USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1057 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 42 MET CE :methyl -155:sc= -4.07 (180deg=-6.77!) USER MOD Set 1.2: A 49 TYR OH : rot 30:sc= -1.41 USER MOD Set 2.1: A 31 MET CE :methyl 163:sc= -0.253 (180deg=-0.765) USER MOD Set 2.2: A 32 MET CE :methyl -117:sc= -0.302 (180deg=-0.51) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -6.79! C(o=-6.8!,f=-7.1!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= -0.0624 USER MOD Single : A 17 GLN : amide:sc= -0.0298 X(o=-0.03,f=-0.14) USER MOD Single : A 24 THR OG1 : rot 103:sc= 1.48 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 30:sc=0.000418 USER MOD Single : A 46 CYS SG : rot 95:sc= 0.122 USER MOD Single : A 50 ASN :FLIP amide:sc= -0.221 F(o=-2.9!,f=-0.22) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HE2:sc= -1.28 K(o=-1.3,f=-4.5!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot -149:sc= 0.152 USER MOD Single : A 66 MET CE :methyl 175:sc= -4.51! (180deg=-4.79!) USER MOD Single : A 79 ASN :FLIP amide:sc= 0.0538 F(o=-0.74,f=0.054) USER MOD Single : A 81 ASN : amide:sc= -6.31! C(o=-6.3!,f=-9.2!) USER MOD Single : A 88 SER OG : rot 180:sc= -0.0345 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN :FLIP amide:sc= -0.899 F(o=-1.5,f=-0.9) USER MOD Single : A 111 THR OG1 : rot -140:sc= -0.0285 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= -0.0825 X(o=-0.082,f=0.0071) USER MOD Single : A 131 HIS : no HD1:sc= 0.307 K(o=0.31,f=-2.3!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.582 2.166 23.334 1.00 0.00 N ATOM 2 CA MET A 1 5.279 3.407 24.095 1.00 0.00 C ATOM 3 C MET A 1 3.876 3.352 24.691 1.00 0.00 C ATOM 4 O MET A 1 3.680 3.644 25.870 1.00 0.00 O ATOM 5 CB MET A 1 5.409 4.629 23.182 1.00 0.00 C ATOM 6 CG MET A 1 5.067 5.941 23.868 1.00 0.00 C ATOM 7 SD MET A 1 6.100 6.263 25.310 1.00 0.00 S ATOM 8 CE MET A 1 5.408 7.814 25.881 1.00 0.00 C ATOM 0 H1 MET A 1 6.542 2.227 22.938 1.00 0.00 H new ATOM 0 H2 MET A 1 5.521 1.345 23.970 1.00 0.00 H new ATOM 0 H3 MET A 1 4.895 2.056 22.561 1.00 0.00 H new ATOM 0 HA MET A 1 5.997 3.489 24.911 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.430 4.682 22.803 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.755 4.499 22.319 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.179 6.759 23.156 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.020 5.925 24.172 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.943 8.145 26.771 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.505 8.566 25.098 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.354 7.675 26.122 1.00 0.00 H new ATOM 20 N ASN A 2 2.903 2.974 23.867 1.00 0.00 N ATOM 21 CA ASN A 2 1.517 2.881 24.313 1.00 0.00 C ATOM 22 C ASN A 2 1.164 1.449 24.700 1.00 0.00 C ATOM 23 O ASN A 2 1.982 0.538 24.563 1.00 0.00 O ATOM 24 CB ASN A 2 0.572 3.368 23.213 1.00 0.00 C ATOM 25 CG ASN A 2 0.875 4.788 22.774 1.00 0.00 C ATOM 26 OD1 ASN A 2 1.352 5.605 23.562 1.00 0.00 O ATOM 27 ND2 ASN A 2 0.600 5.087 21.510 1.00 0.00 N ATOM 0 H ASN A 2 3.049 2.727 22.888 1.00 0.00 H new ATOM 0 HA ASN A 2 1.402 3.516 25.192 1.00 0.00 H new ATOM 0 HB2 ASN A 2 0.646 2.702 22.354 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.456 3.313 23.571 1.00 0.00 H new ATOM 0 HD21 ASN A 2 0.784 6.026 21.156 1.00 0.00 H new ATOM 0 HD22 ASN A 2 0.205 4.378 20.892 1.00 0.00 H new ATOM 34 N THR A 3 -0.059 1.257 25.186 1.00 0.00 N ATOM 35 CA THR A 3 -0.524 -0.063 25.590 1.00 0.00 C ATOM 36 C THR A 3 -1.590 -0.585 24.633 1.00 0.00 C ATOM 37 O THR A 3 -1.977 -1.752 24.695 1.00 0.00 O ATOM 38 CB THR A 3 -1.100 -0.046 27.019 1.00 0.00 C ATOM 39 OG1 THR A 3 -2.243 0.816 27.076 1.00 0.00 O ATOM 40 CG2 THR A 3 -0.054 0.425 28.019 1.00 0.00 C ATOM 0 H THR A 3 -0.746 2.001 25.309 1.00 0.00 H new ATOM 0 HA THR A 3 0.342 -0.724 25.564 1.00 0.00 H new ATOM 0 HB THR A 3 -1.397 -1.062 27.279 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.604 0.820 27.987 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.484 0.429 29.021 1.00 0.00 H new ATOM 0 HG22 THR A 3 0.802 -0.249 27.994 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.270 1.433 27.759 1.00 0.00 H new ATOM 48 N GLU A 4 -2.063 0.290 23.751 1.00 0.00 N ATOM 49 CA GLU A 4 -3.086 -0.077 22.780 1.00 0.00 C ATOM 50 C GLU A 4 -2.623 0.208 21.354 1.00 0.00 C ATOM 51 O GLU A 4 -1.971 -0.625 20.724 1.00 0.00 O ATOM 52 CB GLU A 4 -4.393 0.664 23.079 1.00 0.00 C ATOM 53 CG GLU A 4 -4.190 2.050 23.674 1.00 0.00 C ATOM 54 CD GLU A 4 -5.488 2.822 23.807 1.00 0.00 C ATOM 55 OE1 GLU A 4 -6.144 2.702 24.863 1.00 0.00 O ATOM 56 OE2 GLU A 4 -5.847 3.548 22.857 1.00 0.00 O ATOM 0 H GLU A 4 -1.753 1.260 23.689 1.00 0.00 H new ATOM 0 HA GLU A 4 -3.263 -1.149 22.865 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -4.967 0.755 22.157 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -4.989 0.066 23.769 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -3.725 1.956 24.655 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -3.499 2.613 23.047 1.00 0.00 H new ATOM 63 N GLU A 5 -2.965 1.388 20.852 1.00 0.00 N ATOM 64 CA GLU A 5 -2.585 1.789 19.501 1.00 0.00 C ATOM 65 C GLU A 5 -1.072 1.936 19.380 1.00 0.00 C ATOM 66 O GLU A 5 -0.341 1.764 20.356 1.00 0.00 O ATOM 67 CB GLU A 5 -3.267 3.106 19.128 1.00 0.00 C ATOM 68 CG GLU A 5 -4.786 3.041 19.176 1.00 0.00 C ATOM 69 CD GLU A 5 -5.438 4.351 18.781 1.00 0.00 C ATOM 70 OE1 GLU A 5 -5.642 5.204 19.669 1.00 0.00 O ATOM 71 OE2 GLU A 5 -5.745 4.524 17.583 1.00 0.00 O ATOM 0 H GLU A 5 -3.506 2.087 21.361 1.00 0.00 H new ATOM 0 HA GLU A 5 -2.911 1.009 18.813 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -2.924 3.888 19.806 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -2.956 3.395 18.124 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -5.133 2.251 18.510 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -5.103 2.771 20.183 1.00 0.00 H new ATOM 78 N GLN A 6 -0.608 2.256 18.176 1.00 0.00 N ATOM 79 CA GLN A 6 0.818 2.428 17.928 1.00 0.00 C ATOM 80 C GLN A 6 1.159 3.896 17.664 1.00 0.00 C ATOM 81 O GLN A 6 0.427 4.596 16.966 1.00 0.00 O ATOM 82 CB GLN A 6 1.268 1.560 16.748 1.00 0.00 C ATOM 83 CG GLN A 6 0.183 1.313 15.710 1.00 0.00 C ATOM 84 CD GLN A 6 -0.310 2.588 15.056 1.00 0.00 C ATOM 85 OE1 GLN A 6 -1.270 3.205 15.516 1.00 0.00 O ATOM 86 NE2 GLN A 6 0.348 2.990 13.975 1.00 0.00 N ATOM 0 H GLN A 6 -1.199 2.401 17.358 1.00 0.00 H new ATOM 0 HA GLN A 6 1.353 2.109 18.823 1.00 0.00 H new ATOM 0 HB2 GLN A 6 2.119 2.038 16.262 1.00 0.00 H new ATOM 0 HB3 GLN A 6 1.617 0.600 17.129 1.00 0.00 H new ATOM 0 HG2 GLN A 6 0.568 0.642 14.942 1.00 0.00 H new ATOM 0 HG3 GLN A 6 -0.657 0.806 16.184 1.00 0.00 H new ATOM 0 HE21 GLN A 6 1.139 2.447 13.628 1.00 0.00 H new ATOM 0 HE22 GLN A 6 0.063 3.842 13.492 1.00 0.00 H new ATOM 95 N PRO A 7 2.281 4.380 18.231 1.00 0.00 N ATOM 96 CA PRO A 7 2.724 5.769 18.064 1.00 0.00 C ATOM 97 C PRO A 7 3.189 6.072 16.651 1.00 0.00 C ATOM 98 O PRO A 7 3.702 7.155 16.364 1.00 0.00 O ATOM 99 CB PRO A 7 3.900 5.903 19.036 1.00 0.00 C ATOM 100 CG PRO A 7 3.832 4.701 19.918 1.00 0.00 C ATOM 101 CD PRO A 7 3.198 3.622 19.093 1.00 0.00 C ATOM 0 HA PRO A 7 1.908 6.466 18.257 1.00 0.00 H new ATOM 0 HB2 PRO A 7 4.848 5.943 18.500 1.00 0.00 H new ATOM 0 HB3 PRO A 7 3.824 6.821 19.618 1.00 0.00 H new ATOM 0 HG2 PRO A 7 4.826 4.404 20.251 1.00 0.00 H new ATOM 0 HG3 PRO A 7 3.244 4.906 20.812 1.00 0.00 H new ATOM 0 HD2 PRO A 7 3.936 3.068 18.513 1.00 0.00 H new ATOM 0 HD3 PRO A 7 2.668 2.897 19.711 1.00 0.00 H new ATOM 109 N VAL A 8 3.005 5.105 15.781 1.00 0.00 N ATOM 110 CA VAL A 8 3.400 5.235 14.383 1.00 0.00 C ATOM 111 C VAL A 8 2.323 5.944 13.571 1.00 0.00 C ATOM 112 O VAL A 8 1.146 5.587 13.637 1.00 0.00 O ATOM 113 CB VAL A 8 3.681 3.860 13.747 1.00 0.00 C ATOM 114 CG1 VAL A 8 4.235 4.028 12.340 1.00 0.00 C ATOM 115 CG2 VAL A 8 4.639 3.055 14.611 1.00 0.00 C ATOM 0 H VAL A 8 2.580 4.207 16.014 1.00 0.00 H new ATOM 0 HA VAL A 8 4.314 5.828 14.368 1.00 0.00 H new ATOM 0 HB VAL A 8 2.741 3.312 13.682 1.00 0.00 H new ATOM 0 HG11 VAL A 8 4.428 3.047 11.905 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.510 4.561 11.725 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.164 4.596 12.380 1.00 0.00 H new ATOM 0 HG21 VAL A 8 4.824 2.088 14.144 1.00 0.00 H new ATOM 0 HG22 VAL A 8 5.580 3.596 14.712 1.00 0.00 H new ATOM 0 HG23 VAL A 8 4.200 2.904 15.597 1.00 0.00 H new ATOM 125 N THR A 9 2.732 6.950 12.805 1.00 0.00 N ATOM 126 CA THR A 9 1.805 7.706 11.974 1.00 0.00 C ATOM 127 C THR A 9 2.445 8.074 10.643 1.00 0.00 C ATOM 128 O THR A 9 3.624 8.425 10.586 1.00 0.00 O ATOM 129 CB THR A 9 1.336 8.996 12.675 1.00 0.00 C ATOM 130 OG1 THR A 9 2.465 9.816 12.999 1.00 0.00 O ATOM 131 CG2 THR A 9 0.557 8.673 13.941 1.00 0.00 C ATOM 0 H THR A 9 3.702 7.260 12.743 1.00 0.00 H new ATOM 0 HA THR A 9 0.941 7.064 11.801 1.00 0.00 H new ATOM 0 HB THR A 9 0.680 9.535 11.992 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.158 10.634 13.443 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.237 9.600 14.418 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.318 8.074 13.687 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.193 8.113 14.627 1.00 0.00 H new ATOM 139 N ALA A 10 1.664 7.992 9.574 1.00 0.00 N ATOM 140 CA ALA A 10 2.157 8.317 8.246 1.00 0.00 C ATOM 141 C ALA A 10 2.191 9.824 8.032 1.00 0.00 C ATOM 142 O ALA A 10 1.636 10.586 8.824 1.00 0.00 O ATOM 143 CB ALA A 10 1.299 7.648 7.183 1.00 0.00 C ATOM 0 H ALA A 10 0.686 7.703 9.603 1.00 0.00 H new ATOM 0 HA ALA A 10 3.176 7.940 8.160 1.00 0.00 H new ATOM 0 HB1 ALA A 10 1.681 7.901 6.194 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.330 6.567 7.318 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.270 7.996 7.274 1.00 0.00 H new ATOM 149 N SER A 11 2.843 10.249 6.957 1.00 0.00 N ATOM 150 CA SER A 11 2.949 11.670 6.643 1.00 0.00 C ATOM 151 C SER A 11 3.008 11.891 5.136 1.00 0.00 C ATOM 152 O SER A 11 3.318 10.976 4.378 1.00 0.00 O ATOM 153 CB SER A 11 4.189 12.267 7.310 1.00 0.00 C ATOM 154 OG SER A 11 4.308 13.651 7.024 1.00 0.00 O ATOM 0 H SER A 11 3.306 9.633 6.289 1.00 0.00 H new ATOM 0 HA SER A 11 2.061 12.171 7.029 1.00 0.00 H new ATOM 0 HB2 SER A 11 4.132 12.119 8.388 1.00 0.00 H new ATOM 0 HB3 SER A 11 5.080 11.743 6.963 1.00 0.00 H new ATOM 0 HG SER A 11 5.108 14.008 7.464 1.00 0.00 H new ATOM 160 N LEU A 12 2.711 13.112 4.706 1.00 0.00 N ATOM 161 CA LEU A 12 2.729 13.445 3.290 1.00 0.00 C ATOM 162 C LEU A 12 4.037 14.127 2.913 1.00 0.00 C ATOM 163 O LEU A 12 4.356 15.206 3.411 1.00 0.00 O ATOM 164 CB LEU A 12 1.547 14.350 2.944 1.00 0.00 C ATOM 165 CG LEU A 12 1.262 14.493 1.449 1.00 0.00 C ATOM 166 CD1 LEU A 12 0.927 13.141 0.840 1.00 0.00 C ATOM 167 CD2 LEU A 12 0.131 15.482 1.219 1.00 0.00 C ATOM 0 H LEU A 12 2.455 13.886 5.319 1.00 0.00 H new ATOM 0 HA LEU A 12 2.645 12.520 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.654 13.960 3.434 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.732 15.340 3.360 1.00 0.00 H new ATOM 0 HG LEU A 12 2.157 14.875 0.959 1.00 0.00 H new ATOM 0 HD11 LEU A 12 0.727 13.261 -0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.768 12.462 0.977 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.045 12.729 1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.061 15.573 0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.770 15.128 1.720 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.411 16.455 1.622 1.00 0.00 H new ATOM 179 N VAL A 13 4.790 13.485 2.029 1.00 0.00 N ATOM 180 CA VAL A 13 6.068 14.020 1.580 1.00 0.00 C ATOM 181 C VAL A 13 5.884 14.958 0.391 1.00 0.00 C ATOM 182 O VAL A 13 4.974 14.777 -0.418 1.00 0.00 O ATOM 183 CB VAL A 13 7.040 12.884 1.203 1.00 0.00 C ATOM 184 CG1 VAL A 13 6.363 11.900 0.262 1.00 0.00 C ATOM 185 CG2 VAL A 13 8.314 13.442 0.585 1.00 0.00 C ATOM 0 H VAL A 13 4.537 12.591 1.608 1.00 0.00 H new ATOM 0 HA VAL A 13 6.494 14.586 2.408 1.00 0.00 H new ATOM 0 HB VAL A 13 7.318 12.352 2.113 1.00 0.00 H new ATOM 0 HG11 VAL A 13 7.061 11.104 0.004 1.00 0.00 H new ATOM 0 HG12 VAL A 13 5.488 11.472 0.751 1.00 0.00 H new ATOM 0 HG13 VAL A 13 6.053 12.419 -0.645 1.00 0.00 H new ATOM 0 HG21 VAL A 13 8.983 12.621 0.328 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.066 14.004 -0.316 1.00 0.00 H new ATOM 0 HG23 VAL A 13 8.807 14.101 1.300 1.00 0.00 H new ATOM 195 N ALA A 14 6.752 15.962 0.298 1.00 0.00 N ATOM 196 CA ALA A 14 6.691 16.938 -0.786 1.00 0.00 C ATOM 197 C ALA A 14 6.593 16.254 -2.145 1.00 0.00 C ATOM 198 O ALA A 14 7.061 15.130 -2.322 1.00 0.00 O ATOM 199 CB ALA A 14 7.905 17.852 -0.739 1.00 0.00 C ATOM 0 H ALA A 14 7.509 16.121 0.963 1.00 0.00 H new ATOM 0 HA ALA A 14 5.791 17.537 -0.649 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.848 18.575 -1.552 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.927 18.379 0.215 1.00 0.00 H new ATOM 0 HB3 ALA A 14 8.812 17.257 -0.845 1.00 0.00 H new ATOM 205 N GLU A 15 5.982 16.945 -3.103 1.00 0.00 N ATOM 206 CA GLU A 15 5.815 16.407 -4.448 1.00 0.00 C ATOM 207 C GLU A 15 7.129 16.443 -5.221 1.00 0.00 C ATOM 208 O GLU A 15 7.369 15.609 -6.096 1.00 0.00 O ATOM 209 CB GLU A 15 4.741 17.194 -5.203 1.00 0.00 C ATOM 210 CG GLU A 15 5.040 18.681 -5.318 1.00 0.00 C ATOM 211 CD GLU A 15 3.957 19.436 -6.063 1.00 0.00 C ATOM 212 OE1 GLU A 15 3.003 19.907 -5.409 1.00 0.00 O ATOM 213 OE2 GLU A 15 4.064 19.558 -7.302 1.00 0.00 O ATOM 0 H GLU A 15 5.594 17.879 -2.972 1.00 0.00 H new ATOM 0 HA GLU A 15 5.500 15.367 -4.359 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.633 16.776 -6.204 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.784 17.063 -4.697 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.152 19.104 -4.320 1.00 0.00 H new ATOM 0 HG3 GLU A 15 5.992 18.818 -5.831 1.00 0.00 H new ATOM 220 N ALA A 16 7.977 17.412 -4.897 1.00 0.00 N ATOM 221 CA ALA A 16 9.266 17.554 -5.562 1.00 0.00 C ATOM 222 C ALA A 16 10.327 16.679 -4.904 1.00 0.00 C ATOM 223 O ALA A 16 11.465 16.611 -5.369 1.00 0.00 O ATOM 224 CB ALA A 16 9.704 19.010 -5.555 1.00 0.00 C ATOM 0 H ALA A 16 7.795 18.111 -4.177 1.00 0.00 H new ATOM 0 HA ALA A 16 9.151 17.223 -6.594 1.00 0.00 H new ATOM 0 HB1 ALA A 16 10.668 19.102 -6.055 1.00 0.00 H new ATOM 0 HB2 ALA A 16 8.964 19.615 -6.079 1.00 0.00 H new ATOM 0 HB3 ALA A 16 9.794 19.358 -4.526 1.00 0.00 H new ATOM 230 N GLN A 17 9.947 16.009 -3.819 1.00 0.00 N ATOM 231 CA GLN A 17 10.867 15.141 -3.095 1.00 0.00 C ATOM 232 C GLN A 17 10.378 13.698 -3.112 1.00 0.00 C ATOM 233 O GLN A 17 11.140 12.772 -2.837 1.00 0.00 O ATOM 234 CB GLN A 17 11.025 15.623 -1.653 1.00 0.00 C ATOM 235 CG GLN A 17 11.730 16.964 -1.539 1.00 0.00 C ATOM 236 CD GLN A 17 13.175 16.896 -1.987 1.00 0.00 C ATOM 237 OE1 GLN A 17 14.079 16.681 -1.179 1.00 0.00 O ATOM 238 NE2 GLN A 17 13.402 17.071 -3.284 1.00 0.00 N ATOM 0 H GLN A 17 9.008 16.052 -3.423 1.00 0.00 H new ATOM 0 HA GLN A 17 11.836 15.182 -3.592 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.040 15.699 -1.193 1.00 0.00 H new ATOM 0 HB3 GLN A 17 11.584 14.878 -1.088 1.00 0.00 H new ATOM 0 HG2 GLN A 17 11.200 17.702 -2.141 1.00 0.00 H new ATOM 0 HG3 GLN A 17 11.689 17.307 -0.505 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.623 17.247 -3.919 1.00 0.00 H new ATOM 0 HE22 GLN A 17 14.355 17.029 -3.645 1.00 0.00 H new ATOM 247 N ARG A 18 9.103 13.515 -3.435 1.00 0.00 N ATOM 248 CA ARG A 18 8.517 12.182 -3.489 1.00 0.00 C ATOM 249 C ARG A 18 9.064 11.412 -4.686 1.00 0.00 C ATOM 250 O ARG A 18 9.013 10.182 -4.724 1.00 0.00 O ATOM 251 CB ARG A 18 6.991 12.269 -3.567 1.00 0.00 C ATOM 252 CG ARG A 18 6.479 12.982 -4.808 1.00 0.00 C ATOM 253 CD ARG A 18 4.961 13.054 -4.824 1.00 0.00 C ATOM 254 NE ARG A 18 4.351 11.748 -5.057 1.00 0.00 N ATOM 255 CZ ARG A 18 3.048 11.512 -4.943 1.00 0.00 C ATOM 256 NH1 ARG A 18 2.223 12.486 -4.581 1.00 0.00 N ATOM 257 NH2 ARG A 18 2.568 10.301 -5.187 1.00 0.00 N ATOM 0 H ARG A 18 8.457 14.271 -3.663 1.00 0.00 H new ATOM 0 HA ARG A 18 8.787 11.649 -2.577 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.577 11.261 -3.542 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.620 12.788 -2.683 1.00 0.00 H new ATOM 0 HG2 ARG A 18 6.892 13.990 -4.846 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.829 12.460 -5.699 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.608 13.454 -3.874 1.00 0.00 H new ATOM 0 HD3 ARG A 18 4.640 13.747 -5.601 1.00 0.00 H new ATOM 0 HE ARG A 18 4.959 10.973 -5.322 1.00 0.00 H new ATOM 0 HH11 ARG A 18 2.588 13.419 -4.389 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.223 12.302 -4.494 1.00 0.00 H new ATOM 0 HH21 ARG A 18 3.199 9.548 -5.463 1.00 0.00 H new ATOM 0 HH22 ARG A 18 1.568 10.122 -5.099 1.00 0.00 H new ATOM 271 N LEU A 19 9.594 12.147 -5.657 1.00 0.00 N ATOM 272 CA LEU A 19 10.157 11.541 -6.856 1.00 0.00 C ATOM 273 C LEU A 19 11.404 10.731 -6.514 1.00 0.00 C ATOM 274 O LEU A 19 11.763 9.794 -7.228 1.00 0.00 O ATOM 275 CB LEU A 19 10.492 12.621 -7.887 1.00 0.00 C ATOM 276 CG LEU A 19 11.391 13.750 -7.379 1.00 0.00 C ATOM 277 CD1 LEU A 19 12.858 13.390 -7.557 1.00 0.00 C ATOM 278 CD2 LEU A 19 11.067 15.051 -8.095 1.00 0.00 C ATOM 0 H LEU A 19 9.645 13.166 -5.636 1.00 0.00 H new ATOM 0 HA LEU A 19 9.415 10.866 -7.283 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.977 12.148 -8.741 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.561 13.055 -8.250 1.00 0.00 H new ATOM 0 HG LEU A 19 11.202 13.887 -6.314 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.480 14.206 -7.190 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.081 12.483 -6.995 1.00 0.00 H new ATOM 0 HD13 LEU A 19 13.066 13.223 -8.614 1.00 0.00 H new ATOM 0 HD21 LEU A 19 11.716 15.843 -7.721 1.00 0.00 H new ATOM 0 HD22 LEU A 19 11.226 14.926 -9.166 1.00 0.00 H new ATOM 0 HD23 LEU A 19 10.026 15.318 -7.912 1.00 0.00 H new ATOM 290 N ASP A 20 12.060 11.102 -5.419 1.00 0.00 N ATOM 291 CA ASP A 20 13.263 10.406 -4.975 1.00 0.00 C ATOM 292 C ASP A 20 13.007 9.694 -3.653 1.00 0.00 C ATOM 293 O ASP A 20 13.769 8.819 -3.248 1.00 0.00 O ATOM 294 CB ASP A 20 14.423 11.390 -4.818 1.00 0.00 C ATOM 295 CG ASP A 20 15.762 10.693 -4.689 1.00 0.00 C ATOM 296 OD1 ASP A 20 16.350 10.338 -5.732 1.00 0.00 O ATOM 297 OD2 ASP A 20 16.223 10.499 -3.545 1.00 0.00 O ATOM 0 H ASP A 20 11.779 11.880 -4.823 1.00 0.00 H new ATOM 0 HA ASP A 20 13.528 9.666 -5.730 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.447 12.059 -5.678 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.253 12.009 -3.937 1.00 0.00 H new ATOM 302 N PHE A 21 11.921 10.077 -2.993 1.00 0.00 N ATOM 303 CA PHE A 21 11.544 9.491 -1.712 1.00 0.00 C ATOM 304 C PHE A 21 11.205 8.013 -1.877 1.00 0.00 C ATOM 305 O PHE A 21 11.580 7.182 -1.048 1.00 0.00 O ATOM 306 CB PHE A 21 10.341 10.233 -1.132 1.00 0.00 C ATOM 307 CG PHE A 21 10.207 10.111 0.358 1.00 0.00 C ATOM 308 CD1 PHE A 21 10.884 10.979 1.200 1.00 0.00 C ATOM 309 CD2 PHE A 21 9.397 9.136 0.917 1.00 0.00 C ATOM 310 CE1 PHE A 21 10.757 10.876 2.572 1.00 0.00 C ATOM 311 CE2 PHE A 21 9.267 9.026 2.289 1.00 0.00 C ATOM 312 CZ PHE A 21 9.947 9.898 3.117 1.00 0.00 C ATOM 0 H PHE A 21 11.281 10.797 -3.327 1.00 0.00 H new ATOM 0 HA PHE A 21 12.389 9.583 -1.029 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.417 11.288 -1.394 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.433 9.853 -1.600 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.518 11.745 0.779 1.00 0.00 H new ATOM 0 HD2 PHE A 21 8.861 8.454 0.274 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.290 11.559 3.217 1.00 0.00 H new ATOM 0 HE2 PHE A 21 8.635 8.260 2.713 1.00 0.00 H new ATOM 0 HZ PHE A 21 9.846 9.815 4.189 1.00 0.00 H new ATOM 322 N LEU A 22 10.492 7.696 -2.953 1.00 0.00 N ATOM 323 CA LEU A 22 10.093 6.321 -3.233 1.00 0.00 C ATOM 324 C LEU A 22 11.317 5.426 -3.452 1.00 0.00 C ATOM 325 O LEU A 22 11.457 4.398 -2.792 1.00 0.00 O ATOM 326 CB LEU A 22 9.172 6.271 -4.458 1.00 0.00 C ATOM 327 CG LEU A 22 8.063 5.214 -4.407 1.00 0.00 C ATOM 328 CD1 LEU A 22 8.646 3.829 -4.166 1.00 0.00 C ATOM 329 CD2 LEU A 22 7.046 5.560 -3.330 1.00 0.00 C ATOM 0 H LEU A 22 10.178 8.374 -3.647 1.00 0.00 H new ATOM 0 HA LEU A 22 9.548 5.945 -2.367 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.711 7.251 -4.584 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.782 6.090 -5.343 1.00 0.00 H new ATOM 0 HG LEU A 22 7.556 5.206 -5.372 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.840 3.096 -4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.333 3.578 -4.974 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.183 3.820 -3.217 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.266 4.799 -3.308 1.00 0.00 H new ATOM 0 HD22 LEU A 22 7.542 5.599 -2.360 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.600 6.530 -3.549 1.00 0.00 H new ATOM 341 N PRO A 23 12.222 5.797 -4.383 1.00 0.00 N ATOM 342 CA PRO A 23 13.429 5.008 -4.660 1.00 0.00 C ATOM 343 C PRO A 23 14.435 5.068 -3.515 1.00 0.00 C ATOM 344 O PRO A 23 15.392 4.297 -3.471 1.00 0.00 O ATOM 345 CB PRO A 23 14.007 5.670 -5.914 1.00 0.00 C ATOM 346 CG PRO A 23 13.508 7.071 -5.866 1.00 0.00 C ATOM 347 CD PRO A 23 12.145 7.001 -5.238 1.00 0.00 C ATOM 0 HA PRO A 23 13.203 3.949 -4.786 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.097 5.637 -5.912 1.00 0.00 H new ATOM 0 HB3 PRO A 23 13.674 5.162 -6.819 1.00 0.00 H new ATOM 0 HG2 PRO A 23 14.176 7.704 -5.281 1.00 0.00 H new ATOM 0 HG3 PRO A 23 13.456 7.502 -6.866 1.00 0.00 H new ATOM 0 HD2 PRO A 23 11.925 7.895 -4.654 1.00 0.00 H new ATOM 0 HD3 PRO A 23 11.361 6.910 -5.989 1.00 0.00 H new ATOM 355 N THR A 24 14.214 5.997 -2.594 1.00 0.00 N ATOM 356 CA THR A 24 15.096 6.165 -1.446 1.00 0.00 C ATOM 357 C THR A 24 14.697 5.253 -0.287 1.00 0.00 C ATOM 358 O THR A 24 15.553 4.776 0.460 1.00 0.00 O ATOM 359 CB THR A 24 15.102 7.631 -0.969 1.00 0.00 C ATOM 360 OG1 THR A 24 15.900 8.428 -1.851 1.00 0.00 O ATOM 361 CG2 THR A 24 15.636 7.752 0.448 1.00 0.00 C ATOM 0 H THR A 24 13.429 6.648 -2.620 1.00 0.00 H new ATOM 0 HA THR A 24 16.098 5.888 -1.772 1.00 0.00 H new ATOM 0 HB THR A 24 14.072 7.989 -0.977 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.315 8.947 -2.442 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.626 8.799 0.752 1.00 0.00 H new ATOM 0 HG22 THR A 24 15.008 7.172 1.124 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.657 7.373 0.486 1.00 0.00 H new ATOM 369 N TYR A 25 13.401 5.007 -0.142 1.00 0.00 N ATOM 370 CA TYR A 25 12.904 4.158 0.937 1.00 0.00 C ATOM 371 C TYR A 25 12.644 2.735 0.453 1.00 0.00 C ATOM 372 O TYR A 25 12.707 1.783 1.232 1.00 0.00 O ATOM 373 CB TYR A 25 11.630 4.750 1.537 1.00 0.00 C ATOM 374 CG TYR A 25 11.895 5.802 2.591 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.465 7.023 2.256 1.00 0.00 C ATOM 376 CD2 TYR A 25 11.583 5.568 3.925 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.714 7.983 3.218 1.00 0.00 C ATOM 378 CE2 TYR A 25 11.829 6.523 4.893 1.00 0.00 C ATOM 379 CZ TYR A 25 12.394 7.728 4.535 1.00 0.00 C ATOM 380 OH TYR A 25 12.641 8.682 5.496 1.00 0.00 O ATOM 0 H TYR A 25 12.676 5.381 -0.755 1.00 0.00 H new ATOM 0 HA TYR A 25 13.675 4.116 1.707 1.00 0.00 H new ATOM 0 HB2 TYR A 25 11.031 5.189 0.739 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.037 3.948 1.976 1.00 0.00 H new ATOM 0 HD1 TYR A 25 12.718 7.226 1.226 1.00 0.00 H new ATOM 0 HD2 TYR A 25 11.141 4.625 4.210 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.157 8.928 2.940 1.00 0.00 H new ATOM 0 HE2 TYR A 25 11.580 6.326 5.925 1.00 0.00 H new ATOM 0 HH TYR A 25 12.357 8.346 6.371 1.00 0.00 H new ATOM 390 N PHE A 26 12.352 2.597 -0.834 1.00 0.00 N ATOM 391 CA PHE A 26 12.084 1.293 -1.421 1.00 0.00 C ATOM 392 C PHE A 26 13.279 0.824 -2.240 1.00 0.00 C ATOM 393 O PHE A 26 13.694 -0.331 -2.152 1.00 0.00 O ATOM 394 CB PHE A 26 10.840 1.362 -2.307 1.00 0.00 C ATOM 395 CG PHE A 26 9.987 0.123 -2.260 1.00 0.00 C ATOM 396 CD1 PHE A 26 9.712 -0.504 -1.054 1.00 0.00 C ATOM 397 CD2 PHE A 26 9.460 -0.413 -3.424 1.00 0.00 C ATOM 398 CE1 PHE A 26 8.928 -1.641 -1.010 1.00 0.00 C ATOM 399 CE2 PHE A 26 8.675 -1.551 -3.386 1.00 0.00 C ATOM 400 CZ PHE A 26 8.409 -2.165 -2.179 1.00 0.00 C ATOM 0 H PHE A 26 12.295 3.375 -1.491 1.00 0.00 H new ATOM 0 HA PHE A 26 11.909 0.579 -0.616 1.00 0.00 H new ATOM 0 HB2 PHE A 26 10.237 2.218 -2.003 1.00 0.00 H new ATOM 0 HB3 PHE A 26 11.149 1.539 -3.337 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.116 -0.099 -0.138 1.00 0.00 H new ATOM 0 HD2 PHE A 26 9.665 0.063 -4.372 1.00 0.00 H new ATOM 0 HE1 PHE A 26 8.721 -2.119 -0.064 1.00 0.00 H new ATOM 0 HE2 PHE A 26 8.270 -1.959 -4.300 1.00 0.00 H new ATOM 0 HZ PHE A 26 7.796 -3.054 -2.148 1.00 0.00 H new ATOM 410 N GLY A 27 13.829 1.737 -3.030 1.00 0.00 N ATOM 411 CA GLY A 27 14.972 1.410 -3.861 1.00 0.00 C ATOM 412 C GLY A 27 14.915 2.101 -5.210 1.00 0.00 C ATOM 413 O GLY A 27 13.845 2.201 -5.810 1.00 0.00 O ATOM 0 H GLY A 27 13.503 2.700 -3.110 1.00 0.00 H new ATOM 0 HA2 GLY A 27 15.888 1.698 -3.346 1.00 0.00 H new ATOM 0 HA3 GLY A 27 15.015 0.331 -4.009 1.00 0.00 H new ATOM 417 N PRO A 28 16.060 2.588 -5.720 1.00 0.00 N ATOM 418 CA PRO A 28 16.118 3.281 -7.011 1.00 0.00 C ATOM 419 C PRO A 28 15.614 2.417 -8.156 1.00 0.00 C ATOM 420 O PRO A 28 15.283 2.925 -9.227 1.00 0.00 O ATOM 421 CB PRO A 28 17.607 3.602 -7.193 1.00 0.00 C ATOM 422 CG PRO A 28 18.322 2.705 -6.241 1.00 0.00 C ATOM 423 CD PRO A 28 17.386 2.497 -5.087 1.00 0.00 C ATOM 0 HA PRO A 28 15.481 4.165 -7.020 1.00 0.00 H new ATOM 0 HB2 PRO A 28 17.926 3.420 -8.219 1.00 0.00 H new ATOM 0 HB3 PRO A 28 17.813 4.650 -6.976 1.00 0.00 H new ATOM 0 HG2 PRO A 28 18.575 1.756 -6.714 1.00 0.00 H new ATOM 0 HG3 PRO A 28 19.257 3.155 -5.909 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.541 1.529 -4.610 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.519 3.257 -4.317 1.00 0.00 H new ATOM 431 N ARG A 29 15.560 1.112 -7.931 1.00 0.00 N ATOM 432 CA ARG A 29 15.087 0.192 -8.951 1.00 0.00 C ATOM 433 C ARG A 29 13.649 -0.234 -8.686 1.00 0.00 C ATOM 434 O ARG A 29 12.872 -0.424 -9.622 1.00 0.00 O ATOM 435 CB ARG A 29 15.987 -1.045 -9.027 1.00 0.00 C ATOM 436 CG ARG A 29 15.464 -2.117 -9.972 1.00 0.00 C ATOM 437 CD ARG A 29 15.239 -1.567 -11.373 1.00 0.00 C ATOM 438 NE ARG A 29 14.369 -2.427 -12.171 1.00 0.00 N ATOM 439 CZ ARG A 29 14.561 -2.675 -13.464 1.00 0.00 C ATOM 440 NH1 ARG A 29 15.588 -2.129 -14.101 1.00 0.00 N ATOM 441 NH2 ARG A 29 13.724 -3.466 -14.121 1.00 0.00 N ATOM 0 H ARG A 29 15.837 0.669 -7.055 1.00 0.00 H new ATOM 0 HA ARG A 29 15.123 0.717 -9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 29 16.983 -0.741 -9.350 1.00 0.00 H new ATOM 0 HB3 ARG A 29 16.092 -1.471 -8.029 1.00 0.00 H new ATOM 0 HG2 ARG A 29 16.174 -2.943 -10.014 1.00 0.00 H new ATOM 0 HG3 ARG A 29 14.528 -2.520 -9.584 1.00 0.00 H new ATOM 0 HD2 ARG A 29 14.799 -0.572 -11.304 1.00 0.00 H new ATOM 0 HD3 ARG A 29 16.199 -1.457 -11.877 1.00 0.00 H new ATOM 0 HE ARG A 29 13.569 -2.862 -11.711 1.00 0.00 H new ATOM 0 HH11 ARG A 29 16.232 -1.518 -13.600 1.00 0.00 H new ATOM 0 HH12 ARG A 29 15.733 -2.320 -15.092 1.00 0.00 H new ATOM 0 HH21 ARG A 29 12.931 -3.886 -13.635 1.00 0.00 H new ATOM 0 HH22 ARG A 29 13.873 -3.655 -15.112 1.00 0.00 H new ATOM 455 N LEU A 30 13.290 -0.382 -7.413 1.00 0.00 N ATOM 456 CA LEU A 30 11.948 -0.804 -7.038 1.00 0.00 C ATOM 457 C LEU A 30 10.909 0.289 -7.261 1.00 0.00 C ATOM 458 O LEU A 30 9.741 -0.009 -7.483 1.00 0.00 O ATOM 459 CB LEU A 30 11.937 -1.220 -5.567 1.00 0.00 C ATOM 460 CG LEU A 30 12.806 -2.431 -5.223 1.00 0.00 C ATOM 461 CD1 LEU A 30 12.710 -2.744 -3.738 1.00 0.00 C ATOM 462 CD2 LEU A 30 12.397 -3.638 -6.055 1.00 0.00 C ATOM 0 H LEU A 30 13.914 -0.215 -6.624 1.00 0.00 H new ATOM 0 HA LEU A 30 11.681 -1.645 -7.677 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.268 -0.374 -4.965 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.909 -1.437 -5.276 1.00 0.00 H new ATOM 0 HG LEU A 30 13.843 -2.192 -5.459 1.00 0.00 H new ATOM 0 HD11 LEU A 30 13.333 -3.608 -3.507 1.00 0.00 H new ATOM 0 HD12 LEU A 30 13.053 -1.885 -3.162 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.674 -2.964 -3.479 1.00 0.00 H new ATOM 0 HD21 LEU A 30 13.027 -4.489 -5.796 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.354 -3.883 -5.852 1.00 0.00 H new ATOM 0 HD23 LEU A 30 12.516 -3.408 -7.114 1.00 0.00 H new ATOM 474 N MET A 31 11.331 1.547 -7.173 1.00 0.00 N ATOM 475 CA MET A 31 10.422 2.682 -7.359 1.00 0.00 C ATOM 476 C MET A 31 9.335 2.397 -8.395 1.00 0.00 C ATOM 477 O MET A 31 8.197 2.837 -8.240 1.00 0.00 O ATOM 478 CB MET A 31 11.210 3.931 -7.754 1.00 0.00 C ATOM 479 CG MET A 31 12.271 3.674 -8.812 1.00 0.00 C ATOM 480 SD MET A 31 12.080 4.739 -10.255 1.00 0.00 S ATOM 481 CE MET A 31 13.545 4.316 -11.193 1.00 0.00 C ATOM 0 H MET A 31 12.296 1.810 -6.974 1.00 0.00 H new ATOM 0 HA MET A 31 9.922 2.851 -6.405 1.00 0.00 H new ATOM 0 HB2 MET A 31 10.516 4.686 -8.124 1.00 0.00 H new ATOM 0 HB3 MET A 31 11.688 4.345 -6.866 1.00 0.00 H new ATOM 0 HG2 MET A 31 13.258 3.830 -8.377 1.00 0.00 H new ATOM 0 HG3 MET A 31 12.222 2.631 -9.125 1.00 0.00 H new ATOM 0 HE1 MET A 31 13.426 4.650 -12.224 1.00 0.00 H new ATOM 0 HE2 MET A 31 14.413 4.805 -10.751 1.00 0.00 H new ATOM 0 HE3 MET A 31 13.689 3.236 -11.176 1.00 0.00 H new ATOM 491 N MET A 32 9.685 1.663 -9.445 1.00 0.00 N ATOM 492 CA MET A 32 8.730 1.321 -10.493 1.00 0.00 C ATOM 493 C MET A 32 8.162 -0.077 -10.265 1.00 0.00 C ATOM 494 O MET A 32 6.985 -0.331 -10.523 1.00 0.00 O ATOM 495 CB MET A 32 9.398 1.397 -11.868 1.00 0.00 C ATOM 496 CG MET A 32 10.494 0.361 -12.070 1.00 0.00 C ATOM 497 SD MET A 32 11.285 0.487 -13.686 1.00 0.00 S ATOM 498 CE MET A 32 12.090 2.081 -13.549 1.00 0.00 C ATOM 0 H MET A 32 10.624 1.293 -9.593 1.00 0.00 H new ATOM 0 HA MET A 32 7.912 2.040 -10.458 1.00 0.00 H new ATOM 0 HB2 MET A 32 8.639 1.266 -12.639 1.00 0.00 H new ATOM 0 HB3 MET A 32 9.821 2.392 -12.003 1.00 0.00 H new ATOM 0 HG2 MET A 32 11.248 0.479 -11.291 1.00 0.00 H new ATOM 0 HG3 MET A 32 10.070 -0.637 -11.955 1.00 0.00 H new ATOM 0 HE1 MET A 32 11.672 2.764 -14.289 1.00 0.00 H new ATOM 0 HE2 MET A 32 11.929 2.485 -12.550 1.00 0.00 H new ATOM 0 HE3 MET A 32 13.159 1.965 -13.725 1.00 0.00 H new ATOM 508 N ARG A 33 9.010 -0.980 -9.781 1.00 0.00 N ATOM 509 CA ARG A 33 8.605 -2.355 -9.515 1.00 0.00 C ATOM 510 C ARG A 33 7.566 -2.424 -8.398 1.00 0.00 C ATOM 511 O ARG A 33 6.825 -3.401 -8.290 1.00 0.00 O ATOM 512 CB ARG A 33 9.820 -3.202 -9.131 1.00 0.00 C ATOM 513 CG ARG A 33 10.832 -3.367 -10.252 1.00 0.00 C ATOM 514 CD ARG A 33 11.986 -4.260 -9.827 1.00 0.00 C ATOM 515 NE ARG A 33 12.880 -4.571 -10.938 1.00 0.00 N ATOM 516 CZ ARG A 33 13.912 -5.403 -10.843 1.00 0.00 C ATOM 517 NH1 ARG A 33 14.181 -6.004 -9.691 1.00 0.00 N ATOM 518 NH2 ARG A 33 14.678 -5.636 -11.900 1.00 0.00 N ATOM 0 H ARG A 33 9.987 -0.782 -9.564 1.00 0.00 H new ATOM 0 HA ARG A 33 8.158 -2.748 -10.428 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.313 -2.745 -8.273 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.479 -4.188 -8.814 1.00 0.00 H new ATOM 0 HG2 ARG A 33 10.342 -3.794 -11.127 1.00 0.00 H new ATOM 0 HG3 ARG A 33 11.215 -2.390 -10.546 1.00 0.00 H new ATOM 0 HD2 ARG A 33 12.551 -3.769 -9.035 1.00 0.00 H new ATOM 0 HD3 ARG A 33 11.592 -5.187 -9.410 1.00 0.00 H new ATOM 0 HE ARG A 33 12.703 -4.125 -11.838 1.00 0.00 H new ATOM 0 HH11 ARG A 33 13.595 -5.828 -8.875 1.00 0.00 H new ATOM 0 HH12 ARG A 33 14.974 -6.642 -9.622 1.00 0.00 H new ATOM 0 HH21 ARG A 33 14.476 -5.176 -12.788 1.00 0.00 H new ATOM 0 HH22 ARG A 33 15.470 -6.275 -11.825 1.00 0.00 H new ATOM 532 N GLY A 34 7.517 -1.385 -7.568 1.00 0.00 N ATOM 533 CA GLY A 34 6.575 -1.366 -6.464 1.00 0.00 C ATOM 534 C GLY A 34 5.367 -0.493 -6.732 1.00 0.00 C ATOM 535 O GLY A 34 4.241 -0.872 -6.411 1.00 0.00 O ATOM 0 H GLY A 34 8.111 -0.559 -7.640 1.00 0.00 H new ATOM 0 HA2 GLY A 34 6.243 -2.384 -6.260 1.00 0.00 H new ATOM 0 HA3 GLY A 34 7.082 -1.010 -5.567 1.00 0.00 H new ATOM 539 N GLU A 35 5.594 0.676 -7.324 1.00 0.00 N ATOM 540 CA GLU A 35 4.502 1.593 -7.626 1.00 0.00 C ATOM 541 C GLU A 35 3.471 0.913 -8.515 1.00 0.00 C ATOM 542 O GLU A 35 2.266 1.093 -8.336 1.00 0.00 O ATOM 543 CB GLU A 35 5.029 2.860 -8.308 1.00 0.00 C ATOM 544 CG GLU A 35 5.602 2.616 -9.696 1.00 0.00 C ATOM 545 CD GLU A 35 6.006 3.900 -10.394 1.00 0.00 C ATOM 546 OE1 GLU A 35 5.149 4.501 -11.075 1.00 0.00 O ATOM 547 OE2 GLU A 35 7.180 4.305 -10.260 1.00 0.00 O ATOM 0 H GLU A 35 6.517 1.008 -7.602 1.00 0.00 H new ATOM 0 HA GLU A 35 4.027 1.878 -6.687 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.219 3.586 -8.382 1.00 0.00 H new ATOM 0 HB3 GLU A 35 5.800 3.306 -7.680 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.470 1.961 -9.617 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.863 2.094 -10.303 1.00 0.00 H new ATOM 554 N ALA A 36 3.953 0.131 -9.475 1.00 0.00 N ATOM 555 CA ALA A 36 3.070 -0.581 -10.393 1.00 0.00 C ATOM 556 C ALA A 36 2.432 -1.802 -9.730 1.00 0.00 C ATOM 557 O ALA A 36 1.373 -2.265 -10.155 1.00 0.00 O ATOM 558 CB ALA A 36 3.836 -1.000 -11.639 1.00 0.00 C ATOM 0 H ALA A 36 4.948 -0.026 -9.638 1.00 0.00 H new ATOM 0 HA ALA A 36 2.267 0.100 -10.676 1.00 0.00 H new ATOM 0 HB1 ALA A 36 3.167 -1.530 -12.316 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.231 -0.115 -12.138 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.660 -1.655 -11.356 1.00 0.00 H new ATOM 564 N LEU A 37 3.080 -2.325 -8.695 1.00 0.00 N ATOM 565 CA LEU A 37 2.572 -3.498 -7.989 1.00 0.00 C ATOM 566 C LEU A 37 1.397 -3.159 -7.075 1.00 0.00 C ATOM 567 O LEU A 37 0.473 -3.957 -6.926 1.00 0.00 O ATOM 568 CB LEU A 37 3.685 -4.147 -7.168 1.00 0.00 C ATOM 569 CG LEU A 37 3.937 -5.622 -7.485 1.00 0.00 C ATOM 570 CD1 LEU A 37 4.783 -5.759 -8.742 1.00 0.00 C ATOM 571 CD2 LEU A 37 4.607 -6.311 -6.308 1.00 0.00 C ATOM 0 H LEU A 37 3.957 -1.957 -8.326 1.00 0.00 H new ATOM 0 HA LEU A 37 2.216 -4.196 -8.747 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.609 -3.592 -7.331 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.439 -4.054 -6.110 1.00 0.00 H new ATOM 0 HG LEU A 37 2.978 -6.107 -7.664 1.00 0.00 H new ATOM 0 HD11 LEU A 37 4.953 -6.815 -8.953 1.00 0.00 H new ATOM 0 HD12 LEU A 37 4.263 -5.300 -9.583 1.00 0.00 H new ATOM 0 HD13 LEU A 37 5.741 -5.260 -8.592 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.779 -7.360 -6.550 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.560 -5.826 -6.097 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.963 -6.242 -5.431 1.00 0.00 H new ATOM 583 N VAL A 38 1.430 -1.978 -6.468 1.00 0.00 N ATOM 584 CA VAL A 38 0.361 -1.569 -5.562 1.00 0.00 C ATOM 585 C VAL A 38 -0.918 -1.272 -6.335 1.00 0.00 C ATOM 586 O VAL A 38 -2.013 -1.637 -5.909 1.00 0.00 O ATOM 587 CB VAL A 38 0.755 -0.336 -4.724 1.00 0.00 C ATOM 588 CG1 VAL A 38 2.148 -0.512 -4.145 1.00 0.00 C ATOM 589 CG2 VAL A 38 0.669 0.938 -5.548 1.00 0.00 C ATOM 0 H VAL A 38 2.176 -1.293 -6.584 1.00 0.00 H new ATOM 0 HA VAL A 38 0.188 -2.402 -4.880 1.00 0.00 H new ATOM 0 HB VAL A 38 0.047 -0.246 -3.900 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.411 0.367 -3.556 1.00 0.00 H new ATOM 0 HG12 VAL A 38 2.168 -1.395 -3.507 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.866 -0.634 -4.956 1.00 0.00 H new ATOM 0 HG21 VAL A 38 0.952 1.790 -4.931 1.00 0.00 H new ATOM 0 HG22 VAL A 38 1.345 0.866 -6.400 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -0.352 1.072 -5.905 1.00 0.00 H new ATOM 599 N TYR A 39 -0.768 -0.606 -7.474 1.00 0.00 N ATOM 600 CA TYR A 39 -1.908 -0.264 -8.313 1.00 0.00 C ATOM 601 C TYR A 39 -2.437 -1.502 -9.030 1.00 0.00 C ATOM 602 O TYR A 39 -3.613 -1.570 -9.387 1.00 0.00 O ATOM 603 CB TYR A 39 -1.512 0.822 -9.320 1.00 0.00 C ATOM 604 CG TYR A 39 -1.486 0.363 -10.762 1.00 0.00 C ATOM 605 CD1 TYR A 39 -0.335 -0.181 -11.314 1.00 0.00 C ATOM 606 CD2 TYR A 39 -2.611 0.475 -11.569 1.00 0.00 C ATOM 607 CE1 TYR A 39 -0.304 -0.601 -12.630 1.00 0.00 C ATOM 608 CE2 TYR A 39 -2.590 0.057 -12.886 1.00 0.00 C ATOM 609 CZ TYR A 39 -1.434 -0.481 -13.412 1.00 0.00 C ATOM 610 OH TYR A 39 -1.409 -0.898 -14.723 1.00 0.00 O ATOM 0 H TYR A 39 0.132 -0.293 -7.837 1.00 0.00 H new ATOM 0 HA TYR A 39 -2.706 0.125 -7.680 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.209 1.655 -9.230 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -0.525 1.202 -9.055 1.00 0.00 H new ATOM 0 HD1 TYR A 39 0.552 -0.278 -10.705 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -3.518 0.896 -11.160 1.00 0.00 H new ATOM 0 HE1 TYR A 39 0.601 -1.021 -13.044 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.474 0.151 -13.500 1.00 0.00 H new ATOM 0 HH TYR A 39 -0.773 -1.638 -14.819 1.00 0.00 H new ATOM 620 N ALA A 40 -1.558 -2.479 -9.238 1.00 0.00 N ATOM 621 CA ALA A 40 -1.935 -3.717 -9.908 1.00 0.00 C ATOM 622 C ALA A 40 -3.015 -4.450 -9.120 1.00 0.00 C ATOM 623 O ALA A 40 -3.960 -4.991 -9.696 1.00 0.00 O ATOM 624 CB ALA A 40 -0.717 -4.607 -10.098 1.00 0.00 C ATOM 0 H ALA A 40 -0.580 -2.436 -8.952 1.00 0.00 H new ATOM 0 HA ALA A 40 -2.340 -3.468 -10.889 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -1.014 -5.528 -10.600 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.023 -4.086 -10.705 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -0.286 -4.846 -9.126 1.00 0.00 H new ATOM 630 N TRP A 41 -2.866 -4.466 -7.799 1.00 0.00 N ATOM 631 CA TRP A 41 -3.832 -5.125 -6.928 1.00 0.00 C ATOM 632 C TRP A 41 -5.092 -4.278 -6.782 1.00 0.00 C ATOM 633 O TRP A 41 -6.193 -4.807 -6.644 1.00 0.00 O ATOM 634 CB TRP A 41 -3.218 -5.378 -5.547 1.00 0.00 C ATOM 635 CG TRP A 41 -2.201 -6.477 -5.534 1.00 0.00 C ATOM 636 CD1 TRP A 41 -0.845 -6.342 -5.615 1.00 0.00 C ATOM 637 CD2 TRP A 41 -2.459 -7.883 -5.428 1.00 0.00 C ATOM 638 NE1 TRP A 41 -0.243 -7.575 -5.566 1.00 0.00 N ATOM 639 CE2 TRP A 41 -1.213 -8.539 -5.453 1.00 0.00 C ATOM 640 CE3 TRP A 41 -3.622 -8.650 -5.315 1.00 0.00 C ATOM 641 CZ2 TRP A 41 -1.099 -9.924 -5.368 1.00 0.00 C ATOM 642 CZ3 TRP A 41 -3.508 -10.024 -5.232 1.00 0.00 C ATOM 643 CH2 TRP A 41 -2.254 -10.649 -5.257 1.00 0.00 C ATOM 0 H TRP A 41 -2.085 -4.030 -7.309 1.00 0.00 H new ATOM 0 HA TRP A 41 -4.101 -6.079 -7.381 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -2.752 -4.459 -5.192 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.014 -5.623 -4.844 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.322 -5.402 -5.705 1.00 0.00 H new ATOM 0 HE1 TRP A 41 0.762 -7.747 -5.607 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -4.593 -8.177 -5.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -0.134 -10.408 -5.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -4.400 -10.627 -5.146 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -2.198 -11.725 -5.187 1.00 0.00 H new ATOM 654 N MET A 42 -4.917 -2.960 -6.822 1.00 0.00 N ATOM 655 CA MET A 42 -6.032 -2.031 -6.683 1.00 0.00 C ATOM 656 C MET A 42 -7.067 -2.226 -7.789 1.00 0.00 C ATOM 657 O MET A 42 -8.257 -2.389 -7.515 1.00 0.00 O ATOM 658 CB MET A 42 -5.514 -0.595 -6.703 1.00 0.00 C ATOM 659 CG MET A 42 -6.433 0.388 -6.004 1.00 0.00 C ATOM 660 SD MET A 42 -6.758 -0.072 -4.292 1.00 0.00 S ATOM 661 CE MET A 42 -7.711 1.337 -3.743 1.00 0.00 C ATOM 0 H MET A 42 -4.010 -2.511 -6.950 1.00 0.00 H new ATOM 0 HA MET A 42 -6.520 -2.232 -5.729 1.00 0.00 H new ATOM 0 HB2 MET A 42 -4.533 -0.564 -6.229 1.00 0.00 H new ATOM 0 HB3 MET A 42 -5.378 -0.280 -7.738 1.00 0.00 H new ATOM 0 HG2 MET A 42 -5.986 1.382 -6.032 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.376 0.448 -6.547 1.00 0.00 H new ATOM 0 HE1 MET A 42 -7.616 1.442 -2.662 1.00 0.00 H new ATOM 0 HE2 MET A 42 -7.340 2.239 -4.229 1.00 0.00 H new ATOM 0 HE3 MET A 42 -8.759 1.190 -4.002 1.00 0.00 H new ATOM 671 N ARG A 43 -6.610 -2.208 -9.037 1.00 0.00 N ATOM 672 CA ARG A 43 -7.501 -2.374 -10.182 1.00 0.00 C ATOM 673 C ARG A 43 -8.183 -3.741 -10.166 1.00 0.00 C ATOM 674 O ARG A 43 -9.094 -3.998 -10.953 1.00 0.00 O ATOM 675 CB ARG A 43 -6.730 -2.187 -11.489 1.00 0.00 C ATOM 676 CG ARG A 43 -5.510 -3.085 -11.612 1.00 0.00 C ATOM 677 CD ARG A 43 -4.769 -2.838 -12.915 1.00 0.00 C ATOM 678 NE ARG A 43 -5.583 -3.170 -14.082 1.00 0.00 N ATOM 679 CZ ARG A 43 -5.174 -3.012 -15.337 1.00 0.00 C ATOM 680 NH1 ARG A 43 -3.965 -2.528 -15.588 1.00 0.00 N ATOM 681 NH2 ARG A 43 -5.974 -3.339 -16.343 1.00 0.00 N ATOM 0 H ARG A 43 -5.628 -2.080 -9.282 1.00 0.00 H new ATOM 0 HA ARG A 43 -8.275 -1.610 -10.112 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -7.400 -2.382 -12.327 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -6.414 -1.147 -11.569 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.840 -2.908 -10.771 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -5.818 -4.129 -11.559 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -4.470 -1.791 -12.968 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -3.855 -3.432 -12.930 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.519 -3.544 -13.925 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -3.346 -2.276 -14.817 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.654 -2.408 -16.552 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -6.904 -3.712 -16.154 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.659 -3.217 -17.305 1.00 0.00 H new ATOM 695 N ARG A 44 -7.740 -4.613 -9.266 1.00 0.00 N ATOM 696 CA ARG A 44 -8.315 -5.950 -9.147 1.00 0.00 C ATOM 697 C ARG A 44 -9.423 -5.976 -8.099 1.00 0.00 C ATOM 698 O ARG A 44 -10.407 -6.702 -8.236 1.00 0.00 O ATOM 699 CB ARG A 44 -7.228 -6.963 -8.782 1.00 0.00 C ATOM 700 CG ARG A 44 -6.219 -7.203 -9.894 1.00 0.00 C ATOM 701 CD ARG A 44 -5.195 -8.253 -9.499 1.00 0.00 C ATOM 702 NE ARG A 44 -4.244 -8.523 -10.573 1.00 0.00 N ATOM 703 CZ ARG A 44 -3.302 -9.458 -10.508 1.00 0.00 C ATOM 704 NH1 ARG A 44 -3.183 -10.209 -9.421 1.00 0.00 N ATOM 705 NH2 ARG A 44 -2.476 -9.643 -11.529 1.00 0.00 N ATOM 0 H ARG A 44 -6.985 -4.419 -8.608 1.00 0.00 H new ATOM 0 HA ARG A 44 -8.746 -6.220 -10.111 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -6.701 -6.613 -7.894 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -7.699 -7.910 -8.520 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.740 -7.523 -10.797 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.710 -6.269 -10.133 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.655 -7.918 -8.613 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.708 -9.176 -9.229 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.306 -7.962 -11.422 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.815 -10.069 -8.633 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.459 -10.926 -9.373 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -2.563 -9.067 -12.366 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.754 -10.361 -11.477 1.00 0.00 H new ATOM 719 N LEU A 45 -9.253 -5.174 -7.054 1.00 0.00 N ATOM 720 CA LEU A 45 -10.233 -5.098 -5.977 1.00 0.00 C ATOM 721 C LEU A 45 -11.536 -4.470 -6.461 1.00 0.00 C ATOM 722 O LEU A 45 -12.609 -4.784 -5.950 1.00 0.00 O ATOM 723 CB LEU A 45 -9.680 -4.294 -4.804 1.00 0.00 C ATOM 724 CG LEU A 45 -8.237 -4.621 -4.411 1.00 0.00 C ATOM 725 CD1 LEU A 45 -7.770 -3.701 -3.295 1.00 0.00 C ATOM 726 CD2 LEU A 45 -8.113 -6.079 -3.989 1.00 0.00 C ATOM 0 H LEU A 45 -8.444 -4.566 -6.930 1.00 0.00 H new ATOM 0 HA LEU A 45 -10.440 -6.116 -5.647 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.741 -3.234 -5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -10.321 -4.458 -3.938 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.599 -4.462 -5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.742 -3.946 -3.027 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.820 -2.666 -3.632 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.413 -3.830 -2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -7.080 -6.291 -3.714 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -8.763 -6.267 -3.134 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.408 -6.724 -4.817 1.00 0.00 H new ATOM 738 N CYS A 46 -11.442 -3.581 -7.444 1.00 0.00 N ATOM 739 CA CYS A 46 -12.623 -2.924 -7.995 1.00 0.00 C ATOM 740 C CYS A 46 -12.704 -3.144 -9.504 1.00 0.00 C ATOM 741 O CYS A 46 -11.711 -2.990 -10.216 1.00 0.00 O ATOM 742 CB CYS A 46 -12.600 -1.427 -7.685 1.00 0.00 C ATOM 743 SG CYS A 46 -13.968 -0.500 -8.416 1.00 0.00 S ATOM 0 H CYS A 46 -10.562 -3.299 -7.875 1.00 0.00 H new ATOM 0 HA CYS A 46 -13.505 -3.364 -7.529 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -12.620 -1.291 -6.604 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -11.659 -1.008 -8.042 1.00 0.00 H new ATOM 0 HG CYS A 46 -14.928 -0.385 -7.547 1.00 0.00 H new ATOM 749 N GLU A 47 -13.890 -3.502 -9.983 1.00 0.00 N ATOM 750 CA GLU A 47 -14.101 -3.748 -11.406 1.00 0.00 C ATOM 751 C GLU A 47 -14.171 -2.435 -12.176 1.00 0.00 C ATOM 752 O GLU A 47 -13.875 -2.385 -13.370 1.00 0.00 O ATOM 753 CB GLU A 47 -15.387 -4.546 -11.620 1.00 0.00 C ATOM 754 CG GLU A 47 -16.631 -3.837 -11.113 1.00 0.00 C ATOM 755 CD GLU A 47 -17.894 -4.648 -11.328 1.00 0.00 C ATOM 756 OE1 GLU A 47 -18.512 -4.514 -12.404 1.00 0.00 O ATOM 757 OE2 GLU A 47 -18.265 -5.419 -10.417 1.00 0.00 O ATOM 0 H GLU A 47 -14.722 -3.629 -9.406 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.256 -4.326 -11.781 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -15.504 -4.753 -12.684 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -15.296 -5.508 -11.116 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.516 -3.626 -10.050 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.729 -2.877 -11.620 1.00 0.00 H new ATOM 764 N ARG A 48 -14.563 -1.375 -11.480 1.00 0.00 N ATOM 765 CA ARG A 48 -14.669 -0.055 -12.085 1.00 0.00 C ATOM 766 C ARG A 48 -13.618 0.875 -11.493 1.00 0.00 C ATOM 767 O ARG A 48 -13.918 1.994 -11.077 1.00 0.00 O ATOM 768 CB ARG A 48 -16.072 0.519 -11.867 1.00 0.00 C ATOM 769 CG ARG A 48 -16.489 0.572 -10.406 1.00 0.00 C ATOM 770 CD ARG A 48 -17.919 1.063 -10.251 1.00 0.00 C ATOM 771 NE ARG A 48 -18.108 2.390 -10.830 1.00 0.00 N ATOM 772 CZ ARG A 48 -19.273 3.031 -10.842 1.00 0.00 C ATOM 773 NH1 ARG A 48 -20.348 2.467 -10.306 1.00 0.00 N ATOM 774 NH2 ARG A 48 -19.364 4.235 -11.388 1.00 0.00 N ATOM 0 H ARG A 48 -14.814 -1.405 -10.492 1.00 0.00 H new ATOM 0 HA ARG A 48 -14.495 -0.144 -13.157 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -16.112 1.525 -12.284 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -16.792 -0.084 -12.420 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -16.394 -0.420 -9.963 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -15.816 1.231 -9.858 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -18.598 0.358 -10.731 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -18.181 1.088 -9.193 1.00 0.00 H new ATOM 0 HE ARG A 48 -17.301 2.851 -11.249 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -20.281 1.541 -9.884 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -21.241 2.960 -10.316 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -18.539 4.672 -11.800 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -20.259 4.725 -11.396 1.00 0.00 H new ATOM 788 N TYR A 49 -12.377 0.399 -11.471 1.00 0.00 N ATOM 789 CA TYR A 49 -11.270 1.166 -10.920 1.00 0.00 C ATOM 790 C TYR A 49 -10.281 1.571 -12.008 1.00 0.00 C ATOM 791 O TYR A 49 -9.384 0.805 -12.359 1.00 0.00 O ATOM 792 CB TYR A 49 -10.549 0.339 -9.857 1.00 0.00 C ATOM 793 CG TYR A 49 -9.876 1.172 -8.798 1.00 0.00 C ATOM 794 CD1 TYR A 49 -8.731 1.904 -9.083 1.00 0.00 C ATOM 795 CD2 TYR A 49 -10.390 1.228 -7.512 1.00 0.00 C ATOM 796 CE1 TYR A 49 -8.117 2.670 -8.112 1.00 0.00 C ATOM 797 CE2 TYR A 49 -9.785 1.991 -6.536 1.00 0.00 C ATOM 798 CZ TYR A 49 -8.648 2.712 -6.839 1.00 0.00 C ATOM 799 OH TYR A 49 -8.041 3.476 -5.869 1.00 0.00 O ATOM 0 H TYR A 49 -12.114 -0.519 -11.831 1.00 0.00 H new ATOM 0 HA TYR A 49 -11.676 2.073 -10.472 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -11.266 -0.329 -9.380 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -9.802 -0.289 -10.342 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -8.314 1.874 -10.079 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -11.279 0.665 -7.271 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -7.226 3.233 -8.348 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -10.199 2.024 -5.539 1.00 0.00 H new ATOM 0 HH TYR A 49 -7.600 4.245 -6.287 1.00 0.00 H new ATOM 809 N ASN A 50 -10.454 2.775 -12.545 1.00 0.00 N ATOM 810 CA ASN A 50 -9.567 3.277 -13.587 1.00 0.00 C ATOM 811 C ASN A 50 -8.173 3.555 -13.030 1.00 0.00 C ATOM 812 O ASN A 50 -7.185 2.985 -13.495 1.00 0.00 O ATOM 813 CB ASN A 50 -10.145 4.552 -14.208 1.00 0.00 C ATOM 814 CG ASN A 50 -11.381 4.288 -15.049 1.00 0.00 C ATOM 815 OD1 ASN A 50 -12.154 3.274 -14.675 1.00 0.00 O flip ATOM 816 ND2 ASN A 50 -11.639 4.991 -16.026 1.00 0.00 N flip ATOM 0 H ASN A 50 -11.198 3.419 -12.276 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.484 2.511 -14.358 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -10.395 5.256 -13.415 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -9.384 5.026 -14.828 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.019 5.760 -16.279 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.473 4.804 -16.583 1.00 0.00 H new ATOM 823 N GLY A 51 -8.102 4.433 -12.033 1.00 0.00 N ATOM 824 CA GLY A 51 -6.824 4.769 -11.431 1.00 0.00 C ATOM 825 C GLY A 51 -6.904 5.996 -10.543 1.00 0.00 C ATOM 826 O GLY A 51 -7.991 6.520 -10.297 1.00 0.00 O ATOM 0 H GLY A 51 -8.905 4.917 -11.632 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.469 3.922 -10.844 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.090 4.941 -12.218 1.00 0.00 H new ATOM 830 N ALA A 52 -5.749 6.457 -10.068 1.00 0.00 N ATOM 831 CA ALA A 52 -5.686 7.631 -9.201 1.00 0.00 C ATOM 832 C ALA A 52 -4.242 7.978 -8.850 1.00 0.00 C ATOM 833 O ALA A 52 -3.308 7.303 -9.281 1.00 0.00 O ATOM 834 CB ALA A 52 -6.495 7.399 -7.934 1.00 0.00 C ATOM 0 H ALA A 52 -4.843 6.035 -10.269 1.00 0.00 H new ATOM 0 HA ALA A 52 -6.115 8.473 -9.744 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -6.438 8.283 -7.299 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.535 7.208 -8.197 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -6.092 6.540 -7.397 1.00 0.00 H new ATOM 840 N TYR A 53 -4.069 9.037 -8.063 1.00 0.00 N ATOM 841 CA TYR A 53 -2.741 9.474 -7.651 1.00 0.00 C ATOM 842 C TYR A 53 -2.363 8.875 -6.302 1.00 0.00 C ATOM 843 O TYR A 53 -2.790 9.357 -5.253 1.00 0.00 O ATOM 844 CB TYR A 53 -2.683 11.000 -7.581 1.00 0.00 C ATOM 845 CG TYR A 53 -2.442 11.655 -8.922 1.00 0.00 C ATOM 846 CD1 TYR A 53 -1.276 11.408 -9.633 1.00 0.00 C ATOM 847 CD2 TYR A 53 -3.378 12.519 -9.475 1.00 0.00 C ATOM 848 CE1 TYR A 53 -1.047 12.001 -10.859 1.00 0.00 C ATOM 849 CE2 TYR A 53 -3.159 13.116 -10.702 1.00 0.00 C ATOM 850 CZ TYR A 53 -1.992 12.855 -11.389 1.00 0.00 C ATOM 851 OH TYR A 53 -1.769 13.448 -12.611 1.00 0.00 O ATOM 0 H TYR A 53 -4.832 9.607 -7.699 1.00 0.00 H new ATOM 0 HA TYR A 53 -2.025 9.124 -8.394 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.619 11.373 -7.166 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -1.890 11.295 -6.894 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.534 10.740 -9.220 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -4.291 12.728 -8.938 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -0.134 11.798 -11.399 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -3.898 13.783 -11.121 1.00 0.00 H new ATOM 0 HH TYR A 53 -2.531 14.019 -12.841 1.00 0.00 H new ATOM 861 N TRP A 54 -1.561 7.817 -6.341 1.00 0.00 N ATOM 862 CA TRP A 54 -1.119 7.141 -5.126 1.00 0.00 C ATOM 863 C TRP A 54 -0.050 7.958 -4.405 1.00 0.00 C ATOM 864 O TRP A 54 1.144 7.679 -4.519 1.00 0.00 O ATOM 865 CB TRP A 54 -0.583 5.747 -5.465 1.00 0.00 C ATOM 866 CG TRP A 54 -1.161 5.188 -6.729 1.00 0.00 C ATOM 867 CD1 TRP A 54 -2.463 4.842 -6.955 1.00 0.00 C ATOM 868 CD2 TRP A 54 -0.457 4.919 -7.946 1.00 0.00 C ATOM 869 NE1 TRP A 54 -2.611 4.377 -8.239 1.00 0.00 N ATOM 870 CE2 TRP A 54 -1.393 4.411 -8.867 1.00 0.00 C ATOM 871 CE3 TRP A 54 0.875 5.056 -8.347 1.00 0.00 C ATOM 872 CZ2 TRP A 54 -1.039 4.043 -10.163 1.00 0.00 C ATOM 873 CZ3 TRP A 54 1.225 4.690 -9.632 1.00 0.00 C ATOM 874 CH2 TRP A 54 0.272 4.189 -10.528 1.00 0.00 C ATOM 0 H TRP A 54 -1.202 7.407 -7.204 1.00 0.00 H new ATOM 0 HA TRP A 54 -1.975 7.040 -4.459 1.00 0.00 H new ATOM 0 HB2 TRP A 54 0.502 5.794 -5.558 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.803 5.069 -4.641 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -3.260 4.922 -6.230 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -3.485 4.058 -8.657 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.618 5.441 -7.664 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -1.773 3.656 -10.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 2.252 4.792 -9.952 1.00 0.00 H new ATOM 0 HH2 TRP A 54 0.578 3.913 -11.526 1.00 0.00 H new ATOM 885 N HIS A 55 -0.496 8.978 -3.677 1.00 0.00 N ATOM 886 CA HIS A 55 0.401 9.850 -2.931 1.00 0.00 C ATOM 887 C HIS A 55 1.376 9.040 -2.091 1.00 0.00 C ATOM 888 O HIS A 55 1.031 7.980 -1.568 1.00 0.00 O ATOM 889 CB HIS A 55 -0.398 10.794 -2.032 1.00 0.00 C ATOM 890 CG HIS A 55 -1.360 11.663 -2.779 1.00 0.00 C ATOM 891 ND1 HIS A 55 -1.002 12.869 -3.346 1.00 0.00 N ATOM 892 CD2 HIS A 55 -2.676 11.499 -3.052 1.00 0.00 C ATOM 893 CE1 HIS A 55 -2.056 13.408 -3.933 1.00 0.00 C ATOM 894 NE2 HIS A 55 -3.083 12.596 -3.770 1.00 0.00 N ATOM 0 H HIS A 55 -1.483 9.221 -3.589 1.00 0.00 H new ATOM 0 HA HIS A 55 0.970 10.439 -3.650 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.948 10.205 -1.299 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.295 11.427 -1.477 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -0.069 13.280 -3.317 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.291 10.661 -2.759 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.074 14.352 -4.457 1.00 0.00 H new ATOM 903 N TYR A 56 2.592 9.549 -1.964 1.00 0.00 N ATOM 904 CA TYR A 56 3.621 8.875 -1.186 1.00 0.00 C ATOM 905 C TYR A 56 3.561 9.322 0.270 1.00 0.00 C ATOM 906 O TYR A 56 3.554 10.517 0.564 1.00 0.00 O ATOM 907 CB TYR A 56 5.009 9.154 -1.772 1.00 0.00 C ATOM 908 CG TYR A 56 5.192 8.663 -3.198 1.00 0.00 C ATOM 909 CD1 TYR A 56 4.213 7.910 -3.840 1.00 0.00 C ATOM 910 CD2 TYR A 56 6.353 8.958 -3.903 1.00 0.00 C ATOM 911 CE1 TYR A 56 4.386 7.470 -5.139 1.00 0.00 C ATOM 912 CE2 TYR A 56 6.533 8.519 -5.202 1.00 0.00 C ATOM 913 CZ TYR A 56 5.547 7.776 -5.814 1.00 0.00 C ATOM 914 OH TYR A 56 5.723 7.340 -7.107 1.00 0.00 O ATOM 0 H TYR A 56 2.891 10.427 -2.390 1.00 0.00 H new ATOM 0 HA TYR A 56 3.438 7.801 -1.230 1.00 0.00 H new ATOM 0 HB2 TYR A 56 5.195 10.228 -1.742 1.00 0.00 H new ATOM 0 HB3 TYR A 56 5.760 8.683 -1.138 1.00 0.00 H new ATOM 0 HD1 TYR A 56 3.302 7.665 -3.314 1.00 0.00 H new ATOM 0 HD2 TYR A 56 7.128 9.540 -3.428 1.00 0.00 H new ATOM 0 HE1 TYR A 56 3.614 6.889 -5.622 1.00 0.00 H new ATOM 0 HE2 TYR A 56 7.442 8.757 -5.734 1.00 0.00 H new ATOM 0 HH TYR A 56 6.594 7.642 -7.438 1.00 0.00 H new ATOM 924 N TYR A 57 3.518 8.354 1.175 1.00 0.00 N ATOM 925 CA TYR A 57 3.446 8.646 2.601 1.00 0.00 C ATOM 926 C TYR A 57 4.664 8.109 3.340 1.00 0.00 C ATOM 927 O TYR A 57 5.164 7.028 3.032 1.00 0.00 O ATOM 928 CB TYR A 57 2.170 8.057 3.201 1.00 0.00 C ATOM 929 CG TYR A 57 0.936 8.885 2.927 1.00 0.00 C ATOM 930 CD1 TYR A 57 0.558 9.903 3.791 1.00 0.00 C ATOM 931 CD2 TYR A 57 0.152 8.651 1.804 1.00 0.00 C ATOM 932 CE1 TYR A 57 -0.566 10.666 3.547 1.00 0.00 C ATOM 933 CE2 TYR A 57 -0.976 9.410 1.553 1.00 0.00 C ATOM 934 CZ TYR A 57 -1.330 10.416 2.426 1.00 0.00 C ATOM 935 OH TYR A 57 -2.453 11.174 2.180 1.00 0.00 O ATOM 0 H TYR A 57 3.532 7.360 0.948 1.00 0.00 H new ATOM 0 HA TYR A 57 3.429 9.730 2.717 1.00 0.00 H new ATOM 0 HB2 TYR A 57 2.020 7.054 2.802 1.00 0.00 H new ATOM 0 HB3 TYR A 57 2.298 7.956 4.279 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.154 10.102 4.670 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.428 7.865 1.117 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -0.846 11.454 4.230 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -1.577 9.215 0.677 1.00 0.00 H new ATOM 0 HH TYR A 57 -2.877 10.871 1.350 1.00 0.00 H new ATOM 945 N ALA A 58 5.134 8.876 4.317 1.00 0.00 N ATOM 946 CA ALA A 58 6.290 8.485 5.112 1.00 0.00 C ATOM 947 C ALA A 58 5.849 7.951 6.469 1.00 0.00 C ATOM 948 O ALA A 58 5.037 8.570 7.154 1.00 0.00 O ATOM 949 CB ALA A 58 7.237 9.663 5.286 1.00 0.00 C ATOM 0 H ALA A 58 4.730 9.776 4.578 1.00 0.00 H new ATOM 0 HA ALA A 58 6.819 7.691 4.585 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.096 9.355 5.882 1.00 0.00 H new ATOM 0 HB2 ALA A 58 7.578 10.003 4.308 1.00 0.00 H new ATOM 0 HB3 ALA A 58 6.717 10.476 5.792 1.00 0.00 H new ATOM 955 N LEU A 59 6.390 6.801 6.854 1.00 0.00 N ATOM 956 CA LEU A 59 6.041 6.186 8.124 1.00 0.00 C ATOM 957 C LEU A 59 7.210 6.241 9.098 1.00 0.00 C ATOM 958 O LEU A 59 8.366 6.076 8.709 1.00 0.00 O ATOM 959 CB LEU A 59 5.600 4.741 7.897 1.00 0.00 C ATOM 960 CG LEU A 59 4.139 4.572 7.477 1.00 0.00 C ATOM 961 CD1 LEU A 59 3.917 3.202 6.859 1.00 0.00 C ATOM 962 CD2 LEU A 59 3.216 4.783 8.666 1.00 0.00 C ATOM 0 H LEU A 59 7.071 6.278 6.304 1.00 0.00 H new ATOM 0 HA LEU A 59 5.215 6.745 8.563 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.237 4.298 7.131 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.767 4.177 8.815 1.00 0.00 H new ATOM 0 HG LEU A 59 3.906 5.326 6.725 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.872 3.100 6.566 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.552 3.092 5.980 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.167 2.430 7.586 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.180 4.659 8.349 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.448 4.053 9.441 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.356 5.789 9.062 1.00 0.00 H new ATOM 974 N SER A 60 6.896 6.476 10.367 1.00 0.00 N ATOM 975 CA SER A 60 7.915 6.564 11.406 1.00 0.00 C ATOM 976 C SER A 60 8.389 5.176 11.820 1.00 0.00 C ATOM 977 O SER A 60 9.401 5.034 12.506 1.00 0.00 O ATOM 978 CB SER A 60 7.368 7.312 12.623 1.00 0.00 C ATOM 979 OG SER A 60 6.998 8.638 12.283 1.00 0.00 O ATOM 0 H SER A 60 5.942 6.609 10.701 1.00 0.00 H new ATOM 0 HA SER A 60 8.765 7.114 11.002 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.504 6.781 13.022 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.121 7.332 13.410 1.00 0.00 H new ATOM 0 HG SER A 60 6.650 9.094 13.077 1.00 0.00 H new ATOM 985 N ASP A 61 7.651 4.156 11.396 1.00 0.00 N ATOM 986 CA ASP A 61 7.997 2.780 11.722 1.00 0.00 C ATOM 987 C ASP A 61 9.269 2.355 10.997 1.00 0.00 C ATOM 988 O ASP A 61 9.944 1.412 11.410 1.00 0.00 O ATOM 989 CB ASP A 61 6.844 1.841 11.359 1.00 0.00 C ATOM 990 CG ASP A 61 6.291 2.110 9.974 1.00 0.00 C ATOM 991 OD1 ASP A 61 7.051 1.978 8.994 1.00 0.00 O ATOM 992 OD2 ASP A 61 5.093 2.449 9.870 1.00 0.00 O ATOM 0 H ASP A 61 6.811 4.257 10.827 1.00 0.00 H new ATOM 0 HA ASP A 61 8.176 2.719 12.795 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.189 0.809 11.415 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.046 1.950 12.093 1.00 0.00 H new ATOM 997 N GLY A 62 9.593 3.057 9.913 1.00 0.00 N ATOM 998 CA GLY A 62 10.788 2.735 9.155 1.00 0.00 C ATOM 999 C GLY A 62 10.477 2.365 7.720 1.00 0.00 C ATOM 1000 O GLY A 62 11.368 1.988 6.959 1.00 0.00 O ATOM 0 H GLY A 62 9.051 3.840 9.548 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.465 3.589 9.169 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.309 1.907 9.636 1.00 0.00 H new ATOM 1004 N GLY A 63 9.206 2.473 7.353 1.00 0.00 N ATOM 1005 CA GLY A 63 8.790 2.147 6.003 1.00 0.00 C ATOM 1006 C GLY A 63 8.011 3.274 5.358 1.00 0.00 C ATOM 1007 O GLY A 63 8.312 4.448 5.579 1.00 0.00 O ATOM 0 H GLY A 63 8.454 2.782 7.969 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.668 1.922 5.398 1.00 0.00 H new ATOM 0 HA3 GLY A 63 8.176 1.247 6.021 1.00 0.00 H new ATOM 1011 N PHE A 64 7.005 2.919 4.565 1.00 0.00 N ATOM 1012 CA PHE A 64 6.181 3.910 3.885 1.00 0.00 C ATOM 1013 C PHE A 64 5.064 3.235 3.098 1.00 0.00 C ATOM 1014 O PHE A 64 5.170 2.064 2.733 1.00 0.00 O ATOM 1015 CB PHE A 64 7.040 4.755 2.939 1.00 0.00 C ATOM 1016 CG PHE A 64 7.477 4.017 1.708 1.00 0.00 C ATOM 1017 CD1 PHE A 64 8.552 3.146 1.750 1.00 0.00 C ATOM 1018 CD2 PHE A 64 6.806 4.192 0.508 1.00 0.00 C ATOM 1019 CE1 PHE A 64 8.952 2.463 0.618 1.00 0.00 C ATOM 1020 CE2 PHE A 64 7.201 3.512 -0.627 1.00 0.00 C ATOM 1021 CZ PHE A 64 8.275 2.647 -0.572 1.00 0.00 C ATOM 0 H PHE A 64 6.741 1.952 4.378 1.00 0.00 H new ATOM 0 HA PHE A 64 5.736 4.557 4.641 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.477 5.640 2.642 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.922 5.104 3.476 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.084 2.999 2.678 1.00 0.00 H new ATOM 0 HD2 PHE A 64 5.965 4.868 0.460 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.793 1.786 0.663 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.670 3.657 -1.556 1.00 0.00 H new ATOM 0 HZ PHE A 64 8.586 2.114 -1.459 1.00 0.00 H new ATOM 1031 N TYR A 65 3.994 3.978 2.839 1.00 0.00 N ATOM 1032 CA TYR A 65 2.865 3.444 2.084 1.00 0.00 C ATOM 1033 C TYR A 65 2.320 4.477 1.096 1.00 0.00 C ATOM 1034 O TYR A 65 2.531 5.679 1.259 1.00 0.00 O ATOM 1035 CB TYR A 65 1.758 2.978 3.038 1.00 0.00 C ATOM 1036 CG TYR A 65 0.681 4.011 3.295 1.00 0.00 C ATOM 1037 CD1 TYR A 65 0.823 4.963 4.298 1.00 0.00 C ATOM 1038 CD2 TYR A 65 -0.479 4.029 2.532 1.00 0.00 C ATOM 1039 CE1 TYR A 65 -0.162 5.903 4.531 1.00 0.00 C ATOM 1040 CE2 TYR A 65 -1.467 4.967 2.759 1.00 0.00 C ATOM 1041 CZ TYR A 65 -1.304 5.902 3.759 1.00 0.00 C ATOM 1042 OH TYR A 65 -2.287 6.837 3.989 1.00 0.00 O ATOM 0 H TYR A 65 3.884 4.947 3.138 1.00 0.00 H new ATOM 0 HA TYR A 65 3.219 2.587 1.511 1.00 0.00 H new ATOM 0 HB2 TYR A 65 1.294 2.081 2.627 1.00 0.00 H new ATOM 0 HB3 TYR A 65 2.209 2.696 3.989 1.00 0.00 H new ATOM 0 HD1 TYR A 65 1.717 4.968 4.904 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -0.611 3.298 1.748 1.00 0.00 H new ATOM 0 HE1 TYR A 65 -0.038 6.636 5.315 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -2.363 4.968 2.156 1.00 0.00 H new ATOM 0 HH TYR A 65 -3.162 6.452 3.772 1.00 0.00 H new ATOM 1052 N MET A 66 1.621 3.994 0.072 1.00 0.00 N ATOM 1053 CA MET A 66 1.035 4.864 -0.946 1.00 0.00 C ATOM 1054 C MET A 66 -0.484 4.727 -0.955 1.00 0.00 C ATOM 1055 O MET A 66 -1.019 3.631 -0.790 1.00 0.00 O ATOM 1056 CB MET A 66 1.597 4.523 -2.329 1.00 0.00 C ATOM 1057 CG MET A 66 3.101 4.294 -2.337 1.00 0.00 C ATOM 1058 SD MET A 66 3.824 4.434 -3.984 1.00 0.00 S ATOM 1059 CE MET A 66 2.779 3.323 -4.923 1.00 0.00 C ATOM 0 H MET A 66 1.446 3.000 -0.076 1.00 0.00 H new ATOM 0 HA MET A 66 1.294 5.895 -0.705 1.00 0.00 H new ATOM 0 HB2 MET A 66 1.100 3.628 -2.703 1.00 0.00 H new ATOM 0 HB3 MET A 66 1.358 5.332 -3.019 1.00 0.00 H new ATOM 0 HG2 MET A 66 3.577 5.017 -1.674 1.00 0.00 H new ATOM 0 HG3 MET A 66 3.315 3.304 -1.935 1.00 0.00 H new ATOM 0 HE1 MET A 66 3.049 3.373 -5.978 1.00 0.00 H new ATOM 0 HE2 MET A 66 2.915 2.304 -4.562 1.00 0.00 H new ATOM 0 HE3 MET A 66 1.736 3.615 -4.802 1.00 0.00 H new ATOM 1069 N ALA A 67 -1.172 5.846 -1.151 1.00 0.00 N ATOM 1070 CA ALA A 67 -2.630 5.851 -1.179 1.00 0.00 C ATOM 1071 C ALA A 67 -3.155 6.651 -2.367 1.00 0.00 C ATOM 1072 O ALA A 67 -2.780 7.808 -2.559 1.00 0.00 O ATOM 1073 CB ALA A 67 -3.180 6.416 0.122 1.00 0.00 C ATOM 0 H ALA A 67 -0.744 6.761 -1.293 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.969 4.821 -1.289 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.269 6.414 0.088 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.842 5.802 0.957 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -2.823 7.437 0.255 1.00 0.00 H new ATOM 1079 N PRO A 68 -4.035 6.042 -3.184 1.00 0.00 N ATOM 1080 CA PRO A 68 -4.610 6.707 -4.357 1.00 0.00 C ATOM 1081 C PRO A 68 -5.375 7.970 -3.979 1.00 0.00 C ATOM 1082 O PRO A 68 -5.740 8.160 -2.819 1.00 0.00 O ATOM 1083 CB PRO A 68 -5.564 5.658 -4.944 1.00 0.00 C ATOM 1084 CG PRO A 68 -5.109 4.356 -4.379 1.00 0.00 C ATOM 1085 CD PRO A 68 -4.539 4.668 -3.027 1.00 0.00 C ATOM 0 HA PRO A 68 -3.841 7.032 -5.057 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -6.597 5.867 -4.668 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -5.520 5.651 -6.033 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.939 3.654 -4.300 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -4.360 3.893 -5.021 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.297 4.604 -2.246 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -3.742 3.975 -2.756 1.00 0.00 H new ATOM 1093 N ASP A 69 -5.610 8.835 -4.961 1.00 0.00 N ATOM 1094 CA ASP A 69 -6.330 10.081 -4.723 1.00 0.00 C ATOM 1095 C ASP A 69 -7.771 9.991 -5.217 1.00 0.00 C ATOM 1096 O ASP A 69 -8.063 10.312 -6.369 1.00 0.00 O ATOM 1097 CB ASP A 69 -5.614 11.245 -5.410 1.00 0.00 C ATOM 1098 CG ASP A 69 -6.301 12.574 -5.163 1.00 0.00 C ATOM 1099 OD1 ASP A 69 -5.994 13.219 -4.138 1.00 0.00 O ATOM 1100 OD2 ASP A 69 -7.145 12.970 -5.994 1.00 0.00 O ATOM 0 H ASP A 69 -5.313 8.696 -5.927 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.350 10.256 -3.647 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.586 11.298 -5.051 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -5.568 11.057 -6.483 1.00 0.00 H new ATOM 1105 N LEU A 70 -8.665 9.543 -4.340 1.00 0.00 N ATOM 1106 CA LEU A 70 -10.077 9.416 -4.686 1.00 0.00 C ATOM 1107 C LEU A 70 -10.965 9.801 -3.507 1.00 0.00 C ATOM 1108 O LEU A 70 -10.980 9.125 -2.479 1.00 0.00 O ATOM 1109 CB LEU A 70 -10.390 7.987 -5.138 1.00 0.00 C ATOM 1110 CG LEU A 70 -9.674 7.538 -6.415 1.00 0.00 C ATOM 1111 CD1 LEU A 70 -9.933 6.063 -6.682 1.00 0.00 C ATOM 1112 CD2 LEU A 70 -10.120 8.382 -7.600 1.00 0.00 C ATOM 0 H LEU A 70 -8.437 9.262 -3.386 1.00 0.00 H new ATOM 0 HA LEU A 70 -10.285 10.100 -5.509 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -10.127 7.302 -4.332 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -11.465 7.899 -5.293 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.602 7.678 -6.276 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.416 5.762 -7.593 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.565 5.471 -5.844 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -11.004 5.897 -6.800 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.601 8.050 -8.499 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -11.195 8.273 -7.740 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.883 9.429 -7.411 1.00 0.00 H new ATOM 1124 N ALA A 71 -11.706 10.894 -3.666 1.00 0.00 N ATOM 1125 CA ALA A 71 -12.594 11.377 -2.615 1.00 0.00 C ATOM 1126 C ALA A 71 -14.014 10.848 -2.799 1.00 0.00 C ATOM 1127 O ALA A 71 -14.695 11.193 -3.764 1.00 0.00 O ATOM 1128 CB ALA A 71 -12.597 12.898 -2.589 1.00 0.00 C ATOM 0 H ALA A 71 -11.709 11.462 -4.513 1.00 0.00 H new ATOM 0 HA ALA A 71 -12.220 11.004 -1.661 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -13.264 13.247 -1.800 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -11.587 13.261 -2.398 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -12.943 13.278 -3.551 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.452 10.009 -1.864 1.00 0.00 N ATOM 1135 CA GLY A 72 -15.790 9.450 -1.938 1.00 0.00 C ATOM 1136 C GLY A 72 -15.841 7.999 -1.498 1.00 0.00 C ATOM 1137 O GLY A 72 -14.949 7.523 -0.796 1.00 0.00 O ATOM 0 H GLY A 72 -13.905 9.707 -1.058 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.461 10.039 -1.313 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.157 9.529 -2.961 1.00 0.00 H new ATOM 1141 N ARG A 73 -16.891 7.296 -1.915 1.00 0.00 N ATOM 1142 CA ARG A 73 -17.062 5.892 -1.565 1.00 0.00 C ATOM 1143 C ARG A 73 -16.564 4.997 -2.692 1.00 0.00 C ATOM 1144 O ARG A 73 -17.242 4.818 -3.704 1.00 0.00 O ATOM 1145 CB ARG A 73 -18.534 5.591 -1.270 1.00 0.00 C ATOM 1146 CG ARG A 73 -19.110 6.425 -0.137 1.00 0.00 C ATOM 1147 CD ARG A 73 -20.560 6.061 0.138 1.00 0.00 C ATOM 1148 NE ARG A 73 -21.141 6.888 1.193 1.00 0.00 N ATOM 1149 CZ ARG A 73 -22.400 6.777 1.607 1.00 0.00 C ATOM 1150 NH1 ARG A 73 -23.204 5.874 1.063 1.00 0.00 N ATOM 1151 NH2 ARG A 73 -22.855 7.568 2.569 1.00 0.00 N ATOM 0 H ARG A 73 -17.637 7.678 -2.497 1.00 0.00 H new ATOM 0 HA ARG A 73 -16.474 5.688 -0.670 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -19.120 5.765 -2.173 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -18.638 4.535 -1.022 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -18.518 6.274 0.766 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -19.041 7.483 -0.390 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -21.143 6.177 -0.776 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -20.622 5.011 0.425 1.00 0.00 H new ATOM 0 HE ARG A 73 -20.548 7.589 1.637 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -22.858 5.262 0.325 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -24.169 5.792 1.383 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -22.239 8.262 2.992 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -23.821 7.482 2.886 1.00 0.00 H new ATOM 1165 N LEU A 74 -15.374 4.443 -2.507 1.00 0.00 N ATOM 1166 CA LEU A 74 -14.774 3.568 -3.507 1.00 0.00 C ATOM 1167 C LEU A 74 -15.194 2.119 -3.291 1.00 0.00 C ATOM 1168 O LEU A 74 -14.711 1.456 -2.372 1.00 0.00 O ATOM 1169 CB LEU A 74 -13.249 3.673 -3.460 1.00 0.00 C ATOM 1170 CG LEU A 74 -12.683 5.070 -3.725 1.00 0.00 C ATOM 1171 CD1 LEU A 74 -11.178 5.079 -3.512 1.00 0.00 C ATOM 1172 CD2 LEU A 74 -13.028 5.530 -5.133 1.00 0.00 C ATOM 0 H LEU A 74 -14.804 4.584 -1.673 1.00 0.00 H new ATOM 0 HA LEU A 74 -15.128 3.890 -4.486 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -12.908 3.340 -2.480 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -12.831 2.984 -4.194 1.00 0.00 H new ATOM 0 HG LEU A 74 -13.136 5.766 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -10.789 6.079 -3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -10.954 4.794 -2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -10.710 4.370 -4.195 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -12.617 6.525 -5.302 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -12.604 4.835 -5.857 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -14.111 5.560 -5.251 1.00 0.00 H new ATOM 1184 N GLU A 75 -16.096 1.634 -4.137 1.00 0.00 N ATOM 1185 CA GLU A 75 -16.567 0.265 -4.042 1.00 0.00 C ATOM 1186 C GLU A 75 -15.429 -0.706 -4.342 1.00 0.00 C ATOM 1187 O GLU A 75 -15.222 -1.103 -5.490 1.00 0.00 O ATOM 1188 CB GLU A 75 -17.727 0.043 -5.013 1.00 0.00 C ATOM 1189 CG GLU A 75 -18.275 -1.367 -4.982 1.00 0.00 C ATOM 1190 CD GLU A 75 -19.471 -1.552 -5.895 1.00 0.00 C ATOM 1191 OE1 GLU A 75 -19.265 -1.823 -7.097 1.00 0.00 O ATOM 1192 OE2 GLU A 75 -20.615 -1.425 -5.409 1.00 0.00 O ATOM 0 H GLU A 75 -16.514 2.173 -4.896 1.00 0.00 H new ATOM 0 HA GLU A 75 -16.920 0.082 -3.027 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -18.529 0.742 -4.775 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -17.393 0.273 -6.025 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -17.489 -2.064 -5.274 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -18.561 -1.619 -3.961 1.00 0.00 H new ATOM 1199 N ILE A 76 -14.689 -1.075 -3.303 1.00 0.00 N ATOM 1200 CA ILE A 76 -13.561 -1.985 -3.450 1.00 0.00 C ATOM 1201 C ILE A 76 -13.884 -3.375 -2.906 1.00 0.00 C ATOM 1202 O ILE A 76 -13.943 -3.583 -1.694 1.00 0.00 O ATOM 1203 CB ILE A 76 -12.304 -1.430 -2.743 1.00 0.00 C ATOM 1204 CG1 ILE A 76 -11.611 -0.388 -3.629 1.00 0.00 C ATOM 1205 CG2 ILE A 76 -11.342 -2.555 -2.382 1.00 0.00 C ATOM 1206 CD1 ILE A 76 -10.856 -0.984 -4.800 1.00 0.00 C ATOM 0 H ILE A 76 -14.851 -0.757 -2.348 1.00 0.00 H new ATOM 0 HA ILE A 76 -13.360 -2.071 -4.518 1.00 0.00 H new ATOM 0 HB ILE A 76 -12.617 -0.946 -1.818 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.359 0.308 -4.008 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.918 0.191 -3.019 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.465 -2.139 -1.886 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.839 -3.258 -1.713 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -11.033 -3.074 -3.289 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.393 -0.185 -5.379 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.083 -1.658 -4.430 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.547 -1.538 -5.434 1.00 0.00 H new ATOM 1218 N GLU A 77 -14.110 -4.316 -3.816 1.00 0.00 N ATOM 1219 CA GLU A 77 -14.404 -5.692 -3.435 1.00 0.00 C ATOM 1220 C GLU A 77 -13.132 -6.533 -3.473 1.00 0.00 C ATOM 1221 O GLU A 77 -12.680 -6.955 -4.537 1.00 0.00 O ATOM 1222 CB GLU A 77 -15.475 -6.296 -4.351 1.00 0.00 C ATOM 1223 CG GLU A 77 -15.185 -6.130 -5.833 1.00 0.00 C ATOM 1224 CD GLU A 77 -16.251 -6.760 -6.710 1.00 0.00 C ATOM 1225 OE1 GLU A 77 -17.232 -6.064 -7.045 1.00 0.00 O ATOM 1226 OE2 GLU A 77 -16.103 -7.949 -7.061 1.00 0.00 O ATOM 0 H GLU A 77 -14.095 -4.151 -4.822 1.00 0.00 H new ATOM 0 HA GLU A 77 -14.792 -5.690 -2.417 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -15.573 -7.358 -4.127 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.435 -5.833 -4.125 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -15.107 -5.068 -6.068 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -14.219 -6.579 -6.063 1.00 0.00 H new ATOM 1233 N VAL A 78 -12.561 -6.769 -2.300 1.00 0.00 N ATOM 1234 CA VAL A 78 -11.328 -7.542 -2.188 1.00 0.00 C ATOM 1235 C VAL A 78 -11.571 -9.026 -2.412 1.00 0.00 C ATOM 1236 O VAL A 78 -12.276 -9.670 -1.637 1.00 0.00 O ATOM 1237 CB VAL A 78 -10.665 -7.361 -0.810 1.00 0.00 C ATOM 1238 CG1 VAL A 78 -9.810 -6.106 -0.784 1.00 0.00 C ATOM 1239 CG2 VAL A 78 -11.705 -7.325 0.291 1.00 0.00 C ATOM 0 H VAL A 78 -12.931 -6.436 -1.410 1.00 0.00 H new ATOM 0 HA VAL A 78 -10.664 -7.161 -2.964 1.00 0.00 H new ATOM 0 HB VAL A 78 -10.016 -8.219 -0.633 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -9.352 -5.998 0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.030 -6.181 -1.542 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -10.434 -5.236 -0.991 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.211 -7.196 1.254 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.388 -6.493 0.119 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.266 -8.260 0.293 1.00 0.00 H new ATOM 1249 N ASN A 79 -10.986 -9.565 -3.474 1.00 0.00 N ATOM 1250 CA ASN A 79 -11.129 -10.983 -3.776 1.00 0.00 C ATOM 1251 C ASN A 79 -10.320 -11.808 -2.782 1.00 0.00 C ATOM 1252 O ASN A 79 -10.672 -12.944 -2.464 1.00 0.00 O ATOM 1253 CB ASN A 79 -10.656 -11.274 -5.199 1.00 0.00 C ATOM 1254 CG ASN A 79 -11.101 -10.210 -6.183 1.00 0.00 C ATOM 1255 OD1 ASN A 79 -10.299 -9.161 -6.315 1.00 0.00 O flip ATOM 1256 ND2 ASN A 79 -12.153 -10.327 -6.811 1.00 0.00 N flip ATOM 0 H ASN A 79 -10.411 -9.045 -4.137 1.00 0.00 H new ATOM 0 HA ASN A 79 -12.182 -11.254 -3.695 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -9.568 -11.344 -5.211 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.041 -12.243 -5.516 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.738 -11.152 -6.677 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -12.440 -9.599 -7.466 1.00 0.00 H new ATOM 1263 N GLY A 80 -9.226 -11.217 -2.303 1.00 0.00 N ATOM 1264 CA GLY A 80 -8.363 -11.885 -1.346 1.00 0.00 C ATOM 1265 C GLY A 80 -9.124 -12.531 -0.203 1.00 0.00 C ATOM 1266 O GLY A 80 -8.737 -13.596 0.281 1.00 0.00 O ATOM 0 H GLY A 80 -8.922 -10.279 -2.565 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.780 -12.648 -1.863 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.654 -11.163 -0.940 1.00 0.00 H new ATOM 1270 N ASN A 81 -10.206 -11.893 0.234 1.00 0.00 N ATOM 1271 CA ASN A 81 -11.009 -12.429 1.326 1.00 0.00 C ATOM 1272 C ASN A 81 -12.497 -12.217 1.065 1.00 0.00 C ATOM 1273 O ASN A 81 -13.327 -12.396 1.957 1.00 0.00 O ATOM 1274 CB ASN A 81 -10.604 -11.795 2.655 1.00 0.00 C ATOM 1275 CG ASN A 81 -11.263 -10.454 2.890 1.00 0.00 C ATOM 1276 OD1 ASN A 81 -12.364 -10.381 3.433 1.00 0.00 O ATOM 1277 ND2 ASN A 81 -10.586 -9.382 2.495 1.00 0.00 N ATOM 0 H ASN A 81 -10.544 -11.010 -0.149 1.00 0.00 H new ATOM 0 HA ASN A 81 -10.824 -13.502 1.384 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.866 -12.471 3.469 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -9.521 -11.672 2.678 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -10.977 -8.451 2.638 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -9.675 -9.490 2.048 1.00 0.00 H new ATOM 1284 N GLY A 82 -12.825 -11.841 -0.167 1.00 0.00 N ATOM 1285 CA GLY A 82 -14.210 -11.623 -0.545 1.00 0.00 C ATOM 1286 C GLY A 82 -14.921 -10.569 0.284 1.00 0.00 C ATOM 1287 O GLY A 82 -16.144 -10.615 0.416 1.00 0.00 O ATOM 0 H GLY A 82 -12.151 -11.682 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.247 -11.330 -1.594 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.752 -12.565 -0.457 1.00 0.00 H new ATOM 1291 N PHE A 83 -14.178 -9.617 0.846 1.00 0.00 N ATOM 1292 CA PHE A 83 -14.805 -8.567 1.648 1.00 0.00 C ATOM 1293 C PHE A 83 -15.309 -7.430 0.769 1.00 0.00 C ATOM 1294 O PHE A 83 -14.532 -6.604 0.292 1.00 0.00 O ATOM 1295 CB PHE A 83 -13.841 -8.023 2.705 1.00 0.00 C ATOM 1296 CG PHE A 83 -14.366 -6.811 3.423 1.00 0.00 C ATOM 1297 CD1 PHE A 83 -15.514 -6.891 4.197 1.00 0.00 C ATOM 1298 CD2 PHE A 83 -13.716 -5.591 3.319 1.00 0.00 C ATOM 1299 CE1 PHE A 83 -16.002 -5.777 4.854 1.00 0.00 C ATOM 1300 CE2 PHE A 83 -14.200 -4.475 3.975 1.00 0.00 C ATOM 1301 CZ PHE A 83 -15.345 -4.568 4.743 1.00 0.00 C ATOM 0 H PHE A 83 -13.163 -9.550 0.764 1.00 0.00 H new ATOM 0 HA PHE A 83 -15.657 -9.017 2.157 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.633 -8.806 3.434 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.894 -7.772 2.228 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -16.032 -7.834 4.287 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.822 -5.512 2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -16.897 -5.852 5.454 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.684 -3.531 3.887 1.00 0.00 H new ATOM 0 HZ PHE A 83 -15.725 -3.697 5.255 1.00 0.00 H new ATOM 1311 N ARG A 84 -16.620 -7.396 0.562 1.00 0.00 N ATOM 1312 CA ARG A 84 -17.235 -6.357 -0.248 1.00 0.00 C ATOM 1313 C ARG A 84 -17.615 -5.163 0.619 1.00 0.00 C ATOM 1314 O ARG A 84 -18.499 -5.258 1.472 1.00 0.00 O ATOM 1315 CB ARG A 84 -18.472 -6.902 -0.964 1.00 0.00 C ATOM 1316 CG ARG A 84 -19.172 -5.874 -1.837 1.00 0.00 C ATOM 1317 CD ARG A 84 -20.393 -6.463 -2.522 1.00 0.00 C ATOM 1318 NE ARG A 84 -21.151 -5.453 -3.255 1.00 0.00 N ATOM 1319 CZ ARG A 84 -22.118 -5.740 -4.123 1.00 0.00 C ATOM 1320 NH1 ARG A 84 -22.439 -7.002 -4.369 1.00 0.00 N ATOM 1321 NH2 ARG A 84 -22.764 -4.763 -4.744 1.00 0.00 N ATOM 0 H ARG A 84 -17.276 -8.077 0.945 1.00 0.00 H new ATOM 0 HA ARG A 84 -16.513 -6.030 -0.996 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -18.179 -7.752 -1.581 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -19.177 -7.275 -0.221 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -19.472 -5.021 -1.228 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -18.477 -5.500 -2.589 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -20.079 -7.249 -3.208 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -21.037 -6.929 -1.776 1.00 0.00 H new ATOM 0 HE ARG A 84 -20.926 -4.471 -3.092 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -21.944 -7.756 -3.893 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -23.181 -7.219 -5.035 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -22.520 -3.791 -4.557 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -23.505 -4.984 -5.409 1.00 0.00 H new ATOM 1335 N GLY A 85 -16.942 -4.041 0.396 1.00 0.00 N ATOM 1336 CA GLY A 85 -17.220 -2.845 1.171 1.00 0.00 C ATOM 1337 C GLY A 85 -16.588 -1.603 0.576 1.00 0.00 C ATOM 1338 O GLY A 85 -15.462 -1.648 0.078 1.00 0.00 O ATOM 0 H GLY A 85 -16.210 -3.937 -0.306 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -18.299 -2.703 1.238 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.853 -2.983 2.188 1.00 0.00 H new ATOM 1342 N GLU A 86 -17.313 -0.490 0.628 1.00 0.00 N ATOM 1343 CA GLU A 86 -16.816 0.771 0.092 1.00 0.00 C ATOM 1344 C GLU A 86 -15.863 1.439 1.078 1.00 0.00 C ATOM 1345 O GLU A 86 -16.219 1.689 2.229 1.00 0.00 O ATOM 1346 CB GLU A 86 -17.981 1.709 -0.231 1.00 0.00 C ATOM 1347 CG GLU A 86 -18.928 1.159 -1.285 1.00 0.00 C ATOM 1348 CD GLU A 86 -20.043 2.127 -1.631 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -21.100 2.077 -0.968 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -19.859 2.935 -2.565 1.00 0.00 O ATOM 0 H GLU A 86 -18.246 -0.436 1.036 1.00 0.00 H new ATOM 0 HA GLU A 86 -16.270 0.558 -0.827 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -18.542 1.907 0.682 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -17.584 2.664 -0.574 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -18.364 0.923 -2.187 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -19.361 0.225 -0.927 1.00 0.00 H new ATOM 1357 N LEU A 87 -14.652 1.727 0.614 1.00 0.00 N ATOM 1358 CA LEU A 87 -13.640 2.365 1.449 1.00 0.00 C ATOM 1359 C LEU A 87 -13.143 3.654 0.811 1.00 0.00 C ATOM 1360 O LEU A 87 -13.435 3.937 -0.352 1.00 0.00 O ATOM 1361 CB LEU A 87 -12.453 1.423 1.672 1.00 0.00 C ATOM 1362 CG LEU A 87 -12.549 0.504 2.893 1.00 0.00 C ATOM 1363 CD1 LEU A 87 -12.738 1.318 4.164 1.00 0.00 C ATOM 1364 CD2 LEU A 87 -13.678 -0.501 2.726 1.00 0.00 C ATOM 0 H LEU A 87 -14.346 1.528 -0.339 1.00 0.00 H new ATOM 0 HA LEU A 87 -14.102 2.598 2.408 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -12.334 0.803 0.783 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.549 2.025 1.764 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.613 -0.048 2.976 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.804 0.646 5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.890 1.990 4.295 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -13.656 1.902 4.089 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.727 -1.143 3.606 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -14.623 0.029 2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -13.494 -1.111 1.841 1.00 0.00 H new ATOM 1376 N SER A 88 -12.388 4.431 1.577 1.00 0.00 N ATOM 1377 CA SER A 88 -11.832 5.682 1.082 1.00 0.00 C ATOM 1378 C SER A 88 -10.511 5.413 0.374 1.00 0.00 C ATOM 1379 O SER A 88 -9.889 4.373 0.587 1.00 0.00 O ATOM 1380 CB SER A 88 -11.623 6.669 2.232 1.00 0.00 C ATOM 1381 OG SER A 88 -11.081 7.891 1.763 1.00 0.00 O ATOM 0 H SER A 88 -12.147 4.216 2.544 1.00 0.00 H new ATOM 0 HA SER A 88 -12.534 6.123 0.375 1.00 0.00 H new ATOM 0 HB2 SER A 88 -12.574 6.857 2.731 1.00 0.00 H new ATOM 0 HB3 SER A 88 -10.954 6.232 2.974 1.00 0.00 H new ATOM 0 HG SER A 88 -10.959 8.505 2.517 1.00 0.00 H new ATOM 1387 N ALA A 89 -10.083 6.346 -0.467 1.00 0.00 N ATOM 1388 CA ALA A 89 -8.833 6.188 -1.199 1.00 0.00 C ATOM 1389 C ALA A 89 -7.673 5.934 -0.248 1.00 0.00 C ATOM 1390 O ALA A 89 -6.675 5.314 -0.617 1.00 0.00 O ATOM 1391 CB ALA A 89 -8.559 7.414 -2.054 1.00 0.00 C ATOM 0 H ALA A 89 -10.580 7.216 -0.659 1.00 0.00 H new ATOM 0 HA ALA A 89 -8.931 5.322 -1.853 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.622 7.279 -2.594 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.372 7.549 -2.767 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.486 8.294 -1.415 1.00 0.00 H new ATOM 1397 N ASP A 90 -7.812 6.418 0.978 1.00 0.00 N ATOM 1398 CA ASP A 90 -6.786 6.238 1.992 1.00 0.00 C ATOM 1399 C ASP A 90 -6.886 4.852 2.621 1.00 0.00 C ATOM 1400 O ASP A 90 -5.934 4.076 2.581 1.00 0.00 O ATOM 1401 CB ASP A 90 -6.915 7.312 3.073 1.00 0.00 C ATOM 1402 CG ASP A 90 -5.875 7.163 4.164 1.00 0.00 C ATOM 1403 OD1 ASP A 90 -6.121 6.394 5.119 1.00 0.00 O ATOM 1404 OD2 ASP A 90 -4.813 7.814 4.067 1.00 0.00 O ATOM 0 H ASP A 90 -8.629 6.940 1.294 1.00 0.00 H new ATOM 0 HA ASP A 90 -5.812 6.332 1.512 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.819 8.297 2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -7.910 7.261 3.515 1.00 0.00 H new ATOM 1409 N ALA A 91 -8.049 4.545 3.190 1.00 0.00 N ATOM 1410 CA ALA A 91 -8.271 3.255 3.840 1.00 0.00 C ATOM 1411 C ALA A 91 -8.153 2.098 2.854 1.00 0.00 C ATOM 1412 O ALA A 91 -7.991 0.946 3.256 1.00 0.00 O ATOM 1413 CB ALA A 91 -9.632 3.232 4.520 1.00 0.00 C ATOM 0 H ALA A 91 -8.853 5.172 3.214 1.00 0.00 H new ATOM 0 HA ALA A 91 -7.494 3.128 4.593 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.783 2.265 5.000 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -9.677 4.020 5.271 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -10.413 3.394 3.777 1.00 0.00 H new ATOM 1419 N ALA A 92 -8.237 2.405 1.563 1.00 0.00 N ATOM 1420 CA ALA A 92 -8.135 1.383 0.531 1.00 0.00 C ATOM 1421 C ALA A 92 -6.707 1.297 0.016 1.00 0.00 C ATOM 1422 O ALA A 92 -6.226 0.221 -0.339 1.00 0.00 O ATOM 1423 CB ALA A 92 -9.099 1.679 -0.608 1.00 0.00 C ATOM 0 H ALA A 92 -8.375 3.352 1.209 1.00 0.00 H new ATOM 0 HA ALA A 92 -8.405 0.420 0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -9.010 0.905 -1.371 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -10.120 1.696 -0.226 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.859 2.648 -1.045 1.00 0.00 H new ATOM 1429 N GLY A 93 -6.034 2.443 -0.024 1.00 0.00 N ATOM 1430 CA GLY A 93 -4.661 2.476 -0.478 1.00 0.00 C ATOM 1431 C GLY A 93 -3.767 1.637 0.406 1.00 0.00 C ATOM 1432 O GLY A 93 -2.679 1.228 -0.002 1.00 0.00 O ATOM 0 H GLY A 93 -6.417 3.348 0.250 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.607 2.111 -1.504 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.304 3.506 -0.487 1.00 0.00 H new ATOM 1436 N ILE A 94 -4.234 1.380 1.624 1.00 0.00 N ATOM 1437 CA ILE A 94 -3.483 0.575 2.579 1.00 0.00 C ATOM 1438 C ILE A 94 -3.393 -0.868 2.098 1.00 0.00 C ATOM 1439 O ILE A 94 -2.329 -1.483 2.121 1.00 0.00 O ATOM 1440 CB ILE A 94 -4.139 0.583 3.977 1.00 0.00 C ATOM 1441 CG1 ILE A 94 -4.743 1.954 4.296 1.00 0.00 C ATOM 1442 CG2 ILE A 94 -3.124 0.185 5.039 1.00 0.00 C ATOM 1443 CD1 ILE A 94 -3.747 3.094 4.258 1.00 0.00 C ATOM 0 H ILE A 94 -5.131 1.719 1.973 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.488 1.015 2.653 1.00 0.00 H new ATOM 0 HB ILE A 94 -4.949 -0.147 3.976 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.543 2.161 3.585 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -5.198 1.917 5.286 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.600 0.195 6.019 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.750 -0.817 4.827 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -2.294 0.891 5.032 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.255 4.029 4.495 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -2.959 2.913 4.989 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.309 3.161 3.262 1.00 0.00 H new ATOM 1455 N VAL A 95 -4.531 -1.392 1.654 1.00 0.00 N ATOM 1456 CA VAL A 95 -4.620 -2.760 1.167 1.00 0.00 C ATOM 1457 C VAL A 95 -3.933 -2.915 -0.187 1.00 0.00 C ATOM 1458 O VAL A 95 -3.461 -3.998 -0.530 1.00 0.00 O ATOM 1459 CB VAL A 95 -6.091 -3.196 1.033 1.00 0.00 C ATOM 1460 CG1 VAL A 95 -6.189 -4.677 0.699 1.00 0.00 C ATOM 1461 CG2 VAL A 95 -6.858 -2.878 2.307 1.00 0.00 C ATOM 0 H VAL A 95 -5.413 -0.881 1.622 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.114 -3.393 1.896 1.00 0.00 H new ATOM 0 HB VAL A 95 -6.540 -2.636 0.213 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.237 -4.961 0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.678 -4.872 -0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.721 -5.261 1.492 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.896 -3.193 2.195 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.406 -3.408 3.145 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.822 -1.805 2.495 1.00 0.00 H new ATOM 1471 N ALA A 96 -3.875 -1.830 -0.951 1.00 0.00 N ATOM 1472 CA ALA A 96 -3.255 -1.860 -2.271 1.00 0.00 C ATOM 1473 C ALA A 96 -1.737 -1.986 -2.180 1.00 0.00 C ATOM 1474 O ALA A 96 -1.135 -2.816 -2.861 1.00 0.00 O ATOM 1475 CB ALA A 96 -3.634 -0.613 -3.056 1.00 0.00 C ATOM 0 H ALA A 96 -4.249 -0.920 -0.680 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.628 -2.741 -2.793 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.166 -0.646 -4.040 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.717 -0.571 -3.171 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.291 0.272 -2.520 1.00 0.00 H new ATOM 1481 N THR A 97 -1.121 -1.162 -1.338 1.00 0.00 N ATOM 1482 CA THR A 97 0.327 -1.184 -1.173 1.00 0.00 C ATOM 1483 C THR A 97 0.781 -2.420 -0.400 1.00 0.00 C ATOM 1484 O THR A 97 1.805 -3.021 -0.724 1.00 0.00 O ATOM 1485 CB THR A 97 0.836 0.080 -0.453 1.00 0.00 C ATOM 1486 OG1 THR A 97 2.241 -0.033 -0.197 1.00 0.00 O ATOM 1487 CG2 THR A 97 0.093 0.300 0.856 1.00 0.00 C ATOM 0 H THR A 97 -1.602 -0.472 -0.761 1.00 0.00 H new ATOM 0 HA THR A 97 0.753 -1.214 -2.176 1.00 0.00 H new ATOM 0 HB THR A 97 0.652 0.936 -1.102 1.00 0.00 H new ATOM 0 HG1 THR A 97 2.556 0.775 0.259 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.472 1.198 1.343 1.00 0.00 H new ATOM 0 HG22 THR A 97 -0.972 0.418 0.655 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.245 -0.559 1.510 1.00 0.00 H new ATOM 1495 N LEU A 98 0.016 -2.791 0.623 1.00 0.00 N ATOM 1496 CA LEU A 98 0.344 -3.958 1.438 1.00 0.00 C ATOM 1497 C LEU A 98 0.467 -5.219 0.585 1.00 0.00 C ATOM 1498 O LEU A 98 1.467 -5.934 0.661 1.00 0.00 O ATOM 1499 CB LEU A 98 -0.713 -4.167 2.524 1.00 0.00 C ATOM 1500 CG LEU A 98 -0.557 -3.279 3.760 1.00 0.00 C ATOM 1501 CD1 LEU A 98 -1.755 -3.437 4.685 1.00 0.00 C ATOM 1502 CD2 LEU A 98 0.732 -3.611 4.495 1.00 0.00 C ATOM 0 H LEU A 98 -0.833 -2.302 0.907 1.00 0.00 H new ATOM 0 HA LEU A 98 1.309 -3.769 1.908 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.697 -3.990 2.090 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.686 -5.210 2.839 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.509 -2.240 3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.627 -2.798 5.559 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.664 -3.150 4.156 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.834 -4.476 5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.827 -2.970 5.371 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.713 -4.655 4.809 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.581 -3.447 3.832 1.00 0.00 H new ATOM 1514 N PHE A 99 -0.554 -5.488 -0.225 1.00 0.00 N ATOM 1515 CA PHE A 99 -0.557 -6.669 -1.086 1.00 0.00 C ATOM 1516 C PHE A 99 0.657 -6.689 -2.012 1.00 0.00 C ATOM 1517 O PHE A 99 1.163 -7.756 -2.360 1.00 0.00 O ATOM 1518 CB PHE A 99 -1.845 -6.722 -1.910 1.00 0.00 C ATOM 1519 CG PHE A 99 -2.938 -7.526 -1.262 1.00 0.00 C ATOM 1520 CD1 PHE A 99 -3.740 -6.969 -0.277 1.00 0.00 C ATOM 1521 CD2 PHE A 99 -3.161 -8.840 -1.639 1.00 0.00 C ATOM 1522 CE1 PHE A 99 -4.743 -7.712 0.319 1.00 0.00 C ATOM 1523 CE2 PHE A 99 -4.163 -9.585 -1.048 1.00 0.00 C ATOM 1524 CZ PHE A 99 -4.955 -9.020 -0.068 1.00 0.00 C ATOM 0 H PHE A 99 -1.388 -4.906 -0.304 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.505 -7.548 -0.443 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -2.202 -5.706 -2.077 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -1.624 -7.147 -2.889 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.580 -5.945 0.028 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.544 -9.288 -2.404 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.360 -7.269 1.087 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -4.327 -10.608 -1.352 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.739 -9.601 0.395 1.00 0.00 H new ATOM 1534 N ALA A 100 1.118 -5.508 -2.408 1.00 0.00 N ATOM 1535 CA ALA A 100 2.273 -5.399 -3.293 1.00 0.00 C ATOM 1536 C ALA A 100 3.545 -5.870 -2.597 1.00 0.00 C ATOM 1537 O ALA A 100 4.372 -6.560 -3.194 1.00 0.00 O ATOM 1538 CB ALA A 100 2.433 -3.966 -3.776 1.00 0.00 C ATOM 0 H ALA A 100 0.711 -4.614 -2.131 1.00 0.00 H new ATOM 0 HA ALA A 100 2.102 -6.045 -4.154 1.00 0.00 H new ATOM 0 HB1 ALA A 100 3.298 -3.899 -4.435 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.538 -3.663 -4.320 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.577 -3.307 -2.920 1.00 0.00 H new ATOM 1544 N LEU A 101 3.696 -5.491 -1.332 1.00 0.00 N ATOM 1545 CA LEU A 101 4.869 -5.872 -0.551 1.00 0.00 C ATOM 1546 C LEU A 101 5.004 -7.390 -0.463 1.00 0.00 C ATOM 1547 O LEU A 101 6.098 -7.935 -0.603 1.00 0.00 O ATOM 1548 CB LEU A 101 4.784 -5.281 0.859 1.00 0.00 C ATOM 1549 CG LEU A 101 4.722 -3.754 0.927 1.00 0.00 C ATOM 1550 CD1 LEU A 101 4.546 -3.293 2.366 1.00 0.00 C ATOM 1551 CD2 LEU A 101 5.973 -3.139 0.317 1.00 0.00 C ATOM 0 H LEU A 101 3.020 -4.920 -0.825 1.00 0.00 H new ATOM 0 HA LEU A 101 5.749 -5.475 -1.057 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.900 -5.686 1.352 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.650 -5.618 1.429 1.00 0.00 H new ATOM 0 HG LEU A 101 3.861 -3.418 0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.504 -2.204 2.397 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.620 -3.704 2.769 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.388 -3.640 2.965 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.910 -2.052 0.375 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.851 -3.481 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.056 -3.442 -0.727 1.00 0.00 H new ATOM 1563 N GLY A 102 3.883 -8.065 -0.232 1.00 0.00 N ATOM 1564 CA GLY A 102 3.895 -9.511 -0.115 1.00 0.00 C ATOM 1565 C GLY A 102 4.184 -10.216 -1.427 1.00 0.00 C ATOM 1566 O GLY A 102 4.540 -11.394 -1.436 1.00 0.00 O ATOM 0 H GLY A 102 2.964 -7.635 -0.124 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.645 -9.803 0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 102 2.930 -9.846 0.265 1.00 0.00 H new ATOM 1570 N GLN A 103 4.034 -9.502 -2.539 1.00 0.00 N ATOM 1571 CA GLN A 103 4.280 -10.087 -3.853 1.00 0.00 C ATOM 1572 C GLN A 103 5.758 -10.005 -4.228 1.00 0.00 C ATOM 1573 O GLN A 103 6.337 -10.978 -4.707 1.00 0.00 O ATOM 1574 CB GLN A 103 3.429 -9.392 -4.918 1.00 0.00 C ATOM 1575 CG GLN A 103 3.481 -10.078 -6.275 1.00 0.00 C ATOM 1576 CD GLN A 103 2.445 -9.540 -7.242 1.00 0.00 C ATOM 1577 OE1 GLN A 103 2.827 -8.533 -8.019 1.00 0.00 O flip ATOM 1578 NE2 GLN A 103 1.316 -10.027 -7.295 1.00 0.00 N flip ATOM 0 H GLN A 103 3.745 -8.524 -2.557 1.00 0.00 H new ATOM 0 HA GLN A 103 3.999 -11.139 -3.805 1.00 0.00 H new ATOM 0 HB2 GLN A 103 2.394 -9.354 -4.578 1.00 0.00 H new ATOM 0 HB3 GLN A 103 3.767 -8.361 -5.027 1.00 0.00 H new ATOM 0 HG2 GLN A 103 4.474 -9.950 -6.705 1.00 0.00 H new ATOM 0 HG3 GLN A 103 3.327 -11.149 -6.142 1.00 0.00 H new ATOM 0 HE21 GLN A 103 1.065 -10.800 -6.679 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.632 -9.657 -7.955 1.00 0.00 H new ATOM 1587 N LEU A 104 6.364 -8.841 -4.005 1.00 0.00 N ATOM 1588 CA LEU A 104 7.775 -8.642 -4.325 1.00 0.00 C ATOM 1589 C LEU A 104 8.661 -9.581 -3.514 1.00 0.00 C ATOM 1590 O LEU A 104 9.663 -10.091 -4.015 1.00 0.00 O ATOM 1591 CB LEU A 104 8.187 -7.190 -4.065 1.00 0.00 C ATOM 1592 CG LEU A 104 7.798 -6.198 -5.162 1.00 0.00 C ATOM 1593 CD1 LEU A 104 8.173 -4.782 -4.756 1.00 0.00 C ATOM 1594 CD2 LEU A 104 8.463 -6.571 -6.480 1.00 0.00 C ATOM 0 H LEU A 104 5.902 -8.024 -3.605 1.00 0.00 H new ATOM 0 HA LEU A 104 7.908 -8.867 -5.383 1.00 0.00 H new ATOM 0 HB2 LEU A 104 7.739 -6.864 -3.127 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.268 -7.154 -3.931 1.00 0.00 H new ATOM 0 HG LEU A 104 6.718 -6.242 -5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 104 7.889 -4.089 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 104 7.650 -4.516 -3.837 1.00 0.00 H new ATOM 0 HD13 LEU A 104 9.249 -4.724 -4.591 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.175 -5.854 -7.249 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.546 -6.556 -6.358 1.00 0.00 H new ATOM 0 HD23 LEU A 104 8.145 -7.570 -6.778 1.00 0.00 H new ATOM 1606 N ALA A 105 8.284 -9.805 -2.260 1.00 0.00 N ATOM 1607 CA ALA A 105 9.047 -10.679 -1.378 1.00 0.00 C ATOM 1608 C ALA A 105 9.070 -12.112 -1.900 1.00 0.00 C ATOM 1609 O ALA A 105 10.081 -12.806 -1.795 1.00 0.00 O ATOM 1610 CB ALA A 105 8.465 -10.641 0.027 1.00 0.00 C ATOM 0 H ALA A 105 7.455 -9.393 -1.832 1.00 0.00 H new ATOM 0 HA ALA A 105 10.074 -10.316 -1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 105 9.042 -11.297 0.678 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.507 -9.622 0.411 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.428 -10.977 0.001 1.00 0.00 H new ATOM 1616 N ALA A 106 7.948 -12.549 -2.463 1.00 0.00 N ATOM 1617 CA ALA A 106 7.832 -13.904 -2.991 1.00 0.00 C ATOM 1618 C ALA A 106 8.141 -13.961 -4.483 1.00 0.00 C ATOM 1619 O ALA A 106 8.265 -15.043 -5.057 1.00 0.00 O ATOM 1620 CB ALA A 106 6.436 -14.446 -2.728 1.00 0.00 C ATOM 0 H ALA A 106 7.105 -11.984 -2.565 1.00 0.00 H new ATOM 0 HA ALA A 106 8.568 -14.523 -2.478 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.358 -15.458 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA A 106 6.248 -14.462 -1.654 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.700 -13.807 -3.215 1.00 0.00 H new ATOM 1626 N GLU A 107 8.269 -12.796 -5.109 1.00 0.00 N ATOM 1627 CA GLU A 107 8.557 -12.727 -6.538 1.00 0.00 C ATOM 1628 C GLU A 107 10.047 -12.907 -6.809 1.00 0.00 C ATOM 1629 O GLU A 107 10.439 -13.437 -7.848 1.00 0.00 O ATOM 1630 CB GLU A 107 8.080 -11.391 -7.112 1.00 0.00 C ATOM 1631 CG GLU A 107 8.291 -11.259 -8.611 1.00 0.00 C ATOM 1632 CD GLU A 107 7.795 -9.934 -9.155 1.00 0.00 C ATOM 1633 OE1 GLU A 107 8.586 -8.968 -9.178 1.00 0.00 O ATOM 1634 OE2 GLU A 107 6.616 -9.863 -9.561 1.00 0.00 O ATOM 0 H GLU A 107 8.178 -11.889 -4.651 1.00 0.00 H new ATOM 0 HA GLU A 107 8.020 -13.539 -7.027 1.00 0.00 H new ATOM 0 HB2 GLU A 107 7.020 -11.269 -6.891 1.00 0.00 H new ATOM 0 HB3 GLU A 107 8.606 -10.581 -6.607 1.00 0.00 H new ATOM 0 HG2 GLU A 107 9.352 -11.365 -8.836 1.00 0.00 H new ATOM 0 HG3 GLU A 107 7.774 -12.073 -9.120 1.00 0.00 H new ATOM 1641 N ILE A 108 10.875 -12.464 -5.867 1.00 0.00 N ATOM 1642 CA ILE A 108 12.322 -12.576 -6.010 1.00 0.00 C ATOM 1643 C ILE A 108 12.827 -13.910 -5.470 1.00 0.00 C ATOM 1644 O ILE A 108 14.017 -14.068 -5.195 1.00 0.00 O ATOM 1645 CB ILE A 108 13.050 -11.430 -5.280 1.00 0.00 C ATOM 1646 CG1 ILE A 108 12.688 -11.429 -3.793 1.00 0.00 C ATOM 1647 CG2 ILE A 108 12.705 -10.093 -5.921 1.00 0.00 C ATOM 1648 CD1 ILE A 108 13.446 -10.398 -2.983 1.00 0.00 C ATOM 0 H ILE A 108 10.569 -12.025 -4.999 1.00 0.00 H new ATOM 0 HA ILE A 108 12.540 -12.513 -7.076 1.00 0.00 H new ATOM 0 HB ILE A 108 14.125 -11.586 -5.368 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.619 -11.246 -3.689 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.884 -12.418 -3.380 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.226 -9.292 -5.396 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.012 -10.101 -6.967 1.00 0.00 H new ATOM 0 HG23 ILE A 108 11.629 -9.927 -5.860 1.00 0.00 H new ATOM 0 HD11 ILE A 108 13.137 -10.456 -1.939 1.00 0.00 H new ATOM 0 HD12 ILE A 108 14.516 -10.593 -3.056 1.00 0.00 H new ATOM 0 HD13 ILE A 108 13.231 -9.402 -3.370 1.00 0.00 H new ATOM 1660 N ALA A 109 11.915 -14.869 -5.324 1.00 0.00 N ATOM 1661 CA ALA A 109 12.263 -16.192 -4.819 1.00 0.00 C ATOM 1662 C ALA A 109 12.850 -16.106 -3.414 1.00 0.00 C ATOM 1663 O ALA A 109 12.861 -15.038 -2.800 1.00 0.00 O ATOM 1664 CB ALA A 109 13.241 -16.879 -5.762 1.00 0.00 C ATOM 0 H ALA A 109 10.927 -14.752 -5.549 1.00 0.00 H new ATOM 0 HA ALA A 109 11.350 -16.785 -4.767 1.00 0.00 H new ATOM 0 HB1 ALA A 109 13.491 -17.865 -5.371 1.00 0.00 H new ATOM 0 HB2 ALA A 109 12.785 -16.984 -6.746 1.00 0.00 H new ATOM 0 HB3 ALA A 109 14.148 -16.281 -5.844 1.00 0.00 H new ATOM 1670 N ASP A 110 13.335 -17.235 -2.910 1.00 0.00 N ATOM 1671 CA ASP A 110 13.925 -17.283 -1.577 1.00 0.00 C ATOM 1672 C ASP A 110 15.299 -16.621 -1.566 1.00 0.00 C ATOM 1673 O ASP A 110 16.301 -17.235 -1.929 1.00 0.00 O ATOM 1674 CB ASP A 110 14.033 -18.731 -1.093 1.00 0.00 C ATOM 1675 CG ASP A 110 14.721 -19.632 -2.100 1.00 0.00 C ATOM 1676 OD1 ASP A 110 14.050 -20.078 -3.055 1.00 0.00 O ATOM 1677 OD2 ASP A 110 15.932 -19.892 -1.935 1.00 0.00 O ATOM 0 H ASP A 110 13.332 -18.128 -3.403 1.00 0.00 H new ATOM 0 HA ASP A 110 13.274 -16.732 -0.898 1.00 0.00 H new ATOM 0 HB2 ASP A 110 14.584 -18.756 -0.153 1.00 0.00 H new ATOM 0 HB3 ASP A 110 13.035 -19.117 -0.888 1.00 0.00 H new ATOM 1682 N THR A 111 15.334 -15.358 -1.153 1.00 0.00 N ATOM 1683 CA THR A 111 16.581 -14.606 -1.092 1.00 0.00 C ATOM 1684 C THR A 111 16.673 -13.801 0.199 1.00 0.00 C ATOM 1685 O THR A 111 15.681 -13.632 0.909 1.00 0.00 O ATOM 1686 CB THR A 111 16.719 -13.647 -2.290 1.00 0.00 C ATOM 1687 OG1 THR A 111 15.616 -12.732 -2.316 1.00 0.00 O ATOM 1688 CG2 THR A 111 16.773 -14.420 -3.600 1.00 0.00 C ATOM 0 H THR A 111 14.511 -14.834 -0.855 1.00 0.00 H new ATOM 0 HA THR A 111 17.391 -15.335 -1.124 1.00 0.00 H new ATOM 0 HB THR A 111 17.650 -13.091 -2.176 1.00 0.00 H new ATOM 0 HG1 THR A 111 15.325 -12.597 -3.242 1.00 0.00 H new ATOM 0 HG21 THR A 111 16.870 -13.721 -4.431 1.00 0.00 H new ATOM 0 HG22 THR A 111 17.630 -15.094 -3.590 1.00 0.00 H new ATOM 0 HG23 THR A 111 15.857 -14.999 -3.719 1.00 0.00 H new ATOM 1696 N ASP A 112 17.871 -13.309 0.501 1.00 0.00 N ATOM 1697 CA ASP A 112 18.090 -12.521 1.708 1.00 0.00 C ATOM 1698 C ASP A 112 17.296 -11.219 1.660 1.00 0.00 C ATOM 1699 O ASP A 112 17.020 -10.611 2.693 1.00 0.00 O ATOM 1700 CB ASP A 112 19.580 -12.220 1.883 1.00 0.00 C ATOM 1701 CG ASP A 112 20.406 -13.479 2.060 1.00 0.00 C ATOM 1702 OD1 ASP A 112 20.855 -14.043 1.040 1.00 0.00 O ATOM 1703 OD2 ASP A 112 20.605 -13.900 3.219 1.00 0.00 O ATOM 0 H ASP A 112 18.704 -13.442 -0.073 1.00 0.00 H new ATOM 0 HA ASP A 112 17.743 -13.104 2.561 1.00 0.00 H new ATOM 0 HB2 ASP A 112 19.942 -11.670 1.014 1.00 0.00 H new ATOM 0 HB3 ASP A 112 19.718 -11.573 2.749 1.00 0.00 H new ATOM 1708 N ALA A 113 16.933 -10.798 0.452 1.00 0.00 N ATOM 1709 CA ALA A 113 16.168 -9.571 0.268 1.00 0.00 C ATOM 1710 C ALA A 113 14.669 -9.841 0.339 1.00 0.00 C ATOM 1711 O ALA A 113 13.866 -8.914 0.439 1.00 0.00 O ATOM 1712 CB ALA A 113 16.526 -8.919 -1.060 1.00 0.00 C ATOM 0 H ALA A 113 17.157 -11.289 -0.414 1.00 0.00 H new ATOM 0 HA ALA A 113 16.426 -8.888 1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 113 15.947 -8.004 -1.184 1.00 0.00 H new ATOM 0 HB2 ALA A 113 17.589 -8.680 -1.073 1.00 0.00 H new ATOM 0 HB3 ALA A 113 16.298 -9.605 -1.875 1.00 0.00 H new ATOM 1718 N ALA A 114 14.299 -11.117 0.285 1.00 0.00 N ATOM 1719 CA ALA A 114 12.896 -11.514 0.345 1.00 0.00 C ATOM 1720 C ALA A 114 12.352 -11.382 1.763 1.00 0.00 C ATOM 1721 O ALA A 114 11.154 -11.541 1.997 1.00 0.00 O ATOM 1722 CB ALA A 114 12.731 -12.940 -0.155 1.00 0.00 C ATOM 0 H ALA A 114 14.953 -11.895 0.200 1.00 0.00 H new ATOM 0 HA ALA A 114 12.325 -10.847 -0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 114 11.680 -13.224 -0.105 1.00 0.00 H new ATOM 0 HB2 ALA A 114 13.076 -13.006 -1.187 1.00 0.00 H new ATOM 0 HB3 ALA A 114 13.319 -13.614 0.468 1.00 0.00 H new ATOM 1728 N ASP A 115 13.244 -11.095 2.703 1.00 0.00 N ATOM 1729 CA ASP A 115 12.867 -10.940 4.101 1.00 0.00 C ATOM 1730 C ASP A 115 13.142 -9.518 4.576 1.00 0.00 C ATOM 1731 O ASP A 115 12.675 -9.106 5.637 1.00 0.00 O ATOM 1732 CB ASP A 115 13.632 -11.941 4.970 1.00 0.00 C ATOM 1733 CG ASP A 115 13.223 -11.874 6.429 1.00 0.00 C ATOM 1734 OD1 ASP A 115 12.250 -12.561 6.804 1.00 0.00 O ATOM 1735 OD2 ASP A 115 13.875 -11.134 7.195 1.00 0.00 O ATOM 0 H ASP A 115 14.239 -10.964 2.520 1.00 0.00 H new ATOM 0 HA ASP A 115 11.799 -11.136 4.193 1.00 0.00 H new ATOM 0 HB2 ASP A 115 13.460 -12.950 4.594 1.00 0.00 H new ATOM 0 HB3 ASP A 115 14.701 -11.747 4.886 1.00 0.00 H new ATOM 1740 N ALA A 116 13.903 -8.771 3.781 1.00 0.00 N ATOM 1741 CA ALA A 116 14.239 -7.394 4.117 1.00 0.00 C ATOM 1742 C ALA A 116 13.062 -6.465 3.845 1.00 0.00 C ATOM 1743 O ALA A 116 12.682 -5.663 4.698 1.00 0.00 O ATOM 1744 CB ALA A 116 15.462 -6.943 3.332 1.00 0.00 C ATOM 0 H ALA A 116 14.298 -9.098 2.899 1.00 0.00 H new ATOM 0 HA ALA A 116 14.468 -7.349 5.182 1.00 0.00 H new ATOM 0 HB1 ALA A 116 15.702 -5.912 3.593 1.00 0.00 H new ATOM 0 HB2 ALA A 116 16.308 -7.585 3.576 1.00 0.00 H new ATOM 0 HB3 ALA A 116 15.253 -7.008 2.264 1.00 0.00 H new ATOM 1750 N LEU A 117 12.487 -6.579 2.649 1.00 0.00 N ATOM 1751 CA LEU A 117 11.349 -5.751 2.272 1.00 0.00 C ATOM 1752 C LEU A 117 10.121 -6.143 3.086 1.00 0.00 C ATOM 1753 O LEU A 117 9.148 -5.392 3.168 1.00 0.00 O ATOM 1754 CB LEU A 117 11.070 -5.865 0.760 1.00 0.00 C ATOM 1755 CG LEU A 117 10.321 -7.121 0.280 1.00 0.00 C ATOM 1756 CD1 LEU A 117 10.876 -8.379 0.933 1.00 0.00 C ATOM 1757 CD2 LEU A 117 8.825 -6.992 0.539 1.00 0.00 C ATOM 0 H LEU A 117 12.791 -7.235 1.929 1.00 0.00 H new ATOM 0 HA LEU A 117 11.587 -4.710 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.495 -4.991 0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 117 12.024 -5.818 0.235 1.00 0.00 H new ATOM 0 HG LEU A 117 10.475 -7.209 -0.795 1.00 0.00 H new ATOM 0 HD11 LEU A 117 10.326 -9.249 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.931 -8.486 0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 117 10.770 -8.304 2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 117 8.317 -7.891 0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 117 8.650 -6.866 1.608 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.436 -6.126 0.003 1.00 0.00 H new ATOM 1769 N ILE A 118 10.180 -7.327 3.687 1.00 0.00 N ATOM 1770 CA ILE A 118 9.082 -7.831 4.499 1.00 0.00 C ATOM 1771 C ILE A 118 8.840 -6.916 5.692 1.00 0.00 C ATOM 1772 O ILE A 118 7.711 -6.768 6.159 1.00 0.00 O ATOM 1773 CB ILE A 118 9.372 -9.268 4.992 1.00 0.00 C ATOM 1774 CG1 ILE A 118 9.116 -10.277 3.869 1.00 0.00 C ATOM 1775 CG2 ILE A 118 8.529 -9.603 6.217 1.00 0.00 C ATOM 1776 CD1 ILE A 118 7.684 -10.295 3.377 1.00 0.00 C ATOM 0 H ILE A 118 10.980 -7.956 3.626 1.00 0.00 H new ATOM 0 HA ILE A 118 8.187 -7.852 3.877 1.00 0.00 H new ATOM 0 HB ILE A 118 10.422 -9.326 5.279 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.775 -10.049 3.031 1.00 0.00 H new ATOM 0 HG13 ILE A 118 9.382 -11.274 4.221 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.751 -10.619 6.545 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.761 -8.904 7.020 1.00 0.00 H new ATOM 0 HG23 ILE A 118 7.472 -9.527 5.963 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.582 -11.034 2.582 1.00 0.00 H new ATOM 0 HD12 ILE A 118 7.019 -10.554 4.201 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.419 -9.310 2.993 1.00 0.00 H new ATOM 1788 N ASP A 119 9.913 -6.298 6.171 1.00 0.00 N ATOM 1789 CA ASP A 119 9.832 -5.386 7.301 1.00 0.00 C ATOM 1790 C ASP A 119 8.790 -4.303 7.053 1.00 0.00 C ATOM 1791 O ASP A 119 7.972 -4.005 7.921 1.00 0.00 O ATOM 1792 CB ASP A 119 11.194 -4.742 7.556 1.00 0.00 C ATOM 1793 CG ASP A 119 11.927 -5.375 8.721 1.00 0.00 C ATOM 1794 OD1 ASP A 119 12.623 -6.390 8.506 1.00 0.00 O ATOM 1795 OD2 ASP A 119 11.806 -4.858 9.852 1.00 0.00 O ATOM 0 H ASP A 119 10.852 -6.414 5.791 1.00 0.00 H new ATOM 0 HA ASP A 119 9.533 -5.960 8.178 1.00 0.00 H new ATOM 0 HB2 ASP A 119 11.806 -4.826 6.658 1.00 0.00 H new ATOM 0 HB3 ASP A 119 11.058 -3.678 7.751 1.00 0.00 H new ATOM 1800 N ARG A 120 8.823 -3.725 5.856 1.00 0.00 N ATOM 1801 CA ARG A 120 7.890 -2.666 5.488 1.00 0.00 C ATOM 1802 C ARG A 120 6.446 -3.136 5.631 1.00 0.00 C ATOM 1803 O ARG A 120 5.576 -2.376 6.057 1.00 0.00 O ATOM 1804 CB ARG A 120 8.146 -2.202 4.051 1.00 0.00 C ATOM 1805 CG ARG A 120 9.421 -1.386 3.881 1.00 0.00 C ATOM 1806 CD ARG A 120 10.668 -2.229 4.099 1.00 0.00 C ATOM 1807 NE ARG A 120 11.891 -1.474 3.838 1.00 0.00 N ATOM 1808 CZ ARG A 120 13.026 -1.653 4.507 1.00 0.00 C ATOM 1809 NH1 ARG A 120 13.094 -2.556 5.477 1.00 0.00 N ATOM 1810 NH2 ARG A 120 14.096 -0.930 4.205 1.00 0.00 N ATOM 0 H ARG A 120 9.488 -3.973 5.123 1.00 0.00 H new ATOM 0 HA ARG A 120 8.050 -1.828 6.167 1.00 0.00 H new ATOM 0 HB2 ARG A 120 8.197 -3.076 3.402 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.298 -1.605 3.716 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.445 -0.955 2.880 1.00 0.00 H new ATOM 0 HG3 ARG A 120 9.417 -0.555 4.586 1.00 0.00 H new ATOM 0 HD2 ARG A 120 10.682 -2.598 5.125 1.00 0.00 H new ATOM 0 HD3 ARG A 120 10.634 -3.102 3.447 1.00 0.00 H new ATOM 0 HE ARG A 120 11.873 -0.769 3.101 1.00 0.00 H new ATOM 0 HH11 ARG A 120 12.274 -3.115 5.711 1.00 0.00 H new ATOM 0 HH12 ARG A 120 13.966 -2.691 5.988 1.00 0.00 H new ATOM 0 HH21 ARG A 120 14.049 -0.236 3.459 1.00 0.00 H new ATOM 0 HH22 ARG A 120 14.966 -1.068 4.719 1.00 0.00 H new ATOM 1824 N TYR A 121 6.198 -4.390 5.270 1.00 0.00 N ATOM 1825 CA TYR A 121 4.859 -4.959 5.359 1.00 0.00 C ATOM 1826 C TYR A 121 4.357 -4.945 6.799 1.00 0.00 C ATOM 1827 O TYR A 121 3.261 -4.459 7.080 1.00 0.00 O ATOM 1828 CB TYR A 121 4.853 -6.392 4.818 1.00 0.00 C ATOM 1829 CG TYR A 121 3.468 -6.991 4.684 1.00 0.00 C ATOM 1830 CD1 TYR A 121 2.746 -7.383 5.805 1.00 0.00 C ATOM 1831 CD2 TYR A 121 2.886 -7.167 3.436 1.00 0.00 C ATOM 1832 CE1 TYR A 121 1.483 -7.931 5.684 1.00 0.00 C ATOM 1833 CE2 TYR A 121 1.624 -7.715 3.307 1.00 0.00 C ATOM 1834 CZ TYR A 121 0.927 -8.096 4.434 1.00 0.00 C ATOM 1835 OH TYR A 121 -0.330 -8.642 4.310 1.00 0.00 O ATOM 0 H TYR A 121 6.906 -5.031 4.913 1.00 0.00 H new ATOM 0 HA TYR A 121 4.190 -4.347 4.754 1.00 0.00 H new ATOM 0 HB2 TYR A 121 5.339 -6.404 3.843 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.448 -7.022 5.479 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.179 -7.257 6.786 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.429 -6.871 2.551 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.934 -8.229 6.565 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.186 -7.844 2.328 1.00 0.00 H new ATOM 0 HH TYR A 121 -0.575 -8.688 3.362 1.00 0.00 H new ATOM 1845 N HIS A 122 5.166 -5.483 7.706 1.00 0.00 N ATOM 1846 CA HIS A 122 4.805 -5.541 9.119 1.00 0.00 C ATOM 1847 C HIS A 122 4.706 -4.145 9.727 1.00 0.00 C ATOM 1848 O HIS A 122 3.896 -3.906 10.622 1.00 0.00 O ATOM 1849 CB HIS A 122 5.828 -6.373 9.893 1.00 0.00 C ATOM 1850 CG HIS A 122 5.753 -7.839 9.600 1.00 0.00 C ATOM 1851 ND1 HIS A 122 5.228 -8.757 10.487 1.00 0.00 N ATOM 1852 CD2 HIS A 122 6.142 -8.548 8.514 1.00 0.00 C ATOM 1853 CE1 HIS A 122 5.299 -9.966 9.958 1.00 0.00 C ATOM 1854 NE2 HIS A 122 5.848 -9.865 8.762 1.00 0.00 N ATOM 0 H HIS A 122 6.077 -5.886 7.488 1.00 0.00 H new ATOM 0 HA HIS A 122 3.825 -6.013 9.192 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.830 -6.014 9.656 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.678 -6.216 10.961 1.00 0.00 H new ATOM 0 HD2 HIS A 122 6.599 -8.151 7.619 1.00 0.00 H new ATOM 0 HE1 HIS A 122 4.965 -10.881 10.425 1.00 0.00 H new ATOM 0 HE2 HIS A 122 6.025 -10.641 8.125 1.00 0.00 H new ATOM 1863 N PHE A 123 5.531 -3.226 9.235 1.00 0.00 N ATOM 1864 CA PHE A 123 5.533 -1.858 9.740 1.00 0.00 C ATOM 1865 C PHE A 123 4.217 -1.152 9.426 1.00 0.00 C ATOM 1866 O PHE A 123 3.575 -0.593 10.317 1.00 0.00 O ATOM 1867 CB PHE A 123 6.704 -1.068 9.148 1.00 0.00 C ATOM 1868 CG PHE A 123 8.032 -1.374 9.788 1.00 0.00 C ATOM 1869 CD1 PHE A 123 8.147 -1.483 11.166 1.00 0.00 C ATOM 1870 CD2 PHE A 123 9.165 -1.551 9.010 1.00 0.00 C ATOM 1871 CE1 PHE A 123 9.365 -1.762 11.754 1.00 0.00 C ATOM 1872 CE2 PHE A 123 10.386 -1.830 9.593 1.00 0.00 C ATOM 1873 CZ PHE A 123 10.487 -1.937 10.967 1.00 0.00 C ATOM 0 H PHE A 123 6.204 -3.403 8.490 1.00 0.00 H new ATOM 0 HA PHE A 123 5.647 -1.905 10.823 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.769 -1.279 8.081 1.00 0.00 H new ATOM 0 HB3 PHE A 123 6.499 -0.002 9.251 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.273 -1.348 11.787 1.00 0.00 H new ATOM 0 HD2 PHE A 123 9.093 -1.470 7.935 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.440 -1.843 12.828 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.261 -1.964 8.975 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.440 -2.157 11.424 1.00 0.00 H new ATOM 1883 N LEU A 124 3.821 -1.182 8.159 1.00 0.00 N ATOM 1884 CA LEU A 124 2.583 -0.542 7.728 1.00 0.00 C ATOM 1885 C LEU A 124 1.365 -1.258 8.301 1.00 0.00 C ATOM 1886 O LEU A 124 0.419 -0.620 8.766 1.00 0.00 O ATOM 1887 CB LEU A 124 2.503 -0.520 6.200 1.00 0.00 C ATOM 1888 CG LEU A 124 1.166 -0.046 5.626 1.00 0.00 C ATOM 1889 CD1 LEU A 124 0.895 1.399 6.020 1.00 0.00 C ATOM 1890 CD2 LEU A 124 1.156 -0.199 4.113 1.00 0.00 C ATOM 0 H LEU A 124 4.339 -1.643 7.411 1.00 0.00 H new ATOM 0 HA LEU A 124 2.586 0.482 8.103 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.294 0.127 5.820 1.00 0.00 H new ATOM 0 HB3 LEU A 124 2.705 -1.524 5.827 1.00 0.00 H new ATOM 0 HG LEU A 124 0.372 -0.667 6.042 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.060 1.717 5.602 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.861 1.480 7.106 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.690 2.037 5.634 1.00 0.00 H new ATOM 0 HD21 LEU A 124 0.199 0.142 3.719 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.959 0.398 3.682 1.00 0.00 H new ATOM 0 HD23 LEU A 124 1.303 -1.247 3.852 1.00 0.00 H new ATOM 1902 N ARG A 125 1.391 -2.586 8.252 1.00 0.00 N ATOM 1903 CA ARG A 125 0.290 -3.399 8.763 1.00 0.00 C ATOM 1904 C ARG A 125 -0.132 -2.948 10.161 1.00 0.00 C ATOM 1905 O ARG A 125 -1.316 -2.978 10.497 1.00 0.00 O ATOM 1906 CB ARG A 125 0.688 -4.876 8.791 1.00 0.00 C ATOM 1907 CG ARG A 125 -0.434 -5.800 9.233 1.00 0.00 C ATOM 1908 CD ARG A 125 -0.014 -7.259 9.171 1.00 0.00 C ATOM 1909 NE ARG A 125 -1.085 -8.156 9.595 1.00 0.00 N ATOM 1910 CZ ARG A 125 -1.052 -9.475 9.432 1.00 0.00 C ATOM 1911 NH1 ARG A 125 -0.005 -10.048 8.852 1.00 0.00 N ATOM 1912 NH2 ARG A 125 -2.065 -10.223 9.847 1.00 0.00 N ATOM 0 H ARG A 125 2.165 -3.125 7.862 1.00 0.00 H new ATOM 0 HA ARG A 125 -0.559 -3.268 8.092 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.021 -5.173 7.797 1.00 0.00 H new ATOM 0 HB3 ARG A 125 1.537 -5.002 9.463 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -0.733 -5.550 10.251 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.306 -5.644 8.598 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.284 -7.507 8.152 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.859 -7.412 9.805 1.00 0.00 H new ATOM 0 HE ARG A 125 -1.906 -7.747 10.042 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.776 -9.476 8.530 1.00 0.00 H new ATOM 0 HH12 ARG A 125 0.019 -11.060 8.728 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -2.872 -9.787 10.293 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.037 -11.235 9.721 1.00 0.00 H new ATOM 1926 N GLY A 126 0.838 -2.531 10.970 1.00 0.00 N ATOM 1927 CA GLY A 126 0.538 -2.084 12.318 1.00 0.00 C ATOM 1928 C GLY A 126 -0.126 -0.722 12.347 1.00 0.00 C ATOM 1929 O GLY A 126 -0.929 -0.435 13.235 1.00 0.00 O ATOM 0 H GLY A 126 1.825 -2.495 10.716 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.114 -2.812 12.801 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.460 -2.047 12.898 1.00 0.00 H new ATOM 1933 N PHE A 127 0.209 0.122 11.376 1.00 0.00 N ATOM 1934 CA PHE A 127 -0.362 1.461 11.295 1.00 0.00 C ATOM 1935 C PHE A 127 -1.837 1.396 10.915 1.00 0.00 C ATOM 1936 O PHE A 127 -2.631 2.249 11.315 1.00 0.00 O ATOM 1937 CB PHE A 127 0.408 2.302 10.273 1.00 0.00 C ATOM 1938 CG PHE A 127 -0.183 3.664 10.036 1.00 0.00 C ATOM 1939 CD1 PHE A 127 -0.371 4.546 11.088 1.00 0.00 C ATOM 1940 CD2 PHE A 127 -0.548 4.060 8.760 1.00 0.00 C ATOM 1941 CE1 PHE A 127 -0.912 5.799 10.871 1.00 0.00 C ATOM 1942 CE2 PHE A 127 -1.090 5.311 8.537 1.00 0.00 C ATOM 1943 CZ PHE A 127 -1.273 6.182 9.593 1.00 0.00 C ATOM 0 H PHE A 127 0.873 -0.098 10.634 1.00 0.00 H new ATOM 0 HA PHE A 127 -0.279 1.930 12.275 1.00 0.00 H new ATOM 0 HB2 PHE A 127 1.437 2.417 10.614 1.00 0.00 H new ATOM 0 HB3 PHE A 127 0.444 1.763 9.327 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -0.092 4.251 12.089 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.407 3.383 7.930 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.053 6.478 11.699 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.371 5.608 7.537 1.00 0.00 H new ATOM 0 HZ PHE A 127 -1.697 7.160 9.421 1.00 0.00 H new ATOM 1953 N ALA A 128 -2.195 0.376 10.142 1.00 0.00 N ATOM 1954 CA ALA A 128 -3.572 0.190 9.707 1.00 0.00 C ATOM 1955 C ALA A 128 -4.498 -0.007 10.901 1.00 0.00 C ATOM 1956 O ALA A 128 -5.700 0.246 10.814 1.00 0.00 O ATOM 1957 CB ALA A 128 -3.670 -0.995 8.760 1.00 0.00 C ATOM 0 H ALA A 128 -1.547 -0.336 9.804 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.887 1.089 9.178 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.705 -1.123 8.443 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -3.042 -0.816 7.887 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -3.333 -1.897 9.270 1.00 0.00 H new ATOM 1963 N ALA A 129 -3.932 -0.458 12.017 1.00 0.00 N ATOM 1964 CA ALA A 129 -4.710 -0.689 13.229 1.00 0.00 C ATOM 1965 C ALA A 129 -5.066 0.627 13.913 1.00 0.00 C ATOM 1966 O ALA A 129 -6.054 0.712 14.641 1.00 0.00 O ATOM 1967 CB ALA A 129 -3.942 -1.592 14.184 1.00 0.00 C ATOM 0 H ALA A 129 -2.938 -0.670 12.107 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.639 -1.183 12.946 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.534 -1.756 15.084 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -3.744 -2.549 13.700 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -2.997 -1.119 14.452 1.00 0.00 H new ATOM 1973 N GLY A 130 -4.252 1.652 13.674 1.00 0.00 N ATOM 1974 CA GLY A 130 -4.498 2.951 14.273 1.00 0.00 C ATOM 1975 C GLY A 130 -5.531 3.754 13.506 1.00 0.00 C ATOM 1976 O GLY A 130 -5.964 4.814 13.958 1.00 0.00 O ATOM 0 H GLY A 130 -3.427 1.605 13.076 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -4.836 2.816 15.301 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -3.564 3.511 14.315 1.00 0.00 H new ATOM 1980 N HIS A 131 -5.925 3.245 12.343 1.00 0.00 N ATOM 1981 CA HIS A 131 -6.914 3.917 11.506 1.00 0.00 C ATOM 1982 C HIS A 131 -8.333 3.628 11.994 1.00 0.00 C ATOM 1983 O HIS A 131 -8.611 2.544 12.507 1.00 0.00 O ATOM 1984 CB HIS A 131 -6.762 3.473 10.050 1.00 0.00 C ATOM 1985 CG HIS A 131 -5.821 4.324 9.257 1.00 0.00 C ATOM 1986 ND1 HIS A 131 -6.118 5.613 8.869 1.00 0.00 N ATOM 1987 CD2 HIS A 131 -4.582 4.065 8.774 1.00 0.00 C ATOM 1988 CE1 HIS A 131 -5.105 6.109 8.182 1.00 0.00 C ATOM 1989 NE2 HIS A 131 -4.161 5.190 8.110 1.00 0.00 N ATOM 0 H HIS A 131 -5.574 2.368 11.958 1.00 0.00 H new ATOM 0 HA HIS A 131 -6.741 4.991 11.573 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.411 2.441 10.029 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -7.741 3.486 9.571 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -4.029 3.145 8.890 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -5.057 7.099 7.752 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -3.264 5.298 7.637 1.00 0.00 H new ATOM 1998 N PRO A 132 -9.251 4.602 11.844 1.00 0.00 N ATOM 1999 CA PRO A 132 -10.648 4.446 12.266 1.00 0.00 C ATOM 2000 C PRO A 132 -11.355 3.335 11.497 1.00 0.00 C ATOM 2001 O PRO A 132 -12.360 2.790 11.952 1.00 0.00 O ATOM 2002 CB PRO A 132 -11.285 5.806 11.948 1.00 0.00 C ATOM 2003 CG PRO A 132 -10.141 6.749 11.788 1.00 0.00 C ATOM 2004 CD PRO A 132 -9.000 5.930 11.259 1.00 0.00 C ATOM 0 HA PRO A 132 -10.725 4.168 13.317 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -11.884 5.757 11.039 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -11.949 6.126 12.751 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -10.394 7.556 11.100 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -9.881 7.212 12.740 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -8.997 5.898 10.169 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -8.036 6.333 11.569 1.00 0.00 H new ATOM 2012 N GLU A 133 -10.818 3.008 10.325 1.00 0.00 N ATOM 2013 CA GLU A 133 -11.385 1.960 9.484 1.00 0.00 C ATOM 2014 C GLU A 133 -10.542 0.695 9.563 1.00 0.00 C ATOM 2015 O GLU A 133 -10.669 -0.198 8.726 1.00 0.00 O ATOM 2016 CB GLU A 133 -11.485 2.432 8.034 1.00 0.00 C ATOM 2017 CG GLU A 133 -12.660 3.359 7.783 1.00 0.00 C ATOM 2018 CD GLU A 133 -12.413 4.322 6.638 1.00 0.00 C ATOM 2019 OE1 GLU A 133 -11.755 5.359 6.866 1.00 0.00 O ATOM 2020 OE2 GLU A 133 -12.877 4.039 5.514 1.00 0.00 O ATOM 0 H GLU A 133 -9.988 3.456 9.936 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.387 1.736 9.850 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -10.562 2.945 7.762 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.571 1.563 7.382 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.547 2.764 7.566 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -12.870 3.926 8.690 1.00 0.00 H new ATOM 2027 N ALA A 134 -9.677 0.636 10.572 1.00 0.00 N ATOM 2028 CA ALA A 134 -8.809 -0.516 10.779 1.00 0.00 C ATOM 2029 C ALA A 134 -9.559 -1.817 10.533 1.00 0.00 C ATOM 2030 O ALA A 134 -9.052 -2.718 9.870 1.00 0.00 O ATOM 2031 CB ALA A 134 -8.236 -0.496 12.188 1.00 0.00 C ATOM 0 H ALA A 134 -9.560 1.378 11.262 1.00 0.00 H new ATOM 0 HA ALA A 134 -7.990 -0.457 10.063 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -7.589 -1.362 12.330 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -7.658 0.417 12.333 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -9.050 -0.528 12.912 1.00 0.00 H new ATOM 2037 N ALA A 135 -10.767 -1.906 11.077 1.00 0.00 N ATOM 2038 CA ALA A 135 -11.595 -3.093 10.918 1.00 0.00 C ATOM 2039 C ALA A 135 -11.695 -3.523 9.456 1.00 0.00 C ATOM 2040 O ALA A 135 -11.523 -4.698 9.135 1.00 0.00 O ATOM 2041 CB ALA A 135 -12.982 -2.845 11.490 1.00 0.00 C ATOM 0 H ALA A 135 -11.195 -1.167 11.634 1.00 0.00 H new ATOM 0 HA ALA A 135 -11.119 -3.905 11.468 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -13.592 -3.740 11.365 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -12.901 -2.606 12.550 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -13.448 -2.012 10.965 1.00 0.00 H new ATOM 2047 N ALA A 136 -11.975 -2.570 8.573 1.00 0.00 N ATOM 2048 CA ALA A 136 -12.106 -2.867 7.151 1.00 0.00 C ATOM 2049 C ALA A 136 -10.754 -3.138 6.494 1.00 0.00 C ATOM 2050 O ALA A 136 -10.636 -4.010 5.634 1.00 0.00 O ATOM 2051 CB ALA A 136 -12.817 -1.726 6.439 1.00 0.00 C ATOM 0 H ALA A 136 -12.115 -1.589 8.816 1.00 0.00 H new ATOM 0 HA ALA A 136 -12.701 -3.776 7.061 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -12.909 -1.960 5.378 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -13.810 -1.592 6.868 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -12.243 -0.808 6.560 1.00 0.00 H new ATOM 2057 N ILE A 137 -9.739 -2.386 6.902 1.00 0.00 N ATOM 2058 CA ILE A 137 -8.400 -2.527 6.337 1.00 0.00 C ATOM 2059 C ILE A 137 -7.756 -3.883 6.639 1.00 0.00 C ATOM 2060 O ILE A 137 -7.305 -4.573 5.724 1.00 0.00 O ATOM 2061 CB ILE A 137 -7.470 -1.410 6.847 1.00 0.00 C ATOM 2062 CG1 ILE A 137 -8.004 -0.043 6.418 1.00 0.00 C ATOM 2063 CG2 ILE A 137 -6.053 -1.621 6.331 1.00 0.00 C ATOM 2064 CD1 ILE A 137 -7.286 1.121 7.065 1.00 0.00 C ATOM 0 H ILE A 137 -9.817 -1.670 7.624 1.00 0.00 H new ATOM 0 HA ILE A 137 -8.527 -2.452 5.257 1.00 0.00 H new ATOM 0 HB ILE A 137 -7.444 -1.445 7.936 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -7.920 0.046 5.335 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -9.065 0.015 6.661 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -5.409 -0.823 6.700 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.678 -2.582 6.682 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -6.057 -1.609 5.241 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -7.719 2.057 6.713 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -7.392 1.057 8.148 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -6.229 1.089 6.801 1.00 0.00 H new ATOM 2076 N TYR A 138 -7.712 -4.267 7.914 1.00 0.00 N ATOM 2077 CA TYR A 138 -7.083 -5.529 8.303 1.00 0.00 C ATOM 2078 C TYR A 138 -7.827 -6.730 7.727 1.00 0.00 C ATOM 2079 O TYR A 138 -7.209 -7.727 7.352 1.00 0.00 O ATOM 2080 CB TYR A 138 -6.985 -5.638 9.832 1.00 0.00 C ATOM 2081 CG TYR A 138 -8.158 -6.328 10.494 1.00 0.00 C ATOM 2082 CD1 TYR A 138 -9.279 -5.611 10.886 1.00 0.00 C ATOM 2083 CD2 TYR A 138 -8.139 -7.698 10.732 1.00 0.00 C ATOM 2084 CE1 TYR A 138 -10.350 -6.237 11.494 1.00 0.00 C ATOM 2085 CE2 TYR A 138 -9.206 -8.331 11.340 1.00 0.00 C ATOM 2086 CZ TYR A 138 -10.310 -7.597 11.719 1.00 0.00 C ATOM 2087 OH TYR A 138 -11.374 -8.223 12.326 1.00 0.00 O ATOM 0 H TYR A 138 -8.100 -3.729 8.689 1.00 0.00 H new ATOM 0 HA TYR A 138 -6.075 -5.534 7.888 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -6.073 -6.178 10.086 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -6.889 -4.635 10.249 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -9.315 -4.546 10.713 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -7.276 -8.277 10.437 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -11.215 -5.663 11.792 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -9.175 -9.396 11.518 1.00 0.00 H new ATOM 0 HH TYR A 138 -11.186 -9.181 12.409 1.00 0.00 H new ATOM 2097 N ARG A 139 -9.150 -6.637 7.655 1.00 0.00 N ATOM 2098 CA ARG A 139 -9.951 -7.728 7.115 1.00 0.00 C ATOM 2099 C ARG A 139 -9.786 -7.795 5.602 1.00 0.00 C ATOM 2100 O ARG A 139 -9.911 -8.861 4.998 1.00 0.00 O ATOM 2101 CB ARG A 139 -11.427 -7.553 7.485 1.00 0.00 C ATOM 2102 CG ARG A 139 -12.114 -6.408 6.760 1.00 0.00 C ATOM 2103 CD ARG A 139 -13.527 -6.194 7.276 1.00 0.00 C ATOM 2104 NE ARG A 139 -14.328 -7.413 7.201 1.00 0.00 N ATOM 2105 CZ ARG A 139 -15.582 -7.499 7.634 1.00 0.00 C ATOM 2106 NH1 ARG A 139 -16.179 -6.440 8.165 1.00 0.00 N ATOM 2107 NH2 ARG A 139 -16.242 -8.645 7.533 1.00 0.00 N ATOM 0 H ARG A 139 -9.686 -5.825 7.961 1.00 0.00 H new ATOM 0 HA ARG A 139 -9.602 -8.664 7.551 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -11.958 -8.479 7.266 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -11.505 -7.388 8.560 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.535 -5.494 6.890 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -12.143 -6.618 5.691 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -13.487 -5.850 8.309 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -14.009 -5.407 6.696 1.00 0.00 H new ATOM 0 HE ARG A 139 -13.901 -8.245 6.794 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -15.676 -5.556 8.242 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -17.141 -6.510 8.496 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -15.787 -9.461 7.123 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -17.204 -8.710 7.865 1.00 0.00 H new ATOM 2121 N ALA A 140 -9.502 -6.644 5.001 1.00 0.00 N ATOM 2122 CA ALA A 140 -9.304 -6.559 3.561 1.00 0.00 C ATOM 2123 C ALA A 140 -8.021 -7.269 3.147 1.00 0.00 C ATOM 2124 O ALA A 140 -7.947 -7.863 2.070 1.00 0.00 O ATOM 2125 CB ALA A 140 -9.274 -5.105 3.118 1.00 0.00 C ATOM 0 H ALA A 140 -9.404 -5.755 5.492 1.00 0.00 H new ATOM 0 HA ALA A 140 -10.140 -7.057 3.070 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -9.125 -5.056 2.039 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -10.219 -4.626 3.376 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.456 -4.588 3.621 1.00 0.00 H new ATOM 2131 N ILE A 141 -7.008 -7.205 4.009 1.00 0.00 N ATOM 2132 CA ILE A 141 -5.727 -7.846 3.733 1.00 0.00 C ATOM 2133 C ILE A 141 -5.671 -9.245 4.339 1.00 0.00 C ATOM 2134 O ILE A 141 -4.787 -10.038 4.012 1.00 0.00 O ATOM 2135 CB ILE A 141 -4.549 -7.019 4.280 1.00 0.00 C ATOM 2136 CG1 ILE A 141 -4.682 -6.835 5.794 1.00 0.00 C ATOM 2137 CG2 ILE A 141 -4.479 -5.670 3.579 1.00 0.00 C ATOM 2138 CD1 ILE A 141 -3.470 -6.197 6.437 1.00 0.00 C ATOM 0 H ILE A 141 -7.051 -6.716 4.903 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.639 -7.915 2.649 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.623 -7.558 4.081 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -5.558 -6.220 6.001 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.858 -7.807 6.255 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.641 -5.097 3.976 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -4.339 -5.823 2.509 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -5.406 -5.123 3.749 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -3.637 -6.099 7.510 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -2.594 -6.822 6.262 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -3.305 -5.211 6.003 1.00 0.00 H new ATOM 2150 N ASP A 142 -6.617 -9.540 5.224 1.00 0.00 N ATOM 2151 CA ASP A 142 -6.674 -10.843 5.879 1.00 0.00 C ATOM 2152 C ASP A 142 -6.933 -11.951 4.864 1.00 0.00 C ATOM 2153 O ASP A 142 -5.949 -12.552 4.381 1.00 0.00 O ATOM 2154 CB ASP A 142 -7.764 -10.852 6.952 1.00 0.00 C ATOM 2155 CG ASP A 142 -7.820 -12.164 7.709 1.00 0.00 C ATOM 2156 OD1 ASP A 142 -8.532 -13.083 7.254 1.00 0.00 O ATOM 2157 OD2 ASP A 142 -7.150 -12.273 8.758 1.00 0.00 O ATOM 2158 OXT ASP A 142 -8.116 -12.211 4.559 1.00 0.00 O ATOM 0 H ASP A 142 -7.355 -8.895 5.505 1.00 0.00 H new ATOM 0 HA ASP A 142 -5.709 -11.026 6.351 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -7.585 -10.038 7.654 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -8.731 -10.664 6.485 1.00 0.00 H new TER 2163 ASP A 142