USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1066 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 12 SER OG : rot 82:sc= 0.281 USER MOD Set 1.2: A 139 THR OG1 : rot 180:sc= 0.265 USER MOD Set 2.1: A 91 GLN : amide:sc= 0.871 K(o=0.7,f=-6.9!) USER MOD Set 2.2: A 100 ASN : amide:sc= -0.17 K(o=0.7,f=-3.6!) USER MOD Set 3.1: A 42 SER OG : rot 180:sc= 0.0126 USER MOD Set 3.2: A 66 THR OG1 : rot 68:sc= 0.448 USER MOD Set 4.1: A 19 ASN : amide:sc= 0.0568 K(o=0.38,f=-4.6) USER MOD Set 4.2: A 60 ASN : amide:sc= 0.324 K(o=0.38,f=-4.4!) USER MOD Set 5.1: A 27 LYS NZ :NH3+ 160:sc= 1.71 (180deg=1.12) USER MOD Set 5.2: A 126 SER OG : rot -72:sc= 1.75 USER MOD Set 6.1: A 4 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 116 ASN : amide:sc= -0.261 X(o=-0.26,f=-0.27) USER MOD Single : A 1 ALA N :NH3+ 157:sc= 0.843 (180deg=0.259) USER MOD Single : A 2 THR OG1 : rot 45:sc= 1.14 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 172:sc= 1.24 USER MOD Single : A 9 TYR OH : rot -61:sc= 0.569 USER MOD Single : A 11 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.28) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 GLN : amide:sc= -0.167 K(o=-0.17,f=-2.6!) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= -0.288 X(o=-0.29,f=-0.33) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 144:sc= 1.25 USER MOD Single : A 34 ASN :FLIP amide:sc= 0 F(o=-0.5,f=0) USER MOD Single : A 35 SER OG : rot -7:sc= 1.11 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -119:sc= 0.804 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.589 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0.0699 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0.065 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -40:sc= 0.236 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 1.1 K(o=1.1,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.275 X(o=-0.27,f=-0.011) USER MOD Single : A 62 TYR OH : rot 30:sc= 0 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.913 K(o=0.91,f=0) USER MOD Single : A 78 SER OG : rot 1:sc= 1.13 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0789) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -76:sc= 0.0264 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= -0.081 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 153:sc= -0.101 (180deg=-0.505) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.19 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -155:sc= 1.2 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc=-0.00589 K(o=-0.0059,f=-1.6) USER MOD Single : A 118 MET CE :methyl 176:sc= 0 (180deg=-0.0184) USER MOD Single : A 120 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.48) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 180:sc= -0.121 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -6.713 -25.111 -0.770 1.00 0.00 N ATOM 2 CA ALA A 1 -6.977 -23.681 -0.520 1.00 0.00 C ATOM 3 C ALA A 1 -5.840 -23.077 0.300 1.00 0.00 C ATOM 4 O ALA A 1 -5.215 -23.787 1.097 1.00 0.00 O ATOM 5 CB ALA A 1 -8.309 -23.465 0.194 1.00 0.00 C ATOM 0 H1 ALA A 1 -7.609 -25.600 -0.966 1.00 0.00 H new ATOM 0 H2 ALA A 1 -6.079 -25.209 -1.588 1.00 0.00 H new ATOM 0 H3 ALA A 1 -6.264 -25.533 0.068 1.00 0.00 H new ATOM 0 HA ALA A 1 -7.036 -23.181 -1.487 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -8.465 -22.399 0.359 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -9.119 -23.859 -0.420 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -8.296 -23.982 1.153 1.00 0.00 H new ATOM 11 N THR A 2 -5.586 -21.765 0.178 1.00 0.00 N ATOM 12 CA THR A 2 -4.783 -21.067 1.183 1.00 0.00 C ATOM 13 C THR A 2 -5.211 -19.603 1.289 1.00 0.00 C ATOM 14 O THR A 2 -5.614 -19.000 0.289 1.00 0.00 O ATOM 15 CB THR A 2 -3.281 -21.264 0.886 1.00 0.00 C ATOM 16 OG1 THR A 2 -2.419 -20.542 1.756 1.00 0.00 O ATOM 17 CG2 THR A 2 -2.878 -20.883 -0.544 1.00 0.00 C ATOM 0 H THR A 2 -5.918 -21.181 -0.589 1.00 0.00 H new ATOM 0 HA THR A 2 -4.959 -21.497 2.169 1.00 0.00 H new ATOM 0 HB THR A 2 -3.155 -22.336 1.041 1.00 0.00 H new ATOM 0 HG1 THR A 2 -2.728 -20.642 2.680 1.00 0.00 H new ATOM 0 HG21 THR A 2 -1.809 -21.048 -0.677 1.00 0.00 H new ATOM 0 HG22 THR A 2 -3.431 -21.498 -1.254 1.00 0.00 H new ATOM 0 HG23 THR A 2 -3.107 -19.832 -0.719 1.00 0.00 H new ATOM 25 N SER A 3 -5.039 -19.004 2.467 1.00 0.00 N ATOM 26 CA SER A 3 -5.220 -17.591 2.755 1.00 0.00 C ATOM 27 C SER A 3 -3.993 -17.079 3.506 1.00 0.00 C ATOM 28 O SER A 3 -3.822 -17.304 4.707 1.00 0.00 O ATOM 29 CB SER A 3 -6.514 -17.371 3.550 1.00 0.00 C ATOM 30 OG SER A 3 -7.539 -16.980 2.659 1.00 0.00 O ATOM 0 H SER A 3 -4.752 -19.529 3.293 1.00 0.00 H new ATOM 0 HA SER A 3 -5.317 -17.027 1.827 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.796 -18.286 4.071 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.363 -16.605 4.310 1.00 0.00 H new ATOM 0 HG SER A 3 -8.370 -16.839 3.158 1.00 0.00 H new ATOM 36 N THR A 4 -3.167 -16.306 2.802 1.00 0.00 N ATOM 37 CA THR A 4 -2.230 -15.402 3.443 1.00 0.00 C ATOM 38 C THR A 4 -3.063 -14.375 4.213 1.00 0.00 C ATOM 39 O THR A 4 -4.025 -13.821 3.667 1.00 0.00 O ATOM 40 CB THR A 4 -1.347 -14.747 2.370 1.00 0.00 C ATOM 41 OG1 THR A 4 -0.552 -15.729 1.737 1.00 0.00 O ATOM 42 CG2 THR A 4 -0.378 -13.707 2.936 1.00 0.00 C ATOM 0 H THR A 4 -3.133 -16.292 1.783 1.00 0.00 H new ATOM 0 HA THR A 4 -1.563 -15.917 4.134 1.00 0.00 H new ATOM 0 HB THR A 4 -2.036 -14.257 1.682 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.008 -15.306 1.053 1.00 0.00 H new ATOM 0 HG21 THR A 4 0.215 -13.283 2.126 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.942 -12.913 3.426 1.00 0.00 H new ATOM 0 HG23 THR A 4 0.284 -14.182 3.660 1.00 0.00 H new ATOM 50 N VAL A 5 -2.689 -14.110 5.458 1.00 0.00 N ATOM 51 CA VAL A 5 -3.258 -13.082 6.312 1.00 0.00 C ATOM 52 C VAL A 5 -2.064 -12.347 6.930 1.00 0.00 C ATOM 53 O VAL A 5 -1.063 -12.977 7.270 1.00 0.00 O ATOM 54 CB VAL A 5 -4.216 -13.735 7.331 1.00 0.00 C ATOM 55 CG1 VAL A 5 -5.530 -14.140 6.644 1.00 0.00 C ATOM 56 CG2 VAL A 5 -3.599 -14.963 8.025 1.00 0.00 C ATOM 0 H VAL A 5 -1.945 -14.633 5.920 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.872 -12.355 5.781 1.00 0.00 H new ATOM 0 HB VAL A 5 -4.411 -12.987 8.100 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -6.196 -14.599 7.375 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -6.008 -13.256 6.223 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -5.319 -14.853 5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.317 -15.381 8.730 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -3.345 -15.714 7.277 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.697 -14.664 8.559 1.00 0.00 H new ATOM 66 N THR A 6 -2.110 -11.018 7.002 1.00 0.00 N ATOM 67 CA THR A 6 -0.939 -10.205 7.307 1.00 0.00 C ATOM 68 C THR A 6 -1.330 -9.094 8.291 1.00 0.00 C ATOM 69 O THR A 6 -2.522 -8.855 8.522 1.00 0.00 O ATOM 70 CB THR A 6 -0.278 -9.776 5.981 1.00 0.00 C ATOM 71 OG1 THR A 6 0.934 -9.095 6.211 1.00 0.00 O ATOM 72 CG2 THR A 6 -1.177 -8.978 5.031 1.00 0.00 C ATOM 0 H THR A 6 -2.961 -10.477 6.850 1.00 0.00 H new ATOM 0 HA THR A 6 -0.160 -10.755 7.836 1.00 0.00 H new ATOM 0 HB THR A 6 -0.078 -10.713 5.461 1.00 0.00 H new ATOM 0 HG1 THR A 6 1.392 -8.945 5.358 1.00 0.00 H new ATOM 0 HG21 THR A 6 -0.619 -8.725 4.129 1.00 0.00 H new ATOM 0 HG22 THR A 6 -2.047 -9.578 4.763 1.00 0.00 H new ATOM 0 HG23 THR A 6 -1.505 -8.063 5.524 1.00 0.00 H new ATOM 80 N GLY A 7 -0.332 -8.483 8.931 1.00 0.00 N ATOM 81 CA GLY A 7 -0.491 -7.548 10.034 1.00 0.00 C ATOM 82 C GLY A 7 0.704 -6.608 10.058 1.00 0.00 C ATOM 83 O GLY A 7 1.702 -6.873 10.740 1.00 0.00 O ATOM 0 H GLY A 7 0.645 -8.635 8.682 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.415 -6.981 9.917 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.565 -8.088 10.978 1.00 0.00 H new ATOM 87 N GLY A 8 0.639 -5.550 9.255 1.00 0.00 N ATOM 88 CA GLY A 8 1.706 -4.595 9.067 1.00 0.00 C ATOM 89 C GLY A 8 1.202 -3.169 8.904 1.00 0.00 C ATOM 90 O GLY A 8 0.030 -2.912 8.613 1.00 0.00 O ATOM 0 H GLY A 8 -0.190 -5.334 8.702 1.00 0.00 H new ATOM 0 HA2 GLY A 8 2.382 -4.641 9.921 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.285 -4.873 8.186 1.00 0.00 H new ATOM 94 N TYR A 9 2.145 -2.239 9.032 1.00 0.00 N ATOM 95 CA TYR A 9 1.905 -0.806 9.057 1.00 0.00 C ATOM 96 C TYR A 9 2.114 -0.205 7.671 1.00 0.00 C ATOM 97 O TYR A 9 2.787 -0.801 6.819 1.00 0.00 O ATOM 98 CB TYR A 9 2.774 -0.138 10.138 1.00 0.00 C ATOM 99 CG TYR A 9 1.925 0.336 11.299 1.00 0.00 C ATOM 100 CD1 TYR A 9 1.424 -0.588 12.236 1.00 0.00 C ATOM 101 CD2 TYR A 9 1.519 1.680 11.360 1.00 0.00 C ATOM 102 CE1 TYR A 9 0.516 -0.170 13.224 1.00 0.00 C ATOM 103 CE2 TYR A 9 0.583 2.095 12.318 1.00 0.00 C ATOM 104 CZ TYR A 9 0.063 1.166 13.242 1.00 0.00 C ATOM 105 OH TYR A 9 -0.913 1.549 14.108 1.00 0.00 O ATOM 0 H TYR A 9 3.133 -2.476 9.124 1.00 0.00 H new ATOM 0 HA TYR A 9 0.866 -0.616 9.325 1.00 0.00 H new ATOM 0 HB2 TYR A 9 3.523 -0.844 10.495 1.00 0.00 H new ATOM 0 HB3 TYR A 9 3.312 0.707 9.707 1.00 0.00 H new ATOM 0 HD1 TYR A 9 1.738 -1.620 12.195 1.00 0.00 H new ATOM 0 HD2 TYR A 9 1.930 2.397 10.665 1.00 0.00 H new ATOM 0 HE1 TYR A 9 0.166 -0.870 13.968 1.00 0.00 H new ATOM 0 HE2 TYR A 9 0.261 3.125 12.348 1.00 0.00 H new ATOM 0 HH TYR A 9 -1.729 1.037 13.928 1.00 0.00 H new ATOM 115 N ALA A 10 1.525 0.968 7.446 1.00 0.00 N ATOM 116 CA ALA A 10 1.697 1.779 6.252 1.00 0.00 C ATOM 117 C ALA A 10 2.304 3.119 6.655 1.00 0.00 C ATOM 118 O ALA A 10 1.689 3.877 7.409 1.00 0.00 O ATOM 119 CB ALA A 10 0.350 1.965 5.557 1.00 0.00 C ATOM 0 H ALA A 10 0.890 1.393 8.121 1.00 0.00 H new ATOM 0 HA ALA A 10 2.369 1.286 5.549 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.483 2.573 4.662 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -0.053 0.991 5.277 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -0.343 2.463 6.235 1.00 0.00 H new ATOM 125 N GLN A 11 3.511 3.399 6.165 1.00 0.00 N ATOM 126 CA GLN A 11 4.213 4.662 6.356 1.00 0.00 C ATOM 127 C GLN A 11 4.252 5.394 5.011 1.00 0.00 C ATOM 128 O GLN A 11 4.438 4.736 3.981 1.00 0.00 O ATOM 129 CB GLN A 11 5.609 4.387 6.969 1.00 0.00 C ATOM 130 CG GLN A 11 6.681 3.840 6.009 1.00 0.00 C ATOM 131 CD GLN A 11 8.103 3.871 6.588 1.00 0.00 C ATOM 132 OE1 GLN A 11 8.334 3.686 7.781 1.00 0.00 O ATOM 133 NE2 GLN A 11 9.115 4.053 5.760 1.00 0.00 N ATOM 0 H GLN A 11 4.042 2.730 5.607 1.00 0.00 H new ATOM 0 HA GLN A 11 3.700 5.314 7.063 1.00 0.00 H new ATOM 0 HB2 GLN A 11 5.981 5.315 7.403 1.00 0.00 H new ATOM 0 HB3 GLN A 11 5.489 3.677 7.788 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.429 2.813 5.744 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.661 4.421 5.087 1.00 0.00 H new ATOM 0 HE21 GLN A 11 8.940 4.208 4.767 1.00 0.00 H new ATOM 0 HE22 GLN A 11 10.072 4.039 6.113 1.00 0.00 H new ATOM 142 N SER A 12 4.058 6.717 4.985 1.00 0.00 N ATOM 143 CA SER A 12 4.595 7.513 3.881 1.00 0.00 C ATOM 144 C SER A 12 5.139 8.845 4.409 1.00 0.00 C ATOM 145 O SER A 12 4.353 9.716 4.780 1.00 0.00 O ATOM 146 CB SER A 12 3.491 7.701 2.826 1.00 0.00 C ATOM 147 OG SER A 12 4.016 8.168 1.600 1.00 0.00 O ATOM 0 H SER A 12 3.549 7.245 5.694 1.00 0.00 H new ATOM 0 HA SER A 12 5.432 7.000 3.407 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.976 6.754 2.665 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.749 8.408 3.197 1.00 0.00 H new ATOM 0 HG SER A 12 4.375 7.413 1.089 1.00 0.00 H new ATOM 153 N ASP A 13 6.447 9.085 4.338 1.00 0.00 N ATOM 154 CA ASP A 13 7.074 10.332 4.780 1.00 0.00 C ATOM 155 C ASP A 13 7.836 10.918 3.608 1.00 0.00 C ATOM 156 O ASP A 13 8.332 10.186 2.743 1.00 0.00 O ATOM 157 CB ASP A 13 8.035 10.156 5.963 1.00 0.00 C ATOM 158 CG ASP A 13 7.337 9.917 7.295 1.00 0.00 C ATOM 159 OD1 ASP A 13 6.450 10.704 7.664 1.00 0.00 O ATOM 160 OD2 ASP A 13 7.673 8.897 7.947 1.00 0.00 O ATOM 0 H ASP A 13 7.113 8.408 3.966 1.00 0.00 H new ATOM 0 HA ASP A 13 6.278 10.991 5.126 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.700 9.317 5.757 1.00 0.00 H new ATOM 0 HB3 ASP A 13 8.660 11.045 6.046 1.00 0.00 H new ATOM 165 N ALA A 14 7.936 12.246 3.594 1.00 0.00 N ATOM 166 CA ALA A 14 8.340 13.011 2.436 1.00 0.00 C ATOM 167 C ALA A 14 9.176 14.210 2.881 1.00 0.00 C ATOM 168 O ALA A 14 8.916 14.759 3.955 1.00 0.00 O ATOM 169 CB ALA A 14 7.055 13.469 1.735 1.00 0.00 C ATOM 0 H ALA A 14 7.732 12.824 4.409 1.00 0.00 H new ATOM 0 HA ALA A 14 8.951 12.418 1.756 1.00 0.00 H new ATOM 0 HB1 ALA A 14 7.311 14.053 0.851 1.00 0.00 H new ATOM 0 HB2 ALA A 14 6.472 12.597 1.438 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.467 14.083 2.417 1.00 0.00 H new ATOM 175 N GLN A 15 10.101 14.661 2.027 1.00 0.00 N ATOM 176 CA GLN A 15 10.920 15.869 2.177 1.00 0.00 C ATOM 177 C GLN A 15 10.060 17.145 2.117 1.00 0.00 C ATOM 178 O GLN A 15 10.125 17.929 1.159 1.00 0.00 O ATOM 179 CB GLN A 15 12.032 15.863 1.106 1.00 0.00 C ATOM 180 CG GLN A 15 13.268 15.066 1.539 1.00 0.00 C ATOM 181 CD GLN A 15 14.182 15.907 2.431 1.00 0.00 C ATOM 182 OE1 GLN A 15 14.936 16.748 1.938 1.00 0.00 O ATOM 183 NE2 GLN A 15 14.138 15.709 3.737 1.00 0.00 N ATOM 0 H GLN A 15 10.310 14.163 1.162 1.00 0.00 H new ATOM 0 HA GLN A 15 11.388 15.867 3.162 1.00 0.00 H new ATOM 0 HB2 GLN A 15 11.638 15.440 0.182 1.00 0.00 H new ATOM 0 HB3 GLN A 15 12.325 16.890 0.887 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.957 14.169 2.075 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.818 14.736 0.658 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.507 15.008 4.126 1.00 0.00 H new ATOM 0 HE22 GLN A 15 14.735 16.257 4.356 1.00 0.00 H new ATOM 192 N GLY A 16 9.241 17.347 3.146 1.00 0.00 N ATOM 193 CA GLY A 16 8.397 18.507 3.355 1.00 0.00 C ATOM 194 C GLY A 16 7.123 18.153 4.106 1.00 0.00 C ATOM 195 O GLY A 16 6.408 19.065 4.524 1.00 0.00 O ATOM 0 H GLY A 16 9.148 16.662 3.896 1.00 0.00 H new ATOM 0 HA2 GLY A 16 8.950 19.262 3.914 1.00 0.00 H new ATOM 0 HA3 GLY A 16 8.140 18.947 2.392 1.00 0.00 H new ATOM 199 N GLN A 17 6.817 16.861 4.266 1.00 0.00 N ATOM 200 CA GLN A 17 5.647 16.372 4.971 1.00 0.00 C ATOM 201 C GLN A 17 5.989 14.998 5.559 1.00 0.00 C ATOM 202 O GLN A 17 5.888 13.967 4.888 1.00 0.00 O ATOM 203 CB GLN A 17 4.454 16.319 3.994 1.00 0.00 C ATOM 204 CG GLN A 17 3.470 17.498 4.119 1.00 0.00 C ATOM 205 CD GLN A 17 2.631 17.458 5.403 1.00 0.00 C ATOM 206 OE1 GLN A 17 2.995 16.848 6.405 1.00 0.00 O ATOM 207 NE2 GLN A 17 1.478 18.113 5.416 1.00 0.00 N ATOM 0 H GLN A 17 7.400 16.111 3.894 1.00 0.00 H new ATOM 0 HA GLN A 17 5.362 17.033 5.790 1.00 0.00 H new ATOM 0 HB2 GLN A 17 4.838 16.289 2.974 1.00 0.00 H new ATOM 0 HB3 GLN A 17 3.909 15.389 4.157 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.029 18.433 4.088 1.00 0.00 H new ATOM 0 HG3 GLN A 17 2.802 17.497 3.257 1.00 0.00 H new ATOM 0 HE21 GLN A 17 1.171 18.621 4.587 1.00 0.00 H new ATOM 0 HE22 GLN A 17 0.898 18.109 6.255 1.00 0.00 H new ATOM 216 N MET A 18 6.382 14.972 6.830 1.00 0.00 N ATOM 217 CA MET A 18 6.622 13.764 7.607 1.00 0.00 C ATOM 218 C MET A 18 5.281 13.301 8.182 1.00 0.00 C ATOM 219 O MET A 18 5.018 13.432 9.386 1.00 0.00 O ATOM 220 CB MET A 18 7.673 14.010 8.697 1.00 0.00 C ATOM 221 CG MET A 18 9.055 14.289 8.102 1.00 0.00 C ATOM 222 SD MET A 18 10.329 14.564 9.357 1.00 0.00 S ATOM 223 CE MET A 18 11.783 14.609 8.278 1.00 0.00 C ATOM 0 H MET A 18 6.548 15.825 7.365 1.00 0.00 H new ATOM 0 HA MET A 18 7.030 12.976 6.974 1.00 0.00 H new ATOM 0 HB2 MET A 18 7.366 14.854 9.314 1.00 0.00 H new ATOM 0 HB3 MET A 18 7.728 13.140 9.352 1.00 0.00 H new ATOM 0 HG2 MET A 18 9.349 13.449 7.473 1.00 0.00 H new ATOM 0 HG3 MET A 18 8.995 15.165 7.456 1.00 0.00 H new ATOM 0 HE1 MET A 18 12.677 14.772 8.879 1.00 0.00 H new ATOM 0 HE2 MET A 18 11.871 13.662 7.746 1.00 0.00 H new ATOM 0 HE3 MET A 18 11.677 15.421 7.558 1.00 0.00 H new ATOM 233 N ASN A 19 4.408 12.855 7.281 1.00 0.00 N ATOM 234 CA ASN A 19 3.122 12.221 7.550 1.00 0.00 C ATOM 235 C ASN A 19 3.344 10.871 8.212 1.00 0.00 C ATOM 236 O ASN A 19 3.541 9.865 7.532 1.00 0.00 O ATOM 237 CB ASN A 19 2.305 12.060 6.263 1.00 0.00 C ATOM 238 CG ASN A 19 1.828 13.393 5.729 1.00 0.00 C ATOM 239 OD1 ASN A 19 1.205 14.173 6.446 1.00 0.00 O ATOM 240 ND2 ASN A 19 2.140 13.715 4.487 1.00 0.00 N ATOM 0 H ASN A 19 4.593 12.932 6.281 1.00 0.00 H new ATOM 0 HA ASN A 19 2.555 12.862 8.225 1.00 0.00 H new ATOM 0 HB2 ASN A 19 2.912 11.562 5.507 1.00 0.00 H new ATOM 0 HB3 ASN A 19 1.446 11.417 6.456 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.864 14.622 4.110 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.657 13.057 3.904 1.00 0.00 H new ATOM 247 N LYS A 20 3.277 10.837 9.545 1.00 0.00 N ATOM 248 CA LYS A 20 3.579 9.644 10.324 1.00 0.00 C ATOM 249 C LYS A 20 2.703 8.488 9.866 1.00 0.00 C ATOM 250 O LYS A 20 1.573 8.691 9.418 1.00 0.00 O ATOM 251 CB LYS A 20 3.360 9.937 11.813 1.00 0.00 C ATOM 252 CG LYS A 20 4.490 10.798 12.395 1.00 0.00 C ATOM 253 CD LYS A 20 4.020 11.556 13.642 1.00 0.00 C ATOM 254 CE LYS A 20 5.228 12.186 14.345 1.00 0.00 C ATOM 255 NZ LYS A 20 5.118 13.649 14.495 1.00 0.00 N ATOM 0 H LYS A 20 3.010 11.642 10.112 1.00 0.00 H new ATOM 0 HA LYS A 20 4.621 9.363 10.172 1.00 0.00 H new ATOM 0 HB2 LYS A 20 2.407 10.449 11.947 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.298 8.998 12.363 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.340 10.165 12.649 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.835 11.507 11.643 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.305 12.330 13.362 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.505 10.876 14.321 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.342 11.734 15.330 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.131 11.952 13.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.965 14.013 14.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 5.038 14.089 13.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.274 13.878 15.058 1.00 0.00 H new ATOM 269 N MET A 21 3.226 7.280 10.041 1.00 0.00 N ATOM 270 CA MET A 21 2.540 6.017 9.844 1.00 0.00 C ATOM 271 C MET A 21 1.346 5.918 10.795 1.00 0.00 C ATOM 272 O MET A 21 1.453 5.416 11.913 1.00 0.00 O ATOM 273 CB MET A 21 3.543 4.846 9.930 1.00 0.00 C ATOM 274 CG MET A 21 4.292 4.571 11.240 1.00 0.00 C ATOM 275 SD MET A 21 5.400 5.890 11.815 1.00 0.00 S ATOM 276 CE MET A 21 6.385 4.922 12.986 1.00 0.00 C ATOM 0 H MET A 21 4.193 7.153 10.340 1.00 0.00 H new ATOM 0 HA MET A 21 2.118 5.958 8.841 1.00 0.00 H new ATOM 0 HB2 MET A 21 3.002 3.936 9.669 1.00 0.00 H new ATOM 0 HB3 MET A 21 4.293 5.004 9.155 1.00 0.00 H new ATOM 0 HG2 MET A 21 3.558 4.374 12.021 1.00 0.00 H new ATOM 0 HG3 MET A 21 4.877 3.660 11.116 1.00 0.00 H new ATOM 0 HE1 MET A 21 7.133 5.565 13.451 1.00 0.00 H new ATOM 0 HE2 MET A 21 5.733 4.509 13.756 1.00 0.00 H new ATOM 0 HE3 MET A 21 6.883 4.109 12.458 1.00 0.00 H new ATOM 286 N GLY A 22 0.208 6.447 10.367 1.00 0.00 N ATOM 287 CA GLY A 22 -1.078 6.394 11.043 1.00 0.00 C ATOM 288 C GLY A 22 -2.024 5.582 10.175 1.00 0.00 C ATOM 289 O GLY A 22 -3.151 6.007 9.931 1.00 0.00 O ATOM 0 H GLY A 22 0.157 6.955 9.484 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.974 5.936 12.027 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.470 7.399 11.199 1.00 0.00 H new ATOM 293 N GLY A 23 -1.539 4.461 9.639 1.00 0.00 N ATOM 294 CA GLY A 23 -2.270 3.593 8.747 1.00 0.00 C ATOM 295 C GLY A 23 -1.658 2.204 8.757 1.00 0.00 C ATOM 296 O GLY A 23 -0.533 2.001 9.216 1.00 0.00 O ATOM 0 H GLY A 23 -0.592 4.131 9.828 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.315 3.541 9.052 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.253 4.000 7.736 1.00 0.00 H new ATOM 300 N PHE A 24 -2.398 1.256 8.209 1.00 0.00 N ATOM 301 CA PHE A 24 -2.089 -0.155 8.130 1.00 0.00 C ATOM 302 C PHE A 24 -2.015 -0.555 6.662 1.00 0.00 C ATOM 303 O PHE A 24 -2.315 0.234 5.764 1.00 0.00 O ATOM 304 CB PHE A 24 -3.187 -0.946 8.850 1.00 0.00 C ATOM 305 CG PHE A 24 -3.238 -0.714 10.343 1.00 0.00 C ATOM 306 CD1 PHE A 24 -2.420 -1.485 11.187 1.00 0.00 C ATOM 307 CD2 PHE A 24 -4.122 0.233 10.897 1.00 0.00 C ATOM 308 CE1 PHE A 24 -2.506 -1.328 12.578 1.00 0.00 C ATOM 309 CE2 PHE A 24 -4.224 0.366 12.292 1.00 0.00 C ATOM 310 CZ PHE A 24 -3.413 -0.412 13.134 1.00 0.00 C ATOM 0 H PHE A 24 -3.296 1.472 7.777 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.132 -0.369 8.607 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -4.152 -0.681 8.419 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -3.035 -2.009 8.663 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -1.726 -2.197 10.765 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -4.721 0.856 10.250 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -1.871 -1.915 13.225 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -4.927 1.067 12.717 1.00 0.00 H new ATOM 0 HZ PHE A 24 -3.487 -0.306 14.206 1.00 0.00 H new ATOM 320 N ASN A 25 -1.627 -1.800 6.416 1.00 0.00 N ATOM 321 CA ASN A 25 -1.916 -2.486 5.168 1.00 0.00 C ATOM 322 C ASN A 25 -2.655 -3.778 5.497 1.00 0.00 C ATOM 323 O ASN A 25 -2.606 -4.266 6.632 1.00 0.00 O ATOM 324 CB ASN A 25 -0.635 -2.743 4.355 1.00 0.00 C ATOM 325 CG ASN A 25 0.143 -3.952 4.858 1.00 0.00 C ATOM 326 OD1 ASN A 25 -0.156 -5.085 4.502 1.00 0.00 O ATOM 327 ND2 ASN A 25 1.132 -3.755 5.711 1.00 0.00 N ATOM 0 H ASN A 25 -1.100 -2.364 7.083 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.547 -1.860 4.537 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.897 -2.894 3.308 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.003 -1.860 4.400 1.00 0.00 H new ATOM 0 HD21 ASN A 25 1.654 -4.550 6.079 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.374 -2.808 6.002 1.00 0.00 H new ATOM 334 N LEU A 26 -3.293 -4.366 4.496 1.00 0.00 N ATOM 335 CA LEU A 26 -3.694 -5.763 4.439 1.00 0.00 C ATOM 336 C LEU A 26 -3.502 -6.190 2.980 1.00 0.00 C ATOM 337 O LEU A 26 -3.194 -5.348 2.129 1.00 0.00 O ATOM 338 CB LEU A 26 -5.142 -5.944 4.946 1.00 0.00 C ATOM 339 CG LEU A 26 -5.263 -7.029 6.036 1.00 0.00 C ATOM 340 CD1 LEU A 26 -6.657 -6.998 6.668 1.00 0.00 C ATOM 341 CD2 LEU A 26 -4.989 -8.440 5.511 1.00 0.00 C ATOM 0 H LEU A 26 -3.559 -3.853 3.656 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.094 -6.395 5.094 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.504 -4.995 5.342 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.786 -6.206 4.106 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.500 -6.797 6.780 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.726 -7.769 7.435 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.830 -6.021 7.119 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.409 -7.181 5.900 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.090 -9.157 6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -5.704 -8.681 4.725 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.977 -8.488 5.108 1.00 0.00 H new ATOM 353 N LYS A 27 -3.630 -7.486 2.691 1.00 0.00 N ATOM 354 CA LYS A 27 -3.652 -8.049 1.343 1.00 0.00 C ATOM 355 C LYS A 27 -4.640 -9.211 1.354 1.00 0.00 C ATOM 356 O LYS A 27 -4.907 -9.788 2.419 1.00 0.00 O ATOM 357 CB LYS A 27 -2.247 -8.521 0.911 1.00 0.00 C ATOM 358 CG LYS A 27 -1.309 -7.355 0.561 1.00 0.00 C ATOM 359 CD LYS A 27 0.071 -7.836 0.103 1.00 0.00 C ATOM 360 CE LYS A 27 0.960 -6.618 -0.186 1.00 0.00 C ATOM 361 NZ LYS A 27 2.391 -6.970 -0.222 1.00 0.00 N ATOM 0 H LYS A 27 -3.724 -8.197 3.416 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.960 -7.292 0.622 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.804 -9.110 1.714 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.339 -9.179 0.047 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.761 -6.752 -0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.196 -6.709 1.432 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.526 -8.459 0.873 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -0.024 -8.452 -0.791 1.00 0.00 H new ATOM 0 HE2 LYS A 27 0.672 -6.178 -1.141 1.00 0.00 H new ATOM 0 HE3 LYS A 27 0.793 -5.859 0.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.916 -6.235 -0.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.756 -7.040 0.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.512 -7.884 -0.703 1.00 0.00 H new ATOM 375 N TYR A 28 -5.082 -9.644 0.176 1.00 0.00 N ATOM 376 CA TYR A 28 -5.810 -10.890 -0.022 1.00 0.00 C ATOM 377 C TYR A 28 -5.282 -11.564 -1.283 1.00 0.00 C ATOM 378 O TYR A 28 -5.020 -10.873 -2.276 1.00 0.00 O ATOM 379 CB TYR A 28 -7.307 -10.614 -0.155 1.00 0.00 C ATOM 380 CG TYR A 28 -8.144 -11.871 -0.028 1.00 0.00 C ATOM 381 CD1 TYR A 28 -8.437 -12.667 -1.150 1.00 0.00 C ATOM 382 CD2 TYR A 28 -8.600 -12.264 1.240 1.00 0.00 C ATOM 383 CE1 TYR A 28 -9.190 -13.846 -1.000 1.00 0.00 C ATOM 384 CE2 TYR A 28 -9.355 -13.435 1.400 1.00 0.00 C ATOM 385 CZ TYR A 28 -9.657 -14.231 0.279 1.00 0.00 C ATOM 386 OH TYR A 28 -10.420 -15.343 0.446 1.00 0.00 O ATOM 0 H TYR A 28 -4.939 -9.123 -0.689 1.00 0.00 H new ATOM 0 HA TYR A 28 -5.663 -11.545 0.837 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -7.611 -9.901 0.611 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -7.503 -10.148 -1.121 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -8.084 -12.373 -2.127 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -8.367 -11.657 2.103 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.412 -14.458 -1.862 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -9.704 -13.725 2.380 1.00 0.00 H new ATOM 0 HH TYR A 28 -10.644 -15.446 1.394 1.00 0.00 H new ATOM 396 N ARG A 29 -5.134 -12.892 -1.249 1.00 0.00 N ATOM 397 CA ARG A 29 -4.744 -13.725 -2.382 1.00 0.00 C ATOM 398 C ARG A 29 -5.596 -14.988 -2.331 1.00 0.00 C ATOM 399 O ARG A 29 -5.591 -15.654 -1.299 1.00 0.00 O ATOM 400 CB ARG A 29 -3.235 -14.039 -2.274 1.00 0.00 C ATOM 401 CG ARG A 29 -2.681 -14.943 -3.394 1.00 0.00 C ATOM 402 CD ARG A 29 -2.639 -16.436 -3.022 1.00 0.00 C ATOM 403 NE ARG A 29 -2.362 -17.280 -4.197 1.00 0.00 N ATOM 404 CZ ARG A 29 -1.224 -17.908 -4.512 1.00 0.00 C ATOM 405 NH1 ARG A 29 -0.166 -17.842 -3.711 1.00 0.00 N ATOM 406 NH2 ARG A 29 -1.134 -18.570 -5.658 1.00 0.00 N ATOM 0 H ARG A 29 -5.289 -13.433 -0.398 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.907 -13.225 -3.337 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -2.682 -13.100 -2.277 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.046 -14.517 -1.313 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -3.294 -14.817 -4.286 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -1.674 -14.613 -3.650 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.872 -16.602 -2.265 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -3.591 -16.728 -2.580 1.00 0.00 H new ATOM 0 HE ARG A 29 -3.134 -17.401 -4.852 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.216 -17.308 -2.844 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.696 -18.326 -3.963 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.931 -18.598 -6.294 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -0.268 -19.051 -5.903 1.00 0.00 H new ATOM 420 N TYR A 30 -6.222 -15.380 -3.440 1.00 0.00 N ATOM 421 CA TYR A 30 -6.776 -16.728 -3.593 1.00 0.00 C ATOM 422 C TYR A 30 -5.747 -17.532 -4.386 1.00 0.00 C ATOM 423 O TYR A 30 -4.980 -16.942 -5.158 1.00 0.00 O ATOM 424 CB TYR A 30 -8.152 -16.703 -4.303 1.00 0.00 C ATOM 425 CG TYR A 30 -8.191 -16.680 -5.834 1.00 0.00 C ATOM 426 CD1 TYR A 30 -7.620 -15.620 -6.564 1.00 0.00 C ATOM 427 CD2 TYR A 30 -8.858 -17.706 -6.539 1.00 0.00 C ATOM 428 CE1 TYR A 30 -7.693 -15.599 -7.970 1.00 0.00 C ATOM 429 CE2 TYR A 30 -8.969 -17.672 -7.943 1.00 0.00 C ATOM 430 CZ TYR A 30 -8.375 -16.618 -8.669 1.00 0.00 C ATOM 431 OH TYR A 30 -8.509 -16.507 -10.020 1.00 0.00 O ATOM 0 H TYR A 30 -6.360 -14.779 -4.253 1.00 0.00 H new ATOM 0 HA TYR A 30 -6.958 -17.185 -2.620 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -8.711 -17.578 -3.972 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.692 -15.826 -3.946 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -7.122 -14.817 -6.041 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -9.290 -18.531 -5.992 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -7.223 -14.796 -8.518 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -9.507 -18.451 -8.462 1.00 0.00 H new ATOM 0 HH TYR A 30 -8.449 -17.396 -10.429 1.00 0.00 H new ATOM 441 N GLU A 31 -5.672 -18.848 -4.192 1.00 0.00 N ATOM 442 CA GLU A 31 -5.170 -19.706 -5.262 1.00 0.00 C ATOM 443 C GLU A 31 -6.377 -20.072 -6.123 1.00 0.00 C ATOM 444 O GLU A 31 -7.465 -20.282 -5.584 1.00 0.00 O ATOM 445 CB GLU A 31 -4.444 -20.939 -4.702 1.00 0.00 C ATOM 446 CG GLU A 31 -5.307 -21.829 -3.789 1.00 0.00 C ATOM 447 CD GLU A 31 -4.584 -23.086 -3.303 1.00 0.00 C ATOM 448 OE1 GLU A 31 -3.335 -23.159 -3.377 1.00 0.00 O ATOM 449 OE2 GLU A 31 -5.295 -23.988 -2.808 1.00 0.00 O ATOM 0 H GLU A 31 -5.942 -19.330 -3.335 1.00 0.00 H new ATOM 0 HA GLU A 31 -4.422 -19.192 -5.865 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -4.080 -21.540 -5.535 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.569 -20.607 -4.143 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -5.628 -21.247 -2.925 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -6.208 -22.123 -4.328 1.00 0.00 H new ATOM 456 N GLU A 32 -6.207 -20.107 -7.445 1.00 0.00 N ATOM 457 CA GLU A 32 -7.249 -20.602 -8.328 1.00 0.00 C ATOM 458 C GLU A 32 -7.243 -22.117 -8.219 1.00 0.00 C ATOM 459 O GLU A 32 -6.186 -22.746 -8.297 1.00 0.00 O ATOM 460 CB GLU A 32 -7.014 -20.095 -9.760 1.00 0.00 C ATOM 461 CG GLU A 32 -8.142 -20.526 -10.710 1.00 0.00 C ATOM 462 CD GLU A 32 -8.236 -19.640 -11.954 1.00 0.00 C ATOM 463 OE1 GLU A 32 -8.463 -18.419 -11.789 1.00 0.00 O ATOM 464 OE2 GLU A 32 -8.088 -20.171 -13.084 1.00 0.00 O ATOM 0 H GLU A 32 -5.359 -19.799 -7.921 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.235 -20.233 -8.044 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -6.940 -19.008 -9.753 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.062 -20.477 -10.129 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.979 -21.559 -11.016 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.092 -20.498 -10.176 1.00 0.00 H new ATOM 471 N ASP A 33 -8.407 -22.737 -8.054 1.00 0.00 N ATOM 472 CA ASP A 33 -8.455 -24.177 -7.820 1.00 0.00 C ATOM 473 C ASP A 33 -8.173 -24.978 -9.095 1.00 0.00 C ATOM 474 O ASP A 33 -8.165 -26.208 -9.088 1.00 0.00 O ATOM 475 CB ASP A 33 -9.782 -24.583 -7.170 1.00 0.00 C ATOM 476 CG ASP A 33 -9.601 -25.806 -6.267 1.00 0.00 C ATOM 477 OD1 ASP A 33 -8.571 -25.896 -5.555 1.00 0.00 O ATOM 478 OD2 ASP A 33 -10.525 -26.643 -6.197 1.00 0.00 O ATOM 0 H ASP A 33 -9.316 -22.275 -8.077 1.00 0.00 H new ATOM 0 HA ASP A 33 -7.656 -24.422 -7.120 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -10.174 -23.751 -6.586 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -10.517 -24.804 -7.944 1.00 0.00 H new ATOM 483 N ASN A 34 -7.916 -24.301 -10.216 1.00 0.00 N ATOM 484 CA ASN A 34 -7.610 -24.887 -11.517 1.00 0.00 C ATOM 485 C ASN A 34 -6.311 -24.332 -12.110 1.00 0.00 C ATOM 486 O ASN A 34 -5.970 -24.690 -13.239 1.00 0.00 O ATOM 487 CB ASN A 34 -8.805 -24.673 -12.468 1.00 0.00 C ATOM 488 CG ASN A 34 -9.879 -25.757 -12.400 1.00 0.00 C ATOM 489 OD1 ASN A 34 -10.055 -26.467 -11.295 1.00 0.00 O flip ATOM 490 ND2 ASN A 34 -10.598 -25.956 -13.369 1.00 0.00 N flip ATOM 0 H ASN A 34 -7.916 -23.281 -10.239 1.00 0.00 H new ATOM 0 HA ASN A 34 -7.448 -25.957 -11.384 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -9.265 -23.711 -12.241 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -8.432 -24.614 -13.490 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -10.467 -25.412 -14.222 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -11.329 -26.666 -13.324 1.00 0.00 H new ATOM 497 N SER A 35 -5.570 -23.453 -11.426 1.00 0.00 N ATOM 498 CA SER A 35 -4.267 -22.975 -11.896 1.00 0.00 C ATOM 499 C SER A 35 -3.430 -22.449 -10.724 1.00 0.00 C ATOM 500 O SER A 35 -3.998 -21.945 -9.761 1.00 0.00 O ATOM 501 CB SER A 35 -4.472 -21.840 -12.909 1.00 0.00 C ATOM 502 OG SER A 35 -5.086 -22.325 -14.089 1.00 0.00 O ATOM 0 H SER A 35 -5.857 -23.054 -10.532 1.00 0.00 H new ATOM 0 HA SER A 35 -3.742 -23.808 -12.364 1.00 0.00 H new ATOM 0 HB2 SER A 35 -5.090 -21.059 -12.467 1.00 0.00 H new ATOM 0 HB3 SER A 35 -3.511 -21.386 -13.153 1.00 0.00 H new ATOM 0 HG SER A 35 -5.148 -23.302 -14.048 1.00 0.00 H new ATOM 508 N PRO A 36 -2.092 -22.436 -10.815 1.00 0.00 N ATOM 509 CA PRO A 36 -1.213 -21.889 -9.781 1.00 0.00 C ATOM 510 C PRO A 36 -1.213 -20.345 -9.745 1.00 0.00 C ATOM 511 O PRO A 36 -0.214 -19.727 -9.386 1.00 0.00 O ATOM 512 CB PRO A 36 0.161 -22.495 -10.096 1.00 0.00 C ATOM 513 CG PRO A 36 0.139 -22.631 -11.614 1.00 0.00 C ATOM 514 CD PRO A 36 -1.310 -22.997 -11.907 1.00 0.00 C ATOM 0 HA PRO A 36 -1.546 -22.150 -8.777 1.00 0.00 H new ATOM 0 HB2 PRO A 36 0.973 -21.849 -9.761 1.00 0.00 H new ATOM 0 HB3 PRO A 36 0.298 -23.459 -9.607 1.00 0.00 H new ATOM 0 HG2 PRO A 36 0.428 -21.702 -12.106 1.00 0.00 H new ATOM 0 HG3 PRO A 36 0.827 -23.402 -11.960 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -1.630 -22.589 -12.866 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -1.436 -24.078 -11.962 1.00 0.00 H new ATOM 522 N LEU A 37 -2.320 -19.702 -10.126 1.00 0.00 N ATOM 523 CA LEU A 37 -2.497 -18.262 -10.129 1.00 0.00 C ATOM 524 C LEU A 37 -2.587 -17.736 -8.697 1.00 0.00 C ATOM 525 O LEU A 37 -2.996 -18.448 -7.773 1.00 0.00 O ATOM 526 CB LEU A 37 -3.782 -17.929 -10.910 1.00 0.00 C ATOM 527 CG LEU A 37 -4.118 -16.427 -11.036 1.00 0.00 C ATOM 528 CD1 LEU A 37 -3.021 -15.630 -11.757 1.00 0.00 C ATOM 529 CD2 LEU A 37 -5.427 -16.276 -11.801 1.00 0.00 C ATOM 0 H LEU A 37 -3.148 -20.199 -10.453 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.643 -17.783 -10.608 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.695 -18.348 -11.912 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.620 -18.431 -10.426 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.201 -16.025 -10.026 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.312 -14.581 -11.816 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -2.086 -15.716 -11.204 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.885 -16.026 -12.763 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -5.673 -15.218 -11.895 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -5.321 -16.714 -12.794 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.224 -16.788 -11.262 1.00 0.00 H new ATOM 541 N GLY A 38 -2.245 -16.464 -8.504 1.00 0.00 N ATOM 542 CA GLY A 38 -2.759 -15.659 -7.413 1.00 0.00 C ATOM 543 C GLY A 38 -2.974 -14.230 -7.899 1.00 0.00 C ATOM 544 O GLY A 38 -2.702 -13.909 -9.055 1.00 0.00 O ATOM 0 H GLY A 38 -1.596 -15.963 -9.111 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.698 -16.076 -7.049 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -2.060 -15.670 -6.577 1.00 0.00 H new ATOM 548 N VAL A 39 -3.416 -13.365 -6.997 1.00 0.00 N ATOM 549 CA VAL A 39 -3.396 -11.914 -7.128 1.00 0.00 C ATOM 550 C VAL A 39 -2.811 -11.375 -5.826 1.00 0.00 C ATOM 551 O VAL A 39 -2.818 -12.096 -4.825 1.00 0.00 O ATOM 552 CB VAL A 39 -4.815 -11.353 -7.392 1.00 0.00 C ATOM 553 CG1 VAL A 39 -5.314 -11.682 -8.805 1.00 0.00 C ATOM 554 CG2 VAL A 39 -5.863 -11.847 -6.380 1.00 0.00 C ATOM 0 H VAL A 39 -3.818 -13.670 -6.111 1.00 0.00 H new ATOM 0 HA VAL A 39 -2.792 -11.605 -7.981 1.00 0.00 H new ATOM 0 HB VAL A 39 -4.707 -10.274 -7.281 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -6.313 -11.268 -8.944 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -4.636 -11.248 -9.540 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -5.348 -12.764 -8.936 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.834 -11.416 -6.623 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -5.927 -12.934 -6.424 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.571 -11.541 -5.375 1.00 0.00 H new ATOM 564 N ILE A 40 -2.353 -10.122 -5.812 1.00 0.00 N ATOM 565 CA ILE A 40 -2.260 -9.351 -4.578 1.00 0.00 C ATOM 566 C ILE A 40 -2.800 -7.959 -4.873 1.00 0.00 C ATOM 567 O ILE A 40 -2.738 -7.478 -6.007 1.00 0.00 O ATOM 568 CB ILE A 40 -0.827 -9.310 -3.985 1.00 0.00 C ATOM 569 CG1 ILE A 40 0.227 -8.593 -4.865 1.00 0.00 C ATOM 570 CG2 ILE A 40 -0.331 -10.718 -3.617 1.00 0.00 C ATOM 571 CD1 ILE A 40 0.425 -7.114 -4.503 1.00 0.00 C ATOM 0 H ILE A 40 -2.041 -9.622 -6.644 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.854 -9.836 -3.804 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.927 -8.703 -3.085 1.00 0.00 H new ATOM 0 HG12 ILE A 40 1.181 -9.112 -4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.074 -8.666 -5.910 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.676 -10.653 -3.205 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.999 -11.157 -2.876 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.318 -11.344 -4.509 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.177 -6.676 -5.160 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -0.518 -6.580 -4.624 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.757 -7.034 -3.468 1.00 0.00 H new ATOM 583 N GLY A 41 -3.265 -7.279 -3.839 1.00 0.00 N ATOM 584 CA GLY A 41 -3.654 -5.892 -3.877 1.00 0.00 C ATOM 585 C GLY A 41 -3.587 -5.442 -2.439 1.00 0.00 C ATOM 586 O GLY A 41 -4.341 -5.955 -1.611 1.00 0.00 O ATOM 0 H GLY A 41 -3.384 -7.700 -2.918 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.983 -5.309 -4.507 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.658 -5.772 -4.284 1.00 0.00 H new ATOM 590 N SER A 42 -2.606 -4.610 -2.104 1.00 0.00 N ATOM 591 CA SER A 42 -2.625 -3.915 -0.835 1.00 0.00 C ATOM 592 C SER A 42 -3.557 -2.713 -0.965 1.00 0.00 C ATOM 593 O SER A 42 -3.759 -2.179 -2.065 1.00 0.00 O ATOM 594 CB SER A 42 -1.205 -3.518 -0.411 1.00 0.00 C ATOM 595 OG SER A 42 -0.488 -2.949 -1.487 1.00 0.00 O ATOM 0 H SER A 42 -1.798 -4.406 -2.692 1.00 0.00 H new ATOM 0 HA SER A 42 -3.002 -4.566 -0.046 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.255 -2.806 0.413 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.675 -4.396 -0.042 1.00 0.00 H new ATOM 0 HG SER A 42 0.412 -2.704 -1.187 1.00 0.00 H new ATOM 601 N PHE A 43 -4.108 -2.299 0.170 1.00 0.00 N ATOM 602 CA PHE A 43 -4.653 -0.971 0.370 1.00 0.00 C ATOM 603 C PHE A 43 -3.972 -0.418 1.612 1.00 0.00 C ATOM 604 O PHE A 43 -3.783 -1.156 2.584 1.00 0.00 O ATOM 605 CB PHE A 43 -6.168 -1.028 0.583 1.00 0.00 C ATOM 606 CG PHE A 43 -6.958 -1.592 -0.577 1.00 0.00 C ATOM 607 CD1 PHE A 43 -7.126 -0.833 -1.747 1.00 0.00 C ATOM 608 CD2 PHE A 43 -7.553 -2.863 -0.475 1.00 0.00 C ATOM 609 CE1 PHE A 43 -7.918 -1.330 -2.795 1.00 0.00 C ATOM 610 CE2 PHE A 43 -8.368 -3.349 -1.509 1.00 0.00 C ATOM 611 CZ PHE A 43 -8.565 -2.572 -2.660 1.00 0.00 C ATOM 0 H PHE A 43 -4.188 -2.895 0.994 1.00 0.00 H new ATOM 0 HA PHE A 43 -4.476 -0.342 -0.502 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.372 -1.630 1.468 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -6.528 -0.021 0.792 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -6.647 0.131 -1.840 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.382 -3.468 0.403 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -8.030 -0.759 -3.705 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.841 -4.316 -1.419 1.00 0.00 H new ATOM 0 HZ PHE A 43 -9.215 -2.928 -3.445 1.00 0.00 H new ATOM 621 N THR A 44 -3.641 0.865 1.597 1.00 0.00 N ATOM 622 CA THR A 44 -3.098 1.602 2.728 1.00 0.00 C ATOM 623 C THR A 44 -3.956 2.853 2.930 1.00 0.00 C ATOM 624 O THR A 44 -4.456 3.404 1.948 1.00 0.00 O ATOM 625 CB THR A 44 -1.617 1.929 2.453 1.00 0.00 C ATOM 626 OG1 THR A 44 -1.444 2.610 1.223 1.00 0.00 O ATOM 627 CG2 THR A 44 -0.754 0.663 2.392 1.00 0.00 C ATOM 0 H THR A 44 -3.748 1.443 0.764 1.00 0.00 H new ATOM 0 HA THR A 44 -3.128 1.018 3.648 1.00 0.00 H new ATOM 0 HB THR A 44 -1.303 2.562 3.283 1.00 0.00 H new ATOM 0 HG1 THR A 44 -0.493 2.801 1.086 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.282 0.938 2.196 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.816 0.134 3.343 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.114 0.015 1.593 1.00 0.00 H new ATOM 635 N TYR A 45 -4.162 3.306 4.168 1.00 0.00 N ATOM 636 CA TYR A 45 -4.769 4.607 4.441 1.00 0.00 C ATOM 637 C TYR A 45 -4.085 5.204 5.667 1.00 0.00 C ATOM 638 O TYR A 45 -4.343 4.744 6.780 1.00 0.00 O ATOM 639 CB TYR A 45 -6.279 4.426 4.667 1.00 0.00 C ATOM 640 CG TYR A 45 -6.980 5.650 5.225 1.00 0.00 C ATOM 641 CD1 TYR A 45 -7.166 6.775 4.407 1.00 0.00 C ATOM 642 CD2 TYR A 45 -7.447 5.666 6.555 1.00 0.00 C ATOM 643 CE1 TYR A 45 -7.836 7.902 4.910 1.00 0.00 C ATOM 644 CE2 TYR A 45 -8.082 6.808 7.076 1.00 0.00 C ATOM 645 CZ TYR A 45 -8.289 7.931 6.246 1.00 0.00 C ATOM 646 OH TYR A 45 -8.933 9.040 6.703 1.00 0.00 O ATOM 0 H TYR A 45 -3.913 2.782 5.007 1.00 0.00 H new ATOM 0 HA TYR A 45 -4.638 5.287 3.599 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.746 4.155 3.720 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -6.434 3.591 5.350 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -6.795 6.774 3.393 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -7.316 4.794 7.179 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -8.006 8.754 4.269 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -8.409 6.826 8.105 1.00 0.00 H new ATOM 0 HH TYR A 45 -8.424 9.432 7.443 1.00 0.00 H new ATOM 656 N THR A 46 -3.239 6.226 5.501 1.00 0.00 N ATOM 657 CA THR A 46 -2.629 6.920 6.637 1.00 0.00 C ATOM 658 C THR A 46 -3.336 8.260 6.833 1.00 0.00 C ATOM 659 O THR A 46 -3.667 8.937 5.850 1.00 0.00 O ATOM 660 CB THR A 46 -1.100 7.034 6.464 1.00 0.00 C ATOM 661 OG1 THR A 46 -0.486 7.375 7.686 1.00 0.00 O ATOM 662 CG2 THR A 46 -0.664 8.065 5.423 1.00 0.00 C ATOM 0 H THR A 46 -2.962 6.590 4.590 1.00 0.00 H new ATOM 0 HA THR A 46 -2.764 6.345 7.553 1.00 0.00 H new ATOM 0 HB THR A 46 -0.785 6.050 6.116 1.00 0.00 H new ATOM 0 HG1 THR A 46 0.483 7.441 7.558 1.00 0.00 H new ATOM 0 HG21 THR A 46 0.424 8.083 5.362 1.00 0.00 H new ATOM 0 HG22 THR A 46 -1.077 7.797 4.451 1.00 0.00 H new ATOM 0 HG23 THR A 46 -1.028 9.051 5.713 1.00 0.00 H new ATOM 670 N GLU A 47 -3.538 8.642 8.093 1.00 0.00 N ATOM 671 CA GLU A 47 -4.005 9.963 8.467 1.00 0.00 C ATOM 672 C GLU A 47 -3.290 10.362 9.758 1.00 0.00 C ATOM 673 O GLU A 47 -3.041 9.521 10.622 1.00 0.00 O ATOM 674 CB GLU A 47 -5.531 9.953 8.647 1.00 0.00 C ATOM 675 CG GLU A 47 -6.088 11.385 8.632 1.00 0.00 C ATOM 676 CD GLU A 47 -7.488 11.504 9.223 1.00 0.00 C ATOM 677 OE1 GLU A 47 -8.431 10.847 8.716 1.00 0.00 O ATOM 678 OE2 GLU A 47 -7.678 12.333 10.151 1.00 0.00 O ATOM 0 H GLU A 47 -3.377 8.027 8.891 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.780 10.690 7.687 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.992 9.369 7.850 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.788 9.467 9.588 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.412 12.034 9.188 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.105 11.748 7.604 1.00 0.00 H new ATOM 685 N LYS A 48 -2.986 11.648 9.937 1.00 0.00 N ATOM 686 CA LYS A 48 -2.630 12.228 11.225 1.00 0.00 C ATOM 687 C LYS A 48 -3.208 13.639 11.209 1.00 0.00 C ATOM 688 O LYS A 48 -2.819 14.449 10.367 1.00 0.00 O ATOM 689 CB LYS A 48 -1.103 12.156 11.433 1.00 0.00 C ATOM 690 CG LYS A 48 -0.616 12.280 12.881 1.00 0.00 C ATOM 691 CD LYS A 48 -0.584 13.726 13.382 1.00 0.00 C ATOM 692 CE LYS A 48 0.283 13.790 14.640 1.00 0.00 C ATOM 693 NZ LYS A 48 0.678 15.166 14.999 1.00 0.00 N ATOM 0 H LYS A 48 -2.981 12.325 9.174 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.041 11.688 12.078 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.746 11.208 11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.638 12.948 10.845 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.266 11.692 13.528 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.383 11.852 12.960 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -0.181 14.384 12.612 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.594 14.072 13.601 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.262 13.345 15.473 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.179 13.189 14.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.263 15.146 15.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.223 15.586 14.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.173 15.737 15.173 1.00 0.00 H new ATOM 707 N SER A 49 -4.184 13.919 12.064 1.00 0.00 N ATOM 708 CA SER A 49 -4.883 15.207 12.116 1.00 0.00 C ATOM 709 C SER A 49 -3.904 16.300 12.561 1.00 0.00 C ATOM 710 O SER A 49 -3.079 16.020 13.436 1.00 0.00 O ATOM 711 CB SER A 49 -6.108 15.091 13.048 1.00 0.00 C ATOM 712 OG SER A 49 -5.977 14.113 14.074 1.00 0.00 O ATOM 0 H SER A 49 -4.521 13.249 12.755 1.00 0.00 H new ATOM 0 HA SER A 49 -5.253 15.484 11.129 1.00 0.00 H new ATOM 0 HB2 SER A 49 -6.291 16.061 13.509 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.985 14.853 12.447 1.00 0.00 H new ATOM 0 HG SER A 49 -6.790 14.102 14.621 1.00 0.00 H new ATOM 718 N ARG A 50 -3.933 17.514 11.977 1.00 0.00 N ATOM 719 CA ARG A 50 -2.901 18.519 12.237 1.00 0.00 C ATOM 720 C ARG A 50 -3.525 19.878 12.502 1.00 0.00 C ATOM 721 O ARG A 50 -3.986 20.532 11.569 1.00 0.00 O ATOM 722 CB ARG A 50 -1.917 18.557 11.058 1.00 0.00 C ATOM 723 CG ARG A 50 -0.573 19.246 11.358 1.00 0.00 C ATOM 724 CD ARG A 50 -0.579 20.766 11.581 1.00 0.00 C ATOM 725 NE ARG A 50 0.789 21.297 11.447 1.00 0.00 N ATOM 726 CZ ARG A 50 1.611 21.817 12.371 1.00 0.00 C ATOM 727 NH1 ARG A 50 1.244 21.984 13.641 1.00 0.00 N ATOM 728 NH2 ARG A 50 2.843 22.148 11.996 1.00 0.00 N ATOM 0 H ARG A 50 -4.659 17.815 11.326 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.347 18.247 13.135 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.721 17.535 10.734 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -2.393 19.070 10.222 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -0.149 18.779 12.247 1.00 0.00 H new ATOM 0 HG3 ARG A 50 0.105 19.032 10.531 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -1.238 21.246 10.857 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -0.972 20.996 12.571 1.00 0.00 H new ATOM 0 HE ARG A 50 1.172 21.264 10.502 1.00 0.00 H new ATOM 0 HH11 ARG A 50 0.308 21.713 13.941 1.00 0.00 H new ATOM 0 HH12 ARG A 50 1.899 22.383 14.313 1.00 0.00 H new ATOM 0 HH21 ARG A 50 3.138 22.004 11.030 1.00 0.00 H new ATOM 0 HH22 ARG A 50 3.493 22.546 12.674 1.00 0.00 H new ATOM 742 N THR A 51 -3.450 20.329 13.743 1.00 0.00 N ATOM 743 CA THR A 51 -3.452 21.722 14.158 1.00 0.00 C ATOM 744 C THR A 51 -2.206 21.935 15.032 1.00 0.00 C ATOM 745 O THR A 51 -1.255 21.144 14.941 1.00 0.00 O ATOM 746 CB THR A 51 -4.818 22.070 14.798 1.00 0.00 C ATOM 747 OG1 THR A 51 -4.942 23.471 14.941 1.00 0.00 O ATOM 748 CG2 THR A 51 -5.111 21.422 16.152 1.00 0.00 C ATOM 0 H THR A 51 -3.382 19.692 14.537 1.00 0.00 H new ATOM 0 HA THR A 51 -3.369 22.428 13.332 1.00 0.00 H new ATOM 0 HB THR A 51 -5.549 21.655 14.104 1.00 0.00 H new ATOM 0 HG1 THR A 51 -5.809 23.683 15.345 1.00 0.00 H new ATOM 0 HG21 THR A 51 -6.094 21.738 16.502 1.00 0.00 H new ATOM 0 HG22 THR A 51 -5.095 20.337 16.047 1.00 0.00 H new ATOM 0 HG23 THR A 51 -4.353 21.728 16.873 1.00 0.00 H new ATOM 756 N ALA A 52 -2.207 23.000 15.840 1.00 0.00 N ATOM 757 CA ALA A 52 -1.430 23.268 17.058 1.00 0.00 C ATOM 758 C ALA A 52 -0.694 24.609 17.033 1.00 0.00 C ATOM 759 O ALA A 52 -0.130 24.970 18.070 1.00 0.00 O ATOM 760 CB ALA A 52 -0.474 22.136 17.478 1.00 0.00 C ATOM 0 H ALA A 52 -2.823 23.786 15.633 1.00 0.00 H new ATOM 0 HA ALA A 52 -2.200 23.323 17.827 1.00 0.00 H new ATOM 0 HB1 ALA A 52 0.055 22.425 18.386 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -1.046 21.227 17.665 1.00 0.00 H new ATOM 0 HB3 ALA A 52 0.246 21.954 16.681 1.00 0.00 H new ATOM 766 N SER A 53 -0.676 25.353 15.922 1.00 0.00 N ATOM 767 CA SER A 53 -0.269 26.759 15.954 1.00 0.00 C ATOM 768 C SER A 53 -1.510 27.578 16.348 1.00 0.00 C ATOM 769 O SER A 53 -1.722 27.763 17.547 1.00 0.00 O ATOM 770 CB SER A 53 0.445 27.180 14.657 1.00 0.00 C ATOM 771 OG SER A 53 1.456 26.244 14.302 1.00 0.00 O ATOM 0 H SER A 53 -0.936 25.008 14.998 1.00 0.00 H new ATOM 0 HA SER A 53 0.498 26.950 16.705 1.00 0.00 H new ATOM 0 HB2 SER A 53 -0.281 27.260 13.848 1.00 0.00 H new ATOM 0 HB3 SER A 53 0.888 28.167 14.786 1.00 0.00 H new ATOM 0 HG SER A 53 1.893 26.533 13.474 1.00 0.00 H new ATOM 777 N SER A 54 -2.372 27.980 15.405 1.00 0.00 N ATOM 778 CA SER A 54 -3.598 28.732 15.682 1.00 0.00 C ATOM 779 C SER A 54 -4.848 28.154 14.994 1.00 0.00 C ATOM 780 O SER A 54 -5.943 28.652 15.263 1.00 0.00 O ATOM 781 CB SER A 54 -3.372 30.196 15.274 1.00 0.00 C ATOM 782 OG SER A 54 -4.369 31.040 15.812 1.00 0.00 O ATOM 0 H SER A 54 -2.233 27.788 14.413 1.00 0.00 H new ATOM 0 HA SER A 54 -3.802 28.656 16.750 1.00 0.00 H new ATOM 0 HB2 SER A 54 -2.391 30.524 15.618 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.372 30.277 14.187 1.00 0.00 H new ATOM 0 HG SER A 54 -5.239 30.591 15.764 1.00 0.00 H new ATOM 788 N GLY A 55 -4.725 27.133 14.139 1.00 0.00 N ATOM 789 CA GLY A 55 -5.817 26.608 13.320 1.00 0.00 C ATOM 790 C GLY A 55 -5.450 26.724 11.846 1.00 0.00 C ATOM 791 O GLY A 55 -5.848 27.669 11.168 1.00 0.00 O ATOM 0 H GLY A 55 -3.844 26.640 13.996 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -6.009 25.566 13.577 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -6.735 27.161 13.522 1.00 0.00 H new ATOM 795 N ASP A 56 -4.528 25.872 11.397 1.00 0.00 N ATOM 796 CA ASP A 56 -4.101 25.747 10.002 1.00 0.00 C ATOM 797 C ASP A 56 -4.334 24.309 9.559 1.00 0.00 C ATOM 798 O ASP A 56 -3.583 23.442 10.012 1.00 0.00 O ATOM 799 CB ASP A 56 -2.634 26.159 9.878 1.00 0.00 C ATOM 800 CG ASP A 56 -2.114 26.069 8.452 1.00 0.00 C ATOM 801 OD1 ASP A 56 -2.881 26.363 7.512 1.00 0.00 O ATOM 802 OD2 ASP A 56 -0.906 25.762 8.296 1.00 0.00 O ATOM 0 H ASP A 56 -4.040 25.226 12.017 1.00 0.00 H new ATOM 0 HA ASP A 56 -4.677 26.406 9.353 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.517 27.181 10.239 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -2.027 25.522 10.522 1.00 0.00 H new ATOM 807 N TYR A 57 -5.402 23.974 8.831 1.00 0.00 N ATOM 808 CA TYR A 57 -5.655 22.578 8.453 1.00 0.00 C ATOM 809 C TYR A 57 -4.500 22.136 7.578 1.00 0.00 C ATOM 810 O TYR A 57 -4.258 22.777 6.563 1.00 0.00 O ATOM 811 CB TYR A 57 -6.947 22.402 7.641 1.00 0.00 C ATOM 812 CG TYR A 57 -8.281 22.516 8.353 1.00 0.00 C ATOM 813 CD1 TYR A 57 -8.382 22.872 9.714 1.00 0.00 C ATOM 814 CD2 TYR A 57 -9.453 22.246 7.621 1.00 0.00 C ATOM 815 CE1 TYR A 57 -9.641 23.017 10.316 1.00 0.00 C ATOM 816 CE2 TYR A 57 -10.714 22.398 8.221 1.00 0.00 C ATOM 817 CZ TYR A 57 -10.815 22.829 9.557 1.00 0.00 C ATOM 818 OH TYR A 57 -12.034 23.085 10.101 1.00 0.00 O ATOM 0 H TYR A 57 -6.098 24.639 8.494 1.00 0.00 H new ATOM 0 HA TYR A 57 -5.756 21.992 9.367 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -6.936 23.142 6.840 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.908 21.420 7.169 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -7.486 23.034 10.295 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -9.382 21.921 6.594 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -9.711 23.273 11.363 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.609 22.183 7.655 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.733 22.903 9.438 1.00 0.00 H new ATOM 828 N ASN A 58 -3.808 21.052 7.929 1.00 0.00 N ATOM 829 CA ASN A 58 -2.823 20.471 7.020 1.00 0.00 C ATOM 830 C ASN A 58 -3.298 19.049 6.766 1.00 0.00 C ATOM 831 O ASN A 58 -2.626 18.091 7.160 1.00 0.00 O ATOM 832 CB ASN A 58 -1.389 20.562 7.586 1.00 0.00 C ATOM 833 CG ASN A 58 -0.760 21.951 7.525 1.00 0.00 C ATOM 834 OD1 ASN A 58 0.310 22.119 6.944 1.00 0.00 O ATOM 835 ND2 ASN A 58 -1.317 22.948 8.187 1.00 0.00 N ATOM 0 H ASN A 58 -3.909 20.566 8.820 1.00 0.00 H new ATOM 0 HA ASN A 58 -2.757 21.019 6.080 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -1.402 20.231 8.624 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -0.753 19.867 7.038 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -0.859 23.859 8.217 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -2.205 22.807 8.669 1.00 0.00 H new ATOM 842 N LYS A 59 -4.508 18.898 6.204 1.00 0.00 N ATOM 843 CA LYS A 59 -5.040 17.568 5.935 1.00 0.00 C ATOM 844 C LYS A 59 -4.307 17.041 4.714 1.00 0.00 C ATOM 845 O LYS A 59 -4.137 17.764 3.735 1.00 0.00 O ATOM 846 CB LYS A 59 -6.548 17.576 5.635 1.00 0.00 C ATOM 847 CG LYS A 59 -7.460 17.605 6.871 1.00 0.00 C ATOM 848 CD LYS A 59 -8.868 17.151 6.444 1.00 0.00 C ATOM 849 CE LYS A 59 -9.943 17.300 7.525 1.00 0.00 C ATOM 850 NZ LYS A 59 -9.880 16.269 8.579 1.00 0.00 N ATOM 0 H LYS A 59 -5.120 19.668 5.934 1.00 0.00 H new ATOM 0 HA LYS A 59 -4.895 16.948 6.820 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.774 18.444 5.016 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -6.790 16.692 5.045 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -7.068 16.948 7.647 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -7.497 18.610 7.292 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -9.170 17.725 5.568 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -8.821 16.106 6.139 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -9.846 18.283 7.986 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -10.925 17.264 7.054 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -10.637 16.435 9.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -10.002 15.328 8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -8.957 16.316 9.056 1.00 0.00 H new ATOM 864 N ASN A 60 -3.969 15.760 4.746 1.00 0.00 N ATOM 865 CA ASN A 60 -3.654 14.961 3.575 1.00 0.00 C ATOM 866 C ASN A 60 -3.960 13.513 3.925 1.00 0.00 C ATOM 867 O ASN A 60 -4.338 13.196 5.058 1.00 0.00 O ATOM 868 CB ASN A 60 -2.194 15.137 3.125 1.00 0.00 C ATOM 869 CG ASN A 60 -1.197 14.713 4.192 1.00 0.00 C ATOM 870 OD1 ASN A 60 -1.228 13.588 4.682 1.00 0.00 O ATOM 871 ND2 ASN A 60 -0.323 15.608 4.601 1.00 0.00 N ATOM 0 H ASN A 60 -3.905 15.233 5.617 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.258 15.288 2.729 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.024 14.552 2.221 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -2.021 16.182 2.866 1.00 0.00 H new ATOM 0 HD21 ASN A 60 0.343 15.371 5.336 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -0.312 16.538 4.182 1.00 0.00 H new ATOM 878 N GLN A 61 -3.801 12.639 2.942 1.00 0.00 N ATOM 879 CA GLN A 61 -3.899 11.199 3.047 1.00 0.00 C ATOM 880 C GLN A 61 -2.803 10.671 2.122 1.00 0.00 C ATOM 881 O GLN A 61 -2.474 11.340 1.140 1.00 0.00 O ATOM 882 CB GLN A 61 -5.292 10.746 2.562 1.00 0.00 C ATOM 883 CG GLN A 61 -6.443 11.358 3.382 1.00 0.00 C ATOM 884 CD GLN A 61 -7.853 11.060 2.876 1.00 0.00 C ATOM 885 OE1 GLN A 61 -8.789 11.064 3.669 1.00 0.00 O ATOM 886 NE2 GLN A 61 -8.080 10.859 1.587 1.00 0.00 N ATOM 0 H GLN A 61 -3.587 12.941 1.991 1.00 0.00 H new ATOM 0 HA GLN A 61 -3.778 10.833 4.067 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -5.413 11.021 1.514 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -5.353 9.659 2.615 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -6.363 11.000 4.408 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -6.309 12.439 3.410 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -7.303 10.855 0.927 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -9.032 10.708 1.254 1.00 0.00 H new ATOM 895 N TYR A 62 -2.290 9.474 2.392 1.00 0.00 N ATOM 896 CA TYR A 62 -1.544 8.674 1.428 1.00 0.00 C ATOM 897 C TYR A 62 -2.211 7.312 1.417 1.00 0.00 C ATOM 898 O TYR A 62 -2.471 6.733 2.480 1.00 0.00 O ATOM 899 CB TYR A 62 -0.048 8.562 1.760 1.00 0.00 C ATOM 900 CG TYR A 62 0.807 9.613 1.089 1.00 0.00 C ATOM 901 CD1 TYR A 62 1.009 10.854 1.717 1.00 0.00 C ATOM 902 CD2 TYR A 62 1.406 9.342 -0.158 1.00 0.00 C ATOM 903 CE1 TYR A 62 1.812 11.827 1.104 1.00 0.00 C ATOM 904 CE2 TYR A 62 2.211 10.314 -0.779 1.00 0.00 C ATOM 905 CZ TYR A 62 2.418 11.558 -0.144 1.00 0.00 C ATOM 906 OH TYR A 62 3.196 12.504 -0.732 1.00 0.00 O ATOM 0 H TYR A 62 -2.383 9.026 3.303 1.00 0.00 H new ATOM 0 HA TYR A 62 -1.569 9.150 0.448 1.00 0.00 H new ATOM 0 HB2 TYR A 62 0.081 8.637 2.840 1.00 0.00 H new ATOM 0 HB3 TYR A 62 0.307 7.575 1.464 1.00 0.00 H new ATOM 0 HD1 TYR A 62 0.546 11.058 2.671 1.00 0.00 H new ATOM 0 HD2 TYR A 62 1.247 8.387 -0.637 1.00 0.00 H new ATOM 0 HE1 TYR A 62 1.967 12.781 1.585 1.00 0.00 H new ATOM 0 HE2 TYR A 62 2.668 10.110 -1.736 1.00 0.00 H new ATOM 0 HH TYR A 62 3.619 13.055 -0.041 1.00 0.00 H new ATOM 916 N TYR A 63 -2.531 6.847 0.218 1.00 0.00 N ATOM 917 CA TYR A 63 -3.122 5.557 -0.064 1.00 0.00 C ATOM 918 C TYR A 63 -2.475 5.052 -1.353 1.00 0.00 C ATOM 919 O TYR A 63 -2.147 5.887 -2.200 1.00 0.00 O ATOM 920 CB TYR A 63 -4.643 5.742 -0.168 1.00 0.00 C ATOM 921 CG TYR A 63 -5.164 6.336 -1.464 1.00 0.00 C ATOM 922 CD1 TYR A 63 -5.117 7.722 -1.709 1.00 0.00 C ATOM 923 CD2 TYR A 63 -5.748 5.481 -2.412 1.00 0.00 C ATOM 924 CE1 TYR A 63 -5.706 8.249 -2.875 1.00 0.00 C ATOM 925 CE2 TYR A 63 -6.343 6.003 -3.571 1.00 0.00 C ATOM 926 CZ TYR A 63 -6.346 7.392 -3.791 1.00 0.00 C ATOM 927 OH TYR A 63 -6.992 7.900 -4.871 1.00 0.00 O ATOM 0 H TYR A 63 -2.374 7.395 -0.628 1.00 0.00 H new ATOM 0 HA TYR A 63 -2.949 4.815 0.716 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -5.116 4.771 -0.023 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -4.967 6.380 0.654 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.630 8.380 -1.004 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.739 4.414 -2.248 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -5.667 9.311 -3.067 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.797 5.340 -4.292 1.00 0.00 H new ATOM 0 HH TYR A 63 -7.376 7.168 -5.397 1.00 0.00 H new ATOM 937 N GLY A 64 -2.282 3.740 -1.501 1.00 0.00 N ATOM 938 CA GLY A 64 -1.512 3.146 -2.590 1.00 0.00 C ATOM 939 C GLY A 64 -2.275 2.014 -3.260 1.00 0.00 C ATOM 940 O GLY A 64 -2.126 0.855 -2.865 1.00 0.00 O ATOM 0 H GLY A 64 -2.664 3.050 -0.854 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -1.273 3.912 -3.328 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.565 2.769 -2.204 1.00 0.00 H new ATOM 944 N ILE A 65 -3.079 2.327 -4.283 1.00 0.00 N ATOM 945 CA ILE A 65 -3.871 1.306 -4.971 1.00 0.00 C ATOM 946 C ILE A 65 -2.905 0.453 -5.783 1.00 0.00 C ATOM 947 O ILE A 65 -2.399 0.884 -6.822 1.00 0.00 O ATOM 948 CB ILE A 65 -4.955 1.929 -5.882 1.00 0.00 C ATOM 949 CG1 ILE A 65 -5.846 2.942 -5.139 1.00 0.00 C ATOM 950 CG2 ILE A 65 -5.831 0.839 -6.541 1.00 0.00 C ATOM 951 CD1 ILE A 65 -6.575 2.381 -3.911 1.00 0.00 C ATOM 0 H ILE A 65 -3.197 3.272 -4.649 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.404 0.699 -4.239 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.419 2.472 -6.660 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.230 3.784 -4.824 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.587 3.333 -5.837 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.583 1.310 -7.175 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.204 0.185 -7.147 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.325 0.252 -5.767 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.177 3.167 -3.455 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.223 1.559 -4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.844 2.018 -3.188 1.00 0.00 H new ATOM 963 N THR A 66 -2.707 -0.779 -5.339 1.00 0.00 N ATOM 964 CA THR A 66 -1.745 -1.710 -5.888 1.00 0.00 C ATOM 965 C THR A 66 -2.514 -2.823 -6.577 1.00 0.00 C ATOM 966 O THR A 66 -3.460 -3.339 -5.975 1.00 0.00 O ATOM 967 CB THR A 66 -0.908 -2.249 -4.727 1.00 0.00 C ATOM 968 OG1 THR A 66 -0.305 -1.187 -4.018 1.00 0.00 O ATOM 969 CG2 THR A 66 0.190 -3.190 -5.224 1.00 0.00 C ATOM 0 H THR A 66 -3.234 -1.168 -4.557 1.00 0.00 H new ATOM 0 HA THR A 66 -1.082 -1.241 -6.615 1.00 0.00 H new ATOM 0 HB THR A 66 -1.582 -2.800 -4.071 1.00 0.00 H new ATOM 0 HG1 THR A 66 -0.996 -0.669 -3.554 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.767 -3.556 -4.375 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.262 -4.033 -5.746 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.849 -2.652 -5.906 1.00 0.00 H new ATOM 977 N ALA A 67 -2.136 -3.214 -7.800 1.00 0.00 N ATOM 978 CA ALA A 67 -2.831 -4.291 -8.492 1.00 0.00 C ATOM 979 C ALA A 67 -1.932 -5.034 -9.482 1.00 0.00 C ATOM 980 O ALA A 67 -1.081 -4.437 -10.151 1.00 0.00 O ATOM 981 CB ALA A 67 -4.051 -3.711 -9.211 1.00 0.00 C ATOM 0 H ALA A 67 -1.361 -2.803 -8.321 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.141 -5.025 -7.748 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.579 -4.509 -9.733 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -4.718 -3.250 -8.482 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.726 -2.960 -9.931 1.00 0.00 H new ATOM 987 N GLY A 68 -2.182 -6.336 -9.595 1.00 0.00 N ATOM 988 CA GLY A 68 -1.654 -7.262 -10.584 1.00 0.00 C ATOM 989 C GLY A 68 -1.817 -8.710 -10.096 1.00 0.00 C ATOM 990 O GLY A 68 -2.153 -8.937 -8.922 1.00 0.00 O ATOM 0 H GLY A 68 -2.810 -6.805 -8.943 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.175 -7.129 -11.532 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.601 -7.049 -10.767 1.00 0.00 H new ATOM 994 N PRO A 69 -1.614 -9.701 -10.975 1.00 0.00 N ATOM 995 CA PRO A 69 -1.621 -11.111 -10.612 1.00 0.00 C ATOM 996 C PRO A 69 -0.375 -11.493 -9.789 1.00 0.00 C ATOM 997 O PRO A 69 0.380 -10.648 -9.293 1.00 0.00 O ATOM 998 CB PRO A 69 -1.768 -11.864 -11.944 1.00 0.00 C ATOM 999 CG PRO A 69 -1.125 -10.925 -12.960 1.00 0.00 C ATOM 1000 CD PRO A 69 -1.478 -9.543 -12.416 1.00 0.00 C ATOM 0 HA PRO A 69 -2.442 -11.375 -9.946 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -1.264 -12.830 -11.916 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -2.814 -12.057 -12.182 1.00 0.00 H new ATOM 0 HG2 PRO A 69 -0.047 -11.072 -13.021 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -1.525 -11.079 -13.962 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -0.700 -8.819 -12.657 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -2.404 -9.175 -12.857 1.00 0.00 H new ATOM 1008 N ALA A 70 -0.174 -12.792 -9.590 1.00 0.00 N ATOM 1009 CA ALA A 70 1.016 -13.404 -9.029 1.00 0.00 C ATOM 1010 C ALA A 70 1.457 -14.478 -10.015 1.00 0.00 C ATOM 1011 O ALA A 70 0.608 -15.235 -10.495 1.00 0.00 O ATOM 1012 CB ALA A 70 0.699 -14.007 -7.658 1.00 0.00 C ATOM 0 H ALA A 70 -0.883 -13.484 -9.832 1.00 0.00 H new ATOM 0 HA ALA A 70 1.811 -12.674 -8.880 1.00 0.00 H new ATOM 0 HB1 ALA A 70 1.598 -14.464 -7.245 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.350 -13.222 -6.987 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.077 -14.765 -7.765 1.00 0.00 H new ATOM 1018 N TYR A 71 2.753 -14.530 -10.335 1.00 0.00 N ATOM 1019 CA TYR A 71 3.289 -15.507 -11.274 1.00 0.00 C ATOM 1020 C TYR A 71 3.945 -16.663 -10.524 1.00 0.00 C ATOM 1021 O TYR A 71 4.488 -16.490 -9.425 1.00 0.00 O ATOM 1022 CB TYR A 71 4.239 -14.840 -12.279 1.00 0.00 C ATOM 1023 CG TYR A 71 4.526 -15.718 -13.482 1.00 0.00 C ATOM 1024 CD1 TYR A 71 3.510 -15.939 -14.432 1.00 0.00 C ATOM 1025 CD2 TYR A 71 5.772 -16.356 -13.631 1.00 0.00 C ATOM 1026 CE1 TYR A 71 3.725 -16.799 -15.521 1.00 0.00 C ATOM 1027 CE2 TYR A 71 5.995 -17.219 -14.719 1.00 0.00 C ATOM 1028 CZ TYR A 71 4.972 -17.442 -15.668 1.00 0.00 C ATOM 1029 OH TYR A 71 5.173 -18.337 -16.672 1.00 0.00 O ATOM 0 H TYR A 71 3.454 -13.897 -9.950 1.00 0.00 H new ATOM 0 HA TYR A 71 2.467 -15.926 -11.855 1.00 0.00 H new ATOM 0 HB2 TYR A 71 3.803 -13.899 -12.616 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.177 -14.596 -11.780 1.00 0.00 H new ATOM 0 HD1 TYR A 71 2.557 -15.443 -14.322 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.557 -16.183 -12.910 1.00 0.00 H new ATOM 0 HE1 TYR A 71 2.939 -16.967 -16.243 1.00 0.00 H new ATOM 0 HE2 TYR A 71 6.950 -17.712 -14.829 1.00 0.00 H new ATOM 0 HH TYR A 71 6.089 -18.682 -16.624 1.00 0.00 H new ATOM 1039 N ARG A 72 3.904 -17.846 -11.139 1.00 0.00 N ATOM 1040 CA ARG A 72 4.502 -19.071 -10.633 1.00 0.00 C ATOM 1041 C ARG A 72 5.842 -19.233 -11.340 1.00 0.00 C ATOM 1042 O ARG A 72 5.880 -19.552 -12.527 1.00 0.00 O ATOM 1043 CB ARG A 72 3.538 -20.237 -10.894 1.00 0.00 C ATOM 1044 CG ARG A 72 3.934 -21.519 -10.156 1.00 0.00 C ATOM 1045 CD ARG A 72 3.716 -21.403 -8.641 1.00 0.00 C ATOM 1046 NE ARG A 72 3.625 -22.740 -8.041 1.00 0.00 N ATOM 1047 CZ ARG A 72 2.568 -23.257 -7.403 1.00 0.00 C ATOM 1048 NH1 ARG A 72 1.562 -22.500 -6.969 1.00 0.00 N ATOM 1049 NH2 ARG A 72 2.497 -24.567 -7.213 1.00 0.00 N ATOM 0 H ARG A 72 3.435 -17.976 -12.035 1.00 0.00 H new ATOM 0 HA ARG A 72 4.677 -19.045 -9.557 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.533 -19.945 -10.590 1.00 0.00 H new ATOM 0 HB3 ARG A 72 3.501 -20.438 -11.965 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.351 -22.355 -10.543 1.00 0.00 H new ATOM 0 HG3 ARG A 72 4.982 -21.743 -10.355 1.00 0.00 H new ATOM 0 HD2 ARG A 72 4.538 -20.848 -8.189 1.00 0.00 H new ATOM 0 HD3 ARG A 72 2.803 -20.842 -8.439 1.00 0.00 H new ATOM 0 HE ARG A 72 4.450 -23.335 -8.118 1.00 0.00 H new ATOM 0 HH11 ARG A 72 1.581 -21.491 -7.119 1.00 0.00 H new ATOM 0 HH12 ARG A 72 0.772 -22.929 -6.486 1.00 0.00 H new ATOM 0 HH21 ARG A 72 3.244 -25.173 -7.552 1.00 0.00 H new ATOM 0 HH22 ARG A 72 1.695 -24.969 -6.728 1.00 0.00 H new ATOM 1063 N ILE A 73 6.922 -18.913 -10.636 1.00 0.00 N ATOM 1064 CA ILE A 73 8.274 -18.872 -11.164 1.00 0.00 C ATOM 1065 C ILE A 73 8.734 -20.300 -11.473 1.00 0.00 C ATOM 1066 O ILE A 73 8.886 -20.647 -12.641 1.00 0.00 O ATOM 1067 CB ILE A 73 9.225 -18.140 -10.181 1.00 0.00 C ATOM 1068 CG1 ILE A 73 8.620 -16.809 -9.681 1.00 0.00 C ATOM 1069 CG2 ILE A 73 10.586 -17.892 -10.854 1.00 0.00 C ATOM 1070 CD1 ILE A 73 9.536 -16.075 -8.703 1.00 0.00 C ATOM 0 H ILE A 73 6.875 -18.667 -9.647 1.00 0.00 H new ATOM 0 HA ILE A 73 8.295 -18.302 -12.093 1.00 0.00 H new ATOM 0 HB ILE A 73 9.365 -18.781 -9.311 1.00 0.00 H new ATOM 0 HG12 ILE A 73 8.416 -16.164 -10.535 1.00 0.00 H new ATOM 0 HG13 ILE A 73 7.664 -17.008 -9.197 1.00 0.00 H new ATOM 0 HG21 ILE A 73 11.248 -17.378 -10.157 1.00 0.00 H new ATOM 0 HG22 ILE A 73 11.030 -18.846 -11.139 1.00 0.00 H new ATOM 0 HG23 ILE A 73 10.446 -17.277 -11.743 1.00 0.00 H new ATOM 0 HD11 ILE A 73 9.060 -15.147 -8.385 1.00 0.00 H new ATOM 0 HD12 ILE A 73 9.719 -16.706 -7.833 1.00 0.00 H new ATOM 0 HD13 ILE A 73 10.483 -15.848 -9.192 1.00 0.00 H new ATOM 1082 N ASN A 74 9.009 -21.111 -10.447 1.00 0.00 N ATOM 1083 CA ASN A 74 9.691 -22.398 -10.587 1.00 0.00 C ATOM 1084 C ASN A 74 9.329 -23.282 -9.395 1.00 0.00 C ATOM 1085 O ASN A 74 8.486 -24.168 -9.504 1.00 0.00 O ATOM 1086 CB ASN A 74 11.213 -22.174 -10.694 1.00 0.00 C ATOM 1087 CG ASN A 74 11.965 -23.478 -10.924 1.00 0.00 C ATOM 1088 OD1 ASN A 74 12.092 -23.927 -12.059 1.00 0.00 O ATOM 1089 ND2 ASN A 74 12.506 -24.090 -9.886 1.00 0.00 N ATOM 0 H ASN A 74 8.760 -20.888 -9.483 1.00 0.00 H new ATOM 0 HA ASN A 74 9.370 -22.902 -11.499 1.00 0.00 H new ATOM 0 HB2 ASN A 74 11.422 -21.485 -11.513 1.00 0.00 H new ATOM 0 HB3 ASN A 74 11.575 -21.702 -9.781 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.039 -24.949 -10.021 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.391 -23.703 -8.949 1.00 0.00 H new ATOM 1096 N ASP A 75 9.896 -22.981 -8.229 1.00 0.00 N ATOM 1097 CA ASP A 75 9.607 -23.579 -6.921 1.00 0.00 C ATOM 1098 C ASP A 75 9.297 -22.433 -5.951 1.00 0.00 C ATOM 1099 O ASP A 75 8.774 -21.426 -6.429 1.00 0.00 O ATOM 1100 CB ASP A 75 10.722 -24.534 -6.472 1.00 0.00 C ATOM 1101 CG ASP A 75 12.017 -23.803 -6.159 1.00 0.00 C ATOM 1102 OD1 ASP A 75 12.699 -23.396 -7.130 1.00 0.00 O ATOM 1103 OD2 ASP A 75 12.323 -23.625 -4.962 1.00 0.00 O ATOM 0 H ASP A 75 10.619 -22.264 -8.165 1.00 0.00 H new ATOM 0 HA ASP A 75 8.731 -24.227 -6.962 1.00 0.00 H new ATOM 0 HB2 ASP A 75 10.394 -25.082 -5.589 1.00 0.00 H new ATOM 0 HB3 ASP A 75 10.903 -25.271 -7.255 1.00 0.00 H new ATOM 1108 N TRP A 76 9.473 -22.599 -4.634 1.00 0.00 N ATOM 1109 CA TRP A 76 8.844 -21.819 -3.562 1.00 0.00 C ATOM 1110 C TRP A 76 9.218 -20.328 -3.550 1.00 0.00 C ATOM 1111 O TRP A 76 10.003 -19.844 -2.729 1.00 0.00 O ATOM 1112 CB TRP A 76 9.122 -22.486 -2.208 1.00 0.00 C ATOM 1113 CG TRP A 76 8.900 -23.968 -2.139 1.00 0.00 C ATOM 1114 CD1 TRP A 76 7.937 -24.666 -2.784 1.00 0.00 C ATOM 1115 CD2 TRP A 76 9.699 -24.954 -1.420 1.00 0.00 C ATOM 1116 NE1 TRP A 76 8.071 -26.010 -2.494 1.00 0.00 N ATOM 1117 CE2 TRP A 76 9.147 -26.245 -1.661 1.00 0.00 C ATOM 1118 CE3 TRP A 76 10.857 -24.888 -0.615 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 9.711 -27.413 -1.123 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 11.439 -26.052 -0.081 1.00 0.00 C ATOM 1121 CH2 TRP A 76 10.868 -27.312 -0.330 1.00 0.00 C ATOM 0 H TRP A 76 10.093 -23.322 -4.268 1.00 0.00 H new ATOM 0 HA TRP A 76 7.773 -21.824 -3.762 1.00 0.00 H new ATOM 0 HB2 TRP A 76 10.157 -22.282 -1.932 1.00 0.00 H new ATOM 0 HB3 TRP A 76 8.492 -22.010 -1.457 1.00 0.00 H new ATOM 0 HD1 TRP A 76 7.181 -24.239 -3.426 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.452 -26.738 -2.851 1.00 0.00 H new ATOM 0 HE3 TRP A 76 11.304 -23.927 -0.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 9.262 -28.376 -1.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 12.330 -25.977 0.524 1.00 0.00 H new ATOM 0 HH2 TRP A 76 11.317 -28.201 0.087 1.00 0.00 H new ATOM 1132 N ALA A 77 8.605 -19.580 -4.457 1.00 0.00 N ATOM 1133 CA ALA A 77 8.762 -18.160 -4.665 1.00 0.00 C ATOM 1134 C ALA A 77 7.551 -17.686 -5.454 1.00 0.00 C ATOM 1135 O ALA A 77 6.951 -18.442 -6.225 1.00 0.00 O ATOM 1136 CB ALA A 77 10.037 -17.917 -5.476 1.00 0.00 C ATOM 0 H ALA A 77 7.937 -19.987 -5.112 1.00 0.00 H new ATOM 0 HA ALA A 77 8.837 -17.623 -3.719 1.00 0.00 H new ATOM 0 HB1 ALA A 77 10.166 -16.847 -5.639 1.00 0.00 H new ATOM 0 HB2 ALA A 77 10.896 -18.307 -4.929 1.00 0.00 H new ATOM 0 HB3 ALA A 77 9.959 -18.424 -6.438 1.00 0.00 H new ATOM 1142 N SER A 78 7.171 -16.428 -5.299 1.00 0.00 N ATOM 1143 CA SER A 78 6.293 -15.742 -6.228 1.00 0.00 C ATOM 1144 C SER A 78 6.693 -14.281 -6.183 1.00 0.00 C ATOM 1145 O SER A 78 6.818 -13.714 -5.095 1.00 0.00 O ATOM 1146 CB SER A 78 4.830 -15.963 -5.848 1.00 0.00 C ATOM 1147 OG SER A 78 4.500 -17.331 -6.037 1.00 0.00 O ATOM 0 H SER A 78 7.468 -15.849 -4.514 1.00 0.00 H new ATOM 0 HA SER A 78 6.391 -16.125 -7.244 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.664 -15.677 -4.809 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.184 -15.333 -6.459 1.00 0.00 H new ATOM 0 HG SER A 78 5.288 -17.816 -6.359 1.00 0.00 H new ATOM 1153 N ILE A 79 6.922 -13.699 -7.352 1.00 0.00 N ATOM 1154 CA ILE A 79 7.201 -12.288 -7.515 1.00 0.00 C ATOM 1155 C ILE A 79 6.188 -11.790 -8.537 1.00 0.00 C ATOM 1156 O ILE A 79 5.805 -12.534 -9.449 1.00 0.00 O ATOM 1157 CB ILE A 79 8.680 -12.062 -7.933 1.00 0.00 C ATOM 1158 CG1 ILE A 79 9.069 -12.641 -9.316 1.00 0.00 C ATOM 1159 CG2 ILE A 79 9.648 -12.659 -6.891 1.00 0.00 C ATOM 1160 CD1 ILE A 79 8.901 -11.668 -10.480 1.00 0.00 C ATOM 0 H ILE A 79 6.918 -14.213 -8.233 1.00 0.00 H new ATOM 0 HA ILE A 79 7.096 -11.725 -6.588 1.00 0.00 H new ATOM 0 HB ILE A 79 8.768 -10.977 -7.995 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.108 -12.968 -9.280 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.463 -13.526 -9.509 1.00 0.00 H new ATOM 0 HG21 ILE A 79 10.676 -12.487 -7.209 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.482 -12.182 -5.925 1.00 0.00 H new ATOM 0 HG23 ILE A 79 9.471 -13.731 -6.802 1.00 0.00 H new ATOM 0 HD11 ILE A 79 9.196 -12.157 -11.408 1.00 0.00 H new ATOM 0 HD12 ILE A 79 7.858 -11.359 -10.548 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.529 -10.792 -10.316 1.00 0.00 H new ATOM 1172 N TYR A 80 5.747 -10.545 -8.407 1.00 0.00 N ATOM 1173 CA TYR A 80 5.147 -9.822 -9.510 1.00 0.00 C ATOM 1174 C TYR A 80 5.425 -8.339 -9.301 1.00 0.00 C ATOM 1175 O TYR A 80 5.065 -7.815 -8.250 1.00 0.00 O ATOM 1176 CB TYR A 80 3.646 -10.140 -9.582 1.00 0.00 C ATOM 1177 CG TYR A 80 3.096 -10.013 -10.983 1.00 0.00 C ATOM 1178 CD1 TYR A 80 3.347 -11.025 -11.928 1.00 0.00 C ATOM 1179 CD2 TYR A 80 2.383 -8.865 -11.356 1.00 0.00 C ATOM 1180 CE1 TYR A 80 2.898 -10.880 -13.252 1.00 0.00 C ATOM 1181 CE2 TYR A 80 1.957 -8.695 -12.680 1.00 0.00 C ATOM 1182 CZ TYR A 80 2.216 -9.701 -13.634 1.00 0.00 C ATOM 1183 OH TYR A 80 1.805 -9.543 -14.917 1.00 0.00 O ATOM 0 H TYR A 80 5.797 -10.015 -7.537 1.00 0.00 H new ATOM 0 HA TYR A 80 5.575 -10.123 -10.467 1.00 0.00 H new ATOM 0 HB2 TYR A 80 3.474 -11.153 -9.218 1.00 0.00 H new ATOM 0 HB3 TYR A 80 3.103 -9.467 -8.919 1.00 0.00 H new ATOM 0 HD1 TYR A 80 3.885 -11.914 -11.636 1.00 0.00 H new ATOM 0 HD2 TYR A 80 2.161 -8.108 -10.619 1.00 0.00 H new ATOM 0 HE1 TYR A 80 3.073 -11.664 -13.974 1.00 0.00 H new ATOM 0 HE2 TYR A 80 1.432 -7.797 -12.969 1.00 0.00 H new ATOM 0 HH TYR A 80 1.352 -8.679 -15.011 1.00 0.00 H new ATOM 1193 N GLY A 81 6.037 -7.657 -10.267 1.00 0.00 N ATOM 1194 CA GLY A 81 6.049 -6.200 -10.295 1.00 0.00 C ATOM 1195 C GLY A 81 4.625 -5.733 -10.571 1.00 0.00 C ATOM 1196 O GLY A 81 3.933 -6.337 -11.393 1.00 0.00 O ATOM 0 H GLY A 81 6.533 -8.095 -11.043 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.405 -5.802 -9.345 1.00 0.00 H new ATOM 0 HA3 GLY A 81 6.727 -5.837 -11.067 1.00 0.00 H new ATOM 1200 N VAL A 82 4.185 -4.683 -9.895 1.00 0.00 N ATOM 1201 CA VAL A 82 2.825 -4.167 -9.934 1.00 0.00 C ATOM 1202 C VAL A 82 2.885 -2.650 -10.112 1.00 0.00 C ATOM 1203 O VAL A 82 3.960 -2.040 -10.075 1.00 0.00 O ATOM 1204 CB VAL A 82 2.047 -4.599 -8.663 1.00 0.00 C ATOM 1205 CG1 VAL A 82 1.697 -6.093 -8.697 1.00 0.00 C ATOM 1206 CG2 VAL A 82 2.798 -4.313 -7.353 1.00 0.00 C ATOM 0 H VAL A 82 4.792 -4.144 -9.278 1.00 0.00 H new ATOM 0 HA VAL A 82 2.277 -4.584 -10.779 1.00 0.00 H new ATOM 0 HB VAL A 82 1.141 -3.994 -8.676 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.153 -6.360 -7.791 1.00 0.00 H new ATOM 0 HG12 VAL A 82 1.076 -6.301 -9.568 1.00 0.00 H new ATOM 0 HG13 VAL A 82 2.613 -6.680 -8.756 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.193 -4.641 -6.508 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.746 -4.851 -7.352 1.00 0.00 H new ATOM 0 HG23 VAL A 82 2.988 -3.243 -7.269 1.00 0.00 H new ATOM 1216 N VAL A 83 1.724 -2.029 -10.280 1.00 0.00 N ATOM 1217 CA VAL A 83 1.585 -0.582 -10.250 1.00 0.00 C ATOM 1218 C VAL A 83 1.177 -0.179 -8.838 1.00 0.00 C ATOM 1219 O VAL A 83 0.664 -1.004 -8.078 1.00 0.00 O ATOM 1220 CB VAL A 83 0.559 -0.127 -11.306 1.00 0.00 C ATOM 1221 CG1 VAL A 83 1.180 -0.307 -12.691 1.00 0.00 C ATOM 1222 CG2 VAL A 83 -0.782 -0.882 -11.243 1.00 0.00 C ATOM 0 H VAL A 83 0.846 -2.522 -10.442 1.00 0.00 H new ATOM 0 HA VAL A 83 2.527 -0.092 -10.498 1.00 0.00 H new ATOM 0 HB VAL A 83 0.326 0.917 -11.098 1.00 0.00 H new ATOM 0 HG11 VAL A 83 0.468 0.010 -13.453 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.084 0.297 -12.766 1.00 0.00 H new ATOM 0 HG13 VAL A 83 1.431 -1.357 -12.844 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.449 -0.504 -12.018 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.608 -1.946 -11.402 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -1.239 -0.731 -10.265 1.00 0.00 H new ATOM 1232 N GLY A 84 1.386 1.090 -8.509 1.00 0.00 N ATOM 1233 CA GLY A 84 0.829 1.766 -7.353 1.00 0.00 C ATOM 1234 C GLY A 84 0.548 3.205 -7.770 1.00 0.00 C ATOM 1235 O GLY A 84 1.020 3.630 -8.826 1.00 0.00 O ATOM 0 H GLY A 84 1.978 1.702 -9.071 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.086 1.275 -7.023 1.00 0.00 H new ATOM 0 HA3 GLY A 84 1.526 1.736 -6.516 1.00 0.00 H new ATOM 1239 N VAL A 85 -0.166 3.983 -6.964 1.00 0.00 N ATOM 1240 CA VAL A 85 -0.327 5.423 -7.156 1.00 0.00 C ATOM 1241 C VAL A 85 -0.318 6.027 -5.759 1.00 0.00 C ATOM 1242 O VAL A 85 -1.123 5.638 -4.916 1.00 0.00 O ATOM 1243 CB VAL A 85 -1.607 5.782 -7.948 1.00 0.00 C ATOM 1244 CG1 VAL A 85 -1.519 5.359 -9.421 1.00 0.00 C ATOM 1245 CG2 VAL A 85 -2.882 5.195 -7.328 1.00 0.00 C ATOM 0 H VAL A 85 -0.658 3.627 -6.145 1.00 0.00 H new ATOM 0 HA VAL A 85 0.480 5.828 -7.766 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.672 6.869 -7.895 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -2.441 5.633 -9.934 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.677 5.863 -9.895 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.376 4.280 -9.482 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.745 5.482 -7.929 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.805 4.108 -7.299 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -3.003 5.577 -6.314 1.00 0.00 H new ATOM 1255 N GLY A 86 0.613 6.928 -5.489 1.00 0.00 N ATOM 1256 CA GLY A 86 0.861 7.507 -4.177 1.00 0.00 C ATOM 1257 C GLY A 86 0.903 9.016 -4.317 1.00 0.00 C ATOM 1258 O GLY A 86 1.817 9.546 -4.953 1.00 0.00 O ATOM 0 H GLY A 86 1.242 7.291 -6.206 1.00 0.00 H new ATOM 0 HA2 GLY A 86 0.077 7.213 -3.479 1.00 0.00 H new ATOM 0 HA3 GLY A 86 1.803 7.138 -3.772 1.00 0.00 H new ATOM 1262 N TYR A 87 -0.096 9.721 -3.791 1.00 0.00 N ATOM 1263 CA TYR A 87 -0.088 11.178 -3.769 1.00 0.00 C ATOM 1264 C TYR A 87 -0.757 11.702 -2.510 1.00 0.00 C ATOM 1265 O TYR A 87 -1.472 10.953 -1.837 1.00 0.00 O ATOM 1266 CB TYR A 87 -0.775 11.739 -5.017 1.00 0.00 C ATOM 1267 CG TYR A 87 -0.060 12.949 -5.575 1.00 0.00 C ATOM 1268 CD1 TYR A 87 1.022 12.743 -6.447 1.00 0.00 C ATOM 1269 CD2 TYR A 87 -0.472 14.259 -5.257 1.00 0.00 C ATOM 1270 CE1 TYR A 87 1.601 13.824 -7.125 1.00 0.00 C ATOM 1271 CE2 TYR A 87 0.157 15.358 -5.873 1.00 0.00 C ATOM 1272 CZ TYR A 87 1.151 15.132 -6.855 1.00 0.00 C ATOM 1273 OH TYR A 87 1.619 16.162 -7.607 1.00 0.00 O ATOM 0 H TYR A 87 -0.926 9.301 -3.372 1.00 0.00 H new ATOM 0 HA TYR A 87 0.949 11.513 -3.767 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -0.822 10.964 -5.782 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -1.802 12.008 -4.772 1.00 0.00 H new ATOM 0 HD1 TYR A 87 1.410 11.746 -6.596 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -1.267 14.419 -4.544 1.00 0.00 H new ATOM 0 HE1 TYR A 87 2.385 13.656 -7.848 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -0.117 16.366 -5.598 1.00 0.00 H new ATOM 0 HH TYR A 87 1.215 17.001 -7.301 1.00 0.00 H new ATOM 1283 N GLY A 88 -0.577 13.001 -2.251 1.00 0.00 N ATOM 1284 CA GLY A 88 -1.277 13.695 -1.179 1.00 0.00 C ATOM 1285 C GLY A 88 -2.729 13.934 -1.586 1.00 0.00 C ATOM 1286 O GLY A 88 -3.127 13.616 -2.711 1.00 0.00 O ATOM 0 H GLY A 88 0.059 13.596 -2.782 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.238 13.105 -0.264 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.787 14.645 -0.967 1.00 0.00 H new ATOM 1290 N LYS A 89 -3.542 14.500 -0.696 1.00 0.00 N ATOM 1291 CA LYS A 89 -4.866 15.019 -1.036 1.00 0.00 C ATOM 1292 C LYS A 89 -5.165 16.190 -0.105 1.00 0.00 C ATOM 1293 O LYS A 89 -4.310 16.521 0.721 1.00 0.00 O ATOM 1294 CB LYS A 89 -5.933 13.897 -1.001 1.00 0.00 C ATOM 1295 CG LYS A 89 -7.111 14.236 -1.930 1.00 0.00 C ATOM 1296 CD LYS A 89 -7.947 13.054 -2.436 1.00 0.00 C ATOM 1297 CE LYS A 89 -8.741 13.432 -3.702 1.00 0.00 C ATOM 1298 NZ LYS A 89 -9.520 14.686 -3.565 1.00 0.00 N ATOM 0 H LYS A 89 -3.299 14.612 0.288 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.890 15.388 -2.061 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -5.484 12.952 -1.306 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -6.294 13.764 0.019 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -7.774 14.922 -1.403 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -6.720 14.772 -2.795 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.293 12.209 -2.653 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.635 12.732 -1.655 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -8.048 13.534 -4.537 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -9.421 12.617 -3.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -10.131 14.808 -4.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -10.107 14.638 -2.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -8.868 15.493 -3.493 1.00 0.00 H new ATOM 1312 N PHE A 90 -6.366 16.766 -0.176 1.00 0.00 N ATOM 1313 CA PHE A 90 -6.776 17.905 0.638 1.00 0.00 C ATOM 1314 C PHE A 90 -5.808 19.079 0.447 1.00 0.00 C ATOM 1315 O PHE A 90 -5.202 19.184 -0.627 1.00 0.00 O ATOM 1316 CB PHE A 90 -7.076 17.458 2.078 1.00 0.00 C ATOM 1317 CG PHE A 90 -8.338 16.625 2.176 1.00 0.00 C ATOM 1318 CD1 PHE A 90 -9.587 17.244 1.978 1.00 0.00 C ATOM 1319 CD2 PHE A 90 -8.276 15.239 2.416 1.00 0.00 C ATOM 1320 CE1 PHE A 90 -10.766 16.484 2.012 1.00 0.00 C ATOM 1321 CE2 PHE A 90 -9.460 14.482 2.460 1.00 0.00 C ATOM 1322 CZ PHE A 90 -10.705 15.102 2.263 1.00 0.00 C ATOM 0 H PHE A 90 -7.094 16.445 -0.815 1.00 0.00 H new ATOM 0 HA PHE A 90 -7.729 18.312 0.300 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -6.233 16.881 2.459 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -7.174 18.337 2.715 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -9.638 18.308 1.799 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.321 14.758 2.566 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -11.721 16.961 1.845 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -9.412 13.419 2.646 1.00 0.00 H new ATOM 0 HZ PHE A 90 -11.613 14.519 2.304 1.00 0.00 H new ATOM 1332 N GLN A 91 -5.785 20.059 1.351 1.00 0.00 N ATOM 1333 CA GLN A 91 -4.994 21.265 1.164 1.00 0.00 C ATOM 1334 C GLN A 91 -4.684 21.918 2.506 1.00 0.00 C ATOM 1335 O GLN A 91 -5.152 21.460 3.554 1.00 0.00 O ATOM 1336 CB GLN A 91 -5.697 22.249 0.201 1.00 0.00 C ATOM 1337 CG GLN A 91 -6.910 23.015 0.770 1.00 0.00 C ATOM 1338 CD GLN A 91 -7.241 24.237 -0.085 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -6.349 24.965 -0.514 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -8.506 24.492 -0.360 1.00 0.00 N ATOM 0 H GLN A 91 -6.311 20.036 2.225 1.00 0.00 H new ATOM 0 HA GLN A 91 -4.047 20.984 0.704 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -4.962 22.978 -0.140 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -6.025 21.693 -0.677 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.775 22.353 0.813 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -6.698 23.329 1.792 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -9.239 23.882 0.001 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.751 25.299 -0.933 1.00 0.00 H new ATOM 1349 N THR A 92 -3.988 23.048 2.426 1.00 0.00 N ATOM 1350 CA THR A 92 -3.639 23.897 3.548 1.00 0.00 C ATOM 1351 C THR A 92 -4.097 25.304 3.167 1.00 0.00 C ATOM 1352 O THR A 92 -3.658 25.811 2.130 1.00 0.00 O ATOM 1353 CB THR A 92 -2.125 23.789 3.826 1.00 0.00 C ATOM 1354 OG1 THR A 92 -1.720 22.442 4.027 1.00 0.00 O ATOM 1355 CG2 THR A 92 -1.707 24.605 5.047 1.00 0.00 C ATOM 0 H THR A 92 -3.639 23.408 1.537 1.00 0.00 H new ATOM 0 HA THR A 92 -4.125 23.604 4.479 1.00 0.00 H new ATOM 0 HB THR A 92 -1.633 24.189 2.940 1.00 0.00 H new ATOM 0 HG1 THR A 92 -0.756 22.413 4.199 1.00 0.00 H new ATOM 0 HG21 THR A 92 -0.634 24.500 5.205 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.948 25.655 4.883 1.00 0.00 H new ATOM 0 HG23 THR A 92 -2.240 24.244 5.926 1.00 0.00 H new ATOM 1363 N THR A 93 -5.040 25.881 3.921 1.00 0.00 N ATOM 1364 CA THR A 93 -5.487 27.257 3.731 1.00 0.00 C ATOM 1365 C THR A 93 -6.088 27.770 5.051 1.00 0.00 C ATOM 1366 O THR A 93 -5.502 28.650 5.685 1.00 0.00 O ATOM 1367 CB THR A 93 -6.379 27.371 2.468 1.00 0.00 C ATOM 1368 OG1 THR A 93 -6.662 28.715 2.157 1.00 0.00 O ATOM 1369 CG2 THR A 93 -7.707 26.602 2.521 1.00 0.00 C ATOM 0 H THR A 93 -5.515 25.399 4.684 1.00 0.00 H new ATOM 0 HA THR A 93 -4.658 27.930 3.513 1.00 0.00 H new ATOM 0 HB THR A 93 -5.774 26.902 1.692 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.337 29.059 2.779 1.00 0.00 H new ATOM 0 HG21 THR A 93 -8.251 26.751 1.588 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.507 25.539 2.659 1.00 0.00 H new ATOM 0 HG23 THR A 93 -8.307 26.969 3.353 1.00 0.00 H new ATOM 1377 N GLU A 94 -7.176 27.149 5.516 1.00 0.00 N ATOM 1378 CA GLU A 94 -8.047 27.492 6.645 1.00 0.00 C ATOM 1379 C GLU A 94 -8.702 28.861 6.500 1.00 0.00 C ATOM 1380 O GLU A 94 -9.929 28.934 6.467 1.00 0.00 O ATOM 1381 CB GLU A 94 -7.374 27.304 8.020 1.00 0.00 C ATOM 1382 CG GLU A 94 -7.844 26.029 8.730 1.00 0.00 C ATOM 1383 CD GLU A 94 -9.295 26.081 9.234 1.00 0.00 C ATOM 1384 OE1 GLU A 94 -10.237 25.900 8.424 1.00 0.00 O ATOM 1385 OE2 GLU A 94 -9.491 26.188 10.468 1.00 0.00 O ATOM 0 H GLU A 94 -7.505 26.298 5.059 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.856 26.762 6.609 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -6.292 27.267 7.890 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -7.590 28.168 8.649 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -7.740 25.187 8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.185 25.835 9.576 1.00 0.00 H new ATOM 1392 N TYR A 95 -7.919 29.932 6.405 1.00 0.00 N ATOM 1393 CA TYR A 95 -8.454 31.259 6.151 1.00 0.00 C ATOM 1394 C TYR A 95 -9.187 31.260 4.800 1.00 0.00 C ATOM 1395 O TYR A 95 -8.817 30.490 3.906 1.00 0.00 O ATOM 1396 CB TYR A 95 -7.323 32.298 6.197 1.00 0.00 C ATOM 1397 CG TYR A 95 -7.045 32.846 7.588 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -6.719 31.983 8.655 1.00 0.00 C ATOM 1399 CD2 TYR A 95 -7.143 34.232 7.826 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -6.507 32.493 9.949 1.00 0.00 C ATOM 1401 CE2 TYR A 95 -6.927 34.751 9.115 1.00 0.00 C ATOM 1402 CZ TYR A 95 -6.612 33.883 10.184 1.00 0.00 C ATOM 1403 OH TYR A 95 -6.419 34.397 11.430 1.00 0.00 O ATOM 0 H TYR A 95 -6.904 29.902 6.502 1.00 0.00 H new ATOM 0 HA TYR A 95 -9.173 31.530 6.924 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -6.411 31.846 5.807 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -7.577 33.126 5.535 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -6.631 30.921 8.477 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -7.386 34.900 7.013 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -6.264 31.824 10.761 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -7.002 35.814 9.288 1.00 0.00 H new ATOM 0 HH TYR A 95 -6.530 35.370 11.403 1.00 0.00 H new ATOM 1413 N PRO A 96 -10.209 32.119 4.620 1.00 0.00 N ATOM 1414 CA PRO A 96 -10.986 32.193 3.392 1.00 0.00 C ATOM 1415 C PRO A 96 -10.116 32.752 2.265 1.00 0.00 C ATOM 1416 O PRO A 96 -10.065 33.958 2.023 1.00 0.00 O ATOM 1417 CB PRO A 96 -12.214 33.047 3.725 1.00 0.00 C ATOM 1418 CG PRO A 96 -11.725 33.940 4.863 1.00 0.00 C ATOM 1419 CD PRO A 96 -10.746 33.040 5.613 1.00 0.00 C ATOM 0 HA PRO A 96 -11.322 31.221 3.030 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -12.541 33.633 2.866 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -13.060 32.432 4.032 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -11.239 34.841 4.488 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -12.546 34.264 5.503 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.950 33.626 6.073 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -11.248 32.500 6.415 1.00 0.00 H new ATOM 1427 N THR A 97 -9.365 31.878 1.603 1.00 0.00 N ATOM 1428 CA THR A 97 -8.386 32.235 0.587 1.00 0.00 C ATOM 1429 C THR A 97 -8.281 31.102 -0.439 1.00 0.00 C ATOM 1430 O THR A 97 -8.368 31.389 -1.633 1.00 0.00 O ATOM 1431 CB THR A 97 -7.043 32.553 1.277 1.00 0.00 C ATOM 1432 OG1 THR A 97 -7.222 33.535 2.284 1.00 0.00 O ATOM 1433 CG2 THR A 97 -5.991 33.094 0.305 1.00 0.00 C ATOM 0 H THR A 97 -9.424 30.873 1.765 1.00 0.00 H new ATOM 0 HA THR A 97 -8.691 33.128 0.042 1.00 0.00 H new ATOM 0 HB THR A 97 -6.695 31.609 1.695 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.361 33.724 2.713 1.00 0.00 H new ATOM 0 HG21 THR A 97 -5.067 33.300 0.846 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.799 32.354 -0.472 1.00 0.00 H new ATOM 0 HG23 THR A 97 -6.357 34.014 -0.152 1.00 0.00 H new ATOM 1441 N TYR A 98 -8.186 29.838 0.009 1.00 0.00 N ATOM 1442 CA TYR A 98 -7.871 28.668 -0.813 1.00 0.00 C ATOM 1443 C TYR A 98 -6.461 28.757 -1.417 1.00 0.00 C ATOM 1444 O TYR A 98 -5.857 29.830 -1.518 1.00 0.00 O ATOM 1445 CB TYR A 98 -8.994 28.349 -1.826 1.00 0.00 C ATOM 1446 CG TYR A 98 -10.101 27.437 -1.312 1.00 0.00 C ATOM 1447 CD1 TYR A 98 -10.612 27.557 -0.002 1.00 0.00 C ATOM 1448 CD2 TYR A 98 -10.636 26.455 -2.170 1.00 0.00 C ATOM 1449 CE1 TYR A 98 -11.615 26.683 0.453 1.00 0.00 C ATOM 1450 CE2 TYR A 98 -11.613 25.558 -1.711 1.00 0.00 C ATOM 1451 CZ TYR A 98 -12.102 25.664 -0.394 1.00 0.00 C ATOM 1452 OH TYR A 98 -13.018 24.768 0.056 1.00 0.00 O ATOM 0 H TYR A 98 -8.333 29.600 0.990 1.00 0.00 H new ATOM 0 HA TYR A 98 -7.839 27.796 -0.160 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.442 29.287 -2.152 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -8.546 27.887 -2.706 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -10.230 28.325 0.655 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.291 26.392 -3.191 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -12.013 26.791 1.451 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.990 24.787 -2.367 1.00 0.00 H new ATOM 0 HH TYR A 98 -13.240 24.139 -0.662 1.00 0.00 H new ATOM 1462 N LYS A 99 -5.885 27.601 -1.762 1.00 0.00 N ATOM 1463 CA LYS A 99 -4.492 27.513 -2.194 1.00 0.00 C ATOM 1464 C LYS A 99 -4.308 26.400 -3.212 1.00 0.00 C ATOM 1465 O LYS A 99 -3.807 26.692 -4.296 1.00 0.00 O ATOM 1466 CB LYS A 99 -3.584 27.368 -0.966 1.00 0.00 C ATOM 1467 CG LYS A 99 -2.100 27.436 -1.368 1.00 0.00 C ATOM 1468 CD LYS A 99 -1.216 28.149 -0.329 1.00 0.00 C ATOM 1469 CE LYS A 99 -0.178 29.075 -0.981 1.00 0.00 C ATOM 1470 NZ LYS A 99 -0.804 30.163 -1.769 1.00 0.00 N ATOM 0 H LYS A 99 -6.372 26.705 -1.749 1.00 0.00 H new ATOM 0 HA LYS A 99 -4.204 28.432 -2.705 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.807 28.158 -0.249 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.787 26.419 -0.469 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -1.726 26.423 -1.519 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -2.014 27.953 -2.324 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.847 28.731 0.343 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -0.703 27.405 0.280 1.00 0.00 H new ATOM 0 HE2 LYS A 99 0.454 29.509 -0.206 1.00 0.00 H new ATOM 0 HE3 LYS A 99 0.471 28.488 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -0.163 30.982 -1.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.988 29.829 -2.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -1.701 30.443 -1.323 1.00 0.00 H new ATOM 1484 N ASN A 100 -4.744 25.171 -2.898 1.00 0.00 N ATOM 1485 CA ASN A 100 -5.052 24.127 -3.892 1.00 0.00 C ATOM 1486 C ASN A 100 -3.983 24.006 -4.989 1.00 0.00 C ATOM 1487 O ASN A 100 -4.202 24.446 -6.122 1.00 0.00 O ATOM 1488 CB ASN A 100 -6.422 24.387 -4.557 1.00 0.00 C ATOM 1489 CG ASN A 100 -7.602 24.368 -3.612 1.00 0.00 C ATOM 1490 OD1 ASN A 100 -7.946 25.388 -3.031 1.00 0.00 O ATOM 1491 ND2 ASN A 100 -8.240 23.224 -3.435 1.00 0.00 N ATOM 0 H ASN A 100 -4.895 24.869 -1.936 1.00 0.00 H new ATOM 0 HA ASN A 100 -5.073 23.188 -3.339 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.390 25.356 -5.055 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.582 23.636 -5.331 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -9.039 23.178 -2.802 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -7.934 22.387 -3.931 1.00 0.00 H new ATOM 1498 N ASP A 101 -2.834 23.396 -4.686 1.00 0.00 N ATOM 1499 CA ASP A 101 -1.807 23.133 -5.699 1.00 0.00 C ATOM 1500 C ASP A 101 -1.484 21.640 -5.706 1.00 0.00 C ATOM 1501 O ASP A 101 -1.853 20.936 -6.647 1.00 0.00 O ATOM 1502 CB ASP A 101 -0.576 24.038 -5.504 1.00 0.00 C ATOM 1503 CG ASP A 101 0.277 24.233 -6.759 1.00 0.00 C ATOM 1504 OD1 ASP A 101 -0.074 23.736 -7.853 1.00 0.00 O ATOM 1505 OD2 ASP A 101 1.317 24.925 -6.652 1.00 0.00 O ATOM 0 H ASP A 101 -2.591 23.075 -3.749 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.185 23.389 -6.689 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.911 25.014 -5.153 1.00 0.00 H new ATOM 0 HB3 ASP A 101 0.049 23.614 -4.718 1.00 0.00 H new ATOM 1510 N THR A 102 -0.851 21.131 -4.648 1.00 0.00 N ATOM 1511 CA THR A 102 -0.392 19.749 -4.606 1.00 0.00 C ATOM 1512 C THR A 102 -1.556 18.826 -4.208 1.00 0.00 C ATOM 1513 O THR A 102 -1.804 18.634 -3.016 1.00 0.00 O ATOM 1514 CB THR A 102 0.814 19.641 -3.643 1.00 0.00 C ATOM 1515 OG1 THR A 102 1.649 20.786 -3.731 1.00 0.00 O ATOM 1516 CG2 THR A 102 1.656 18.404 -3.954 1.00 0.00 C ATOM 0 H THR A 102 -0.645 21.664 -3.803 1.00 0.00 H new ATOM 0 HA THR A 102 -0.054 19.427 -5.591 1.00 0.00 H new ATOM 0 HB THR A 102 0.406 19.565 -2.635 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.401 20.691 -3.110 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.497 18.353 -3.262 1.00 0.00 H new ATOM 0 HG22 THR A 102 1.042 17.510 -3.846 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.030 18.466 -4.976 1.00 0.00 H new ATOM 1524 N SER A 103 -2.274 18.246 -5.174 1.00 0.00 N ATOM 1525 CA SER A 103 -3.296 17.220 -4.953 1.00 0.00 C ATOM 1526 C SER A 103 -3.670 16.653 -6.324 1.00 0.00 C ATOM 1527 O SER A 103 -4.714 17.029 -6.857 1.00 0.00 O ATOM 1528 CB SER A 103 -4.530 17.831 -4.246 1.00 0.00 C ATOM 1529 OG SER A 103 -5.505 16.861 -3.885 1.00 0.00 O ATOM 0 H SER A 103 -2.157 18.484 -6.159 1.00 0.00 H new ATOM 0 HA SER A 103 -2.919 16.427 -4.307 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.203 18.359 -3.350 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.988 18.570 -4.903 1.00 0.00 H new ATOM 0 HG SER A 103 -6.259 17.304 -3.442 1.00 0.00 H new ATOM 1535 N ASP A 104 -2.839 15.800 -6.932 1.00 0.00 N ATOM 1536 CA ASP A 104 -3.209 15.190 -8.217 1.00 0.00 C ATOM 1537 C ASP A 104 -2.270 14.029 -8.517 1.00 0.00 C ATOM 1538 O ASP A 104 -1.065 14.228 -8.435 1.00 0.00 O ATOM 1539 CB ASP A 104 -3.106 16.211 -9.366 1.00 0.00 C ATOM 1540 CG ASP A 104 -3.951 15.823 -10.581 1.00 0.00 C ATOM 1541 OD1 ASP A 104 -4.523 14.713 -10.618 1.00 0.00 O ATOM 1542 OD2 ASP A 104 -4.106 16.683 -11.478 1.00 0.00 O ATOM 0 H ASP A 104 -1.928 15.520 -6.568 1.00 0.00 H new ATOM 0 HA ASP A 104 -4.239 14.842 -8.141 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -3.423 17.190 -9.006 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -2.063 16.306 -9.669 1.00 0.00 H new ATOM 1547 N TYR A 105 -2.788 12.842 -8.840 1.00 0.00 N ATOM 1548 CA TYR A 105 -2.046 11.582 -8.822 1.00 0.00 C ATOM 1549 C TYR A 105 -0.675 11.653 -9.521 1.00 0.00 C ATOM 1550 O TYR A 105 -0.517 12.277 -10.575 1.00 0.00 O ATOM 1551 CB TYR A 105 -2.915 10.435 -9.372 1.00 0.00 C ATOM 1552 CG TYR A 105 -2.930 10.285 -10.886 1.00 0.00 C ATOM 1553 CD1 TYR A 105 -3.490 11.290 -11.697 1.00 0.00 C ATOM 1554 CD2 TYR A 105 -2.326 9.163 -11.490 1.00 0.00 C ATOM 1555 CE1 TYR A 105 -3.386 11.208 -13.094 1.00 0.00 C ATOM 1556 CE2 TYR A 105 -2.225 9.072 -12.889 1.00 0.00 C ATOM 1557 CZ TYR A 105 -2.715 10.124 -13.696 1.00 0.00 C ATOM 1558 OH TYR A 105 -2.511 10.120 -15.044 1.00 0.00 O ATOM 0 H TYR A 105 -3.760 12.729 -9.128 1.00 0.00 H new ATOM 0 HA TYR A 105 -1.816 11.375 -7.777 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -2.566 9.499 -8.936 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -3.939 10.584 -9.030 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -4.001 12.126 -11.243 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -1.938 8.367 -10.872 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.822 11.979 -13.711 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -1.775 8.203 -13.345 1.00 0.00 H new ATOM 0 HH TYR A 105 -2.034 9.303 -15.300 1.00 0.00 H new ATOM 1568 N GLY A 106 0.321 10.990 -8.928 1.00 0.00 N ATOM 1569 CA GLY A 106 1.662 10.846 -9.474 1.00 0.00 C ATOM 1570 C GLY A 106 1.756 9.518 -10.209 1.00 0.00 C ATOM 1571 O GLY A 106 0.747 9.005 -10.695 1.00 0.00 O ATOM 0 H GLY A 106 0.207 10.526 -8.027 1.00 0.00 H new ATOM 0 HA2 GLY A 106 1.882 11.669 -10.154 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.401 10.887 -8.674 1.00 0.00 H new ATOM 1575 N PHE A 107 2.959 8.949 -10.273 1.00 0.00 N ATOM 1576 CA PHE A 107 3.134 7.593 -10.769 1.00 0.00 C ATOM 1577 C PHE A 107 3.995 6.836 -9.772 1.00 0.00 C ATOM 1578 O PHE A 107 4.969 7.395 -9.253 1.00 0.00 O ATOM 1579 CB PHE A 107 3.756 7.610 -12.171 1.00 0.00 C ATOM 1580 CG PHE A 107 3.447 6.358 -12.968 1.00 0.00 C ATOM 1581 CD1 PHE A 107 2.287 6.317 -13.763 1.00 0.00 C ATOM 1582 CD2 PHE A 107 4.274 5.221 -12.880 1.00 0.00 C ATOM 1583 CE1 PHE A 107 1.961 5.154 -14.481 1.00 0.00 C ATOM 1584 CE2 PHE A 107 3.942 4.053 -13.590 1.00 0.00 C ATOM 1585 CZ PHE A 107 2.788 4.023 -14.394 1.00 0.00 C ATOM 0 H PHE A 107 3.823 9.409 -9.987 1.00 0.00 H new ATOM 0 HA PHE A 107 2.172 7.090 -10.863 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.390 8.481 -12.715 1.00 0.00 H new ATOM 0 HB3 PHE A 107 4.837 7.721 -12.082 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.644 7.183 -13.822 1.00 0.00 H new ATOM 0 HD2 PHE A 107 5.163 5.246 -12.267 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.076 5.130 -15.099 1.00 0.00 H new ATOM 0 HE2 PHE A 107 4.573 3.179 -13.518 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.538 3.129 -14.945 1.00 0.00 H new ATOM 1595 N SER A 108 3.669 5.568 -9.538 1.00 0.00 N ATOM 1596 CA SER A 108 4.419 4.653 -8.698 1.00 0.00 C ATOM 1597 C SER A 108 4.377 3.263 -9.338 1.00 0.00 C ATOM 1598 O SER A 108 3.545 2.969 -10.204 1.00 0.00 O ATOM 1599 CB SER A 108 3.832 4.685 -7.278 1.00 0.00 C ATOM 1600 OG SER A 108 4.506 3.817 -6.395 1.00 0.00 O ATOM 0 H SER A 108 2.840 5.137 -9.948 1.00 0.00 H new ATOM 0 HA SER A 108 5.466 4.943 -8.615 1.00 0.00 H new ATOM 0 HB2 SER A 108 3.882 5.703 -6.891 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.778 4.411 -7.318 1.00 0.00 H new ATOM 0 HG SER A 108 3.905 3.564 -5.663 1.00 0.00 H new ATOM 1606 N TYR A 109 5.278 2.394 -8.895 1.00 0.00 N ATOM 1607 CA TYR A 109 5.255 0.967 -9.142 1.00 0.00 C ATOM 1608 C TYR A 109 5.833 0.292 -7.909 1.00 0.00 C ATOM 1609 O TYR A 109 6.654 0.888 -7.201 1.00 0.00 O ATOM 1610 CB TYR A 109 6.036 0.608 -10.412 1.00 0.00 C ATOM 1611 CG TYR A 109 7.513 0.970 -10.429 1.00 0.00 C ATOM 1612 CD1 TYR A 109 7.920 2.238 -10.883 1.00 0.00 C ATOM 1613 CD2 TYR A 109 8.484 0.011 -10.074 1.00 0.00 C ATOM 1614 CE1 TYR A 109 9.285 2.550 -10.991 1.00 0.00 C ATOM 1615 CE2 TYR A 109 9.854 0.312 -10.189 1.00 0.00 C ATOM 1616 CZ TYR A 109 10.258 1.582 -10.661 1.00 0.00 C ATOM 1617 OH TYR A 109 11.579 1.876 -10.804 1.00 0.00 O ATOM 0 H TYR A 109 6.077 2.683 -8.330 1.00 0.00 H new ATOM 0 HA TYR A 109 4.236 0.621 -9.315 1.00 0.00 H new ATOM 0 HB2 TYR A 109 5.947 -0.466 -10.574 1.00 0.00 H new ATOM 0 HB3 TYR A 109 5.555 1.099 -11.258 1.00 0.00 H new ATOM 0 HD1 TYR A 109 7.178 2.976 -11.150 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.175 -0.959 -9.712 1.00 0.00 H new ATOM 0 HE1 TYR A 109 9.590 3.530 -11.326 1.00 0.00 H new ATOM 0 HE2 TYR A 109 10.595 -0.425 -9.917 1.00 0.00 H new ATOM 0 HH TYR A 109 12.117 1.103 -10.533 1.00 0.00 H new ATOM 1627 N GLY A 110 5.424 -0.948 -7.672 1.00 0.00 N ATOM 1628 CA GLY A 110 5.816 -1.740 -6.523 1.00 0.00 C ATOM 1629 C GLY A 110 6.093 -3.168 -6.965 1.00 0.00 C ATOM 1630 O GLY A 110 6.070 -3.464 -8.161 1.00 0.00 O ATOM 0 H GLY A 110 4.789 -1.443 -8.298 1.00 0.00 H new ATOM 0 HA2 GLY A 110 6.705 -1.312 -6.059 1.00 0.00 H new ATOM 0 HA3 GLY A 110 5.026 -1.727 -5.772 1.00 0.00 H new ATOM 1634 N ALA A 111 6.305 -4.073 -6.012 1.00 0.00 N ATOM 1635 CA ALA A 111 6.300 -5.503 -6.271 1.00 0.00 C ATOM 1636 C ALA A 111 5.537 -6.211 -5.157 1.00 0.00 C ATOM 1637 O ALA A 111 5.570 -5.792 -3.997 1.00 0.00 O ATOM 1638 CB ALA A 111 7.729 -6.033 -6.398 1.00 0.00 C ATOM 0 H ALA A 111 6.485 -3.830 -5.038 1.00 0.00 H new ATOM 0 HA ALA A 111 5.798 -5.701 -7.218 1.00 0.00 H new ATOM 0 HB1 ALA A 111 7.703 -7.105 -6.592 1.00 0.00 H new ATOM 0 HB2 ALA A 111 8.233 -5.527 -7.222 1.00 0.00 H new ATOM 0 HB3 ALA A 111 8.271 -5.845 -5.471 1.00 0.00 H new ATOM 1644 N GLY A 112 4.860 -7.294 -5.516 1.00 0.00 N ATOM 1645 CA GLY A 112 4.274 -8.255 -4.611 1.00 0.00 C ATOM 1646 C GLY A 112 5.309 -9.341 -4.382 1.00 0.00 C ATOM 1647 O GLY A 112 5.622 -10.088 -5.314 1.00 0.00 O ATOM 0 H GLY A 112 4.701 -7.531 -6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 112 4.000 -7.780 -3.669 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.361 -8.675 -5.034 1.00 0.00 H new ATOM 1651 N LEU A 113 5.854 -9.401 -3.167 1.00 0.00 N ATOM 1652 CA LEU A 113 6.603 -10.547 -2.675 1.00 0.00 C ATOM 1653 C LEU A 113 5.774 -11.083 -1.514 1.00 0.00 C ATOM 1654 O LEU A 113 5.236 -10.293 -0.734 1.00 0.00 O ATOM 1655 CB LEU A 113 7.989 -10.113 -2.166 1.00 0.00 C ATOM 1656 CG LEU A 113 9.003 -9.540 -3.179 1.00 0.00 C ATOM 1657 CD1 LEU A 113 9.313 -10.543 -4.284 1.00 0.00 C ATOM 1658 CD2 LEU A 113 8.587 -8.211 -3.821 1.00 0.00 C ATOM 0 H LEU A 113 5.784 -8.641 -2.490 1.00 0.00 H new ATOM 0 HA LEU A 113 6.767 -11.290 -3.456 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.836 -9.363 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 113 8.451 -10.977 -1.688 1.00 0.00 H new ATOM 0 HG LEU A 113 9.892 -9.341 -2.581 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.030 -10.108 -4.980 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.735 -11.447 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.395 -10.792 -4.817 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.360 -7.886 -4.518 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.648 -8.344 -4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.458 -7.457 -3.045 1.00 0.00 H new ATOM 1670 N GLN A 114 5.648 -12.402 -1.394 1.00 0.00 N ATOM 1671 CA GLN A 114 4.732 -13.050 -0.461 1.00 0.00 C ATOM 1672 C GLN A 114 5.364 -14.363 0.008 1.00 0.00 C ATOM 1673 O GLN A 114 5.563 -15.261 -0.813 1.00 0.00 O ATOM 1674 CB GLN A 114 3.338 -13.220 -1.107 1.00 0.00 C ATOM 1675 CG GLN A 114 3.286 -13.683 -2.581 1.00 0.00 C ATOM 1676 CD GLN A 114 2.974 -12.572 -3.596 1.00 0.00 C ATOM 1677 OE1 GLN A 114 3.176 -11.383 -3.355 1.00 0.00 O ATOM 1678 NE2 GLN A 114 2.443 -12.942 -4.751 1.00 0.00 N ATOM 0 H GLN A 114 6.189 -13.062 -1.953 1.00 0.00 H new ATOM 0 HA GLN A 114 4.569 -12.434 0.423 1.00 0.00 H new ATOM 0 HB2 GLN A 114 2.775 -13.937 -0.509 1.00 0.00 H new ATOM 0 HB3 GLN A 114 2.816 -12.266 -1.035 1.00 0.00 H new ATOM 0 HG2 GLN A 114 4.245 -14.133 -2.840 1.00 0.00 H new ATOM 0 HG3 GLN A 114 2.531 -14.464 -2.675 1.00 0.00 H new ATOM 0 HE21 GLN A 114 2.279 -13.930 -4.943 1.00 0.00 H new ATOM 0 HE22 GLN A 114 2.198 -12.239 -5.448 1.00 0.00 H new ATOM 1687 N PHE A 115 5.737 -14.471 1.288 1.00 0.00 N ATOM 1688 CA PHE A 115 6.532 -15.582 1.806 1.00 0.00 C ATOM 1689 C PHE A 115 5.862 -16.215 3.031 1.00 0.00 C ATOM 1690 O PHE A 115 5.246 -15.522 3.848 1.00 0.00 O ATOM 1691 CB PHE A 115 7.937 -15.060 2.125 1.00 0.00 C ATOM 1692 CG PHE A 115 8.923 -16.139 2.519 1.00 0.00 C ATOM 1693 CD1 PHE A 115 9.699 -16.789 1.539 1.00 0.00 C ATOM 1694 CD2 PHE A 115 9.064 -16.498 3.870 1.00 0.00 C ATOM 1695 CE1 PHE A 115 10.617 -17.785 1.913 1.00 0.00 C ATOM 1696 CE2 PHE A 115 9.967 -17.508 4.239 1.00 0.00 C ATOM 1697 CZ PHE A 115 10.747 -18.149 3.264 1.00 0.00 C ATOM 0 H PHE A 115 5.491 -13.781 1.998 1.00 0.00 H new ATOM 0 HA PHE A 115 6.606 -16.371 1.058 1.00 0.00 H new ATOM 0 HB2 PHE A 115 8.323 -14.531 1.254 1.00 0.00 H new ATOM 0 HB3 PHE A 115 7.868 -14.333 2.934 1.00 0.00 H new ATOM 0 HD1 PHE A 115 9.588 -16.521 0.499 1.00 0.00 H new ATOM 0 HD2 PHE A 115 8.477 -15.997 4.625 1.00 0.00 H new ATOM 0 HE1 PHE A 115 11.223 -18.271 1.162 1.00 0.00 H new ATOM 0 HE2 PHE A 115 10.062 -17.793 5.277 1.00 0.00 H new ATOM 0 HZ PHE A 115 11.446 -18.921 3.552 1.00 0.00 H new ATOM 1707 N ASN A 116 6.013 -17.534 3.186 1.00 0.00 N ATOM 1708 CA ASN A 116 5.356 -18.323 4.223 1.00 0.00 C ATOM 1709 C ASN A 116 6.391 -19.250 4.861 1.00 0.00 C ATOM 1710 O ASN A 116 6.709 -20.284 4.270 1.00 0.00 O ATOM 1711 CB ASN A 116 4.206 -19.156 3.617 1.00 0.00 C ATOM 1712 CG ASN A 116 3.201 -18.331 2.832 1.00 0.00 C ATOM 1713 OD1 ASN A 116 3.017 -18.524 1.635 1.00 0.00 O ATOM 1714 ND2 ASN A 116 2.540 -17.374 3.454 1.00 0.00 N ATOM 0 H ASN A 116 6.611 -18.093 2.577 1.00 0.00 H new ATOM 0 HA ASN A 116 4.936 -17.658 4.977 1.00 0.00 H new ATOM 0 HB2 ASN A 116 4.628 -19.918 2.962 1.00 0.00 H new ATOM 0 HB3 ASN A 116 3.686 -19.678 4.420 1.00 0.00 H new ATOM 0 HD21 ASN A 116 1.876 -16.795 2.939 1.00 0.00 H new ATOM 0 HD22 ASN A 116 2.692 -17.213 4.450 1.00 0.00 H new ATOM 1721 N PRO A 117 6.941 -18.940 6.046 1.00 0.00 N ATOM 1722 CA PRO A 117 7.796 -19.881 6.754 1.00 0.00 C ATOM 1723 C PRO A 117 6.976 -20.939 7.501 1.00 0.00 C ATOM 1724 O PRO A 117 7.538 -21.988 7.828 1.00 0.00 O ATOM 1725 CB PRO A 117 8.594 -19.029 7.745 1.00 0.00 C ATOM 1726 CG PRO A 117 7.614 -17.909 8.083 1.00 0.00 C ATOM 1727 CD PRO A 117 6.831 -17.692 6.785 1.00 0.00 C ATOM 0 HA PRO A 117 8.437 -20.428 6.063 1.00 0.00 H new ATOM 0 HB2 PRO A 117 8.881 -19.598 8.630 1.00 0.00 H new ATOM 0 HB3 PRO A 117 9.512 -18.644 7.302 1.00 0.00 H new ATOM 0 HG2 PRO A 117 6.954 -18.191 8.904 1.00 0.00 H new ATOM 0 HG3 PRO A 117 8.135 -17.002 8.390 1.00 0.00 H new ATOM 0 HD2 PRO A 117 5.789 -17.450 6.992 1.00 0.00 H new ATOM 0 HD3 PRO A 117 7.243 -16.861 6.213 1.00 0.00 H new ATOM 1735 N MET A 118 5.701 -20.675 7.832 1.00 0.00 N ATOM 1736 CA MET A 118 4.998 -21.419 8.863 1.00 0.00 C ATOM 1737 C MET A 118 3.492 -21.369 8.600 1.00 0.00 C ATOM 1738 O MET A 118 3.038 -20.872 7.575 1.00 0.00 O ATOM 1739 CB MET A 118 5.397 -20.901 10.260 1.00 0.00 C ATOM 1740 CG MET A 118 5.678 -22.048 11.239 1.00 0.00 C ATOM 1741 SD MET A 118 7.145 -23.072 10.921 1.00 0.00 S ATOM 1742 CE MET A 118 8.469 -21.901 11.319 1.00 0.00 C ATOM 0 H MET A 118 5.142 -19.945 7.391 1.00 0.00 H new ATOM 0 HA MET A 118 5.287 -22.470 8.834 1.00 0.00 H new ATOM 0 HB2 MET A 118 6.283 -20.272 10.174 1.00 0.00 H new ATOM 0 HB3 MET A 118 4.598 -20.274 10.656 1.00 0.00 H new ATOM 0 HG2 MET A 118 5.773 -21.623 12.238 1.00 0.00 H new ATOM 0 HG3 MET A 118 4.806 -22.702 11.252 1.00 0.00 H new ATOM 0 HE1 MET A 118 9.434 -22.402 11.242 1.00 0.00 H new ATOM 0 HE2 MET A 118 8.437 -21.065 10.620 1.00 0.00 H new ATOM 0 HE3 MET A 118 8.333 -21.530 12.335 1.00 0.00 H new ATOM 1752 N GLU A 119 2.728 -21.946 9.520 1.00 0.00 N ATOM 1753 CA GLU A 119 1.318 -22.310 9.423 1.00 0.00 C ATOM 1754 C GLU A 119 0.494 -21.430 10.377 1.00 0.00 C ATOM 1755 O GLU A 119 -0.701 -21.635 10.558 1.00 0.00 O ATOM 1756 CB GLU A 119 1.173 -23.804 9.758 1.00 0.00 C ATOM 1757 CG GLU A 119 1.809 -24.721 8.703 1.00 0.00 C ATOM 1758 CD GLU A 119 1.904 -26.166 9.197 1.00 0.00 C ATOM 1759 OE1 GLU A 119 0.906 -26.918 9.133 1.00 0.00 O ATOM 1760 OE2 GLU A 119 2.993 -26.566 9.668 1.00 0.00 O ATOM 0 H GLU A 119 3.112 -22.193 10.432 1.00 0.00 H new ATOM 0 HA GLU A 119 0.943 -22.143 8.413 1.00 0.00 H new ATOM 0 HB2 GLU A 119 1.634 -24.000 10.726 1.00 0.00 H new ATOM 0 HB3 GLU A 119 0.115 -24.048 9.853 1.00 0.00 H new ATOM 0 HG2 GLU A 119 1.219 -24.687 7.787 1.00 0.00 H new ATOM 0 HG3 GLU A 119 2.805 -24.355 8.454 1.00 0.00 H new ATOM 1767 N ASN A 120 1.137 -20.447 11.009 1.00 0.00 N ATOM 1768 CA ASN A 120 0.519 -19.330 11.710 1.00 0.00 C ATOM 1769 C ASN A 120 1.411 -18.085 11.589 1.00 0.00 C ATOM 1770 O ASN A 120 1.300 -17.157 12.388 1.00 0.00 O ATOM 1771 CB ASN A 120 0.218 -19.687 13.176 1.00 0.00 C ATOM 1772 CG ASN A 120 1.380 -19.364 14.107 1.00 0.00 C ATOM 1773 OD1 ASN A 120 2.527 -19.729 13.856 1.00 0.00 O ATOM 1774 ND2 ASN A 120 1.111 -18.610 15.155 1.00 0.00 N ATOM 0 H ASN A 120 2.156 -20.410 11.045 1.00 0.00 H new ATOM 0 HA ASN A 120 -0.441 -19.106 11.244 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -0.668 -19.143 13.504 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -0.015 -20.749 13.247 1.00 0.00 H new ATOM 0 HD21 ASN A 120 1.863 -18.317 15.779 1.00 0.00 H new ATOM 0 HD22 ASN A 120 0.151 -18.320 15.342 1.00 0.00 H new ATOM 1781 N VAL A 121 2.311 -18.042 10.604 1.00 0.00 N ATOM 1782 CA VAL A 121 3.167 -16.897 10.334 1.00 0.00 C ATOM 1783 C VAL A 121 3.221 -16.746 8.821 1.00 0.00 C ATOM 1784 O VAL A 121 3.542 -17.710 8.121 1.00 0.00 O ATOM 1785 CB VAL A 121 4.559 -17.097 10.979 1.00 0.00 C ATOM 1786 CG1 VAL A 121 5.681 -16.243 10.378 1.00 0.00 C ATOM 1787 CG2 VAL A 121 4.520 -16.808 12.485 1.00 0.00 C ATOM 0 H VAL A 121 2.464 -18.820 9.962 1.00 0.00 H new ATOM 0 HA VAL A 121 2.777 -15.979 10.774 1.00 0.00 H new ATOM 0 HB VAL A 121 4.790 -18.142 10.773 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.616 -16.454 10.896 1.00 0.00 H new ATOM 0 HG12 VAL A 121 5.791 -16.479 9.320 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.434 -15.187 10.490 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.513 -16.957 12.910 1.00 0.00 H new ATOM 0 HG22 VAL A 121 4.206 -15.777 12.650 1.00 0.00 H new ATOM 0 HG23 VAL A 121 3.814 -17.484 12.967 1.00 0.00 H new ATOM 1797 N ALA A 122 2.928 -15.544 8.331 1.00 0.00 N ATOM 1798 CA ALA A 122 3.150 -15.143 6.958 1.00 0.00 C ATOM 1799 C ALA A 122 3.589 -13.691 7.012 1.00 0.00 C ATOM 1800 O ALA A 122 3.091 -12.912 7.832 1.00 0.00 O ATOM 1801 CB ALA A 122 1.882 -15.282 6.114 1.00 0.00 C ATOM 0 H ALA A 122 2.517 -14.805 8.902 1.00 0.00 H new ATOM 0 HA ALA A 122 3.900 -15.780 6.490 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.090 -14.971 5.090 1.00 0.00 H new ATOM 0 HB2 ALA A 122 1.554 -16.322 6.118 1.00 0.00 H new ATOM 0 HB3 ALA A 122 1.096 -14.652 6.531 1.00 0.00 H new ATOM 1807 N LEU A 123 4.516 -13.340 6.131 1.00 0.00 N ATOM 1808 CA LEU A 123 5.044 -11.998 6.002 1.00 0.00 C ATOM 1809 C LEU A 123 5.272 -11.718 4.529 1.00 0.00 C ATOM 1810 O LEU A 123 5.529 -12.617 3.718 1.00 0.00 O ATOM 1811 CB LEU A 123 6.279 -11.756 6.888 1.00 0.00 C ATOM 1812 CG LEU A 123 7.566 -12.560 6.612 1.00 0.00 C ATOM 1813 CD1 LEU A 123 8.652 -12.061 7.577 1.00 0.00 C ATOM 1814 CD2 LEU A 123 7.402 -14.074 6.821 1.00 0.00 C ATOM 0 H LEU A 123 4.929 -14.000 5.472 1.00 0.00 H new ATOM 0 HA LEU A 123 4.319 -11.277 6.380 1.00 0.00 H new ATOM 0 HB2 LEU A 123 6.531 -10.698 6.819 1.00 0.00 H new ATOM 0 HB3 LEU A 123 5.986 -11.948 7.920 1.00 0.00 H new ATOM 0 HG LEU A 123 7.826 -12.406 5.565 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.575 -12.614 7.403 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.828 -10.999 7.409 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.324 -12.216 8.605 1.00 0.00 H new ATOM 0 HD21 LEU A 123 8.347 -14.575 6.609 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.111 -14.269 7.853 1.00 0.00 H new ATOM 0 HD23 LEU A 123 6.632 -14.453 6.149 1.00 0.00 H new ATOM 1826 N ASP A 124 5.082 -10.463 4.168 1.00 0.00 N ATOM 1827 CA ASP A 124 5.073 -9.963 2.810 1.00 0.00 C ATOM 1828 C ASP A 124 5.586 -8.534 2.875 1.00 0.00 C ATOM 1829 O ASP A 124 5.537 -7.894 3.927 1.00 0.00 O ATOM 1830 CB ASP A 124 3.663 -10.020 2.206 1.00 0.00 C ATOM 1831 CG ASP A 124 2.699 -9.033 2.858 1.00 0.00 C ATOM 1832 OD1 ASP A 124 2.046 -9.424 3.855 1.00 0.00 O ATOM 1833 OD2 ASP A 124 2.555 -7.930 2.289 1.00 0.00 O ATOM 0 H ASP A 124 4.921 -9.726 4.854 1.00 0.00 H new ATOM 0 HA ASP A 124 5.704 -10.575 2.165 1.00 0.00 H new ATOM 0 HB2 ASP A 124 3.722 -9.811 1.138 1.00 0.00 H new ATOM 0 HB3 ASP A 124 3.268 -11.030 2.312 1.00 0.00 H new ATOM 1838 N PHE A 125 6.139 -8.080 1.757 1.00 0.00 N ATOM 1839 CA PHE A 125 6.956 -6.888 1.704 1.00 0.00 C ATOM 1840 C PHE A 125 6.762 -6.259 0.333 1.00 0.00 C ATOM 1841 O PHE A 125 6.991 -6.929 -0.681 1.00 0.00 O ATOM 1842 CB PHE A 125 8.426 -7.284 1.902 1.00 0.00 C ATOM 1843 CG PHE A 125 8.828 -7.740 3.293 1.00 0.00 C ATOM 1844 CD1 PHE A 125 9.205 -6.801 4.272 1.00 0.00 C ATOM 1845 CD2 PHE A 125 8.918 -9.114 3.582 1.00 0.00 C ATOM 1846 CE1 PHE A 125 9.670 -7.235 5.524 1.00 0.00 C ATOM 1847 CE2 PHE A 125 9.378 -9.548 4.837 1.00 0.00 C ATOM 1848 CZ PHE A 125 9.753 -8.607 5.811 1.00 0.00 C ATOM 0 H PHE A 125 6.027 -8.540 0.853 1.00 0.00 H new ATOM 0 HA PHE A 125 6.675 -6.180 2.484 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.660 -8.085 1.201 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.048 -6.431 1.631 1.00 0.00 H new ATOM 0 HD1 PHE A 125 9.136 -5.744 4.060 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.632 -9.840 2.835 1.00 0.00 H new ATOM 0 HE1 PHE A 125 9.965 -6.511 6.269 1.00 0.00 H new ATOM 0 HE2 PHE A 125 9.443 -10.604 5.053 1.00 0.00 H new ATOM 0 HZ PHE A 125 10.104 -8.938 6.777 1.00 0.00 H new ATOM 1858 N SER A 126 6.369 -4.988 0.290 1.00 0.00 N ATOM 1859 CA SER A 126 6.391 -4.168 -0.915 1.00 0.00 C ATOM 1860 C SER A 126 7.069 -2.832 -0.598 1.00 0.00 C ATOM 1861 O SER A 126 7.131 -2.422 0.567 1.00 0.00 O ATOM 1862 CB SER A 126 4.965 -3.967 -1.439 1.00 0.00 C ATOM 1863 OG SER A 126 4.330 -5.213 -1.700 1.00 0.00 O ATOM 0 H SER A 126 6.020 -4.491 1.109 1.00 0.00 H new ATOM 0 HA SER A 126 6.961 -4.668 -1.699 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.383 -3.406 -0.708 1.00 0.00 H new ATOM 0 HB3 SER A 126 4.991 -3.371 -2.352 1.00 0.00 H new ATOM 0 HG SER A 126 4.720 -5.617 -2.504 1.00 0.00 H new ATOM 1869 N TYR A 127 7.585 -2.176 -1.635 1.00 0.00 N ATOM 1870 CA TYR A 127 8.258 -0.887 -1.613 1.00 0.00 C ATOM 1871 C TYR A 127 7.724 -0.120 -2.819 1.00 0.00 C ATOM 1872 O TYR A 127 7.600 -0.709 -3.897 1.00 0.00 O ATOM 1873 CB TYR A 127 9.784 -1.078 -1.724 1.00 0.00 C ATOM 1874 CG TYR A 127 10.551 -0.793 -0.449 1.00 0.00 C ATOM 1875 CD1 TYR A 127 10.794 0.541 -0.075 1.00 0.00 C ATOM 1876 CD2 TYR A 127 11.068 -1.840 0.338 1.00 0.00 C ATOM 1877 CE1 TYR A 127 11.551 0.839 1.071 1.00 0.00 C ATOM 1878 CE2 TYR A 127 11.824 -1.550 1.490 1.00 0.00 C ATOM 1879 CZ TYR A 127 12.065 -0.209 1.864 1.00 0.00 C ATOM 1880 OH TYR A 127 12.780 0.078 2.984 1.00 0.00 O ATOM 0 H TYR A 127 7.538 -2.562 -2.578 1.00 0.00 H new ATOM 0 HA TYR A 127 8.071 -0.349 -0.683 1.00 0.00 H new ATOM 0 HB2 TYR A 127 9.987 -2.104 -2.033 1.00 0.00 H new ATOM 0 HB3 TYR A 127 10.162 -0.427 -2.513 1.00 0.00 H new ATOM 0 HD1 TYR A 127 10.394 1.345 -0.675 1.00 0.00 H new ATOM 0 HD2 TYR A 127 10.884 -2.867 0.058 1.00 0.00 H new ATOM 0 HE1 TYR A 127 11.739 1.867 1.344 1.00 0.00 H new ATOM 0 HE2 TYR A 127 12.221 -2.356 2.090 1.00 0.00 H new ATOM 0 HH TYR A 127 13.060 -0.756 3.416 1.00 0.00 H new ATOM 1890 N GLU A 128 7.413 1.160 -2.641 1.00 0.00 N ATOM 1891 CA GLU A 128 6.965 2.085 -3.675 1.00 0.00 C ATOM 1892 C GLU A 128 7.680 3.419 -3.490 1.00 0.00 C ATOM 1893 O GLU A 128 7.896 3.849 -2.356 1.00 0.00 O ATOM 1894 CB GLU A 128 5.460 2.313 -3.532 1.00 0.00 C ATOM 1895 CG GLU A 128 4.643 1.285 -4.313 1.00 0.00 C ATOM 1896 CD GLU A 128 3.169 1.640 -4.215 1.00 0.00 C ATOM 1897 OE1 GLU A 128 2.777 2.735 -4.672 1.00 0.00 O ATOM 1898 OE2 GLU A 128 2.426 0.836 -3.599 1.00 0.00 O ATOM 0 H GLU A 128 7.470 1.602 -1.724 1.00 0.00 H new ATOM 0 HA GLU A 128 7.187 1.670 -4.658 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.186 2.267 -2.478 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.211 3.315 -3.883 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.957 1.270 -5.357 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.816 0.286 -3.914 1.00 0.00 H new ATOM 1905 N GLN A 129 7.999 4.111 -4.581 1.00 0.00 N ATOM 1906 CA GLN A 129 8.567 5.452 -4.558 1.00 0.00 C ATOM 1907 C GLN A 129 7.802 6.342 -5.538 1.00 0.00 C ATOM 1908 O GLN A 129 7.467 5.900 -6.641 1.00 0.00 O ATOM 1909 CB GLN A 129 10.076 5.404 -4.840 1.00 0.00 C ATOM 1910 CG GLN A 129 10.475 4.514 -6.027 1.00 0.00 C ATOM 1911 CD GLN A 129 11.891 4.842 -6.463 1.00 0.00 C ATOM 1912 OE1 GLN A 129 12.097 5.805 -7.195 1.00 0.00 O ATOM 1913 NE2 GLN A 129 12.889 4.098 -6.025 1.00 0.00 N ATOM 0 H GLN A 129 7.866 3.746 -5.524 1.00 0.00 H new ATOM 0 HA GLN A 129 8.458 5.889 -3.565 1.00 0.00 H new ATOM 0 HB2 GLN A 129 10.430 6.418 -5.027 1.00 0.00 H new ATOM 0 HB3 GLN A 129 10.588 5.047 -3.947 1.00 0.00 H new ATOM 0 HG2 GLN A 129 10.406 3.463 -5.745 1.00 0.00 H new ATOM 0 HG3 GLN A 129 9.785 4.667 -6.856 1.00 0.00 H new ATOM 0 HE21 GLN A 129 12.702 3.301 -5.417 1.00 0.00 H new ATOM 0 HE22 GLN A 129 13.847 4.320 -6.294 1.00 0.00 H new ATOM 1922 N SER A 130 7.588 7.601 -5.161 1.00 0.00 N ATOM 1923 CA SER A 130 6.930 8.630 -5.957 1.00 0.00 C ATOM 1924 C SER A 130 7.752 9.916 -5.893 1.00 0.00 C ATOM 1925 O SER A 130 8.601 10.078 -5.007 1.00 0.00 O ATOM 1926 CB SER A 130 5.497 8.856 -5.464 1.00 0.00 C ATOM 1927 OG SER A 130 4.686 7.754 -5.810 1.00 0.00 O ATOM 0 H SER A 130 7.884 7.946 -4.248 1.00 0.00 H new ATOM 0 HA SER A 130 6.868 8.306 -6.996 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.494 8.995 -4.383 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.092 9.768 -5.904 1.00 0.00 H new ATOM 0 HG SER A 130 3.773 7.907 -5.489 1.00 0.00 H new ATOM 1933 N ARG A 131 7.543 10.820 -6.855 1.00 0.00 N ATOM 1934 CA ARG A 131 8.262 12.091 -6.931 1.00 0.00 C ATOM 1935 C ARG A 131 7.235 13.203 -7.081 1.00 0.00 C ATOM 1936 O ARG A 131 6.834 13.540 -8.195 1.00 0.00 O ATOM 1937 CB ARG A 131 9.207 12.070 -8.143 1.00 0.00 C ATOM 1938 CG ARG A 131 10.410 11.126 -8.027 1.00 0.00 C ATOM 1939 CD ARG A 131 10.994 10.977 -9.431 1.00 0.00 C ATOM 1940 NE ARG A 131 12.349 10.420 -9.437 1.00 0.00 N ATOM 1941 CZ ARG A 131 12.914 9.748 -10.445 1.00 0.00 C ATOM 1942 NH1 ARG A 131 12.268 9.547 -11.588 1.00 0.00 N ATOM 1943 NH2 ARG A 131 14.147 9.296 -10.290 1.00 0.00 N ATOM 0 H ARG A 131 6.866 10.688 -7.606 1.00 0.00 H new ATOM 0 HA ARG A 131 8.856 12.254 -6.032 1.00 0.00 H new ATOM 0 HB2 ARG A 131 8.632 11.790 -9.025 1.00 0.00 H new ATOM 0 HB3 ARG A 131 9.576 13.082 -8.311 1.00 0.00 H new ATOM 0 HG2 ARG A 131 11.154 11.531 -7.340 1.00 0.00 H new ATOM 0 HG3 ARG A 131 10.104 10.158 -7.631 1.00 0.00 H new ATOM 0 HD2 ARG A 131 10.342 10.335 -10.022 1.00 0.00 H new ATOM 0 HD3 ARG A 131 11.007 11.952 -9.917 1.00 0.00 H new ATOM 0 HE ARG A 131 12.911 10.557 -8.597 1.00 0.00 H new ATOM 0 HH11 ARG A 131 11.322 9.908 -11.709 1.00 0.00 H new ATOM 0 HH12 ARG A 131 12.718 9.031 -12.344 1.00 0.00 H new ATOM 0 HH21 ARG A 131 14.645 9.463 -9.416 1.00 0.00 H new ATOM 0 HH22 ARG A 131 14.600 8.780 -11.045 1.00 0.00 H new ATOM 1957 N ILE A 132 6.867 13.845 -5.977 1.00 0.00 N ATOM 1958 CA ILE A 132 5.876 14.910 -5.993 1.00 0.00 C ATOM 1959 C ILE A 132 6.649 16.218 -5.981 1.00 0.00 C ATOM 1960 O ILE A 132 7.134 16.615 -4.930 1.00 0.00 O ATOM 1961 CB ILE A 132 4.876 14.747 -4.822 1.00 0.00 C ATOM 1962 CG1 ILE A 132 4.008 13.479 -5.009 1.00 0.00 C ATOM 1963 CG2 ILE A 132 3.954 15.977 -4.744 1.00 0.00 C ATOM 1964 CD1 ILE A 132 4.505 12.233 -4.276 1.00 0.00 C ATOM 0 H ILE A 132 7.246 13.642 -5.052 1.00 0.00 H new ATOM 0 HA ILE A 132 5.250 14.883 -6.885 1.00 0.00 H new ATOM 0 HB ILE A 132 5.449 14.652 -3.900 1.00 0.00 H new ATOM 0 HG12 ILE A 132 2.995 13.699 -4.672 1.00 0.00 H new ATOM 0 HG13 ILE A 132 3.947 13.254 -6.074 1.00 0.00 H new ATOM 0 HG21 ILE A 132 3.253 15.855 -3.918 1.00 0.00 H new ATOM 0 HG22 ILE A 132 4.554 16.872 -4.581 1.00 0.00 H new ATOM 0 HG23 ILE A 132 3.400 16.076 -5.678 1.00 0.00 H new ATOM 0 HD11 ILE A 132 3.828 11.401 -4.472 1.00 0.00 H new ATOM 0 HD12 ILE A 132 5.504 11.978 -4.628 1.00 0.00 H new ATOM 0 HD13 ILE A 132 4.537 12.430 -3.204 1.00 0.00 H new ATOM 1976 N ARG A 133 6.793 16.892 -7.127 1.00 0.00 N ATOM 1977 CA ARG A 133 7.480 18.189 -7.230 1.00 0.00 C ATOM 1978 C ARG A 133 8.837 18.168 -6.534 1.00 0.00 C ATOM 1979 O ARG A 133 9.149 19.024 -5.702 1.00 0.00 O ATOM 1980 CB ARG A 133 6.566 19.332 -6.761 1.00 0.00 C ATOM 1981 CG ARG A 133 5.321 19.392 -7.650 1.00 0.00 C ATOM 1982 CD ARG A 133 4.462 20.626 -7.413 1.00 0.00 C ATOM 1983 NE ARG A 133 5.137 21.858 -7.845 1.00 0.00 N ATOM 1984 CZ ARG A 133 4.539 23.048 -7.894 1.00 0.00 C ATOM 1985 NH1 ARG A 133 3.271 23.169 -7.523 1.00 0.00 N ATOM 1986 NH2 ARG A 133 5.219 24.110 -8.304 1.00 0.00 N ATOM 0 H ARG A 133 6.433 16.551 -8.019 1.00 0.00 H new ATOM 0 HA ARG A 133 7.697 18.381 -8.281 1.00 0.00 H new ATOM 0 HB2 ARG A 133 6.276 19.176 -5.722 1.00 0.00 H new ATOM 0 HB3 ARG A 133 7.102 20.280 -6.804 1.00 0.00 H new ATOM 0 HG2 ARG A 133 5.630 19.370 -8.695 1.00 0.00 H new ATOM 0 HG3 ARG A 133 4.718 18.501 -7.477 1.00 0.00 H new ATOM 0 HD2 ARG A 133 3.520 20.521 -7.951 1.00 0.00 H new ATOM 0 HD3 ARG A 133 4.217 20.699 -6.353 1.00 0.00 H new ATOM 0 HE ARG A 133 6.117 21.799 -8.122 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.754 22.351 -7.200 1.00 0.00 H new ATOM 0 HH12 ARG A 133 2.813 24.080 -7.560 1.00 0.00 H new ATOM 0 HH21 ARG A 133 6.196 24.014 -8.580 1.00 0.00 H new ATOM 0 HH22 ARG A 133 4.765 25.023 -8.343 1.00 0.00 H new ATOM 2000 N SER A 134 9.633 17.157 -6.876 1.00 0.00 N ATOM 2001 CA SER A 134 10.983 16.942 -6.369 1.00 0.00 C ATOM 2002 C SER A 134 11.038 16.759 -4.842 1.00 0.00 C ATOM 2003 O SER A 134 12.119 16.774 -4.255 1.00 0.00 O ATOM 2004 CB SER A 134 11.914 18.035 -6.913 1.00 0.00 C ATOM 2005 OG SER A 134 11.655 18.259 -8.295 1.00 0.00 O ATOM 0 H SER A 134 9.342 16.439 -7.539 1.00 0.00 H new ATOM 0 HA SER A 134 11.349 15.986 -6.744 1.00 0.00 H new ATOM 0 HB2 SER A 134 11.768 18.959 -6.354 1.00 0.00 H new ATOM 0 HB3 SER A 134 12.954 17.740 -6.774 1.00 0.00 H new ATOM 0 HG SER A 134 12.253 18.959 -8.631 1.00 0.00 H new ATOM 2011 N VAL A 135 9.901 16.485 -4.199 1.00 0.00 N ATOM 2012 CA VAL A 135 9.867 16.011 -2.833 1.00 0.00 C ATOM 2013 C VAL A 135 10.151 14.518 -2.956 1.00 0.00 C ATOM 2014 O VAL A 135 9.421 13.782 -3.627 1.00 0.00 O ATOM 2015 CB VAL A 135 8.488 16.269 -2.190 1.00 0.00 C ATOM 2016 CG1 VAL A 135 8.438 15.690 -0.783 1.00 0.00 C ATOM 2017 CG2 VAL A 135 8.149 17.763 -2.107 1.00 0.00 C ATOM 0 H VAL A 135 8.979 16.589 -4.622 1.00 0.00 H new ATOM 0 HA VAL A 135 10.587 16.521 -2.193 1.00 0.00 H new ATOM 0 HB VAL A 135 7.756 15.781 -2.833 1.00 0.00 H new ATOM 0 HG11 VAL A 135 7.458 15.881 -0.345 1.00 0.00 H new ATOM 0 HG12 VAL A 135 8.613 14.615 -0.826 1.00 0.00 H new ATOM 0 HG13 VAL A 135 9.207 16.158 -0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 135 7.169 17.889 -1.647 1.00 0.00 H new ATOM 0 HG22 VAL A 135 8.901 18.274 -1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 135 8.136 18.190 -3.110 1.00 0.00 H new ATOM 2027 N ASP A 136 11.257 14.095 -2.349 1.00 0.00 N ATOM 2028 CA ASP A 136 11.593 12.694 -2.169 1.00 0.00 C ATOM 2029 C ASP A 136 10.603 12.076 -1.188 1.00 0.00 C ATOM 2030 O ASP A 136 10.396 12.661 -0.119 1.00 0.00 O ATOM 2031 CB ASP A 136 13.023 12.589 -1.620 1.00 0.00 C ATOM 2032 CG ASP A 136 13.506 11.151 -1.663 1.00 0.00 C ATOM 2033 OD1 ASP A 136 13.429 10.577 -2.772 1.00 0.00 O ATOM 2034 OD2 ASP A 136 13.970 10.614 -0.629 1.00 0.00 O ATOM 0 H ASP A 136 11.954 14.732 -1.963 1.00 0.00 H new ATOM 0 HA ASP A 136 11.538 12.162 -3.119 1.00 0.00 H new ATOM 0 HB2 ASP A 136 13.691 13.221 -2.206 1.00 0.00 H new ATOM 0 HB3 ASP A 136 13.053 12.958 -0.595 1.00 0.00 H new ATOM 2039 N VAL A 137 10.011 10.925 -1.514 1.00 0.00 N ATOM 2040 CA VAL A 137 9.037 10.220 -0.679 1.00 0.00 C ATOM 2041 C VAL A 137 9.489 8.765 -0.564 1.00 0.00 C ATOM 2042 O VAL A 137 10.057 8.223 -1.518 1.00 0.00 O ATOM 2043 CB VAL A 137 7.617 10.324 -1.292 1.00 0.00 C ATOM 2044 CG1 VAL A 137 6.534 9.809 -0.329 1.00 0.00 C ATOM 2045 CG2 VAL A 137 7.258 11.765 -1.686 1.00 0.00 C ATOM 0 H VAL A 137 10.202 10.444 -2.393 1.00 0.00 H new ATOM 0 HA VAL A 137 8.987 10.669 0.313 1.00 0.00 H new ATOM 0 HB VAL A 137 7.642 9.699 -2.185 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.555 9.901 -0.800 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.726 8.763 -0.092 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.552 10.398 0.588 1.00 0.00 H new ATOM 0 HG21 VAL A 137 6.254 11.787 -2.111 1.00 0.00 H new ATOM 0 HG22 VAL A 137 7.292 12.403 -0.803 1.00 0.00 H new ATOM 0 HG23 VAL A 137 7.972 12.129 -2.425 1.00 0.00 H new ATOM 2055 N GLY A 138 9.224 8.128 0.578 1.00 0.00 N ATOM 2056 CA GLY A 138 9.405 6.696 0.763 1.00 0.00 C ATOM 2057 C GLY A 138 8.086 6.074 1.195 1.00 0.00 C ATOM 2058 O GLY A 138 7.365 6.662 2.006 1.00 0.00 O ATOM 0 H GLY A 138 8.873 8.604 1.409 1.00 0.00 H new ATOM 0 HA2 GLY A 138 9.749 6.239 -0.165 1.00 0.00 H new ATOM 0 HA3 GLY A 138 10.172 6.509 1.515 1.00 0.00 H new ATOM 2062 N THR A 139 7.762 4.896 0.675 1.00 0.00 N ATOM 2063 CA THR A 139 6.645 4.076 1.112 1.00 0.00 C ATOM 2064 C THR A 139 7.102 2.617 1.090 1.00 0.00 C ATOM 2065 O THR A 139 7.597 2.130 0.073 1.00 0.00 O ATOM 2066 CB THR A 139 5.444 4.307 0.184 1.00 0.00 C ATOM 2067 OG1 THR A 139 5.096 5.685 0.114 1.00 0.00 O ATOM 2068 CG2 THR A 139 4.204 3.546 0.634 1.00 0.00 C ATOM 0 H THR A 139 8.290 4.473 -0.089 1.00 0.00 H new ATOM 0 HA THR A 139 6.331 4.339 2.122 1.00 0.00 H new ATOM 0 HB THR A 139 5.761 3.942 -0.793 1.00 0.00 H new ATOM 0 HG1 THR A 139 4.329 5.799 -0.486 1.00 0.00 H new ATOM 0 HG21 THR A 139 3.385 3.745 -0.057 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.417 2.477 0.646 1.00 0.00 H new ATOM 0 HG23 THR A 139 3.921 3.871 1.635 1.00 0.00 H new ATOM 2076 N TRP A 140 6.919 1.894 2.192 1.00 0.00 N ATOM 2077 CA TRP A 140 7.042 0.446 2.233 1.00 0.00 C ATOM 2078 C TRP A 140 5.965 -0.073 3.174 1.00 0.00 C ATOM 2079 O TRP A 140 5.506 0.650 4.070 1.00 0.00 O ATOM 2080 CB TRP A 140 8.457 0.001 2.665 1.00 0.00 C ATOM 2081 CG TRP A 140 8.745 -0.016 4.139 1.00 0.00 C ATOM 2082 CD1 TRP A 140 8.436 0.980 4.990 1.00 0.00 C ATOM 2083 CD2 TRP A 140 9.366 -1.047 4.966 1.00 0.00 C ATOM 2084 NE1 TRP A 140 8.706 0.607 6.289 1.00 0.00 N ATOM 2085 CE2 TRP A 140 9.290 -0.635 6.331 1.00 0.00 C ATOM 2086 CE3 TRP A 140 10.011 -2.275 4.710 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 9.778 -1.421 7.383 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 10.517 -3.070 5.757 1.00 0.00 C ATOM 2089 CH2 TRP A 140 10.386 -2.651 7.092 1.00 0.00 C ATOM 0 H TRP A 140 6.678 2.307 3.093 1.00 0.00 H new ATOM 0 HA TRP A 140 6.901 0.026 1.237 1.00 0.00 H new ATOM 0 HB2 TRP A 140 8.631 -1.001 2.274 1.00 0.00 H new ATOM 0 HB3 TRP A 140 9.181 0.660 2.186 1.00 0.00 H new ATOM 0 HD1 TRP A 140 8.033 1.938 4.696 1.00 0.00 H new ATOM 0 HE1 TRP A 140 8.500 1.177 7.109 1.00 0.00 H new ATOM 0 HE3 TRP A 140 10.119 -2.613 3.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 9.687 -1.084 8.405 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 11.008 -4.006 5.533 1.00 0.00 H new ATOM 0 HH2 TRP A 140 10.753 -3.275 7.893 1.00 0.00 H new ATOM 2100 N ILE A 141 5.606 -1.337 3.007 1.00 0.00 N ATOM 2101 CA ILE A 141 4.736 -2.064 3.913 1.00 0.00 C ATOM 2102 C ILE A 141 5.502 -3.304 4.352 1.00 0.00 C ATOM 2103 O ILE A 141 6.109 -3.984 3.517 1.00 0.00 O ATOM 2104 CB ILE A 141 3.370 -2.358 3.258 1.00 0.00 C ATOM 2105 CG1 ILE A 141 3.483 -3.150 1.940 1.00 0.00 C ATOM 2106 CG2 ILE A 141 2.605 -1.037 3.056 1.00 0.00 C ATOM 2107 CD1 ILE A 141 2.135 -3.577 1.355 1.00 0.00 C ATOM 0 H ILE A 141 5.921 -1.898 2.216 1.00 0.00 H new ATOM 0 HA ILE A 141 4.483 -1.478 4.797 1.00 0.00 H new ATOM 0 HB ILE A 141 2.812 -3.004 3.936 1.00 0.00 H new ATOM 0 HG12 ILE A 141 4.010 -2.541 1.206 1.00 0.00 H new ATOM 0 HG13 ILE A 141 4.091 -4.038 2.112 1.00 0.00 H new ATOM 0 HG21 ILE A 141 1.640 -1.243 2.593 1.00 0.00 H new ATOM 0 HG22 ILE A 141 2.449 -0.555 4.021 1.00 0.00 H new ATOM 0 HG23 ILE A 141 3.184 -0.377 2.410 1.00 0.00 H new ATOM 0 HD11 ILE A 141 2.298 -4.129 0.429 1.00 0.00 H new ATOM 0 HD12 ILE A 141 1.614 -4.214 2.070 1.00 0.00 H new ATOM 0 HD13 ILE A 141 1.531 -2.693 1.149 1.00 0.00 H new ATOM 2119 N ALA A 142 5.533 -3.560 5.658 1.00 0.00 N ATOM 2120 CA ALA A 142 6.056 -4.783 6.239 1.00 0.00 C ATOM 2121 C ALA A 142 5.224 -5.124 7.470 1.00 0.00 C ATOM 2122 O ALA A 142 4.581 -4.243 8.059 1.00 0.00 O ATOM 2123 CB ALA A 142 7.522 -4.585 6.613 1.00 0.00 C ATOM 0 H ALA A 142 5.185 -2.902 6.355 1.00 0.00 H new ATOM 0 HA ALA A 142 5.996 -5.604 5.524 1.00 0.00 H new ATOM 0 HB1 ALA A 142 7.914 -5.504 7.049 1.00 0.00 H new ATOM 0 HB2 ALA A 142 8.095 -4.334 5.720 1.00 0.00 H new ATOM 0 HB3 ALA A 142 7.606 -3.775 7.337 1.00 0.00 H new ATOM 2129 N GLY A 143 5.266 -6.377 7.906 1.00 0.00 N ATOM 2130 CA GLY A 143 4.501 -6.853 9.043 1.00 0.00 C ATOM 2131 C GLY A 143 4.630 -8.359 9.188 1.00 0.00 C ATOM 2132 O GLY A 143 5.472 -8.982 8.537 1.00 0.00 O ATOM 0 H GLY A 143 5.842 -7.098 7.471 1.00 0.00 H new ATOM 0 HA2 GLY A 143 4.851 -6.364 9.952 1.00 0.00 H new ATOM 0 HA3 GLY A 143 3.452 -6.584 8.920 1.00 0.00 H new ATOM 2136 N VAL A 144 3.796 -8.921 10.056 1.00 0.00 N ATOM 2137 CA VAL A 144 3.676 -10.337 10.341 1.00 0.00 C ATOM 2138 C VAL A 144 2.196 -10.575 10.656 1.00 0.00 C ATOM 2139 O VAL A 144 1.568 -9.779 11.364 1.00 0.00 O ATOM 2140 CB VAL A 144 4.591 -10.727 11.534 1.00 0.00 C ATOM 2141 CG1 VAL A 144 5.978 -11.181 11.056 1.00 0.00 C ATOM 2142 CG2 VAL A 144 4.776 -9.630 12.596 1.00 0.00 C ATOM 0 H VAL A 144 3.148 -8.361 10.611 1.00 0.00 H new ATOM 0 HA VAL A 144 3.994 -10.954 9.501 1.00 0.00 H new ATOM 0 HB VAL A 144 4.057 -11.549 12.012 1.00 0.00 H new ATOM 0 HG11 VAL A 144 6.591 -11.446 11.917 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.872 -12.049 10.405 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.456 -10.371 10.506 1.00 0.00 H new ATOM 0 HG21 VAL A 144 5.430 -9.996 13.387 1.00 0.00 H new ATOM 0 HG22 VAL A 144 5.223 -8.749 12.135 1.00 0.00 H new ATOM 0 HG23 VAL A 144 3.807 -9.366 13.019 1.00 0.00 H new ATOM 2152 N GLY A 145 1.640 -11.674 10.154 1.00 0.00 N ATOM 2153 CA GLY A 145 0.282 -12.113 10.429 1.00 0.00 C ATOM 2154 C GLY A 145 0.283 -13.604 10.706 1.00 0.00 C ATOM 2155 O GLY A 145 0.968 -14.050 11.630 1.00 0.00 O ATOM 0 H GLY A 145 2.141 -12.301 9.525 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.120 -11.573 11.286 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.364 -11.890 9.580 1.00 0.00 H new ATOM 2159 N TYR A 146 -0.478 -14.363 9.923 1.00 0.00 N ATOM 2160 CA TYR A 146 -0.810 -15.765 10.159 1.00 0.00 C ATOM 2161 C TYR A 146 -0.921 -16.494 8.814 1.00 0.00 C ATOM 2162 O TYR A 146 -0.700 -15.876 7.770 1.00 0.00 O ATOM 2163 CB TYR A 146 -2.045 -15.906 11.071 1.00 0.00 C ATOM 2164 CG TYR A 146 -1.914 -15.184 12.395 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -2.330 -13.847 12.504 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -1.291 -15.815 13.485 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -2.055 -13.114 13.666 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -0.998 -15.090 14.650 1.00 0.00 C ATOM 2169 CZ TYR A 146 -1.352 -13.724 14.727 1.00 0.00 C ATOM 2170 OH TYR A 146 -1.023 -12.996 15.823 1.00 0.00 O ATOM 0 H TYR A 146 -0.899 -14.001 9.068 1.00 0.00 H new ATOM 0 HA TYR A 146 -0.009 -16.253 10.713 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -2.919 -15.523 10.544 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -2.225 -16.964 11.261 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -2.864 -13.382 11.689 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -1.037 -16.863 13.426 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -2.379 -12.087 13.749 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -0.506 -15.572 15.482 1.00 0.00 H new ATOM 0 HH TYR A 146 -0.543 -13.564 16.461 1.00 0.00 H new ATOM 2180 N ARG A 147 -1.150 -17.810 8.788 1.00 0.00 N ATOM 2181 CA ARG A 147 -1.085 -18.545 7.521 1.00 0.00 C ATOM 2182 C ARG A 147 -2.125 -19.660 7.444 1.00 0.00 C ATOM 2183 O ARG A 147 -1.978 -20.701 8.087 1.00 0.00 O ATOM 2184 CB ARG A 147 0.365 -19.004 7.329 1.00 0.00 C ATOM 2185 CG ARG A 147 0.706 -19.423 5.898 1.00 0.00 C ATOM 2186 CD ARG A 147 0.171 -20.819 5.572 1.00 0.00 C ATOM 2187 NE ARG A 147 1.161 -21.624 4.857 1.00 0.00 N ATOM 2188 CZ ARG A 147 1.553 -21.514 3.590 1.00 0.00 C ATOM 2189 NH1 ARG A 147 1.054 -20.570 2.797 1.00 0.00 N ATOM 2190 NH2 ARG A 147 2.469 -22.360 3.149 1.00 0.00 N ATOM 0 H ARG A 147 -1.376 -18.376 9.606 1.00 0.00 H new ATOM 0 HA ARG A 147 -1.353 -17.902 6.683 1.00 0.00 H new ATOM 0 HB2 ARG A 147 1.033 -18.196 7.628 1.00 0.00 H new ATOM 0 HB3 ARG A 147 0.560 -19.843 7.997 1.00 0.00 H new ATOM 0 HG2 ARG A 147 0.287 -18.700 5.198 1.00 0.00 H new ATOM 0 HG3 ARG A 147 1.787 -19.407 5.763 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -0.112 -21.325 6.495 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -0.732 -20.731 4.967 1.00 0.00 H new ATOM 0 HE ARG A 147 1.608 -22.364 5.398 1.00 0.00 H new ATOM 0 HH11 ARG A 147 0.359 -19.916 3.157 1.00 0.00 H new ATOM 0 HH12 ARG A 147 1.366 -20.500 1.828 1.00 0.00 H new ATOM 0 HH21 ARG A 147 2.852 -23.069 3.775 1.00 0.00 H new ATOM 0 HH22 ARG A 147 2.792 -22.304 2.183 1.00 0.00 H new ATOM 2204 N PHE A 148 -3.157 -19.464 6.628 1.00 0.00 N ATOM 2205 CA PHE A 148 -4.207 -20.437 6.361 1.00 0.00 C ATOM 2206 C PHE A 148 -4.111 -20.907 4.915 1.00 0.00 C ATOM 2207 O PHE A 148 -3.243 -20.425 4.153 1.00 0.00 O ATOM 2208 CB PHE A 148 -5.567 -19.779 6.624 1.00 0.00 C ATOM 2209 CG PHE A 148 -5.729 -19.128 7.984 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -5.651 -19.908 9.151 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -5.972 -17.745 8.087 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -5.884 -19.327 10.408 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -6.192 -17.162 9.348 1.00 0.00 C ATOM 2214 CZ PHE A 148 -6.161 -17.954 10.508 1.00 0.00 C ATOM 0 H PHE A 148 -3.288 -18.591 6.117 1.00 0.00 H new ATOM 0 HA PHE A 148 -4.094 -21.303 7.013 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -5.739 -19.024 5.857 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -6.344 -20.534 6.508 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -5.411 -20.959 9.080 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -5.989 -17.132 7.198 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -5.850 -19.937 11.299 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -6.385 -16.102 9.425 1.00 0.00 H new ATOM 0 HZ PHE A 148 -6.350 -17.508 11.473 1.00 0.00 H new TER 2224 PHE A 148