USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 839 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 132 ASN : amide:sc= 0.742 K(o=3.6,f=1.9) USER MOD Set 1.2: A 133 HIS : no HE2:sc= 0.905 K(o=3.6,f=0.51) USER MOD Set 1.3: B 149 C O2' : rot 84:sc= 1.91 USER MOD Set 2.1: A 101 MET CE :methyl 178:sc= -4.39! (180deg=-4.49!) USER MOD Set 2.2: A 110 MET CE :methyl -179:sc= -1.36 (180deg=-1.39) USER MOD Set 3.1: A 87 ASN : amide:sc= 0.345 K(o=0.77,f=0.051) USER MOD Set 3.2: A 138 THR OG1 : rot -163:sc= 0.42 USER MOD Set 4.1: A 65 LYS NZ :NH3+ 177:sc= 1.07 (180deg=0) USER MOD Set 4.2: B 147 C O2' : rot 17:sc= 1.01 USER MOD Set 5.1: A 62 HIS : no HE2:sc= -2.89! K(o=-3.3!,f=-5.4) USER MOD Set 5.2: A 96 GLN : amide:sc= -0.426 K(o=-3.3,f=-4.2) USER MOD Set 6.1: A 58 SER OG : rot 32:sc= 1.37 USER MOD Set 6.2: A 134 LYS NZ :NH3+ 150:sc= 0.783 (180deg=-0.00223) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -89:sc= 0.755 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 88:sc= 1.22 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 MET CE :methyl 157:sc= 0 (180deg=-0.0884) USER MOD Single : A 92 LYS NZ :NH3+ 178:sc= 1.28 (180deg=1.22) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.21 K(o=1.2,f=-0.012) USER MOD Single : A 102 ASN :FLIP amide:sc= -5.61! C(o=-7.4!,f=-5.6!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.534 USER MOD Single : A 108 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0.271 X(o=0.27,f=-0.0051) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 178:sc= 1.05 USER MOD Single : A 115 THR OG1 : rot 74:sc= 1.18 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= -0.511 X(o=-0.51,f=-0.87) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 1.07 K(o=1.1,f=-2.8!) USER MOD Single : A 131 SER OG : rot -87:sc= -1.13! USER MOD Single : A 137 LYS NZ :NH3+ -169:sc= 1.26 (180deg=1.03) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 147 C O5' : rot 32:sc= 0.604 USER MOD Single : B 148 U O2' : rot -18:sc= 0.275 USER MOD Single : B 150 U O2' : rot -24:sc= 0.0641 USER MOD Single : B 151 C O2' : rot 27:sc= 0.0936 USER MOD Single : B 152 U O2' : rot 180:sc= 0 USER MOD Single : B 152 U O3' : rot 137:sc= 0.0965 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -20.598 5.319 -2.773 1.00 0.00 N ATOM 2 CA GLY A 49 -19.659 6.418 -3.093 1.00 0.00 C ATOM 3 C GLY A 49 -18.246 5.890 -3.259 1.00 0.00 C ATOM 4 O GLY A 49 -17.674 5.359 -2.311 1.00 0.00 O ATOM 0 HA2 GLY A 49 -19.975 6.917 -4.009 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -19.682 7.164 -2.299 1.00 0.00 H new ATOM 8 N ASP A 50 -17.676 6.014 -4.458 1.00 0.00 N ATOM 9 CA ASP A 50 -16.414 5.382 -4.890 1.00 0.00 C ATOM 10 C ASP A 50 -15.224 5.661 -3.950 1.00 0.00 C ATOM 11 O ASP A 50 -14.525 4.735 -3.525 1.00 0.00 O ATOM 12 CB ASP A 50 -16.080 5.847 -6.318 1.00 0.00 C ATOM 13 CG ASP A 50 -17.219 5.586 -7.321 1.00 0.00 C ATOM 14 OD1 ASP A 50 -18.237 6.323 -7.283 1.00 0.00 O ATOM 15 OD2 ASP A 50 -17.102 4.654 -8.148 1.00 0.00 O ATOM 0 H ASP A 50 -18.095 6.583 -5.194 1.00 0.00 H new ATOM 0 HA ASP A 50 -16.572 4.304 -4.859 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.855 6.913 -6.303 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -15.180 5.336 -6.659 1.00 0.00 H new ATOM 20 N SER A 51 -15.010 6.929 -3.582 1.00 0.00 N ATOM 21 CA SER A 51 -13.918 7.374 -2.698 1.00 0.00 C ATOM 22 C SER A 51 -14.027 6.861 -1.256 1.00 0.00 C ATOM 23 O SER A 51 -13.023 6.819 -0.543 1.00 0.00 O ATOM 24 CB SER A 51 -13.850 8.906 -2.667 1.00 0.00 C ATOM 25 OG SER A 51 -13.730 9.432 -3.982 1.00 0.00 O ATOM 0 H SER A 51 -15.604 7.696 -3.897 1.00 0.00 H new ATOM 0 HA SER A 51 -13.011 6.946 -3.124 1.00 0.00 H new ATOM 0 HB2 SER A 51 -14.746 9.305 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 51 -13.000 9.225 -2.064 1.00 0.00 H new ATOM 0 HG SER A 51 -13.690 10.410 -3.941 1.00 0.00 H new ATOM 31 N ARG A 52 -15.219 6.435 -0.808 1.00 0.00 N ATOM 32 CA ARG A 52 -15.485 5.901 0.543 1.00 0.00 C ATOM 33 C ARG A 52 -14.899 4.495 0.779 1.00 0.00 C ATOM 34 O ARG A 52 -14.969 3.967 1.889 1.00 0.00 O ATOM 35 CB ARG A 52 -17.002 5.978 0.816 1.00 0.00 C ATOM 36 CG ARG A 52 -17.346 6.079 2.311 1.00 0.00 C ATOM 37 CD ARG A 52 -18.834 6.390 2.508 1.00 0.00 C ATOM 38 NE ARG A 52 -19.167 6.553 3.939 1.00 0.00 N ATOM 39 CZ ARG A 52 -20.280 7.050 4.448 1.00 0.00 C ATOM 40 NH1 ARG A 52 -21.264 7.459 3.698 1.00 0.00 N ATOM 41 NH2 ARG A 52 -20.424 7.152 5.738 1.00 0.00 N ATOM 0 H ARG A 52 -16.054 6.452 -1.394 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.960 6.522 1.269 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -17.414 6.843 0.296 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -17.485 5.095 0.398 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.097 5.143 2.810 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -16.742 6.859 2.776 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -19.091 7.301 1.967 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -19.435 5.586 2.083 1.00 0.00 H new ATOM 0 HE ARG A 52 -18.459 6.248 4.607 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -21.189 7.401 2.682 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -22.109 7.837 4.127 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.675 6.847 6.360 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -21.285 7.536 6.126 1.00 0.00 H new ATOM 55 N SER A 53 -14.274 3.902 -0.242 1.00 0.00 N ATOM 56 CA SER A 53 -13.408 2.710 -0.157 1.00 0.00 C ATOM 57 C SER A 53 -12.169 2.885 0.746 1.00 0.00 C ATOM 58 O SER A 53 -11.564 1.891 1.153 1.00 0.00 O ATOM 59 CB SER A 53 -12.974 2.276 -1.562 1.00 0.00 C ATOM 60 OG SER A 53 -12.333 3.335 -2.258 1.00 0.00 O ATOM 0 H SER A 53 -14.358 4.252 -1.197 1.00 0.00 H new ATOM 0 HA SER A 53 -14.014 1.936 0.315 1.00 0.00 H new ATOM 0 HB2 SER A 53 -12.297 1.425 -1.488 1.00 0.00 H new ATOM 0 HB3 SER A 53 -13.845 1.943 -2.126 1.00 0.00 H new ATOM 0 HG SER A 53 -13.004 3.863 -2.740 1.00 0.00 H new ATOM 66 N ALA A 54 -11.823 4.124 1.118 1.00 0.00 N ATOM 67 CA ALA A 54 -10.926 4.479 2.223 1.00 0.00 C ATOM 68 C ALA A 54 -11.504 5.653 3.060 1.00 0.00 C ATOM 69 O ALA A 54 -12.584 6.168 2.750 1.00 0.00 O ATOM 70 CB ALA A 54 -9.520 4.717 1.647 1.00 0.00 C ATOM 0 H ALA A 54 -12.179 4.947 0.631 1.00 0.00 H new ATOM 0 HA ALA A 54 -10.841 3.664 2.941 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -8.837 4.983 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.169 3.808 1.158 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.557 5.529 0.921 1.00 0.00 H new ATOM 76 N GLY A 55 -10.842 6.046 4.157 1.00 0.00 N ATOM 77 CA GLY A 55 -11.427 6.891 5.212 1.00 0.00 C ATOM 78 C GLY A 55 -11.355 8.384 4.889 1.00 0.00 C ATOM 79 O GLY A 55 -12.379 9.070 4.852 1.00 0.00 O ATOM 0 H GLY A 55 -9.874 5.784 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.469 6.607 5.362 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -10.907 6.702 6.151 1.00 0.00 H new ATOM 83 N VAL A 56 -10.139 8.872 4.627 1.00 0.00 N ATOM 84 CA VAL A 56 -9.877 10.198 4.036 1.00 0.00 C ATOM 85 C VAL A 56 -8.712 10.129 3.023 1.00 0.00 C ATOM 86 O VAL A 56 -7.590 10.573 3.287 1.00 0.00 O ATOM 87 CB VAL A 56 -9.756 11.250 5.145 1.00 0.00 C ATOM 88 CG1 VAL A 56 -8.658 10.998 6.190 1.00 0.00 C ATOM 89 CG2 VAL A 56 -9.625 12.669 4.585 1.00 0.00 C ATOM 0 H VAL A 56 -9.286 8.348 4.823 1.00 0.00 H new ATOM 0 HA VAL A 56 -10.722 10.530 3.432 1.00 0.00 H new ATOM 0 HB VAL A 56 -10.700 11.150 5.680 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.663 11.803 6.925 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -8.844 10.048 6.691 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.687 10.964 5.696 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -9.542 13.379 5.408 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.734 12.733 3.960 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -10.505 12.907 3.988 1.00 0.00 H new ATOM 99 N PRO A 57 -8.954 9.490 1.868 1.00 0.00 N ATOM 100 CA PRO A 57 -7.922 9.061 0.923 1.00 0.00 C ATOM 101 C PRO A 57 -7.707 10.057 -0.228 1.00 0.00 C ATOM 102 O PRO A 57 -8.642 10.729 -0.675 1.00 0.00 O ATOM 103 CB PRO A 57 -8.506 7.733 0.451 1.00 0.00 C ATOM 104 CG PRO A 57 -9.995 8.038 0.282 1.00 0.00 C ATOM 105 CD PRO A 57 -10.248 8.930 1.486 1.00 0.00 C ATOM 0 HA PRO A 57 -6.925 8.987 1.357 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.054 7.406 -0.486 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -8.339 6.939 1.179 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.208 8.546 -0.659 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -10.606 7.135 0.302 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -10.956 9.722 1.240 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -10.681 8.359 2.307 1.00 0.00 H new ATOM 113 N SER A 58 -6.475 10.156 -0.737 1.00 0.00 N ATOM 114 CA SER A 58 -6.111 11.010 -1.881 1.00 0.00 C ATOM 115 C SER A 58 -4.775 10.616 -2.527 1.00 0.00 C ATOM 116 O SER A 58 -3.720 10.730 -1.898 1.00 0.00 O ATOM 117 CB SER A 58 -5.996 12.470 -1.429 1.00 0.00 C ATOM 118 OG SER A 58 -7.247 13.132 -1.398 1.00 0.00 O ATOM 0 H SER A 58 -5.683 9.635 -0.360 1.00 0.00 H new ATOM 0 HA SER A 58 -6.902 10.878 -2.619 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.546 12.505 -0.437 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.324 13.003 -2.102 1.00 0.00 H new ATOM 0 HG SER A 58 -7.952 12.489 -1.176 1.00 0.00 H new ATOM 124 N ARG A 59 -4.819 10.215 -3.806 1.00 0.00 N ATOM 125 CA ARG A 59 -3.697 10.028 -4.762 1.00 0.00 C ATOM 126 C ARG A 59 -2.623 8.982 -4.420 1.00 0.00 C ATOM 127 O ARG A 59 -1.893 8.569 -5.324 1.00 0.00 O ATOM 128 CB ARG A 59 -3.067 11.389 -5.097 1.00 0.00 C ATOM 129 CG ARG A 59 -3.800 12.110 -6.247 1.00 0.00 C ATOM 130 CD ARG A 59 -3.248 13.518 -6.475 1.00 0.00 C ATOM 131 NE ARG A 59 -1.786 13.477 -6.620 1.00 0.00 N ATOM 132 CZ ARG A 59 -0.901 14.335 -6.159 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.197 15.535 -5.756 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.339 13.991 -6.044 1.00 0.00 N ATOM 0 H ARG A 59 -5.713 9.992 -4.244 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.173 9.582 -5.635 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.080 12.021 -4.209 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.022 11.245 -5.370 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.701 11.528 -7.163 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.864 12.169 -6.020 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.697 13.951 -7.369 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.519 14.162 -5.638 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.411 12.686 -7.143 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.164 15.859 -5.787 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -0.463 16.152 -5.409 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.635 13.052 -6.311 1.00 0.00 H new ATOM 0 HH22 ARG A 59 1.022 14.658 -5.686 1.00 0.00 H new ATOM 148 N VAL A 60 -2.583 8.468 -3.188 1.00 0.00 N ATOM 149 CA VAL A 60 -1.845 7.253 -2.822 1.00 0.00 C ATOM 150 C VAL A 60 -2.777 6.070 -2.550 1.00 0.00 C ATOM 151 O VAL A 60 -3.843 6.209 -1.948 1.00 0.00 O ATOM 152 CB VAL A 60 -0.741 7.485 -1.777 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.013 8.286 -0.503 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.033 6.190 -1.420 1.00 0.00 C ATOM 0 H VAL A 60 -3.072 8.892 -2.400 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.275 6.955 -3.702 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.119 8.180 -2.340 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.105 8.332 0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.325 9.296 -0.768 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.803 7.801 0.070 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.741 6.391 -0.679 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.754 5.483 -1.009 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.423 5.766 -2.315 1.00 0.00 H new ATOM 164 N ILE A 61 -2.356 4.898 -3.016 1.00 0.00 N ATOM 165 CA ILE A 61 -2.900 3.555 -2.766 1.00 0.00 C ATOM 166 C ILE A 61 -1.853 2.773 -1.973 1.00 0.00 C ATOM 167 O ILE A 61 -0.663 3.032 -2.116 1.00 0.00 O ATOM 168 CB ILE A 61 -3.199 2.892 -4.129 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.404 3.594 -4.792 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.434 1.368 -4.107 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.386 3.384 -6.298 1.00 0.00 C ATOM 0 H ILE A 61 -1.549 4.854 -3.638 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.826 3.584 -2.192 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.284 3.021 -4.707 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.333 3.203 -4.376 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.378 4.660 -4.568 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.634 1.016 -5.119 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.547 0.869 -3.718 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.288 1.141 -3.468 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.243 3.887 -6.746 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.466 3.797 -6.712 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.436 2.317 -6.517 1.00 0.00 H new ATOM 183 N HIS A 62 -2.269 1.802 -1.168 1.00 0.00 N ATOM 184 CA HIS A 62 -1.403 0.905 -0.409 1.00 0.00 C ATOM 185 C HIS A 62 -1.651 -0.557 -0.808 1.00 0.00 C ATOM 186 O HIS A 62 -2.761 -0.938 -1.186 1.00 0.00 O ATOM 187 CB HIS A 62 -1.610 1.191 1.087 1.00 0.00 C ATOM 188 CG HIS A 62 -1.040 0.160 2.043 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.460 -1.145 2.204 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.084 0.395 2.991 1.00 0.00 C ATOM 191 CE1 HIS A 62 -0.729 -1.698 3.186 1.00 0.00 C ATOM 192 NE2 HIS A 62 0.131 -0.796 3.697 1.00 0.00 N ATOM 0 H HIS A 62 -3.260 1.610 -1.020 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.352 1.084 -0.638 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.163 2.158 1.318 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.680 1.281 1.275 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.196 -1.608 1.671 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.418 1.335 3.166 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -0.818 -2.722 3.519 1.00 0.00 H new ATOM 200 N ILE A 63 -0.607 -1.382 -0.698 1.00 0.00 N ATOM 201 CA ILE A 63 -0.575 -2.797 -1.096 1.00 0.00 C ATOM 202 C ILE A 63 -0.017 -3.644 0.063 1.00 0.00 C ATOM 203 O ILE A 63 0.920 -3.215 0.733 1.00 0.00 O ATOM 204 CB ILE A 63 0.267 -2.997 -2.389 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.102 -1.850 -3.425 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.105 -4.352 -3.022 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.967 -1.988 -4.688 1.00 0.00 C ATOM 0 H ILE A 63 0.283 -1.069 -0.311 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.591 -3.124 -1.317 1.00 0.00 H new ATOM 0 HB ILE A 63 1.317 -2.982 -2.098 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.945 -1.798 -3.724 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.342 -0.904 -2.939 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.480 -4.502 -3.930 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.108 -5.154 -2.316 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.167 -4.359 -3.269 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.783 -1.142 -5.350 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.020 -2.007 -4.407 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.713 -2.914 -5.204 1.00 0.00 H new ATOM 219 N ARG A 64 -0.560 -4.848 0.291 1.00 0.00 N ATOM 220 CA ARG A 64 -0.067 -5.899 1.222 1.00 0.00 C ATOM 221 C ARG A 64 0.286 -7.186 0.464 1.00 0.00 C ATOM 222 O ARG A 64 -0.001 -7.308 -0.726 1.00 0.00 O ATOM 223 CB ARG A 64 -1.042 -6.159 2.415 1.00 0.00 C ATOM 224 CG ARG A 64 -2.451 -5.573 2.231 1.00 0.00 C ATOM 225 CD ARG A 64 -3.549 -5.923 3.246 1.00 0.00 C ATOM 226 NE ARG A 64 -4.732 -5.085 2.951 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.945 -5.441 2.564 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.405 -6.650 2.689 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.737 -4.559 2.029 1.00 0.00 N ATOM 0 H ARG A 64 -1.408 -5.142 -0.194 1.00 0.00 H new ATOM 0 HA ARG A 64 0.851 -5.521 1.672 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.128 -7.235 2.569 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.605 -5.741 3.322 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.355 -4.487 2.214 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.806 -5.877 1.246 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.806 -6.980 3.180 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.199 -5.743 4.262 1.00 0.00 H new ATOM 0 HE ARG A 64 -4.590 -4.081 3.063 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.822 -7.377 3.103 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -7.349 -6.871 2.374 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -6.422 -3.596 1.909 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.674 -4.830 1.729 1.00 0.00 H new ATOM 243 N LYS A 65 0.871 -8.165 1.169 1.00 0.00 N ATOM 244 CA LYS A 65 1.212 -9.519 0.667 1.00 0.00 C ATOM 245 C LYS A 65 2.239 -9.508 -0.479 1.00 0.00 C ATOM 246 O LYS A 65 2.252 -10.394 -1.338 1.00 0.00 O ATOM 247 CB LYS A 65 -0.059 -10.314 0.293 1.00 0.00 C ATOM 248 CG LYS A 65 -1.258 -10.090 1.226 1.00 0.00 C ATOM 249 CD LYS A 65 -1.064 -10.530 2.677 1.00 0.00 C ATOM 250 CE LYS A 65 -1.400 -12.019 2.801 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.011 -12.565 4.127 1.00 0.00 N ATOM 0 H LYS A 65 1.134 -8.037 2.146 1.00 0.00 H new ATOM 0 HA LYS A 65 1.702 -10.035 1.493 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.352 -10.046 -0.722 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.184 -11.377 0.285 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.507 -9.029 1.218 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.117 -10.622 0.817 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.036 -10.350 2.990 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.705 -9.944 3.336 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.469 -12.164 2.648 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.887 -12.574 2.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.301 -13.562 4.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.020 -12.496 4.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.480 -12.020 4.878 1.00 0.00 H new ATOM 265 N LEU A 66 3.106 -8.493 -0.489 1.00 0.00 N ATOM 266 CA LEU A 66 4.239 -8.372 -1.412 1.00 0.00 C ATOM 267 C LEU A 66 5.270 -9.503 -1.169 1.00 0.00 C ATOM 268 O LEU A 66 5.278 -10.114 -0.099 1.00 0.00 O ATOM 269 CB LEU A 66 4.923 -7.004 -1.187 1.00 0.00 C ATOM 270 CG LEU A 66 4.871 -6.064 -2.393 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.474 -5.502 -2.595 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.827 -4.906 -2.143 1.00 0.00 C ATOM 0 H LEU A 66 3.038 -7.711 0.162 1.00 0.00 H new ATOM 0 HA LEU A 66 3.871 -8.452 -2.435 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.451 -6.511 -0.337 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.966 -7.173 -0.918 1.00 0.00 H new ATOM 0 HG LEU A 66 5.151 -6.625 -3.284 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.470 -4.838 -3.459 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.773 -6.320 -2.763 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.174 -4.944 -1.708 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.803 -4.225 -2.993 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.524 -4.372 -1.242 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.839 -5.291 -2.014 1.00 0.00 H new ATOM 284 N PRO A 67 6.196 -9.739 -2.109 1.00 0.00 N ATOM 285 CA PRO A 67 7.482 -10.394 -1.887 1.00 0.00 C ATOM 286 C PRO A 67 8.379 -9.678 -0.865 1.00 0.00 C ATOM 287 O PRO A 67 8.025 -8.671 -0.246 1.00 0.00 O ATOM 288 CB PRO A 67 8.164 -10.441 -3.263 1.00 0.00 C ATOM 289 CG PRO A 67 6.994 -10.364 -4.234 1.00 0.00 C ATOM 290 CD PRO A 67 6.038 -9.427 -3.504 1.00 0.00 C ATOM 0 HA PRO A 67 7.318 -11.383 -1.459 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.855 -9.609 -3.398 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.738 -11.358 -3.397 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.294 -9.967 -5.204 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.548 -11.342 -4.414 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.280 -8.383 -3.704 1.00 0.00 H new ATOM 0 HD3 PRO A 67 5.009 -9.583 -3.828 1.00 0.00 H new ATOM 298 N ILE A 68 9.584 -10.215 -0.720 1.00 0.00 N ATOM 299 CA ILE A 68 10.647 -9.760 0.197 1.00 0.00 C ATOM 300 C ILE A 68 11.465 -8.595 -0.370 1.00 0.00 C ATOM 301 O ILE A 68 11.996 -7.769 0.368 1.00 0.00 O ATOM 302 CB ILE A 68 11.572 -10.953 0.539 1.00 0.00 C ATOM 303 CG1 ILE A 68 12.266 -11.551 -0.712 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.731 -12.013 1.261 1.00 0.00 C ATOM 305 CD1 ILE A 68 13.201 -12.731 -0.414 1.00 0.00 C ATOM 0 H ILE A 68 9.872 -11.027 -1.266 1.00 0.00 H new ATOM 0 HA ILE A 68 10.165 -9.386 1.100 1.00 0.00 H new ATOM 0 HB ILE A 68 12.378 -10.600 1.182 1.00 0.00 H new ATOM 0 HG12 ILE A 68 11.501 -11.878 -1.416 1.00 0.00 H new ATOM 0 HG13 ILE A 68 12.838 -10.765 -1.206 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.360 -12.866 1.514 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.314 -11.587 2.173 1.00 0.00 H new ATOM 0 HG23 ILE A 68 9.921 -12.340 0.610 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.644 -13.088 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.991 -12.407 0.264 1.00 0.00 H new ATOM 0 HD13 ILE A 68 12.633 -13.537 0.050 1.00 0.00 H new ATOM 317 N ASP A 69 11.584 -8.556 -1.697 1.00 0.00 N ATOM 318 CA ASP A 69 12.497 -7.690 -2.450 1.00 0.00 C ATOM 319 C ASP A 69 11.980 -7.440 -3.883 1.00 0.00 C ATOM 320 O ASP A 69 12.750 -7.373 -4.843 1.00 0.00 O ATOM 321 CB ASP A 69 13.909 -8.309 -2.420 1.00 0.00 C ATOM 322 CG ASP A 69 14.999 -7.317 -2.871 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.960 -6.143 -2.423 1.00 0.00 O ATOM 324 OD2 ASP A 69 15.919 -7.717 -3.625 1.00 0.00 O ATOM 0 H ASP A 69 11.023 -9.153 -2.305 1.00 0.00 H new ATOM 0 HA ASP A 69 12.546 -6.707 -1.982 1.00 0.00 H new ATOM 0 HB2 ASP A 69 14.130 -8.652 -1.409 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.931 -9.186 -3.066 1.00 0.00 H new ATOM 329 N VAL A 70 10.649 -7.346 -4.037 1.00 0.00 N ATOM 330 CA VAL A 70 9.996 -6.984 -5.312 1.00 0.00 C ATOM 331 C VAL A 70 10.590 -5.692 -5.900 1.00 0.00 C ATOM 332 O VAL A 70 11.034 -4.808 -5.158 1.00 0.00 O ATOM 333 CB VAL A 70 8.458 -6.880 -5.154 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.934 -5.473 -4.853 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.761 -7.384 -6.419 1.00 0.00 C ATOM 0 H VAL A 70 9.990 -7.519 -3.278 1.00 0.00 H new ATOM 0 HA VAL A 70 10.196 -7.788 -6.020 1.00 0.00 H new ATOM 0 HB VAL A 70 8.227 -7.499 -4.287 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.848 -5.501 -4.760 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.369 -5.115 -3.920 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.211 -4.800 -5.665 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.681 -7.306 -6.295 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.073 -6.781 -7.271 1.00 0.00 H new ATOM 0 HG23 VAL A 70 8.032 -8.425 -6.593 1.00 0.00 H new ATOM 345 N THR A 71 10.581 -5.555 -7.231 1.00 0.00 N ATOM 346 CA THR A 71 11.170 -4.382 -7.889 1.00 0.00 C ATOM 347 C THR A 71 10.165 -3.252 -8.070 1.00 0.00 C ATOM 348 O THR A 71 9.009 -3.433 -8.474 1.00 0.00 O ATOM 349 CB THR A 71 11.934 -4.737 -9.177 1.00 0.00 C ATOM 350 OG1 THR A 71 12.471 -3.565 -9.753 1.00 0.00 O ATOM 351 CG2 THR A 71 11.113 -5.428 -10.260 1.00 0.00 C ATOM 0 H THR A 71 10.175 -6.238 -7.871 1.00 0.00 H new ATOM 0 HA THR A 71 11.928 -3.996 -7.208 1.00 0.00 H new ATOM 0 HB THR A 71 12.696 -5.444 -8.849 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.958 -3.796 -10.572 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.747 -5.633 -11.122 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.714 -6.365 -9.872 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.289 -4.781 -10.561 1.00 0.00 H new ATOM 359 N GLU A 72 10.635 -2.043 -7.773 1.00 0.00 N ATOM 360 CA GLU A 72 9.895 -0.813 -8.004 1.00 0.00 C ATOM 361 C GLU A 72 9.443 -0.698 -9.465 1.00 0.00 C ATOM 362 O GLU A 72 8.310 -0.296 -9.711 1.00 0.00 O ATOM 363 CB GLU A 72 10.718 0.389 -7.497 1.00 0.00 C ATOM 364 CG GLU A 72 10.651 1.678 -8.338 1.00 0.00 C ATOM 365 CD GLU A 72 11.576 1.700 -9.578 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.629 1.021 -9.595 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.277 2.448 -10.540 1.00 0.00 O ATOM 0 H GLU A 72 11.555 -1.892 -7.359 1.00 0.00 H new ATOM 0 HA GLU A 72 8.969 -0.823 -7.428 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.387 0.625 -6.486 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.762 0.082 -7.428 1.00 0.00 H new ATOM 0 HG2 GLU A 72 9.623 1.825 -8.668 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.905 2.524 -7.699 1.00 0.00 H new ATOM 374 N GLY A 73 10.274 -1.134 -10.418 1.00 0.00 N ATOM 375 CA GLY A 73 9.946 -1.171 -11.846 1.00 0.00 C ATOM 376 C GLY A 73 8.679 -1.972 -12.164 1.00 0.00 C ATOM 377 O GLY A 73 7.869 -1.548 -12.988 1.00 0.00 O ATOM 0 H GLY A 73 11.212 -1.478 -10.213 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.821 -0.151 -12.208 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.785 -1.602 -12.392 1.00 0.00 H new ATOM 381 N GLU A 74 8.462 -3.093 -11.471 1.00 0.00 N ATOM 382 CA GLU A 74 7.219 -3.876 -11.533 1.00 0.00 C ATOM 383 C GLU A 74 6.040 -3.089 -10.959 1.00 0.00 C ATOM 384 O GLU A 74 5.020 -2.929 -11.632 1.00 0.00 O ATOM 385 CB GLU A 74 7.392 -5.232 -10.812 1.00 0.00 C ATOM 386 CG GLU A 74 7.777 -6.328 -11.813 1.00 0.00 C ATOM 387 CD GLU A 74 7.749 -7.722 -11.158 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.672 -8.372 -11.156 1.00 0.00 O ATOM 389 OE2 GLU A 74 8.798 -8.183 -10.647 1.00 0.00 O ATOM 0 H GLU A 74 9.156 -3.491 -10.839 1.00 0.00 H new ATOM 0 HA GLU A 74 6.998 -4.077 -12.581 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.161 -5.147 -10.044 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.465 -5.503 -10.306 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.090 -6.308 -12.659 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.774 -6.129 -12.207 1.00 0.00 H new ATOM 396 N VAL A 75 6.184 -2.567 -9.738 1.00 0.00 N ATOM 397 CA VAL A 75 5.106 -1.840 -9.049 1.00 0.00 C ATOM 398 C VAL A 75 4.658 -0.586 -9.828 1.00 0.00 C ATOM 399 O VAL A 75 3.467 -0.416 -10.099 1.00 0.00 O ATOM 400 CB VAL A 75 5.505 -1.543 -7.593 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.403 -0.791 -6.836 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.773 -2.865 -6.857 1.00 0.00 C ATOM 0 H VAL A 75 7.047 -2.634 -9.198 1.00 0.00 H new ATOM 0 HA VAL A 75 4.226 -2.482 -9.015 1.00 0.00 H new ATOM 0 HB VAL A 75 6.397 -0.918 -7.622 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.728 -0.603 -5.813 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.202 0.158 -7.333 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.495 -1.393 -6.823 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.056 -2.656 -5.825 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.871 -3.477 -6.869 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.582 -3.400 -7.354 1.00 0.00 H new ATOM 412 N ILE A 76 5.576 0.273 -10.273 1.00 0.00 N ATOM 413 CA ILE A 76 5.249 1.479 -11.048 1.00 0.00 C ATOM 414 C ILE A 76 4.764 1.178 -12.464 1.00 0.00 C ATOM 415 O ILE A 76 3.927 1.920 -12.976 1.00 0.00 O ATOM 416 CB ILE A 76 6.422 2.475 -11.077 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.674 1.997 -11.841 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.807 2.816 -9.642 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.706 2.500 -13.280 1.00 0.00 C ATOM 0 H ILE A 76 6.575 0.154 -10.107 1.00 0.00 H new ATOM 0 HA ILE A 76 4.414 1.943 -10.523 1.00 0.00 H new ATOM 0 HB ILE A 76 6.064 3.344 -11.628 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.567 2.340 -11.319 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.703 0.907 -11.839 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.638 3.522 -9.646 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.953 3.263 -9.133 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.105 1.907 -9.120 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.607 2.135 -13.773 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.828 2.135 -13.813 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.706 3.590 -13.285 1.00 0.00 H new ATOM 431 N SER A 77 5.213 0.084 -13.088 1.00 0.00 N ATOM 432 CA SER A 77 4.659 -0.332 -14.392 1.00 0.00 C ATOM 433 C SER A 77 3.245 -0.896 -14.260 1.00 0.00 C ATOM 434 O SER A 77 2.494 -0.911 -15.237 1.00 0.00 O ATOM 435 CB SER A 77 5.547 -1.339 -15.126 1.00 0.00 C ATOM 436 OG SER A 77 6.831 -0.799 -15.381 1.00 0.00 O ATOM 0 H SER A 77 5.946 -0.524 -12.723 1.00 0.00 H new ATOM 0 HA SER A 77 4.622 0.578 -14.990 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.643 -2.246 -14.529 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.076 -1.625 -16.067 1.00 0.00 H new ATOM 0 HG SER A 77 7.417 -0.972 -14.615 1.00 0.00 H new ATOM 442 N LEU A 78 2.849 -1.281 -13.044 1.00 0.00 N ATOM 443 CA LEU A 78 1.455 -1.555 -12.697 1.00 0.00 C ATOM 444 C LEU A 78 0.673 -0.293 -12.285 1.00 0.00 C ATOM 445 O LEU A 78 -0.557 -0.288 -12.354 1.00 0.00 O ATOM 446 CB LEU A 78 1.419 -2.642 -11.610 1.00 0.00 C ATOM 447 CG LEU A 78 1.663 -4.048 -12.182 1.00 0.00 C ATOM 448 CD1 LEU A 78 1.997 -5.010 -11.047 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.424 -4.541 -12.936 1.00 0.00 C ATOM 0 H LEU A 78 3.495 -1.412 -12.266 1.00 0.00 H new ATOM 0 HA LEU A 78 0.944 -1.917 -13.589 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.174 -2.423 -10.855 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.452 -2.619 -11.108 1.00 0.00 H new ATOM 0 HG LEU A 78 2.499 -4.005 -12.880 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.170 -6.006 -11.454 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.895 -4.668 -10.532 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.166 -5.045 -10.343 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.613 -5.538 -13.335 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.426 -4.578 -12.254 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.202 -3.858 -13.756 1.00 0.00 H new ATOM 461 N GLY A 79 1.366 0.795 -11.945 1.00 0.00 N ATOM 462 CA GLY A 79 0.785 2.128 -11.794 1.00 0.00 C ATOM 463 C GLY A 79 0.444 2.785 -13.135 1.00 0.00 C ATOM 464 O GLY A 79 -0.551 3.495 -13.273 1.00 0.00 O ATOM 0 H GLY A 79 2.369 0.772 -11.763 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.119 2.058 -11.189 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.484 2.764 -11.251 1.00 0.00 H new ATOM 468 N LEU A 80 1.330 2.621 -14.116 1.00 0.00 N ATOM 469 CA LEU A 80 1.449 3.550 -15.234 1.00 0.00 C ATOM 470 C LEU A 80 0.324 3.604 -16.287 1.00 0.00 C ATOM 471 O LEU A 80 0.067 4.713 -16.769 1.00 0.00 O ATOM 472 CB LEU A 80 2.825 3.364 -15.886 1.00 0.00 C ATOM 473 CG LEU A 80 3.851 4.381 -15.362 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.230 4.015 -15.916 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.475 5.797 -15.810 1.00 0.00 C ATOM 0 H LEU A 80 1.985 1.840 -14.156 1.00 0.00 H new ATOM 0 HA LEU A 80 1.333 4.530 -14.771 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.185 2.353 -15.692 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.731 3.467 -16.967 1.00 0.00 H new ATOM 0 HG LEU A 80 3.864 4.355 -14.272 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.969 4.729 -15.552 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.500 3.012 -15.585 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.204 4.043 -17.005 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.211 6.506 -15.431 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.456 5.841 -16.899 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.490 6.053 -15.419 1.00 0.00 H new ATOM 487 N PRO A 81 -0.376 2.511 -16.654 1.00 0.00 N ATOM 488 CA PRO A 81 -1.521 2.538 -17.581 1.00 0.00 C ATOM 489 C PRO A 81 -2.725 3.397 -17.193 1.00 0.00 C ATOM 490 O PRO A 81 -3.721 3.391 -17.921 1.00 0.00 O ATOM 491 CB PRO A 81 -1.919 1.072 -17.798 1.00 0.00 C ATOM 492 CG PRO A 81 -0.655 0.290 -17.448 1.00 0.00 C ATOM 493 CD PRO A 81 -0.011 1.133 -16.353 1.00 0.00 C ATOM 0 HA PRO A 81 -1.191 3.042 -18.489 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.755 0.787 -17.159 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.228 0.891 -18.827 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.888 -0.715 -17.097 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.002 0.181 -18.311 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.372 0.838 -15.368 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.072 1.007 -16.347 1.00 0.00 H new ATOM 501 N PHE A 82 -2.651 4.141 -16.088 1.00 0.00 N ATOM 502 CA PHE A 82 -3.804 4.776 -15.474 1.00 0.00 C ATOM 503 C PHE A 82 -3.703 6.300 -15.380 1.00 0.00 C ATOM 504 O PHE A 82 -4.689 6.991 -15.650 1.00 0.00 O ATOM 505 CB PHE A 82 -4.040 4.147 -14.096 1.00 0.00 C ATOM 506 CG PHE A 82 -4.258 2.654 -14.180 1.00 0.00 C ATOM 507 CD1 PHE A 82 -3.170 1.766 -14.322 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.567 2.157 -14.156 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.405 0.388 -14.458 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.808 0.788 -14.325 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.729 -0.095 -14.478 1.00 0.00 C ATOM 0 H PHE A 82 -1.776 4.318 -15.594 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.659 4.596 -16.125 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.184 4.352 -13.453 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.908 4.613 -13.629 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -2.159 2.145 -14.326 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.395 2.833 -14.006 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.576 -0.298 -14.547 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.821 0.413 -14.337 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.914 -1.151 -14.612 1.00 0.00 H new ATOM 521 N GLY A 83 -2.525 6.833 -15.026 1.00 0.00 N ATOM 522 CA GLY A 83 -2.271 8.263 -14.979 1.00 0.00 C ATOM 523 C GLY A 83 -0.825 8.598 -15.331 1.00 0.00 C ATOM 524 O GLY A 83 -0.359 8.409 -16.456 1.00 0.00 O ATOM 0 H GLY A 83 -1.718 6.268 -14.763 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.940 8.773 -15.672 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.498 8.639 -13.981 1.00 0.00 H new ATOM 528 N LYS A 84 -0.136 9.103 -14.316 1.00 0.00 N ATOM 529 CA LYS A 84 1.251 9.545 -14.258 1.00 0.00 C ATOM 530 C LYS A 84 1.684 9.281 -12.818 1.00 0.00 C ATOM 531 O LYS A 84 0.999 9.734 -11.903 1.00 0.00 O ATOM 532 CB LYS A 84 1.279 11.045 -14.635 1.00 0.00 C ATOM 533 CG LYS A 84 2.586 11.543 -15.243 1.00 0.00 C ATOM 534 CD LYS A 84 2.982 10.828 -16.542 1.00 0.00 C ATOM 535 CE LYS A 84 4.184 11.529 -17.189 1.00 0.00 C ATOM 536 NZ LYS A 84 4.579 10.865 -18.459 1.00 0.00 N ATOM 0 H LYS A 84 -0.588 9.227 -13.410 1.00 0.00 H new ATOM 0 HA LYS A 84 1.926 9.033 -14.943 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.472 11.240 -15.341 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.068 11.631 -13.740 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.499 12.611 -15.440 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.386 11.418 -14.513 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.229 9.787 -16.332 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.140 10.822 -17.234 1.00 0.00 H new ATOM 0 HE2 LYS A 84 3.937 12.573 -17.384 1.00 0.00 H new ATOM 0 HE3 LYS A 84 5.026 11.524 -16.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.394 11.362 -18.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 4.837 9.876 -18.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.782 10.892 -19.127 1.00 0.00 H new ATOM 550 N VAL A 85 2.665 8.418 -12.578 1.00 0.00 N ATOM 551 CA VAL A 85 2.820 7.762 -11.255 1.00 0.00 C ATOM 552 C VAL A 85 4.242 7.973 -10.757 1.00 0.00 C ATOM 553 O VAL A 85 5.159 7.191 -11.003 1.00 0.00 O ATOM 554 CB VAL A 85 2.253 6.324 -11.205 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.180 5.713 -9.793 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.086 6.188 -12.178 1.00 0.00 C ATOM 0 H VAL A 85 3.367 8.148 -13.267 1.00 0.00 H new ATOM 0 HA VAL A 85 2.178 8.246 -10.519 1.00 0.00 H new ATOM 0 HB VAL A 85 2.972 5.608 -11.603 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.771 4.705 -9.854 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.180 5.673 -9.362 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.537 6.328 -9.163 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.693 5.172 -12.136 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.300 6.892 -11.905 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.429 6.402 -13.190 1.00 0.00 H new ATOM 566 N THR A 86 4.408 9.157 -10.167 1.00 0.00 N ATOM 567 CA THR A 86 5.675 9.834 -9.890 1.00 0.00 C ATOM 568 C THR A 86 6.425 9.196 -8.727 1.00 0.00 C ATOM 569 O THR A 86 7.660 9.230 -8.709 1.00 0.00 O ATOM 570 CB THR A 86 5.428 11.338 -9.662 1.00 0.00 C ATOM 571 OG1 THR A 86 6.647 12.043 -9.566 1.00 0.00 O ATOM 572 CG2 THR A 86 4.602 11.632 -8.413 1.00 0.00 C ATOM 0 H THR A 86 3.608 9.705 -9.849 1.00 0.00 H new ATOM 0 HA THR A 86 6.320 9.720 -10.761 1.00 0.00 H new ATOM 0 HB THR A 86 4.860 11.672 -10.531 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.464 12.995 -9.423 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.465 12.709 -8.312 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.628 11.149 -8.499 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.121 11.248 -7.535 1.00 0.00 H new ATOM 580 N ASN A 87 5.708 8.552 -7.794 1.00 0.00 N ATOM 581 CA ASN A 87 6.333 7.856 -6.680 1.00 0.00 C ATOM 582 C ASN A 87 5.661 6.528 -6.306 1.00 0.00 C ATOM 583 O ASN A 87 4.531 6.217 -6.675 1.00 0.00 O ATOM 584 CB ASN A 87 6.408 8.809 -5.463 1.00 0.00 C ATOM 585 CG ASN A 87 7.553 9.805 -5.556 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.720 9.438 -5.614 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.266 11.085 -5.519 1.00 0.00 N ATOM 0 H ASN A 87 4.689 8.504 -7.797 1.00 0.00 H new ATOM 0 HA ASN A 87 7.335 7.576 -7.003 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.467 9.353 -5.376 1.00 0.00 H new ATOM 0 HB3 ASN A 87 6.520 8.219 -4.553 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.016 11.776 -5.539 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.293 11.388 -5.471 1.00 0.00 H new ATOM 594 N LEU A 88 6.386 5.764 -5.499 1.00 0.00 N ATOM 595 CA LEU A 88 5.933 4.677 -4.650 1.00 0.00 C ATOM 596 C LEU A 88 6.795 4.613 -3.378 1.00 0.00 C ATOM 597 O LEU A 88 7.786 5.333 -3.248 1.00 0.00 O ATOM 598 CB LEU A 88 5.973 3.383 -5.482 1.00 0.00 C ATOM 599 CG LEU A 88 7.353 2.703 -5.526 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.154 1.380 -6.230 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.444 3.488 -6.247 1.00 0.00 C ATOM 0 H LEU A 88 7.393 5.904 -5.417 1.00 0.00 H new ATOM 0 HA LEU A 88 4.909 4.829 -4.310 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.247 2.680 -5.074 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.660 3.610 -6.501 1.00 0.00 H new ATOM 0 HG LEU A 88 7.706 2.611 -4.499 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.106 0.853 -6.289 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.438 0.775 -5.673 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.774 1.557 -7.236 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.376 2.923 -6.222 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.148 3.654 -7.283 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.589 4.448 -5.752 1.00 0.00 H new ATOM 613 N LEU A 89 6.436 3.733 -2.448 1.00 0.00 N ATOM 614 CA LEU A 89 7.163 3.486 -1.202 1.00 0.00 C ATOM 615 C LEU A 89 7.063 2.009 -0.818 1.00 0.00 C ATOM 616 O LEU A 89 6.110 1.335 -1.207 1.00 0.00 O ATOM 617 CB LEU A 89 6.668 4.510 -0.163 1.00 0.00 C ATOM 618 CG LEU A 89 6.468 4.102 1.300 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.856 5.326 1.964 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.491 2.988 1.572 1.00 0.00 C ATOM 0 H LEU A 89 5.603 3.151 -2.542 1.00 0.00 H new ATOM 0 HA LEU A 89 8.237 3.647 -1.292 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.372 5.342 -0.171 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.714 4.896 -0.522 1.00 0.00 H new ATOM 0 HG LEU A 89 7.437 3.753 1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.680 5.118 3.019 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.539 6.171 1.870 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.910 5.568 1.479 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.444 2.799 2.644 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.503 3.274 1.210 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.818 2.084 1.058 1.00 0.00 H new ATOM 632 N MET A 90 8.027 1.511 -0.036 1.00 0.00 N ATOM 633 CA MET A 90 8.089 0.112 0.404 1.00 0.00 C ATOM 634 C MET A 90 8.235 0.003 1.917 1.00 0.00 C ATOM 635 O MET A 90 9.304 0.256 2.475 1.00 0.00 O ATOM 636 CB MET A 90 9.186 -0.650 -0.358 1.00 0.00 C ATOM 637 CG MET A 90 8.919 -0.513 -1.859 1.00 0.00 C ATOM 638 SD MET A 90 9.393 -1.906 -2.903 1.00 0.00 S ATOM 639 CE MET A 90 8.103 -1.599 -4.132 1.00 0.00 C ATOM 0 H MET A 90 8.799 2.078 0.315 1.00 0.00 H new ATOM 0 HA MET A 90 7.140 -0.366 0.160 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.168 -0.248 -0.110 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.189 -1.701 -0.068 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.853 -0.332 -1.999 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.443 0.373 -2.217 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.394 -2.043 -5.084 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.166 -2.043 -3.795 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.970 -0.525 -4.259 1.00 0.00 H new ATOM 649 N LEU A 91 7.154 -0.406 2.587 1.00 0.00 N ATOM 650 CA LEU A 91 7.178 -0.863 3.983 1.00 0.00 C ATOM 651 C LEU A 91 7.762 -2.289 4.038 1.00 0.00 C ATOM 652 O LEU A 91 7.075 -3.262 4.371 1.00 0.00 O ATOM 653 CB LEU A 91 5.763 -0.811 4.596 1.00 0.00 C ATOM 654 CG LEU A 91 4.971 0.507 4.685 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.854 1.721 4.936 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.041 0.705 3.490 1.00 0.00 C ATOM 0 H LEU A 91 6.223 -0.430 2.171 1.00 0.00 H new ATOM 0 HA LEU A 91 7.811 -0.201 4.574 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.148 -1.512 4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.843 -1.201 5.611 1.00 0.00 H new ATOM 0 HG LEU A 91 4.337 0.414 5.567 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.235 2.617 4.988 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.388 1.594 5.878 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.572 1.823 4.122 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.505 1.648 3.599 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.628 0.725 2.572 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.326 -0.116 3.446 1.00 0.00 H new ATOM 668 N LYS A 92 9.043 -2.407 3.664 1.00 0.00 N ATOM 669 CA LYS A 92 9.700 -3.650 3.231 1.00 0.00 C ATOM 670 C LYS A 92 9.548 -4.802 4.232 1.00 0.00 C ATOM 671 O LYS A 92 9.188 -5.916 3.851 1.00 0.00 O ATOM 672 CB LYS A 92 11.177 -3.338 2.926 1.00 0.00 C ATOM 673 CG LYS A 92 11.849 -4.406 2.049 1.00 0.00 C ATOM 674 CD LYS A 92 13.353 -4.113 1.926 1.00 0.00 C ATOM 675 CE LYS A 92 14.043 -5.001 0.882 1.00 0.00 C ATOM 676 NZ LYS A 92 13.837 -4.490 -0.496 1.00 0.00 N ATOM 0 H LYS A 92 9.676 -1.608 3.654 1.00 0.00 H new ATOM 0 HA LYS A 92 9.202 -4.007 2.329 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.242 -2.372 2.426 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.725 -3.249 3.864 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.697 -5.394 2.483 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.390 -4.418 1.060 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.495 -3.066 1.658 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.829 -4.261 2.895 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.111 -5.051 1.096 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.655 -6.017 0.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.346 -5.096 -1.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.822 -4.498 -0.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.199 -3.517 -0.563 1.00 0.00 H new ATOM 690 N GLY A 93 9.754 -4.518 5.518 1.00 0.00 N ATOM 691 CA GLY A 93 9.673 -5.488 6.618 1.00 0.00 C ATOM 692 C GLY A 93 8.260 -5.991 6.965 1.00 0.00 C ATOM 693 O GLY A 93 8.139 -6.959 7.719 1.00 0.00 O ATOM 0 H GLY A 93 9.989 -3.578 5.836 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.292 -6.348 6.365 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.106 -5.035 7.510 1.00 0.00 H new ATOM 697 N LYS A 94 7.195 -5.361 6.432 1.00 0.00 N ATOM 698 CA LYS A 94 5.784 -5.749 6.656 1.00 0.00 C ATOM 699 C LYS A 94 5.147 -6.446 5.441 1.00 0.00 C ATOM 700 O LYS A 94 3.979 -6.815 5.513 1.00 0.00 O ATOM 701 CB LYS A 94 4.926 -4.539 7.095 1.00 0.00 C ATOM 702 CG LYS A 94 5.142 -4.026 8.538 1.00 0.00 C ATOM 703 CD LYS A 94 6.534 -3.517 8.945 1.00 0.00 C ATOM 704 CE LYS A 94 7.027 -2.302 8.145 1.00 0.00 C ATOM 705 NZ LYS A 94 6.343 -1.050 8.569 1.00 0.00 N ATOM 0 H LYS A 94 7.291 -4.550 5.820 1.00 0.00 H new ATOM 0 HA LYS A 94 5.803 -6.478 7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.121 -3.716 6.408 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.876 -4.807 6.982 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.432 -3.217 8.710 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.875 -4.834 9.219 1.00 0.00 H new ATOM 0 HD2 LYS A 94 6.517 -3.256 10.003 1.00 0.00 H new ATOM 0 HD3 LYS A 94 7.252 -4.329 8.828 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.103 -2.191 8.277 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.852 -2.470 7.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.701 -0.251 8.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.318 -1.146 8.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.531 -0.876 9.577 1.00 0.00 H new ATOM 719 N ASN A 95 5.882 -6.613 4.333 1.00 0.00 N ATOM 720 CA ASN A 95 5.362 -7.015 3.017 1.00 0.00 C ATOM 721 C ASN A 95 4.327 -6.021 2.460 1.00 0.00 C ATOM 722 O ASN A 95 3.323 -6.423 1.868 1.00 0.00 O ATOM 723 CB ASN A 95 4.802 -8.448 3.049 1.00 0.00 C ATOM 724 CG ASN A 95 5.831 -9.495 3.419 1.00 0.00 C ATOM 725 OD1 ASN A 95 6.175 -9.702 4.574 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.337 -10.211 2.450 1.00 0.00 N ATOM 0 H ASN A 95 6.891 -6.467 4.327 1.00 0.00 H new ATOM 0 HA ASN A 95 6.209 -7.000 2.331 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.979 -8.491 3.763 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.387 -8.689 2.070 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.018 -10.941 2.658 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.051 -10.039 1.486 1.00 0.00 H new ATOM 733 N GLN A 96 4.546 -4.720 2.671 1.00 0.00 N ATOM 734 CA GLN A 96 3.594 -3.669 2.348 1.00 0.00 C ATOM 735 C GLN A 96 4.235 -2.545 1.494 1.00 0.00 C ATOM 736 O GLN A 96 5.460 -2.426 1.434 1.00 0.00 O ATOM 737 CB GLN A 96 3.015 -3.161 3.666 1.00 0.00 C ATOM 738 CG GLN A 96 2.038 -4.154 4.301 1.00 0.00 C ATOM 739 CD GLN A 96 1.631 -3.737 5.705 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.464 -4.534 6.612 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.431 -2.465 5.931 1.00 0.00 N ATOM 0 H GLN A 96 5.411 -4.367 3.080 1.00 0.00 H new ATOM 0 HA GLN A 96 2.790 -4.060 1.724 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.829 -2.961 4.363 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.504 -2.214 3.493 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.149 -4.237 3.676 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.497 -5.142 4.335 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.567 -1.786 5.182 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.139 -2.151 6.857 1.00 0.00 H new ATOM 750 N ALA A 97 3.436 -1.699 0.840 1.00 0.00 N ATOM 751 CA ALA A 97 3.878 -0.602 -0.042 1.00 0.00 C ATOM 752 C ALA A 97 2.828 0.520 -0.139 1.00 0.00 C ATOM 753 O ALA A 97 1.664 0.307 0.189 1.00 0.00 O ATOM 754 CB ALA A 97 4.096 -1.192 -1.451 1.00 0.00 C ATOM 0 H ALA A 97 2.420 -1.757 0.909 1.00 0.00 H new ATOM 0 HA ALA A 97 4.791 -0.171 0.369 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.424 -0.404 -2.129 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.857 -1.971 -1.405 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.161 -1.618 -1.816 1.00 0.00 H new ATOM 760 N PHE A 98 3.234 1.673 -0.676 1.00 0.00 N ATOM 761 CA PHE A 98 2.381 2.731 -1.238 1.00 0.00 C ATOM 762 C PHE A 98 2.642 2.816 -2.755 1.00 0.00 C ATOM 763 O PHE A 98 3.768 2.544 -3.178 1.00 0.00 O ATOM 764 CB PHE A 98 2.728 4.115 -0.661 1.00 0.00 C ATOM 765 CG PHE A 98 2.288 4.503 0.748 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.953 3.543 1.720 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.252 5.868 1.106 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.609 3.938 3.020 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.854 6.272 2.384 1.00 0.00 C ATOM 770 CZ PHE A 98 1.543 5.299 3.336 1.00 0.00 C ATOM 0 H PHE A 98 4.224 1.910 -0.735 1.00 0.00 H new ATOM 0 HA PHE A 98 1.347 2.482 -0.997 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.813 4.215 -0.698 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.316 4.859 -1.342 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.961 2.494 1.463 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.537 6.614 0.379 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.396 3.195 3.774 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.788 7.321 2.631 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.247 5.601 4.330 1.00 0.00 H new ATOM 780 N ILE A 99 1.700 3.318 -3.561 1.00 0.00 N ATOM 781 CA ILE A 99 1.945 3.797 -4.928 1.00 0.00 C ATOM 782 C ILE A 99 1.188 5.117 -5.159 1.00 0.00 C ATOM 783 O ILE A 99 0.013 5.241 -4.816 1.00 0.00 O ATOM 784 CB ILE A 99 1.652 2.677 -5.951 1.00 0.00 C ATOM 785 CG1 ILE A 99 2.007 3.160 -7.369 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.219 2.137 -5.856 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.952 2.050 -8.422 1.00 0.00 C ATOM 0 H ILE A 99 0.725 3.405 -3.276 1.00 0.00 H new ATOM 0 HA ILE A 99 2.998 4.037 -5.075 1.00 0.00 H new ATOM 0 HB ILE A 99 2.288 1.826 -5.707 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.321 3.957 -7.656 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.008 3.591 -7.358 1.00 0.00 H new ATOM 0 HG21 ILE A 99 0.075 1.353 -6.600 1.00 0.00 H new ATOM 0 HG22 ILE A 99 0.050 1.727 -4.860 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.488 2.946 -6.040 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.213 2.461 -9.397 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.659 1.263 -8.158 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.945 1.635 -8.461 1.00 0.00 H new ATOM 799 N GLU A 100 1.890 6.125 -5.683 1.00 0.00 N ATOM 800 CA GLU A 100 1.556 7.555 -5.633 1.00 0.00 C ATOM 801 C GLU A 100 1.558 8.194 -7.010 1.00 0.00 C ATOM 802 O GLU A 100 2.565 8.241 -7.730 1.00 0.00 O ATOM 803 CB GLU A 100 2.537 8.287 -4.709 1.00 0.00 C ATOM 804 CG GLU A 100 2.623 9.821 -4.870 1.00 0.00 C ATOM 805 CD GLU A 100 1.312 10.547 -4.555 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.755 10.312 -3.460 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.873 11.382 -5.383 1.00 0.00 O ATOM 0 H GLU A 100 2.762 5.956 -6.185 1.00 0.00 H new ATOM 0 HA GLU A 100 0.544 7.642 -5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.262 8.067 -3.677 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.532 7.871 -4.869 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.406 10.203 -4.215 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.921 10.054 -5.892 1.00 0.00 H new ATOM 814 N MET A 101 0.382 8.715 -7.342 1.00 0.00 N ATOM 815 CA MET A 101 0.025 9.085 -8.696 1.00 0.00 C ATOM 816 C MET A 101 -0.648 10.451 -8.789 1.00 0.00 C ATOM 817 O MET A 101 -1.232 10.977 -7.847 1.00 0.00 O ATOM 818 CB MET A 101 -0.753 7.948 -9.357 1.00 0.00 C ATOM 819 CG MET A 101 -1.549 7.027 -8.436 1.00 0.00 C ATOM 820 SD MET A 101 -2.594 5.871 -9.346 1.00 0.00 S ATOM 821 CE MET A 101 -1.615 5.533 -10.831 1.00 0.00 C ATOM 0 H MET A 101 -0.358 8.893 -6.663 1.00 0.00 H new ATOM 0 HA MET A 101 0.941 9.221 -9.271 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.443 8.385 -10.079 1.00 0.00 H new ATOM 0 HB3 MET A 101 -0.047 7.337 -9.920 1.00 0.00 H new ATOM 0 HG2 MET A 101 -0.860 6.468 -7.804 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.171 7.630 -7.774 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.137 4.807 -11.454 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.474 6.457 -11.392 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.643 5.132 -10.543 1.00 0.00 H new ATOM 831 N ASN A 102 -0.505 11.047 -9.964 1.00 0.00 N ATOM 832 CA ASN A 102 -0.632 12.485 -10.204 1.00 0.00 C ATOM 833 C ASN A 102 -2.067 13.039 -10.136 1.00 0.00 C ATOM 834 O ASN A 102 -2.243 14.246 -9.964 1.00 0.00 O ATOM 835 CB ASN A 102 0.008 12.749 -11.579 1.00 0.00 C ATOM 836 CG ASN A 102 -0.892 12.446 -12.760 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.483 11.273 -12.820 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -1.031 13.243 -13.674 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.289 10.525 -10.813 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.126 13.016 -9.398 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.312 13.794 -11.629 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.914 12.149 -11.665 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.574 14.154 -13.630 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.604 12.998 -14.481 1.00 0.00 H new ATOM 845 N THR A 103 -3.082 12.181 -10.285 1.00 0.00 N ATOM 846 CA THR A 103 -4.498 12.563 -10.338 1.00 0.00 C ATOM 847 C THR A 103 -5.358 11.616 -9.501 1.00 0.00 C ATOM 848 O THR A 103 -5.181 10.390 -9.493 1.00 0.00 O ATOM 849 CB THR A 103 -5.048 12.674 -11.781 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.328 11.421 -12.356 1.00 0.00 O ATOM 851 CG2 THR A 103 -4.122 13.390 -12.769 1.00 0.00 C ATOM 0 H THR A 103 -2.938 11.175 -10.374 1.00 0.00 H new ATOM 0 HA THR A 103 -4.556 13.563 -9.907 1.00 0.00 H new ATOM 0 HB THR A 103 -5.954 13.263 -11.636 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.673 11.548 -13.264 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.592 13.419 -13.752 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.939 14.408 -12.424 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.175 12.854 -12.835 1.00 0.00 H new ATOM 859 N GLU A 104 -6.306 12.210 -8.773 1.00 0.00 N ATOM 860 CA GLU A 104 -7.306 11.468 -7.997 1.00 0.00 C ATOM 861 C GLU A 104 -8.124 10.537 -8.903 1.00 0.00 C ATOM 862 O GLU A 104 -8.504 9.449 -8.482 1.00 0.00 O ATOM 863 CB GLU A 104 -8.238 12.441 -7.253 1.00 0.00 C ATOM 864 CG GLU A 104 -7.505 13.237 -6.158 1.00 0.00 C ATOM 865 CD GLU A 104 -8.398 14.268 -5.426 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.643 14.102 -5.370 1.00 0.00 O ATOM 867 OE2 GLU A 104 -7.844 15.254 -4.883 1.00 0.00 O ATOM 0 H GLU A 104 -6.403 13.223 -8.704 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.780 10.856 -7.265 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.680 13.135 -7.968 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.058 11.881 -6.804 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.098 12.539 -5.426 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.659 13.758 -6.606 1.00 0.00 H new ATOM 874 N GLU A 105 -8.356 10.920 -10.162 1.00 0.00 N ATOM 875 CA GLU A 105 -9.106 10.116 -11.128 1.00 0.00 C ATOM 876 C GLU A 105 -8.349 8.899 -11.660 1.00 0.00 C ATOM 877 O GLU A 105 -8.945 7.820 -11.724 1.00 0.00 O ATOM 878 CB GLU A 105 -9.577 10.971 -12.313 1.00 0.00 C ATOM 879 CG GLU A 105 -10.610 12.029 -11.911 1.00 0.00 C ATOM 880 CD GLU A 105 -11.075 12.835 -13.142 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.066 12.431 -13.801 1.00 0.00 O ATOM 882 OE2 GLU A 105 -10.452 13.880 -13.461 1.00 0.00 O ATOM 0 H GLU A 105 -8.024 11.807 -10.542 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.961 9.738 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.716 11.464 -12.764 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.007 10.321 -13.075 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.467 11.547 -11.441 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.178 12.703 -11.171 1.00 0.00 H new ATOM 889 N ALA A 106 -7.056 9.016 -11.995 1.00 0.00 N ATOM 890 CA ALA A 106 -6.226 7.848 -12.287 1.00 0.00 C ATOM 891 C ALA A 106 -6.294 6.876 -11.127 1.00 0.00 C ATOM 892 O ALA A 106 -6.613 5.713 -11.327 1.00 0.00 O ATOM 893 CB ALA A 106 -4.765 8.211 -12.521 1.00 0.00 C ATOM 0 H ALA A 106 -6.567 9.908 -12.069 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.617 7.402 -13.202 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.195 7.307 -12.733 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.691 8.894 -13.367 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.363 8.693 -11.630 1.00 0.00 H new ATOM 899 N ALA A 107 -6.021 7.337 -9.913 1.00 0.00 N ATOM 900 CA ALA A 107 -5.966 6.413 -8.799 1.00 0.00 C ATOM 901 C ALA A 107 -7.320 5.843 -8.376 1.00 0.00 C ATOM 902 O ALA A 107 -7.391 4.671 -8.028 1.00 0.00 O ATOM 903 CB ALA A 107 -5.313 7.140 -7.669 1.00 0.00 C ATOM 0 H ALA A 107 -5.840 8.314 -9.683 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.398 5.535 -9.107 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.248 6.482 -6.802 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.311 7.449 -7.966 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.903 8.020 -7.413 1.00 0.00 H new ATOM 909 N ASN A 108 -8.407 6.613 -8.470 1.00 0.00 N ATOM 910 CA ASN A 108 -9.763 6.097 -8.315 1.00 0.00 C ATOM 911 C ASN A 108 -10.041 4.995 -9.345 1.00 0.00 C ATOM 912 O ASN A 108 -10.428 3.886 -8.976 1.00 0.00 O ATOM 913 CB ASN A 108 -10.758 7.258 -8.413 1.00 0.00 C ATOM 914 CG ASN A 108 -12.186 6.775 -8.204 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.568 6.354 -7.125 1.00 0.00 O ATOM 916 ND2 ASN A 108 -13.008 6.800 -9.228 1.00 0.00 N ATOM 0 H ASN A 108 -8.368 7.615 -8.657 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.878 5.639 -7.333 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.514 8.014 -7.667 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.671 7.734 -9.390 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.966 6.467 -9.121 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.688 7.152 -10.130 1.00 0.00 H new ATOM 923 N THR A 109 -9.766 5.249 -10.627 1.00 0.00 N ATOM 924 CA THR A 109 -9.902 4.220 -11.660 1.00 0.00 C ATOM 925 C THR A 109 -8.953 3.048 -11.395 1.00 0.00 C ATOM 926 O THR A 109 -9.335 1.906 -11.633 1.00 0.00 O ATOM 927 CB THR A 109 -9.782 4.824 -13.079 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.835 4.320 -13.875 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.491 4.540 -13.845 1.00 0.00 C ATOM 0 H THR A 109 -9.449 6.155 -10.973 1.00 0.00 H new ATOM 0 HA THR A 109 -10.908 3.803 -11.611 1.00 0.00 H new ATOM 0 HB THR A 109 -9.808 5.900 -12.909 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.772 4.697 -14.778 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.535 5.019 -14.823 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.642 4.934 -13.286 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.373 3.464 -13.973 1.00 0.00 H new ATOM 937 N MET A 110 -7.762 3.285 -10.822 1.00 0.00 N ATOM 938 CA MET A 110 -6.750 2.261 -10.586 1.00 0.00 C ATOM 939 C MET A 110 -7.128 1.327 -9.435 1.00 0.00 C ATOM 940 O MET A 110 -7.075 0.107 -9.549 1.00 0.00 O ATOM 941 CB MET A 110 -5.342 2.853 -10.325 1.00 0.00 C ATOM 942 CG MET A 110 -4.369 1.810 -10.878 1.00 0.00 C ATOM 943 SD MET A 110 -2.619 2.198 -10.826 1.00 0.00 S ATOM 944 CE MET A 110 -2.442 2.450 -9.055 1.00 0.00 C ATOM 0 H MET A 110 -7.477 4.212 -10.507 1.00 0.00 H new ATOM 0 HA MET A 110 -6.711 1.685 -11.510 1.00 0.00 H new ATOM 0 HB2 MET A 110 -5.218 3.814 -10.825 1.00 0.00 H new ATOM 0 HB3 MET A 110 -5.176 3.024 -9.261 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.524 0.881 -10.329 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.639 1.615 -11.916 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.411 2.721 -8.827 1.00 0.00 H new ATOM 0 HE2 MET A 110 -3.107 3.251 -8.733 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.700 1.531 -8.529 1.00 0.00 H new ATOM 954 N VAL A 111 -7.525 1.893 -8.300 1.00 0.00 N ATOM 955 CA VAL A 111 -7.938 1.153 -7.111 1.00 0.00 C ATOM 956 C VAL A 111 -9.196 0.329 -7.388 1.00 0.00 C ATOM 957 O VAL A 111 -9.285 -0.815 -6.957 1.00 0.00 O ATOM 958 CB VAL A 111 -8.104 2.139 -5.941 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.464 2.797 -5.858 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.839 1.482 -4.593 1.00 0.00 C ATOM 0 H VAL A 111 -7.570 2.905 -8.178 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.170 0.431 -6.832 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.361 2.906 -6.158 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.489 3.474 -5.004 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.653 3.359 -6.773 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.231 2.032 -5.737 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.968 2.217 -3.798 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.540 0.660 -4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.819 1.098 -4.570 1.00 0.00 H new ATOM 970 N ASN A 112 -10.145 0.876 -8.163 1.00 0.00 N ATOM 971 CA ASN A 112 -11.385 0.206 -8.570 1.00 0.00 C ATOM 972 C ASN A 112 -11.117 -0.896 -9.606 1.00 0.00 C ATOM 973 O ASN A 112 -11.625 -2.010 -9.470 1.00 0.00 O ATOM 974 CB ASN A 112 -12.370 1.245 -9.109 1.00 0.00 C ATOM 975 CG ASN A 112 -13.083 2.006 -7.998 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.251 1.781 -7.722 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.418 2.900 -7.301 1.00 0.00 N ATOM 0 H ASN A 112 -10.067 1.823 -8.533 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.822 -0.281 -7.698 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.836 1.952 -9.744 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -13.110 0.748 -9.737 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.878 3.398 -6.539 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.442 3.096 -7.522 1.00 0.00 H new ATOM 984 N TYR A 113 -10.249 -0.625 -10.588 1.00 0.00 N ATOM 985 CA TYR A 113 -9.639 -1.625 -11.467 1.00 0.00 C ATOM 986 C TYR A 113 -9.096 -2.796 -10.633 1.00 0.00 C ATOM 987 O TYR A 113 -9.600 -3.907 -10.714 1.00 0.00 O ATOM 988 CB TYR A 113 -8.573 -0.939 -12.344 1.00 0.00 C ATOM 989 CG TYR A 113 -7.727 -1.859 -13.181 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.530 -2.390 -12.665 1.00 0.00 C ATOM 991 CD2 TYR A 113 -8.105 -2.112 -14.512 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.800 -3.312 -13.440 1.00 0.00 C ATOM 993 CE2 TYR A 113 -7.337 -2.985 -15.311 1.00 0.00 C ATOM 994 CZ TYR A 113 -6.188 -3.598 -14.767 1.00 0.00 C ATOM 995 OH TYR A 113 -5.444 -4.459 -15.518 1.00 0.00 O ATOM 0 H TYR A 113 -9.944 0.325 -10.798 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.378 -2.056 -12.142 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -9.073 -0.233 -13.006 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.915 -0.359 -11.697 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -6.176 -2.095 -11.688 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -8.984 -1.638 -14.923 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -4.937 -3.804 -13.016 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -7.626 -3.183 -16.332 1.00 0.00 H new ATOM 0 HH TYR A 113 -5.846 -4.549 -16.407 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.233 -2.555 -9.657 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.632 -3.551 -8.779 1.00 0.00 C ATOM 1007 C TYR A 114 -8.555 -4.026 -7.665 1.00 0.00 C ATOM 1008 O TYR A 114 -8.137 -4.751 -6.760 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.336 -2.983 -8.209 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.247 -2.819 -9.223 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.922 -3.914 -10.038 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.522 -1.618 -9.293 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.819 -3.829 -10.895 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.441 -1.520 -10.191 1.00 0.00 C ATOM 1015 CZ TYR A 114 -3.099 -2.623 -11.005 1.00 0.00 C ATOM 1016 OH TYR A 114 -2.099 -2.533 -11.918 1.00 0.00 O ATOM 0 H TYR A 114 -7.916 -1.609 -9.444 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.430 -4.438 -9.379 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.544 -2.014 -7.754 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.982 -3.639 -7.414 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.518 -4.814 -10.004 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.790 -0.780 -8.666 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.519 -4.690 -11.474 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.874 -0.603 -10.257 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.718 -1.630 -11.898 1.00 0.00 H new ATOM 1026 N THR A 115 -9.826 -3.660 -7.791 1.00 0.00 N ATOM 1027 CA THR A 115 -10.911 -4.137 -6.948 1.00 0.00 C ATOM 1028 C THR A 115 -11.878 -5.033 -7.747 1.00 0.00 C ATOM 1029 O THR A 115 -12.608 -5.846 -7.182 1.00 0.00 O ATOM 1030 CB THR A 115 -11.572 -2.982 -6.159 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.637 -2.453 -5.241 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.793 -3.383 -5.330 1.00 0.00 C ATOM 0 H THR A 115 -10.137 -3.002 -8.506 1.00 0.00 H new ATOM 0 HA THR A 115 -10.504 -4.787 -6.173 1.00 0.00 H new ATOM 0 HB THR A 115 -11.897 -2.273 -6.921 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.969 -1.923 -5.724 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.186 -2.507 -4.814 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.561 -3.792 -5.987 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.504 -4.136 -4.597 1.00 0.00 H new ATOM 1040 N SER A 116 -11.788 -4.981 -9.081 1.00 0.00 N ATOM 1041 CA SER A 116 -12.342 -5.951 -10.039 1.00 0.00 C ATOM 1042 C SER A 116 -11.352 -7.077 -10.346 1.00 0.00 C ATOM 1043 O SER A 116 -11.717 -8.249 -10.468 1.00 0.00 O ATOM 1044 CB SER A 116 -12.571 -5.235 -11.380 1.00 0.00 C ATOM 1045 OG SER A 116 -13.936 -4.881 -11.540 1.00 0.00 O ATOM 0 H SER A 116 -11.299 -4.218 -9.550 1.00 0.00 H new ATOM 0 HA SER A 116 -13.253 -6.357 -9.599 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.951 -4.340 -11.429 1.00 0.00 H new ATOM 0 HB3 SER A 116 -12.261 -5.883 -12.200 1.00 0.00 H new ATOM 0 HG SER A 116 -14.057 -4.425 -12.399 1.00 0.00 H new ATOM 1051 N VAL A 117 -10.099 -6.676 -10.567 1.00 0.00 N ATOM 1052 CA VAL A 117 -9.186 -7.273 -11.542 1.00 0.00 C ATOM 1053 C VAL A 117 -8.016 -7.992 -10.865 1.00 0.00 C ATOM 1054 O VAL A 117 -7.744 -9.149 -11.183 1.00 0.00 O ATOM 1055 CB VAL A 117 -8.675 -6.151 -12.471 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -7.705 -6.666 -13.484 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -9.761 -5.492 -13.332 1.00 0.00 C ATOM 0 H VAL A 117 -9.678 -5.901 -10.055 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.721 -8.028 -12.117 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.244 -5.440 -11.766 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.370 -5.845 -14.117 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.847 -7.105 -12.976 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -8.190 -7.424 -14.099 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.312 -4.716 -13.953 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -10.225 -6.244 -13.970 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.518 -5.047 -12.686 1.00 0.00 H new ATOM 1067 N THR A 118 -7.356 -7.304 -9.925 1.00 0.00 N ATOM 1068 CA THR A 118 -6.120 -7.693 -9.200 1.00 0.00 C ATOM 1069 C THR A 118 -4.871 -7.684 -10.119 1.00 0.00 C ATOM 1070 O THR A 118 -4.970 -8.061 -11.288 1.00 0.00 O ATOM 1071 CB THR A 118 -6.315 -9.057 -8.502 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.475 -9.029 -7.695 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.184 -9.438 -7.560 1.00 0.00 C ATOM 0 H THR A 118 -7.690 -6.389 -9.622 1.00 0.00 H new ATOM 0 HA THR A 118 -5.933 -6.942 -8.432 1.00 0.00 H new ATOM 0 HB THR A 118 -6.370 -9.778 -9.318 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.591 -9.899 -7.258 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.396 -10.408 -7.110 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.249 -9.494 -8.118 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.095 -8.686 -6.776 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.674 -7.245 -9.660 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.472 -7.148 -10.500 1.00 0.00 C ATOM 1083 C PRO A 119 -1.708 -8.485 -10.668 1.00 0.00 C ATOM 1084 O PRO A 119 -0.863 -8.601 -11.554 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.598 -6.067 -9.830 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.326 -5.648 -8.540 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.269 -6.821 -8.329 1.00 0.00 C ATOM 0 HA PRO A 119 -2.747 -6.888 -11.522 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.605 -6.456 -9.605 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.463 -5.213 -10.493 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.638 -5.519 -7.704 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -2.863 -4.707 -8.659 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -2.773 -7.631 -7.794 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.132 -6.527 -7.732 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.042 -9.495 -9.849 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.586 -10.906 -9.803 1.00 0.00 C ATOM 1097 C VAL A 120 -0.067 -11.110 -9.806 1.00 0.00 C ATOM 1098 O VAL A 120 0.592 -11.069 -10.847 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.312 -11.763 -10.858 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.994 -13.257 -10.706 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.829 -11.593 -10.680 1.00 0.00 C ATOM 0 H VAL A 120 -2.723 -9.327 -9.109 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.878 -11.266 -8.817 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.975 -11.429 -11.839 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.527 -13.822 -11.470 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.922 -13.414 -10.821 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.307 -13.597 -9.719 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.352 -12.196 -11.422 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.117 -11.918 -9.680 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.095 -10.544 -10.811 1.00 0.00 H new ATOM 1111 N LEU A 121 0.492 -11.378 -8.619 1.00 0.00 N ATOM 1112 CA LEU A 121 1.924 -11.600 -8.427 1.00 0.00 C ATOM 1113 C LEU A 121 2.236 -13.090 -8.537 1.00 0.00 C ATOM 1114 O LEU A 121 1.980 -13.865 -7.616 1.00 0.00 O ATOM 1115 CB LEU A 121 2.420 -10.988 -7.105 1.00 0.00 C ATOM 1116 CG LEU A 121 3.893 -10.556 -7.201 1.00 0.00 C ATOM 1117 CD1 LEU A 121 4.088 -9.335 -6.303 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.850 -11.684 -6.809 1.00 0.00 C ATOM 0 H LEU A 121 -0.048 -11.447 -7.756 1.00 0.00 H new ATOM 0 HA LEU A 121 2.470 -11.085 -9.218 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.803 -10.127 -6.848 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.305 -11.715 -6.301 1.00 0.00 H new ATOM 0 HG LEU A 121 4.127 -10.306 -8.236 1.00 0.00 H new ATOM 0 HD11 LEU A 121 5.127 -9.008 -6.353 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.437 -8.528 -6.640 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.839 -9.596 -5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.879 -11.334 -6.892 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.652 -11.988 -5.781 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.702 -12.535 -7.474 1.00 0.00 H new ATOM 1130 N ARG A 122 2.762 -13.475 -9.700 1.00 0.00 N ATOM 1131 CA ARG A 122 3.185 -14.838 -10.068 1.00 0.00 C ATOM 1132 C ARG A 122 2.140 -15.895 -9.671 1.00 0.00 C ATOM 1133 O ARG A 122 2.384 -16.789 -8.860 1.00 0.00 O ATOM 1134 CB ARG A 122 4.604 -15.089 -9.511 1.00 0.00 C ATOM 1135 CG ARG A 122 5.451 -16.051 -10.353 1.00 0.00 C ATOM 1136 CD ARG A 122 4.826 -17.443 -10.549 1.00 0.00 C ATOM 1137 NE ARG A 122 5.709 -18.331 -11.337 1.00 0.00 N ATOM 1138 CZ ARG A 122 6.530 -19.264 -10.888 1.00 0.00 C ATOM 1139 NH1 ARG A 122 6.699 -19.499 -9.617 1.00 0.00 N ATOM 1140 NH2 ARG A 122 7.216 -19.993 -11.722 1.00 0.00 N ATOM 0 H ARG A 122 2.916 -12.810 -10.458 1.00 0.00 H new ATOM 0 HA ARG A 122 3.245 -14.932 -11.152 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.126 -14.135 -9.435 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.520 -15.487 -8.500 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.624 -15.603 -11.331 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.426 -16.167 -9.879 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.630 -17.894 -9.576 1.00 0.00 H new ATOM 0 HD3 ARG A 122 3.865 -17.343 -11.054 1.00 0.00 H new ATOM 0 HE ARG A 122 5.681 -18.208 -12.349 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.187 -18.952 -8.925 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.343 -20.230 -9.315 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.121 -19.845 -12.727 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.848 -20.712 -11.370 1.00 0.00 H new ATOM 1154 N GLY A 123 0.951 -15.779 -10.266 1.00 0.00 N ATOM 1155 CA GLY A 123 -0.134 -16.753 -10.128 1.00 0.00 C ATOM 1156 C GLY A 123 -0.987 -16.636 -8.855 1.00 0.00 C ATOM 1157 O GLY A 123 -1.829 -17.506 -8.620 1.00 0.00 O ATOM 0 H GLY A 123 0.711 -14.991 -10.868 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.792 -16.659 -10.992 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.296 -17.754 -10.162 1.00 0.00 H new ATOM 1161 N GLN A 124 -0.797 -15.597 -8.031 1.00 0.00 N ATOM 1162 CA GLN A 124 -1.431 -15.412 -6.727 1.00 0.00 C ATOM 1163 C GLN A 124 -2.009 -13.987 -6.616 1.00 0.00 C ATOM 1164 O GLN A 124 -1.396 -13.045 -7.129 1.00 0.00 O ATOM 1165 CB GLN A 124 -0.367 -15.678 -5.655 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.842 -15.607 -4.196 1.00 0.00 C ATOM 1167 CD GLN A 124 -1.771 -16.744 -3.755 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -2.004 -17.728 -4.447 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -2.346 -16.650 -2.574 1.00 0.00 N ATOM 0 H GLN A 124 -0.168 -14.830 -8.270 1.00 0.00 H new ATOM 0 HA GLN A 124 -2.264 -16.103 -6.593 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.056 -16.667 -5.830 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.441 -14.958 -5.788 1.00 0.00 H new ATOM 0 HG2 GLN A 124 0.033 -15.602 -3.546 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.358 -14.659 -4.044 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -2.166 -15.839 -1.982 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -2.972 -17.388 -2.251 1.00 0.00 H new ATOM 1178 N PRO A 125 -3.179 -13.795 -5.978 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.789 -12.478 -5.808 1.00 0.00 C ATOM 1180 C PRO A 125 -2.938 -11.479 -5.007 1.00 0.00 C ATOM 1181 O PRO A 125 -1.995 -11.853 -4.307 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.130 -12.728 -5.099 1.00 0.00 C ATOM 1183 CG PRO A 125 -5.457 -14.180 -5.429 1.00 0.00 C ATOM 1184 CD PRO A 125 -4.077 -14.827 -5.489 1.00 0.00 C ATOM 0 HA PRO A 125 -3.900 -12.010 -6.786 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.048 -12.572 -4.023 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.905 -12.052 -5.461 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -6.086 -14.637 -4.665 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.989 -14.271 -6.376 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.768 -15.181 -4.506 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -4.079 -15.691 -6.153 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.319 -10.199 -5.069 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.684 -9.074 -4.356 1.00 0.00 C ATOM 1194 C ILE A 126 -3.756 -8.158 -3.765 1.00 0.00 C ATOM 1195 O ILE A 126 -4.899 -8.115 -4.223 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.705 -8.246 -5.219 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.189 -9.042 -6.428 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.530 -7.771 -4.334 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.139 -8.289 -7.226 1.00 0.00 C ATOM 0 H ILE A 126 -4.110 -9.901 -5.639 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.083 -9.523 -3.566 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.240 -7.383 -5.617 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -0.768 -9.986 -6.082 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.027 -9.287 -7.080 1.00 0.00 H new ATOM 0 HG21 ILE A 126 0.165 -7.186 -4.936 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -0.913 -7.155 -3.520 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.013 -8.637 -3.921 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.187 -8.901 -8.067 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -0.564 -7.357 -7.599 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.715 -8.067 -6.586 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.374 -7.458 -2.706 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.281 -6.940 -1.695 1.00 0.00 C ATOM 1213 C TYR A 127 -4.149 -5.412 -1.639 1.00 0.00 C ATOM 1214 O TYR A 127 -3.286 -4.882 -0.937 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.916 -7.599 -0.356 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.224 -9.068 -0.099 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -4.010 -10.097 -1.045 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.614 -9.419 1.207 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -4.267 -11.438 -0.705 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.849 -10.755 1.560 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.699 -11.773 0.596 1.00 0.00 C ATOM 1222 OH TYR A 127 -4.907 -13.077 0.924 1.00 0.00 O ATOM 0 H TYR A 127 -2.397 -7.229 -2.523 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.320 -7.171 -1.928 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.843 -7.468 -0.217 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.411 -7.026 0.428 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.648 -9.853 -2.033 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.734 -8.645 1.951 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -4.133 -12.215 -1.443 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.144 -11.004 2.568 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.201 -13.137 1.857 1.00 0.00 H new ATOM 1232 N ILE A 128 -4.964 -4.696 -2.419 1.00 0.00 N ATOM 1233 CA ILE A 128 -4.967 -3.233 -2.510 1.00 0.00 C ATOM 1234 C ILE A 128 -6.030 -2.600 -1.592 1.00 0.00 C ATOM 1235 O ILE A 128 -7.087 -3.177 -1.331 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.102 -2.816 -4.007 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.749 -2.240 -4.466 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.268 -1.855 -4.308 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.674 -1.841 -5.944 1.00 0.00 C ATOM 0 H ILE A 128 -5.661 -5.132 -3.023 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.019 -2.842 -2.141 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.356 -3.709 -4.577 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.521 -1.364 -3.858 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.972 -2.978 -4.266 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.282 -1.622 -5.373 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.210 -2.327 -4.028 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.139 -0.936 -3.737 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.682 -1.448 -6.165 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.865 -2.715 -6.567 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.422 -1.076 -6.153 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.768 -1.362 -1.166 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.769 -0.350 -0.800 1.00 0.00 C ATOM 1253 C GLN A 129 -6.206 1.032 -1.146 1.00 0.00 C ATOM 1254 O GLN A 129 -4.994 1.208 -1.223 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.057 -0.418 0.713 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.379 0.233 1.155 1.00 0.00 C ATOM 1257 CD GLN A 129 -8.394 0.452 2.664 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -8.803 -0.397 3.448 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -7.904 1.582 3.129 1.00 0.00 N ATOM 0 H GLN A 129 -4.813 -1.020 -1.061 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.695 -0.532 -1.345 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -7.065 -1.464 1.019 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -6.237 0.064 1.245 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -8.510 1.186 0.643 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.217 -0.401 0.866 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -7.562 2.293 2.483 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -7.867 1.746 4.135 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.054 2.050 -1.254 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.604 3.435 -1.108 1.00 0.00 C ATOM 1270 C PHE A 130 -5.846 3.661 0.217 1.00 0.00 C ATOM 1271 O PHE A 130 -6.085 2.972 1.218 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.806 4.384 -1.170 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.108 5.079 -2.477 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.080 5.555 -3.315 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.453 5.345 -2.800 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.406 6.243 -4.493 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.772 6.051 -3.967 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.750 6.504 -4.815 1.00 0.00 C ATOM 0 H PHE A 130 -8.051 1.946 -1.441 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.918 3.642 -1.929 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.692 3.817 -0.884 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.661 5.153 -0.411 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.046 5.391 -3.051 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.241 5.003 -2.145 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.621 6.574 -5.156 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.805 6.247 -4.214 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.995 7.052 -5.713 1.00 0.00 H new ATOM 1288 N SER A 131 -4.949 4.654 0.223 1.00 0.00 N ATOM 1289 CA SER A 131 -4.181 5.035 1.410 1.00 0.00 C ATOM 1290 C SER A 131 -5.055 5.597 2.547 1.00 0.00 C ATOM 1291 O SER A 131 -6.224 5.946 2.354 1.00 0.00 O ATOM 1292 CB SER A 131 -3.081 6.048 1.066 1.00 0.00 C ATOM 1293 OG SER A 131 -3.664 7.309 0.819 1.00 0.00 O ATOM 0 H SER A 131 -4.736 5.217 -0.600 1.00 0.00 H new ATOM 0 HA SER A 131 -3.728 4.111 1.769 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.368 6.120 1.887 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.525 5.714 0.190 1.00 0.00 H new ATOM 0 HG SER A 131 -3.923 7.370 -0.124 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.462 5.776 3.726 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.997 6.573 4.833 1.00 0.00 C ATOM 1301 C ASN A 132 -4.599 8.069 4.746 1.00 0.00 C ATOM 1302 O ASN A 132 -4.837 8.823 5.694 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.516 5.944 6.155 1.00 0.00 C ATOM 1304 CG ASN A 132 -5.019 4.524 6.372 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -6.154 4.173 6.070 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -4.207 3.671 6.953 1.00 0.00 N ATOM 0 H ASN A 132 -3.560 5.354 3.947 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.086 6.558 4.779 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.426 5.941 6.171 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.845 6.568 6.986 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.522 2.721 7.151 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -3.262 3.958 7.206 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.959 8.500 3.651 1.00 0.00 N ATOM 1314 CA HIS A 133 -3.185 9.745 3.551 1.00 0.00 C ATOM 1315 C HIS A 133 -3.517 10.570 2.286 1.00 0.00 C ATOM 1316 O HIS A 133 -4.427 10.240 1.520 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.685 9.391 3.638 1.00 0.00 C ATOM 1318 CG HIS A 133 -1.296 8.586 4.859 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -1.347 9.003 6.174 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.830 7.300 4.860 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.911 7.990 6.945 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.570 6.939 6.185 1.00 0.00 N ATOM 0 H HIS A 133 -3.966 7.972 2.778 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.461 10.395 4.381 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -1.405 8.831 2.746 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.106 10.315 3.629 1.00 0.00 H new ATOM 0 HD1 HIS A 133 -1.660 9.917 6.503 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.688 6.674 3.991 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.845 8.019 8.023 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.789 11.680 2.085 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.949 12.647 0.984 1.00 0.00 C ATOM 1332 C LYS A 134 -1.587 13.128 0.467 1.00 0.00 C ATOM 1333 O LYS A 134 -0.952 13.972 1.100 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.863 13.793 1.466 1.00 0.00 C ATOM 1335 CG LYS A 134 -4.151 14.849 0.384 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.465 15.591 0.692 1.00 0.00 C ATOM 1337 CE LYS A 134 -5.909 16.575 -0.402 1.00 0.00 C ATOM 1338 NZ LYS A 134 -6.297 15.891 -1.666 1.00 0.00 N ATOM 0 H LYS A 134 -2.033 11.942 2.718 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.428 12.172 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -4.807 13.372 1.812 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.399 14.281 2.323 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -3.327 15.561 0.334 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -4.217 14.369 -0.592 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.256 14.856 0.846 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.350 16.136 1.629 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.752 17.161 -0.037 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -5.099 17.275 -0.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.023 16.452 -2.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -5.462 15.795 -2.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -6.677 14.948 -1.448 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.149 12.573 -0.666 1.00 0.00 N ATOM 1353 CA GLU A 135 0.161 12.774 -1.316 1.00 0.00 C ATOM 1354 C GLU A 135 1.370 12.264 -0.499 1.00 0.00 C ATOM 1355 O GLU A 135 1.794 12.856 0.497 1.00 0.00 O ATOM 1356 CB GLU A 135 0.367 14.214 -1.812 1.00 0.00 C ATOM 1357 CG GLU A 135 1.611 14.322 -2.712 1.00 0.00 C ATOM 1358 CD GLU A 135 1.775 15.737 -3.291 1.00 0.00 C ATOM 1359 OE1 GLU A 135 1.158 16.034 -4.342 1.00 0.00 O ATOM 1360 OE2 GLU A 135 2.547 16.542 -2.720 1.00 0.00 O ATOM 0 H GLU A 135 -1.735 11.927 -1.194 1.00 0.00 H new ATOM 0 HA GLU A 135 0.122 12.132 -2.196 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -0.514 14.540 -2.365 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.474 14.883 -0.958 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.499 14.059 -2.138 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.534 13.602 -3.527 1.00 0.00 H new ATOM 1367 N LEU A 136 1.960 11.165 -0.966 1.00 0.00 N ATOM 1368 CA LEU A 136 3.238 10.603 -0.507 1.00 0.00 C ATOM 1369 C LEU A 136 4.420 11.557 -0.782 1.00 0.00 C ATOM 1370 O LEU A 136 4.683 11.930 -1.927 1.00 0.00 O ATOM 1371 CB LEU A 136 3.418 9.241 -1.204 1.00 0.00 C ATOM 1372 CG LEU A 136 4.825 8.616 -1.213 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.325 8.299 0.186 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.833 7.304 -1.993 1.00 0.00 C ATOM 0 H LEU A 136 1.542 10.611 -1.713 1.00 0.00 H new ATOM 0 HA LEU A 136 3.223 10.470 0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.740 8.531 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.094 9.350 -2.239 1.00 0.00 H new ATOM 0 HG LEU A 136 5.474 9.358 -1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.321 7.860 0.126 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.367 9.216 0.774 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.646 7.593 0.664 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.838 6.882 -1.985 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.141 6.601 -1.530 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.526 7.491 -3.022 1.00 0.00 H new ATOM 1386 N LYS A 137 5.173 11.893 0.272 1.00 0.00 N ATOM 1387 CA LYS A 137 6.486 12.561 0.251 1.00 0.00 C ATOM 1388 C LYS A 137 7.615 11.544 0.484 1.00 0.00 C ATOM 1389 O LYS A 137 7.849 11.113 1.617 1.00 0.00 O ATOM 1390 CB LYS A 137 6.531 13.672 1.319 1.00 0.00 C ATOM 1391 CG LYS A 137 5.466 14.774 1.182 1.00 0.00 C ATOM 1392 CD LYS A 137 5.531 15.542 -0.148 1.00 0.00 C ATOM 1393 CE LYS A 137 4.749 16.857 -0.012 1.00 0.00 C ATOM 1394 NZ LYS A 137 4.662 17.591 -1.297 1.00 0.00 N ATOM 0 H LYS A 137 4.865 11.694 1.224 1.00 0.00 H new ATOM 0 HA LYS A 137 6.632 13.012 -0.731 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.426 13.211 2.301 1.00 0.00 H new ATOM 0 HB3 LYS A 137 7.516 14.139 1.290 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.478 14.325 1.283 1.00 0.00 H new ATOM 0 HG3 LYS A 137 5.581 15.480 2.004 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.568 15.748 -0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 137 5.111 14.937 -0.952 1.00 0.00 H new ATOM 0 HE2 LYS A 137 3.744 16.644 0.352 1.00 0.00 H new ATOM 0 HE3 LYS A 137 5.231 17.489 0.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 4.294 18.549 -1.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 5.608 17.655 -1.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 4.023 17.085 -1.943 1.00 0.00 H new ATOM 1408 N THR A 138 8.318 11.142 -0.574 1.00 0.00 N ATOM 1409 CA THR A 138 9.518 10.270 -0.546 1.00 0.00 C ATOM 1410 C THR A 138 10.780 11.045 -0.105 1.00 0.00 C ATOM 1411 O THR A 138 11.762 11.175 -0.839 1.00 0.00 O ATOM 1412 CB THR A 138 9.721 9.600 -1.923 1.00 0.00 C ATOM 1413 OG1 THR A 138 9.566 10.546 -2.963 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.684 8.501 -2.166 1.00 0.00 C ATOM 0 H THR A 138 8.065 11.421 -1.522 1.00 0.00 H new ATOM 0 HA THR A 138 9.352 9.490 0.197 1.00 0.00 H new ATOM 0 HB THR A 138 10.726 9.179 -1.920 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.432 10.078 -3.814 1.00 0.00 H new ATOM 0 HG21 THR A 138 8.854 8.050 -3.143 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.775 7.738 -1.393 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.683 8.932 -2.135 1.00 0.00 H new ATOM 1422 N ASP A 139 10.754 11.593 1.112 1.00 0.00 N ATOM 1423 CA ASP A 139 11.734 12.561 1.635 1.00 0.00 C ATOM 1424 C ASP A 139 13.189 12.044 1.697 1.00 0.00 C ATOM 1425 O ASP A 139 14.119 12.758 1.312 1.00 0.00 O ATOM 1426 CB ASP A 139 11.258 13.023 3.017 1.00 0.00 C ATOM 1427 CG ASP A 139 12.143 14.147 3.587 1.00 0.00 C ATOM 1428 OD1 ASP A 139 12.023 15.303 3.115 1.00 0.00 O ATOM 1429 OD2 ASP A 139 12.943 13.887 4.520 1.00 0.00 O ATOM 0 H ASP A 139 10.025 11.370 1.789 1.00 0.00 H new ATOM 0 HA ASP A 139 11.775 13.391 0.930 1.00 0.00 H new ATOM 0 HB2 ASP A 139 10.228 13.373 2.947 1.00 0.00 H new ATOM 0 HB3 ASP A 139 11.261 12.176 3.703 1.00 0.00 H new ATOM 1434 N SER A 140 13.403 10.813 2.186 1.00 0.00 N ATOM 1435 CA SER A 140 14.724 10.214 2.418 1.00 0.00 C ATOM 1436 C SER A 140 15.276 9.470 1.190 1.00 0.00 C ATOM 1437 O SER A 140 15.101 8.255 1.053 1.00 0.00 O ATOM 1438 CB SER A 140 14.690 9.284 3.642 1.00 0.00 C ATOM 1439 OG SER A 140 14.448 10.021 4.832 1.00 0.00 O ATOM 0 H SER A 140 12.637 10.189 2.438 1.00 0.00 H new ATOM 0 HA SER A 140 15.407 11.041 2.613 1.00 0.00 H new ATOM 0 HB2 SER A 140 13.912 8.532 3.511 1.00 0.00 H new ATOM 0 HB3 SER A 140 15.637 8.751 3.726 1.00 0.00 H new ATOM 0 HG SER A 140 14.429 9.409 5.597 1.00 0.00 H new ATOM 1445 N SER A 141 15.970 10.181 0.295 1.00 0.00 N ATOM 1446 CA SER A 141 16.688 9.599 -0.855 1.00 0.00 C ATOM 1447 C SER A 141 17.871 8.706 -0.416 1.00 0.00 C ATOM 1448 O SER A 141 18.638 9.127 0.462 1.00 0.00 O ATOM 1449 CB SER A 141 17.234 10.707 -1.763 1.00 0.00 C ATOM 1450 OG SER A 141 16.189 11.537 -2.249 1.00 0.00 O ATOM 0 H SER A 141 16.053 11.196 0.346 1.00 0.00 H new ATOM 0 HA SER A 141 15.965 8.985 -1.392 1.00 0.00 H new ATOM 0 HB2 SER A 141 17.954 11.311 -1.211 1.00 0.00 H new ATOM 0 HB3 SER A 141 17.768 10.262 -2.602 1.00 0.00 H new ATOM 0 HG SER A 141 16.566 12.235 -2.824 1.00 0.00 H new ATOM 1456 N PRO A 142 18.074 7.510 -1.016 1.00 0.00 N ATOM 1457 CA PRO A 142 19.209 6.623 -0.720 1.00 0.00 C ATOM 1458 C PRO A 142 20.587 7.300 -0.791 1.00 0.00 C ATOM 1459 O PRO A 142 20.868 8.076 -1.707 1.00 0.00 O ATOM 1460 CB PRO A 142 19.121 5.483 -1.745 1.00 0.00 C ATOM 1461 CG PRO A 142 17.632 5.414 -2.071 1.00 0.00 C ATOM 1462 CD PRO A 142 17.201 6.878 -2.000 1.00 0.00 C ATOM 0 HA PRO A 142 19.133 6.283 0.313 1.00 0.00 H new ATOM 0 HB2 PRO A 142 19.717 5.694 -2.633 1.00 0.00 H new ATOM 0 HB3 PRO A 142 19.486 4.543 -1.332 1.00 0.00 H new ATOM 0 HG2 PRO A 142 17.454 4.987 -3.058 1.00 0.00 H new ATOM 0 HG3 PRO A 142 17.089 4.798 -1.354 1.00 0.00 H new ATOM 0 HD2 PRO A 142 17.297 7.360 -2.973 1.00 0.00 H new ATOM 0 HD3 PRO A 142 16.155 6.962 -1.704 1.00 0.00 H new ATOM 1470 N ASN A 143 21.472 6.976 0.156 1.00 0.00 N ATOM 1471 CA ASN A 143 22.860 7.445 0.211 1.00 0.00 C ATOM 1472 C ASN A 143 23.717 6.759 -0.878 1.00 0.00 C ATOM 1473 O ASN A 143 24.343 5.723 -0.627 1.00 0.00 O ATOM 1474 CB ASN A 143 23.383 7.219 1.644 1.00 0.00 C ATOM 1475 CG ASN A 143 24.742 7.858 1.867 1.00 0.00 C ATOM 1476 OD1 ASN A 143 24.851 9.026 2.217 1.00 0.00 O ATOM 1477 ND2 ASN A 143 25.816 7.129 1.672 1.00 0.00 N ATOM 0 H ASN A 143 21.234 6.359 0.932 1.00 0.00 H new ATOM 0 HA ASN A 143 22.922 8.511 -0.009 1.00 0.00 H new ATOM 0 HB2 ASN A 143 22.669 7.629 2.358 1.00 0.00 H new ATOM 0 HB3 ASN A 143 23.450 6.149 1.840 1.00 0.00 H new ATOM 0 HD21 ASN A 143 26.741 7.536 1.812 1.00 0.00 H new ATOM 0 HD22 ASN A 143 25.726 6.156 1.380 1.00 0.00 H new ATOM 1484 N GLN A 144 23.704 7.308 -2.100 1.00 0.00 N ATOM 1485 CA GLN A 144 24.158 6.627 -3.322 1.00 0.00 C ATOM 1486 C GLN A 144 25.262 7.395 -4.080 1.00 0.00 C ATOM 1487 O GLN A 144 26.437 7.043 -3.967 1.00 0.00 O ATOM 1488 CB GLN A 144 22.919 6.305 -4.180 1.00 0.00 C ATOM 1489 CG GLN A 144 23.232 5.426 -5.400 1.00 0.00 C ATOM 1490 CD GLN A 144 21.967 5.109 -6.196 1.00 0.00 C ATOM 1491 OE1 GLN A 144 21.133 4.301 -5.805 1.00 0.00 O ATOM 1492 NE2 GLN A 144 21.768 5.723 -7.343 1.00 0.00 N ATOM 0 H GLN A 144 23.371 8.257 -2.271 1.00 0.00 H new ATOM 0 HA GLN A 144 24.652 5.693 -3.053 1.00 0.00 H new ATOM 0 HB2 GLN A 144 22.178 5.801 -3.559 1.00 0.00 H new ATOM 0 HB3 GLN A 144 22.469 7.238 -4.520 1.00 0.00 H new ATOM 0 HG2 GLN A 144 23.950 5.935 -6.043 1.00 0.00 H new ATOM 0 HG3 GLN A 144 23.700 4.498 -5.072 1.00 0.00 H new ATOM 0 HE21 GLN A 144 22.451 6.399 -7.685 1.00 0.00 H new ATOM 0 HE22 GLN A 144 20.931 5.523 -7.890 1.00 0.00 H new ATOM 1501 N ALA A 145 24.903 8.406 -4.884 1.00 0.00 N ATOM 1502 CA ALA A 145 25.787 9.015 -5.888 1.00 0.00 C ATOM 1503 C ALA A 145 26.874 9.937 -5.289 1.00 0.00 C ATOM 1504 O ALA A 145 28.063 9.600 -5.317 1.00 0.00 O ATOM 1505 CB ALA A 145 24.914 9.735 -6.925 1.00 0.00 C ATOM 0 H ALA A 145 23.976 8.830 -4.854 1.00 0.00 H new ATOM 0 HA ALA A 145 26.357 8.221 -6.370 1.00 0.00 H new ATOM 0 HB1 ALA A 145 25.551 10.195 -7.681 1.00 0.00 H new ATOM 0 HB2 ALA A 145 24.247 9.016 -7.401 1.00 0.00 H new ATOM 0 HB3 ALA A 145 24.323 10.506 -6.431 1.00 0.00 H new ATOM 1511 N ARG A 146 26.474 11.110 -4.773 1.00 0.00 N ATOM 1512 CA ARG A 146 27.360 12.194 -4.287 1.00 0.00 C ATOM 1513 C ARG A 146 27.106 12.587 -2.815 1.00 0.00 C ATOM 1514 O ARG A 146 27.870 13.368 -2.243 1.00 0.00 O ATOM 1515 CB ARG A 146 27.231 13.375 -5.272 1.00 0.00 C ATOM 1516 CG ARG A 146 28.369 14.408 -5.179 1.00 0.00 C ATOM 1517 CD ARG A 146 28.269 15.488 -6.268 1.00 0.00 C ATOM 1518 NE ARG A 146 28.510 14.953 -7.627 1.00 0.00 N ATOM 1519 CZ ARG A 146 29.671 14.767 -8.230 1.00 0.00 C ATOM 1520 NH1 ARG A 146 30.808 15.038 -7.653 1.00 0.00 N ATOM 1521 NH2 ARG A 146 29.717 14.293 -9.443 1.00 0.00 N ATOM 1522 OXT ARG A 146 26.139 12.116 -2.221 1.00 0.00 O ATOM 0 H ARG A 146 25.486 11.344 -4.677 1.00 0.00 H new ATOM 0 HA ARG A 146 28.392 11.842 -4.271 1.00 0.00 H new ATOM 0 HB2 ARG A 146 27.195 12.982 -6.288 1.00 0.00 H new ATOM 0 HB3 ARG A 146 26.282 13.880 -5.092 1.00 0.00 H new ATOM 0 HG2 ARG A 146 28.347 14.882 -4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 146 29.328 13.897 -5.265 1.00 0.00 H new ATOM 0 HD2 ARG A 146 27.280 15.944 -6.232 1.00 0.00 H new ATOM 0 HD3 ARG A 146 28.992 16.277 -6.059 1.00 0.00 H new ATOM 0 HE ARG A 146 27.680 14.697 -8.162 1.00 0.00 H new ATOM 0 HH11 ARG A 146 30.822 15.408 -6.702 1.00 0.00 H new ATOM 0 HH12 ARG A 146 31.683 14.880 -8.152 1.00 0.00 H new ATOM 0 HH21 ARG A 146 28.853 14.063 -9.934 1.00 0.00 H new ATOM 0 HH22 ARG A 146 30.617 14.152 -9.902 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -5.578 -8.725 4.491 1.00 0.00 O ATOM 1538 C5' C B 147 -5.407 -7.886 5.625 1.00 0.00 C ATOM 1539 C4' C B 147 -4.497 -8.500 6.693 1.00 0.00 C ATOM 1540 O4' C B 147 -5.168 -9.559 7.362 1.00 0.00 O ATOM 1541 C3' C B 147 -3.166 -9.032 6.133 1.00 0.00 C ATOM 1542 O3' C B 147 -2.120 -8.585 6.979 1.00 0.00 O ATOM 1543 C2' C B 147 -3.361 -10.547 6.243 1.00 0.00 C ATOM 1544 O2' C B 147 -2.148 -11.270 6.402 1.00 0.00 O ATOM 1545 C1' C B 147 -4.280 -10.657 7.462 1.00 0.00 C ATOM 1546 N1 C B 147 -5.063 -11.922 7.498 1.00 0.00 N ATOM 1547 C2 C B 147 -5.030 -12.722 8.649 1.00 0.00 C ATOM 1548 O2 C B 147 -4.349 -12.421 9.634 1.00 0.00 O ATOM 1549 N3 C B 147 -5.767 -13.863 8.714 1.00 0.00 N ATOM 1550 C4 C B 147 -6.505 -14.199 7.675 1.00 0.00 C ATOM 1551 N4 C B 147 -7.189 -15.300 7.800 1.00 0.00 N ATOM 1552 C5 C B 147 -6.580 -13.429 6.481 1.00 0.00 C ATOM 1553 C6 C B 147 -5.843 -12.290 6.428 1.00 0.00 C ATOM 0 H5' C B 147 -6.382 -7.675 6.064 1.00 0.00 H new ATOM 0 H5'' C B 147 -4.989 -6.932 5.304 1.00 0.00 H new ATOM 0 H4' C B 147 -4.261 -7.691 7.385 1.00 0.00 H new ATOM 0 H3' C B 147 -2.917 -8.711 5.122 1.00 0.00 H new ATOM 0 H2' C B 147 -3.773 -10.990 5.336 1.00 0.00 H new ATOM 0 HO2' C B 147 -1.436 -10.657 6.680 1.00 0.00 H new ATOM 0 HO5' C B 147 -5.543 -9.664 4.770 1.00 0.00 H new ATOM 0 H1' C B 147 -3.682 -10.654 8.373 1.00 0.00 H new ATOM 0 H41 C B 147 -7.782 -15.621 7.035 1.00 0.00 H new ATOM 0 H42 C B 147 -7.131 -15.841 8.663 1.00 0.00 H new ATOM 0 H5 C B 147 -7.198 -13.738 5.651 1.00 0.00 H new ATOM 0 H6 C B 147 -5.870 -11.672 5.543 1.00 0.00 H new ATOM 1566 P U B 148 -0.850 -7.805 6.390 1.00 0.00 P ATOM 1567 OP1 U B 148 -0.402 -8.502 5.165 1.00 0.00 O ATOM 1568 OP2 U B 148 0.102 -7.639 7.512 1.00 0.00 O ATOM 1569 O5' U B 148 -1.433 -6.366 5.961 1.00 0.00 O ATOM 1570 C5' U B 148 -1.943 -5.460 6.928 1.00 0.00 C ATOM 1571 C4' U B 148 -1.938 -4.009 6.431 1.00 0.00 C ATOM 1572 O4' U B 148 -2.976 -3.762 5.494 1.00 0.00 O ATOM 1573 C3' U B 148 -2.167 -3.066 7.619 1.00 0.00 C ATOM 1574 O3' U B 148 -1.427 -1.865 7.427 1.00 0.00 O ATOM 1575 C2' U B 148 -3.677 -2.845 7.575 1.00 0.00 C ATOM 1576 O2' U B 148 -4.106 -1.638 8.196 1.00 0.00 O ATOM 1577 C1' U B 148 -3.896 -2.852 6.064 1.00 0.00 C ATOM 1578 N1 U B 148 -5.283 -3.201 5.679 1.00 0.00 N ATOM 1579 C2 U B 148 -6.036 -2.287 4.934 1.00 0.00 C ATOM 1580 O2 U B 148 -5.567 -1.270 4.421 1.00 0.00 O ATOM 1581 N3 U B 148 -7.367 -2.595 4.735 1.00 0.00 N ATOM 1582 C4 U B 148 -7.987 -3.759 5.130 1.00 0.00 C ATOM 1583 O4 U B 148 -9.174 -3.940 4.873 1.00 0.00 O ATOM 1584 C5 U B 148 -7.121 -4.697 5.818 1.00 0.00 C ATOM 1585 C6 U B 148 -5.816 -4.405 6.071 1.00 0.00 C ATOM 0 H5' U B 148 -1.347 -5.531 7.838 1.00 0.00 H new ATOM 0 H5'' U B 148 -2.961 -5.748 7.190 1.00 0.00 H new ATOM 0 H4' U B 148 -0.974 -3.837 5.952 1.00 0.00 H new ATOM 0 H3' U B 148 -1.838 -3.450 8.584 1.00 0.00 H new ATOM 0 H2' U B 148 -4.253 -3.585 8.131 1.00 0.00 H new ATOM 0 HO2' U B 148 -3.396 -1.301 8.782 1.00 0.00 H new ATOM 0 H1' U B 148 -3.732 -1.843 5.687 1.00 0.00 H new ATOM 0 H3 U B 148 -7.940 -1.901 4.254 1.00 0.00 H new ATOM 0 H5 U B 148 -7.521 -5.648 6.137 1.00 0.00 H new ATOM 0 H6 U B 148 -5.195 -5.125 6.584 1.00 0.00 H new ATOM 1596 P C B 149 -0.623 -1.233 8.651 1.00 0.00 P ATOM 1597 OP1 C B 149 0.629 -2.010 8.782 1.00 0.00 O ATOM 1598 OP2 C B 149 -1.554 -1.143 9.802 1.00 0.00 O ATOM 1599 O5' C B 149 -0.259 0.261 8.188 1.00 0.00 O ATOM 1600 C5' C B 149 1.076 0.627 7.867 1.00 0.00 C ATOM 1601 C4' C B 149 1.218 2.076 7.377 1.00 0.00 C ATOM 1602 O4' C B 149 0.783 2.185 6.027 1.00 0.00 O ATOM 1603 C3' C B 149 0.435 3.098 8.224 1.00 0.00 C ATOM 1604 O3' C B 149 1.115 4.335 8.364 1.00 0.00 O ATOM 1605 C2' C B 149 -0.820 3.307 7.379 1.00 0.00 C ATOM 1606 O2' C B 149 -1.497 4.542 7.585 1.00 0.00 O ATOM 1607 C1' C B 149 -0.310 3.093 5.955 1.00 0.00 C ATOM 1608 N1 C B 149 -1.424 2.527 5.159 1.00 0.00 N ATOM 1609 C2 C B 149 -2.163 3.351 4.306 1.00 0.00 C ATOM 1610 O2 C B 149 -1.855 4.519 4.087 1.00 0.00 O ATOM 1611 N3 C B 149 -3.270 2.878 3.691 1.00 0.00 N ATOM 1612 C4 C B 149 -3.612 1.626 3.869 1.00 0.00 C ATOM 1613 N4 C B 149 -4.674 1.223 3.237 1.00 0.00 N ATOM 1614 C5 C B 149 -2.872 0.737 4.681 1.00 0.00 C ATOM 1615 C6 C B 149 -1.802 1.226 5.341 1.00 0.00 C ATOM 0 H5' C B 149 1.453 -0.046 7.097 1.00 0.00 H new ATOM 0 H5'' C B 149 1.703 0.487 8.747 1.00 0.00 H new ATOM 0 H4' C B 149 2.278 2.314 7.471 1.00 0.00 H new ATOM 0 H3' C B 149 0.267 2.747 9.242 1.00 0.00 H new ATOM 0 H2' C B 149 -1.616 2.615 7.653 1.00 0.00 H new ATOM 0 HO2' C B 149 -1.078 5.240 7.039 1.00 0.00 H new ATOM 0 H1' C B 149 0.024 4.019 5.486 1.00 0.00 H new ATOM 0 H41 C B 149 -4.991 0.258 3.335 1.00 0.00 H new ATOM 0 H42 C B 149 -5.190 1.871 2.643 1.00 0.00 H new ATOM 0 H5 C B 149 -3.154 -0.302 4.770 1.00 0.00 H new ATOM 0 H6 C B 149 -1.244 0.590 6.013 1.00 0.00 H new ATOM 1627 P U B 150 2.357 4.502 9.357 1.00 0.00 P ATOM 1628 OP1 U B 150 2.263 3.481 10.429 1.00 0.00 O ATOM 1629 OP2 U B 150 2.434 5.934 9.731 1.00 0.00 O ATOM 1630 O5' U B 150 3.621 4.135 8.436 1.00 0.00 O ATOM 1631 C5' U B 150 3.800 4.750 7.174 1.00 0.00 C ATOM 1632 C4' U B 150 5.287 4.793 6.804 1.00 0.00 C ATOM 1633 O4' U B 150 5.412 5.075 5.417 1.00 0.00 O ATOM 1634 C3' U B 150 6.012 5.923 7.548 1.00 0.00 C ATOM 1635 O3' U B 150 6.581 5.588 8.809 1.00 0.00 O ATOM 1636 C2' U B 150 7.066 6.358 6.526 1.00 0.00 C ATOM 1637 O2' U B 150 8.295 5.644 6.636 1.00 0.00 O ATOM 1638 C1' U B 150 6.441 6.034 5.179 1.00 0.00 C ATOM 1639 N1 U B 150 5.936 7.291 4.551 1.00 0.00 N ATOM 1640 C2 U B 150 6.846 8.170 3.943 1.00 0.00 C ATOM 1641 O2 U B 150 8.058 7.955 3.878 1.00 0.00 O ATOM 1642 N3 U B 150 6.328 9.325 3.391 1.00 0.00 N ATOM 1643 C4 U B 150 4.994 9.653 3.328 1.00 0.00 C ATOM 1644 O4 U B 150 4.638 10.701 2.804 1.00 0.00 O ATOM 1645 C5 U B 150 4.108 8.672 3.910 1.00 0.00 C ATOM 1646 C6 U B 150 4.593 7.563 4.522 1.00 0.00 C ATOM 0 H5' U B 150 3.395 5.762 7.195 1.00 0.00 H new ATOM 0 H5'' U B 150 3.246 4.201 6.413 1.00 0.00 H new ATOM 0 H4' U B 150 5.722 3.830 7.070 1.00 0.00 H new ATOM 0 H3' U B 150 5.313 6.703 7.850 1.00 0.00 H new ATOM 0 H2' U B 150 7.316 7.408 6.675 1.00 0.00 H new ATOM 0 HO2' U B 150 8.392 5.299 7.548 1.00 0.00 H new ATOM 0 H1' U B 150 7.160 5.610 4.478 1.00 0.00 H new ATOM 0 H3 U B 150 6.991 9.992 2.996 1.00 0.00 H new ATOM 0 H5 U B 150 3.040 8.824 3.857 1.00 0.00 H new ATOM 0 H6 U B 150 3.905 6.879 4.997 1.00 0.00 H new ATOM 1657 P C B 151 6.969 6.756 9.847 1.00 0.00 P ATOM 1658 OP1 C B 151 5.714 7.279 10.432 1.00 0.00 O ATOM 1659 OP2 C B 151 7.875 7.711 9.164 1.00 0.00 O ATOM 1660 O5' C B 151 7.779 6.029 11.030 1.00 0.00 O ATOM 1661 C5' C B 151 9.168 5.730 10.936 1.00 0.00 C ATOM 1662 C4' C B 151 9.844 5.661 12.319 1.00 0.00 C ATOM 1663 O4' C B 151 9.699 6.916 12.984 1.00 0.00 O ATOM 1664 C3' C B 151 9.293 4.574 13.264 1.00 0.00 C ATOM 1665 O3' C B 151 10.265 4.164 14.219 1.00 0.00 O ATOM 1666 C2' C B 151 8.202 5.369 13.992 1.00 0.00 C ATOM 1667 O2' C B 151 7.819 4.798 15.235 1.00 0.00 O ATOM 1668 C1' C B 151 8.901 6.728 14.146 1.00 0.00 C ATOM 1669 N1 C B 151 8.020 7.912 14.377 1.00 0.00 N ATOM 1670 C2 C B 151 8.515 8.952 15.184 1.00 0.00 C ATOM 1671 O2 C B 151 9.649 8.919 15.666 1.00 0.00 O ATOM 1672 N3 C B 151 7.748 10.034 15.474 1.00 0.00 N ATOM 1673 C4 C B 151 6.530 10.091 14.977 1.00 0.00 C ATOM 1674 N4 C B 151 5.839 11.155 15.290 1.00 0.00 N ATOM 1675 C5 C B 151 5.974 9.090 14.140 1.00 0.00 C ATOM 1676 C6 C B 151 6.751 8.015 13.851 1.00 0.00 C ATOM 0 H5' C B 151 9.661 6.490 10.330 1.00 0.00 H new ATOM 0 H5'' C B 151 9.299 4.778 10.422 1.00 0.00 H new ATOM 0 H4' C B 151 10.883 5.407 12.109 1.00 0.00 H new ATOM 0 H3' C B 151 8.974 3.668 12.748 1.00 0.00 H new ATOM 0 H2' C B 151 7.251 5.407 13.461 1.00 0.00 H new ATOM 0 HO2' C B 151 8.568 4.285 15.604 1.00 0.00 H new ATOM 0 H1' C B 151 9.484 6.680 15.066 1.00 0.00 H new ATOM 0 H41 C B 151 4.887 11.266 14.940 1.00 0.00 H new ATOM 0 H42 C B 151 6.251 11.874 15.884 1.00 0.00 H new ATOM 0 H5 C B 151 4.972 9.180 13.748 1.00 0.00 H new ATOM 0 H6 C B 151 6.372 7.236 13.205 1.00 0.00 H new ATOM 1688 P U B 152 11.404 3.089 13.884 1.00 0.00 P ATOM 1689 OP1 U B 152 12.117 3.470 12.645 1.00 0.00 O ATOM 1690 OP2 U B 152 10.814 1.735 13.995 1.00 0.00 O ATOM 1691 O5' U B 152 12.385 3.313 15.134 1.00 0.00 O ATOM 1692 C5' U B 152 13.038 4.559 15.332 1.00 0.00 C ATOM 1693 C4' U B 152 13.587 4.716 16.759 1.00 0.00 C ATOM 1694 O4' U B 152 12.508 4.800 17.694 1.00 0.00 O ATOM 1695 C3' U B 152 14.505 3.563 17.201 1.00 0.00 C ATOM 1696 O3' U B 152 15.524 4.052 18.079 1.00 0.00 O ATOM 1697 C2' U B 152 13.517 2.663 17.958 1.00 0.00 C ATOM 1698 O2' U B 152 14.160 1.800 18.889 1.00 0.00 O ATOM 1699 C1' U B 152 12.610 3.715 18.612 1.00 0.00 C ATOM 1700 N1 U B 152 11.271 3.155 18.954 1.00 0.00 N ATOM 1701 C2 U B 152 10.956 2.951 20.302 1.00 0.00 C ATOM 1702 O2 U B 152 11.691 3.280 21.235 1.00 0.00 O ATOM 1703 N3 U B 152 9.746 2.349 20.581 1.00 0.00 N ATOM 1704 C4 U B 152 8.821 1.937 19.650 1.00 0.00 C ATOM 1705 O4 U B 152 7.774 1.407 20.016 1.00 0.00 O ATOM 1706 C5 U B 152 9.204 2.188 18.278 1.00 0.00 C ATOM 1707 C6 U B 152 10.390 2.773 17.965 1.00 0.00 C ATOM 0 H5' U B 152 12.339 5.369 15.124 1.00 0.00 H new ATOM 0 H5'' U B 152 13.857 4.654 14.619 1.00 0.00 H new ATOM 0 H4' U B 152 14.181 5.630 16.744 1.00 0.00 H new ATOM 0 H3' U B 152 15.029 3.061 16.388 1.00 0.00 H new ATOM 0 H2' U B 152 12.978 1.953 17.331 1.00 0.00 H new ATOM 0 HO2' U B 152 13.488 1.251 19.344 1.00 0.00 H new ATOM 0 HO3' U B 152 15.631 3.434 18.832 1.00 0.00 H new ATOM 0 H1' U B 152 13.036 4.051 19.557 1.00 0.00 H new ATOM 0 H3 U B 152 9.518 2.196 21.563 1.00 0.00 H new ATOM 0 H5 U B 152 8.531 1.904 17.483 1.00 0.00 H new ATOM 0 H6 U B 152 10.645 2.941 16.929 1.00 0.00 H new TER 1719 U B 152