USER MOD reduce.3.24.130724 H: found=0, std=0, add=1090, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1088 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 THR OG1 : rot 74:sc= 0.874 USER MOD Set 1.2: B 133 LYS NZ :NH3+ -142:sc= 1.15 (180deg=0.868) USER MOD Set 2.1: B 93 SER OG : rot 180:sc= 0.0427 USER MOD Set 2.2: B 104 TYR OH : rot -166:sc= 0.0405 USER MOD Set 3.1: A 25 GLN : amide:sc= 0.909 K(o=0.48,f=-4.2) USER MOD Set 3.2: A 65 MET CE :methyl 178:sc= -0.428 (180deg=-0.453) USER MOD Set 4.1: A 53 GLN : amide:sc= 0.52 K(o=1.4,f=-6.9!) USER MOD Set 4.2: A 54 THR OG1 : rot 180:sc= 0 USER MOD Set 4.3: A 57 THR OG1 : rot 152:sc= 0.847 USER MOD Set 5.1: A 7 THR OG1 : rot 180:sc= 0 USER MOD Set 5.2: A 45 THR OG1 : rot 180:sc=-0.000523 USER MOD Set 6.1: A 4 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Set 6.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.855 (180deg=0.192) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl -165:sc= -0.203 (180deg=-1.33) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0.23 K(o=0.23,f=-2.4!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc=-0.00186 X(o=-0.0019,f=-0.41) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 33 HIS : no HD1:sc= -0.0748 X(o=-0.075,f=-0.56) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -0.196 K(o=-0.2,f=-1.8) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -158:sc= 1.19 (180deg=0.704) USER MOD Single : A 59 GLN : amide:sc= 0.117 K(o=0.12,f=-0.45) USER MOD Single : A 72 HIS : no HD1:sc= -0.246 X(o=-0.25,f=-0.11) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 MET CE :methyl 177:sc= 0 (180deg=-0.0172) USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 HIS : no HE2:sc= -0.208 K(o=-0.21,f=-2.9!) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 83 MET CE :methyl -168:sc= -0.218 (180deg=-0.467) USER MOD Single : B 84 THR OG1 : rot 65:sc= 1.25 USER MOD Single : B 88 CYS SG : rot -23:sc= -0.662 USER MOD Single : B 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 LYS NZ :NH3+ -159:sc= 1.3 (180deg=0.931) USER MOD Single : B 110 ASN : amide:sc= -0.347 K(o=-0.35,f=-5.6!) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 LYS NZ :NH3+ 159:sc= 1.12 (180deg=0.543) USER MOD Single : B 114 CYS SG : rot -42:sc= -0.048 USER MOD Single : B 117 SER OG : rot 180:sc= 0.214 USER MOD Single : B 119 HIS : no HD1:sc= 0 X(o=0,f=-0.002) USER MOD Single : B 120 SER OG : rot 180:sc= 0.0556 USER MOD Single : B 121 MET CE :methyl 168:sc= 0 (180deg=-0.169) USER MOD Single : B 123 THR OG1 : rot 180:sc= 0 USER MOD Single : B 127 THR OG1 : rot 86:sc= 0.901 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 THR OG1 : rot 93:sc= 1.28 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.922 -8.567 29.487 1.00 0.00 N ATOM 2 CA MET A 1 -11.291 -8.343 28.171 1.00 0.00 C ATOM 3 C MET A 1 -9.772 -8.418 28.282 1.00 0.00 C ATOM 4 O MET A 1 -9.195 -7.944 29.262 1.00 0.00 O ATOM 5 CB MET A 1 -11.772 -7.059 27.471 1.00 0.00 C ATOM 6 CG MET A 1 -11.263 -5.737 28.066 1.00 0.00 C ATOM 7 SD MET A 1 -11.774 -5.355 29.762 1.00 0.00 S ATOM 8 CE MET A 1 -13.499 -4.875 29.484 1.00 0.00 C ATOM 0 H1 MET A 1 -12.840 -9.039 29.356 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.304 -9.167 30.071 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.067 -7.653 29.962 1.00 0.00 H new ATOM 0 HA MET A 1 -11.619 -9.153 27.519 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.469 -7.104 26.425 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.862 -7.046 27.487 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.174 -5.747 28.033 1.00 0.00 H new ATOM 0 HG3 MET A 1 -11.594 -4.924 27.420 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.960 -4.608 30.435 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.534 -4.018 28.811 1.00 0.00 H new ATOM 0 HE3 MET A 1 -14.042 -5.709 29.039 1.00 0.00 H new ATOM 20 N GLY A 2 -9.123 -9.011 27.279 1.00 0.00 N ATOM 21 CA GLY A 2 -7.676 -9.270 27.244 1.00 0.00 C ATOM 22 C GLY A 2 -7.103 -9.137 25.835 1.00 0.00 C ATOM 23 O GLY A 2 -7.679 -8.428 25.012 1.00 0.00 O ATOM 0 H GLY A 2 -9.602 -9.336 26.439 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -7.167 -8.572 27.909 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -7.478 -10.273 27.622 1.00 0.00 H new ATOM 27 N VAL A 3 -5.989 -9.812 25.551 1.00 0.00 N ATOM 28 CA VAL A 3 -5.489 -9.981 24.169 1.00 0.00 C ATOM 29 C VAL A 3 -6.511 -10.712 23.285 1.00 0.00 C ATOM 30 O VAL A 3 -7.220 -11.608 23.747 1.00 0.00 O ATOM 31 CB VAL A 3 -4.124 -10.703 24.076 1.00 0.00 C ATOM 32 CG1 VAL A 3 -2.990 -9.808 24.595 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.076 -12.071 24.774 1.00 0.00 C ATOM 0 H VAL A 3 -5.406 -10.257 26.259 1.00 0.00 H new ATOM 0 HA VAL A 3 -5.341 -8.965 23.803 1.00 0.00 H new ATOM 0 HB VAL A 3 -3.984 -10.902 23.013 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.042 -10.340 24.518 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -2.944 -8.897 23.999 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.178 -9.550 25.637 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.082 -12.504 24.658 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.296 -11.946 25.834 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.816 -12.734 24.326 1.00 0.00 H new ATOM 43 N ASN A 4 -6.583 -10.335 22.008 1.00 0.00 N ATOM 44 CA ASN A 4 -7.533 -10.870 21.029 1.00 0.00 C ATOM 45 C ASN A 4 -6.823 -11.105 19.681 1.00 0.00 C ATOM 46 O ASN A 4 -6.167 -10.209 19.153 1.00 0.00 O ATOM 47 CB ASN A 4 -8.696 -9.866 20.930 1.00 0.00 C ATOM 48 CG ASN A 4 -9.967 -10.416 20.298 1.00 0.00 C ATOM 49 OD1 ASN A 4 -9.973 -11.384 19.546 1.00 0.00 O ATOM 50 ND2 ASN A 4 -11.095 -9.801 20.606 1.00 0.00 N ATOM 0 H ASN A 4 -5.963 -9.627 21.613 1.00 0.00 H new ATOM 0 HA ASN A 4 -7.929 -11.839 21.332 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.932 -9.506 21.931 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -8.364 -9.004 20.352 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.978 -10.131 20.217 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -11.082 -8.996 21.232 1.00 0.00 H new ATOM 57 N SER A 5 -6.892 -12.315 19.129 1.00 0.00 N ATOM 58 CA SER A 5 -6.175 -12.696 17.899 1.00 0.00 C ATOM 59 C SER A 5 -7.102 -12.723 16.673 1.00 0.00 C ATOM 60 O SER A 5 -8.274 -13.098 16.785 1.00 0.00 O ATOM 61 CB SER A 5 -5.499 -14.062 18.086 1.00 0.00 C ATOM 62 OG SER A 5 -4.577 -14.330 17.039 1.00 0.00 O ATOM 0 H SER A 5 -7.452 -13.072 19.522 1.00 0.00 H new ATOM 0 HA SER A 5 -5.415 -11.937 17.713 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.981 -14.085 19.045 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.257 -14.844 18.115 1.00 0.00 H new ATOM 0 HG SER A 5 -4.161 -15.205 17.186 1.00 0.00 H new ATOM 68 N VAL A 6 -6.585 -12.376 15.490 1.00 0.00 N ATOM 69 CA VAL A 6 -7.290 -12.570 14.208 1.00 0.00 C ATOM 70 C VAL A 6 -6.305 -12.898 13.083 1.00 0.00 C ATOM 71 O VAL A 6 -5.169 -12.416 13.081 1.00 0.00 O ATOM 72 CB VAL A 6 -8.214 -11.372 13.864 1.00 0.00 C ATOM 73 CG1 VAL A 6 -7.455 -10.067 13.577 1.00 0.00 C ATOM 74 CG2 VAL A 6 -9.153 -11.685 12.687 1.00 0.00 C ATOM 0 H VAL A 6 -5.663 -11.951 15.389 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.948 -13.432 14.318 1.00 0.00 H new ATOM 0 HB VAL A 6 -8.805 -11.216 14.766 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -8.167 -9.275 13.345 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -6.872 -9.785 14.454 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -6.786 -10.214 12.729 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -9.781 -10.818 12.482 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -8.561 -11.922 11.803 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.783 -12.537 12.941 1.00 0.00 H new ATOM 84 N THR A 7 -6.756 -13.733 12.138 1.00 0.00 N ATOM 85 CA THR A 7 -5.984 -14.198 10.978 1.00 0.00 C ATOM 86 C THR A 7 -6.739 -13.878 9.691 1.00 0.00 C ATOM 87 O THR A 7 -7.954 -14.065 9.596 1.00 0.00 O ATOM 88 CB THR A 7 -5.648 -15.691 11.100 1.00 0.00 C ATOM 89 OG1 THR A 7 -5.005 -15.899 12.338 1.00 0.00 O ATOM 90 CG2 THR A 7 -4.692 -16.150 9.999 1.00 0.00 C ATOM 0 H THR A 7 -7.701 -14.117 12.161 1.00 0.00 H new ATOM 0 HA THR A 7 -5.032 -13.668 10.947 1.00 0.00 H new ATOM 0 HB THR A 7 -6.576 -16.256 11.016 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.783 -16.849 12.436 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.479 -17.212 10.121 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.151 -15.982 9.025 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.763 -15.584 10.065 1.00 0.00 H new ATOM 98 N ILE A 8 -6.020 -13.350 8.704 1.00 0.00 N ATOM 99 CA ILE A 8 -6.554 -12.725 7.486 1.00 0.00 C ATOM 100 C ILE A 8 -5.780 -13.221 6.259 1.00 0.00 C ATOM 101 O ILE A 8 -4.565 -13.055 6.165 1.00 0.00 O ATOM 102 CB ILE A 8 -6.463 -11.180 7.616 1.00 0.00 C ATOM 103 CG1 ILE A 8 -7.180 -10.674 8.894 1.00 0.00 C ATOM 104 CG2 ILE A 8 -7.024 -10.507 6.352 1.00 0.00 C ATOM 105 CD1 ILE A 8 -7.366 -9.152 9.005 1.00 0.00 C ATOM 0 H ILE A 8 -5.000 -13.343 8.728 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.600 -13.003 7.359 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.412 -10.906 7.712 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -8.162 -11.145 8.946 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.616 -11.015 9.762 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.955 -9.424 6.455 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.448 -10.826 5.484 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.068 -10.793 6.220 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.878 -8.915 9.938 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.391 -8.664 8.992 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.961 -8.796 8.164 1.00 0.00 H new ATOM 117 N SER A 9 -6.463 -13.772 5.263 1.00 0.00 N ATOM 118 CA SER A 9 -5.861 -14.179 3.985 1.00 0.00 C ATOM 119 C SER A 9 -5.525 -12.955 3.110 1.00 0.00 C ATOM 120 O SER A 9 -6.185 -12.707 2.102 1.00 0.00 O ATOM 121 CB SER A 9 -6.775 -15.184 3.269 1.00 0.00 C ATOM 122 OG SER A 9 -6.917 -16.369 4.038 1.00 0.00 O ATOM 0 H SER A 9 -7.465 -13.954 5.314 1.00 0.00 H new ATOM 0 HA SER A 9 -4.914 -14.680 4.183 1.00 0.00 H new ATOM 0 HB2 SER A 9 -7.754 -14.736 3.098 1.00 0.00 H new ATOM 0 HB3 SER A 9 -6.361 -15.427 2.290 1.00 0.00 H new ATOM 0 HG SER A 9 -7.504 -16.996 3.567 1.00 0.00 H new ATOM 128 N VAL A 10 -4.530 -12.159 3.518 1.00 0.00 N ATOM 129 CA VAL A 10 -3.955 -11.060 2.716 1.00 0.00 C ATOM 130 C VAL A 10 -3.225 -11.644 1.498 1.00 0.00 C ATOM 131 O VAL A 10 -2.183 -12.285 1.636 1.00 0.00 O ATOM 132 CB VAL A 10 -3.018 -10.139 3.531 1.00 0.00 C ATOM 133 CG1 VAL A 10 -2.351 -9.062 2.651 1.00 0.00 C ATOM 134 CG2 VAL A 10 -3.805 -9.418 4.633 1.00 0.00 C ATOM 0 H VAL A 10 -4.089 -12.258 4.433 1.00 0.00 H new ATOM 0 HA VAL A 10 -4.781 -10.429 2.386 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.247 -10.782 3.957 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.702 -8.439 3.267 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.759 -9.543 1.873 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.120 -8.441 2.191 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.132 -8.773 5.198 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.592 -8.814 4.182 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -4.250 -10.154 5.303 1.00 0.00 H new ATOM 144 N GLU A 11 -3.805 -11.433 0.316 1.00 0.00 N ATOM 145 CA GLU A 11 -3.373 -12.033 -0.955 1.00 0.00 C ATOM 146 C GLU A 11 -2.081 -11.430 -1.535 1.00 0.00 C ATOM 147 O GLU A 11 -1.300 -12.144 -2.165 1.00 0.00 O ATOM 148 CB GLU A 11 -4.525 -11.927 -1.974 1.00 0.00 C ATOM 149 CG GLU A 11 -5.672 -12.883 -1.611 1.00 0.00 C ATOM 150 CD GLU A 11 -6.972 -12.617 -2.369 1.00 0.00 C ATOM 151 OE1 GLU A 11 -6.952 -12.188 -3.547 1.00 0.00 O ATOM 152 OE2 GLU A 11 -8.045 -12.901 -1.787 1.00 0.00 O ATOM 0 H GLU A 11 -4.614 -10.821 0.209 1.00 0.00 H new ATOM 0 HA GLU A 11 -3.131 -13.075 -0.747 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -4.896 -10.903 -2.003 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -4.155 -12.160 -2.972 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -5.353 -13.907 -1.807 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -5.867 -12.809 -0.541 1.00 0.00 H new ATOM 159 N GLY A 12 -1.846 -10.127 -1.360 1.00 0.00 N ATOM 160 CA GLY A 12 -0.856 -9.359 -2.132 1.00 0.00 C ATOM 161 C GLY A 12 0.557 -9.327 -1.548 1.00 0.00 C ATOM 162 O GLY A 12 1.174 -8.263 -1.549 1.00 0.00 O ATOM 0 H GLY A 12 -2.343 -9.565 -0.669 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -0.805 -9.775 -3.138 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -1.213 -8.334 -2.229 1.00 0.00 H new ATOM 166 N MET A 13 1.059 -10.437 -0.996 1.00 0.00 N ATOM 167 CA MET A 13 2.416 -10.529 -0.414 1.00 0.00 C ATOM 168 C MET A 13 3.258 -11.685 -0.991 1.00 0.00 C ATOM 169 O MET A 13 2.765 -12.809 -1.062 1.00 0.00 O ATOM 170 CB MET A 13 2.321 -10.620 1.108 1.00 0.00 C ATOM 171 CG MET A 13 1.667 -9.358 1.697 1.00 0.00 C ATOM 172 SD MET A 13 1.516 -9.325 3.496 1.00 0.00 S ATOM 173 CE MET A 13 0.694 -10.916 3.718 1.00 0.00 C ATOM 0 H MET A 13 0.534 -11.310 -0.937 1.00 0.00 H new ATOM 0 HA MET A 13 2.945 -9.618 -0.693 1.00 0.00 H new ATOM 0 HB2 MET A 13 1.740 -11.499 1.388 1.00 0.00 H new ATOM 0 HB3 MET A 13 3.317 -10.749 1.531 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.247 -8.490 1.383 1.00 0.00 H new ATOM 0 HG3 MET A 13 0.672 -9.251 1.265 1.00 0.00 H new ATOM 0 HE1 MET A 13 0.274 -10.971 4.722 1.00 0.00 H new ATOM 0 HE2 MET A 13 -0.105 -11.018 2.984 1.00 0.00 H new ATOM 0 HE3 MET A 13 1.416 -11.721 3.582 1.00 0.00 H new ATOM 183 N THR A 14 4.534 -11.423 -1.326 1.00 0.00 N ATOM 184 CA THR A 14 5.556 -12.370 -1.855 1.00 0.00 C ATOM 185 C THR A 14 6.955 -11.744 -2.010 1.00 0.00 C ATOM 186 O THR A 14 7.954 -12.464 -1.986 1.00 0.00 O ATOM 187 CB THR A 14 5.066 -13.091 -3.117 1.00 0.00 C ATOM 188 OG1 THR A 14 6.036 -13.992 -3.599 1.00 0.00 O ATOM 189 CG2 THR A 14 4.764 -12.103 -4.223 1.00 0.00 C ATOM 0 H THR A 14 4.914 -10.481 -1.231 1.00 0.00 H new ATOM 0 HA THR A 14 5.686 -13.137 -1.092 1.00 0.00 H new ATOM 0 HB THR A 14 4.162 -13.632 -2.837 1.00 0.00 H new ATOM 0 HG1 THR A 14 5.697 -14.439 -4.403 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.419 -12.640 -5.106 1.00 0.00 H new ATOM 0 HG22 THR A 14 3.989 -11.412 -3.892 1.00 0.00 H new ATOM 0 HG23 THR A 14 5.667 -11.544 -4.468 1.00 0.00 H new ATOM 197 N CYS A 15 7.052 -10.416 -2.127 1.00 0.00 N ATOM 198 CA CYS A 15 8.299 -9.669 -2.230 1.00 0.00 C ATOM 199 C CYS A 15 8.985 -9.390 -0.863 1.00 0.00 C ATOM 200 O CYS A 15 8.715 -10.036 0.155 1.00 0.00 O ATOM 201 CB CYS A 15 7.982 -8.406 -3.063 1.00 0.00 C ATOM 202 SG CYS A 15 7.184 -7.101 -2.091 1.00 0.00 S ATOM 0 H CYS A 15 6.230 -9.813 -2.153 1.00 0.00 H new ATOM 0 HA CYS A 15 9.060 -10.264 -2.735 1.00 0.00 H new ATOM 0 HB2 CYS A 15 8.906 -8.019 -3.492 1.00 0.00 H new ATOM 0 HB3 CYS A 15 7.334 -8.679 -3.896 1.00 0.00 H new ATOM 207 N ASN A 16 9.848 -8.373 -0.842 1.00 0.00 N ATOM 208 CA ASN A 16 10.582 -7.893 0.326 1.00 0.00 C ATOM 209 C ASN A 16 9.918 -6.714 1.073 1.00 0.00 C ATOM 210 O ASN A 16 10.226 -6.520 2.251 1.00 0.00 O ATOM 211 CB ASN A 16 12.004 -7.520 -0.125 1.00 0.00 C ATOM 212 CG ASN A 16 12.051 -6.332 -1.088 1.00 0.00 C ATOM 213 OD1 ASN A 16 11.527 -6.385 -2.198 1.00 0.00 O ATOM 214 ND2 ASN A 16 12.648 -5.228 -0.679 1.00 0.00 N ATOM 0 H ASN A 16 10.063 -7.836 -1.682 1.00 0.00 H new ATOM 0 HA ASN A 16 10.591 -8.703 1.056 1.00 0.00 H new ATOM 0 HB2 ASN A 16 12.605 -7.288 0.754 1.00 0.00 H new ATOM 0 HB3 ASN A 16 12.462 -8.385 -0.606 1.00 0.00 H new ATOM 0 HD21 ASN A 16 12.677 -4.409 -1.286 1.00 0.00 H new ATOM 0 HD22 ASN A 16 13.080 -5.194 0.244 1.00 0.00 H new ATOM 221 N SER A 17 9.035 -5.925 0.441 1.00 0.00 N ATOM 222 CA SER A 17 8.588 -4.628 1.002 1.00 0.00 C ATOM 223 C SER A 17 7.058 -4.429 1.106 1.00 0.00 C ATOM 224 O SER A 17 6.581 -3.627 1.914 1.00 0.00 O ATOM 225 CB SER A 17 9.258 -3.478 0.242 1.00 0.00 C ATOM 226 OG SER A 17 9.151 -2.277 0.983 1.00 0.00 O ATOM 0 H SER A 17 8.613 -6.157 -0.458 1.00 0.00 H new ATOM 0 HA SER A 17 8.911 -4.633 2.043 1.00 0.00 H new ATOM 0 HB2 SER A 17 10.308 -3.712 0.064 1.00 0.00 H new ATOM 0 HB3 SER A 17 8.789 -3.355 -0.734 1.00 0.00 H new ATOM 0 HG SER A 17 9.583 -1.549 0.490 1.00 0.00 H new ATOM 232 N CYS A 18 6.243 -5.217 0.404 1.00 0.00 N ATOM 233 CA CYS A 18 4.804 -5.259 0.619 1.00 0.00 C ATOM 234 C CYS A 18 4.500 -5.726 2.079 1.00 0.00 C ATOM 235 O CYS A 18 3.736 -5.081 2.797 1.00 0.00 O ATOM 236 CB CYS A 18 4.237 -6.119 -0.533 1.00 0.00 C ATOM 237 SG CYS A 18 4.901 -5.589 -2.153 1.00 0.00 S ATOM 0 H CYS A 18 6.568 -5.845 -0.331 1.00 0.00 H new ATOM 0 HA CYS A 18 4.304 -4.292 0.571 1.00 0.00 H new ATOM 0 HB2 CYS A 18 4.484 -7.167 -0.362 1.00 0.00 H new ATOM 0 HB3 CYS A 18 3.150 -6.045 -0.542 1.00 0.00 H new ATOM 242 N VAL A 19 5.214 -6.751 2.561 1.00 0.00 N ATOM 243 CA VAL A 19 5.252 -7.175 3.984 1.00 0.00 C ATOM 244 C VAL A 19 5.805 -6.116 4.960 1.00 0.00 C ATOM 245 O VAL A 19 5.380 -6.059 6.116 1.00 0.00 O ATOM 246 CB VAL A 19 6.072 -8.471 4.189 1.00 0.00 C ATOM 247 CG1 VAL A 19 5.352 -9.683 3.583 1.00 0.00 C ATOM 248 CG2 VAL A 19 7.524 -8.355 3.682 1.00 0.00 C ATOM 0 H VAL A 19 5.801 -7.331 1.962 1.00 0.00 H new ATOM 0 HA VAL A 19 4.200 -7.339 4.219 1.00 0.00 H new ATOM 0 HB VAL A 19 6.145 -8.626 5.266 1.00 0.00 H new ATOM 0 HG11 VAL A 19 5.951 -10.579 3.742 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.381 -9.806 4.062 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.212 -9.526 2.514 1.00 0.00 H new ATOM 0 HG21 VAL A 19 8.046 -9.296 3.855 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.520 -8.132 2.615 1.00 0.00 H new ATOM 0 HG23 VAL A 19 8.034 -7.554 4.218 1.00 0.00 H new ATOM 258 N TRP A 20 6.737 -5.262 4.518 1.00 0.00 N ATOM 259 CA TRP A 20 7.256 -4.138 5.312 1.00 0.00 C ATOM 260 C TRP A 20 6.189 -3.044 5.473 1.00 0.00 C ATOM 261 O TRP A 20 5.980 -2.537 6.578 1.00 0.00 O ATOM 262 CB TRP A 20 8.522 -3.597 4.632 1.00 0.00 C ATOM 263 CG TRP A 20 9.099 -2.348 5.206 1.00 0.00 C ATOM 264 CD1 TRP A 20 9.956 -2.288 6.244 1.00 0.00 C ATOM 265 CD2 TRP A 20 8.905 -0.966 4.769 1.00 0.00 C ATOM 266 NE1 TRP A 20 10.291 -0.975 6.492 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.674 -0.113 5.615 1.00 0.00 C ATOM 268 CE3 TRP A 20 8.165 -0.343 3.739 1.00 0.00 C ATOM 269 CZ2 TRP A 20 9.694 1.282 5.465 1.00 0.00 C ATOM 270 CZ3 TRP A 20 8.175 1.056 3.583 1.00 0.00 C ATOM 271 CH2 TRP A 20 8.926 1.869 4.449 1.00 0.00 C ATOM 0 H TRP A 20 7.157 -5.331 3.591 1.00 0.00 H new ATOM 0 HA TRP A 20 7.510 -4.481 6.315 1.00 0.00 H new ATOM 0 HB2 TRP A 20 9.286 -4.373 4.665 1.00 0.00 H new ATOM 0 HB3 TRP A 20 8.295 -3.417 3.581 1.00 0.00 H new ATOM 0 HD1 TRP A 20 10.324 -3.139 6.797 1.00 0.00 H new ATOM 0 HE1 TRP A 20 10.921 -0.677 7.237 1.00 0.00 H new ATOM 0 HE3 TRP A 20 7.583 -0.949 3.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 10.292 1.895 6.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 7.599 1.509 2.789 1.00 0.00 H new ATOM 0 HH2 TRP A 20 8.912 2.943 4.332 1.00 0.00 H new ATOM 282 N THR A 21 5.451 -2.760 4.390 1.00 0.00 N ATOM 283 CA THR A 21 4.335 -1.801 4.342 1.00 0.00 C ATOM 284 C THR A 21 3.293 -2.130 5.408 1.00 0.00 C ATOM 285 O THR A 21 2.910 -1.230 6.148 1.00 0.00 O ATOM 286 CB THR A 21 3.726 -1.734 2.932 1.00 0.00 C ATOM 287 OG1 THR A 21 4.753 -1.453 2.001 1.00 0.00 O ATOM 288 CG2 THR A 21 2.672 -0.626 2.814 1.00 0.00 C ATOM 0 H THR A 21 5.620 -3.208 3.489 1.00 0.00 H new ATOM 0 HA THR A 21 4.722 -0.807 4.567 1.00 0.00 H new ATOM 0 HB THR A 21 3.250 -2.694 2.733 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.310 -2.250 1.878 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.268 -0.614 1.802 1.00 0.00 H new ATOM 0 HG22 THR A 21 1.866 -0.813 3.524 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.131 0.338 3.032 1.00 0.00 H new ATOM 296 N ILE A 22 2.917 -3.405 5.577 1.00 0.00 N ATOM 297 CA ILE A 22 1.980 -3.825 6.644 1.00 0.00 C ATOM 298 C ILE A 22 2.499 -3.464 8.047 1.00 0.00 C ATOM 299 O ILE A 22 1.752 -2.887 8.834 1.00 0.00 O ATOM 300 CB ILE A 22 1.651 -5.341 6.570 1.00 0.00 C ATOM 301 CG1 ILE A 22 1.179 -5.830 5.179 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.604 -5.702 7.646 1.00 0.00 C ATOM 303 CD1 ILE A 22 -0.104 -5.190 4.638 1.00 0.00 C ATOM 0 H ILE A 22 3.246 -4.171 4.989 1.00 0.00 H new ATOM 0 HA ILE A 22 1.059 -3.269 6.470 1.00 0.00 H new ATOM 0 HB ILE A 22 2.591 -5.861 6.758 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.980 -5.650 4.462 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.030 -6.909 5.227 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.377 -6.767 7.590 1.00 0.00 H new ATOM 0 HG22 ILE A 22 1.001 -5.467 8.634 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.306 -5.127 7.475 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -0.335 -5.610 3.659 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -0.928 -5.391 5.323 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.037 -4.113 4.546 1.00 0.00 H new ATOM 315 N GLU A 23 3.764 -3.760 8.367 1.00 0.00 N ATOM 316 CA GLU A 23 4.358 -3.448 9.679 1.00 0.00 C ATOM 317 C GLU A 23 4.345 -1.929 9.946 1.00 0.00 C ATOM 318 O GLU A 23 4.006 -1.491 11.048 1.00 0.00 O ATOM 319 CB GLU A 23 5.796 -4.005 9.747 1.00 0.00 C ATOM 320 CG GLU A 23 6.385 -3.990 11.168 1.00 0.00 C ATOM 321 CD GLU A 23 7.902 -4.188 11.163 1.00 0.00 C ATOM 322 OE1 GLU A 23 8.365 -5.323 10.890 1.00 0.00 O ATOM 323 OE2 GLU A 23 8.633 -3.207 11.441 1.00 0.00 O ATOM 0 H GLU A 23 4.408 -4.223 7.726 1.00 0.00 H new ATOM 0 HA GLU A 23 3.758 -3.923 10.455 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.801 -5.027 9.369 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.437 -3.419 9.089 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.145 -3.042 11.650 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.919 -4.776 11.762 1.00 0.00 H new ATOM 330 N GLN A 24 4.663 -1.125 8.926 1.00 0.00 N ATOM 331 CA GLN A 24 4.646 0.338 8.980 1.00 0.00 C ATOM 332 C GLN A 24 3.220 0.903 9.119 1.00 0.00 C ATOM 333 O GLN A 24 3.042 1.936 9.762 1.00 0.00 O ATOM 334 CB GLN A 24 5.309 0.888 7.701 1.00 0.00 C ATOM 335 CG GLN A 24 6.819 0.594 7.569 1.00 0.00 C ATOM 336 CD GLN A 24 7.714 1.553 8.358 1.00 0.00 C ATOM 337 OE1 GLN A 24 7.481 2.756 8.410 1.00 0.00 O ATOM 338 NE2 GLN A 24 8.753 1.086 9.013 1.00 0.00 N ATOM 0 H GLN A 24 4.947 -1.486 8.015 1.00 0.00 H new ATOM 0 HA GLN A 24 5.199 0.653 9.865 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.796 0.469 6.835 1.00 0.00 H new ATOM 0 HB3 GLN A 24 5.160 1.967 7.668 1.00 0.00 H new ATOM 0 HG2 GLN A 24 7.011 -0.425 7.906 1.00 0.00 H new ATOM 0 HG3 GLN A 24 7.096 0.639 6.516 1.00 0.00 H new ATOM 0 HE21 GLN A 24 8.967 0.089 8.985 1.00 0.00 H new ATOM 0 HE22 GLN A 24 9.345 1.720 9.549 1.00 0.00 H new ATOM 347 N GLN A 25 2.197 0.262 8.539 1.00 0.00 N ATOM 348 CA GLN A 25 0.794 0.651 8.724 1.00 0.00 C ATOM 349 C GLN A 25 0.251 0.303 10.106 1.00 0.00 C ATOM 350 O GLN A 25 -0.405 1.130 10.742 1.00 0.00 O ATOM 351 CB GLN A 25 -0.103 -0.060 7.707 1.00 0.00 C ATOM 352 CG GLN A 25 0.018 0.482 6.291 1.00 0.00 C ATOM 353 CD GLN A 25 -0.892 -0.312 5.378 1.00 0.00 C ATOM 354 OE1 GLN A 25 -0.604 -1.443 5.025 1.00 0.00 O ATOM 355 NE2 GLN A 25 -2.027 0.241 5.018 1.00 0.00 N ATOM 0 H GLN A 25 2.320 -0.544 7.926 1.00 0.00 H new ATOM 0 HA GLN A 25 0.778 1.733 8.593 1.00 0.00 H new ATOM 0 HB2 GLN A 25 0.143 -1.122 7.701 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.140 0.025 8.030 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -0.254 1.537 6.268 1.00 0.00 H new ATOM 0 HG3 GLN A 25 1.050 0.411 5.948 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -2.252 1.188 5.322 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -2.684 -0.277 4.434 1.00 0.00 H new ATOM 364 N ILE A 26 0.417 -0.959 10.510 1.00 0.00 N ATOM 365 CA ILE A 26 -0.216 -1.530 11.703 1.00 0.00 C ATOM 366 C ILE A 26 0.434 -0.981 12.971 1.00 0.00 C ATOM 367 O ILE A 26 -0.280 -0.508 13.855 1.00 0.00 O ATOM 368 CB ILE A 26 -0.235 -3.079 11.579 1.00 0.00 C ATOM 369 CG1 ILE A 26 -1.492 -3.590 10.831 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.201 -3.811 12.927 1.00 0.00 C ATOM 371 CD1 ILE A 26 -1.762 -2.980 9.449 1.00 0.00 C ATOM 0 H ILE A 26 1.005 -1.625 10.009 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.259 -1.224 11.781 1.00 0.00 H new ATOM 0 HB ILE A 26 0.675 -3.301 11.022 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -1.405 -4.670 10.716 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.362 -3.406 11.461 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.217 -4.888 12.757 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.708 -3.542 13.464 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -1.070 -3.524 13.519 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.667 -3.418 9.029 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.891 -1.902 9.546 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.919 -3.186 8.789 1.00 0.00 H new ATOM 383 N GLY A 27 1.770 -0.947 13.042 1.00 0.00 N ATOM 384 CA GLY A 27 2.527 -0.557 14.242 1.00 0.00 C ATOM 385 C GLY A 27 2.311 0.883 14.726 1.00 0.00 C ATOM 386 O GLY A 27 2.807 1.242 15.792 1.00 0.00 O ATOM 0 H GLY A 27 2.368 -1.194 12.254 1.00 0.00 H new ATOM 0 HA2 GLY A 27 2.263 -1.237 15.052 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.589 -0.698 14.041 1.00 0.00 H new ATOM 390 N LYS A 28 1.559 1.702 13.984 1.00 0.00 N ATOM 391 CA LYS A 28 1.069 3.028 14.386 1.00 0.00 C ATOM 392 C LYS A 28 -0.292 2.997 15.101 1.00 0.00 C ATOM 393 O LYS A 28 -0.634 3.981 15.757 1.00 0.00 O ATOM 394 CB LYS A 28 0.983 3.907 13.123 1.00 0.00 C ATOM 395 CG LYS A 28 2.266 4.671 12.766 1.00 0.00 C ATOM 396 CD LYS A 28 3.519 3.828 12.493 1.00 0.00 C ATOM 397 CE LYS A 28 4.384 3.666 13.748 1.00 0.00 C ATOM 398 NZ LYS A 28 5.638 2.949 13.440 1.00 0.00 N ATOM 0 H LYS A 28 1.260 1.448 13.042 1.00 0.00 H new ATOM 0 HA LYS A 28 1.772 3.435 15.113 1.00 0.00 H new ATOM 0 HB2 LYS A 28 0.710 3.275 12.278 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.176 4.627 13.256 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.066 5.278 11.883 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.490 5.359 13.581 1.00 0.00 H new ATOM 0 HD2 LYS A 28 3.222 2.845 12.127 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.108 4.297 11.705 1.00 0.00 H new ATOM 0 HE2 LYS A 28 4.615 4.647 14.164 1.00 0.00 H new ATOM 0 HE3 LYS A 28 3.827 3.120 14.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 6.205 2.853 14.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 5.415 2.005 13.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 6.178 3.484 12.730 1.00 0.00 H new ATOM 412 N VAL A 29 -1.053 1.908 15.004 1.00 0.00 N ATOM 413 CA VAL A 29 -2.365 1.771 15.647 1.00 0.00 C ATOM 414 C VAL A 29 -2.154 1.296 17.087 1.00 0.00 C ATOM 415 O VAL A 29 -1.915 0.119 17.344 1.00 0.00 O ATOM 416 CB VAL A 29 -3.274 0.803 14.864 1.00 0.00 C ATOM 417 CG1 VAL A 29 -4.652 0.628 15.519 1.00 0.00 C ATOM 418 CG2 VAL A 29 -3.467 1.244 13.401 1.00 0.00 C ATOM 0 H VAL A 29 -0.775 1.084 14.471 1.00 0.00 H new ATOM 0 HA VAL A 29 -2.870 2.737 15.653 1.00 0.00 H new ATOM 0 HB VAL A 29 -2.755 -0.156 14.883 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.251 -0.064 14.927 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.528 0.230 16.526 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.156 1.593 15.570 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.114 0.532 12.889 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.924 2.233 13.376 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.499 1.279 12.901 1.00 0.00 H new ATOM 428 N ASN A 30 -2.229 2.249 18.013 1.00 0.00 N ATOM 429 CA ASN A 30 -2.023 2.115 19.473 1.00 0.00 C ATOM 430 C ASN A 30 -2.464 0.766 20.093 1.00 0.00 C ATOM 431 O ASN A 30 -1.757 0.204 20.928 1.00 0.00 O ATOM 432 CB ASN A 30 -2.770 3.272 20.166 1.00 0.00 C ATOM 433 CG ASN A 30 -2.466 3.424 21.661 1.00 0.00 C ATOM 434 OD1 ASN A 30 -1.414 3.052 22.174 1.00 0.00 O ATOM 435 ND2 ASN A 30 -3.393 3.992 22.408 1.00 0.00 N ATOM 0 H ASN A 30 -2.451 3.210 17.755 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.946 2.151 19.635 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.517 4.204 19.661 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -3.842 3.122 20.040 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -3.235 4.121 23.407 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.268 4.303 21.986 1.00 0.00 H new ATOM 442 N GLY A 31 -3.610 0.213 19.671 1.00 0.00 N ATOM 443 CA GLY A 31 -4.184 -1.030 20.202 1.00 0.00 C ATOM 444 C GLY A 31 -3.666 -2.335 19.589 1.00 0.00 C ATOM 445 O GLY A 31 -4.151 -3.385 19.986 1.00 0.00 O ATOM 0 H GLY A 31 -4.177 0.629 18.932 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.000 -1.060 21.276 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -5.265 -0.993 20.065 1.00 0.00 H new ATOM 449 N VAL A 32 -2.734 -2.324 18.635 1.00 0.00 N ATOM 450 CA VAL A 32 -2.108 -3.563 18.112 1.00 0.00 C ATOM 451 C VAL A 32 -0.939 -4.001 19.010 1.00 0.00 C ATOM 452 O VAL A 32 -0.098 -3.181 19.381 1.00 0.00 O ATOM 453 CB VAL A 32 -1.703 -3.468 16.628 1.00 0.00 C ATOM 454 CG1 VAL A 32 -2.903 -2.941 15.812 1.00 0.00 C ATOM 455 CG2 VAL A 32 -0.395 -2.690 16.403 1.00 0.00 C ATOM 0 H VAL A 32 -2.387 -1.470 18.199 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.871 -4.340 18.145 1.00 0.00 H new ATOM 0 HB VAL A 32 -1.462 -4.466 16.262 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -2.625 -2.871 14.760 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -3.745 -3.625 15.920 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.187 -1.955 16.179 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -0.168 -2.661 15.337 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -0.508 -1.673 16.778 1.00 0.00 H new ATOM 0 HG23 VAL A 32 0.418 -3.185 16.934 1.00 0.00 H new ATOM 465 N HIS A 33 -0.880 -5.287 19.360 1.00 0.00 N ATOM 466 CA HIS A 33 0.122 -5.841 20.282 1.00 0.00 C ATOM 467 C HIS A 33 1.189 -6.717 19.594 1.00 0.00 C ATOM 468 O HIS A 33 2.333 -6.724 20.045 1.00 0.00 O ATOM 469 CB HIS A 33 -0.600 -6.622 21.394 1.00 0.00 C ATOM 470 CG HIS A 33 -1.096 -5.763 22.535 1.00 0.00 C ATOM 471 ND1 HIS A 33 -0.350 -4.853 23.251 1.00 0.00 N ATOM 472 CD2 HIS A 33 -2.326 -5.819 23.136 1.00 0.00 C ATOM 473 CE1 HIS A 33 -1.096 -4.389 24.261 1.00 0.00 C ATOM 474 NE2 HIS A 33 -2.321 -4.940 24.230 1.00 0.00 N ATOM 0 H HIS A 33 -1.535 -5.986 19.008 1.00 0.00 H new ATOM 0 HA HIS A 33 0.674 -5.001 20.704 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -1.447 -7.152 20.959 1.00 0.00 H new ATOM 0 HB3 HIS A 33 0.078 -7.377 21.791 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -3.157 -6.434 22.822 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -0.761 -3.673 24.997 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -3.092 -4.756 24.872 1.00 0.00 H new ATOM 482 N HIS A 34 0.877 -7.421 18.500 1.00 0.00 N ATOM 483 CA HIS A 34 1.897 -8.098 17.684 1.00 0.00 C ATOM 484 C HIS A 34 1.427 -8.311 16.235 1.00 0.00 C ATOM 485 O HIS A 34 0.337 -8.847 16.025 1.00 0.00 O ATOM 486 CB HIS A 34 2.297 -9.444 18.320 1.00 0.00 C ATOM 487 CG HIS A 34 3.445 -10.104 17.593 1.00 0.00 C ATOM 488 ND1 HIS A 34 3.344 -10.983 16.540 1.00 0.00 N ATOM 489 CD2 HIS A 34 4.781 -9.883 17.801 1.00 0.00 C ATOM 490 CE1 HIS A 34 4.584 -11.279 16.121 1.00 0.00 C ATOM 491 NE2 HIS A 34 5.508 -10.623 16.853 1.00 0.00 N ATOM 0 H HIS A 34 -0.076 -7.538 18.157 1.00 0.00 H new ATOM 0 HA HIS A 34 2.770 -7.447 17.654 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.574 -9.283 19.362 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.437 -10.113 18.319 1.00 0.00 H new ATOM 0 HD2 HIS A 34 5.204 -9.247 18.565 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.812 -11.952 15.307 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.521 -10.657 16.742 1.00 0.00 H new ATOM 499 N ILE A 35 2.254 -7.939 15.245 1.00 0.00 N ATOM 500 CA ILE A 35 2.037 -8.200 13.807 1.00 0.00 C ATOM 501 C ILE A 35 2.967 -9.290 13.248 1.00 0.00 C ATOM 502 O ILE A 35 4.197 -9.225 13.364 1.00 0.00 O ATOM 503 CB ILE A 35 2.105 -6.875 12.996 1.00 0.00 C ATOM 504 CG1 ILE A 35 1.813 -7.056 11.484 1.00 0.00 C ATOM 505 CG2 ILE A 35 3.375 -6.035 13.237 1.00 0.00 C ATOM 506 CD1 ILE A 35 3.019 -7.289 10.554 1.00 0.00 C ATOM 0 H ILE A 35 3.120 -7.432 15.426 1.00 0.00 H new ATOM 0 HA ILE A 35 1.031 -8.605 13.695 1.00 0.00 H new ATOM 0 HB ILE A 35 1.285 -6.287 13.408 1.00 0.00 H new ATOM 0 HG12 ILE A 35 1.132 -7.899 11.371 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.284 -6.170 11.134 1.00 0.00 H new ATOM 0 HG21 ILE A 35 3.334 -5.131 12.630 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.436 -5.762 14.290 1.00 0.00 H new ATOM 0 HG23 ILE A 35 4.254 -6.617 12.961 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.671 -7.399 9.527 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.698 -6.438 10.618 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.543 -8.195 10.858 1.00 0.00 H new ATOM 518 N LYS A 36 2.364 -10.258 12.554 1.00 0.00 N ATOM 519 CA LYS A 36 3.035 -11.225 11.678 1.00 0.00 C ATOM 520 C LYS A 36 2.365 -11.239 10.293 1.00 0.00 C ATOM 521 O LYS A 36 1.140 -11.312 10.190 1.00 0.00 O ATOM 522 CB LYS A 36 3.002 -12.626 12.322 1.00 0.00 C ATOM 523 CG LYS A 36 3.843 -13.660 11.549 1.00 0.00 C ATOM 524 CD LYS A 36 3.632 -15.074 12.104 1.00 0.00 C ATOM 525 CE LYS A 36 4.514 -16.078 11.352 1.00 0.00 C ATOM 526 NZ LYS A 36 4.200 -17.481 11.713 1.00 0.00 N ATOM 0 H LYS A 36 1.354 -10.396 12.587 1.00 0.00 H new ATOM 0 HA LYS A 36 4.076 -10.931 11.548 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.369 -12.559 13.346 1.00 0.00 H new ATOM 0 HB3 LYS A 36 1.970 -12.972 12.376 1.00 0.00 H new ATOM 0 HG2 LYS A 36 3.572 -13.637 10.493 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.898 -13.395 11.613 1.00 0.00 H new ATOM 0 HD2 LYS A 36 3.871 -15.094 13.167 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.584 -15.357 12.008 1.00 0.00 H new ATOM 0 HE2 LYS A 36 4.381 -15.943 10.279 1.00 0.00 H new ATOM 0 HE3 LYS A 36 5.562 -15.874 11.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 4.821 -18.124 11.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 4.351 -17.619 12.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 3.207 -17.686 11.479 1.00 0.00 H new ATOM 540 N VAL A 37 3.157 -11.218 9.228 1.00 0.00 N ATOM 541 CA VAL A 37 2.704 -11.452 7.850 1.00 0.00 C ATOM 542 C VAL A 37 3.492 -12.610 7.257 1.00 0.00 C ATOM 543 O VAL A 37 4.693 -12.736 7.482 1.00 0.00 O ATOM 544 CB VAL A 37 2.788 -10.187 6.970 1.00 0.00 C ATOM 545 CG1 VAL A 37 1.593 -9.285 7.290 1.00 0.00 C ATOM 546 CG2 VAL A 37 4.090 -9.385 7.128 1.00 0.00 C ATOM 0 H VAL A 37 4.158 -11.034 9.293 1.00 0.00 H new ATOM 0 HA VAL A 37 1.646 -11.713 7.877 1.00 0.00 H new ATOM 0 HB VAL A 37 2.774 -10.529 5.935 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.640 -8.387 6.675 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.667 -9.820 7.081 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.620 -9.005 8.343 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.063 -8.514 6.473 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.193 -9.058 8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.939 -10.014 6.860 1.00 0.00 H new ATOM 556 N SER A 38 2.789 -13.489 6.548 1.00 0.00 N ATOM 557 CA SER A 38 3.278 -14.810 6.148 1.00 0.00 C ATOM 558 C SER A 38 3.191 -14.961 4.623 1.00 0.00 C ATOM 559 O SER A 38 2.274 -15.590 4.085 1.00 0.00 O ATOM 560 CB SER A 38 2.492 -15.902 6.895 1.00 0.00 C ATOM 561 OG SER A 38 2.655 -15.757 8.300 1.00 0.00 O ATOM 0 H SER A 38 1.840 -13.300 6.227 1.00 0.00 H new ATOM 0 HA SER A 38 4.327 -14.920 6.422 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.435 -15.839 6.637 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.839 -16.887 6.582 1.00 0.00 H new ATOM 0 HG SER A 38 2.148 -16.457 8.762 1.00 0.00 H new ATOM 567 N LEU A 39 4.142 -14.345 3.908 1.00 0.00 N ATOM 568 CA LEU A 39 4.188 -14.305 2.438 1.00 0.00 C ATOM 569 C LEU A 39 4.285 -15.689 1.787 1.00 0.00 C ATOM 570 O LEU A 39 3.809 -15.868 0.667 1.00 0.00 O ATOM 571 CB LEU A 39 5.350 -13.388 2.009 1.00 0.00 C ATOM 572 CG LEU A 39 6.765 -13.972 2.244 1.00 0.00 C ATOM 573 CD1 LEU A 39 7.321 -14.743 1.034 1.00 0.00 C ATOM 574 CD2 LEU A 39 7.755 -12.838 2.538 1.00 0.00 C ATOM 0 H LEU A 39 4.919 -13.849 4.345 1.00 0.00 H new ATOM 0 HA LEU A 39 3.241 -13.901 2.081 1.00 0.00 H new ATOM 0 HB2 LEU A 39 5.239 -13.158 0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.268 -12.445 2.550 1.00 0.00 H new ATOM 0 HG LEU A 39 6.661 -14.662 3.081 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.315 -15.123 1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.660 -15.577 0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.383 -14.076 0.175 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.748 -13.256 2.702 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.785 -12.153 1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 39 7.436 -12.299 3.430 1.00 0.00 H new ATOM 586 N GLU A 40 4.868 -16.671 2.481 1.00 0.00 N ATOM 587 CA GLU A 40 5.015 -18.040 1.983 1.00 0.00 C ATOM 588 C GLU A 40 3.649 -18.742 1.876 1.00 0.00 C ATOM 589 O GLU A 40 3.505 -19.704 1.121 1.00 0.00 O ATOM 590 CB GLU A 40 5.964 -18.802 2.925 1.00 0.00 C ATOM 591 CG GLU A 40 6.506 -20.104 2.323 1.00 0.00 C ATOM 592 CD GLU A 40 7.340 -20.926 3.304 1.00 0.00 C ATOM 593 OE1 GLU A 40 7.797 -20.433 4.363 1.00 0.00 O ATOM 594 OE2 GLU A 40 7.554 -22.129 3.027 1.00 0.00 O ATOM 0 H GLU A 40 5.255 -16.535 3.415 1.00 0.00 H new ATOM 0 HA GLU A 40 5.437 -18.022 0.978 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.802 -18.155 3.186 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.437 -19.031 3.852 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.670 -20.709 1.973 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.115 -19.866 1.451 1.00 0.00 H new ATOM 601 N GLU A 41 2.650 -18.249 2.618 1.00 0.00 N ATOM 602 CA GLU A 41 1.308 -18.838 2.746 1.00 0.00 C ATOM 603 C GLU A 41 0.175 -17.875 2.334 1.00 0.00 C ATOM 604 O GLU A 41 -0.997 -18.265 2.330 1.00 0.00 O ATOM 605 CB GLU A 41 1.101 -19.290 4.202 1.00 0.00 C ATOM 606 CG GLU A 41 2.189 -20.263 4.682 1.00 0.00 C ATOM 607 CD GLU A 41 1.815 -20.873 6.023 1.00 0.00 C ATOM 608 OE1 GLU A 41 1.765 -20.154 7.042 1.00 0.00 O ATOM 609 OE2 GLU A 41 1.525 -22.092 6.079 1.00 0.00 O ATOM 0 H GLU A 41 2.757 -17.396 3.167 1.00 0.00 H new ATOM 0 HA GLU A 41 1.258 -19.684 2.060 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.090 -18.415 4.852 1.00 0.00 H new ATOM 0 HB3 GLU A 41 0.126 -19.768 4.294 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.328 -21.053 3.944 1.00 0.00 H new ATOM 0 HG3 GLU A 41 3.140 -19.738 4.769 1.00 0.00 H new ATOM 616 N LYS A 42 0.508 -16.622 2.001 1.00 0.00 N ATOM 617 CA LYS A 42 -0.411 -15.534 1.633 1.00 0.00 C ATOM 618 C LYS A 42 -1.536 -15.316 2.660 1.00 0.00 C ATOM 619 O LYS A 42 -2.731 -15.315 2.341 1.00 0.00 O ATOM 620 CB LYS A 42 -0.866 -15.672 0.169 1.00 0.00 C ATOM 621 CG LYS A 42 0.342 -15.463 -0.756 1.00 0.00 C ATOM 622 CD LYS A 42 -0.054 -15.395 -2.231 1.00 0.00 C ATOM 623 CE LYS A 42 1.184 -14.993 -3.035 1.00 0.00 C ATOM 624 NZ LYS A 42 0.855 -14.773 -4.455 1.00 0.00 N ATOM 0 H LYS A 42 1.482 -16.321 1.979 1.00 0.00 H new ATOM 0 HA LYS A 42 0.139 -14.594 1.679 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -1.301 -16.657 0.002 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.641 -14.939 -0.054 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.853 -14.541 -0.478 1.00 0.00 H new ATOM 0 HG3 LYS A 42 1.052 -16.278 -0.611 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.431 -16.360 -2.569 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -0.855 -14.671 -2.377 1.00 0.00 H new ATOM 0 HE2 LYS A 42 1.613 -14.084 -2.614 1.00 0.00 H new ATOM 0 HE3 LYS A 42 1.942 -15.772 -2.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 1.715 -14.502 -4.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 0.468 -15.649 -4.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 0.149 -14.013 -4.534 1.00 0.00 H new ATOM 638 N ASN A 43 -1.117 -15.111 3.913 1.00 0.00 N ATOM 639 CA ASN A 43 -1.967 -14.666 5.016 1.00 0.00 C ATOM 640 C ASN A 43 -1.206 -13.794 6.039 1.00 0.00 C ATOM 641 O ASN A 43 0.005 -13.588 5.934 1.00 0.00 O ATOM 642 CB ASN A 43 -2.704 -15.868 5.646 1.00 0.00 C ATOM 643 CG ASN A 43 -1.820 -16.784 6.487 1.00 0.00 C ATOM 644 OD1 ASN A 43 -1.241 -16.362 7.475 1.00 0.00 O ATOM 645 ND2 ASN A 43 -1.714 -18.053 6.146 1.00 0.00 N ATOM 0 H ASN A 43 -0.147 -15.255 4.193 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.731 -14.002 4.612 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -3.515 -15.494 6.271 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -3.160 -16.456 4.850 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -1.146 -18.687 6.709 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -2.200 -18.401 5.319 1.00 0.00 H new ATOM 652 N ALA A 44 -1.937 -13.251 7.009 1.00 0.00 N ATOM 653 CA ALA A 44 -1.496 -12.290 8.012 1.00 0.00 C ATOM 654 C ALA A 44 -2.142 -12.640 9.365 1.00 0.00 C ATOM 655 O ALA A 44 -3.353 -12.864 9.403 1.00 0.00 O ATOM 656 CB ALA A 44 -1.939 -10.904 7.506 1.00 0.00 C ATOM 0 H ALA A 44 -2.922 -13.489 7.121 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.416 -12.304 8.159 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.634 -10.141 8.222 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.474 -10.703 6.541 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.023 -10.886 7.397 1.00 0.00 H new ATOM 662 N THR A 45 -1.369 -12.680 10.460 1.00 0.00 N ATOM 663 CA THR A 45 -1.854 -12.985 11.820 1.00 0.00 C ATOM 664 C THR A 45 -1.474 -11.846 12.750 1.00 0.00 C ATOM 665 O THR A 45 -0.317 -11.437 12.803 1.00 0.00 O ATOM 666 CB THR A 45 -1.280 -14.304 12.353 1.00 0.00 C ATOM 667 OG1 THR A 45 -1.640 -15.348 11.478 1.00 0.00 O ATOM 668 CG2 THR A 45 -1.838 -14.647 13.736 1.00 0.00 C ATOM 0 H THR A 45 -0.366 -12.497 10.427 1.00 0.00 H new ATOM 0 HA THR A 45 -2.938 -13.095 11.777 1.00 0.00 H new ATOM 0 HB THR A 45 -0.198 -14.189 12.423 1.00 0.00 H new ATOM 0 HG1 THR A 45 -1.275 -16.194 11.811 1.00 0.00 H new ATOM 0 HG21 THR A 45 -1.407 -15.588 14.079 1.00 0.00 H new ATOM 0 HG22 THR A 45 -1.583 -13.854 14.438 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.922 -14.744 13.677 1.00 0.00 H new ATOM 676 N ILE A 46 -2.435 -11.344 13.520 1.00 0.00 N ATOM 677 CA ILE A 46 -2.243 -10.190 14.405 1.00 0.00 C ATOM 678 C ILE A 46 -2.982 -10.378 15.734 1.00 0.00 C ATOM 679 O ILE A 46 -4.099 -10.909 15.777 1.00 0.00 O ATOM 680 CB ILE A 46 -2.628 -8.891 13.649 1.00 0.00 C ATOM 681 CG1 ILE A 46 -2.177 -7.623 14.408 1.00 0.00 C ATOM 682 CG2 ILE A 46 -4.128 -8.843 13.307 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.591 -6.306 13.752 1.00 0.00 C ATOM 0 H ILE A 46 -3.380 -11.728 13.550 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.191 -10.102 14.678 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.085 -8.909 12.704 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.587 -7.655 15.418 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.091 -7.640 14.504 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -4.351 -7.916 12.779 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -4.384 -9.692 12.674 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.712 -8.886 14.226 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.232 -5.471 14.354 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -2.159 -6.246 12.753 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.678 -6.261 13.681 1.00 0.00 H new ATOM 695 N ILE A 47 -2.345 -9.921 16.814 1.00 0.00 N ATOM 696 CA ILE A 47 -2.959 -9.771 18.142 1.00 0.00 C ATOM 697 C ILE A 47 -3.178 -8.285 18.435 1.00 0.00 C ATOM 698 O ILE A 47 -2.266 -7.469 18.280 1.00 0.00 O ATOM 699 CB ILE A 47 -2.117 -10.471 19.238 1.00 0.00 C ATOM 700 CG1 ILE A 47 -2.065 -11.994 18.963 1.00 0.00 C ATOM 701 CG2 ILE A 47 -2.712 -10.195 20.636 1.00 0.00 C ATOM 702 CD1 ILE A 47 -1.340 -12.820 20.033 1.00 0.00 C ATOM 0 H ILE A 47 -1.365 -9.637 16.793 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.930 -10.266 18.147 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.103 -10.071 19.215 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.085 -12.366 18.867 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.574 -12.159 18.004 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.108 -10.694 21.394 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -2.716 -9.121 20.824 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.733 -10.574 20.678 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -1.356 -13.873 19.752 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.307 -12.482 20.116 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.841 -12.693 20.992 1.00 0.00 H new ATOM 714 N TYR A 48 -4.386 -7.955 18.888 1.00 0.00 N ATOM 715 CA TYR A 48 -4.854 -6.610 19.224 1.00 0.00 C ATOM 716 C TYR A 48 -5.602 -6.569 20.572 1.00 0.00 C ATOM 717 O TYR A 48 -6.064 -7.588 21.085 1.00 0.00 O ATOM 718 CB TYR A 48 -5.749 -6.092 18.082 1.00 0.00 C ATOM 719 CG TYR A 48 -7.091 -6.797 17.915 1.00 0.00 C ATOM 720 CD1 TYR A 48 -7.193 -7.964 17.128 1.00 0.00 C ATOM 721 CD2 TYR A 48 -8.249 -6.278 18.529 1.00 0.00 C ATOM 722 CE1 TYR A 48 -8.435 -8.612 16.966 1.00 0.00 C ATOM 723 CE2 TYR A 48 -9.499 -6.899 18.346 1.00 0.00 C ATOM 724 CZ TYR A 48 -9.596 -8.074 17.568 1.00 0.00 C ATOM 725 OH TYR A 48 -10.804 -8.687 17.416 1.00 0.00 O ATOM 0 H TYR A 48 -5.107 -8.660 19.040 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.985 -5.962 19.337 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.936 -5.031 18.246 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -5.197 -6.178 17.146 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -6.313 -8.364 16.646 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.176 -5.395 19.146 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -8.499 -9.519 16.383 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.383 -6.477 18.800 1.00 0.00 H new ATOM 0 HH TYR A 48 -11.491 -8.181 17.898 1.00 0.00 H new ATOM 735 N ASP A 49 -5.734 -5.370 21.130 1.00 0.00 N ATOM 736 CA ASP A 49 -6.515 -5.046 22.320 1.00 0.00 C ATOM 737 C ASP A 49 -7.908 -4.523 21.907 1.00 0.00 C ATOM 738 O ASP A 49 -7.991 -3.460 21.284 1.00 0.00 O ATOM 739 CB ASP A 49 -5.737 -3.986 23.112 1.00 0.00 C ATOM 740 CG ASP A 49 -6.394 -3.537 24.418 1.00 0.00 C ATOM 741 OD1 ASP A 49 -7.460 -4.082 24.784 1.00 0.00 O ATOM 742 OD2 ASP A 49 -5.807 -2.640 25.076 1.00 0.00 O ATOM 0 H ASP A 49 -5.271 -4.549 20.741 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.668 -5.929 22.940 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.746 -4.380 23.339 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -5.595 -3.112 22.476 1.00 0.00 H new ATOM 747 N PRO A 50 -9.007 -5.227 22.237 1.00 0.00 N ATOM 748 CA PRO A 50 -10.353 -4.836 21.837 1.00 0.00 C ATOM 749 C PRO A 50 -10.829 -3.531 22.493 1.00 0.00 C ATOM 750 O PRO A 50 -11.754 -2.920 21.971 1.00 0.00 O ATOM 751 CB PRO A 50 -11.249 -6.028 22.190 1.00 0.00 C ATOM 752 CG PRO A 50 -10.501 -6.724 23.321 1.00 0.00 C ATOM 753 CD PRO A 50 -9.040 -6.480 22.966 1.00 0.00 C ATOM 0 HA PRO A 50 -10.386 -4.611 20.771 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -12.240 -5.703 22.507 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -11.388 -6.690 21.336 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -10.756 -6.302 24.293 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.734 -7.788 23.364 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.425 -6.425 23.864 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -8.645 -7.295 22.359 1.00 0.00 H new ATOM 761 N LYS A 51 -10.195 -3.055 23.577 1.00 0.00 N ATOM 762 CA LYS A 51 -10.529 -1.777 24.239 1.00 0.00 C ATOM 763 C LYS A 51 -10.443 -0.542 23.311 1.00 0.00 C ATOM 764 O LYS A 51 -11.113 0.465 23.550 1.00 0.00 O ATOM 765 CB LYS A 51 -9.593 -1.600 25.443 1.00 0.00 C ATOM 766 CG LYS A 51 -9.886 -2.624 26.552 1.00 0.00 C ATOM 767 CD LYS A 51 -8.784 -2.696 27.616 1.00 0.00 C ATOM 768 CE LYS A 51 -8.385 -1.328 28.177 1.00 0.00 C ATOM 769 NZ LYS A 51 -7.359 -1.453 29.237 1.00 0.00 N ATOM 0 H LYS A 51 -9.425 -3.551 24.026 1.00 0.00 H new ATOM 0 HA LYS A 51 -11.573 -1.834 24.548 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -8.558 -1.704 25.117 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -9.701 -0.592 25.842 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.830 -2.368 27.033 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -10.013 -3.609 26.103 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.122 -3.331 28.435 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -7.904 -3.173 27.185 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.003 -0.701 27.372 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.266 -0.828 28.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.112 -0.508 29.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.734 -2.031 30.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.509 -1.908 28.846 1.00 0.00 H new ATOM 783 N LEU A 52 -9.616 -0.606 22.259 1.00 0.00 N ATOM 784 CA LEU A 52 -9.375 0.473 21.297 1.00 0.00 C ATOM 785 C LEU A 52 -9.032 -0.020 19.879 1.00 0.00 C ATOM 786 O LEU A 52 -8.345 0.685 19.135 1.00 0.00 O ATOM 787 CB LEU A 52 -8.374 1.482 21.888 1.00 0.00 C ATOM 788 CG LEU A 52 -6.899 1.049 21.995 1.00 0.00 C ATOM 789 CD1 LEU A 52 -6.238 2.009 22.975 1.00 0.00 C ATOM 790 CD2 LEU A 52 -6.688 -0.383 22.489 1.00 0.00 C ATOM 0 H LEU A 52 -9.076 -1.445 22.048 1.00 0.00 H new ATOM 0 HA LEU A 52 -10.314 1.004 21.139 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.415 2.388 21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.718 1.750 22.887 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.469 1.077 20.994 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.186 1.746 23.088 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.319 3.028 22.597 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.735 1.941 23.943 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.621 -0.599 22.532 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -7.121 -0.492 23.483 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.172 -1.079 21.804 1.00 0.00 H new ATOM 802 N GLN A 53 -9.470 -1.224 19.498 1.00 0.00 N ATOM 803 CA GLN A 53 -9.098 -1.838 18.220 1.00 0.00 C ATOM 804 C GLN A 53 -10.110 -2.906 17.743 1.00 0.00 C ATOM 805 O GLN A 53 -10.810 -3.527 18.551 1.00 0.00 O ATOM 806 CB GLN A 53 -7.652 -2.388 18.327 1.00 0.00 C ATOM 807 CG GLN A 53 -6.703 -1.867 17.241 1.00 0.00 C ATOM 808 CD GLN A 53 -7.211 -2.239 15.862 1.00 0.00 C ATOM 809 OE1 GLN A 53 -8.013 -1.530 15.277 1.00 0.00 O ATOM 810 NE2 GLN A 53 -6.891 -3.407 15.351 1.00 0.00 N ATOM 0 H GLN A 53 -10.092 -1.800 20.066 1.00 0.00 H new ATOM 0 HA GLN A 53 -9.128 -1.071 17.446 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -7.247 -2.127 19.305 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -7.684 -3.476 18.275 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -6.611 -0.784 17.320 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -5.707 -2.283 17.391 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -6.221 -4.008 15.832 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -7.312 -3.712 14.474 1.00 0.00 H new ATOM 819 N THR A 54 -10.170 -3.120 16.417 1.00 0.00 N ATOM 820 CA THR A 54 -11.073 -4.045 15.703 1.00 0.00 C ATOM 821 C THR A 54 -10.398 -4.648 14.453 1.00 0.00 C ATOM 822 O THR A 54 -9.471 -4.034 13.911 1.00 0.00 O ATOM 823 CB THR A 54 -12.379 -3.345 15.279 1.00 0.00 C ATOM 824 OG1 THR A 54 -12.097 -2.176 14.540 1.00 0.00 O ATOM 825 CG2 THR A 54 -13.271 -2.961 16.457 1.00 0.00 C ATOM 0 H THR A 54 -9.553 -2.623 15.775 1.00 0.00 H new ATOM 0 HA THR A 54 -11.307 -4.847 16.403 1.00 0.00 H new ATOM 0 HB THR A 54 -12.917 -4.072 14.671 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.937 -1.745 14.277 1.00 0.00 H new ATOM 0 HG21 THR A 54 -14.172 -2.473 16.087 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.546 -3.858 17.013 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.732 -2.278 17.114 1.00 0.00 H new ATOM 833 N PRO A 55 -10.859 -5.814 13.942 1.00 0.00 N ATOM 834 CA PRO A 55 -10.429 -6.377 12.654 1.00 0.00 C ATOM 835 C PRO A 55 -10.733 -5.463 11.461 1.00 0.00 C ATOM 836 O PRO A 55 -10.006 -5.487 10.470 1.00 0.00 O ATOM 837 CB PRO A 55 -11.183 -7.705 12.502 1.00 0.00 C ATOM 838 CG PRO A 55 -11.586 -8.071 13.925 1.00 0.00 C ATOM 839 CD PRO A 55 -11.823 -6.708 14.564 1.00 0.00 C ATOM 0 HA PRO A 55 -9.346 -6.502 12.655 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -12.055 -7.596 11.857 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -10.551 -8.473 12.057 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -12.483 -8.690 13.946 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.802 -8.628 14.438 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -12.843 -6.366 14.392 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -11.679 -6.750 15.644 1.00 0.00 H new ATOM 847 N LYS A 56 -11.780 -4.634 11.550 1.00 0.00 N ATOM 848 CA LYS A 56 -12.137 -3.676 10.500 1.00 0.00 C ATOM 849 C LYS A 56 -10.986 -2.707 10.168 1.00 0.00 C ATOM 850 O LYS A 56 -10.684 -2.524 8.988 1.00 0.00 O ATOM 851 CB LYS A 56 -13.435 -2.969 10.918 1.00 0.00 C ATOM 852 CG LYS A 56 -13.936 -1.972 9.865 1.00 0.00 C ATOM 853 CD LYS A 56 -15.406 -1.621 10.133 1.00 0.00 C ATOM 854 CE LYS A 56 -15.967 -0.601 9.138 1.00 0.00 C ATOM 855 NZ LYS A 56 -15.277 0.706 9.226 1.00 0.00 N ATOM 0 H LYS A 56 -12.405 -4.610 12.356 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.313 -4.204 9.563 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.207 -3.716 11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -13.270 -2.444 11.859 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -13.327 -1.068 9.889 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -13.832 -2.400 8.868 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.005 -2.531 10.089 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.501 -1.225 11.144 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -15.871 -0.993 8.126 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.032 -0.461 9.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -15.892 1.450 8.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -15.062 0.919 10.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -14.392 0.669 8.681 1.00 0.00 H new ATOM 869 N THR A 57 -10.265 -2.189 11.175 1.00 0.00 N ATOM 870 CA THR A 57 -9.040 -1.376 10.998 1.00 0.00 C ATOM 871 C THR A 57 -8.001 -2.090 10.140 1.00 0.00 C ATOM 872 O THR A 57 -7.401 -1.468 9.267 1.00 0.00 O ATOM 873 CB THR A 57 -8.430 -1.063 12.365 1.00 0.00 C ATOM 874 OG1 THR A 57 -9.394 -0.437 13.174 1.00 0.00 O ATOM 875 CG2 THR A 57 -7.204 -0.148 12.318 1.00 0.00 C ATOM 0 H THR A 57 -10.517 -2.323 12.154 1.00 0.00 H new ATOM 0 HA THR A 57 -9.326 -0.456 10.488 1.00 0.00 H new ATOM 0 HB THR A 57 -8.105 -2.024 12.765 1.00 0.00 H new ATOM 0 HG1 THR A 57 -9.205 -0.628 14.116 1.00 0.00 H new ATOM 0 HG21 THR A 57 -6.837 0.021 13.330 1.00 0.00 H new ATOM 0 HG22 THR A 57 -6.422 -0.618 11.722 1.00 0.00 H new ATOM 0 HG23 THR A 57 -7.479 0.806 11.868 1.00 0.00 H new ATOM 883 N LEU A 58 -7.801 -3.391 10.379 1.00 0.00 N ATOM 884 CA LEU A 58 -6.802 -4.215 9.695 1.00 0.00 C ATOM 885 C LEU A 58 -7.207 -4.476 8.241 1.00 0.00 C ATOM 886 O LEU A 58 -6.386 -4.298 7.349 1.00 0.00 O ATOM 887 CB LEU A 58 -6.598 -5.522 10.493 1.00 0.00 C ATOM 888 CG LEU A 58 -5.783 -5.453 11.812 1.00 0.00 C ATOM 889 CD1 LEU A 58 -5.357 -4.059 12.301 1.00 0.00 C ATOM 890 CD2 LEU A 58 -6.555 -6.150 12.944 1.00 0.00 C ATOM 0 H LEU A 58 -8.343 -3.911 11.070 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.850 -3.685 9.655 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.583 -5.925 10.730 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.109 -6.241 9.836 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.852 -5.960 11.558 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.796 -4.155 13.230 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -4.730 -3.584 11.546 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.243 -3.448 12.474 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.976 -6.097 13.866 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -7.515 -5.654 13.089 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.723 -7.194 12.681 1.00 0.00 H new ATOM 902 N GLN A 59 -8.468 -4.826 7.988 1.00 0.00 N ATOM 903 CA GLN A 59 -9.022 -4.959 6.635 1.00 0.00 C ATOM 904 C GLN A 59 -8.902 -3.647 5.836 1.00 0.00 C ATOM 905 O GLN A 59 -8.388 -3.643 4.719 1.00 0.00 O ATOM 906 CB GLN A 59 -10.496 -5.394 6.744 1.00 0.00 C ATOM 907 CG GLN A 59 -10.652 -6.868 7.155 1.00 0.00 C ATOM 908 CD GLN A 59 -10.377 -7.802 5.978 1.00 0.00 C ATOM 909 OE1 GLN A 59 -9.256 -8.224 5.750 1.00 0.00 O ATOM 910 NE2 GLN A 59 -11.366 -8.107 5.164 1.00 0.00 N ATOM 0 H GLN A 59 -9.144 -5.028 8.724 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.449 -5.712 6.094 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.004 -4.762 7.473 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.989 -5.234 5.785 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -9.966 -7.095 7.971 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -11.661 -7.039 7.530 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.306 -7.757 5.350 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.192 -8.693 4.348 1.00 0.00 H new ATOM 919 N GLU A 60 -9.365 -2.525 6.394 1.00 0.00 N ATOM 920 CA GLU A 60 -9.391 -1.206 5.734 1.00 0.00 C ATOM 921 C GLU A 60 -8.019 -0.527 5.620 1.00 0.00 C ATOM 922 O GLU A 60 -7.881 0.507 4.960 1.00 0.00 O ATOM 923 CB GLU A 60 -10.428 -0.305 6.419 1.00 0.00 C ATOM 924 CG GLU A 60 -11.795 -0.985 6.296 1.00 0.00 C ATOM 925 CD GLU A 60 -12.989 -0.127 6.701 1.00 0.00 C ATOM 926 OE1 GLU A 60 -12.915 0.673 7.665 1.00 0.00 O ATOM 927 OE2 GLU A 60 -14.054 -0.297 6.061 1.00 0.00 O ATOM 0 H GLU A 60 -9.743 -2.503 7.341 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.689 -1.377 4.699 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -10.170 -0.154 7.467 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.448 0.679 5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -11.932 -1.304 5.263 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -11.791 -1.886 6.910 1.00 0.00 H new ATOM 934 N ALA A 61 -7.000 -1.120 6.242 1.00 0.00 N ATOM 935 CA ALA A 61 -5.586 -0.839 5.959 1.00 0.00 C ATOM 936 C ALA A 61 -5.138 -1.395 4.598 1.00 0.00 C ATOM 937 O ALA A 61 -4.395 -0.733 3.879 1.00 0.00 O ATOM 938 CB ALA A 61 -4.710 -1.393 7.093 1.00 0.00 C ATOM 0 H ALA A 61 -7.133 -1.822 6.970 1.00 0.00 H new ATOM 0 HA ALA A 61 -5.467 0.243 5.905 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -3.662 -1.183 6.879 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.991 -0.920 8.034 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.855 -2.470 7.172 1.00 0.00 H new ATOM 944 N ILE A 62 -5.603 -2.587 4.206 1.00 0.00 N ATOM 945 CA ILE A 62 -5.188 -3.251 2.953 1.00 0.00 C ATOM 946 C ILE A 62 -5.672 -2.467 1.720 1.00 0.00 C ATOM 947 O ILE A 62 -5.089 -2.541 0.638 1.00 0.00 O ATOM 948 CB ILE A 62 -5.697 -4.718 2.950 1.00 0.00 C ATOM 949 CG1 ILE A 62 -5.426 -5.493 4.261 1.00 0.00 C ATOM 950 CG2 ILE A 62 -5.097 -5.512 1.783 1.00 0.00 C ATOM 951 CD1 ILE A 62 -3.982 -5.454 4.777 1.00 0.00 C ATOM 0 H ILE A 62 -6.280 -3.125 4.747 1.00 0.00 H new ATOM 0 HA ILE A 62 -4.099 -3.268 2.900 1.00 0.00 H new ATOM 0 HB ILE A 62 -6.778 -4.629 2.843 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -6.079 -5.095 5.037 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.709 -6.535 4.110 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -5.472 -6.535 1.808 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -5.381 -5.044 0.840 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -4.011 -5.522 1.870 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.910 -6.030 5.700 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -3.316 -5.883 4.028 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.692 -4.421 4.970 1.00 0.00 H new ATOM 963 N ASP A 63 -6.718 -1.665 1.906 1.00 0.00 N ATOM 964 CA ASP A 63 -7.307 -0.749 0.933 1.00 0.00 C ATOM 965 C ASP A 63 -6.389 0.429 0.538 1.00 0.00 C ATOM 966 O ASP A 63 -6.540 0.963 -0.563 1.00 0.00 O ATOM 967 CB ASP A 63 -8.621 -0.251 1.548 1.00 0.00 C ATOM 968 CG ASP A 63 -9.348 0.806 0.722 1.00 0.00 C ATOM 969 OD1 ASP A 63 -9.977 0.466 -0.311 1.00 0.00 O ATOM 970 OD2 ASP A 63 -9.339 1.977 1.167 1.00 0.00 O ATOM 0 H ASP A 63 -7.209 -1.636 2.800 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.470 -1.280 -0.005 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -9.286 -1.103 1.690 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.412 0.159 2.536 1.00 0.00 H new ATOM 975 N ASP A 64 -5.440 0.830 1.396 1.00 0.00 N ATOM 976 CA ASP A 64 -4.556 1.987 1.161 1.00 0.00 C ATOM 977 C ASP A 64 -3.550 1.755 0.018 1.00 0.00 C ATOM 978 O ASP A 64 -3.209 2.703 -0.691 1.00 0.00 O ATOM 979 CB ASP A 64 -3.828 2.389 2.461 1.00 0.00 C ATOM 980 CG ASP A 64 -4.743 3.055 3.502 1.00 0.00 C ATOM 981 OD1 ASP A 64 -5.714 3.751 3.114 1.00 0.00 O ATOM 982 OD2 ASP A 64 -4.464 2.946 4.721 1.00 0.00 O ATOM 0 H ASP A 64 -5.261 0.357 2.282 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.197 2.810 0.844 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.376 1.501 2.903 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -3.015 3.072 2.215 1.00 0.00 H new ATOM 987 N MET A 65 -3.154 0.499 -0.214 1.00 0.00 N ATOM 988 CA MET A 65 -2.363 0.059 -1.371 1.00 0.00 C ATOM 989 C MET A 65 -3.309 -0.447 -2.482 1.00 0.00 C ATOM 990 O MET A 65 -4.357 0.151 -2.729 1.00 0.00 O ATOM 991 CB MET A 65 -1.315 -0.994 -0.937 1.00 0.00 C ATOM 992 CG MET A 65 -0.371 -0.550 0.188 1.00 0.00 C ATOM 993 SD MET A 65 -1.056 -0.541 1.864 1.00 0.00 S ATOM 994 CE MET A 65 -1.385 -2.309 2.097 1.00 0.00 C ATOM 0 H MET A 65 -3.383 -0.267 0.420 1.00 0.00 H new ATOM 0 HA MET A 65 -1.802 0.898 -1.784 1.00 0.00 H new ATOM 0 HB2 MET A 65 -1.839 -1.894 -0.616 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.716 -1.267 -1.806 1.00 0.00 H new ATOM 0 HG2 MET A 65 0.501 -1.204 0.180 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.017 0.455 -0.041 1.00 0.00 H new ATOM 0 HE1 MET A 65 -1.779 -2.477 3.100 1.00 0.00 H new ATOM 0 HE2 MET A 65 -2.115 -2.643 1.360 1.00 0.00 H new ATOM 0 HE3 MET A 65 -0.459 -2.871 1.972 1.00 0.00 H new ATOM 1004 N GLY A 66 -2.973 -1.558 -3.150 1.00 0.00 N ATOM 1005 CA GLY A 66 -3.843 -2.264 -4.099 1.00 0.00 C ATOM 1006 C GLY A 66 -3.783 -3.772 -3.905 1.00 0.00 C ATOM 1007 O GLY A 66 -3.398 -4.498 -4.822 1.00 0.00 O ATOM 0 H GLY A 66 -2.062 -2.003 -3.042 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.870 -1.922 -3.974 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.546 -2.016 -5.118 1.00 0.00 H new ATOM 1011 N PHE A 67 -4.143 -4.221 -2.703 1.00 0.00 N ATOM 1012 CA PHE A 67 -4.198 -5.629 -2.311 1.00 0.00 C ATOM 1013 C PHE A 67 -5.619 -6.019 -1.851 1.00 0.00 C ATOM 1014 O PHE A 67 -6.464 -5.154 -1.585 1.00 0.00 O ATOM 1015 CB PHE A 67 -3.152 -5.897 -1.210 1.00 0.00 C ATOM 1016 CG PHE A 67 -1.699 -5.516 -1.477 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -1.123 -5.630 -2.758 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -0.897 -5.084 -0.401 1.00 0.00 C ATOM 1019 CE1 PHE A 67 0.217 -5.262 -2.972 1.00 0.00 C ATOM 1020 CE2 PHE A 67 0.451 -4.738 -0.609 1.00 0.00 C ATOM 1021 CZ PHE A 67 1.002 -4.805 -1.900 1.00 0.00 C ATOM 0 H PHE A 67 -4.414 -3.591 -1.948 1.00 0.00 H new ATOM 0 HA PHE A 67 -3.961 -6.251 -3.174 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.473 -5.369 -0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.178 -6.962 -0.980 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.715 -6.003 -3.581 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.320 -5.018 0.590 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.644 -5.331 -3.962 1.00 0.00 H new ATOM 0 HE2 PHE A 67 1.062 -4.421 0.223 1.00 0.00 H new ATOM 0 HZ PHE A 67 2.026 -4.506 -2.068 1.00 0.00 H new ATOM 1031 N ASP A 68 -5.873 -7.325 -1.744 1.00 0.00 N ATOM 1032 CA ASP A 68 -7.164 -7.916 -1.361 1.00 0.00 C ATOM 1033 C ASP A 68 -7.019 -8.815 -0.120 1.00 0.00 C ATOM 1034 O ASP A 68 -5.992 -9.475 0.067 1.00 0.00 O ATOM 1035 CB ASP A 68 -7.741 -8.739 -2.526 1.00 0.00 C ATOM 1036 CG ASP A 68 -7.886 -7.944 -3.825 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -8.853 -7.159 -3.963 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -7.027 -8.093 -4.721 1.00 0.00 O ATOM 0 H ASP A 68 -5.159 -8.030 -1.928 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.844 -7.099 -1.120 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.096 -9.599 -2.706 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.717 -9.128 -2.237 1.00 0.00 H new ATOM 1043 N ALA A 69 -8.058 -8.853 0.724 1.00 0.00 N ATOM 1044 CA ALA A 69 -8.037 -9.548 2.013 1.00 0.00 C ATOM 1045 C ALA A 69 -9.436 -9.951 2.516 1.00 0.00 C ATOM 1046 O ALA A 69 -10.406 -9.210 2.348 1.00 0.00 O ATOM 1047 CB ALA A 69 -7.334 -8.645 3.031 1.00 0.00 C ATOM 0 H ALA A 69 -8.948 -8.395 0.526 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.496 -10.485 1.883 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.306 -9.142 4.000 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.316 -8.444 2.697 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.879 -7.705 3.121 1.00 0.00 H new ATOM 1053 N VAL A 70 -9.511 -11.111 3.171 1.00 0.00 N ATOM 1054 CA VAL A 70 -10.711 -11.708 3.782 1.00 0.00 C ATOM 1055 C VAL A 70 -10.294 -12.346 5.108 1.00 0.00 C ATOM 1056 O VAL A 70 -9.219 -12.946 5.202 1.00 0.00 O ATOM 1057 CB VAL A 70 -11.342 -12.797 2.876 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -12.633 -13.389 3.467 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -11.687 -12.255 1.475 1.00 0.00 C ATOM 0 H VAL A 70 -8.687 -11.699 3.300 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.456 -10.926 3.927 1.00 0.00 H new ATOM 0 HB VAL A 70 -10.580 -13.574 2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -13.030 -14.146 2.790 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -12.415 -13.845 4.433 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -13.370 -12.597 3.598 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.126 -13.052 0.875 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.399 -11.435 1.567 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.780 -11.894 0.991 1.00 0.00 H new ATOM 1069 N ILE A 71 -11.128 -12.218 6.139 1.00 0.00 N ATOM 1070 CA ILE A 71 -10.877 -12.806 7.461 1.00 0.00 C ATOM 1071 C ILE A 71 -11.063 -14.327 7.426 1.00 0.00 C ATOM 1072 O ILE A 71 -11.985 -14.857 6.802 1.00 0.00 O ATOM 1073 CB ILE A 71 -11.718 -12.085 8.546 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -11.272 -10.601 8.642 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -11.572 -12.788 9.912 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -12.117 -9.721 9.564 1.00 0.00 C ATOM 0 H ILE A 71 -12.005 -11.700 6.083 1.00 0.00 H new ATOM 0 HA ILE A 71 -9.835 -12.648 7.740 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.770 -12.125 8.264 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -10.238 -10.571 8.986 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -11.287 -10.169 7.641 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -12.171 -12.264 10.657 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -11.916 -13.819 9.829 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -10.525 -12.778 10.216 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -11.722 -8.705 9.560 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -13.149 -9.711 9.212 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -12.084 -10.119 10.578 1.00 0.00 H new ATOM 1088 N HIS A 72 -10.159 -15.037 8.096 1.00 0.00 N ATOM 1089 CA HIS A 72 -10.045 -16.490 8.015 1.00 0.00 C ATOM 1090 C HIS A 72 -9.763 -17.140 9.393 1.00 0.00 C ATOM 1091 O HIS A 72 -9.151 -18.209 9.492 1.00 0.00 O ATOM 1092 CB HIS A 72 -9.018 -16.818 6.910 1.00 0.00 C ATOM 1093 CG HIS A 72 -9.054 -18.263 6.490 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -7.984 -19.106 6.293 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -10.189 -18.995 6.282 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -8.468 -20.320 5.981 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -9.816 -20.310 5.974 1.00 0.00 N ATOM 0 H HIS A 72 -9.474 -14.612 8.721 1.00 0.00 H new ATOM 0 HA HIS A 72 -10.997 -16.940 7.732 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -9.211 -16.187 6.042 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.017 -16.573 7.266 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -11.201 -18.623 6.344 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -7.860 -21.186 5.765 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -10.436 -21.097 5.784 1.00 0.00 H new ATOM 1105 N ASN A 73 -10.220 -16.498 10.479 1.00 0.00 N ATOM 1106 CA ASN A 73 -10.288 -17.087 11.824 1.00 0.00 C ATOM 1107 C ASN A 73 -11.544 -17.947 11.994 1.00 0.00 C ATOM 1108 O ASN A 73 -11.406 -19.125 12.399 1.00 0.00 O ATOM 1109 CB ASN A 73 -10.198 -15.970 12.886 1.00 0.00 C ATOM 1110 CG ASN A 73 -10.267 -16.497 14.311 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -11.269 -16.364 14.999 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -9.244 -17.157 14.789 1.00 0.00 N ATOM 1113 OXT ASN A 73 -12.658 -17.450 11.711 1.00 0.00 O ATOM 0 H ASN A 73 -10.559 -15.537 10.446 1.00 0.00 H new ATOM 0 HA ASN A 73 -9.438 -17.755 11.962 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -9.265 -15.423 12.752 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -11.009 -15.260 12.728 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -9.287 -17.555 15.727 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -8.403 -17.274 14.224 1.00 0.00 H new TER 1120 ASN A 73 ATOM 1121 N MET B 74 -1.605 19.567 -21.071 1.00 0.00 N ATOM 1122 CA MET B 74 -0.473 19.563 -22.017 1.00 0.00 C ATOM 1123 C MET B 74 0.765 18.813 -21.508 1.00 0.00 C ATOM 1124 O MET B 74 1.196 17.916 -22.236 1.00 0.00 O ATOM 1125 CB MET B 74 -0.167 20.972 -22.547 1.00 0.00 C ATOM 1126 CG MET B 74 0.883 20.971 -23.666 1.00 0.00 C ATOM 1127 SD MET B 74 0.469 19.974 -25.127 1.00 0.00 S ATOM 1128 CE MET B 74 -0.893 20.954 -25.821 1.00 0.00 C ATOM 0 HA MET B 74 -0.799 18.974 -22.874 1.00 0.00 H new ATOM 0 HB2 MET B 74 -1.087 21.423 -22.919 1.00 0.00 H new ATOM 0 HB3 MET B 74 0.185 21.596 -21.725 1.00 0.00 H new ATOM 0 HG2 MET B 74 1.049 22.000 -23.985 1.00 0.00 H new ATOM 0 HG3 MET B 74 1.825 20.608 -23.256 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.226 20.503 -26.756 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.722 20.977 -25.114 1.00 0.00 H new ATOM 0 HE3 MET B 74 -0.550 21.971 -26.011 1.00 0.00 H new ATOM 1140 N PRO B 75 1.400 19.152 -20.363 1.00 0.00 N ATOM 1141 CA PRO B 75 2.736 18.656 -20.045 1.00 0.00 C ATOM 1142 C PRO B 75 2.727 17.283 -19.357 1.00 0.00 C ATOM 1143 O PRO B 75 1.694 16.790 -18.907 1.00 0.00 O ATOM 1144 CB PRO B 75 3.340 19.732 -19.146 1.00 0.00 C ATOM 1145 CG PRO B 75 2.137 20.200 -18.333 1.00 0.00 C ATOM 1146 CD PRO B 75 0.995 20.122 -19.347 1.00 0.00 C ATOM 0 HA PRO B 75 3.317 18.489 -20.952 1.00 0.00 H new ATOM 0 HB2 PRO B 75 4.129 19.332 -18.509 1.00 0.00 H new ATOM 0 HB3 PRO B 75 3.779 20.545 -19.725 1.00 0.00 H new ATOM 0 HG2 PRO B 75 1.957 19.559 -17.470 1.00 0.00 H new ATOM 0 HG3 PRO B 75 2.274 21.213 -17.954 1.00 0.00 H new ATOM 0 HD2 PRO B 75 0.069 19.812 -18.863 1.00 0.00 H new ATOM 0 HD3 PRO B 75 0.809 21.098 -19.796 1.00 0.00 H new ATOM 1154 N LYS B 76 3.912 16.680 -19.254 1.00 0.00 N ATOM 1155 CA LYS B 76 4.142 15.341 -18.697 1.00 0.00 C ATOM 1156 C LYS B 76 5.104 15.397 -17.494 1.00 0.00 C ATOM 1157 O LYS B 76 5.999 16.240 -17.450 1.00 0.00 O ATOM 1158 CB LYS B 76 4.683 14.481 -19.851 1.00 0.00 C ATOM 1159 CG LYS B 76 4.729 12.977 -19.554 1.00 0.00 C ATOM 1160 CD LYS B 76 5.108 12.225 -20.831 1.00 0.00 C ATOM 1161 CE LYS B 76 5.102 10.711 -20.618 1.00 0.00 C ATOM 1162 NZ LYS B 76 5.054 10.019 -21.926 1.00 0.00 N ATOM 0 H LYS B 76 4.774 17.126 -19.568 1.00 0.00 H new ATOM 0 HA LYS B 76 3.223 14.905 -18.305 1.00 0.00 H new ATOM 0 HB2 LYS B 76 4.063 14.646 -20.732 1.00 0.00 H new ATOM 0 HB3 LYS B 76 5.688 14.820 -20.100 1.00 0.00 H new ATOM 0 HG2 LYS B 76 5.455 12.771 -18.767 1.00 0.00 H new ATOM 0 HG3 LYS B 76 3.760 12.636 -19.191 1.00 0.00 H new ATOM 0 HD2 LYS B 76 4.409 12.483 -21.627 1.00 0.00 H new ATOM 0 HD3 LYS B 76 6.097 12.542 -21.160 1.00 0.00 H new ATOM 0 HE2 LYS B 76 5.994 10.409 -20.069 1.00 0.00 H new ATOM 0 HE3 LYS B 76 4.242 10.423 -20.013 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 5.050 8.990 -21.774 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 4.191 10.297 -22.435 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 5.888 10.283 -22.489 1.00 0.00 H new ATOM 1176 N HIS B 77 4.961 14.506 -16.513 1.00 0.00 N ATOM 1177 CA HIS B 77 5.781 14.502 -15.294 1.00 0.00 C ATOM 1178 C HIS B 77 6.140 13.075 -14.840 1.00 0.00 C ATOM 1179 O HIS B 77 5.533 12.091 -15.271 1.00 0.00 O ATOM 1180 CB HIS B 77 5.107 15.332 -14.175 1.00 0.00 C ATOM 1181 CG HIS B 77 3.596 15.267 -14.081 1.00 0.00 C ATOM 1182 ND1 HIS B 77 2.749 16.280 -13.691 1.00 0.00 N ATOM 1183 CD2 HIS B 77 2.804 14.193 -14.372 1.00 0.00 C ATOM 1184 CE1 HIS B 77 1.487 15.823 -13.762 1.00 0.00 C ATOM 1185 NE2 HIS B 77 1.463 14.549 -14.194 1.00 0.00 N ATOM 0 H HIS B 77 4.267 13.759 -16.539 1.00 0.00 H new ATOM 0 HA HIS B 77 6.729 14.985 -15.529 1.00 0.00 H new ATOM 0 HB2 HIS B 77 5.519 15.009 -13.219 1.00 0.00 H new ATOM 0 HB3 HIS B 77 5.393 16.375 -14.309 1.00 0.00 H new ATOM 0 HD1 HIS B 77 3.031 17.216 -13.399 1.00 0.00 H new ATOM 0 HD2 HIS B 77 3.157 13.223 -14.689 1.00 0.00 H new ATOM 0 HE1 HIS B 77 0.611 16.400 -13.507 1.00 0.00 H new ATOM 1193 N GLU B 78 7.149 12.963 -13.976 1.00 0.00 N ATOM 1194 CA GLU B 78 7.670 11.685 -13.491 1.00 0.00 C ATOM 1195 C GLU B 78 7.790 11.712 -11.967 1.00 0.00 C ATOM 1196 O GLU B 78 8.134 12.737 -11.380 1.00 0.00 O ATOM 1197 CB GLU B 78 9.036 11.374 -14.128 1.00 0.00 C ATOM 1198 CG GLU B 78 8.952 11.181 -15.653 1.00 0.00 C ATOM 1199 CD GLU B 78 10.282 10.745 -16.267 1.00 0.00 C ATOM 1200 OE1 GLU B 78 11.359 11.126 -15.753 1.00 0.00 O ATOM 1201 OE2 GLU B 78 10.273 10.007 -17.281 1.00 0.00 O ATOM 0 H GLU B 78 7.635 13.771 -13.587 1.00 0.00 H new ATOM 0 HA GLU B 78 6.973 10.898 -13.778 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.729 12.186 -13.907 1.00 0.00 H new ATOM 0 HB3 GLU B 78 9.447 10.472 -13.674 1.00 0.00 H new ATOM 0 HG2 GLU B 78 8.190 10.435 -15.879 1.00 0.00 H new ATOM 0 HG3 GLU B 78 8.631 12.114 -16.116 1.00 0.00 H new ATOM 1208 N PHE B 79 7.514 10.570 -11.336 1.00 0.00 N ATOM 1209 CA PHE B 79 7.576 10.380 -9.890 1.00 0.00 C ATOM 1210 C PHE B 79 8.395 9.120 -9.591 1.00 0.00 C ATOM 1211 O PHE B 79 8.078 8.032 -10.086 1.00 0.00 O ATOM 1212 CB PHE B 79 6.155 10.271 -9.307 1.00 0.00 C ATOM 1213 CG PHE B 79 5.273 11.501 -9.473 1.00 0.00 C ATOM 1214 CD1 PHE B 79 4.661 11.780 -10.714 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.037 12.353 -8.378 1.00 0.00 C ATOM 1216 CE1 PHE B 79 3.849 12.918 -10.868 1.00 0.00 C ATOM 1217 CE2 PHE B 79 4.197 13.473 -8.521 1.00 0.00 C ATOM 1218 CZ PHE B 79 3.613 13.762 -9.767 1.00 0.00 C ATOM 0 H PHE B 79 7.232 9.726 -11.835 1.00 0.00 H new ATOM 0 HA PHE B 79 8.060 11.237 -9.422 1.00 0.00 H new ATOM 0 HB2 PHE B 79 5.655 9.423 -9.775 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.236 10.046 -8.243 1.00 0.00 H new ATOM 0 HD1 PHE B 79 4.817 11.115 -11.551 1.00 0.00 H new ATOM 0 HD2 PHE B 79 5.502 12.147 -7.425 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.408 13.143 -11.828 1.00 0.00 H new ATOM 0 HE2 PHE B 79 4.001 14.112 -7.672 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.983 14.632 -9.879 1.00 0.00 H new ATOM 1228 N SER B 80 9.446 9.261 -8.788 1.00 0.00 N ATOM 1229 CA SER B 80 10.224 8.135 -8.257 1.00 0.00 C ATOM 1230 C SER B 80 9.552 7.569 -7.003 1.00 0.00 C ATOM 1231 O SER B 80 9.055 8.332 -6.176 1.00 0.00 O ATOM 1232 CB SER B 80 11.659 8.557 -7.930 1.00 0.00 C ATOM 1233 OG SER B 80 12.376 8.817 -9.124 1.00 0.00 O ATOM 0 H SER B 80 9.789 10.171 -8.481 1.00 0.00 H new ATOM 0 HA SER B 80 10.260 7.363 -9.026 1.00 0.00 H new ATOM 0 HB2 SER B 80 11.650 9.447 -7.301 1.00 0.00 H new ATOM 0 HB3 SER B 80 12.157 7.771 -7.362 1.00 0.00 H new ATOM 0 HG SER B 80 13.292 9.088 -8.903 1.00 0.00 H new ATOM 1239 N VAL B 81 9.550 6.240 -6.863 1.00 0.00 N ATOM 1240 CA VAL B 81 8.884 5.486 -5.787 1.00 0.00 C ATOM 1241 C VAL B 81 9.631 4.172 -5.596 1.00 0.00 C ATOM 1242 O VAL B 81 10.064 3.572 -6.572 1.00 0.00 O ATOM 1243 CB VAL B 81 7.396 5.156 -6.089 1.00 0.00 C ATOM 1244 CG1 VAL B 81 6.466 6.334 -5.766 1.00 0.00 C ATOM 1245 CG2 VAL B 81 7.137 4.703 -7.543 1.00 0.00 C ATOM 0 H VAL B 81 10.032 5.630 -7.523 1.00 0.00 H new ATOM 0 HA VAL B 81 8.901 6.114 -4.896 1.00 0.00 H new ATOM 0 HB VAL B 81 7.170 4.316 -5.432 1.00 0.00 H new ATOM 0 HG11 VAL B 81 5.436 6.057 -5.993 1.00 0.00 H new ATOM 0 HG12 VAL B 81 6.550 6.584 -4.708 1.00 0.00 H new ATOM 0 HG13 VAL B 81 6.751 7.198 -6.367 1.00 0.00 H new ATOM 0 HG21 VAL B 81 6.076 4.491 -7.675 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.437 5.495 -8.230 1.00 0.00 H new ATOM 0 HG23 VAL B 81 7.715 3.803 -7.752 1.00 0.00 H new ATOM 1255 N ASP B 82 9.756 3.697 -4.354 1.00 0.00 N ATOM 1256 CA ASP B 82 10.574 2.519 -4.018 1.00 0.00 C ATOM 1257 C ASP B 82 10.034 1.173 -4.566 1.00 0.00 C ATOM 1258 O ASP B 82 10.628 0.120 -4.338 1.00 0.00 O ATOM 1259 CB ASP B 82 10.804 2.495 -2.500 1.00 0.00 C ATOM 1260 CG ASP B 82 12.127 1.826 -2.130 1.00 0.00 C ATOM 1261 OD1 ASP B 82 13.185 2.476 -2.293 1.00 0.00 O ATOM 1262 OD2 ASP B 82 12.135 0.677 -1.639 1.00 0.00 O ATOM 0 H ASP B 82 9.293 4.117 -3.548 1.00 0.00 H new ATOM 0 HA ASP B 82 11.529 2.625 -4.533 1.00 0.00 H new ATOM 0 HB2 ASP B 82 10.794 3.515 -2.116 1.00 0.00 H new ATOM 0 HB3 ASP B 82 9.983 1.965 -2.018 1.00 0.00 H new ATOM 1267 N MET B 83 8.936 1.218 -5.325 1.00 0.00 N ATOM 1268 CA MET B 83 8.378 0.132 -6.139 1.00 0.00 C ATOM 1269 C MET B 83 9.393 -0.368 -7.182 1.00 0.00 C ATOM 1270 O MET B 83 10.030 0.426 -7.874 1.00 0.00 O ATOM 1271 CB MET B 83 7.095 0.677 -6.800 1.00 0.00 C ATOM 1272 CG MET B 83 6.369 -0.251 -7.790 1.00 0.00 C ATOM 1273 SD MET B 83 7.118 -0.536 -9.424 1.00 0.00 S ATOM 1274 CE MET B 83 7.489 1.153 -9.968 1.00 0.00 C ATOM 0 H MET B 83 8.376 2.068 -5.392 1.00 0.00 H new ATOM 0 HA MET B 83 8.144 -0.733 -5.518 1.00 0.00 H new ATOM 0 HB2 MET B 83 6.394 0.943 -6.009 1.00 0.00 H new ATOM 0 HB3 MET B 83 7.349 1.598 -7.324 1.00 0.00 H new ATOM 0 HG2 MET B 83 6.248 -1.221 -7.307 1.00 0.00 H new ATOM 0 HG3 MET B 83 5.369 0.152 -7.950 1.00 0.00 H new ATOM 0 HE1 MET B 83 7.750 1.145 -11.026 1.00 0.00 H new ATOM 0 HE2 MET B 83 6.614 1.785 -9.814 1.00 0.00 H new ATOM 0 HE3 MET B 83 8.326 1.545 -9.391 1.00 0.00 H new ATOM 1284 N THR B 84 9.500 -1.697 -7.307 1.00 0.00 N ATOM 1285 CA THR B 84 10.279 -2.448 -8.314 1.00 0.00 C ATOM 1286 C THR B 84 9.811 -3.898 -8.366 1.00 0.00 C ATOM 1287 O THR B 84 9.807 -4.522 -9.425 1.00 0.00 O ATOM 1288 CB THR B 84 11.790 -2.344 -8.054 1.00 0.00 C ATOM 1289 OG1 THR B 84 12.476 -2.754 -9.210 1.00 0.00 O ATOM 1290 CG2 THR B 84 12.312 -3.142 -6.857 1.00 0.00 C ATOM 0 H THR B 84 9.013 -2.324 -6.666 1.00 0.00 H new ATOM 0 HA THR B 84 10.100 -1.999 -9.291 1.00 0.00 H new ATOM 0 HB THR B 84 11.973 -1.299 -7.805 1.00 0.00 H new ATOM 0 HG1 THR B 84 12.291 -2.127 -9.940 1.00 0.00 H new ATOM 0 HG21 THR B 84 13.388 -2.998 -6.765 1.00 0.00 H new ATOM 0 HG22 THR B 84 11.821 -2.797 -5.947 1.00 0.00 H new ATOM 0 HG23 THR B 84 12.099 -4.201 -7.005 1.00 0.00 H new ATOM 1298 N CYS B 85 9.349 -4.401 -7.221 1.00 0.00 N ATOM 1299 CA CYS B 85 8.579 -5.624 -7.121 1.00 0.00 C ATOM 1300 C CYS B 85 7.194 -5.528 -7.833 1.00 0.00 C ATOM 1301 O CYS B 85 6.510 -4.496 -7.821 1.00 0.00 O ATOM 1302 CB CYS B 85 8.583 -6.047 -5.637 1.00 0.00 C ATOM 1303 SG CYS B 85 7.793 -4.852 -4.522 1.00 0.00 S ATOM 0 H CYS B 85 9.508 -3.952 -6.319 1.00 0.00 H new ATOM 0 HA CYS B 85 9.035 -6.439 -7.684 1.00 0.00 H new ATOM 0 HB2 CYS B 85 8.074 -7.006 -5.543 1.00 0.00 H new ATOM 0 HB3 CYS B 85 9.614 -6.200 -5.317 1.00 0.00 H new ATOM 1308 N GLY B 86 6.797 -6.624 -8.492 1.00 0.00 N ATOM 1309 CA GLY B 86 5.715 -6.638 -9.490 1.00 0.00 C ATOM 1310 C GLY B 86 4.298 -6.582 -8.924 1.00 0.00 C ATOM 1311 O GLY B 86 3.398 -6.071 -9.593 1.00 0.00 O ATOM 0 H GLY B 86 7.223 -7.539 -8.346 1.00 0.00 H new ATOM 0 HA2 GLY B 86 5.853 -5.791 -10.162 1.00 0.00 H new ATOM 0 HA3 GLY B 86 5.812 -7.541 -10.092 1.00 0.00 H new ATOM 1315 N GLY B 87 4.096 -7.040 -7.685 1.00 0.00 N ATOM 1316 CA GLY B 87 2.834 -6.874 -6.952 1.00 0.00 C ATOM 1317 C GLY B 87 2.621 -5.421 -6.530 1.00 0.00 C ATOM 1318 O GLY B 87 1.518 -4.892 -6.643 1.00 0.00 O ATOM 0 H GLY B 87 4.810 -7.541 -7.156 1.00 0.00 H new ATOM 0 HA2 GLY B 87 2.003 -7.198 -7.578 1.00 0.00 H new ATOM 0 HA3 GLY B 87 2.837 -7.514 -6.070 1.00 0.00 H new ATOM 1322 N CYS B 88 3.695 -4.729 -6.141 1.00 0.00 N ATOM 1323 CA CYS B 88 3.677 -3.291 -5.867 1.00 0.00 C ATOM 1324 C CYS B 88 3.362 -2.449 -7.121 1.00 0.00 C ATOM 1325 O CYS B 88 2.662 -1.438 -7.015 1.00 0.00 O ATOM 1326 CB CYS B 88 5.002 -2.929 -5.191 1.00 0.00 C ATOM 1327 SG CYS B 88 4.938 -1.220 -4.587 1.00 0.00 S ATOM 0 H CYS B 88 4.611 -5.157 -6.006 1.00 0.00 H new ATOM 0 HA CYS B 88 2.859 -3.048 -5.189 1.00 0.00 H new ATOM 0 HB2 CYS B 88 5.196 -3.610 -4.362 1.00 0.00 H new ATOM 0 HB3 CYS B 88 5.824 -3.044 -5.897 1.00 0.00 H new ATOM 0 HG CYS B 88 4.040 -0.557 -5.254 1.00 0.00 H new ATOM 1333 N ALA B 89 3.766 -2.890 -8.320 1.00 0.00 N ATOM 1334 CA ALA B 89 3.331 -2.266 -9.579 1.00 0.00 C ATOM 1335 C ALA B 89 1.801 -2.334 -9.772 1.00 0.00 C ATOM 1336 O ALA B 89 1.177 -1.304 -10.037 1.00 0.00 O ATOM 1337 CB ALA B 89 4.095 -2.872 -10.759 1.00 0.00 C ATOM 0 H ALA B 89 4.397 -3.681 -8.446 1.00 0.00 H new ATOM 0 HA ALA B 89 3.572 -1.204 -9.530 1.00 0.00 H new ATOM 0 HB1 ALA B 89 3.765 -2.403 -11.686 1.00 0.00 H new ATOM 0 HB2 ALA B 89 5.163 -2.702 -10.627 1.00 0.00 H new ATOM 0 HB3 ALA B 89 3.901 -3.944 -10.806 1.00 0.00 H new ATOM 1343 N GLU B 90 1.180 -3.502 -9.541 1.00 0.00 N ATOM 1344 CA GLU B 90 -0.287 -3.619 -9.491 1.00 0.00 C ATOM 1345 C GLU B 90 -0.872 -2.713 -8.395 1.00 0.00 C ATOM 1346 O GLU B 90 -1.885 -2.053 -8.619 1.00 0.00 O ATOM 1347 CB GLU B 90 -0.721 -5.083 -9.274 1.00 0.00 C ATOM 1348 CG GLU B 90 -2.252 -5.252 -9.332 1.00 0.00 C ATOM 1349 CD GLU B 90 -2.721 -6.648 -8.924 1.00 0.00 C ATOM 1350 OE1 GLU B 90 -2.152 -7.648 -9.421 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -3.686 -6.755 -8.125 1.00 0.00 O ATOM 0 H GLU B 90 1.673 -4.381 -9.385 1.00 0.00 H new ATOM 0 HA GLU B 90 -0.680 -3.290 -10.453 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -0.259 -5.713 -10.034 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -0.356 -5.429 -8.307 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -2.717 -4.514 -8.678 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -2.596 -5.042 -10.345 1.00 0.00 H new ATOM 1358 N ALA B 91 -0.230 -2.633 -7.223 1.00 0.00 N ATOM 1359 CA ALA B 91 -0.689 -1.778 -6.134 1.00 0.00 C ATOM 1360 C ALA B 91 -0.708 -0.294 -6.524 1.00 0.00 C ATOM 1361 O ALA B 91 -1.750 0.348 -6.399 1.00 0.00 O ATOM 1362 CB ALA B 91 0.142 -2.039 -4.873 1.00 0.00 C ATOM 0 H ALA B 91 0.618 -3.158 -7.009 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.725 -2.036 -5.916 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -0.209 -1.395 -4.066 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.036 -3.083 -4.577 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.191 -1.825 -5.078 1.00 0.00 H new ATOM 1368 N VAL B 92 0.404 0.247 -7.031 1.00 0.00 N ATOM 1369 CA VAL B 92 0.473 1.665 -7.427 1.00 0.00 C ATOM 1370 C VAL B 92 -0.428 1.970 -8.640 1.00 0.00 C ATOM 1371 O VAL B 92 -0.997 3.055 -8.705 1.00 0.00 O ATOM 1372 CB VAL B 92 1.927 2.164 -7.596 1.00 0.00 C ATOM 1373 CG1 VAL B 92 2.625 1.572 -8.823 1.00 0.00 C ATOM 1374 CG2 VAL B 92 1.999 3.699 -7.646 1.00 0.00 C ATOM 0 H VAL B 92 1.270 -0.271 -7.178 1.00 0.00 H new ATOM 0 HA VAL B 92 0.066 2.247 -6.600 1.00 0.00 H new ATOM 0 HB VAL B 92 2.460 1.812 -6.713 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.641 1.961 -8.886 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.657 0.486 -8.735 1.00 0.00 H new ATOM 0 HG13 VAL B 92 2.075 1.847 -9.723 1.00 0.00 H new ATOM 0 HG21 VAL B 92 3.037 4.011 -7.765 1.00 0.00 H new ATOM 0 HG22 VAL B 92 1.411 4.064 -8.488 1.00 0.00 H new ATOM 0 HG23 VAL B 92 1.600 4.112 -6.720 1.00 0.00 H new ATOM 1384 N SER B 93 -0.669 1.004 -9.539 1.00 0.00 N ATOM 1385 CA SER B 93 -1.728 1.102 -10.562 1.00 0.00 C ATOM 1386 C SER B 93 -3.121 1.232 -9.914 1.00 0.00 C ATOM 1387 O SER B 93 -3.827 2.215 -10.140 1.00 0.00 O ATOM 1388 CB SER B 93 -1.654 -0.115 -11.498 1.00 0.00 C ATOM 1389 OG SER B 93 -2.583 -0.010 -12.561 1.00 0.00 O ATOM 0 H SER B 93 -0.138 0.134 -9.580 1.00 0.00 H new ATOM 0 HA SER B 93 -1.567 2.005 -11.151 1.00 0.00 H new ATOM 0 HB2 SER B 93 -0.646 -0.203 -11.902 1.00 0.00 H new ATOM 0 HB3 SER B 93 -1.851 -1.024 -10.930 1.00 0.00 H new ATOM 0 HG SER B 93 -2.510 -0.798 -13.139 1.00 0.00 H new ATOM 1395 N ARG B 94 -3.487 0.308 -9.014 1.00 0.00 N ATOM 1396 CA ARG B 94 -4.752 0.323 -8.260 1.00 0.00 C ATOM 1397 C ARG B 94 -4.912 1.556 -7.351 1.00 0.00 C ATOM 1398 O ARG B 94 -6.048 1.968 -7.101 1.00 0.00 O ATOM 1399 CB ARG B 94 -4.856 -0.974 -7.437 1.00 0.00 C ATOM 1400 CG ARG B 94 -5.267 -2.180 -8.296 1.00 0.00 C ATOM 1401 CD ARG B 94 -5.115 -3.525 -7.570 1.00 0.00 C ATOM 1402 NE ARG B 94 -6.076 -3.709 -6.465 1.00 0.00 N ATOM 1403 CZ ARG B 94 -6.447 -4.875 -5.941 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -5.970 -6.032 -6.350 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -7.327 -4.898 -4.966 1.00 0.00 N ATOM 0 H ARG B 94 -2.897 -0.492 -8.783 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.564 0.385 -8.984 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -3.896 -1.179 -6.963 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -5.583 -0.836 -6.637 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -6.305 -2.059 -8.607 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -4.662 -2.194 -9.203 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -5.242 -4.334 -8.290 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -4.102 -3.604 -7.177 1.00 0.00 H new ATOM 0 HE ARG B 94 -6.493 -2.867 -6.067 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -5.282 -6.063 -7.103 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -6.288 -6.898 -5.914 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -7.722 -4.026 -4.615 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -7.615 -5.788 -4.560 1.00 0.00 H new ATOM 1419 N VAL B 95 -3.824 2.153 -6.858 1.00 0.00 N ATOM 1420 CA VAL B 95 -3.819 3.449 -6.148 1.00 0.00 C ATOM 1421 C VAL B 95 -4.100 4.621 -7.107 1.00 0.00 C ATOM 1422 O VAL B 95 -5.001 5.415 -6.839 1.00 0.00 O ATOM 1423 CB VAL B 95 -2.497 3.655 -5.363 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -2.284 5.100 -4.881 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -2.462 2.730 -4.133 1.00 0.00 C ATOM 0 H VAL B 95 -2.894 1.743 -6.940 1.00 0.00 H new ATOM 0 HA VAL B 95 -4.631 3.429 -5.421 1.00 0.00 H new ATOM 0 HB VAL B 95 -1.697 3.417 -6.065 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -1.340 5.168 -4.340 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -2.259 5.770 -5.740 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -3.102 5.387 -4.220 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -1.530 2.883 -3.589 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -3.304 2.960 -3.481 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -2.527 1.691 -4.457 1.00 0.00 H new ATOM 1435 N LEU B 96 -3.382 4.723 -8.236 1.00 0.00 N ATOM 1436 CA LEU B 96 -3.587 5.782 -9.240 1.00 0.00 C ATOM 1437 C LEU B 96 -4.986 5.725 -9.869 1.00 0.00 C ATOM 1438 O LEU B 96 -5.594 6.766 -10.107 1.00 0.00 O ATOM 1439 CB LEU B 96 -2.497 5.684 -10.329 1.00 0.00 C ATOM 1440 CG LEU B 96 -1.104 6.189 -9.895 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -0.069 5.833 -10.974 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -1.097 7.710 -9.666 1.00 0.00 C ATOM 0 H LEU B 96 -2.638 4.070 -8.481 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.509 6.743 -8.731 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -2.410 4.644 -10.644 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -2.820 6.255 -11.200 1.00 0.00 H new ATOM 0 HG LEU B 96 -0.851 5.703 -8.953 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.914 6.190 -10.667 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.038 4.751 -11.105 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.348 6.305 -11.916 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.100 8.028 -9.362 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -1.374 8.218 -10.590 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -1.813 7.963 -8.884 1.00 0.00 H new ATOM 1454 N ASN B 97 -5.538 4.527 -10.056 1.00 0.00 N ATOM 1455 CA ASN B 97 -6.891 4.299 -10.565 1.00 0.00 C ATOM 1456 C ASN B 97 -7.999 5.018 -9.749 1.00 0.00 C ATOM 1457 O ASN B 97 -9.044 5.369 -10.299 1.00 0.00 O ATOM 1458 CB ASN B 97 -7.094 2.776 -10.622 1.00 0.00 C ATOM 1459 CG ASN B 97 -8.442 2.383 -11.201 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -9.257 1.759 -10.535 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -8.716 2.739 -12.437 1.00 0.00 N ATOM 0 H ASN B 97 -5.041 3.660 -9.851 1.00 0.00 H new ATOM 0 HA ASN B 97 -6.985 4.740 -11.557 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -6.302 2.331 -11.224 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -7.001 2.364 -9.617 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -9.616 2.495 -12.850 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -8.028 3.259 -12.982 1.00 0.00 H new ATOM 1468 N LYS B 98 -7.766 5.337 -8.467 1.00 0.00 N ATOM 1469 CA LYS B 98 -8.687 6.146 -7.648 1.00 0.00 C ATOM 1470 C LYS B 98 -8.756 7.635 -8.060 1.00 0.00 C ATOM 1471 O LYS B 98 -9.730 8.310 -7.727 1.00 0.00 O ATOM 1472 CB LYS B 98 -8.321 6.008 -6.156 1.00 0.00 C ATOM 1473 CG LYS B 98 -8.333 4.574 -5.593 1.00 0.00 C ATOM 1474 CD LYS B 98 -9.674 3.847 -5.784 1.00 0.00 C ATOM 1475 CE LYS B 98 -9.678 2.521 -5.014 1.00 0.00 C ATOM 1476 NZ LYS B 98 -10.886 1.719 -5.314 1.00 0.00 N ATOM 0 H LYS B 98 -6.929 5.040 -7.965 1.00 0.00 H new ATOM 0 HA LYS B 98 -9.686 5.749 -7.826 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -7.327 6.429 -6.005 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -9.016 6.613 -5.573 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -7.545 3.997 -6.076 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -8.097 4.609 -4.529 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -10.491 4.479 -5.436 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -9.846 3.660 -6.844 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -8.787 1.948 -5.271 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -9.630 2.721 -3.944 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -10.855 0.830 -4.776 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -11.735 2.256 -5.046 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -10.918 1.507 -6.332 1.00 0.00 H new ATOM 1490 N LEU B 99 -7.760 8.165 -8.787 1.00 0.00 N ATOM 1491 CA LEU B 99 -7.855 9.467 -9.472 1.00 0.00 C ATOM 1492 C LEU B 99 -8.740 9.407 -10.729 1.00 0.00 C ATOM 1493 O LEU B 99 -9.389 10.399 -11.058 1.00 0.00 O ATOM 1494 CB LEU B 99 -6.447 9.995 -9.808 1.00 0.00 C ATOM 1495 CG LEU B 99 -5.554 10.298 -8.585 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -4.146 10.669 -9.061 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -6.122 11.439 -7.729 1.00 0.00 C ATOM 0 H LEU B 99 -6.861 7.701 -8.918 1.00 0.00 H new ATOM 0 HA LEU B 99 -8.339 10.163 -8.787 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -5.941 9.262 -10.436 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -6.548 10.905 -10.399 1.00 0.00 H new ATOM 0 HG LEU B 99 -5.521 9.402 -7.966 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -3.515 10.883 -8.198 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -3.721 9.838 -9.624 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -4.198 11.551 -9.700 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -5.463 11.619 -6.880 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -6.194 12.345 -8.331 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -7.113 11.164 -7.368 1.00 0.00 H new ATOM 1509 N GLY B 100 -8.794 8.259 -11.415 1.00 0.00 N ATOM 1510 CA GLY B 100 -9.682 8.015 -12.558 1.00 0.00 C ATOM 1511 C GLY B 100 -9.074 8.459 -13.887 1.00 0.00 C ATOM 1512 O GLY B 100 -8.412 7.672 -14.566 1.00 0.00 O ATOM 0 H GLY B 100 -8.208 7.456 -11.186 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -9.917 6.952 -12.609 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -10.623 8.542 -12.400 1.00 0.00 H new ATOM 1516 N GLY B 101 -9.303 9.715 -14.283 1.00 0.00 N ATOM 1517 CA GLY B 101 -8.993 10.267 -15.616 1.00 0.00 C ATOM 1518 C GLY B 101 -7.518 10.623 -15.814 1.00 0.00 C ATOM 1519 O GLY B 101 -7.200 11.734 -16.247 1.00 0.00 O ATOM 0 H GLY B 101 -9.726 10.406 -13.663 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -9.286 9.542 -16.375 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -9.597 11.160 -15.778 1.00 0.00 H new ATOM 1523 N VAL B 102 -6.623 9.692 -15.484 1.00 0.00 N ATOM 1524 CA VAL B 102 -5.162 9.870 -15.477 1.00 0.00 C ATOM 1525 C VAL B 102 -4.466 8.932 -16.472 1.00 0.00 C ATOM 1526 O VAL B 102 -4.757 7.738 -16.541 1.00 0.00 O ATOM 1527 CB VAL B 102 -4.567 9.700 -14.056 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -4.958 10.892 -13.167 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -4.984 8.402 -13.340 1.00 0.00 C ATOM 0 H VAL B 102 -6.903 8.753 -15.202 1.00 0.00 H new ATOM 0 HA VAL B 102 -4.973 10.894 -15.798 1.00 0.00 H new ATOM 0 HB VAL B 102 -3.489 9.650 -14.206 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -4.533 10.759 -12.172 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -4.575 11.814 -13.605 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -6.044 10.950 -13.093 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -4.522 8.366 -12.353 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -6.069 8.377 -13.234 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -4.657 7.542 -13.925 1.00 0.00 H new ATOM 1539 N LYS B 103 -3.516 9.497 -17.224 1.00 0.00 N ATOM 1540 CA LYS B 103 -2.584 8.792 -18.114 1.00 0.00 C ATOM 1541 C LYS B 103 -1.287 8.450 -17.362 1.00 0.00 C ATOM 1542 O LYS B 103 -0.677 9.348 -16.777 1.00 0.00 O ATOM 1543 CB LYS B 103 -2.247 9.715 -19.301 1.00 0.00 C ATOM 1544 CG LYS B 103 -3.399 9.901 -20.302 1.00 0.00 C ATOM 1545 CD LYS B 103 -3.006 10.831 -21.462 1.00 0.00 C ATOM 1546 CE LYS B 103 -2.009 10.161 -22.418 1.00 0.00 C ATOM 1547 NZ LYS B 103 -1.522 11.091 -23.462 1.00 0.00 N ATOM 0 H LYS B 103 -3.368 10.506 -17.230 1.00 0.00 H new ATOM 0 HA LYS B 103 -3.045 7.868 -18.464 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -1.954 10.692 -18.916 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -1.384 9.309 -19.829 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -3.695 8.930 -20.699 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -4.266 10.312 -19.785 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -3.900 11.121 -22.014 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -2.568 11.745 -21.062 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -1.161 9.782 -21.848 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -2.484 9.302 -22.892 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -1.154 10.546 -24.268 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -2.306 11.695 -23.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -0.764 11.685 -23.071 1.00 0.00 H new ATOM 1561 N TYR B 104 -0.839 7.193 -17.407 1.00 0.00 N ATOM 1562 CA TYR B 104 0.383 6.715 -16.736 1.00 0.00 C ATOM 1563 C TYR B 104 1.011 5.440 -17.347 1.00 0.00 C ATOM 1564 O TYR B 104 0.367 4.709 -18.107 1.00 0.00 O ATOM 1565 CB TYR B 104 0.125 6.549 -15.223 1.00 0.00 C ATOM 1566 CG TYR B 104 -0.928 5.524 -14.835 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -2.273 5.920 -14.703 1.00 0.00 C ATOM 1568 CD2 TYR B 104 -0.568 4.185 -14.579 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -3.259 4.982 -14.342 1.00 0.00 C ATOM 1570 CE2 TYR B 104 -1.550 3.243 -14.210 1.00 0.00 C ATOM 1571 CZ TYR B 104 -2.903 3.637 -14.106 1.00 0.00 C ATOM 1572 OH TYR B 104 -3.870 2.723 -13.814 1.00 0.00 O ATOM 0 H TYR B 104 -1.324 6.458 -17.922 1.00 0.00 H new ATOM 0 HA TYR B 104 1.134 7.488 -16.901 1.00 0.00 H new ATOM 0 HB2 TYR B 104 1.064 6.275 -14.742 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -0.171 7.516 -14.817 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -2.550 6.949 -14.880 1.00 0.00 H new ATOM 0 HD2 TYR B 104 0.464 3.880 -14.666 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -4.289 5.292 -14.246 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -1.268 2.220 -14.007 1.00 0.00 H new ATOM 0 HH TYR B 104 -3.455 1.910 -13.457 1.00 0.00 H new ATOM 1582 N ASP B 105 2.270 5.157 -16.984 1.00 0.00 N ATOM 1583 CA ASP B 105 2.970 3.886 -17.250 1.00 0.00 C ATOM 1584 C ASP B 105 4.046 3.618 -16.173 1.00 0.00 C ATOM 1585 O ASP B 105 4.821 4.517 -15.829 1.00 0.00 O ATOM 1586 CB ASP B 105 3.577 3.882 -18.675 1.00 0.00 C ATOM 1587 CG ASP B 105 3.781 2.478 -19.261 1.00 0.00 C ATOM 1588 OD1 ASP B 105 2.801 1.694 -19.294 1.00 0.00 O ATOM 1589 OD2 ASP B 105 4.898 2.155 -19.732 1.00 0.00 O ATOM 0 H ASP B 105 2.851 5.827 -16.480 1.00 0.00 H new ATOM 0 HA ASP B 105 2.244 3.075 -17.199 1.00 0.00 H new ATOM 0 HB2 ASP B 105 2.925 4.451 -19.338 1.00 0.00 H new ATOM 0 HB3 ASP B 105 4.537 4.398 -18.652 1.00 0.00 H new ATOM 1594 N ILE B 106 4.080 2.392 -15.631 1.00 0.00 N ATOM 1595 CA ILE B 106 4.986 1.962 -14.541 1.00 0.00 C ATOM 1596 C ILE B 106 6.333 1.471 -15.092 1.00 0.00 C ATOM 1597 O ILE B 106 6.368 0.664 -16.029 1.00 0.00 O ATOM 1598 CB ILE B 106 4.340 0.833 -13.683 1.00 0.00 C ATOM 1599 CG1 ILE B 106 2.812 0.913 -13.446 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.068 0.737 -12.331 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.308 2.177 -12.748 1.00 0.00 C ATOM 0 H ILE B 106 3.461 1.645 -15.945 1.00 0.00 H new ATOM 0 HA ILE B 106 5.159 2.835 -13.911 1.00 0.00 H new ATOM 0 HB ILE B 106 4.465 -0.065 -14.288 1.00 0.00 H new ATOM 0 HG12 ILE B 106 2.310 0.829 -14.410 1.00 0.00 H new ATOM 0 HG13 ILE B 106 2.510 0.049 -12.853 1.00 0.00 H new ATOM 0 HG21 ILE B 106 4.617 -0.053 -11.730 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.120 0.508 -12.500 1.00 0.00 H new ATOM 0 HG23 ILE B 106 4.983 1.687 -11.804 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.225 2.123 -12.635 1.00 0.00 H new ATOM 0 HD12 ILE B 106 2.771 2.259 -11.765 1.00 0.00 H new ATOM 0 HD13 ILE B 106 2.568 3.051 -13.346 1.00 0.00 H new ATOM 1613 N ASP B 107 7.439 1.909 -14.485 1.00 0.00 N ATOM 1614 CA ASP B 107 8.811 1.529 -14.837 1.00 0.00 C ATOM 1615 C ASP B 107 9.501 0.839 -13.644 1.00 0.00 C ATOM 1616 O ASP B 107 9.990 1.500 -12.724 1.00 0.00 O ATOM 1617 CB ASP B 107 9.571 2.788 -15.296 1.00 0.00 C ATOM 1618 CG ASP B 107 10.682 2.482 -16.299 1.00 0.00 C ATOM 1619 OD1 ASP B 107 11.362 1.440 -16.168 1.00 0.00 O ATOM 1620 OD2 ASP B 107 10.832 3.263 -17.269 1.00 0.00 O ATOM 0 H ASP B 107 7.403 2.564 -13.704 1.00 0.00 H new ATOM 0 HA ASP B 107 8.805 0.810 -15.656 1.00 0.00 H new ATOM 0 HB2 ASP B 107 8.866 3.488 -15.745 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.001 3.284 -14.426 1.00 0.00 H new ATOM 1625 N LEU B 108 9.514 -0.500 -13.637 1.00 0.00 N ATOM 1626 CA LEU B 108 9.963 -1.297 -12.489 1.00 0.00 C ATOM 1627 C LEU B 108 11.480 -1.151 -12.224 1.00 0.00 C ATOM 1628 O LEU B 108 11.831 -0.898 -11.067 1.00 0.00 O ATOM 1629 CB LEU B 108 9.519 -2.776 -12.630 1.00 0.00 C ATOM 1630 CG LEU B 108 8.049 -3.087 -12.264 1.00 0.00 C ATOM 1631 CD1 LEU B 108 7.027 -2.428 -13.204 1.00 0.00 C ATOM 1632 CD2 LEU B 108 7.816 -4.604 -12.315 1.00 0.00 C ATOM 0 H LEU B 108 9.212 -1.063 -14.432 1.00 0.00 H new ATOM 0 HA LEU B 108 9.472 -0.897 -11.602 1.00 0.00 H new ATOM 0 HB2 LEU B 108 9.688 -3.087 -13.661 1.00 0.00 H new ATOM 0 HB3 LEU B 108 10.165 -3.389 -12.002 1.00 0.00 H new ATOM 0 HG LEU B 108 7.897 -2.681 -11.264 1.00 0.00 H new ATOM 0 HD11 LEU B 108 6.018 -2.690 -12.886 1.00 0.00 H new ATOM 0 HD12 LEU B 108 7.148 -1.345 -13.171 1.00 0.00 H new ATOM 0 HD13 LEU B 108 7.189 -2.780 -14.223 1.00 0.00 H new ATOM 0 HD21 LEU B 108 6.780 -4.822 -12.057 1.00 0.00 H new ATOM 0 HD22 LEU B 108 8.024 -4.971 -13.320 1.00 0.00 H new ATOM 0 HD23 LEU B 108 8.478 -5.098 -11.604 1.00 0.00 H new ATOM 1644 N PRO B 109 12.394 -1.270 -13.215 1.00 0.00 N ATOM 1645 CA PRO B 109 13.833 -1.118 -12.974 1.00 0.00 C ATOM 1646 C PRO B 109 14.259 0.334 -12.743 1.00 0.00 C ATOM 1647 O PRO B 109 15.135 0.579 -11.912 1.00 0.00 O ATOM 1648 CB PRO B 109 14.540 -1.694 -14.211 1.00 0.00 C ATOM 1649 CG PRO B 109 13.457 -2.477 -14.949 1.00 0.00 C ATOM 1650 CD PRO B 109 12.182 -1.729 -14.580 1.00 0.00 C ATOM 0 HA PRO B 109 14.104 -1.644 -12.059 1.00 0.00 H new ATOM 0 HB2 PRO B 109 14.951 -0.902 -14.837 1.00 0.00 H new ATOM 0 HB3 PRO B 109 15.371 -2.340 -13.927 1.00 0.00 H new ATOM 0 HG2 PRO B 109 13.625 -2.481 -16.026 1.00 0.00 H new ATOM 0 HG3 PRO B 109 13.422 -3.518 -14.628 1.00 0.00 H new ATOM 0 HD2 PRO B 109 12.007 -0.891 -15.255 1.00 0.00 H new ATOM 0 HD3 PRO B 109 11.310 -2.380 -14.646 1.00 0.00 H new ATOM 1658 N ASN B 110 13.643 1.300 -13.442 1.00 0.00 N ATOM 1659 CA ASN B 110 13.912 2.726 -13.227 1.00 0.00 C ATOM 1660 C ASN B 110 13.191 3.295 -11.988 1.00 0.00 C ATOM 1661 O ASN B 110 13.341 4.480 -11.688 1.00 0.00 O ATOM 1662 CB ASN B 110 13.604 3.526 -14.504 1.00 0.00 C ATOM 1663 CG ASN B 110 14.210 4.929 -14.506 1.00 0.00 C ATOM 1664 OD1 ASN B 110 13.534 5.898 -14.811 1.00 0.00 O ATOM 1665 ND2 ASN B 110 15.475 5.107 -14.166 1.00 0.00 N ATOM 0 H ASN B 110 12.950 1.114 -14.167 1.00 0.00 H new ATOM 0 HA ASN B 110 14.975 2.830 -13.010 1.00 0.00 H new ATOM 0 HB2 ASN B 110 13.979 2.976 -15.367 1.00 0.00 H new ATOM 0 HB3 ASN B 110 12.523 3.606 -14.622 1.00 0.00 H new ATOM 0 HD21 ASN B 110 15.875 6.045 -14.161 1.00 0.00 H new ATOM 0 HD22 ASN B 110 16.052 4.306 -13.909 1.00 0.00 H new ATOM 1672 N LYS B 111 12.443 2.467 -11.241 1.00 0.00 N ATOM 1673 CA LYS B 111 12.004 2.761 -9.867 1.00 0.00 C ATOM 1674 C LYS B 111 10.983 3.933 -9.843 1.00 0.00 C ATOM 1675 O LYS B 111 11.020 4.812 -8.971 1.00 0.00 O ATOM 1676 CB LYS B 111 13.293 2.972 -9.021 1.00 0.00 C ATOM 1677 CG LYS B 111 13.284 2.594 -7.541 1.00 0.00 C ATOM 1678 CD LYS B 111 13.287 1.081 -7.387 1.00 0.00 C ATOM 1679 CE LYS B 111 13.250 0.626 -5.924 1.00 0.00 C ATOM 1680 NZ LYS B 111 14.533 0.856 -5.219 1.00 0.00 N ATOM 0 H LYS B 111 12.121 1.560 -11.580 1.00 0.00 H new ATOM 0 HA LYS B 111 11.444 1.939 -9.421 1.00 0.00 H new ATOM 0 HB2 LYS B 111 14.095 2.408 -9.499 1.00 0.00 H new ATOM 0 HB3 LYS B 111 13.561 4.026 -9.089 1.00 0.00 H new ATOM 0 HG2 LYS B 111 14.156 3.019 -7.044 1.00 0.00 H new ATOM 0 HG3 LYS B 111 12.403 3.015 -7.056 1.00 0.00 H new ATOM 0 HD2 LYS B 111 12.426 0.667 -7.912 1.00 0.00 H new ATOM 0 HD3 LYS B 111 14.178 0.675 -7.865 1.00 0.00 H new ATOM 0 HE2 LYS B 111 12.454 1.158 -5.403 1.00 0.00 H new ATOM 0 HE3 LYS B 111 13.004 -0.435 -5.884 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 14.451 0.530 -4.235 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 15.291 0.328 -5.697 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 14.758 1.871 -5.230 1.00 0.00 H new ATOM 1694 N LYS B 112 10.107 4.023 -10.861 1.00 0.00 N ATOM 1695 CA LYS B 112 9.300 5.223 -11.116 1.00 0.00 C ATOM 1696 C LYS B 112 7.932 4.927 -11.750 1.00 0.00 C ATOM 1697 O LYS B 112 7.675 3.834 -12.255 1.00 0.00 O ATOM 1698 CB LYS B 112 10.118 6.232 -11.967 1.00 0.00 C ATOM 1699 CG LYS B 112 10.262 5.866 -13.452 1.00 0.00 C ATOM 1700 CD LYS B 112 10.700 7.059 -14.313 1.00 0.00 C ATOM 1701 CE LYS B 112 10.783 6.614 -15.779 1.00 0.00 C ATOM 1702 NZ LYS B 112 11.542 7.568 -16.620 1.00 0.00 N ATOM 0 H LYS B 112 9.942 3.267 -11.526 1.00 0.00 H new ATOM 0 HA LYS B 112 9.071 5.666 -10.147 1.00 0.00 H new ATOM 0 HB2 LYS B 112 9.645 7.212 -11.894 1.00 0.00 H new ATOM 0 HB3 LYS B 112 11.114 6.326 -11.534 1.00 0.00 H new ATOM 0 HG2 LYS B 112 10.990 5.061 -13.555 1.00 0.00 H new ATOM 0 HG3 LYS B 112 9.310 5.485 -13.823 1.00 0.00 H new ATOM 0 HD2 LYS B 112 9.990 7.879 -14.208 1.00 0.00 H new ATOM 0 HD3 LYS B 112 11.668 7.430 -13.977 1.00 0.00 H new ATOM 0 HE2 LYS B 112 11.256 5.633 -15.831 1.00 0.00 H new ATOM 0 HE3 LYS B 112 9.775 6.504 -16.179 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 11.876 7.085 -17.478 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 10.926 8.362 -16.887 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 12.359 7.928 -16.086 1.00 0.00 H new ATOM 1716 N VAL B 113 7.098 5.961 -11.808 1.00 0.00 N ATOM 1717 CA VAL B 113 5.975 6.068 -12.749 1.00 0.00 C ATOM 1718 C VAL B 113 6.157 7.325 -13.603 1.00 0.00 C ATOM 1719 O VAL B 113 6.664 8.335 -13.111 1.00 0.00 O ATOM 1720 CB VAL B 113 4.601 6.077 -12.034 1.00 0.00 C ATOM 1721 CG1 VAL B 113 4.360 4.736 -11.326 1.00 0.00 C ATOM 1722 CG2 VAL B 113 4.444 7.210 -11.006 1.00 0.00 C ATOM 0 H VAL B 113 7.181 6.769 -11.191 1.00 0.00 H new ATOM 0 HA VAL B 113 5.979 5.184 -13.387 1.00 0.00 H new ATOM 0 HB VAL B 113 3.863 6.244 -12.819 1.00 0.00 H new ATOM 0 HG11 VAL B 113 3.391 4.757 -10.828 1.00 0.00 H new ATOM 0 HG12 VAL B 113 4.374 3.930 -12.059 1.00 0.00 H new ATOM 0 HG13 VAL B 113 5.144 4.568 -10.588 1.00 0.00 H new ATOM 0 HG21 VAL B 113 3.457 7.151 -10.547 1.00 0.00 H new ATOM 0 HG22 VAL B 113 5.209 7.111 -10.236 1.00 0.00 H new ATOM 0 HG23 VAL B 113 4.555 8.172 -11.506 1.00 0.00 H new ATOM 1732 N CYS B 114 5.747 7.269 -14.871 1.00 0.00 N ATOM 1733 CA CYS B 114 5.501 8.464 -15.686 1.00 0.00 C ATOM 1734 C CYS B 114 3.990 8.743 -15.722 1.00 0.00 C ATOM 1735 O CYS B 114 3.193 7.804 -15.740 1.00 0.00 O ATOM 1736 CB CYS B 114 6.138 8.303 -17.079 1.00 0.00 C ATOM 1737 SG CYS B 114 5.262 7.085 -18.105 1.00 0.00 S ATOM 0 H CYS B 114 5.575 6.393 -15.365 1.00 0.00 H new ATOM 0 HA CYS B 114 5.978 9.339 -15.244 1.00 0.00 H new ATOM 0 HB2 CYS B 114 6.141 9.267 -17.588 1.00 0.00 H new ATOM 0 HB3 CYS B 114 7.178 7.998 -16.967 1.00 0.00 H new ATOM 0 HG CYS B 114 4.952 6.051 -17.381 1.00 0.00 H new ATOM 1743 N ILE B 115 3.591 10.016 -15.690 1.00 0.00 N ATOM 1744 CA ILE B 115 2.184 10.454 -15.628 1.00 0.00 C ATOM 1745 C ILE B 115 1.992 11.656 -16.580 1.00 0.00 C ATOM 1746 O ILE B 115 2.936 12.400 -16.860 1.00 0.00 O ATOM 1747 CB ILE B 115 1.754 10.730 -14.149 1.00 0.00 C ATOM 1748 CG1 ILE B 115 2.009 9.509 -13.227 1.00 0.00 C ATOM 1749 CG2 ILE B 115 0.277 11.165 -14.041 1.00 0.00 C ATOM 1750 CD1 ILE B 115 1.570 9.678 -11.764 1.00 0.00 C ATOM 0 H ILE B 115 4.249 10.795 -15.707 1.00 0.00 H new ATOM 0 HA ILE B 115 1.517 9.664 -15.973 1.00 0.00 H new ATOM 0 HB ILE B 115 2.380 11.555 -13.809 1.00 0.00 H new ATOM 0 HG12 ILE B 115 1.491 8.646 -13.646 1.00 0.00 H new ATOM 0 HG13 ILE B 115 3.075 9.280 -13.244 1.00 0.00 H new ATOM 0 HG21 ILE B 115 0.026 11.345 -12.996 1.00 0.00 H new ATOM 0 HG22 ILE B 115 0.124 12.080 -14.613 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -0.364 10.378 -14.438 1.00 0.00 H new ATOM 0 HD11 ILE B 115 1.794 8.767 -11.209 1.00 0.00 H new ATOM 0 HD12 ILE B 115 2.106 10.516 -11.318 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.498 9.872 -11.726 1.00 0.00 H new ATOM 1762 N GLU B 116 0.779 11.852 -17.094 1.00 0.00 N ATOM 1763 CA GLU B 116 0.382 13.040 -17.860 1.00 0.00 C ATOM 1764 C GLU B 116 -0.989 13.535 -17.358 1.00 0.00 C ATOM 1765 O GLU B 116 -2.002 13.429 -18.048 1.00 0.00 O ATOM 1766 CB GLU B 116 0.420 12.723 -19.371 1.00 0.00 C ATOM 1767 CG GLU B 116 0.398 13.980 -20.257 1.00 0.00 C ATOM 1768 CD GLU B 116 0.083 13.665 -21.721 1.00 0.00 C ATOM 1769 OE1 GLU B 116 0.432 12.561 -22.197 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -0.545 14.515 -22.401 1.00 0.00 O ATOM 0 H GLU B 116 0.024 11.174 -16.989 1.00 0.00 H new ATOM 0 HA GLU B 116 1.084 13.859 -17.705 1.00 0.00 H new ATOM 0 HB2 GLU B 116 1.319 12.147 -19.592 1.00 0.00 H new ATOM 0 HB3 GLU B 116 -0.433 12.093 -19.625 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -0.345 14.678 -19.872 1.00 0.00 H new ATOM 0 HG3 GLU B 116 1.365 14.479 -20.197 1.00 0.00 H new ATOM 1777 N SER B 117 -1.051 14.034 -16.119 1.00 0.00 N ATOM 1778 CA SER B 117 -2.303 14.495 -15.492 1.00 0.00 C ATOM 1779 C SER B 117 -2.368 16.022 -15.354 1.00 0.00 C ATOM 1780 O SER B 117 -1.376 16.675 -15.020 1.00 0.00 O ATOM 1781 CB SER B 117 -2.474 13.865 -14.103 1.00 0.00 C ATOM 1782 OG SER B 117 -3.660 14.338 -13.476 1.00 0.00 O ATOM 0 H SER B 117 -0.233 14.132 -15.517 1.00 0.00 H new ATOM 0 HA SER B 117 -3.110 14.180 -16.153 1.00 0.00 H new ATOM 0 HB2 SER B 117 -2.513 12.779 -14.193 1.00 0.00 H new ATOM 0 HB3 SER B 117 -1.610 14.102 -13.482 1.00 0.00 H new ATOM 0 HG SER B 117 -3.751 13.923 -12.593 1.00 0.00 H new ATOM 1788 N GLU B 118 -3.564 16.591 -15.534 1.00 0.00 N ATOM 1789 CA GLU B 118 -3.862 18.014 -15.312 1.00 0.00 C ATOM 1790 C GLU B 118 -4.136 18.371 -13.832 1.00 0.00 C ATOM 1791 O GLU B 118 -4.472 19.514 -13.518 1.00 0.00 O ATOM 1792 CB GLU B 118 -5.042 18.424 -16.205 1.00 0.00 C ATOM 1793 CG GLU B 118 -6.361 17.736 -15.832 1.00 0.00 C ATOM 1794 CD GLU B 118 -7.433 18.038 -16.869 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -7.474 17.322 -17.896 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -8.252 18.958 -16.643 1.00 0.00 O ATOM 0 H GLU B 118 -4.377 16.061 -15.847 1.00 0.00 H new ATOM 0 HA GLU B 118 -2.969 18.578 -15.581 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -5.175 19.504 -16.144 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -4.801 18.191 -17.242 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -6.209 16.659 -15.761 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -6.690 18.076 -14.850 1.00 0.00 H new ATOM 1803 N HIS B 119 -4.026 17.412 -12.911 1.00 0.00 N ATOM 1804 CA HIS B 119 -4.221 17.635 -11.475 1.00 0.00 C ATOM 1805 C HIS B 119 -3.006 18.302 -10.786 1.00 0.00 C ATOM 1806 O HIS B 119 -1.906 18.413 -11.344 1.00 0.00 O ATOM 1807 CB HIS B 119 -4.573 16.293 -10.808 1.00 0.00 C ATOM 1808 CG HIS B 119 -5.918 15.708 -11.183 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -7.047 16.378 -11.614 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -6.271 14.391 -11.045 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -8.042 15.486 -11.731 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -7.622 14.256 -11.385 1.00 0.00 N ATOM 0 H HIS B 119 -3.796 16.446 -13.143 1.00 0.00 H new ATOM 0 HA HIS B 119 -5.042 18.341 -11.355 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -3.799 15.568 -11.060 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -4.544 16.427 -9.727 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -5.617 13.592 -10.728 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -9.044 15.723 -12.058 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -8.175 13.399 -11.373 1.00 0.00 H new ATOM 1820 N SER B 120 -3.207 18.742 -9.544 1.00 0.00 N ATOM 1821 CA SER B 120 -2.166 19.316 -8.689 1.00 0.00 C ATOM 1822 C SER B 120 -1.163 18.256 -8.214 1.00 0.00 C ATOM 1823 O SER B 120 -1.532 17.123 -7.882 1.00 0.00 O ATOM 1824 CB SER B 120 -2.814 19.995 -7.473 1.00 0.00 C ATOM 1825 OG SER B 120 -1.844 20.519 -6.579 1.00 0.00 O ATOM 0 H SER B 120 -4.121 18.709 -9.092 1.00 0.00 H new ATOM 0 HA SER B 120 -1.618 20.049 -9.281 1.00 0.00 H new ATOM 0 HB2 SER B 120 -3.467 20.799 -7.812 1.00 0.00 H new ATOM 0 HB3 SER B 120 -3.441 19.275 -6.947 1.00 0.00 H new ATOM 0 HG SER B 120 -2.295 20.944 -5.820 1.00 0.00 H new ATOM 1831 N MET B 121 0.108 18.656 -8.099 1.00 0.00 N ATOM 1832 CA MET B 121 1.170 17.875 -7.468 1.00 0.00 C ATOM 1833 C MET B 121 0.786 17.445 -6.044 1.00 0.00 C ATOM 1834 O MET B 121 1.131 16.338 -5.643 1.00 0.00 O ATOM 1835 CB MET B 121 2.456 18.721 -7.479 1.00 0.00 C ATOM 1836 CG MET B 121 3.674 17.931 -6.984 1.00 0.00 C ATOM 1837 SD MET B 121 5.195 18.897 -6.785 1.00 0.00 S ATOM 1838 CE MET B 121 4.742 19.880 -5.328 1.00 0.00 C ATOM 0 H MET B 121 0.432 19.556 -8.453 1.00 0.00 H new ATOM 0 HA MET B 121 1.332 16.954 -8.027 1.00 0.00 H new ATOM 0 HB2 MET B 121 2.644 19.079 -8.491 1.00 0.00 H new ATOM 0 HB3 MET B 121 2.316 19.600 -6.850 1.00 0.00 H new ATOM 0 HG2 MET B 121 3.425 17.474 -6.026 1.00 0.00 H new ATOM 0 HG3 MET B 121 3.868 17.118 -7.684 1.00 0.00 H new ATOM 0 HE1 MET B 121 5.629 20.376 -4.934 1.00 0.00 H new ATOM 0 HE2 MET B 121 4.002 20.629 -5.610 1.00 0.00 H new ATOM 0 HE3 MET B 121 4.322 19.226 -4.564 1.00 0.00 H new ATOM 1848 N ASP B 122 0.034 18.266 -5.302 1.00 0.00 N ATOM 1849 CA ASP B 122 -0.416 17.927 -3.945 1.00 0.00 C ATOM 1850 C ASP B 122 -1.434 16.775 -3.944 1.00 0.00 C ATOM 1851 O ASP B 122 -1.369 15.915 -3.070 1.00 0.00 O ATOM 1852 CB ASP B 122 -0.991 19.180 -3.261 1.00 0.00 C ATOM 1853 CG ASP B 122 -1.190 18.975 -1.755 1.00 0.00 C ATOM 1854 OD1 ASP B 122 -0.208 18.600 -1.071 1.00 0.00 O ATOM 1855 OD2 ASP B 122 -2.312 19.212 -1.240 1.00 0.00 O ATOM 0 H ASP B 122 -0.280 19.182 -5.623 1.00 0.00 H new ATOM 0 HA ASP B 122 0.447 17.577 -3.379 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -0.320 20.023 -3.426 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -1.945 19.438 -3.721 1.00 0.00 H new ATOM 1860 N THR B 123 -2.327 16.718 -4.943 1.00 0.00 N ATOM 1861 CA THR B 123 -3.325 15.644 -5.125 1.00 0.00 C ATOM 1862 C THR B 123 -2.646 14.337 -5.525 1.00 0.00 C ATOM 1863 O THR B 123 -2.986 13.267 -5.008 1.00 0.00 O ATOM 1864 CB THR B 123 -4.338 16.051 -6.206 1.00 0.00 C ATOM 1865 OG1 THR B 123 -4.840 17.336 -5.924 1.00 0.00 O ATOM 1866 CG2 THR B 123 -5.530 15.098 -6.271 1.00 0.00 C ATOM 0 H THR B 123 -2.380 17.434 -5.667 1.00 0.00 H new ATOM 0 HA THR B 123 -3.843 15.492 -4.178 1.00 0.00 H new ATOM 0 HB THR B 123 -3.810 16.025 -7.159 1.00 0.00 H new ATOM 0 HG1 THR B 123 -5.485 17.594 -6.615 1.00 0.00 H new ATOM 0 HG21 THR B 123 -6.218 15.428 -7.050 1.00 0.00 H new ATOM 0 HG22 THR B 123 -5.179 14.092 -6.499 1.00 0.00 H new ATOM 0 HG23 THR B 123 -6.045 15.094 -5.310 1.00 0.00 H new ATOM 1874 N LEU B 124 -1.668 14.431 -6.432 1.00 0.00 N ATOM 1875 CA LEU B 124 -0.853 13.310 -6.903 1.00 0.00 C ATOM 1876 C LEU B 124 -0.019 12.726 -5.751 1.00 0.00 C ATOM 1877 O LEU B 124 -0.120 11.528 -5.485 1.00 0.00 O ATOM 1878 CB LEU B 124 0.012 13.787 -8.093 1.00 0.00 C ATOM 1879 CG LEU B 124 -0.803 14.101 -9.372 1.00 0.00 C ATOM 1880 CD1 LEU B 124 0.009 14.940 -10.367 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -1.254 12.812 -10.077 1.00 0.00 C ATOM 0 H LEU B 124 -1.415 15.316 -6.871 1.00 0.00 H new ATOM 0 HA LEU B 124 -1.490 12.499 -7.255 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.562 14.680 -7.795 1.00 0.00 H new ATOM 0 HB3 LEU B 124 0.751 13.020 -8.324 1.00 0.00 H new ATOM 0 HG LEU B 124 -1.676 14.668 -9.049 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -0.595 15.141 -11.252 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.294 15.883 -9.900 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.906 14.393 -10.657 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -1.824 13.066 -10.971 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -0.379 12.226 -10.359 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -1.880 12.228 -9.402 1.00 0.00 H new ATOM 1893 N LEU B 125 0.737 13.556 -5.022 1.00 0.00 N ATOM 1894 CA LEU B 125 1.551 13.120 -3.880 1.00 0.00 C ATOM 1895 C LEU B 125 0.699 12.603 -2.716 1.00 0.00 C ATOM 1896 O LEU B 125 1.037 11.562 -2.156 1.00 0.00 O ATOM 1897 CB LEU B 125 2.478 14.264 -3.424 1.00 0.00 C ATOM 1898 CG LEU B 125 3.624 14.610 -4.399 1.00 0.00 C ATOM 1899 CD1 LEU B 125 4.370 15.847 -3.876 1.00 0.00 C ATOM 1900 CD2 LEU B 125 4.621 13.452 -4.573 1.00 0.00 C ATOM 0 H LEU B 125 0.802 14.557 -5.209 1.00 0.00 H new ATOM 0 HA LEU B 125 2.160 12.280 -4.213 1.00 0.00 H new ATOM 0 HB2 LEU B 125 1.875 15.158 -3.266 1.00 0.00 H new ATOM 0 HB3 LEU B 125 2.911 13.997 -2.460 1.00 0.00 H new ATOM 0 HG LEU B 125 3.179 14.805 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU B 125 5.181 16.098 -4.559 1.00 0.00 H new ATOM 0 HD12 LEU B 125 3.679 16.687 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU B 125 4.780 15.634 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU B 125 5.406 13.749 -5.269 1.00 0.00 H new ATOM 0 HD22 LEU B 125 5.065 13.206 -3.608 1.00 0.00 H new ATOM 0 HD23 LEU B 125 4.100 12.579 -4.966 1.00 0.00 H new ATOM 1912 N ALA B 126 -0.412 13.259 -2.361 1.00 0.00 N ATOM 1913 CA ALA B 126 -1.316 12.782 -1.305 1.00 0.00 C ATOM 1914 C ALA B 126 -1.886 11.387 -1.603 1.00 0.00 C ATOM 1915 O ALA B 126 -2.042 10.586 -0.677 1.00 0.00 O ATOM 1916 CB ALA B 126 -2.441 13.805 -1.108 1.00 0.00 C ATOM 0 H ALA B 126 -0.710 14.133 -2.795 1.00 0.00 H new ATOM 0 HA ALA B 126 -0.741 12.684 -0.384 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -3.116 13.458 -0.326 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -2.013 14.765 -0.818 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -2.995 13.921 -2.040 1.00 0.00 H new ATOM 1922 N THR B 127 -2.172 11.088 -2.877 1.00 0.00 N ATOM 1923 CA THR B 127 -2.605 9.764 -3.337 1.00 0.00 C ATOM 1924 C THR B 127 -1.453 8.760 -3.292 1.00 0.00 C ATOM 1925 O THR B 127 -1.604 7.706 -2.680 1.00 0.00 O ATOM 1926 CB THR B 127 -3.235 9.883 -4.726 1.00 0.00 C ATOM 1927 OG1 THR B 127 -4.318 10.786 -4.631 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.764 8.543 -5.230 1.00 0.00 C ATOM 0 H THR B 127 -2.107 11.773 -3.630 1.00 0.00 H new ATOM 0 HA THR B 127 -3.367 9.377 -2.661 1.00 0.00 H new ATOM 0 HB THR B 127 -2.474 10.227 -5.426 1.00 0.00 H new ATOM 0 HG1 THR B 127 -3.990 11.703 -4.744 1.00 0.00 H new ATOM 0 HG21 THR B 127 -4.203 8.674 -6.219 1.00 0.00 H new ATOM 0 HG22 THR B 127 -2.944 7.827 -5.288 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.523 8.170 -4.543 1.00 0.00 H new ATOM 1936 N LEU B 128 -0.299 9.081 -3.890 1.00 0.00 N ATOM 1937 CA LEU B 128 0.862 8.182 -3.968 1.00 0.00 C ATOM 1938 C LEU B 128 1.405 7.776 -2.590 1.00 0.00 C ATOM 1939 O LEU B 128 1.748 6.608 -2.399 1.00 0.00 O ATOM 1940 CB LEU B 128 1.968 8.843 -4.819 1.00 0.00 C ATOM 1941 CG LEU B 128 1.696 8.847 -6.339 1.00 0.00 C ATOM 1942 CD1 LEU B 128 2.700 9.772 -7.044 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.802 7.433 -6.936 1.00 0.00 C ATOM 0 H LEU B 128 -0.142 9.983 -4.339 1.00 0.00 H new ATOM 0 HA LEU B 128 0.528 7.259 -4.443 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.099 9.872 -4.484 1.00 0.00 H new ATOM 0 HB3 LEU B 128 2.909 8.325 -4.633 1.00 0.00 H new ATOM 0 HG LEU B 128 0.680 9.209 -6.495 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.504 9.772 -8.116 1.00 0.00 H new ATOM 0 HD12 LEU B 128 2.595 10.785 -6.656 1.00 0.00 H new ATOM 0 HD13 LEU B 128 3.714 9.416 -6.860 1.00 0.00 H new ATOM 0 HD21 LEU B 128 1.604 7.475 -8.007 1.00 0.00 H new ATOM 0 HD22 LEU B 128 2.805 7.041 -6.767 1.00 0.00 H new ATOM 0 HD23 LEU B 128 1.072 6.780 -6.457 1.00 0.00 H new ATOM 1955 N LYS B 129 1.442 8.692 -1.614 1.00 0.00 N ATOM 1956 CA LYS B 129 1.912 8.413 -0.247 1.00 0.00 C ATOM 1957 C LYS B 129 1.152 7.266 0.449 1.00 0.00 C ATOM 1958 O LYS B 129 1.750 6.512 1.216 1.00 0.00 O ATOM 1959 CB LYS B 129 1.858 9.711 0.583 1.00 0.00 C ATOM 1960 CG LYS B 129 3.086 10.597 0.304 1.00 0.00 C ATOM 1961 CD LYS B 129 3.075 11.911 1.094 1.00 0.00 C ATOM 1962 CE LYS B 129 2.156 12.939 0.425 1.00 0.00 C ATOM 1963 NZ LYS B 129 2.232 14.265 1.076 1.00 0.00 N ATOM 0 H LYS B 129 1.144 9.658 -1.750 1.00 0.00 H new ATOM 0 HA LYS B 129 2.942 8.063 -0.321 1.00 0.00 H new ATOM 0 HB2 LYS B 129 0.947 10.261 0.346 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.815 9.466 1.644 1.00 0.00 H new ATOM 0 HG2 LYS B 129 3.991 10.041 0.549 1.00 0.00 H new ATOM 0 HG3 LYS B 129 3.129 10.822 -0.762 1.00 0.00 H new ATOM 0 HD2 LYS B 129 2.739 11.725 2.114 1.00 0.00 H new ATOM 0 HD3 LYS B 129 4.087 12.310 1.160 1.00 0.00 H new ATOM 0 HE2 LYS B 129 2.427 13.036 -0.626 1.00 0.00 H new ATOM 0 HE3 LYS B 129 1.128 12.579 0.457 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 1.594 14.927 0.590 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 1.948 14.179 2.073 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 3.207 14.622 1.023 1.00 0.00 H new ATOM 1977 N LYS B 130 -0.127 7.027 0.120 1.00 0.00 N ATOM 1978 CA LYS B 130 -0.912 5.917 0.694 1.00 0.00 C ATOM 1979 C LYS B 130 -0.331 4.521 0.378 1.00 0.00 C ATOM 1980 O LYS B 130 -0.508 3.596 1.175 1.00 0.00 O ATOM 1981 CB LYS B 130 -2.380 6.035 0.251 1.00 0.00 C ATOM 1982 CG LYS B 130 -3.047 7.293 0.840 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.499 7.493 0.388 1.00 0.00 C ATOM 1984 CE LYS B 130 -5.390 6.299 0.752 1.00 0.00 C ATOM 1985 NZ LYS B 130 -6.824 6.621 0.591 1.00 0.00 N ATOM 0 H LYS B 130 -0.647 7.594 -0.549 1.00 0.00 H new ATOM 0 HA LYS B 130 -0.855 6.009 1.779 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -2.431 6.070 -0.837 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -2.929 5.148 0.568 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -3.020 7.231 1.928 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -2.464 8.169 0.556 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -4.900 8.396 0.848 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -4.524 7.647 -0.691 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -5.135 5.448 0.121 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -5.197 6.001 1.783 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -7.397 5.791 0.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -7.073 7.417 1.212 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -7.012 6.881 -0.398 1.00 0.00 H new ATOM 1999 N THR B 131 0.453 4.392 -0.706 1.00 0.00 N ATOM 2000 CA THR B 131 1.215 3.181 -1.086 1.00 0.00 C ATOM 2001 C THR B 131 2.318 2.815 -0.080 1.00 0.00 C ATOM 2002 O THR B 131 2.865 1.716 -0.167 1.00 0.00 O ATOM 2003 CB THR B 131 1.830 3.319 -2.494 1.00 0.00 C ATOM 2004 OG1 THR B 131 1.060 4.168 -3.311 1.00 0.00 O ATOM 2005 CG2 THR B 131 1.904 1.976 -3.226 1.00 0.00 C ATOM 0 H THR B 131 0.581 5.156 -1.370 1.00 0.00 H new ATOM 0 HA THR B 131 0.486 2.370 -1.084 1.00 0.00 H new ATOM 0 HB THR B 131 2.829 3.723 -2.332 1.00 0.00 H new ATOM 0 HG1 THR B 131 1.406 5.083 -3.250 1.00 0.00 H new ATOM 0 HG21 THR B 131 2.344 2.123 -4.213 1.00 0.00 H new ATOM 0 HG22 THR B 131 2.521 1.283 -2.654 1.00 0.00 H new ATOM 0 HG23 THR B 131 0.900 1.565 -3.334 1.00 0.00 H new ATOM 2013 N GLY B 132 2.675 3.714 0.848 1.00 0.00 N ATOM 2014 CA GLY B 132 3.678 3.484 1.894 1.00 0.00 C ATOM 2015 C GLY B 132 5.088 3.442 1.319 1.00 0.00 C ATOM 2016 O GLY B 132 5.741 2.404 1.386 1.00 0.00 O ATOM 0 H GLY B 132 2.262 4.646 0.892 1.00 0.00 H new ATOM 0 HA2 GLY B 132 3.613 4.274 2.642 1.00 0.00 H new ATOM 0 HA3 GLY B 132 3.464 2.545 2.404 1.00 0.00 H new ATOM 2020 N LYS B 133 5.520 4.534 0.678 1.00 0.00 N ATOM 2021 CA LYS B 133 6.799 4.646 -0.044 1.00 0.00 C ATOM 2022 C LYS B 133 7.391 6.061 0.066 1.00 0.00 C ATOM 2023 O LYS B 133 6.648 7.049 0.064 1.00 0.00 O ATOM 2024 CB LYS B 133 6.592 4.303 -1.539 1.00 0.00 C ATOM 2025 CG LYS B 133 5.999 2.916 -1.847 1.00 0.00 C ATOM 2026 CD LYS B 133 6.941 1.761 -1.478 1.00 0.00 C ATOM 2027 CE LYS B 133 6.238 0.404 -1.550 1.00 0.00 C ATOM 2028 NZ LYS B 133 5.280 0.165 -0.438 1.00 0.00 N ATOM 0 H LYS B 133 4.973 5.394 0.645 1.00 0.00 H new ATOM 0 HA LYS B 133 7.496 3.943 0.412 1.00 0.00 H new ATOM 0 HB2 LYS B 133 5.939 5.059 -1.976 1.00 0.00 H new ATOM 0 HB3 LYS B 133 7.554 4.383 -2.044 1.00 0.00 H new ATOM 0 HG2 LYS B 133 5.061 2.800 -1.303 1.00 0.00 H new ATOM 0 HG3 LYS B 133 5.761 2.857 -2.909 1.00 0.00 H new ATOM 0 HD2 LYS B 133 7.798 1.762 -2.152 1.00 0.00 H new ATOM 0 HD3 LYS B 133 7.328 1.916 -0.471 1.00 0.00 H new ATOM 0 HE2 LYS B 133 5.705 0.331 -2.498 1.00 0.00 H new ATOM 0 HE3 LYS B 133 6.990 -0.385 -1.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 5.330 -0.831 -0.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 5.524 0.776 0.368 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 4.315 0.383 -0.758 1.00 0.00 H new ATOM 2042 N THR B 134 8.727 6.163 0.071 1.00 0.00 N ATOM 2043 CA THR B 134 9.476 7.424 -0.059 1.00 0.00 C ATOM 2044 C THR B 134 9.348 7.921 -1.497 1.00 0.00 C ATOM 2045 O THR B 134 10.046 7.424 -2.383 1.00 0.00 O ATOM 2046 CB THR B 134 10.939 7.237 0.359 1.00 0.00 C ATOM 2047 OG1 THR B 134 10.963 6.695 1.659 1.00 0.00 O ATOM 2048 CG2 THR B 134 11.681 8.568 0.414 1.00 0.00 C ATOM 0 H THR B 134 9.335 5.350 0.168 1.00 0.00 H new ATOM 0 HA THR B 134 9.059 8.176 0.610 1.00 0.00 H new ATOM 0 HB THR B 134 11.419 6.587 -0.372 1.00 0.00 H new ATOM 0 HG1 THR B 134 11.892 6.567 1.943 1.00 0.00 H new ATOM 0 HG21 THR B 134 12.715 8.396 0.714 1.00 0.00 H new ATOM 0 HG22 THR B 134 11.662 9.036 -0.570 1.00 0.00 H new ATOM 0 HG23 THR B 134 11.198 9.224 1.138 1.00 0.00 H new ATOM 2056 N VAL B 135 8.425 8.858 -1.718 1.00 0.00 N ATOM 2057 CA VAL B 135 8.048 9.381 -3.047 1.00 0.00 C ATOM 2058 C VAL B 135 8.692 10.746 -3.332 1.00 0.00 C ATOM 2059 O VAL B 135 8.755 11.614 -2.459 1.00 0.00 O ATOM 2060 CB VAL B 135 6.509 9.413 -3.249 1.00 0.00 C ATOM 2061 CG1 VAL B 135 5.749 10.260 -2.217 1.00 0.00 C ATOM 2062 CG2 VAL B 135 6.108 9.892 -4.656 1.00 0.00 C ATOM 0 H VAL B 135 7.899 9.292 -0.959 1.00 0.00 H new ATOM 0 HA VAL B 135 8.447 8.682 -3.782 1.00 0.00 H new ATOM 0 HB VAL B 135 6.217 8.372 -3.110 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.681 10.226 -2.434 1.00 0.00 H new ATOM 0 HG12 VAL B 135 5.929 9.864 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL B 135 6.097 11.292 -2.266 1.00 0.00 H new ATOM 0 HG21 VAL B 135 5.022 9.895 -4.743 1.00 0.00 H new ATOM 0 HG22 VAL B 135 6.488 10.900 -4.819 1.00 0.00 H new ATOM 0 HG23 VAL B 135 6.530 9.220 -5.403 1.00 0.00 H new ATOM 2072 N SER B 136 9.147 10.950 -4.571 1.00 0.00 N ATOM 2073 CA SER B 136 9.752 12.209 -5.038 1.00 0.00 C ATOM 2074 C SER B 136 9.299 12.577 -6.460 1.00 0.00 C ATOM 2075 O SER B 136 9.269 11.731 -7.356 1.00 0.00 O ATOM 2076 CB SER B 136 11.282 12.093 -4.986 1.00 0.00 C ATOM 2077 OG SER B 136 11.930 13.321 -5.282 1.00 0.00 O ATOM 0 H SER B 136 9.106 10.233 -5.295 1.00 0.00 H new ATOM 0 HA SER B 136 9.416 13.007 -4.375 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.584 11.756 -3.994 1.00 0.00 H new ATOM 0 HB3 SER B 136 11.610 11.333 -5.695 1.00 0.00 H new ATOM 0 HG SER B 136 12.901 13.198 -5.235 1.00 0.00 H new ATOM 2083 N TYR B 137 8.967 13.853 -6.683 1.00 0.00 N ATOM 2084 CA TYR B 137 8.697 14.420 -8.011 1.00 0.00 C ATOM 2085 C TYR B 137 10.006 14.647 -8.790 1.00 0.00 C ATOM 2086 O TYR B 137 10.835 15.472 -8.392 1.00 0.00 O ATOM 2087 CB TYR B 137 7.929 15.736 -7.811 1.00 0.00 C ATOM 2088 CG TYR B 137 7.572 16.496 -9.078 1.00 0.00 C ATOM 2089 CD1 TYR B 137 6.466 16.090 -9.845 1.00 0.00 C ATOM 2090 CD2 TYR B 137 8.296 17.645 -9.454 1.00 0.00 C ATOM 2091 CE1 TYR B 137 6.041 16.855 -10.946 1.00 0.00 C ATOM 2092 CE2 TYR B 137 7.890 18.405 -10.569 1.00 0.00 C ATOM 2093 CZ TYR B 137 6.743 18.027 -11.305 1.00 0.00 C ATOM 2094 OH TYR B 137 6.298 18.805 -12.331 1.00 0.00 O ATOM 0 H TYR B 137 8.876 14.536 -5.931 1.00 0.00 H new ATOM 0 HA TYR B 137 8.099 13.728 -8.603 1.00 0.00 H new ATOM 0 HB2 TYR B 137 7.008 15.518 -7.270 1.00 0.00 H new ATOM 0 HB3 TYR B 137 8.526 16.389 -7.175 1.00 0.00 H new ATOM 0 HD1 TYR B 137 5.939 15.184 -9.587 1.00 0.00 H new ATOM 0 HD2 TYR B 137 9.165 17.944 -8.886 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.178 16.546 -11.517 1.00 0.00 H new ATOM 0 HE2 TYR B 137 8.455 19.277 -10.862 1.00 0.00 H new ATOM 0 HH TYR B 137 6.897 19.572 -12.443 1.00 0.00 H new ATOM 2104 N LEU B 138 10.196 13.952 -9.916 1.00 0.00 N ATOM 2105 CA LEU B 138 11.379 14.065 -10.783 1.00 0.00 C ATOM 2106 C LEU B 138 11.041 14.867 -12.058 1.00 0.00 C ATOM 2107 O LEU B 138 11.375 14.478 -13.183 1.00 0.00 O ATOM 2108 CB LEU B 138 11.944 12.643 -11.050 1.00 0.00 C ATOM 2109 CG LEU B 138 12.967 12.108 -10.022 1.00 0.00 C ATOM 2110 CD1 LEU B 138 14.304 12.859 -10.086 1.00 0.00 C ATOM 2111 CD2 LEU B 138 12.454 12.099 -8.579 1.00 0.00 C ATOM 0 H LEU B 138 9.514 13.276 -10.261 1.00 0.00 H new ATOM 0 HA LEU B 138 12.170 14.632 -10.293 1.00 0.00 H new ATOM 0 HB2 LEU B 138 11.108 11.946 -11.095 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.414 12.641 -12.033 1.00 0.00 H new ATOM 0 HG LEU B 138 13.124 11.070 -10.317 1.00 0.00 H new ATOM 0 HD11 LEU B 138 14.989 12.447 -9.345 1.00 0.00 H new ATOM 0 HD12 LEU B 138 14.736 12.749 -11.081 1.00 0.00 H new ATOM 0 HD13 LEU B 138 14.138 13.916 -9.878 1.00 0.00 H new ATOM 0 HD21 LEU B 138 13.230 11.710 -7.919 1.00 0.00 H new ATOM 0 HD22 LEU B 138 12.197 13.115 -8.278 1.00 0.00 H new ATOM 0 HD23 LEU B 138 11.569 11.466 -8.511 1.00 0.00 H new ATOM 2123 N GLY B 139 10.484 16.065 -11.853 1.00 0.00 N ATOM 2124 CA GLY B 139 10.398 17.133 -12.852 1.00 0.00 C ATOM 2125 C GLY B 139 9.278 17.006 -13.889 1.00 0.00 C ATOM 2126 O GLY B 139 8.512 16.038 -13.937 1.00 0.00 O ATOM 0 H GLY B 139 10.068 16.325 -10.959 1.00 0.00 H new ATOM 0 HA2 GLY B 139 10.273 18.081 -12.329 1.00 0.00 H new ATOM 0 HA3 GLY B 139 11.350 17.183 -13.381 1.00 0.00 H new ATOM 2130 N LEU B 140 9.223 18.033 -14.742 1.00 0.00 N ATOM 2131 CA LEU B 140 8.364 18.149 -15.922 1.00 0.00 C ATOM 2132 C LEU B 140 9.194 17.857 -17.184 1.00 0.00 C ATOM 2133 O LEU B 140 10.311 18.373 -17.315 1.00 0.00 O ATOM 2134 CB LEU B 140 7.788 19.578 -15.947 1.00 0.00 C ATOM 2135 CG LEU B 140 6.453 19.699 -16.706 1.00 0.00 C ATOM 2136 CD1 LEU B 140 5.290 19.259 -15.800 1.00 0.00 C ATOM 2137 CD2 LEU B 140 6.248 21.153 -17.141 1.00 0.00 C ATOM 0 H LEU B 140 9.814 18.855 -14.619 1.00 0.00 H new ATOM 0 HA LEU B 140 7.544 17.432 -15.889 1.00 0.00 H new ATOM 0 HB2 LEU B 140 7.644 19.919 -14.922 1.00 0.00 H new ATOM 0 HB3 LEU B 140 8.517 20.245 -16.406 1.00 0.00 H new ATOM 0 HG LEU B 140 6.479 19.055 -17.585 1.00 0.00 H new ATOM 0 HD11 LEU B 140 4.350 19.348 -16.345 1.00 0.00 H new ATOM 0 HD12 LEU B 140 5.437 18.222 -15.497 1.00 0.00 H new ATOM 0 HD13 LEU B 140 5.258 19.895 -14.915 1.00 0.00 H new ATOM 0 HD21 LEU B 140 5.304 21.242 -17.679 1.00 0.00 H new ATOM 0 HD22 LEU B 140 6.227 21.796 -16.261 1.00 0.00 H new ATOM 0 HD23 LEU B 140 7.067 21.457 -17.793 1.00 0.00 H new ATOM 2149 N GLU B 141 8.690 17.029 -18.099 1.00 0.00 N ATOM 2150 CA GLU B 141 9.457 16.483 -19.238 1.00 0.00 C ATOM 2151 C GLU B 141 9.710 17.500 -20.357 1.00 0.00 C ATOM 2152 O GLU B 141 8.785 18.259 -20.723 1.00 0.00 O ATOM 2153 CB GLU B 141 8.774 15.204 -19.763 1.00 0.00 C ATOM 2154 CG GLU B 141 9.757 14.328 -20.555 1.00 0.00 C ATOM 2155 CD GLU B 141 9.105 13.046 -21.090 1.00 0.00 C ATOM 2156 OE1 GLU B 141 8.477 13.089 -22.175 1.00 0.00 O ATOM 2157 OE2 GLU B 141 9.251 11.960 -20.473 1.00 0.00 O ATOM 2158 OXT GLU B 141 10.861 17.576 -20.849 1.00 0.00 O ATOM 0 H GLU B 141 7.722 16.709 -18.077 1.00 0.00 H new ATOM 0 HA GLU B 141 10.449 16.230 -18.865 1.00 0.00 H new ATOM 0 HB2 GLU B 141 8.371 14.635 -18.925 1.00 0.00 H new ATOM 0 HB3 GLU B 141 7.931 15.475 -20.399 1.00 0.00 H new ATOM 0 HG2 GLU B 141 10.159 14.903 -21.390 1.00 0.00 H new ATOM 0 HG3 GLU B 141 10.599 14.063 -19.915 1.00 0.00 H new TER 2165 GLU B 141 HETATM 2166 CU CU A 142 6.974 -5.006 -2.495 1.00 0.00 CU