA MET A 95 -18.602 4.385 -0.199 1.00 0.00 C ATOM 1520 C MET A 95 -18.210 5.876 -0.090 1.00 0.00 C ATOM 1521 O MET A 95 -17.124 6.261 -0.527 1.00 0.00 O ATOM 1522 CB MET A 95 -18.197 3.591 1.056 1.00 0.00 C ATOM 1523 CG MET A 95 -19.070 3.909 2.279 1.00 0.00 C ATOM 1524 SD MET A 95 -18.608 3.073 3.824 1.00 0.00 S ATOM 1525 CE MET A 95 -18.527 1.338 3.293 1.00 0.00 C ATOM 0 H MET A 95 -17.228 3.080 -1.077 1.00 0.00 H new ATOM 0 HA MET A 95 -19.686 4.375 -0.315 1.00 0.00 H new ATOM 0 HB2 MET A 95 -18.260 2.525 0.840 1.00 0.00 H new ATOM 0 HB3 MET A 95 -17.156 3.807 1.295 1.00 0.00 H new ATOM 0 HG2 MET A 95 -19.044 4.985 2.449 1.00 0.00 H new ATOM 0 HG3 MET A 95 -20.102 3.648 2.042 1.00 0.00 H new ATOM 0 HE1 MET A 95 -18.448 0.693 4.168 1.00 0.00 H new ATOM 0 HE2 MET A 95 -19.429 1.085 2.736 1.00 0.00 H new ATOM 0 HE3 MET A 95 -17.655 1.193 2.655 1.00 0.00 H new ATOM 1535 N ARG A 96 -19.078 6.707 0.513 1.00 0.00 N ATOM 1536 CA ARG A 96 -18.921 8.176 0.691 1.00 0.00 C ATOM 1537 C ARG A 96 -19.429 8.664 2.068 1.00 0.00 C ATOM 1538 O ARG A 96 -20.238 7.990 2.705 1.00 0.00 O ATOM 1539 CB ARG A 96 -19.663 8.899 -0.463 1.00 0.00 C ATOM 1540 CG ARG A 96 -18.854 8.971 -1.776 1.00 0.00 C ATOM 1541 CD ARG A 96 -19.735 9.251 -3.011 1.00 0.00 C ATOM 1542 NE ARG A 96 -19.341 10.484 -3.730 1.00 0.00 N ATOM 1543 CZ ARG A 96 -19.710 10.841 -4.952 1.00 0.00 C ATOM 1544 NH1 ARG A 96 -20.569 10.169 -5.659 1.00 0.00 N ATOM 1545 NH2 ARG A 96 -19.222 11.910 -5.511 1.00 0.00 N ATOM 0 H ARG A 96 -19.952 6.364 0.911 1.00 0.00 H new ATOM 0 HA ARG A 96 -17.858 8.415 0.660 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -20.605 8.385 -0.655 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -19.912 9.911 -0.145 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -18.100 9.753 -1.689 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -18.323 8.030 -1.921 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -19.676 8.403 -3.694 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -20.776 9.336 -2.698 1.00 0.00 H new ATOM 0 HE ARG A 96 -18.722 11.125 -3.234 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -20.993 9.323 -5.277 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -20.819 10.487 -6.595 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -18.546 12.485 -5.008 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -19.515 12.173 -6.452 1.00 0.00 H new ATOM 1559 N VAL A 97 -18.990 9.858 2.501 1.00 0.00 N ATOM 1560 CA VAL A 97 -19.370 10.521 3.785 1.00 0.00 C ATOM 1561 C VAL A 97 -20.425 11.622 3.618 1.00 0.00 C ATOM 1562 O VAL A 97 -21.215 11.874 4.526 1.00 0.00 O ATOM 1563 CB VAL A 97 -18.123 11.079 4.517 1.00 0.00 C ATOM 1564 CG1 VAL A 97 -17.507 12.312 3.843 1.00 0.00 C ATOM 1565 CG2 VAL A 97 -18.381 11.502 5.967 1.00 0.00 C ATOM 0 H VAL A 97 -18.336 10.418 1.955 1.00 0.00 H new ATOM 0 HA VAL A 97 -19.826 9.741 4.395 1.00 0.00 H new ATOM 0 HB VAL A 97 -17.446 10.226 4.476 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -16.640 12.643 4.414 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -17.198 12.056 2.829 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -18.245 13.113 3.806 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -17.458 11.880 6.405 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -19.140 12.284 5.988 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -18.729 10.643 6.540 1.00 0.00 H new ATOM 1575 N ASP A 98 -20.497 12.239 2.435 1.00 0.00 N ATOM 1576 CA ASP A 98 -21.436 13.325 2.096 1.00 0.00 C ATOM 1577 C ASP A 98 -22.874 12.830 1.801 1.00 0.00 C ATOM 1578 O ASP A 98 -23.739 13.620 1.414 1.00 0.00 O ATOM 1579 CB ASP A 98 -20.849 14.122 0.915 1.00 0.00 C ATOM 1580 CG ASP A 98 -19.888 15.225 1.390 1.00 0.00 C ATOM 1581 OD1 ASP A 98 -18.721 14.922 1.732 1.00 0.00 O ATOM 1582 OD2 ASP A 98 -20.302 16.409 1.418 1.00 0.00 O ATOM 0 H ASP A 98 -19.885 11.992 1.657 1.00 0.00 H new ATOM 0 HA ASP A 98 -21.543 13.971 2.968 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -20.320 13.443 0.246 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -21.660 14.569 0.340 1.00 0.00 H new ATOM 1587 N ASN A 99 -23.142 11.526 1.985 1.00 0.00 N ATOM 1588 CA ASN A 99 -24.399 10.829 1.625 1.00 0.00 C ATOM 1589 C ASN A 99 -24.737 10.968 0.134 1.00 0.00 C ATOM 1590 O ASN A 99 -25.894 10.906 -0.296 1.00 0.00 O ATOM 1591 CB ASN A 99 -25.530 11.184 2.612 1.00 0.00 C ATOM 1592 CG ASN A 99 -25.197 10.599 3.967 1.00 0.00 C ATOM 1593 OD1 ASN A 99 -25.686 9.548 4.366 1.00 0.00 O ATOM 1594 ND2 ASN A 99 -24.238 11.185 4.640 1.00 0.00 N ATOM 0 H ASN A 99 -22.460 10.896 2.408 1.00 0.00 H new ATOM 0 HA ASN A 99 -24.256 9.755 1.745 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -25.641 12.266 2.685 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -26.481 10.789 2.254 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -23.892 10.767 5.504 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -23.837 12.059 4.300 1.00 0.00 H new ATOM 1601 N LEU A 100 -23.674 11.146 -0.648 1.00 0.00 N ATOM 1602 CA LEU A 100 -23.710 11.168 -2.112 1.00 0.00 C ATOM 1603 C LEU A 100 -23.981 9.761 -2.691 1.00 0.00 C ATOM 1604 O LEU A 100 -23.673 8.756 -2.039 1.00 0.00 O ATOM 1605 CB LEU A 100 -22.385 11.753 -2.633 1.00 0.00 C ATOM 1606 CG LEU A 100 -22.313 13.288 -2.549 1.00 0.00 C ATOM 1607 CD1 LEU A 100 -20.880 13.760 -2.784 1.00 0.00 C ATOM 1608 CD2 LEU A 100 -23.195 13.965 -3.601 1.00 0.00 C ATOM 0 H LEU A 100 -22.736 11.283 -0.271 1.00 0.00 H new ATOM 0 HA LEU A 100 -24.533 11.800 -2.444 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -21.560 11.327 -2.062 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -22.246 11.447 -3.670 1.00 0.00 H new ATOM 0 HG LEU A 100 -22.664 13.561 -1.554 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -20.840 14.848 -2.722 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -20.226 13.330 -2.026 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -20.549 13.440 -3.772 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -23.112 15.047 -3.503 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -22.869 13.664 -4.597 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -24.233 13.666 -3.453 1.00 0.00 H new ATOM 1620 N PRO A 101 -24.531 9.670 -3.918 1.00 0.00 N ATOM 1621 CA PRO A 101 -24.826 8.398 -4.570 1.00 0.00 C ATOM 1622 C PRO A 101 -23.538 7.633 -4.888 1.00 0.00 C ATOM 1623 O PRO A 101 -22.491 8.222 -5.172 1.00 0.00 O ATOM 1624 CB PRO A 101 -25.626 8.754 -5.829 1.00 0.00 C ATOM 1625 CG PRO A 101 -25.175 10.177 -6.158 1.00 0.00 C ATOM 1626 CD PRO A 101 -24.878 10.784 -4.787 1.00 0.00 C ATOM 0 HA PRO A 101 -25.402 7.731 -3.928 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -25.411 8.067 -6.647 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -26.700 8.707 -5.647 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -24.293 10.180 -6.798 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -25.952 10.733 -6.683 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -24.059 11.501 -4.847 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -25.745 11.322 -4.403 1.00 0.00 H new ATOM 1634 N ASN A 102 -23.603 6.304 -4.845 1.00 0.00 N ATOM 1635 CA ASN A 102 -22.450 5.440 -5.086 1.00 0.00 C ATOM 1636 C ASN A 102 -22.391 5.065 -6.579 1.00 0.00 C ATOM 1637 O ASN A 102 -23.369 4.563 -7.137 1.00 0.00 O ATOM 1638 CB ASN A 102 -22.545 4.210 -4.168 1.00 0.00 C ATOM 1639 CG ASN A 102 -22.829 4.578 -2.718 1.00 0.00 C ATOM 1640 OD1 ASN A 102 -23.943 4.449 -2.226 1.00 0.00 O ATOM 1641 ND2 ASN A 102 -21.847 5.062 -1.997 1.00 0.00 N ATOM 0 H ASN A 102 -24.462 5.794 -4.641 1.00 0.00 H new ATOM 0 HA ASN A 102 -21.520 5.957 -4.849 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -23.333 3.550 -4.532 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -21.611 3.650 -4.220 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -22.011 5.331 -1.027 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -20.919 5.170 -2.406 1.00 0.00 H new ATOM 1648 N ILE A 103 -21.244 5.322 -7.218 1.00 0.00 N ATOM 1649 CA ILE A 103 -21.017 5.135 -8.663 1.00 0.00 C ATOM 1650 C ILE A 103 -19.597 4.628 -8.947 1.00 0.00 C ATOM 1651 O ILE A 103 -18.625 5.069 -8.325 1.00 0.00 O ATOM 1652 CB ILE A 103 -21.298 6.423 -9.474 1.00 0.00 C ATOM 1653 CG1 ILE A 103 -20.884 7.705 -8.719 1.00 0.00 C ATOM 1654 CG2 ILE A 103 -22.780 6.476 -9.882 1.00 0.00 C ATOM 1655 CD1 ILE A 103 -20.838 8.942 -9.613 1.00 0.00 C ATOM 0 H ILE A 103 -20.420 5.677 -6.732 1.00 0.00 H new ATOM 0 HA ILE A 103 -21.729 4.377 -8.990 1.00 0.00 H new ATOM 0 HB ILE A 103 -20.681 6.384 -10.372 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -21.585 7.880 -7.903 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -19.903 7.553 -8.269 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -22.968 7.386 -10.452 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -23.020 5.607 -10.495 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -23.404 6.473 -8.988 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -20.541 9.808 -9.021 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -20.116 8.785 -10.415 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -21.824 9.118 -10.042 1.00 0.00 H new ATOM 1667 N LYS A 104 -19.495 3.691 -9.894 1.00 0.00 N ATOM 1668 CA LYS A 104 -18.241 3.106 -10.386 1.00 0.00 C ATOM 1669 C LYS A 104 -17.491 4.030 -11.355 1.00 0.00 C ATOM 1670 O LYS A 104 -17.981 5.090 -11.753 1.00 0.00 O ATOM 1671 CB LYS A 104 -18.529 1.690 -10.937 1.00 0.00 C ATOM 1672 CG LYS A 104 -19.401 1.561 -12.200 1.00 0.00 C ATOM 1673 CD LYS A 104 -18.624 1.780 -13.504 1.00 0.00 C ATOM 1674 CE LYS A 104 -19.394 1.215 -14.705 1.00 0.00 C ATOM 1675 NZ LYS A 104 -18.557 1.210 -15.936 1.00 0.00 N ATOM 0 H LYS A 104 -20.316 3.303 -10.358 1.00 0.00 H new ATOM 0 HA LYS A 104 -17.541 2.998 -9.557 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -17.571 1.213 -11.144 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -19.006 1.115 -10.143 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -19.855 0.570 -12.219 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -20.215 2.284 -12.145 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -18.446 2.845 -13.651 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -17.648 1.300 -13.435 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -19.723 0.200 -14.483 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -20.291 1.810 -14.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -18.905 1.935 -16.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -17.569 1.416 -15.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -18.611 0.275 -16.389 1.00 0.00 H new ATOM 1689 N ILE A 105 -16.284 3.614 -11.730 1.00 0.00 N ATOM 1690 CA ILE A 105 -15.370 4.346 -12.622 1.00 0.00 C ATOM 1691 C ILE A 105 -15.980 4.475 -14.029 1.00 0.00 C ATOM 1692 O ILE A 105 -16.231 3.477 -14.708 1.00 0.00 O ATOM 1693 CB ILE A 105 -14.017 3.605 -12.689 1.00 0.00 C ATOM 1694 CG1 ILE A 105 -13.372 3.373 -11.305 1.00 0.00 C ATOM 1695 CG2 ILE A 105 -13.022 4.365 -13.585 1.00 0.00 C ATOM 1696 CD1 ILE A 105 -12.554 2.089 -11.246 1.00 0.00 C ATOM 0 H ILE A 105 -15.895 2.726 -11.413 1.00 0.00 H new ATOM 0 HA ILE A 105 -15.212 5.349 -12.227 1.00 0.00 H new ATOM 0 HB ILE A 105 -14.240 2.626 -13.114 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.730 4.220 -11.061 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -14.153 3.337 -10.546 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -12.076 3.825 -13.618 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -13.429 4.446 -14.593 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -12.856 5.363 -13.180 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.124 1.977 -10.251 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.199 1.237 -11.461 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -11.753 2.133 -11.984 1.00 0.00 H new ATOM 1708 N ALA A 106 -16.203 5.709 -14.476 1.00 0.00 N ATOM 1709 CA ALA A 106 -16.725 6.023 -15.806 1.00 0.00 C ATOM 1710 C ALA A 106 -15.688 5.752 -16.911 1.00 0.00 C ATOM 1711 O ALA A 106 -16.007 5.139 -17.933 1.00 0.00 O ATOM 1712 CB ALA A 106 -17.154 7.495 -15.824 1.00 0.00 C ATOM 0 H ALA A 106 -16.022 6.539 -13.911 1.00 0.00 H new ATOM 0 HA ALA A 106 -17.578 5.376 -16.010 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -17.546 7.748 -16.809 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -17.927 7.658 -15.073 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -16.294 8.127 -15.603 1.00 0.00 H new ATOM 1718 N THR A 107 -14.442 6.175 -16.677 1.00 0.00 N ATOM 1719 CA THR A 107 -13.295 6.019 -17.586 1.00 0.00 C ATOM 1720 C THR A 107 -11.983 5.906 -16.805 1.00 0.00 C ATOM 1721 O THR A 107 -11.805 6.523 -15.748 1.00 0.00 O ATOM 1722 CB THR A 107 -13.162 7.194 -18.583 1.00 0.00 C ATOM 1723 OG1 THR A 107 -13.419 8.442 -17.975 1.00 0.00 O ATOM 1724 CG2 THR A 107 -14.109 7.069 -19.775 1.00 0.00 C ATOM 0 H THR A 107 -14.191 6.656 -15.813 1.00 0.00 H new ATOM 0 HA THR A 107 -13.484 5.103 -18.145 1.00 0.00 H new ATOM 0 HB THR A 107 -12.129 7.145 -18.926 1.00 0.00 H new ATOM 0 HG1 THR A 107 -13.322 9.156 -18.640 1.00 0.00 H new ATOM 0 HG21 THR A 107 -13.971 7.921 -20.440 1.00 0.00 H new ATOM 0 HG22 THR A 107 -13.893 6.148 -20.316 1.00 0.00 H new ATOM 0 HG23 THR A 107 -15.140 7.049 -19.420 1.00 0.00 H new ATOM 1732 N ARG A 108 -11.050 5.129 -17.368 1.00 0.00 N ATOM 1733 CA ARG A 108 -9.682 4.920 -16.873 1.00 0.00 C ATOM 1734 C ARG A 108 -8.700 4.878 -18.046 1.00 0.00 C ATOM 1735 O ARG A 108 -8.994 4.287 -19.087 1.00 0.00 O ATOM 1736 CB ARG A 108 -9.643 3.631 -16.018 1.00 0.00 C ATOM 1737 CG ARG A 108 -8.232 3.194 -15.574 1.00 0.00 C ATOM 1738 CD ARG A 108 -7.566 2.217 -16.561 1.00 0.00 C ATOM 1739 NE ARG A 108 -7.829 0.810 -16.205 1.00 0.00 N ATOM 1740 CZ ARG A 108 -7.317 -0.259 -16.798 1.00 0.00 C ATOM 1741 NH1 ARG A 108 -6.571 -0.174 -17.866 1.00 0.00 N ATOM 1742 NH2 ARG A 108 -7.538 -1.450 -16.321 1.00 0.00 N ATOM 0 H ARG A 108 -11.236 4.603 -18.222 1.00 0.00 H new ATOM 0 HA ARG A 108 -9.377 5.750 -16.236 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -10.258 3.781 -15.131 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -10.097 2.820 -16.587 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -7.602 4.077 -15.464 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.295 2.724 -14.593 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -7.934 2.411 -17.568 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -6.490 2.393 -16.575 1.00 0.00 H new ATOM 0 HE ARG A 108 -8.467 0.644 -15.427 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -6.364 0.738 -18.272 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -6.195 -1.020 -18.294 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -8.109 -1.566 -15.484 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -7.140 -2.267 -16.784 1.00 0.00 H new ATOM 1756 N LYS A 109 -7.518 5.459 -17.833 1.00 0.00 N ATOM 1757 CA LYS A 109 -6.334 5.400 -18.707 1.00 0.00 C ATOM 1758 C LYS A 109 -5.057 5.623 -17.897 1.00 0.00 C ATOM 1759 O LYS A 109 -5.063 6.362 -16.912 1.00 0.00 O ATOM 1760 CB LYS A 109 -6.396 6.492 -19.799 1.00 0.00 C ATOM 1761 CG LYS A 109 -7.237 6.087 -21.022 1.00 0.00 C ATOM 1762 CD LYS A 109 -6.844 6.837 -22.306 1.00 0.00 C ATOM 1763 CE LYS A 109 -5.435 6.437 -22.776 1.00 0.00 C ATOM 1764 NZ LYS A 109 -5.116 6.988 -24.120 1.00 0.00 N ATOM 0 H LYS A 109 -7.346 6.018 -16.997 1.00 0.00 H new ATOM 0 HA LYS A 109 -6.324 4.412 -19.168 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -6.811 7.403 -19.368 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -5.383 6.726 -20.126 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -7.130 5.015 -21.189 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -8.289 6.273 -20.808 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -7.567 6.621 -23.092 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -6.879 7.912 -22.127 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.699 6.792 -22.055 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -5.357 5.350 -22.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -4.158 6.694 -24.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -5.803 6.630 -24.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -5.164 8.026 -24.090 1.00 0.00 H new ATOM 1778 N TYR A 110 -3.960 5.013 -18.336 1.00 0.00 N ATOM 1779 CA TYR A 110 -2.625 5.326 -17.830 1.00 0.00 C ATOM 1780 C TYR A 110 -2.260 6.775 -18.182 1.00 0.00 C ATOM 1781 O TYR A 110 -2.407 7.194 -19.336 1.00 0.00 O ATOM 1782 CB TYR A 110 -1.592 4.357 -18.428 1.00 0.00 C ATOM 1783 CG TYR A 110 -0.185 4.565 -17.896 1.00 0.00 C ATOM 1784 CD1 TYR A 110 0.030 4.605 -16.506 1.00 0.00 C ATOM 1785 CD2 TYR A 110 0.902 4.751 -18.773 1.00 0.00 C ATOM 1786 CE1 TYR A 110 1.312 4.834 -15.990 1.00 0.00 C ATOM 1787 CE2 TYR A 110 2.199 4.950 -18.260 1.00 0.00 C ATOM 1788 CZ TYR A 110 2.410 4.991 -16.864 1.00 0.00 C ATOM 1789 OH TYR A 110 3.660 5.204 -16.375 1.00 0.00 O ATOM 0 H TYR A 110 -3.970 4.287 -19.053 1.00 0.00 H new ATOM 0 HA TYR A 110 -2.621 5.214 -16.746 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -1.903 3.333 -18.219 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -1.583 4.472 -19.512 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -0.800 4.458 -15.831 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.741 4.741 -19.841 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.461 4.891 -14.922 1.00 0.00 H new ATOM 0 HE2 TYR A 110 3.033 5.071 -18.935 1.00 0.00 H new ATOM 0 HH TYR A 110 4.292 5.288 -17.119 1.00 0.00 H new ATOM 1799 N LEU A 111 -1.789 7.537 -17.195 1.00 0.00 N ATOM 1800 CA LEU A 111 -1.368 8.929 -17.373 1.00 0.00 C ATOM 1801 C LEU A 111 0.154 9.036 -17.409 1.00 0.00 C ATOM 1802 O LEU A 111 0.711 9.611 -18.348 1.00 0.00 O ATOM 1803 CB LEU A 111 -1.907 9.765 -16.206 1.00 0.00 C ATOM 1804 CG LEU A 111 -3.417 9.993 -16.230 1.00 0.00 C ATOM 1805 CD1 LEU A 111 -3.841 10.601 -14.895 1.00 0.00 C ATOM 1806 CD2 LEU A 111 -3.811 10.948 -17.353 1.00 0.00 C ATOM 0 H LEU A 111 -1.687 7.202 -16.237 1.00 0.00 H new ATOM 0 HA LEU A 111 -1.763 9.298 -18.320 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.642 9.272 -15.271 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -1.407 10.733 -16.209 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.912 9.037 -16.398 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -4.918 10.770 -14.898 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.583 9.918 -14.086 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -3.326 11.550 -14.747 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.891 11.092 -17.346 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.316 11.908 -17.205 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.507 10.527 -18.312 1.00 0.00 H new ATOM 1818 N GLY A 112 0.824 8.481 -16.397 1.00 0.00 N ATOM 1819 CA GLY A 112 2.283 8.492 -16.334 1.00 0.00 C ATOM 1820 C GLY A 112 2.829 8.090 -14.971 1.00 0.00 C ATOM 1821 O GLY A 112 2.300 7.198 -14.318 1.00 0.00 O ATOM 0 H GLY A 112 0.375 8.017 -15.608 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.678 7.814 -17.090 1.00 0.00 H new ATOM 0 HA3 GLY A 112 2.643 9.490 -16.582 1.00 0.00 H new ATOM 1825 N LYS A 113 3.896 8.751 -14.526 1.00 0.00 N ATOM 1826 CA LYS A 113 4.700 8.346 -13.357 1.00 0.00 C ATOM 1827 C LYS A 113 4.946 9.518 -12.401 1.00 0.00 C ATOM 1828 O LYS A 113 6.050 10.036 -12.241 1.00 0.00 O ATOM 1829 CB LYS A 113 5.973 7.660 -13.861 1.00 0.00 C ATOM 1830 CG LYS A 113 6.449 6.603 -12.855 1.00 0.00 C ATOM 1831 CD LYS A 113 7.776 5.953 -13.265 1.00 0.00 C ATOM 1832 CE LYS A 113 8.950 6.933 -13.141 1.00 0.00 C ATOM 1833 NZ LYS A 113 10.194 6.378 -13.733 1.00 0.00 N ATOM 0 H LYS A 113 4.239 9.602 -14.972 1.00 0.00 H new ATOM 0 HA LYS A 113 4.154 7.624 -12.750 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.783 7.192 -14.827 1.00 0.00 H new ATOM 0 HB3 LYS A 113 6.756 8.402 -14.015 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.563 7.065 -11.875 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.686 5.831 -12.757 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.963 5.080 -12.639 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.705 5.598 -14.293 1.00 0.00 H new ATOM 0 HE2 LYS A 113 8.697 7.869 -13.638 1.00 0.00 H new ATOM 0 HE3 LYS A 113 9.120 7.166 -12.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 10.965 7.068 -13.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 10.450 5.498 -13.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 10.039 6.179 -14.742 1.00 0.00 H new ATOM 1847 N GLN A 114 3.840 9.982 -11.843 1.00 0.00 N ATOM 1848 CA GLN A 114 3.692 11.233 -11.098 1.00 0.00 C ATOM 1849 C GLN A 114 4.068 11.085 -9.621 1.00 0.00 C ATOM 1850 O GLN A 114 4.027 9.989 -9.058 1.00 0.00 O ATOM 1851 CB GLN A 114 2.250 11.728 -11.237 1.00 0.00 C ATOM 1852 CG GLN A 114 1.886 11.638 -12.722 1.00 0.00 C ATOM 1853 CD GLN A 114 0.627 12.337 -13.122 1.00 0.00 C ATOM 1854 OE1 GLN A 114 -0.065 13.028 -12.383 1.00 0.00 O ATOM 1855 NE2 GLN A 114 0.272 12.102 -14.353 1.00 0.00 N ATOM 0 H GLN A 114 2.962 9.466 -11.899 1.00 0.00 H new ATOM 0 HA GLN A 114 4.383 11.962 -11.521 1.00 0.00 H new ATOM 0 HB2 GLN A 114 1.574 11.119 -10.637 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.158 12.753 -10.879 1.00 0.00 H new ATOM 0 HG2 GLN A 114 2.710 12.050 -13.305 1.00 0.00 H new ATOM 0 HG3 GLN A 114 1.798 10.586 -12.993 1.00 0.00 H new ATOM 0 HE21 GLN A 114 0.862 11.524 -14.952 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -0.595 12.496 -14.718 1.00 0.00 H new ATOM 1864 N ASN A 115 4.386 12.203 -8.971 1.00 0.00 N ATOM 1865 CA ASN A 115 4.613 12.274 -7.544 1.00 0.00 C ATOM 1866 C ASN A 115 3.334 11.950 -6.765 1.00 0.00 C ATOM 1867 O ASN A 115 2.356 12.702 -6.805 1.00 0.00 O ATOM 1868 CB ASN A 115 5.189 13.660 -7.189 1.00 0.00 C ATOM 1869 CG ASN A 115 6.258 13.532 -6.129 1.00 0.00 C ATOM 1870 OD1 ASN A 115 7.339 14.099 -6.228 1.00 0.00 O ATOM 1871 ND2 ASN A 115 6.040 12.726 -5.116 1.00 0.00 N ATOM 0 H ASN A 115 4.494 13.102 -9.441 1.00 0.00 H new ATOM 0 HA ASN A 115 5.344 11.520 -7.251 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.607 14.126 -8.081 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.391 14.312 -6.833 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.768 12.576 -4.418 1.00 0.00 H new ATOM 0 HD22 ASN A 115 5.142 12.250 -5.027 1.00 0.00 H new ATOM 1878 N VAL A 116 3.366 10.832 -6.039 1.00 0.00 N ATOM 1879 CA VAL A 116 2.246 10.355 -5.222 1.00 0.00 C ATOM 1880 C VAL A 116 2.692 10.164 -3.766 1.00 0.00 C ATOM 1881 O VAL A 116 3.873 9.948 -3.482 1.00 0.00 O ATOM 1882 CB VAL A 116 1.608 9.089 -5.836 1.00 0.00 C ATOM 1883 CG1 VAL A 116 0.898 9.361 -7.167 1.00 0.00 C ATOM 1884 CG2 VAL A 116 2.611 7.962 -6.101 1.00 0.00 C ATOM 0 H VAL A 116 4.183 10.222 -6.000 1.00 0.00 H new ATOM 0 HA VAL A 116 1.461 11.112 -5.215 1.00 0.00 H new ATOM 0 HB VAL A 116 0.893 8.780 -5.074 1.00 0.00 H new ATOM 0 HG11 VAL A 116 0.471 8.433 -7.548 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.103 10.090 -7.013 1.00 0.00 H new ATOM 0 HG13 VAL A 116 1.615 9.753 -7.888 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.091 7.106 -6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.375 8.311 -6.796 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.082 7.666 -5.164 1.00 0.00 H new ATOM 1894 N TYR A 117 1.745 10.284 -2.841 1.00 0.00 N ATOM 1895 CA TYR A 117 1.961 10.333 -1.394 1.00 0.00 C ATOM 1896 C TYR A 117 0.839 9.595 -0.642 1.00 0.00 C ATOM 1897 O TYR A 117 -0.269 9.427 -1.163 1.00 0.00 O ATOM 1898 CB TYR A 117 1.976 11.801 -0.946 1.00 0.00 C ATOM 1899 CG TYR A 117 2.854 12.744 -1.749 1.00 0.00 C ATOM 1900 CD1 TYR A 117 2.332 13.409 -2.877 1.00 0.00 C ATOM 1901 CD2 TYR A 117 4.177 12.987 -1.341 1.00 0.00 C ATOM 1902 CE1 TYR A 117 3.121 14.352 -3.567 1.00 0.00 C ATOM 1903 CE2 TYR A 117 4.962 13.934 -2.019 1.00 0.00 C ATOM 1904 CZ TYR A 117 4.427 14.646 -3.112 1.00 0.00 C ATOM 1905 OH TYR A 117 5.165 15.618 -3.715 1.00 0.00 O ATOM 0 H TYR A 117 0.758 10.353 -3.089 1.00 0.00 H new ATOM 0 HA TYR A 117 2.910 9.847 -1.166 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.954 12.178 -0.976 1.00 0.00 H new ATOM 0 HB3 TYR A 117 2.298 11.837 0.095 1.00 0.00 H new ATOM 0 HD1 TYR A 117 1.328 13.196 -3.213 1.00 0.00 H new ATOM 0 HD2 TYR A 117 4.591 12.444 -0.504 1.00 0.00 H new ATOM 0 HE1 TYR A 117 2.728 14.849 -4.442 1.00 0.00 H new ATOM 0 HE2 TYR A 117 5.978 14.117 -1.702 1.00 0.00 H new ATOM 0 HH TYR A 117 5.931 15.847 -3.148 1.00 0.00 H new ATOM 1915 N ASP A 118 1.107 9.184 0.595 1.00 0.00 N ATOM 1916 CA ASP A 118 0.142 8.500 1.458 1.00 0.00 C ATOM 1917 C ASP A 118 0.454 8.739 2.947 1.00 0.00 C ATOM 1918 O ASP A 118 1.601 8.662 3.390 1.00 0.00 O ATOM 1919 CB ASP A 118 0.067 6.999 1.119 1.00 0.00 C ATOM 1920 CG ASP A 118 1.352 6.202 1.422 1.00 0.00 C ATOM 1921 OD1 ASP A 118 2.308 6.240 0.607 1.00 0.00 O ATOM 1922 OD2 ASP A 118 1.371 5.459 2.434 1.00 0.00 O ATOM 0 H ASP A 118 2.017 9.319 1.036 1.00 0.00 H new ATOM 0 HA ASP A 118 -0.843 8.926 1.267 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -0.758 6.556 1.676 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -0.169 6.891 0.060 1.00 0.00 H new ATOM 1927 N ILE A 119 -0.576 9.056 3.734 1.00 0.00 N ATOM 1928 CA ILE A 119 -0.450 9.224 5.189 1.00 0.00 C ATOM 1929 C ILE A 119 -0.689 7.895 5.923 1.00 0.00 C ATOM 1930 O ILE A 119 -1.389 7.005 5.429 1.00 0.00 O ATOM 1931 CB ILE A 119 -1.375 10.345 5.708 1.00 0.00 C ATOM 1932 CG1 ILE A 119 -2.861 10.110 5.366 1.00 0.00 C ATOM 1933 CG2 ILE A 119 -0.868 11.698 5.175 1.00 0.00 C ATOM 1934 CD1 ILE A 119 -3.818 11.042 6.115 1.00 0.00 C ATOM 0 H ILE A 119 -1.522 9.204 3.384 1.00 0.00 H new ATOM 0 HA ILE A 119 0.574 9.532 5.403 1.00 0.00 H new ATOM 0 HB ILE A 119 -1.333 10.345 6.797 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -3.004 10.242 4.294 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -3.119 9.076 5.597 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -1.515 12.497 5.536 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.150 11.869 5.526 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -0.879 11.687 4.085 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -4.845 10.819 5.825 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -3.704 10.894 7.189 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -3.587 12.078 5.865 1.00 0.00 H new ATOM 1946 N GLY A 120 -0.124 7.777 7.126 1.00 0.00 N ATOM 1947 CA GLY A 120 -0.305 6.643 8.030 1.00 0.00 C ATOM 1948 C GLY A 120 -1.137 7.036 9.253 1.00 0.00 C ATOM 1949 O GLY A 120 -1.156 8.200 9.660 1.00 0.00 O ATOM 0 H GLY A 120 0.493 8.493 7.509 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.796 5.827 7.500 1.00 0.00 H new ATOM 0 HA3 GLY A 120 0.668 6.273 8.353 1.00 0.00 H new ATOM 1953 N VAL A 121 -1.824 6.061 9.846 1.00 0.00 N ATOM 1954 CA VAL A 121 -2.804 6.243 10.935 1.00 0.00 C ATOM 1955 C VAL A 121 -2.691 5.056 11.916 1.00 0.00 C ATOM 1956 O VAL A 121 -2.231 3.976 11.539 1.00 0.00 O ATOM 1957 CB VAL A 121 -4.228 6.365 10.344 1.00 0.00 C ATOM 1958 CG1 VAL A 121 -5.239 6.833 11.386 1.00 0.00 C ATOM 1959 CG2 VAL A 121 -4.344 7.345 9.159 1.00 0.00 C ATOM 0 H VAL A 121 -1.715 5.083 9.577 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.596 7.162 11.483 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.442 5.354 9.997 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -6.226 6.905 10.929 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -5.271 6.118 12.208 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -4.943 7.811 11.767 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.375 7.369 8.806 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -4.048 8.343 9.482 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -3.691 7.017 8.350 1.00 0.00 H new ATOM 2037 N ASN A 126 -6.490 4.463 5.858 1.00 0.00 N ATOM 2038 CA ASN A 126 -7.661 4.954 5.128 1.00 0.00 C ATOM 2039 C ASN A 126 -8.193 6.296 5.666 1.00 0.00 C ATOM 2040 O ASN A 126 -7.882 6.704 6.791 1.00 0.00 O ATOM 2041 CB ASN A 126 -8.748 3.858 5.116 1.00 0.00 C ATOM 2042 CG ASN A 126 -9.522 3.702 6.418 1.00 0.00 C ATOM 2043 OD1 ASN A 126 -9.043 3.961 7.513 1.00 0.00 O ATOM 2044 ND2 ASN A 126 -10.768 3.293 6.336 1.00 0.00 N ATOM 0 HA ASN A 126 -7.356 5.166 4.103 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -9.454 4.077 4.315 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -8.278 2.905 4.874 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.329 3.193 7.182 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -11.174 3.075 5.426 1.00 0.00 H new ATOM 2051 N PHE A 127 -8.986 6.986 4.841 1.00 0.00 N ATOM 2052 CA PHE A 127 -9.458 8.359 5.077 1.00 0.00 C ATOM 2053 C PHE A 127 -10.462 8.806 3.998 1.00 0.00 C ATOM 2054 O PHE A 127 -10.418 8.318 2.868 1.00 0.00 O ATOM 2055 CB PHE A 127 -8.269 9.346 5.127 1.00 0.00 C ATOM 2056 CG PHE A 127 -7.196 9.119 4.073 1.00 0.00 C ATOM 2057 CD1 PHE A 127 -7.412 9.511 2.739 1.00 0.00 C ATOM 2058 CD2 PHE A 127 -5.994 8.475 4.424 1.00 0.00 C ATOM 2059 CE1 PHE A 127 -6.434 9.254 1.760 1.00 0.00 C ATOM 2060 CE2 PHE A 127 -5.019 8.215 3.445 1.00 0.00 C ATOM 2061 CZ PHE A 127 -5.238 8.609 2.116 1.00 0.00 C ATOM 0 H PHE A 127 -9.329 6.595 3.963 1.00 0.00 H new ATOM 0 HA PHE A 127 -9.967 8.365 6.041 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -8.654 10.360 5.018 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -7.807 9.284 6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -8.330 10.010 2.466 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -5.821 8.180 5.448 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -6.603 9.552 0.736 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -4.102 7.712 3.716 1.00 0.00 H new ATOM 0 HZ PHE A 127 -4.486 8.416 1.366 1.00 0.00 H new ATOM 2071 N ALA A 128 -11.343 9.760 4.323 1.00 0.00 N ATOM 2072 CA ALA A 128 -12.282 10.360 3.372 1.00 0.00 C ATOM 2073 C ALA A 128 -11.609 11.443 2.494 1.00 0.00 C ATOM 2074 O ALA A 128 -11.047 12.418 3.007 1.00 0.00 O ATOM 2075 CB ALA A 128 -13.480 10.933 4.142 1.00 0.00 C ATOM 0 H ALA A 128 -11.423 10.140 5.266 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.628 9.584 2.689 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.183 11.381 3.440 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.976 10.133 4.691 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -13.133 11.692 4.842 1.00 0.00 H new ATOM 2081 N LEU A 129 -11.688 11.289 1.169 1.00 0.00 N ATOM 2082 CA LEU A 129 -11.316 12.317 0.182 1.00 0.00 C ATOM 2083 C LEU A 129 -12.315 13.498 0.203 1.00 0.00 C ATOM 2084 O LEU A 129 -13.369 13.422 0.837 1.00 0.00 O ATOM 2085 CB LEU A 129 -11.245 11.698 -1.234 1.00 0.00 C ATOM 2086 CG LEU A 129 -10.273 10.515 -1.435 1.00 0.00 C ATOM 2087 CD1 LEU A 129 -10.156 10.185 -2.927 1.00 0.00 C ATOM 2088 CD2 LEU A 129 -8.867 10.791 -0.924 1.00 0.00 C ATOM 0 H LEU A 129 -12.020 10.426 0.738 1.00 0.00 H new ATOM 0 HA LEU A 129 -10.332 12.703 0.449 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -12.246 11.364 -1.508 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.969 12.486 -1.935 1.00 0.00 H new ATOM 0 HG LEU A 129 -10.692 9.688 -0.862 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -9.469 9.350 -3.062 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -11.137 9.915 -3.318 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.779 11.055 -3.464 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.239 9.917 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.450 11.649 -1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -8.904 11.005 0.144 1.00 0.00 H new ATOM 2100 N LYS A 130 -12.030 14.572 -0.550 1.00 0.00 N ATOM 2101 CA LYS A 130 -12.879 15.779 -0.687 1.00 0.00 C ATOM 2102 C LYS A 130 -14.381 15.550 -0.919 1.00 0.00 C ATOM 2103 O LYS A 130 -15.206 16.235 -0.315 1.00 0.00 O ATOM 2104 CB LYS A 130 -12.313 16.716 -1.774 1.00 0.00 C ATOM 2105 CG LYS A 130 -11.960 16.037 -3.117 1.00 0.00 C ATOM 2106 CD LYS A 130 -11.496 17.034 -4.193 1.00 0.00 C ATOM 2107 CE LYS A 130 -12.619 17.890 -4.796 1.00 0.00 C ATOM 2108 NZ LYS A 130 -13.366 17.169 -5.863 1.00 0.00 N ATOM 0 H LYS A 130 -11.174 14.632 -1.102 1.00 0.00 H new ATOM 0 HA LYS A 130 -12.831 16.239 0.300 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -13.041 17.504 -1.965 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -11.417 17.198 -1.383 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -11.174 15.300 -2.950 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -12.832 15.495 -3.484 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -10.746 17.695 -3.758 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -11.007 16.481 -4.995 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -13.311 18.186 -4.007 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -12.194 18.806 -5.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.919 17.851 -6.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -12.694 16.677 -6.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -14.008 16.475 -5.429 1.00 0.00 H new ATOM 2122 N ASN A 131 -14.733 14.593 -1.780 1.00 0.00 N ATOM 2123 CA ASN A 131 -16.123 14.214 -2.089 1.00 0.00 C ATOM 2124 C ASN A 131 -16.662 13.084 -1.194 1.00 0.00 C ATOM 2125 O ASN A 131 -17.831 12.714 -1.297 1.00 0.00 O ATOM 2126 CB ASN A 131 -16.178 13.771 -3.560 1.00 0.00 C ATOM 2127 CG ASN A 131 -16.290 14.927 -4.530 1.00 0.00 C ATOM 2128 OD1 ASN A 131 -15.332 15.302 -5.187 1.00 0.00 O ATOM 2129 ND2 ASN A 131 -17.454 15.523 -4.653 1.00 0.00 N ATOM 0 H ASN A 131 -14.046 14.044 -2.297 1.00 0.00 H new ATOM 0 HA ASN A 131 -16.755 15.082 -1.901 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -15.282 13.196 -3.793 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -17.029 13.105 -3.700 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -17.561 16.304 -5.300 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -18.251 15.205 -4.101 1.00 0.00 H new ATOM 2136 N GLY A 132 -15.806 12.496 -0.358 1.00 0.00 N ATOM 2137 CA GLY A 132 -16.180 11.516 0.651 1.00 0.00 C ATOM 2138 C GLY A 132 -15.599 10.120 0.459 1.00 0.00 C ATOM 2139 O GLY A 132 -15.682 9.332 1.397 1.00 0.00 O ATOM 0 H GLY A 132 -14.806 12.697 -0.368 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -15.869 11.889 1.627 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -17.267 11.438 0.671 1.00 0.00 H new ATOM 2143 N PHE A 133 -15.043 9.803 -0.716 1.00 0.00 N ATOM 2144 CA PHE A 133 -14.518 8.468 -1.050 1.00 0.00 C ATOM 2145 C PHE A 133 -13.492 7.977 -0.027 1.00 0.00 C ATOM 2146 O PHE A 133 -12.665 8.765 0.426 1.00 0.00 O ATOM 2147 CB PHE A 133 -13.862 8.482 -2.435 1.00 0.00 C ATOM 2148 CG PHE A 133 -14.694 9.124 -3.521 1.00 0.00 C ATOM 2149 CD1 PHE A 133 -15.890 8.513 -3.939 1.00 0.00 C ATOM 2150 CD2 PHE A 133 -14.281 10.338 -4.100 1.00 0.00 C ATOM 2151 CE1 PHE A 133 -16.678 9.126 -4.926 1.00 0.00 C ATOM 2152 CE2 PHE A 133 -15.065 10.941 -5.097 1.00 0.00 C ATOM 2153 CZ PHE A 133 -16.271 10.345 -5.495 1.00 0.00 C ATOM 0 H PHE A 133 -14.942 10.476 -1.476 1.00 0.00 H new ATOM 0 HA PHE A 133 -15.369 7.787 -1.041 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -12.910 9.009 -2.366 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -13.638 7.456 -2.726 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -16.201 7.576 -3.502 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -13.362 10.806 -3.778 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -17.598 8.661 -5.248 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -14.740 11.863 -5.557 1.00 0.00 H new ATOM 0 HZ PHE A 133 -16.888 10.824 -6.241 1.00 0.00 H new ATOM 2163 N ILE A 134 -13.484 6.681 0.290 1.00 0.00 N ATOM 2164 CA ILE A 134 -12.571 6.118 1.290 1.00 0.00 C ATOM 2165 C ILE A 134 -11.511 5.269 0.585 1.00 0.00 C ATOM 2166 O ILE A 134 -11.705 4.085 0.308 1.00 0.00 O ATOM 2167 CB ILE A 134 -13.302 5.391 2.441 1.00 0.00 C ATOM 2168 CG1 ILE A 134 -14.281 6.293 3.231 1.00 0.00 C ATOM 2169 CG2 ILE A 134 -12.252 4.862 3.441 1.00 0.00 C ATOM 2170 CD1 ILE A 134 -15.679 6.402 2.617 1.00 0.00 C ATOM 0 H ILE A 134 -14.106 5.994 -0.136 1.00 0.00 H new ATOM 0 HA ILE A 134 -12.058 6.935 1.797 1.00 0.00 H new ATOM 0 HB ILE A 134 -13.885 4.595 1.978 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -14.373 5.906 4.246 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -13.853 7.292 3.308 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -12.756 4.346 4.259 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -11.582 4.168 2.933 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -11.675 5.697 3.839 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -16.298 7.052 3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -15.604 6.819 1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -16.132 5.412 2.565 1.00 0.00 H new ATOM 2182 N ALA A 135 -10.387 5.902 0.259 1.00 0.00 N ATOM 2183 CA ALA A 135 -9.190 5.211 -0.196 1.00 0.00 C ATOM 2184 C ALA A 135 -8.592 4.453 1.003 1.00 0.00 C ATOM 2185 O ALA A 135 -8.602 4.971 2.116 1.00 0.00 O ATOM 2186 CB ALA A 135 -8.226 6.255 -0.771 1.00 0.00 C ATOM 0 H ALA A 135 -10.283 6.916 0.304 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.403 4.485 -0.980 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -7.319 5.760 -1.119 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -8.702 6.769 -1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -7.970 6.979 0.003 1.00 0.00 H new ATOM 2192 N SER A 136 -8.072 3.244 0.797 1.00 0.00 N ATOM 2193 CA SER A 136 -7.426 2.414 1.830 1.00 0.00 C ATOM 2194 C SER A 136 -6.170 1.732 1.279 1.00 0.00 C ATOM 2195 O SER A 136 -6.184 1.197 0.174 1.00 0.00 O ATOM 2196 CB SER A 136 -8.412 1.366 2.359 1.00 0.00 C ATOM 2197 OG SER A 136 -7.846 0.668 3.453 1.00 0.00 O ATOM 0 H SER A 136 -8.086 2.795 -0.119 1.00 0.00 H new ATOM 0 HA SER A 136 -7.126 3.064 2.652 1.00 0.00 H new ATOM 0 HB2 SER A 136 -9.338 1.851 2.668 1.00 0.00 H new ATOM 0 HB3 SER A 136 -8.669 0.665 1.565 1.00 0.00 H new ATOM 0 HG SER A 136 -8.486 0.003 3.783 1.00 0.00 H new ATOM 2203 N ASN A 137 -5.065 1.770 2.023 1.00 0.00 N ATOM 2204 CA ASN A 137 -3.740 1.324 1.560 1.00 0.00 C ATOM 2205 C ASN A 137 -3.306 -0.039 2.152 1.00 0.00 C ATOM 2206 O ASN A 137 -3.508 -0.293 3.363 1.00 0.00 O ATOM 2207 CB ASN A 137 -2.744 2.478 1.801 1.00 0.00 C ATOM 2208 CG ASN A 137 -1.290 2.042 1.800 1.00 0.00 C ATOM 2209 OD1 ASN A 137 -0.641 1.925 2.833 1.00 0.00 O ATOM 2210 ND2 ASN A 137 -0.731 1.787 0.640 1.00 0.00 N ATOM 0 H ASN A 137 -5.060 2.117 2.982 1.00 0.00 H new ATOM 0 HA ASN A 137 -3.773 1.111 0.492 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -2.887 3.236 1.031 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -2.972 2.949 2.757 1.00 0.00 H new ATOM 0 HD21 ASN A 137 0.244 1.491 0.598 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -1.272 1.885 -0.219 1.00 0.00 H new