USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1096 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 42 ASN : amide:sc= -8.89! C(o=-13!,f=-24!) USER MOD Set 1.2: A 74 GLN : amide:sc= -4.39! C(o=-13!,f=-24!) USER MOD Set 2.1: A 21 GLN : amide:sc= -2.56 K(o=-2.6,f=-5.8!) USER MOD Set 2.2: A 52 SER OG : rot -65:sc= -0.0702 USER MOD Set 3.1: A 51 ASN : amide:sc= 0.42 K(o=0.6,f=-3.8!) USER MOD Set 3.2: A 59 LYS NZ :NH3+ 174:sc= 0.182 (180deg=0.0188) USER MOD Set 4.1: A 47 SER OG : rot 65:sc= -0.157 USER MOD Set 4.2: A 77 GLN : amide:sc= -0.0159 X(o=-0.17,f=-0.39) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0232 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot -110:sc= -0.84 USER MOD Single : A 37 GLN : amide:sc= -2.91! C(o=-2.9!,f=-4.6!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 0:sc= -0.952 USER MOD Single : A 58 SER OG : rot -170:sc= -1.1 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -1.39 K(o=-1.4,f=-4.8!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -144:sc= -2.37 (180deg=-7.22!) USER MOD Single : A 80 GLN :FLIP amide:sc= -0.418 F(o=-1.1,f=-0.42) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 30:sc= -1.51 USER MOD Single : A 92 LYS NZ :NH3+ 159:sc= 0.118 (180deg=0.028) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 MET CE :methyl 156:sc= -3.32 (180deg=-4.69!) USER MOD Single : A 97 GLN : amide:sc= -0.28 K(o=-0.28,f=-2.6!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0287 USER MOD Single : A 102 TYR OH : rot 0:sc= -2.14 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 MET CE :methyl -177:sc= -3.28 (180deg=-3.36!) USER MOD Single : A 111 GLN : amide:sc= -0.0127 K(o=-0.013,f=-1.2) USER MOD Single : A 113 THR OG1 : rot 24:sc= -1.08 USER MOD Single : A 115 MET CE :methyl -133:sc= -3.17! (180deg=-5.35!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 77:sc= 0.214 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.508 K(o=-0.51,f=-2.6!) USER MOD Single : A 128 ASN :FLIP amide:sc= -1.93 F(o=-3.6!,f=-1.9) USER MOD Single : A 129 TYR OH : rot 74:sc= 0.205 USER MOD Single : A 134 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.261 -17.046 12.885 1.00 0.00 N ATOM 2 CA GLY A 1 -5.654 -17.154 11.570 1.00 0.00 C ATOM 3 C GLY A 1 -4.257 -16.532 11.558 1.00 0.00 C ATOM 4 O GLY A 1 -4.103 -15.346 11.267 1.00 0.00 O ATOM 0 H1 GLY A 1 -7.208 -17.475 12.867 1.00 0.00 H new ATOM 0 H2 GLY A 1 -5.670 -17.542 13.582 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.341 -16.043 13.149 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -5.591 -18.203 11.280 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.284 -16.656 10.833 1.00 0.00 H new ATOM 8 N SER A 2 -3.273 -17.360 11.877 1.00 0.00 N ATOM 9 CA SER A 2 -1.893 -16.906 11.907 1.00 0.00 C ATOM 10 C SER A 2 -1.726 -15.805 12.957 1.00 0.00 C ATOM 11 O SER A 2 -2.700 -15.163 13.348 1.00 0.00 O ATOM 12 CB SER A 2 -1.450 -16.399 10.533 1.00 0.00 C ATOM 13 OG SER A 2 -0.089 -15.974 10.534 1.00 0.00 O ATOM 0 H SER A 2 -3.404 -18.343 12.117 1.00 0.00 H new ATOM 0 HA SER A 2 -1.261 -17.753 12.174 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.582 -17.190 9.795 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.089 -15.570 10.229 1.00 0.00 H new ATOM 0 HG SER A 2 0.156 -15.659 9.639 1.00 0.00 H new ATOM 19 N SER A 3 -0.486 -15.622 13.385 1.00 0.00 N ATOM 20 CA SER A 3 -0.179 -14.610 14.382 1.00 0.00 C ATOM 21 C SER A 3 0.083 -13.266 13.700 1.00 0.00 C ATOM 22 O SER A 3 0.905 -13.177 12.790 1.00 0.00 O ATOM 23 CB SER A 3 1.027 -15.020 15.229 1.00 0.00 C ATOM 24 OG SER A 3 1.097 -14.286 16.449 1.00 0.00 O ATOM 0 H SER A 3 0.319 -16.158 13.060 1.00 0.00 H new ATOM 0 HA SER A 3 -1.038 -14.512 15.046 1.00 0.00 H new ATOM 0 HB2 SER A 3 0.969 -16.086 15.450 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.942 -14.862 14.658 1.00 0.00 H new ATOM 0 HG SER A 3 1.879 -14.578 16.962 1.00 0.00 H new ATOM 30 N GLY A 4 -0.632 -12.253 14.167 1.00 0.00 N ATOM 31 CA GLY A 4 -0.488 -10.917 13.614 1.00 0.00 C ATOM 32 C GLY A 4 0.457 -10.069 14.469 1.00 0.00 C ATOM 33 O GLY A 4 0.034 -9.091 15.083 1.00 0.00 O ATOM 0 H GLY A 4 -1.313 -12.331 14.922 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -0.105 -10.980 12.596 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -1.464 -10.435 13.558 1.00 0.00 H new ATOM 37 N SER A 5 1.718 -10.475 14.480 1.00 0.00 N ATOM 38 CA SER A 5 2.726 -9.765 15.249 1.00 0.00 C ATOM 39 C SER A 5 3.116 -8.471 14.531 1.00 0.00 C ATOM 40 O SER A 5 2.898 -8.335 13.328 1.00 0.00 O ATOM 41 CB SER A 5 3.960 -10.638 15.478 1.00 0.00 C ATOM 42 OG SER A 5 4.381 -10.621 16.840 1.00 0.00 O ATOM 0 H SER A 5 2.065 -11.287 13.969 1.00 0.00 H new ATOM 0 HA SER A 5 2.303 -9.519 16.223 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.739 -11.663 15.179 1.00 0.00 H new ATOM 0 HB3 SER A 5 4.774 -10.289 14.843 1.00 0.00 H new ATOM 0 HG SER A 5 5.171 -11.192 16.945 1.00 0.00 H new ATOM 48 N SER A 6 3.688 -7.555 15.299 1.00 0.00 N ATOM 49 CA SER A 6 4.111 -6.278 14.751 1.00 0.00 C ATOM 50 C SER A 6 5.631 -6.260 14.580 1.00 0.00 C ATOM 51 O SER A 6 6.349 -5.736 15.430 1.00 0.00 O ATOM 52 CB SER A 6 3.664 -5.120 15.646 1.00 0.00 C ATOM 53 OG SER A 6 2.245 -5.051 15.760 1.00 0.00 O ATOM 0 H SER A 6 3.868 -7.672 16.296 1.00 0.00 H new ATOM 0 HA SER A 6 3.640 -6.151 13.776 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.102 -5.238 16.637 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.041 -4.181 15.240 1.00 0.00 H new ATOM 0 HG SER A 6 2.000 -4.300 16.340 1.00 0.00 H new ATOM 59 N GLY A 7 6.077 -6.838 13.474 1.00 0.00 N ATOM 60 CA GLY A 7 7.499 -6.895 13.181 1.00 0.00 C ATOM 61 C GLY A 7 7.764 -7.703 11.909 1.00 0.00 C ATOM 62 O GLY A 7 7.658 -7.178 10.802 1.00 0.00 O ATOM 0 H GLY A 7 5.479 -7.271 12.770 1.00 0.00 H new ATOM 0 HA2 GLY A 7 7.890 -5.885 13.063 1.00 0.00 H new ATOM 0 HA3 GLY A 7 8.029 -7.346 14.020 1.00 0.00 H new ATOM 66 N GLU A 8 8.104 -8.968 12.110 1.00 0.00 N ATOM 67 CA GLU A 8 8.385 -9.854 10.993 1.00 0.00 C ATOM 68 C GLU A 8 9.468 -9.250 10.096 1.00 0.00 C ATOM 69 O GLU A 8 9.869 -8.103 10.287 1.00 0.00 O ATOM 70 CB GLU A 8 7.115 -10.150 10.195 1.00 0.00 C ATOM 71 CG GLU A 8 6.154 -11.029 10.998 1.00 0.00 C ATOM 72 CD GLU A 8 4.842 -10.294 11.279 1.00 0.00 C ATOM 73 OE1 GLU A 8 4.903 -9.287 12.016 1.00 0.00 O ATOM 74 OE2 GLU A 8 3.808 -10.757 10.750 1.00 0.00 O ATOM 0 H GLU A 8 8.191 -9.400 13.030 1.00 0.00 H new ATOM 0 HA GLU A 8 8.754 -10.800 11.389 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.622 -9.215 9.929 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.376 -10.649 9.262 1.00 0.00 H new ATOM 0 HG2 GLU A 8 5.950 -11.947 10.447 1.00 0.00 H new ATOM 0 HG3 GLU A 8 6.621 -11.319 11.939 1.00 0.00 H new ATOM 81 N GLU A 9 9.911 -10.050 9.137 1.00 0.00 N ATOM 82 CA GLU A 9 10.940 -9.609 8.211 1.00 0.00 C ATOM 83 C GLU A 9 10.307 -8.881 7.023 1.00 0.00 C ATOM 84 O GLU A 9 10.646 -7.732 6.743 1.00 0.00 O ATOM 85 CB GLU A 9 11.795 -10.787 7.739 1.00 0.00 C ATOM 86 CG GLU A 9 13.107 -10.860 8.522 1.00 0.00 C ATOM 87 CD GLU A 9 13.240 -12.200 9.247 1.00 0.00 C ATOM 88 OE1 GLU A 9 13.741 -13.147 8.603 1.00 0.00 O ATOM 89 OE2 GLU A 9 12.838 -12.248 10.430 1.00 0.00 O ATOM 0 H GLU A 9 9.576 -11.001 8.981 1.00 0.00 H new ATOM 0 HA GLU A 9 11.596 -8.912 8.732 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.240 -11.717 7.864 1.00 0.00 H new ATOM 0 HB3 GLU A 9 12.008 -10.684 6.675 1.00 0.00 H new ATOM 0 HG2 GLU A 9 13.948 -10.726 7.842 1.00 0.00 H new ATOM 0 HG3 GLU A 9 13.149 -10.046 9.245 1.00 0.00 H new ATOM 96 N LEU A 10 9.400 -9.580 6.356 1.00 0.00 N ATOM 97 CA LEU A 10 8.717 -9.014 5.205 1.00 0.00 C ATOM 98 C LEU A 10 8.378 -7.549 5.488 1.00 0.00 C ATOM 99 O LEU A 10 8.854 -6.652 4.794 1.00 0.00 O ATOM 100 CB LEU A 10 7.503 -9.865 4.831 1.00 0.00 C ATOM 101 CG LEU A 10 7.436 -10.336 3.377 1.00 0.00 C ATOM 102 CD1 LEU A 10 6.357 -11.405 3.195 1.00 0.00 C ATOM 103 CD2 LEU A 10 7.237 -9.154 2.426 1.00 0.00 C ATOM 0 H LEU A 10 9.122 -10.533 6.591 1.00 0.00 H new ATOM 0 HA LEU A 10 9.368 -9.028 4.331 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.486 -10.742 5.477 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.602 -9.292 5.048 1.00 0.00 H new ATOM 0 HG LEU A 10 8.391 -10.796 3.124 1.00 0.00 H new ATOM 0 HD11 LEU A 10 6.331 -11.722 2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 10 6.583 -12.262 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.387 -10.994 3.473 1.00 0.00 H new ATOM 0 HD21 LEU A 10 7.193 -9.517 1.399 1.00 0.00 H new ATOM 0 HD22 LEU A 10 6.306 -8.643 2.671 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.070 -8.459 2.530 1.00 0.00 H new ATOM 115 N GLU A 11 7.557 -7.352 6.510 1.00 0.00 N ATOM 116 CA GLU A 11 7.149 -6.011 6.893 1.00 0.00 C ATOM 117 C GLU A 11 8.326 -5.042 6.770 1.00 0.00 C ATOM 118 O GLU A 11 8.236 -4.037 6.066 1.00 0.00 O ATOM 119 CB GLU A 11 6.573 -5.998 8.311 1.00 0.00 C ATOM 120 CG GLU A 11 5.117 -5.529 8.307 1.00 0.00 C ATOM 121 CD GLU A 11 4.267 -6.371 9.261 1.00 0.00 C ATOM 122 OE1 GLU A 11 4.214 -5.998 10.453 1.00 0.00 O ATOM 123 OE2 GLU A 11 3.690 -7.368 8.777 1.00 0.00 O ATOM 0 H GLU A 11 7.164 -8.098 7.084 1.00 0.00 H new ATOM 0 HA GLU A 11 6.362 -5.683 6.213 1.00 0.00 H new ATOM 0 HB2 GLU A 11 6.636 -6.997 8.742 1.00 0.00 H new ATOM 0 HB3 GLU A 11 7.169 -5.340 8.943 1.00 0.00 H new ATOM 0 HG2 GLU A 11 5.068 -4.480 8.600 1.00 0.00 H new ATOM 0 HG3 GLU A 11 4.712 -5.597 7.297 1.00 0.00 H new ATOM 130 N GLU A 12 9.402 -5.377 7.466 1.00 0.00 N ATOM 131 CA GLU A 12 10.596 -4.548 7.444 1.00 0.00 C ATOM 132 C GLU A 12 10.912 -4.112 6.012 1.00 0.00 C ATOM 133 O GLU A 12 11.018 -2.919 5.731 1.00 0.00 O ATOM 134 CB GLU A 12 11.784 -5.282 8.068 1.00 0.00 C ATOM 135 CG GLU A 12 11.468 -5.718 9.500 1.00 0.00 C ATOM 136 CD GLU A 12 12.471 -5.121 10.490 1.00 0.00 C ATOM 137 OE1 GLU A 12 12.695 -3.895 10.399 1.00 0.00 O ATOM 138 OE2 GLU A 12 12.990 -5.904 11.314 1.00 0.00 O ATOM 0 H GLU A 12 9.473 -6.211 8.049 1.00 0.00 H new ATOM 0 HA GLU A 12 10.407 -3.656 8.042 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.034 -6.155 7.465 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.659 -4.632 8.067 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.459 -5.403 9.765 1.00 0.00 H new ATOM 0 HG3 GLU A 12 11.490 -6.806 9.566 1.00 0.00 H new ATOM 145 N ARG A 13 11.055 -5.102 5.143 1.00 0.00 N ATOM 146 CA ARG A 13 11.357 -4.835 3.747 1.00 0.00 C ATOM 147 C ARG A 13 10.246 -3.995 3.115 1.00 0.00 C ATOM 148 O ARG A 13 10.514 -2.958 2.510 1.00 0.00 O ATOM 149 CB ARG A 13 11.514 -6.137 2.959 1.00 0.00 C ATOM 150 CG ARG A 13 12.960 -6.329 2.500 1.00 0.00 C ATOM 151 CD ARG A 13 13.294 -7.814 2.344 1.00 0.00 C ATOM 152 NE ARG A 13 13.568 -8.413 3.670 1.00 0.00 N ATOM 153 CZ ARG A 13 14.088 -9.635 3.849 1.00 0.00 C ATOM 154 NH1 ARG A 13 14.394 -10.395 2.789 1.00 0.00 N ATOM 155 NH2 ARG A 13 14.302 -10.096 5.089 1.00 0.00 N ATOM 0 H ARG A 13 10.967 -6.090 5.379 1.00 0.00 H new ATOM 0 HA ARG A 13 12.298 -4.286 3.710 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.211 -6.980 3.579 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.852 -6.124 2.093 1.00 0.00 H new ATOM 0 HG2 ARG A 13 13.115 -5.816 1.551 1.00 0.00 H new ATOM 0 HG3 ARG A 13 13.638 -5.874 3.222 1.00 0.00 H new ATOM 0 HD2 ARG A 13 12.464 -8.334 1.865 1.00 0.00 H new ATOM 0 HD3 ARG A 13 14.162 -7.934 1.695 1.00 0.00 H new ATOM 0 HE ARG A 13 13.347 -7.861 4.499 1.00 0.00 H new ATOM 0 HH11 ARG A 13 14.231 -10.044 1.845 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.790 -11.325 2.926 1.00 0.00 H new ATOM 0 HH21 ARG A 13 14.069 -9.517 5.896 1.00 0.00 H new ATOM 0 HH22 ARG A 13 14.698 -11.026 5.226 1.00 0.00 H new ATOM 169 N LEU A 14 9.021 -4.474 3.275 1.00 0.00 N ATOM 170 CA LEU A 14 7.868 -3.780 2.728 1.00 0.00 C ATOM 171 C LEU A 14 8.039 -2.274 2.935 1.00 0.00 C ATOM 172 O LEU A 14 7.965 -1.500 1.981 1.00 0.00 O ATOM 173 CB LEU A 14 6.574 -4.339 3.322 1.00 0.00 C ATOM 174 CG LEU A 14 6.029 -5.611 2.668 1.00 0.00 C ATOM 175 CD1 LEU A 14 4.930 -6.241 3.525 1.00 0.00 C ATOM 176 CD2 LEU A 14 5.554 -5.332 1.240 1.00 0.00 C ATOM 0 H LEU A 14 8.802 -5.335 3.776 1.00 0.00 H new ATOM 0 HA LEU A 14 7.797 -3.949 1.653 1.00 0.00 H new ATOM 0 HB2 LEU A 14 6.741 -4.541 4.380 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.807 -3.567 3.263 1.00 0.00 H new ATOM 0 HG LEU A 14 6.840 -6.336 2.602 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.560 -7.143 3.037 1.00 0.00 H new ATOM 0 HD12 LEU A 14 5.334 -6.498 4.504 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.111 -5.532 3.645 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.171 -6.252 0.798 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.763 -4.582 1.260 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.389 -4.963 0.644 1.00 0.00 H new ATOM 188 N VAL A 15 8.264 -1.903 4.186 1.00 0.00 N ATOM 189 CA VAL A 15 8.447 -0.503 4.530 1.00 0.00 C ATOM 190 C VAL A 15 9.665 0.046 3.786 1.00 0.00 C ATOM 191 O VAL A 15 9.584 1.089 3.140 1.00 0.00 O ATOM 192 CB VAL A 15 8.553 -0.346 6.049 1.00 0.00 C ATOM 193 CG1 VAL A 15 8.764 1.119 6.436 1.00 0.00 C ATOM 194 CG2 VAL A 15 7.321 -0.926 6.747 1.00 0.00 C ATOM 0 H VAL A 15 8.324 -2.547 4.974 1.00 0.00 H new ATOM 0 HA VAL A 15 7.583 0.083 4.216 1.00 0.00 H new ATOM 0 HB VAL A 15 9.424 -0.909 6.384 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.836 1.202 7.520 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.684 1.486 5.982 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.922 1.714 6.082 1.00 0.00 H new ATOM 0 HG21 VAL A 15 7.421 -0.802 7.825 1.00 0.00 H new ATOM 0 HG22 VAL A 15 6.428 -0.404 6.403 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.234 -1.987 6.511 1.00 0.00 H new ATOM 204 N GLU A 16 10.767 -0.681 3.903 1.00 0.00 N ATOM 205 CA GLU A 16 12.001 -0.280 3.249 1.00 0.00 C ATOM 206 C GLU A 16 11.729 0.113 1.796 1.00 0.00 C ATOM 207 O GLU A 16 12.479 0.891 1.208 1.00 0.00 O ATOM 208 CB GLU A 16 13.050 -1.390 3.329 1.00 0.00 C ATOM 209 CG GLU A 16 13.617 -1.508 4.746 1.00 0.00 C ATOM 210 CD GLU A 16 15.104 -1.869 4.713 1.00 0.00 C ATOM 211 OE1 GLU A 16 15.391 -3.076 4.561 1.00 0.00 O ATOM 212 OE2 GLU A 16 15.919 -0.930 4.840 1.00 0.00 O ATOM 0 H GLU A 16 10.831 -1.545 4.441 1.00 0.00 H new ATOM 0 HA GLU A 16 12.399 0.590 3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 16 12.604 -2.339 3.032 1.00 0.00 H new ATOM 0 HB3 GLU A 16 13.857 -1.184 2.626 1.00 0.00 H new ATOM 0 HG2 GLU A 16 13.480 -0.566 5.276 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.067 -2.269 5.300 1.00 0.00 H new ATOM 219 N TRP A 17 10.653 -0.442 1.258 1.00 0.00 N ATOM 220 CA TRP A 17 10.272 -0.159 -0.115 1.00 0.00 C ATOM 221 C TRP A 17 9.458 1.137 -0.123 1.00 0.00 C ATOM 222 O TRP A 17 9.807 2.088 -0.820 1.00 0.00 O ATOM 223 CB TRP A 17 9.520 -1.341 -0.730 1.00 0.00 C ATOM 224 CG TRP A 17 8.969 -1.068 -2.131 1.00 0.00 C ATOM 225 CD1 TRP A 17 9.505 -0.304 -3.094 1.00 0.00 C ATOM 226 CD2 TRP A 17 7.746 -1.590 -2.692 1.00 0.00 C ATOM 227 NE1 TRP A 17 8.720 -0.296 -4.229 1.00 0.00 N ATOM 228 CE2 TRP A 17 7.616 -1.103 -3.977 1.00 0.00 C ATOM 229 CE3 TRP A 17 6.782 -2.446 -2.132 1.00 0.00 C ATOM 230 CZ2 TRP A 17 6.535 -1.416 -4.809 1.00 0.00 C ATOM 231 CZ3 TRP A 17 5.707 -2.749 -2.977 1.00 0.00 C ATOM 232 CH2 TRP A 17 5.562 -2.267 -4.272 1.00 0.00 C ATOM 0 H TRP A 17 10.033 -1.086 1.748 1.00 0.00 H new ATOM 0 HA TRP A 17 11.155 -0.019 -0.739 1.00 0.00 H new ATOM 0 HB2 TRP A 17 10.189 -2.200 -0.775 1.00 0.00 H new ATOM 0 HB3 TRP A 17 8.694 -1.614 -0.073 1.00 0.00 H new ATOM 0 HD1 TRP A 17 10.434 0.237 -2.994 1.00 0.00 H new ATOM 0 HE1 TRP A 17 8.914 0.209 -5.094 1.00 0.00 H new ATOM 0 HE3 TRP A 17 6.864 -2.839 -1.129 1.00 0.00 H new ATOM 0 HZ2 TRP A 17 6.456 -1.022 -5.811 1.00 0.00 H new ATOM 0 HZ3 TRP A 17 4.937 -3.403 -2.595 1.00 0.00 H new ATOM 0 HH2 TRP A 17 4.702 -2.548 -4.862 1.00 0.00 H new ATOM 243 N ILE A 18 8.389 1.131 0.659 1.00 0.00 N ATOM 244 CA ILE A 18 7.524 2.294 0.751 1.00 0.00 C ATOM 245 C ILE A 18 8.366 3.527 1.083 1.00 0.00 C ATOM 246 O ILE A 18 7.943 4.657 0.841 1.00 0.00 O ATOM 247 CB ILE A 18 6.388 2.040 1.745 1.00 0.00 C ATOM 248 CG1 ILE A 18 5.444 0.951 1.232 1.00 0.00 C ATOM 249 CG2 ILE A 18 5.644 3.337 2.071 1.00 0.00 C ATOM 250 CD1 ILE A 18 4.785 0.205 2.394 1.00 0.00 C ATOM 0 H ILE A 18 8.102 0.339 1.235 1.00 0.00 H new ATOM 0 HA ILE A 18 7.042 2.486 -0.208 1.00 0.00 H new ATOM 0 HB ILE A 18 6.823 1.676 2.676 1.00 0.00 H new ATOM 0 HG12 ILE A 18 4.677 1.398 0.600 1.00 0.00 H new ATOM 0 HG13 ILE A 18 5.998 0.247 0.611 1.00 0.00 H new ATOM 0 HG21 ILE A 18 4.842 3.128 2.779 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.338 4.054 2.510 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.221 3.754 1.157 1.00 0.00 H new ATOM 0 HD11 ILE A 18 4.119 -0.564 2.002 1.00 0.00 H new ATOM 0 HD12 ILE A 18 5.554 -0.261 3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 18 4.212 0.908 2.999 1.00 0.00 H new ATOM 262 N VAL A 19 9.544 3.269 1.632 1.00 0.00 N ATOM 263 CA VAL A 19 10.450 4.344 1.999 1.00 0.00 C ATOM 264 C VAL A 19 11.066 4.942 0.732 1.00 0.00 C ATOM 265 O VAL A 19 10.999 6.151 0.516 1.00 0.00 O ATOM 266 CB VAL A 19 11.499 3.830 2.987 1.00 0.00 C ATOM 267 CG1 VAL A 19 12.661 4.817 3.116 1.00 0.00 C ATOM 268 CG2 VAL A 19 10.871 3.540 4.352 1.00 0.00 C ATOM 0 H VAL A 19 9.892 2.331 1.832 1.00 0.00 H new ATOM 0 HA VAL A 19 9.908 5.143 2.506 1.00 0.00 H new ATOM 0 HB VAL A 19 11.897 2.894 2.596 1.00 0.00 H new ATOM 0 HG11 VAL A 19 13.392 4.427 3.824 1.00 0.00 H new ATOM 0 HG12 VAL A 19 13.134 4.952 2.143 1.00 0.00 H new ATOM 0 HG13 VAL A 19 12.286 5.776 3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 19 11.638 3.176 5.035 1.00 0.00 H new ATOM 0 HG22 VAL A 19 10.432 4.454 4.752 1.00 0.00 H new ATOM 0 HG23 VAL A 19 10.094 2.783 4.242 1.00 0.00 H new ATOM 278 N VAL A 20 11.651 4.068 -0.073 1.00 0.00 N ATOM 279 CA VAL A 20 12.277 4.494 -1.313 1.00 0.00 C ATOM 280 C VAL A 20 11.203 5.020 -2.267 1.00 0.00 C ATOM 281 O VAL A 20 11.422 6.003 -2.973 1.00 0.00 O ATOM 282 CB VAL A 20 13.095 3.346 -1.908 1.00 0.00 C ATOM 283 CG1 VAL A 20 13.758 2.517 -0.806 1.00 0.00 C ATOM 284 CG2 VAL A 20 12.229 2.466 -2.811 1.00 0.00 C ATOM 0 H VAL A 20 11.705 3.066 0.109 1.00 0.00 H new ATOM 0 HA VAL A 20 12.975 5.310 -1.127 1.00 0.00 H new ATOM 0 HB VAL A 20 13.885 3.780 -2.522 1.00 0.00 H new ATOM 0 HG11 VAL A 20 14.333 1.708 -1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 20 14.423 3.154 -0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 20 12.991 2.098 -0.154 1.00 0.00 H new ATOM 0 HG21 VAL A 20 12.835 1.658 -3.221 1.00 0.00 H new ATOM 0 HG22 VAL A 20 11.408 2.045 -2.230 1.00 0.00 H new ATOM 0 HG23 VAL A 20 11.826 3.067 -3.626 1.00 0.00 H new ATOM 294 N GLN A 21 10.065 4.342 -2.258 1.00 0.00 N ATOM 295 CA GLN A 21 8.956 4.729 -3.114 1.00 0.00 C ATOM 296 C GLN A 21 8.447 6.119 -2.728 1.00 0.00 C ATOM 297 O GLN A 21 8.646 7.083 -3.464 1.00 0.00 O ATOM 298 CB GLN A 21 7.830 3.695 -3.052 1.00 0.00 C ATOM 299 CG GLN A 21 8.221 2.412 -3.788 1.00 0.00 C ATOM 300 CD GLN A 21 7.638 2.392 -5.203 1.00 0.00 C ATOM 301 OE1 GLN A 21 6.683 1.693 -5.499 1.00 0.00 O ATOM 302 NE2 GLN A 21 8.265 3.196 -6.058 1.00 0.00 N ATOM 0 H GLN A 21 9.887 3.527 -1.671 1.00 0.00 H new ATOM 0 HA GLN A 21 9.313 4.768 -4.143 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.599 3.466 -2.012 1.00 0.00 H new ATOM 0 HB3 GLN A 21 6.925 4.111 -3.495 1.00 0.00 H new ATOM 0 HG2 GLN A 21 9.307 2.333 -3.837 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.864 1.546 -3.231 1.00 0.00 H new ATOM 0 HE21 GLN A 21 9.059 3.755 -5.744 1.00 0.00 H new ATOM 0 HE22 GLN A 21 7.952 3.254 -7.027 1.00 0.00 H new ATOM 311 N CYS A 22 7.800 6.177 -1.573 1.00 0.00 N ATOM 312 CA CYS A 22 7.261 7.433 -1.080 1.00 0.00 C ATOM 313 C CYS A 22 8.424 8.403 -0.864 1.00 0.00 C ATOM 314 O CYS A 22 8.415 9.515 -1.391 1.00 0.00 O ATOM 315 CB CYS A 22 6.439 7.234 0.196 1.00 0.00 C ATOM 316 SG CYS A 22 5.012 6.140 -0.143 1.00 0.00 S ATOM 0 H CYS A 22 7.637 5.375 -0.965 1.00 0.00 H new ATOM 0 HA CYS A 22 6.573 7.850 -1.816 1.00 0.00 H new ATOM 0 HB2 CYS A 22 7.063 6.799 0.977 1.00 0.00 H new ATOM 0 HB3 CYS A 22 6.089 8.197 0.567 1.00 0.00 H new ATOM 0 HG CYS A 22 3.913 6.832 -0.090 1.00 0.00 H new ATOM 322 N GLY A 23 9.397 7.948 -0.089 1.00 0.00 N ATOM 323 CA GLY A 23 10.565 8.761 0.202 1.00 0.00 C ATOM 324 C GLY A 23 10.616 9.135 1.685 1.00 0.00 C ATOM 325 O GLY A 23 9.712 8.795 2.447 1.00 0.00 O ATOM 0 H GLY A 23 9.400 7.026 0.347 1.00 0.00 H new ATOM 0 HA2 GLY A 23 11.469 8.216 -0.071 1.00 0.00 H new ATOM 0 HA3 GLY A 23 10.543 9.666 -0.405 1.00 0.00 H new ATOM 329 N PRO A 24 11.712 9.847 2.061 1.00 0.00 N ATOM 330 CA PRO A 24 11.894 10.270 3.439 1.00 0.00 C ATOM 331 C PRO A 24 10.972 11.443 3.778 1.00 0.00 C ATOM 332 O PRO A 24 11.432 12.484 4.246 1.00 0.00 O ATOM 333 CB PRO A 24 13.369 10.621 3.552 1.00 0.00 C ATOM 334 CG PRO A 24 13.858 10.827 2.128 1.00 0.00 C ATOM 335 CD PRO A 24 12.804 10.267 1.187 1.00 0.00 C ATOM 0 HA PRO A 24 11.628 9.494 4.156 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.512 11.522 4.148 1.00 0.00 H new ATOM 0 HB3 PRO A 24 13.924 9.822 4.044 1.00 0.00 H new ATOM 0 HG2 PRO A 24 14.022 11.886 1.930 1.00 0.00 H new ATOM 0 HG3 PRO A 24 14.812 10.323 1.976 1.00 0.00 H new ATOM 0 HD2 PRO A 24 12.472 11.019 0.472 1.00 0.00 H new ATOM 0 HD3 PRO A 24 13.194 9.429 0.610 1.00 0.00 H new ATOM 343 N ASP A 25 9.687 11.236 3.529 1.00 0.00 N ATOM 344 CA ASP A 25 8.697 12.264 3.803 1.00 0.00 C ATOM 345 C ASP A 25 7.551 11.658 4.615 1.00 0.00 C ATOM 346 O ASP A 25 7.106 12.245 5.600 1.00 0.00 O ATOM 347 CB ASP A 25 8.112 12.824 2.505 1.00 0.00 C ATOM 348 CG ASP A 25 7.743 14.308 2.550 1.00 0.00 C ATOM 349 OD1 ASP A 25 8.685 15.126 2.629 1.00 0.00 O ATOM 350 OD2 ASP A 25 6.526 14.592 2.503 1.00 0.00 O ATOM 0 H ASP A 25 9.309 10.372 3.141 1.00 0.00 H new ATOM 0 HA ASP A 25 9.187 13.067 4.354 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.833 12.668 1.702 1.00 0.00 H new ATOM 0 HB3 ASP A 25 7.221 12.251 2.249 1.00 0.00 H new ATOM 355 N VAL A 26 7.106 10.492 4.171 1.00 0.00 N ATOM 356 CA VAL A 26 6.020 9.800 4.845 1.00 0.00 C ATOM 357 C VAL A 26 6.506 9.300 6.207 1.00 0.00 C ATOM 358 O VAL A 26 5.713 9.144 7.134 1.00 0.00 O ATOM 359 CB VAL A 26 5.481 8.679 3.954 1.00 0.00 C ATOM 360 CG1 VAL A 26 4.954 9.236 2.630 1.00 0.00 C ATOM 361 CG2 VAL A 26 6.548 7.609 3.713 1.00 0.00 C ATOM 0 H VAL A 26 7.477 10.009 3.353 1.00 0.00 H new ATOM 0 HA VAL A 26 5.188 10.481 5.027 1.00 0.00 H new ATOM 0 HB VAL A 26 4.647 8.209 4.475 1.00 0.00 H new ATOM 0 HG11 VAL A 26 4.577 8.418 2.016 1.00 0.00 H new ATOM 0 HG12 VAL A 26 4.148 9.943 2.828 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.761 9.744 2.102 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.139 6.824 3.077 1.00 0.00 H new ATOM 0 HG22 VAL A 26 7.411 8.060 3.223 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.855 7.180 4.667 1.00 0.00 H new ATOM 371 N GLY A 27 7.807 9.063 6.284 1.00 0.00 N ATOM 372 CA GLY A 27 8.409 8.585 7.517 1.00 0.00 C ATOM 373 C GLY A 27 8.304 7.062 7.623 1.00 0.00 C ATOM 374 O GLY A 27 8.268 6.366 6.609 1.00 0.00 O ATOM 0 H GLY A 27 8.461 9.193 5.512 1.00 0.00 H new ATOM 0 HA2 GLY A 27 9.456 8.885 7.555 1.00 0.00 H new ATOM 0 HA3 GLY A 27 7.914 9.048 8.371 1.00 0.00 H new ATOM 378 N ARG A 28 8.258 6.588 8.860 1.00 0.00 N ATOM 379 CA ARG A 28 8.158 5.161 9.111 1.00 0.00 C ATOM 380 C ARG A 28 7.143 4.887 10.223 1.00 0.00 C ATOM 381 O ARG A 28 6.626 5.818 10.840 1.00 0.00 O ATOM 382 CB ARG A 28 9.513 4.576 9.512 1.00 0.00 C ATOM 383 CG ARG A 28 10.003 3.565 8.474 1.00 0.00 C ATOM 384 CD ARG A 28 10.861 2.480 9.127 1.00 0.00 C ATOM 385 NE ARG A 28 11.410 2.972 10.410 1.00 0.00 N ATOM 386 CZ ARG A 28 12.363 3.908 10.510 1.00 0.00 C ATOM 387 NH1 ARG A 28 12.879 4.459 9.402 1.00 0.00 N ATOM 388 NH2 ARG A 28 12.801 4.294 11.716 1.00 0.00 N ATOM 0 H ARG A 28 8.288 7.168 9.699 1.00 0.00 H new ATOM 0 HA ARG A 28 7.828 4.685 8.188 1.00 0.00 H new ATOM 0 HB2 ARG A 28 10.243 5.379 9.616 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.430 4.092 10.485 1.00 0.00 H new ATOM 0 HG2 ARG A 28 9.149 3.107 7.976 1.00 0.00 H new ATOM 0 HG3 ARG A 28 10.582 4.078 7.706 1.00 0.00 H new ATOM 0 HD2 ARG A 28 10.262 1.585 9.298 1.00 0.00 H new ATOM 0 HD3 ARG A 28 11.674 2.197 8.459 1.00 0.00 H new ATOM 0 HE ARG A 28 11.039 2.573 11.273 1.00 0.00 H new ATOM 0 HH11 ARG A 28 12.546 4.165 8.484 1.00 0.00 H new ATOM 0 HH12 ARG A 28 13.605 5.172 9.477 1.00 0.00 H new ATOM 0 HH21 ARG A 28 12.409 3.875 12.559 1.00 0.00 H new ATOM 0 HH22 ARG A 28 13.527 5.007 11.791 1.00 0.00 H new ATOM 402 N PRO A 29 6.881 3.572 10.451 1.00 0.00 N ATOM 403 CA PRO A 29 5.937 3.165 11.478 1.00 0.00 C ATOM 404 C PRO A 29 6.544 3.322 12.874 1.00 0.00 C ATOM 405 O PRO A 29 7.642 2.833 13.136 1.00 0.00 O ATOM 406 CB PRO A 29 5.587 1.725 11.142 1.00 0.00 C ATOM 407 CG PRO A 29 6.691 1.232 10.221 1.00 0.00 C ATOM 408 CD PRO A 29 7.473 2.443 9.741 1.00 0.00 C ATOM 0 HA PRO A 29 5.041 3.785 11.495 1.00 0.00 H new ATOM 0 HB2 PRO A 29 5.530 1.116 12.044 1.00 0.00 H new ATOM 0 HB3 PRO A 29 4.614 1.663 10.654 1.00 0.00 H new ATOM 0 HG2 PRO A 29 7.347 0.539 10.748 1.00 0.00 H new ATOM 0 HG3 PRO A 29 6.269 0.690 9.375 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.534 2.345 9.969 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.389 2.566 8.661 1.00 0.00 H new ATOM 416 N ASP A 30 5.802 4.006 13.733 1.00 0.00 N ATOM 417 CA ASP A 30 6.253 4.233 15.096 1.00 0.00 C ATOM 418 C ASP A 30 6.247 2.907 15.859 1.00 0.00 C ATOM 419 O ASP A 30 5.346 2.089 15.682 1.00 0.00 O ATOM 420 CB ASP A 30 5.325 5.204 15.828 1.00 0.00 C ATOM 421 CG ASP A 30 4.783 6.350 14.972 1.00 0.00 C ATOM 422 OD1 ASP A 30 5.516 7.354 14.837 1.00 0.00 O ATOM 423 OD2 ASP A 30 3.647 6.197 14.473 1.00 0.00 O ATOM 0 H ASP A 30 4.892 4.410 13.512 1.00 0.00 H new ATOM 0 HA ASP A 30 7.257 4.656 15.053 1.00 0.00 H new ATOM 0 HB2 ASP A 30 4.483 4.643 16.232 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.863 5.627 16.676 1.00 0.00 H new ATOM 428 N ARG A 31 7.264 2.735 16.691 1.00 0.00 N ATOM 429 CA ARG A 31 7.387 1.522 17.481 1.00 0.00 C ATOM 430 C ARG A 31 6.169 1.356 18.391 1.00 0.00 C ATOM 431 O ARG A 31 5.309 2.234 18.451 1.00 0.00 O ATOM 432 CB ARG A 31 8.655 1.549 18.337 1.00 0.00 C ATOM 433 CG ARG A 31 8.459 2.421 19.580 1.00 0.00 C ATOM 434 CD ARG A 31 8.206 1.559 20.819 1.00 0.00 C ATOM 435 NE ARG A 31 9.275 1.783 21.817 1.00 0.00 N ATOM 436 CZ ARG A 31 9.309 1.202 23.025 1.00 0.00 C ATOM 437 NH1 ARG A 31 8.332 0.360 23.391 1.00 0.00 N ATOM 438 NH2 ARG A 31 10.318 1.464 23.866 1.00 0.00 N ATOM 0 H ARG A 31 8.010 3.415 16.835 1.00 0.00 H new ATOM 0 HA ARG A 31 7.446 0.681 16.791 1.00 0.00 H new ATOM 0 HB2 ARG A 31 8.917 0.535 18.638 1.00 0.00 H new ATOM 0 HB3 ARG A 31 9.488 1.932 17.747 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.342 3.040 19.737 1.00 0.00 H new ATOM 0 HG3 ARG A 31 7.619 3.098 19.425 1.00 0.00 H new ATOM 0 HD2 ARG A 31 7.236 1.805 21.251 1.00 0.00 H new ATOM 0 HD3 ARG A 31 8.173 0.506 20.539 1.00 0.00 H new ATOM 0 HE ARG A 31 10.033 2.419 21.571 1.00 0.00 H new ATOM 0 HH11 ARG A 31 7.563 0.162 22.751 1.00 0.00 H new ATOM 0 HH12 ARG A 31 8.357 -0.082 24.310 1.00 0.00 H new ATOM 0 HH21 ARG A 31 11.061 2.106 23.588 1.00 0.00 H new ATOM 0 HH22 ARG A 31 10.344 1.022 24.785 1.00 0.00 H new ATOM 452 N GLY A 32 6.133 0.223 19.078 1.00 0.00 N ATOM 453 CA GLY A 32 5.035 -0.069 19.983 1.00 0.00 C ATOM 454 C GLY A 32 3.705 -0.132 19.228 1.00 0.00 C ATOM 455 O GLY A 32 3.544 0.512 18.192 1.00 0.00 O ATOM 0 H GLY A 32 6.847 -0.503 19.026 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.217 -1.018 20.487 1.00 0.00 H new ATOM 0 HA3 GLY A 32 4.983 0.697 20.756 1.00 0.00 H new ATOM 459 N ARG A 33 2.786 -0.913 19.777 1.00 0.00 N ATOM 460 CA ARG A 33 1.476 -1.068 19.168 1.00 0.00 C ATOM 461 C ARG A 33 1.616 -1.381 17.677 1.00 0.00 C ATOM 462 O ARG A 33 2.721 -1.621 17.191 1.00 0.00 O ATOM 463 CB ARG A 33 0.636 0.199 19.339 1.00 0.00 C ATOM 464 CG ARG A 33 -0.760 -0.135 19.869 1.00 0.00 C ATOM 465 CD ARG A 33 -1.064 0.649 21.147 1.00 0.00 C ATOM 466 NE ARG A 33 -2.023 -0.103 21.986 1.00 0.00 N ATOM 467 CZ ARG A 33 -1.761 -1.293 22.544 1.00 0.00 C ATOM 468 NH1 ARG A 33 -0.569 -1.874 22.354 1.00 0.00 N ATOM 469 NH2 ARG A 33 -2.692 -1.902 23.291 1.00 0.00 N ATOM 0 H ARG A 33 2.923 -1.445 20.637 1.00 0.00 H new ATOM 0 HA ARG A 33 0.973 -1.895 19.670 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.136 0.881 20.027 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.552 0.715 18.383 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -1.506 0.098 19.109 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -0.831 -1.204 20.069 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.143 0.826 21.703 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.477 1.626 20.895 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.941 0.310 22.150 1.00 0.00 H new ATOM 0 HH11 ARG A 33 0.139 -1.411 21.785 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -0.370 -2.780 22.779 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.600 -1.460 23.435 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.493 -2.808 23.716 1.00 0.00 H new ATOM 483 N LEU A 34 0.482 -1.368 16.993 1.00 0.00 N ATOM 484 CA LEU A 34 0.465 -1.648 15.567 1.00 0.00 C ATOM 485 C LEU A 34 1.647 -0.942 14.899 1.00 0.00 C ATOM 486 O LEU A 34 2.641 -1.579 14.555 1.00 0.00 O ATOM 487 CB LEU A 34 -0.892 -1.279 14.965 1.00 0.00 C ATOM 488 CG LEU A 34 -2.107 -1.997 15.558 1.00 0.00 C ATOM 489 CD1 LEU A 34 -3.263 -1.021 15.785 1.00 0.00 C ATOM 490 CD2 LEU A 34 -2.521 -3.184 14.686 1.00 0.00 C ATOM 0 H LEU A 34 -0.432 -1.168 17.399 1.00 0.00 H new ATOM 0 HA LEU A 34 0.588 -2.716 15.387 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -1.038 -0.205 15.080 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -0.860 -1.484 13.895 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.827 -2.396 16.533 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.114 -1.556 16.207 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.948 -0.238 16.475 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.552 -0.572 14.835 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.386 -3.677 15.129 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.777 -2.830 13.687 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -1.695 -3.892 14.619 1.00 0.00 H new ATOM 502 N GLY A 35 1.499 0.364 14.736 1.00 0.00 N ATOM 503 CA GLY A 35 2.541 1.164 14.115 1.00 0.00 C ATOM 504 C GLY A 35 2.530 0.994 12.594 1.00 0.00 C ATOM 505 O GLY A 35 2.410 1.972 11.858 1.00 0.00 O ATOM 0 H GLY A 35 0.673 0.889 15.023 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.397 2.214 14.368 1.00 0.00 H new ATOM 0 HA3 GLY A 35 3.514 0.871 14.510 1.00 0.00 H new ATOM 509 N PHE A 36 2.657 -0.254 12.169 1.00 0.00 N ATOM 510 CA PHE A 36 2.662 -0.564 10.750 1.00 0.00 C ATOM 511 C PHE A 36 1.257 -0.447 10.157 1.00 0.00 C ATOM 512 O PHE A 36 1.020 0.369 9.267 1.00 0.00 O ATOM 513 CB PHE A 36 3.143 -2.010 10.609 1.00 0.00 C ATOM 514 CG PHE A 36 3.197 -2.510 9.165 1.00 0.00 C ATOM 515 CD1 PHE A 36 3.948 -1.849 8.243 1.00 0.00 C ATOM 516 CD2 PHE A 36 2.494 -3.617 8.801 1.00 0.00 C ATOM 517 CE1 PHE A 36 3.998 -2.314 6.903 1.00 0.00 C ATOM 518 CE2 PHE A 36 2.544 -4.081 7.460 1.00 0.00 C ATOM 519 CZ PHE A 36 3.295 -3.420 6.539 1.00 0.00 C ATOM 0 H PHE A 36 2.757 -1.063 12.783 1.00 0.00 H new ATOM 0 HA PHE A 36 3.310 0.134 10.220 1.00 0.00 H new ATOM 0 HB2 PHE A 36 4.136 -2.096 11.050 1.00 0.00 H new ATOM 0 HB3 PHE A 36 2.482 -2.659 11.183 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.506 -0.970 8.531 1.00 0.00 H new ATOM 0 HD2 PHE A 36 1.898 -4.143 9.532 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.595 -1.789 6.172 1.00 0.00 H new ATOM 0 HE2 PHE A 36 1.985 -4.959 7.171 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.333 -3.773 5.519 1.00 0.00 H new ATOM 529 N GLN A 37 0.360 -1.273 10.674 1.00 0.00 N ATOM 530 CA GLN A 37 -1.016 -1.273 10.208 1.00 0.00 C ATOM 531 C GLN A 37 -1.542 0.161 10.110 1.00 0.00 C ATOM 532 O GLN A 37 -2.223 0.511 9.147 1.00 0.00 O ATOM 533 CB GLN A 37 -1.905 -2.122 11.118 1.00 0.00 C ATOM 534 CG GLN A 37 -3.330 -2.209 10.568 1.00 0.00 C ATOM 535 CD GLN A 37 -4.317 -1.485 11.486 1.00 0.00 C ATOM 536 OE1 GLN A 37 -4.576 -1.892 12.606 1.00 0.00 O ATOM 537 NE2 GLN A 37 -4.852 -0.391 10.950 1.00 0.00 N ATOM 0 H GLN A 37 0.560 -1.948 11.412 1.00 0.00 H new ATOM 0 HA GLN A 37 -1.042 -1.719 9.214 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.485 -3.124 11.210 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -1.924 -1.691 12.119 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.366 -1.770 9.571 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.621 -3.254 10.467 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -4.591 -0.106 10.006 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.523 0.162 11.483 1.00 0.00 H new ATOM 546 N VAL A 38 -1.207 0.951 11.119 1.00 0.00 N ATOM 547 CA VAL A 38 -1.637 2.338 11.159 1.00 0.00 C ATOM 548 C VAL A 38 -0.904 3.126 10.072 1.00 0.00 C ATOM 549 O VAL A 38 -1.467 4.044 9.478 1.00 0.00 O ATOM 550 CB VAL A 38 -1.425 2.912 12.561 1.00 0.00 C ATOM 551 CG1 VAL A 38 -2.000 4.325 12.668 1.00 0.00 C ATOM 552 CG2 VAL A 38 -2.025 1.993 13.627 1.00 0.00 C ATOM 0 H VAL A 38 -0.642 0.657 11.916 1.00 0.00 H new ATOM 0 HA VAL A 38 -2.704 2.413 10.951 1.00 0.00 H new ATOM 0 HB VAL A 38 -0.351 2.973 12.738 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -1.836 4.709 13.675 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -1.505 4.975 11.946 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -3.070 4.299 12.459 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.860 2.425 14.614 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.095 1.884 13.453 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -1.547 1.015 13.575 1.00 0.00 H new ATOM 562 N TRP A 39 0.343 2.740 9.846 1.00 0.00 N ATOM 563 CA TRP A 39 1.160 3.399 8.841 1.00 0.00 C ATOM 564 C TRP A 39 0.457 3.254 7.490 1.00 0.00 C ATOM 565 O TRP A 39 0.378 4.211 6.722 1.00 0.00 O ATOM 566 CB TRP A 39 2.583 2.838 8.837 1.00 0.00 C ATOM 567 CG TRP A 39 3.589 3.696 8.067 1.00 0.00 C ATOM 568 CD1 TRP A 39 3.820 5.010 8.194 1.00 0.00 C ATOM 569 CD2 TRP A 39 4.495 3.245 7.038 1.00 0.00 C ATOM 570 NE1 TRP A 39 4.805 5.436 7.327 1.00 0.00 N ATOM 571 CE2 TRP A 39 5.229 4.329 6.602 1.00 0.00 C ATOM 572 CE3 TRP A 39 4.689 1.962 6.495 1.00 0.00 C ATOM 573 CZ2 TRP A 39 6.205 4.241 5.602 1.00 0.00 C ATOM 574 CZ3 TRP A 39 5.668 1.892 5.497 1.00 0.00 C ATOM 575 CH2 TRP A 39 6.415 2.974 5.046 1.00 0.00 C ATOM 0 H TRP A 39 0.808 1.979 10.342 1.00 0.00 H new ATOM 0 HA TRP A 39 1.266 4.460 9.066 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.924 2.733 9.867 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.567 1.838 8.403 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.300 5.654 8.888 1.00 0.00 H new ATOM 0 HE1 TRP A 39 5.157 6.389 7.235 1.00 0.00 H new ATOM 0 HE3 TRP A 39 4.127 1.100 6.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.766 5.105 5.277 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 5.856 0.929 5.045 1.00 0.00 H new ATOM 0 HH2 TRP A 39 7.154 2.838 4.270 1.00 0.00 H new ATOM 586 N LEU A 40 -0.037 2.050 7.242 1.00 0.00 N ATOM 587 CA LEU A 40 -0.731 1.767 5.997 1.00 0.00 C ATOM 588 C LEU A 40 -2.238 1.721 6.258 1.00 0.00 C ATOM 589 O LEU A 40 -2.932 0.842 5.750 1.00 0.00 O ATOM 590 CB LEU A 40 -0.179 0.495 5.352 1.00 0.00 C ATOM 591 CG LEU A 40 1.340 0.435 5.179 1.00 0.00 C ATOM 592 CD1 LEU A 40 1.764 -0.869 4.502 1.00 0.00 C ATOM 593 CD2 LEU A 40 1.855 1.665 4.428 1.00 0.00 C ATOM 0 H LEU A 40 0.030 1.259 7.882 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.556 2.564 5.274 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.490 -0.358 5.955 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.641 0.379 4.372 1.00 0.00 H new ATOM 0 HG LEU A 40 1.797 0.447 6.168 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.848 -0.886 4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 40 1.449 -1.715 5.112 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.298 -0.937 3.519 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.937 1.598 4.318 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.392 1.709 3.442 1.00 0.00 H new ATOM 0 HD23 LEU A 40 1.602 2.565 4.988 1.00 0.00 H new ATOM 605 N LYS A 41 -2.699 2.678 7.049 1.00 0.00 N ATOM 606 CA LYS A 41 -4.111 2.757 7.384 1.00 0.00 C ATOM 607 C LYS A 41 -4.757 3.891 6.586 1.00 0.00 C ATOM 608 O LYS A 41 -5.681 3.659 5.807 1.00 0.00 O ATOM 609 CB LYS A 41 -4.297 2.886 8.897 1.00 0.00 C ATOM 610 CG LYS A 41 -5.741 3.255 9.242 1.00 0.00 C ATOM 611 CD LYS A 41 -5.855 3.721 10.695 1.00 0.00 C ATOM 612 CE LYS A 41 -7.248 4.286 10.982 1.00 0.00 C ATOM 613 NZ LYS A 41 -7.156 5.697 11.419 1.00 0.00 N ATOM 0 H LYS A 41 -2.120 3.406 7.468 1.00 0.00 H new ATOM 0 HA LYS A 41 -4.621 1.836 7.101 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -4.033 1.946 9.381 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -3.620 3.647 9.287 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -6.088 4.044 8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -6.389 2.393 9.081 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -5.652 2.886 11.365 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -5.101 4.482 10.897 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -7.867 4.216 10.087 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -7.736 3.691 11.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -8.110 6.064 11.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -6.583 5.756 12.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -6.710 6.264 10.670 1.00 0.00 H new ATOM 627 N ASN A 42 -4.246 5.093 6.807 1.00 0.00 N ATOM 628 CA ASN A 42 -4.761 6.264 6.118 1.00 0.00 C ATOM 629 C ASN A 42 -5.014 5.916 4.649 1.00 0.00 C ATOM 630 O ASN A 42 -6.125 6.088 4.149 1.00 0.00 O ATOM 631 CB ASN A 42 -3.757 7.417 6.165 1.00 0.00 C ATOM 632 CG ASN A 42 -4.265 8.619 5.366 1.00 0.00 C ATOM 633 OD1 ASN A 42 -4.815 8.491 4.285 1.00 0.00 O ATOM 634 ND2 ASN A 42 -4.051 9.791 5.958 1.00 0.00 N ATOM 0 H ASN A 42 -3.480 5.281 7.454 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.683 6.569 6.614 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.584 7.711 7.200 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.799 7.087 5.763 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -4.354 10.654 5.506 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -3.584 9.827 6.864 1.00 0.00 H new ATOM 641 N GLY A 43 -3.965 5.434 4.000 1.00 0.00 N ATOM 642 CA GLY A 43 -4.059 5.061 2.599 1.00 0.00 C ATOM 643 C GLY A 43 -3.241 6.012 1.722 1.00 0.00 C ATOM 644 O GLY A 43 -2.698 5.604 0.696 1.00 0.00 O ATOM 0 H GLY A 43 -3.045 5.293 4.418 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -3.701 4.040 2.466 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -5.102 5.077 2.284 1.00 0.00 H new ATOM 648 N VAL A 44 -3.179 7.261 2.158 1.00 0.00 N ATOM 649 CA VAL A 44 -2.437 8.273 1.425 1.00 0.00 C ATOM 650 C VAL A 44 -1.093 7.692 0.980 1.00 0.00 C ATOM 651 O VAL A 44 -0.712 7.821 -0.182 1.00 0.00 O ATOM 652 CB VAL A 44 -2.289 9.534 2.279 1.00 0.00 C ATOM 653 CG1 VAL A 44 -1.227 10.469 1.697 1.00 0.00 C ATOM 654 CG2 VAL A 44 -3.630 10.254 2.430 1.00 0.00 C ATOM 0 H VAL A 44 -3.630 7.596 3.009 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.978 8.567 0.526 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.959 9.229 3.272 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.142 11.357 2.323 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -0.267 9.954 1.665 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -1.515 10.763 0.688 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -3.497 11.147 3.041 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.002 10.540 1.446 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.348 9.589 2.910 1.00 0.00 H new ATOM 664 N ILE A 45 -0.413 7.065 1.928 1.00 0.00 N ATOM 665 CA ILE A 45 0.880 6.463 1.648 1.00 0.00 C ATOM 666 C ILE A 45 0.705 5.344 0.619 1.00 0.00 C ATOM 667 O ILE A 45 1.511 5.209 -0.299 1.00 0.00 O ATOM 668 CB ILE A 45 1.550 6.006 2.945 1.00 0.00 C ATOM 669 CG1 ILE A 45 2.122 7.198 3.716 1.00 0.00 C ATOM 670 CG2 ILE A 45 2.612 4.941 2.668 1.00 0.00 C ATOM 671 CD1 ILE A 45 2.725 6.750 5.049 1.00 0.00 C ATOM 0 H ILE A 45 -0.733 6.961 2.891 1.00 0.00 H new ATOM 0 HA ILE A 45 1.555 7.198 1.209 1.00 0.00 H new ATOM 0 HB ILE A 45 0.791 5.547 3.578 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.886 7.692 3.115 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.335 7.930 3.896 1.00 0.00 H new ATOM 0 HG21 ILE A 45 3.073 4.634 3.607 1.00 0.00 H new ATOM 0 HG22 ILE A 45 2.146 4.078 2.193 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.375 5.351 2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.124 7.616 5.577 1.00 0.00 H new ATOM 0 HD12 ILE A 45 1.953 6.278 5.657 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.528 6.036 4.864 1.00 0.00 H new ATOM 683 N LEU A 46 -0.354 4.571 0.808 1.00 0.00 N ATOM 684 CA LEU A 46 -0.646 3.468 -0.092 1.00 0.00 C ATOM 685 C LEU A 46 -0.904 4.017 -1.497 1.00 0.00 C ATOM 686 O LEU A 46 -0.300 3.561 -2.467 1.00 0.00 O ATOM 687 CB LEU A 46 -1.792 2.617 0.456 1.00 0.00 C ATOM 688 CG LEU A 46 -1.414 1.592 1.527 1.00 0.00 C ATOM 689 CD1 LEU A 46 -2.662 1.011 2.195 1.00 0.00 C ATOM 690 CD2 LEU A 46 -0.514 0.499 0.947 1.00 0.00 C ATOM 0 H LEU A 46 -1.021 4.687 1.571 1.00 0.00 H new ATOM 0 HA LEU A 46 0.211 2.798 -0.163 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.548 3.284 0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.256 2.088 -0.377 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.842 2.103 2.301 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -2.365 0.285 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.230 1.814 2.665 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.281 0.520 1.444 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -0.260 -0.216 1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -1.039 -0.015 0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.399 0.949 0.556 1.00 0.00 H new ATOM 702 N SER A 47 -1.803 4.988 -1.562 1.00 0.00 N ATOM 703 CA SER A 47 -2.149 5.604 -2.832 1.00 0.00 C ATOM 704 C SER A 47 -0.899 6.199 -3.482 1.00 0.00 C ATOM 705 O SER A 47 -0.779 6.213 -4.707 1.00 0.00 O ATOM 706 CB SER A 47 -3.217 6.684 -2.647 1.00 0.00 C ATOM 707 OG SER A 47 -4.400 6.167 -2.042 1.00 0.00 O ATOM 0 H SER A 47 -2.302 5.363 -0.756 1.00 0.00 H new ATOM 0 HA SER A 47 -2.559 4.834 -3.486 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.816 7.488 -2.030 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.465 7.118 -3.615 1.00 0.00 H new ATOM 0 HG SER A 47 -4.198 5.869 -1.131 1.00 0.00 H new ATOM 713 N LYS A 48 0.000 6.677 -2.635 1.00 0.00 N ATOM 714 CA LYS A 48 1.236 7.273 -3.112 1.00 0.00 C ATOM 715 C LYS A 48 2.112 6.186 -3.738 1.00 0.00 C ATOM 716 O LYS A 48 2.767 6.419 -4.753 1.00 0.00 O ATOM 717 CB LYS A 48 1.927 8.047 -1.988 1.00 0.00 C ATOM 718 CG LYS A 48 1.383 9.474 -1.890 1.00 0.00 C ATOM 719 CD LYS A 48 1.786 10.125 -0.565 1.00 0.00 C ATOM 720 CE LYS A 48 1.815 11.649 -0.690 1.00 0.00 C ATOM 721 NZ LYS A 48 3.098 12.097 -1.276 1.00 0.00 N ATOM 0 H LYS A 48 -0.103 6.664 -1.620 1.00 0.00 H new ATOM 0 HA LYS A 48 1.029 8.006 -3.892 1.00 0.00 H new ATOM 0 HB2 LYS A 48 1.776 7.531 -1.040 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.002 8.075 -2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 48 1.761 10.069 -2.721 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.297 9.460 -1.977 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.083 9.834 0.216 1.00 0.00 H new ATOM 0 HD3 LYS A 48 2.768 9.763 -0.261 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.987 11.984 -1.314 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.679 12.103 0.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.101 13.134 -1.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 3.883 11.793 -0.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 3.213 11.679 -2.221 1.00 0.00 H new ATOM 735 N LEU A 49 2.095 5.021 -3.108 1.00 0.00 N ATOM 736 CA LEU A 49 2.880 3.897 -3.590 1.00 0.00 C ATOM 737 C LEU A 49 2.460 3.566 -5.024 1.00 0.00 C ATOM 738 O LEU A 49 3.213 3.804 -5.966 1.00 0.00 O ATOM 739 CB LEU A 49 2.769 2.713 -2.628 1.00 0.00 C ATOM 740 CG LEU A 49 3.757 1.567 -2.857 1.00 0.00 C ATOM 741 CD1 LEU A 49 5.156 1.944 -2.365 1.00 0.00 C ATOM 742 CD2 LEU A 49 3.253 0.273 -2.215 1.00 0.00 C ATOM 0 H LEU A 49 1.550 4.831 -2.267 1.00 0.00 H new ATOM 0 HA LEU A 49 3.938 4.156 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.902 3.083 -1.611 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.757 2.312 -2.692 1.00 0.00 H new ATOM 0 HG LEU A 49 3.830 1.387 -3.930 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.839 1.113 -2.539 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.508 2.822 -2.906 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.119 2.166 -1.298 1.00 0.00 H new ATOM 0 HD21 LEU A 49 3.973 -0.526 -2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 49 3.133 0.422 -1.142 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.293 -0.000 -2.653 1.00 0.00 H new ATOM 754 N VAL A 50 1.258 3.021 -5.143 1.00 0.00 N ATOM 755 CA VAL A 50 0.728 2.654 -6.446 1.00 0.00 C ATOM 756 C VAL A 50 1.071 3.750 -7.458 1.00 0.00 C ATOM 757 O VAL A 50 1.579 3.463 -8.541 1.00 0.00 O ATOM 758 CB VAL A 50 -0.774 2.385 -6.343 1.00 0.00 C ATOM 759 CG1 VAL A 50 -1.523 3.628 -5.859 1.00 0.00 C ATOM 760 CG2 VAL A 50 -1.335 1.892 -7.678 1.00 0.00 C ATOM 0 H VAL A 50 0.636 2.825 -4.359 1.00 0.00 H new ATOM 0 HA VAL A 50 1.187 1.730 -6.799 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.923 1.597 -5.605 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.589 3.409 -5.795 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.152 3.916 -4.875 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.363 4.446 -6.561 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -2.405 1.708 -7.578 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -1.167 2.648 -8.445 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -0.833 0.968 -7.964 1.00 0.00 H new ATOM 770 N ASN A 51 0.780 4.982 -7.068 1.00 0.00 N ATOM 771 CA ASN A 51 1.051 6.122 -7.928 1.00 0.00 C ATOM 772 C ASN A 51 2.535 6.133 -8.301 1.00 0.00 C ATOM 773 O ASN A 51 2.882 6.210 -9.478 1.00 0.00 O ATOM 774 CB ASN A 51 0.734 7.438 -7.214 1.00 0.00 C ATOM 775 CG ASN A 51 -0.653 7.953 -7.604 1.00 0.00 C ATOM 776 OD1 ASN A 51 -0.918 8.296 -8.745 1.00 0.00 O ATOM 777 ND2 ASN A 51 -1.520 7.987 -6.597 1.00 0.00 N ATOM 0 H ASN A 51 0.360 5.216 -6.169 1.00 0.00 H new ATOM 0 HA ASN A 51 0.424 6.032 -8.815 1.00 0.00 H new ATOM 0 HB2 ASN A 51 0.781 7.291 -6.135 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.487 8.184 -7.467 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -2.473 8.315 -6.755 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -1.232 7.685 -5.666 1.00 0.00 H new ATOM 784 N SER A 52 3.371 6.054 -7.276 1.00 0.00 N ATOM 785 CA SER A 52 4.809 6.053 -7.481 1.00 0.00 C ATOM 786 C SER A 52 5.164 5.194 -8.697 1.00 0.00 C ATOM 787 O SER A 52 6.052 5.546 -9.472 1.00 0.00 O ATOM 788 CB SER A 52 5.543 5.544 -6.239 1.00 0.00 C ATOM 789 OG SER A 52 5.672 4.124 -6.240 1.00 0.00 O ATOM 0 H SER A 52 3.079 5.990 -6.301 1.00 0.00 H new ATOM 0 HA SER A 52 5.129 7.079 -7.663 1.00 0.00 H new ATOM 0 HB2 SER A 52 6.533 5.998 -6.191 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.004 5.859 -5.345 1.00 0.00 H new ATOM 0 HG SER A 52 4.784 3.715 -6.170 1.00 0.00 H new ATOM 795 N LEU A 53 4.451 4.085 -8.825 1.00 0.00 N ATOM 796 CA LEU A 53 4.680 3.173 -9.934 1.00 0.00 C ATOM 797 C LEU A 53 4.086 3.771 -11.211 1.00 0.00 C ATOM 798 O LEU A 53 4.820 4.223 -12.088 1.00 0.00 O ATOM 799 CB LEU A 53 4.144 1.779 -9.600 1.00 0.00 C ATOM 800 CG LEU A 53 4.571 1.202 -8.249 1.00 0.00 C ATOM 801 CD1 LEU A 53 3.588 0.129 -7.776 1.00 0.00 C ATOM 802 CD2 LEU A 53 6.007 0.679 -8.305 1.00 0.00 C ATOM 0 H LEU A 53 3.715 3.797 -8.180 1.00 0.00 H new ATOM 0 HA LEU A 53 5.748 3.045 -10.109 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.055 1.813 -9.630 1.00 0.00 H new ATOM 0 HB3 LEU A 53 4.463 1.092 -10.383 1.00 0.00 H new ATOM 0 HG LEU A 53 4.550 2.005 -7.513 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.915 -0.265 -6.814 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.595 0.566 -7.671 1.00 0.00 H new ATOM 0 HD13 LEU A 53 3.553 -0.680 -8.506 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.285 0.274 -7.332 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.079 -0.106 -9.058 1.00 0.00 H new ATOM 0 HD23 LEU A 53 6.681 1.495 -8.565 1.00 0.00 H new ATOM 814 N TYR A 54 2.763 3.753 -11.275 1.00 0.00 N ATOM 815 CA TYR A 54 2.062 4.288 -12.430 1.00 0.00 C ATOM 816 C TYR A 54 2.793 5.506 -12.999 1.00 0.00 C ATOM 817 O TYR A 54 3.464 6.230 -12.266 1.00 0.00 O ATOM 818 CB TYR A 54 0.686 4.725 -11.924 1.00 0.00 C ATOM 819 CG TYR A 54 -0.377 3.626 -11.984 1.00 0.00 C ATOM 820 CD1 TYR A 54 -1.127 3.454 -13.129 1.00 0.00 C ATOM 821 CD2 TYR A 54 -0.584 2.806 -10.894 1.00 0.00 C ATOM 822 CE1 TYR A 54 -2.128 2.420 -13.186 1.00 0.00 C ATOM 823 CE2 TYR A 54 -1.585 1.772 -10.951 1.00 0.00 C ATOM 824 CZ TYR A 54 -2.307 1.630 -12.094 1.00 0.00 C ATOM 825 OH TYR A 54 -3.252 0.653 -12.148 1.00 0.00 O ATOM 0 H TYR A 54 2.158 3.376 -10.546 1.00 0.00 H new ATOM 0 HA TYR A 54 1.998 3.540 -13.220 1.00 0.00 H new ATOM 0 HB2 TYR A 54 0.781 5.068 -10.894 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.347 5.577 -12.514 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.964 4.095 -13.983 1.00 0.00 H new ATOM 0 HD2 TYR A 54 0.004 2.939 -9.998 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -2.723 2.275 -14.076 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -1.758 1.124 -10.105 1.00 0.00 H new ATOM 0 HH TYR A 54 -3.689 0.669 -13.025 1.00 0.00 H new ATOM 835 N PRO A 55 2.634 5.698 -14.336 1.00 0.00 N ATOM 836 CA PRO A 55 3.271 6.815 -15.012 1.00 0.00 C ATOM 837 C PRO A 55 2.548 8.128 -14.703 1.00 0.00 C ATOM 838 O PRO A 55 1.568 8.140 -13.959 1.00 0.00 O ATOM 839 CB PRO A 55 3.238 6.453 -16.488 1.00 0.00 C ATOM 840 CG PRO A 55 2.177 5.374 -16.628 1.00 0.00 C ATOM 841 CD PRO A 55 1.848 4.860 -15.236 1.00 0.00 C ATOM 0 HA PRO A 55 4.296 6.979 -14.678 1.00 0.00 H new ATOM 0 HB2 PRO A 55 2.994 7.323 -17.098 1.00 0.00 H new ATOM 0 HB3 PRO A 55 4.210 6.091 -16.823 1.00 0.00 H new ATOM 0 HG2 PRO A 55 1.284 5.776 -17.107 1.00 0.00 H new ATOM 0 HG3 PRO A 55 2.539 4.562 -17.259 1.00 0.00 H new ATOM 0 HD2 PRO A 55 0.782 4.944 -15.025 1.00 0.00 H new ATOM 0 HD3 PRO A 55 2.113 3.808 -15.130 1.00 0.00 H new ATOM 849 N GLU A 56 3.060 9.201 -15.288 1.00 0.00 N ATOM 850 CA GLU A 56 2.475 10.515 -15.084 1.00 0.00 C ATOM 851 C GLU A 56 1.208 10.669 -15.928 1.00 0.00 C ATOM 852 O GLU A 56 0.273 11.362 -15.529 1.00 0.00 O ATOM 853 CB GLU A 56 3.485 11.620 -15.403 1.00 0.00 C ATOM 854 CG GLU A 56 4.134 12.156 -14.126 1.00 0.00 C ATOM 855 CD GLU A 56 3.445 13.439 -13.658 1.00 0.00 C ATOM 856 OE1 GLU A 56 2.291 13.327 -13.192 1.00 0.00 O ATOM 857 OE2 GLU A 56 4.088 14.504 -13.777 1.00 0.00 O ATOM 0 H GLU A 56 3.873 9.187 -15.903 1.00 0.00 H new ATOM 0 HA GLU A 56 2.201 10.611 -14.033 1.00 0.00 H new ATOM 0 HB2 GLU A 56 4.254 11.232 -16.071 1.00 0.00 H new ATOM 0 HB3 GLU A 56 2.985 12.433 -15.930 1.00 0.00 H new ATOM 0 HG2 GLU A 56 4.078 11.402 -13.341 1.00 0.00 H new ATOM 0 HG3 GLU A 56 5.191 12.351 -14.305 1.00 0.00 H new ATOM 864 N GLY A 57 1.218 10.012 -17.078 1.00 0.00 N ATOM 865 CA GLY A 57 0.082 10.068 -17.982 1.00 0.00 C ATOM 866 C GLY A 57 -0.937 8.976 -17.648 1.00 0.00 C ATOM 867 O GLY A 57 -1.534 8.384 -18.546 1.00 0.00 O ATOM 0 H GLY A 57 1.995 9.438 -17.405 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.393 11.047 -17.915 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.424 9.949 -19.010 1.00 0.00 H new ATOM 871 N SER A 58 -1.105 8.743 -16.355 1.00 0.00 N ATOM 872 CA SER A 58 -2.042 7.733 -15.892 1.00 0.00 C ATOM 873 C SER A 58 -2.687 8.180 -14.579 1.00 0.00 C ATOM 874 O SER A 58 -3.863 8.540 -14.551 1.00 0.00 O ATOM 875 CB SER A 58 -1.348 6.382 -15.710 1.00 0.00 C ATOM 876 OG SER A 58 -0.928 5.826 -16.952 1.00 0.00 O ATOM 0 H SER A 58 -0.608 9.236 -15.613 1.00 0.00 H new ATOM 0 HA SER A 58 -2.818 7.614 -16.648 1.00 0.00 H new ATOM 0 HB2 SER A 58 -0.484 6.503 -15.057 1.00 0.00 H new ATOM 0 HB3 SER A 58 -2.028 5.689 -15.214 1.00 0.00 H new ATOM 0 HG SER A 58 -0.635 4.901 -16.814 1.00 0.00 H new ATOM 882 N LYS A 59 -1.888 8.144 -13.522 1.00 0.00 N ATOM 883 CA LYS A 59 -2.367 8.541 -12.209 1.00 0.00 C ATOM 884 C LYS A 59 -3.773 7.978 -11.991 1.00 0.00 C ATOM 885 O LYS A 59 -4.763 8.624 -12.328 1.00 0.00 O ATOM 886 CB LYS A 59 -2.281 10.060 -12.043 1.00 0.00 C ATOM 887 CG LYS A 59 -0.993 10.460 -11.320 1.00 0.00 C ATOM 888 CD LYS A 59 0.229 10.238 -12.213 1.00 0.00 C ATOM 889 CE LYS A 59 1.482 9.981 -11.374 1.00 0.00 C ATOM 890 NZ LYS A 59 1.492 8.589 -10.870 1.00 0.00 N ATOM 0 H LYS A 59 -0.913 7.846 -13.548 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.731 8.122 -11.430 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -2.317 10.539 -13.021 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -3.144 10.418 -11.481 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.047 11.508 -11.026 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.890 9.877 -10.405 1.00 0.00 H new ATOM 0 HD2 LYS A 59 0.051 9.391 -12.875 1.00 0.00 H new ATOM 0 HD3 LYS A 59 0.384 11.111 -12.847 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.373 10.163 -11.975 1.00 0.00 H new ATOM 0 HE3 LYS A 59 1.515 10.678 -10.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 2.395 8.400 -10.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 0.708 8.457 -10.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.380 7.930 -11.667 1.00 0.00 H new ATOM 904 N PRO A 60 -3.815 6.747 -11.414 1.00 0.00 N ATOM 905 CA PRO A 60 -5.083 6.089 -11.147 1.00 0.00 C ATOM 906 C PRO A 60 -5.784 6.717 -9.940 1.00 0.00 C ATOM 907 O PRO A 60 -6.954 7.087 -10.021 1.00 0.00 O ATOM 908 CB PRO A 60 -4.730 4.626 -10.933 1.00 0.00 C ATOM 909 CG PRO A 60 -3.241 4.597 -10.628 1.00 0.00 C ATOM 910 CD PRO A 60 -2.662 5.952 -11.001 1.00 0.00 C ATOM 0 HA PRO A 60 -5.794 6.198 -11.966 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -5.306 4.202 -10.110 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -4.959 4.035 -11.820 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -3.072 4.387 -9.572 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -2.751 3.804 -11.193 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -2.148 6.409 -10.155 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -1.933 5.863 -11.807 1.00 0.00 H new ATOM 918 N VAL A 61 -5.038 6.820 -8.850 1.00 0.00 N ATOM 919 CA VAL A 61 -5.572 7.397 -7.629 1.00 0.00 C ATOM 920 C VAL A 61 -5.307 8.904 -7.623 1.00 0.00 C ATOM 921 O VAL A 61 -4.545 9.406 -8.448 1.00 0.00 O ATOM 922 CB VAL A 61 -4.985 6.681 -6.411 1.00 0.00 C ATOM 923 CG1 VAL A 61 -5.584 7.226 -5.113 1.00 0.00 C ATOM 924 CG2 VAL A 61 -5.184 5.168 -6.514 1.00 0.00 C ATOM 0 H VAL A 61 -4.067 6.513 -8.787 1.00 0.00 H new ATOM 0 HA VAL A 61 -6.652 7.257 -7.581 1.00 0.00 H new ATOM 0 HB VAL A 61 -3.913 6.876 -6.393 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -5.150 6.700 -4.263 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.366 8.291 -5.031 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.664 7.076 -5.119 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -4.757 4.684 -5.635 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.249 4.944 -6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.687 4.796 -7.410 1.00 0.00 H new ATOM 934 N LYS A 62 -5.950 9.582 -6.684 1.00 0.00 N ATOM 935 CA LYS A 62 -5.792 11.021 -6.560 1.00 0.00 C ATOM 936 C LYS A 62 -5.424 11.367 -5.116 1.00 0.00 C ATOM 937 O LYS A 62 -6.263 11.283 -4.220 1.00 0.00 O ATOM 938 CB LYS A 62 -7.043 11.742 -7.065 1.00 0.00 C ATOM 939 CG LYS A 62 -7.044 11.835 -8.592 1.00 0.00 C ATOM 940 CD LYS A 62 -7.514 13.215 -9.057 1.00 0.00 C ATOM 941 CE LYS A 62 -7.326 13.378 -10.567 1.00 0.00 C ATOM 942 NZ LYS A 62 -7.576 14.779 -10.972 1.00 0.00 N ATOM 0 H LYS A 62 -6.581 9.162 -6.002 1.00 0.00 H new ATOM 0 HA LYS A 62 -4.974 11.370 -7.190 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -7.934 11.211 -6.729 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -7.088 12.743 -6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -6.041 11.641 -8.972 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -7.696 11.066 -9.006 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -8.565 13.351 -8.801 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -6.955 13.990 -8.532 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -6.313 13.088 -10.847 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -8.007 12.713 -11.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -7.444 14.872 -11.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -8.550 15.044 -10.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -6.910 15.407 -10.479 1.00 0.00 H new ATOM 956 N VAL A 63 -4.168 11.748 -4.934 1.00 0.00 N ATOM 957 CA VAL A 63 -3.679 12.107 -3.614 1.00 0.00 C ATOM 958 C VAL A 63 -3.722 13.628 -3.455 1.00 0.00 C ATOM 959 O VAL A 63 -3.057 14.352 -4.195 1.00 0.00 O ATOM 960 CB VAL A 63 -2.281 11.523 -3.397 1.00 0.00 C ATOM 961 CG1 VAL A 63 -1.671 12.032 -2.090 1.00 0.00 C ATOM 962 CG2 VAL A 63 -2.316 9.993 -3.428 1.00 0.00 C ATOM 0 H VAL A 63 -3.474 11.816 -5.679 1.00 0.00 H new ATOM 0 HA VAL A 63 -4.319 11.681 -2.841 1.00 0.00 H new ATOM 0 HB VAL A 63 -1.645 11.860 -4.216 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -0.678 11.602 -1.960 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -1.594 13.119 -2.123 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -2.306 11.739 -1.254 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -1.310 9.603 -3.271 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.974 9.628 -2.639 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -2.689 9.657 -4.396 1.00 0.00 H new ATOM 972 N PRO A 64 -4.531 14.079 -2.459 1.00 0.00 N ATOM 973 CA PRO A 64 -4.669 15.501 -2.194 1.00 0.00 C ATOM 974 C PRO A 64 -3.431 16.049 -1.482 1.00 0.00 C ATOM 975 O PRO A 64 -2.509 15.298 -1.166 1.00 0.00 O ATOM 976 CB PRO A 64 -5.936 15.624 -1.361 1.00 0.00 C ATOM 977 CG PRO A 64 -6.203 14.237 -0.801 1.00 0.00 C ATOM 978 CD PRO A 64 -5.333 13.251 -1.563 1.00 0.00 C ATOM 0 HA PRO A 64 -4.747 16.093 -3.106 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -5.807 16.351 -0.559 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -6.772 15.967 -1.970 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -5.973 14.205 0.264 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -7.256 13.978 -0.908 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -4.702 12.674 -0.886 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -5.939 12.537 -2.120 1.00 0.00 H new ATOM 986 N GLU A 65 -3.449 17.354 -1.251 1.00 0.00 N ATOM 987 CA GLU A 65 -2.339 18.011 -0.583 1.00 0.00 C ATOM 988 C GLU A 65 -2.227 17.526 0.864 1.00 0.00 C ATOM 989 O GLU A 65 -1.194 16.995 1.267 1.00 0.00 O ATOM 990 CB GLU A 65 -2.487 19.533 -0.642 1.00 0.00 C ATOM 991 CG GLU A 65 -1.280 20.175 -1.329 1.00 0.00 C ATOM 992 CD GLU A 65 -1.312 21.698 -1.181 1.00 0.00 C ATOM 993 OE1 GLU A 65 -1.077 22.163 -0.045 1.00 0.00 O ATOM 994 OE2 GLU A 65 -1.570 22.362 -2.208 1.00 0.00 O ATOM 0 H GLU A 65 -4.215 17.974 -1.515 1.00 0.00 H new ATOM 0 HA GLU A 65 -1.419 17.748 -1.105 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.398 19.793 -1.182 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -2.590 19.931 0.367 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -0.360 19.783 -0.896 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -1.274 19.909 -2.386 1.00 0.00 H new ATOM 1001 N ASN A 66 -3.307 17.725 1.605 1.00 0.00 N ATOM 1002 CA ASN A 66 -3.344 17.315 2.999 1.00 0.00 C ATOM 1003 C ASN A 66 -4.127 16.006 3.120 1.00 0.00 C ATOM 1004 O ASN A 66 -5.093 15.787 2.391 1.00 0.00 O ATOM 1005 CB ASN A 66 -4.042 18.366 3.864 1.00 0.00 C ATOM 1006 CG ASN A 66 -5.492 18.567 3.420 1.00 0.00 C ATOM 1007 OD1 ASN A 66 -5.941 18.034 2.418 1.00 0.00 O ATOM 1008 ND2 ASN A 66 -6.196 19.365 4.217 1.00 0.00 N ATOM 0 H ASN A 66 -4.163 18.165 1.267 1.00 0.00 H new ATOM 0 HA ASN A 66 -2.317 17.191 3.342 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -4.018 18.057 4.909 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -3.504 19.312 3.799 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -7.174 19.564 4.005 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -5.758 19.779 5.040 1.00 0.00 H new ATOM 1015 N PRO A 67 -3.670 15.149 4.071 1.00 0.00 N ATOM 1016 CA PRO A 67 -4.318 13.868 4.298 1.00 0.00 C ATOM 1017 C PRO A 67 -5.641 14.046 5.045 1.00 0.00 C ATOM 1018 O PRO A 67 -5.764 14.927 5.895 1.00 0.00 O ATOM 1019 CB PRO A 67 -3.303 13.046 5.075 1.00 0.00 C ATOM 1020 CG PRO A 67 -2.315 14.045 5.657 1.00 0.00 C ATOM 1021 CD PRO A 67 -2.529 15.375 4.954 1.00 0.00 C ATOM 0 HA PRO A 67 -4.592 13.365 3.370 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -3.788 12.471 5.864 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -2.799 12.332 4.424 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -2.468 14.152 6.731 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -1.292 13.698 5.514 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -2.733 16.172 5.669 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -1.645 15.672 4.390 1.00 0.00 H new ATOM 1029 N PRO A 68 -6.623 13.174 4.692 1.00 0.00 N ATOM 1030 CA PRO A 68 -7.932 13.227 5.319 1.00 0.00 C ATOM 1031 C PRO A 68 -7.884 12.653 6.737 1.00 0.00 C ATOM 1032 O PRO A 68 -6.811 12.326 7.242 1.00 0.00 O ATOM 1033 CB PRO A 68 -8.845 12.443 4.391 1.00 0.00 C ATOM 1034 CG PRO A 68 -7.929 11.592 3.527 1.00 0.00 C ATOM 1035 CD PRO A 68 -6.513 12.118 3.689 1.00 0.00 C ATOM 0 HA PRO A 68 -8.297 14.246 5.446 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -9.537 11.820 4.958 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -9.448 13.113 3.779 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -7.984 10.546 3.828 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -8.237 11.640 2.482 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.833 11.331 4.015 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -6.124 12.505 2.747 1.00 0.00 H new ATOM 1043 N SER A 69 -9.060 12.549 7.339 1.00 0.00 N ATOM 1044 CA SER A 69 -9.166 12.020 8.688 1.00 0.00 C ATOM 1045 C SER A 69 -10.411 11.139 8.809 1.00 0.00 C ATOM 1046 O SER A 69 -10.344 10.033 9.343 1.00 0.00 O ATOM 1047 CB SER A 69 -9.212 13.148 9.720 1.00 0.00 C ATOM 1048 OG SER A 69 -8.375 12.881 10.842 1.00 0.00 O ATOM 0 H SER A 69 -9.948 12.822 6.917 1.00 0.00 H new ATOM 0 HA SER A 69 -8.281 11.416 8.889 1.00 0.00 H new ATOM 0 HB2 SER A 69 -8.902 14.081 9.250 1.00 0.00 H new ATOM 0 HB3 SER A 69 -10.239 13.287 10.059 1.00 0.00 H new ATOM 0 HG SER A 69 -8.431 13.626 11.477 1.00 0.00 H new ATOM 1054 N MET A 70 -11.518 11.662 8.303 1.00 0.00 N ATOM 1055 CA MET A 70 -12.777 10.937 8.348 1.00 0.00 C ATOM 1056 C MET A 70 -12.575 9.466 7.981 1.00 0.00 C ATOM 1057 O MET A 70 -11.586 9.112 7.340 1.00 0.00 O ATOM 1058 CB MET A 70 -13.768 11.576 7.373 1.00 0.00 C ATOM 1059 CG MET A 70 -14.858 12.343 8.124 1.00 0.00 C ATOM 1060 SD MET A 70 -16.164 12.807 6.999 1.00 0.00 S ATOM 1061 CE MET A 70 -16.962 14.083 7.959 1.00 0.00 C ATOM 0 H MET A 70 -11.570 12.579 7.860 1.00 0.00 H new ATOM 0 HA MET A 70 -13.169 10.988 9.364 1.00 0.00 H new ATOM 0 HB2 MET A 70 -13.239 12.253 6.702 1.00 0.00 H new ATOM 0 HB3 MET A 70 -14.223 10.804 6.753 1.00 0.00 H new ATOM 0 HG2 MET A 70 -15.261 11.726 8.927 1.00 0.00 H new ATOM 0 HG3 MET A 70 -14.434 13.233 8.588 1.00 0.00 H new ATOM 0 HE1 MET A 70 -17.807 14.485 7.400 1.00 0.00 H new ATOM 0 HE2 MET A 70 -17.317 13.662 8.900 1.00 0.00 H new ATOM 0 HE3 MET A 70 -16.250 14.882 8.165 1.00 0.00 H new ATOM 1071 N VAL A 71 -13.528 8.648 8.402 1.00 0.00 N ATOM 1072 CA VAL A 71 -13.467 7.223 8.126 1.00 0.00 C ATOM 1073 C VAL A 71 -13.757 6.982 6.643 1.00 0.00 C ATOM 1074 O VAL A 71 -12.888 6.522 5.904 1.00 0.00 O ATOM 1075 CB VAL A 71 -14.425 6.469 9.052 1.00 0.00 C ATOM 1076 CG1 VAL A 71 -14.507 4.990 8.668 1.00 0.00 C ATOM 1077 CG2 VAL A 71 -14.014 6.634 10.516 1.00 0.00 C ATOM 0 H VAL A 71 -14.347 8.945 8.932 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.468 6.837 8.329 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.418 6.902 8.932 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.194 4.477 9.341 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.868 4.900 7.643 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.518 4.539 8.746 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.710 6.089 11.153 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -13.008 6.240 10.658 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -14.030 7.691 10.782 1.00 0.00 H new ATOM 1087 N PHE A 72 -14.981 7.305 6.252 1.00 0.00 N ATOM 1088 CA PHE A 72 -15.396 7.130 4.871 1.00 0.00 C ATOM 1089 C PHE A 72 -14.275 7.524 3.907 1.00 0.00 C ATOM 1090 O PHE A 72 -14.025 6.830 2.923 1.00 0.00 O ATOM 1091 CB PHE A 72 -16.595 8.052 4.643 1.00 0.00 C ATOM 1092 CG PHE A 72 -17.871 7.603 5.359 1.00 0.00 C ATOM 1093 CD1 PHE A 72 -18.624 6.597 4.838 1.00 0.00 C ATOM 1094 CD2 PHE A 72 -18.251 8.208 6.516 1.00 0.00 C ATOM 1095 CE1 PHE A 72 -19.808 6.180 5.502 1.00 0.00 C ATOM 1096 CE2 PHE A 72 -19.435 7.791 7.180 1.00 0.00 C ATOM 1097 CZ PHE A 72 -20.188 6.786 6.659 1.00 0.00 C ATOM 0 H PHE A 72 -15.699 7.687 6.868 1.00 0.00 H new ATOM 0 HA PHE A 72 -15.646 6.085 4.688 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -16.337 9.056 4.978 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -16.794 8.115 3.573 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -18.321 6.116 3.920 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -17.652 9.006 6.930 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -20.407 5.382 5.088 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -19.737 8.272 8.099 1.00 0.00 H new ATOM 0 HZ PHE A 72 -21.088 6.469 7.164 1.00 0.00 H new ATOM 1107 N LYS A 73 -13.629 8.637 4.225 1.00 0.00 N ATOM 1108 CA LYS A 73 -12.540 9.131 3.400 1.00 0.00 C ATOM 1109 C LYS A 73 -11.378 8.138 3.447 1.00 0.00 C ATOM 1110 O LYS A 73 -11.057 7.504 2.442 1.00 0.00 O ATOM 1111 CB LYS A 73 -12.153 10.551 3.818 1.00 0.00 C ATOM 1112 CG LYS A 73 -12.877 11.592 2.962 1.00 0.00 C ATOM 1113 CD LYS A 73 -11.919 12.241 1.962 1.00 0.00 C ATOM 1114 CE LYS A 73 -12.642 13.284 1.107 1.00 0.00 C ATOM 1115 NZ LYS A 73 -13.199 12.659 -0.113 1.00 0.00 N ATOM 0 H LYS A 73 -13.839 9.210 5.042 1.00 0.00 H new ATOM 0 HA LYS A 73 -12.854 9.204 2.359 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -12.399 10.704 4.869 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -11.075 10.681 3.721 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -13.701 11.119 2.427 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -13.312 12.358 3.604 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -11.094 12.712 2.497 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -11.486 11.475 1.319 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -13.443 13.744 1.685 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -11.950 14.080 0.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.686 13.381 -0.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -12.428 12.241 -0.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -13.875 11.916 0.155 1.00 0.00 H new ATOM 1129 N GLN A 74 -10.779 8.032 4.624 1.00 0.00 N ATOM 1130 CA GLN A 74 -9.659 7.126 4.815 1.00 0.00 C ATOM 1131 C GLN A 74 -9.954 5.773 4.165 1.00 0.00 C ATOM 1132 O GLN A 74 -9.148 5.266 3.386 1.00 0.00 O ATOM 1133 CB GLN A 74 -9.335 6.961 6.301 1.00 0.00 C ATOM 1134 CG GLN A 74 -8.883 8.288 6.914 1.00 0.00 C ATOM 1135 CD GLN A 74 -7.374 8.480 6.755 1.00 0.00 C ATOM 1136 OE1 GLN A 74 -6.857 8.661 5.665 1.00 0.00 O ATOM 1137 NE2 GLN A 74 -6.698 8.430 7.899 1.00 0.00 N ATOM 0 H GLN A 74 -11.048 8.559 5.455 1.00 0.00 H new ATOM 0 HA GLN A 74 -8.782 7.556 4.331 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -10.214 6.593 6.830 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -8.552 6.213 6.425 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -9.411 9.113 6.434 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.147 8.313 7.971 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -7.193 8.275 8.777 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.685 8.547 7.898 1.00 0.00 H new ATOM 1146 N MET A 75 -11.112 5.227 4.508 1.00 0.00 N ATOM 1147 CA MET A 75 -11.523 3.943 3.967 1.00 0.00 C ATOM 1148 C MET A 75 -11.486 3.955 2.438 1.00 0.00 C ATOM 1149 O MET A 75 -10.947 3.038 1.819 1.00 0.00 O ATOM 1150 CB MET A 75 -12.941 3.620 4.442 1.00 0.00 C ATOM 1151 CG MET A 75 -12.924 3.008 5.844 1.00 0.00 C ATOM 1152 SD MET A 75 -13.908 1.518 5.872 1.00 0.00 S ATOM 1153 CE MET A 75 -12.767 0.409 6.682 1.00 0.00 C ATOM 0 H MET A 75 -11.778 5.651 5.154 1.00 0.00 H new ATOM 0 HA MET A 75 -10.829 3.181 4.322 1.00 0.00 H new ATOM 0 HB2 MET A 75 -13.543 4.529 4.445 1.00 0.00 H new ATOM 0 HB3 MET A 75 -13.413 2.928 3.745 1.00 0.00 H new ATOM 0 HG2 MET A 75 -11.899 2.782 6.139 1.00 0.00 H new ATOM 0 HG3 MET A 75 -13.313 3.724 6.567 1.00 0.00 H new ATOM 0 HE1 MET A 75 -12.867 -0.590 6.257 1.00 0.00 H new ATOM 0 HE2 MET A 75 -11.747 0.765 6.536 1.00 0.00 H new ATOM 0 HE3 MET A 75 -12.989 0.373 7.748 1.00 0.00 H new ATOM 1163 N GLU A 76 -12.067 5.002 1.872 1.00 0.00 N ATOM 1164 CA GLU A 76 -12.107 5.146 0.426 1.00 0.00 C ATOM 1165 C GLU A 76 -10.691 5.300 -0.131 1.00 0.00 C ATOM 1166 O GLU A 76 -10.315 4.611 -1.079 1.00 0.00 O ATOM 1167 CB GLU A 76 -12.989 6.327 0.017 1.00 0.00 C ATOM 1168 CG GLU A 76 -14.468 5.936 0.025 1.00 0.00 C ATOM 1169 CD GLU A 76 -15.229 6.643 -1.098 1.00 0.00 C ATOM 1170 OE1 GLU A 76 -14.808 6.473 -2.263 1.00 0.00 O ATOM 1171 OE2 GLU A 76 -16.214 7.337 -0.767 1.00 0.00 O ATOM 0 H GLU A 76 -12.514 5.759 2.388 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.547 4.243 0.002 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -12.826 7.161 0.700 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -12.705 6.670 -0.978 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -14.563 4.856 -0.091 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -14.911 6.194 0.987 1.00 0.00 H new ATOM 1178 N GLN A 77 -9.944 6.207 0.480 1.00 0.00 N ATOM 1179 CA GLN A 77 -8.577 6.460 0.056 1.00 0.00 C ATOM 1180 C GLN A 77 -7.865 5.142 -0.255 1.00 0.00 C ATOM 1181 O GLN A 77 -7.156 5.036 -1.255 1.00 0.00 O ATOM 1182 CB GLN A 77 -7.814 7.259 1.115 1.00 0.00 C ATOM 1183 CG GLN A 77 -6.402 7.599 0.632 1.00 0.00 C ATOM 1184 CD GLN A 77 -6.325 9.046 0.140 1.00 0.00 C ATOM 1185 OE1 GLN A 77 -6.729 9.980 0.812 1.00 0.00 O ATOM 1186 NE2 GLN A 77 -5.785 9.178 -1.068 1.00 0.00 N ATOM 0 H GLN A 77 -10.259 6.776 1.266 1.00 0.00 H new ATOM 0 HA GLN A 77 -8.604 7.059 -0.854 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -8.355 8.177 1.343 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -7.758 6.684 2.039 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -5.690 7.449 1.444 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -6.116 6.922 -0.173 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -5.467 8.353 -1.577 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -5.689 10.104 -1.485 1.00 0.00 H new ATOM 1195 N VAL A 78 -8.078 4.170 0.620 1.00 0.00 N ATOM 1196 CA VAL A 78 -7.466 2.863 0.451 1.00 0.00 C ATOM 1197 C VAL A 78 -8.092 2.163 -0.757 1.00 0.00 C ATOM 1198 O VAL A 78 -7.384 1.730 -1.664 1.00 0.00 O ATOM 1199 CB VAL A 78 -7.594 2.054 1.744 1.00 0.00 C ATOM 1200 CG1 VAL A 78 -6.993 0.657 1.578 1.00 0.00 C ATOM 1201 CG2 VAL A 78 -6.950 2.792 2.919 1.00 0.00 C ATOM 0 H VAL A 78 -8.666 4.262 1.448 1.00 0.00 H new ATOM 0 HA VAL A 78 -6.399 2.964 0.251 1.00 0.00 H new ATOM 0 HB VAL A 78 -8.655 1.938 1.963 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -7.097 0.103 2.511 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -7.516 0.128 0.782 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -5.937 0.743 1.323 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -7.055 2.195 3.825 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -5.892 2.953 2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -7.443 3.754 3.059 1.00 0.00 H new ATOM 1211 N ALA A 79 -9.414 2.075 -0.730 1.00 0.00 N ATOM 1212 CA ALA A 79 -10.144 1.436 -1.811 1.00 0.00 C ATOM 1213 C ALA A 79 -9.555 1.881 -3.151 1.00 0.00 C ATOM 1214 O ALA A 79 -9.328 1.059 -4.038 1.00 0.00 O ATOM 1215 CB ALA A 79 -11.632 1.767 -1.689 1.00 0.00 C ATOM 0 H ALA A 79 -9.998 2.436 0.024 1.00 0.00 H new ATOM 0 HA ALA A 79 -10.046 0.352 -1.752 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -12.179 1.287 -2.500 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -12.008 1.403 -0.733 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -11.770 2.847 -1.747 1.00 0.00 H new ATOM 1221 N GLN A 80 -9.325 3.182 -3.257 1.00 0.00 N ATOM 1222 CA GLN A 80 -8.767 3.747 -4.474 1.00 0.00 C ATOM 1223 C GLN A 80 -7.486 3.007 -4.864 1.00 0.00 C ATOM 1224 O GLN A 80 -7.262 2.722 -6.039 1.00 0.00 O ATOM 1225 CB GLN A 80 -8.507 5.246 -4.314 1.00 0.00 C ATOM 1226 CG GLN A 80 -9.811 6.005 -4.062 1.00 0.00 C ATOM 1227 CD GLN A 80 -9.542 7.490 -3.811 1.00 0.00 C ATOM 1228 OE1 GLN A 80 -9.934 7.916 -2.614 1.00 0.00 O flip ATOM 1229 NE2 GLN A 80 -9.014 8.202 -4.650 1.00 0.00 N flip ATOM 0 H GLN A 80 -9.515 3.861 -2.520 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.494 3.622 -5.276 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -7.819 5.413 -3.485 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -8.025 5.633 -5.212 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.473 5.892 -4.920 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.326 5.575 -3.203 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -8.737 7.810 -5.550 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -8.850 9.189 -4.451 1.00 0.00 H new ATOM 1238 N PHE A 81 -6.678 2.716 -3.855 1.00 0.00 N ATOM 1239 CA PHE A 81 -5.425 2.015 -4.077 1.00 0.00 C ATOM 1240 C PHE A 81 -5.666 0.521 -4.307 1.00 0.00 C ATOM 1241 O PHE A 81 -5.081 -0.073 -5.211 1.00 0.00 O ATOM 1242 CB PHE A 81 -4.581 2.194 -2.814 1.00 0.00 C ATOM 1243 CG PHE A 81 -3.608 1.044 -2.546 1.00 0.00 C ATOM 1244 CD1 PHE A 81 -2.586 0.803 -3.411 1.00 0.00 C ATOM 1245 CD2 PHE A 81 -3.765 0.263 -1.444 1.00 0.00 C ATOM 1246 CE1 PHE A 81 -1.683 -0.264 -3.163 1.00 0.00 C ATOM 1247 CE2 PHE A 81 -2.862 -0.804 -1.196 1.00 0.00 C ATOM 1248 CZ PHE A 81 -1.840 -1.045 -2.061 1.00 0.00 C ATOM 0 H PHE A 81 -6.867 2.953 -2.881 1.00 0.00 H new ATOM 0 HA PHE A 81 -4.926 2.416 -4.959 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -4.016 3.122 -2.896 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.246 2.300 -1.957 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.462 1.423 -4.286 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -4.577 0.454 -0.758 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -0.871 -0.455 -3.849 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -2.986 -1.424 -0.321 1.00 0.00 H new ATOM 0 HZ PHE A 81 -1.153 -1.857 -1.872 1.00 0.00 H new ATOM 1258 N LEU A 82 -6.528 -0.042 -3.474 1.00 0.00 N ATOM 1259 CA LEU A 82 -6.854 -1.454 -3.575 1.00 0.00 C ATOM 1260 C LEU A 82 -7.262 -1.777 -5.013 1.00 0.00 C ATOM 1261 O LEU A 82 -6.660 -2.635 -5.656 1.00 0.00 O ATOM 1262 CB LEU A 82 -7.909 -1.836 -2.535 1.00 0.00 C ATOM 1263 CG LEU A 82 -7.417 -1.948 -1.091 1.00 0.00 C ATOM 1264 CD1 LEU A 82 -8.579 -2.233 -0.137 1.00 0.00 C ATOM 1265 CD2 LEU A 82 -6.307 -2.993 -0.969 1.00 0.00 C ATOM 0 H LEU A 82 -7.011 0.455 -2.725 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.980 -2.064 -3.347 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -8.709 -1.096 -2.569 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -8.346 -2.792 -2.824 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.989 -0.988 -0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.202 -2.308 0.883 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -9.306 -1.423 -0.197 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.058 -3.171 -0.417 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.975 -3.052 0.068 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.686 -3.965 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -5.467 -2.708 -1.603 1.00 0.00 H new ATOM 1277 N LYS A 83 -8.284 -1.072 -5.477 1.00 0.00 N ATOM 1278 CA LYS A 83 -8.780 -1.273 -6.828 1.00 0.00 C ATOM 1279 C LYS A 83 -7.643 -1.037 -7.825 1.00 0.00 C ATOM 1280 O LYS A 83 -7.504 -1.775 -8.799 1.00 0.00 O ATOM 1281 CB LYS A 83 -10.011 -0.400 -7.082 1.00 0.00 C ATOM 1282 CG LYS A 83 -11.011 -1.115 -7.993 1.00 0.00 C ATOM 1283 CD LYS A 83 -12.359 -1.296 -7.292 1.00 0.00 C ATOM 1284 CE LYS A 83 -13.472 -1.568 -8.305 1.00 0.00 C ATOM 1285 NZ LYS A 83 -14.692 -2.049 -7.619 1.00 0.00 N ATOM 0 H LYS A 83 -8.782 -0.361 -4.941 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.114 -2.302 -6.962 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.489 -0.154 -6.134 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -9.706 0.541 -7.539 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -11.148 -0.541 -8.910 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.614 -2.088 -8.282 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.297 -2.123 -6.584 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.597 -0.401 -6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -13.696 -0.658 -8.861 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.139 -2.311 -9.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -15.437 -2.229 -8.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -14.479 -2.929 -7.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -15.018 -1.328 -6.945 1.00 0.00 H new ATOM 1299 N ALA A 84 -6.859 -0.006 -7.546 1.00 0.00 N ATOM 1300 CA ALA A 84 -5.739 0.336 -8.406 1.00 0.00 C ATOM 1301 C ALA A 84 -4.746 -0.827 -8.430 1.00 0.00 C ATOM 1302 O ALA A 84 -4.201 -1.162 -9.481 1.00 0.00 O ATOM 1303 CB ALA A 84 -5.100 1.638 -7.919 1.00 0.00 C ATOM 0 H ALA A 84 -6.977 0.603 -6.737 1.00 0.00 H new ATOM 0 HA ALA A 84 -6.078 0.502 -9.429 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.260 1.894 -8.564 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -5.838 2.439 -7.949 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.746 1.509 -6.896 1.00 0.00 H new ATOM 1309 N ALA A 85 -4.541 -1.413 -7.259 1.00 0.00 N ATOM 1310 CA ALA A 85 -3.623 -2.532 -7.133 1.00 0.00 C ATOM 1311 C ALA A 85 -4.017 -3.624 -8.130 1.00 0.00 C ATOM 1312 O ALA A 85 -3.207 -4.031 -8.961 1.00 0.00 O ATOM 1313 CB ALA A 85 -3.626 -3.034 -5.687 1.00 0.00 C ATOM 0 H ALA A 85 -4.995 -1.134 -6.389 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.605 -2.222 -7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.937 -3.874 -5.592 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.312 -2.230 -5.022 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -4.631 -3.357 -5.416 1.00 0.00 H new ATOM 1319 N GLU A 86 -5.260 -4.067 -8.013 1.00 0.00 N ATOM 1320 CA GLU A 86 -5.770 -5.104 -8.894 1.00 0.00 C ATOM 1321 C GLU A 86 -5.352 -4.825 -10.339 1.00 0.00 C ATOM 1322 O GLU A 86 -4.791 -5.694 -11.005 1.00 0.00 O ATOM 1323 CB GLU A 86 -7.291 -5.223 -8.776 1.00 0.00 C ATOM 1324 CG GLU A 86 -7.737 -6.682 -8.893 1.00 0.00 C ATOM 1325 CD GLU A 86 -9.122 -6.783 -9.535 1.00 0.00 C ATOM 1326 OE1 GLU A 86 -9.972 -5.936 -9.185 1.00 0.00 O ATOM 1327 OE2 GLU A 86 -9.299 -7.703 -10.362 1.00 0.00 O ATOM 0 H GLU A 86 -5.929 -3.727 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.339 -6.058 -8.590 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -7.618 -4.814 -7.820 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -7.768 -4.630 -9.556 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.015 -7.240 -9.489 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -7.756 -7.140 -7.904 1.00 0.00 H new ATOM 1334 N ASP A 87 -5.642 -3.611 -10.782 1.00 0.00 N ATOM 1335 CA ASP A 87 -5.303 -3.207 -12.136 1.00 0.00 C ATOM 1336 C ASP A 87 -3.880 -3.666 -12.459 1.00 0.00 C ATOM 1337 O ASP A 87 -3.656 -4.353 -13.455 1.00 0.00 O ATOM 1338 CB ASP A 87 -5.355 -1.685 -12.286 1.00 0.00 C ATOM 1339 CG ASP A 87 -6.078 -1.184 -13.538 1.00 0.00 C ATOM 1340 OD1 ASP A 87 -6.303 -2.022 -14.438 1.00 0.00 O ATOM 1341 OD2 ASP A 87 -6.390 0.027 -13.567 1.00 0.00 O ATOM 0 H ASP A 87 -6.108 -2.893 -10.227 1.00 0.00 H new ATOM 0 HA ASP A 87 -6.025 -3.661 -12.814 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.846 -1.265 -11.408 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.335 -1.301 -12.295 1.00 0.00 H new ATOM 1346 N TYR A 88 -2.954 -3.267 -11.600 1.00 0.00 N ATOM 1347 CA TYR A 88 -1.558 -3.628 -11.781 1.00 0.00 C ATOM 1348 C TYR A 88 -1.425 -5.077 -12.256 1.00 0.00 C ATOM 1349 O TYR A 88 -0.592 -5.380 -13.109 1.00 0.00 O ATOM 1350 CB TYR A 88 -0.905 -3.493 -10.405 1.00 0.00 C ATOM 1351 CG TYR A 88 0.587 -3.157 -10.454 1.00 0.00 C ATOM 1352 CD1 TYR A 88 1.006 -1.955 -10.988 1.00 0.00 C ATOM 1353 CD2 TYR A 88 1.513 -4.055 -9.964 1.00 0.00 C ATOM 1354 CE1 TYR A 88 2.410 -1.639 -11.035 1.00 0.00 C ATOM 1355 CE2 TYR A 88 2.917 -3.739 -10.011 1.00 0.00 C ATOM 1356 CZ TYR A 88 3.296 -2.546 -10.544 1.00 0.00 C ATOM 1357 OH TYR A 88 4.623 -2.248 -10.588 1.00 0.00 O ATOM 0 H TYR A 88 -3.143 -2.697 -10.776 1.00 0.00 H new ATOM 0 HA TYR A 88 -1.090 -2.989 -12.529 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -1.423 -2.716 -9.843 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -1.039 -4.426 -9.858 1.00 0.00 H new ATOM 0 HD1 TYR A 88 0.281 -1.252 -11.370 1.00 0.00 H new ATOM 0 HD2 TYR A 88 1.185 -4.995 -9.545 1.00 0.00 H new ATOM 0 HE1 TYR A 88 2.752 -0.703 -11.451 1.00 0.00 H new ATOM 0 HE2 TYR A 88 3.652 -4.433 -9.632 1.00 0.00 H new ATOM 0 HH TYR A 88 4.743 -1.277 -10.525 1.00 0.00 H new ATOM 1367 N GLY A 89 -2.257 -5.933 -11.682 1.00 0.00 N ATOM 1368 CA GLY A 89 -2.242 -7.342 -12.036 1.00 0.00 C ATOM 1369 C GLY A 89 -2.617 -8.213 -10.835 1.00 0.00 C ATOM 1370 O GLY A 89 -2.973 -9.379 -10.996 1.00 0.00 O ATOM 0 H GLY A 89 -2.946 -5.678 -10.974 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.940 -7.523 -12.853 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.251 -7.620 -12.396 1.00 0.00 H new ATOM 1374 N VAL A 90 -2.524 -7.613 -9.658 1.00 0.00 N ATOM 1375 CA VAL A 90 -2.848 -8.319 -8.430 1.00 0.00 C ATOM 1376 C VAL A 90 -4.132 -9.125 -8.635 1.00 0.00 C ATOM 1377 O VAL A 90 -4.983 -8.750 -9.440 1.00 0.00 O ATOM 1378 CB VAL A 90 -2.943 -7.330 -7.267 1.00 0.00 C ATOM 1379 CG1 VAL A 90 -3.378 -8.035 -5.981 1.00 0.00 C ATOM 1380 CG2 VAL A 90 -1.618 -6.591 -7.065 1.00 0.00 C ATOM 0 H VAL A 90 -2.229 -6.645 -9.528 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.057 -9.025 -8.175 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.704 -6.591 -7.518 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -3.437 -7.309 -5.170 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.356 -8.493 -6.130 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.651 -8.806 -5.725 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.713 -5.894 -6.232 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.829 -7.311 -6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -1.367 -6.041 -7.972 1.00 0.00 H new ATOM 1390 N ILE A 91 -4.232 -10.218 -7.892 1.00 0.00 N ATOM 1391 CA ILE A 91 -5.397 -11.081 -7.982 1.00 0.00 C ATOM 1392 C ILE A 91 -6.376 -10.727 -6.861 1.00 0.00 C ATOM 1393 O ILE A 91 -6.202 -9.722 -6.174 1.00 0.00 O ATOM 1394 CB ILE A 91 -4.976 -12.552 -7.990 1.00 0.00 C ATOM 1395 CG1 ILE A 91 -4.059 -12.866 -6.807 1.00 0.00 C ATOM 1396 CG2 ILE A 91 -4.338 -12.932 -9.328 1.00 0.00 C ATOM 1397 CD1 ILE A 91 -3.851 -14.374 -6.659 1.00 0.00 C ATOM 0 H ILE A 91 -3.524 -10.525 -7.225 1.00 0.00 H new ATOM 0 HA ILE A 91 -5.919 -10.919 -8.925 1.00 0.00 H new ATOM 0 HB ILE A 91 -5.870 -13.164 -7.875 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -3.096 -12.375 -6.948 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -4.491 -12.463 -5.891 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -4.048 -13.982 -9.307 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -5.055 -12.769 -10.132 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -3.456 -12.315 -9.499 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -3.195 -14.569 -5.811 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -4.813 -14.859 -6.494 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -3.397 -14.769 -7.567 1.00 0.00 H new ATOM 1409 N LYS A 92 -7.384 -11.574 -6.710 1.00 0.00 N ATOM 1410 CA LYS A 92 -8.390 -11.363 -5.683 1.00 0.00 C ATOM 1411 C LYS A 92 -8.121 -12.307 -4.509 1.00 0.00 C ATOM 1412 O LYS A 92 -8.875 -12.327 -3.538 1.00 0.00 O ATOM 1413 CB LYS A 92 -9.795 -11.502 -6.273 1.00 0.00 C ATOM 1414 CG LYS A 92 -10.081 -10.382 -7.276 1.00 0.00 C ATOM 1415 CD LYS A 92 -9.721 -10.816 -8.699 1.00 0.00 C ATOM 1416 CE LYS A 92 -10.838 -10.456 -9.680 1.00 0.00 C ATOM 1417 NZ LYS A 92 -10.342 -10.514 -11.074 1.00 0.00 N ATOM 0 H LYS A 92 -7.525 -12.407 -7.281 1.00 0.00 H new ATOM 0 HA LYS A 92 -8.330 -10.346 -5.295 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -9.893 -12.470 -6.765 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -10.534 -11.476 -5.472 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -11.135 -10.109 -7.231 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -9.510 -9.493 -7.007 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -8.793 -10.334 -9.006 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -9.545 -11.891 -8.722 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -11.674 -11.144 -9.556 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -11.213 -9.456 -9.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -11.146 -10.623 -11.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -9.832 -9.636 -11.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -9.699 -11.324 -11.180 1.00 0.00 H new ATOM 1431 N THR A 93 -7.043 -13.067 -4.638 1.00 0.00 N ATOM 1432 CA THR A 93 -6.664 -14.011 -3.600 1.00 0.00 C ATOM 1433 C THR A 93 -5.520 -13.446 -2.757 1.00 0.00 C ATOM 1434 O THR A 93 -5.134 -14.039 -1.751 1.00 0.00 O ATOM 1435 CB THR A 93 -6.323 -15.342 -4.274 1.00 0.00 C ATOM 1436 OG1 THR A 93 -7.432 -16.182 -3.964 1.00 0.00 O ATOM 1437 CG2 THR A 93 -5.131 -16.042 -3.617 1.00 0.00 C ATOM 0 H THR A 93 -6.420 -13.048 -5.446 1.00 0.00 H new ATOM 0 HA THR A 93 -7.484 -14.183 -2.903 1.00 0.00 H new ATOM 0 HB THR A 93 -6.108 -15.170 -5.329 1.00 0.00 H new ATOM 0 HG1 THR A 93 -7.295 -17.066 -4.364 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.931 -16.981 -4.133 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.253 -15.400 -3.679 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.359 -16.244 -2.571 1.00 0.00 H new ATOM 1445 N ASP A 94 -5.010 -12.306 -3.198 1.00 0.00 N ATOM 1446 CA ASP A 94 -3.917 -11.654 -2.496 1.00 0.00 C ATOM 1447 C ASP A 94 -4.395 -10.302 -1.961 1.00 0.00 C ATOM 1448 O ASP A 94 -3.680 -9.640 -1.210 1.00 0.00 O ATOM 1449 CB ASP A 94 -2.734 -11.400 -3.432 1.00 0.00 C ATOM 1450 CG ASP A 94 -3.107 -10.857 -4.813 1.00 0.00 C ATOM 1451 OD1 ASP A 94 -4.287 -10.479 -4.974 1.00 0.00 O ATOM 1452 OD2 ASP A 94 -2.203 -10.832 -5.676 1.00 0.00 O ATOM 0 H ASP A 94 -5.333 -11.817 -4.033 1.00 0.00 H new ATOM 0 HA ASP A 94 -3.600 -12.309 -1.684 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -2.055 -10.695 -2.952 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -2.185 -12.333 -3.561 1.00 0.00 H new ATOM 1457 N MET A 95 -5.600 -9.932 -2.370 1.00 0.00 N ATOM 1458 CA MET A 95 -6.181 -8.672 -1.941 1.00 0.00 C ATOM 1459 C MET A 95 -6.953 -8.841 -0.631 1.00 0.00 C ATOM 1460 O MET A 95 -7.640 -9.842 -0.436 1.00 0.00 O ATOM 1461 CB MET A 95 -7.126 -8.150 -3.026 1.00 0.00 C ATOM 1462 CG MET A 95 -6.344 -7.691 -4.259 1.00 0.00 C ATOM 1463 SD MET A 95 -5.540 -6.132 -3.926 1.00 0.00 S ATOM 1464 CE MET A 95 -6.852 -5.006 -4.365 1.00 0.00 C ATOM 0 H MET A 95 -6.189 -10.483 -2.994 1.00 0.00 H new ATOM 0 HA MET A 95 -5.373 -7.959 -1.775 1.00 0.00 H new ATOM 0 HB2 MET A 95 -7.830 -8.933 -3.308 1.00 0.00 H new ATOM 0 HB3 MET A 95 -7.713 -7.320 -2.633 1.00 0.00 H new ATOM 0 HG2 MET A 95 -5.602 -8.442 -4.529 1.00 0.00 H new ATOM 0 HG3 MET A 95 -7.018 -7.588 -5.110 1.00 0.00 H new ATOM 0 HE1 MET A 95 -6.709 -4.060 -3.843 1.00 0.00 H new ATOM 0 HE2 MET A 95 -6.838 -4.832 -5.441 1.00 0.00 H new ATOM 0 HE3 MET A 95 -7.812 -5.437 -4.080 1.00 0.00 H new ATOM 1474 N PHE A 96 -6.813 -7.847 0.234 1.00 0.00 N ATOM 1475 CA PHE A 96 -7.488 -7.873 1.520 1.00 0.00 C ATOM 1476 C PHE A 96 -8.651 -6.878 1.549 1.00 0.00 C ATOM 1477 O PHE A 96 -8.951 -6.239 0.542 1.00 0.00 O ATOM 1478 CB PHE A 96 -6.457 -7.465 2.575 1.00 0.00 C ATOM 1479 CG PHE A 96 -5.884 -6.061 2.374 1.00 0.00 C ATOM 1480 CD1 PHE A 96 -6.643 -4.969 2.660 1.00 0.00 C ATOM 1481 CD2 PHE A 96 -4.615 -5.904 1.911 1.00 0.00 C ATOM 1482 CE1 PHE A 96 -6.111 -3.666 2.474 1.00 0.00 C ATOM 1483 CE2 PHE A 96 -4.083 -4.601 1.725 1.00 0.00 C ATOM 1484 CZ PHE A 96 -4.842 -3.509 2.010 1.00 0.00 C ATOM 0 H PHE A 96 -6.242 -7.018 0.069 1.00 0.00 H new ATOM 0 HA PHE A 96 -7.891 -8.868 1.709 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -6.919 -7.520 3.561 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -5.639 -8.185 2.566 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -7.651 -5.093 3.029 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.012 -6.771 1.685 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -6.714 -2.799 2.701 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -3.075 -4.477 1.357 1.00 0.00 H new ATOM 0 HZ PHE A 96 -4.437 -2.518 1.868 1.00 0.00 H new ATOM 1494 N GLN A 97 -9.273 -6.779 2.715 1.00 0.00 N ATOM 1495 CA GLN A 97 -10.396 -5.873 2.889 1.00 0.00 C ATOM 1496 C GLN A 97 -9.943 -4.597 3.600 1.00 0.00 C ATOM 1497 O GLN A 97 -9.173 -4.655 4.558 1.00 0.00 O ATOM 1498 CB GLN A 97 -11.534 -6.552 3.653 1.00 0.00 C ATOM 1499 CG GLN A 97 -12.418 -7.370 2.708 1.00 0.00 C ATOM 1500 CD GLN A 97 -13.790 -6.715 2.537 1.00 0.00 C ATOM 1501 OE1 GLN A 97 -14.041 -5.610 2.990 1.00 0.00 O ATOM 1502 NE2 GLN A 97 -14.662 -7.457 1.860 1.00 0.00 N ATOM 0 H GLN A 97 -9.021 -7.311 3.548 1.00 0.00 H new ATOM 0 HA GLN A 97 -10.775 -5.601 1.904 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -11.122 -7.202 4.425 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -12.137 -5.798 4.160 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -11.931 -7.462 1.737 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.539 -8.380 3.100 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -14.387 -8.374 1.508 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -15.606 -7.109 1.693 1.00 0.00 H new ATOM 1511 N THR A 98 -10.440 -3.473 3.104 1.00 0.00 N ATOM 1512 CA THR A 98 -10.096 -2.184 3.679 1.00 0.00 C ATOM 1513 C THR A 98 -9.998 -2.290 5.203 1.00 0.00 C ATOM 1514 O THR A 98 -9.098 -1.714 5.812 1.00 0.00 O ATOM 1515 CB THR A 98 -11.132 -1.163 3.206 1.00 0.00 C ATOM 1516 OG1 THR A 98 -11.059 -1.227 1.785 1.00 0.00 O ATOM 1517 CG2 THR A 98 -10.730 0.276 3.536 1.00 0.00 C ATOM 0 H THR A 98 -11.079 -3.429 2.310 1.00 0.00 H new ATOM 0 HA THR A 98 -9.114 -1.850 3.343 1.00 0.00 H new ATOM 0 HB THR A 98 -12.095 -1.385 3.665 1.00 0.00 H new ATOM 0 HG1 THR A 98 -11.701 -0.597 1.396 1.00 0.00 H new ATOM 0 HG21 THR A 98 -11.500 0.960 3.179 1.00 0.00 H new ATOM 0 HG22 THR A 98 -10.621 0.385 4.615 1.00 0.00 H new ATOM 0 HG23 THR A 98 -9.783 0.510 3.050 1.00 0.00 H new ATOM 1525 N VAL A 99 -10.937 -3.030 5.774 1.00 0.00 N ATOM 1526 CA VAL A 99 -10.968 -3.218 7.214 1.00 0.00 C ATOM 1527 C VAL A 99 -9.724 -3.995 7.650 1.00 0.00 C ATOM 1528 O VAL A 99 -9.000 -3.564 8.546 1.00 0.00 O ATOM 1529 CB VAL A 99 -12.274 -3.902 7.625 1.00 0.00 C ATOM 1530 CG1 VAL A 99 -12.281 -5.371 7.197 1.00 0.00 C ATOM 1531 CG2 VAL A 99 -12.514 -3.767 9.130 1.00 0.00 C ATOM 0 H VAL A 99 -11.682 -3.506 5.265 1.00 0.00 H new ATOM 0 HA VAL A 99 -10.946 -2.255 7.725 1.00 0.00 H new ATOM 0 HB VAL A 99 -13.093 -3.399 7.110 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -13.220 -5.834 7.501 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -12.179 -5.435 6.114 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -11.449 -5.892 7.671 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -13.448 -4.262 9.395 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -11.691 -4.231 9.673 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -12.574 -2.712 9.396 1.00 0.00 H new ATOM 1541 N ASP A 100 -9.514 -5.128 6.995 1.00 0.00 N ATOM 1542 CA ASP A 100 -8.370 -5.969 7.303 1.00 0.00 C ATOM 1543 C ASP A 100 -7.149 -5.086 7.567 1.00 0.00 C ATOM 1544 O ASP A 100 -6.271 -5.450 8.348 1.00 0.00 O ATOM 1545 CB ASP A 100 -8.038 -6.897 6.133 1.00 0.00 C ATOM 1546 CG ASP A 100 -9.105 -7.947 5.818 1.00 0.00 C ATOM 1547 OD1 ASP A 100 -9.874 -8.272 6.748 1.00 0.00 O ATOM 1548 OD2 ASP A 100 -9.129 -8.400 4.653 1.00 0.00 O ATOM 0 H ASP A 100 -10.117 -5.483 6.253 1.00 0.00 H new ATOM 0 HA ASP A 100 -8.618 -6.568 8.179 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -7.873 -6.290 5.243 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -7.100 -7.408 6.349 1.00 0.00 H new ATOM 1553 N LEU A 101 -7.132 -3.940 6.901 1.00 0.00 N ATOM 1554 CA LEU A 101 -6.033 -3.002 7.053 1.00 0.00 C ATOM 1555 C LEU A 101 -6.443 -1.897 8.029 1.00 0.00 C ATOM 1556 O LEU A 101 -5.822 -1.729 9.078 1.00 0.00 O ATOM 1557 CB LEU A 101 -5.581 -2.480 5.688 1.00 0.00 C ATOM 1558 CG LEU A 101 -4.612 -1.296 5.710 1.00 0.00 C ATOM 1559 CD1 LEU A 101 -3.398 -1.597 6.590 1.00 0.00 C ATOM 1560 CD2 LEU A 101 -4.207 -0.893 4.291 1.00 0.00 C ATOM 0 H LEU A 101 -7.862 -3.640 6.255 1.00 0.00 H new ATOM 0 HA LEU A 101 -5.163 -3.500 7.481 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -5.110 -3.300 5.146 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.466 -2.190 5.121 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.125 -0.442 6.153 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -2.726 -0.739 6.588 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -3.728 -1.797 7.609 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -2.874 -2.470 6.201 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -3.518 -0.049 4.335 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -3.719 -1.735 3.799 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.095 -0.607 3.727 1.00 0.00 H new ATOM 1572 N TYR A 102 -7.486 -1.174 7.650 1.00 0.00 N ATOM 1573 CA TYR A 102 -7.987 -0.090 8.479 1.00 0.00 C ATOM 1574 C TYR A 102 -8.094 -0.524 9.942 1.00 0.00 C ATOM 1575 O TYR A 102 -7.511 0.105 10.824 1.00 0.00 O ATOM 1576 CB TYR A 102 -9.386 0.233 7.951 1.00 0.00 C ATOM 1577 CG TYR A 102 -9.918 1.597 8.394 1.00 0.00 C ATOM 1578 CD1 TYR A 102 -9.187 2.740 8.138 1.00 0.00 C ATOM 1579 CD2 TYR A 102 -11.129 1.686 9.048 1.00 0.00 C ATOM 1580 CE1 TYR A 102 -9.688 4.024 8.554 1.00 0.00 C ATOM 1581 CE2 TYR A 102 -11.630 2.970 9.465 1.00 0.00 C ATOM 1582 CZ TYR A 102 -10.885 4.076 9.197 1.00 0.00 C ATOM 1583 OH TYR A 102 -11.358 5.288 9.591 1.00 0.00 O ATOM 0 H TYR A 102 -7.998 -1.317 6.780 1.00 0.00 H new ATOM 0 HA TYR A 102 -7.316 0.768 8.436 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.369 0.197 6.862 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -10.077 -0.541 8.285 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -8.239 2.671 7.625 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -11.702 0.792 9.247 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -9.126 4.925 8.360 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -12.576 3.053 9.979 1.00 0.00 H new ATOM 0 HH TYR A 102 -10.720 5.987 9.335 1.00 0.00 H new ATOM 1593 N GLU A 103 -8.844 -1.595 10.155 1.00 0.00 N ATOM 1594 CA GLU A 103 -9.035 -2.120 11.496 1.00 0.00 C ATOM 1595 C GLU A 103 -8.119 -3.322 11.732 1.00 0.00 C ATOM 1596 O GLU A 103 -8.402 -4.167 12.580 1.00 0.00 O ATOM 1597 CB GLU A 103 -10.500 -2.491 11.736 1.00 0.00 C ATOM 1598 CG GLU A 103 -11.422 -1.307 11.438 1.00 0.00 C ATOM 1599 CD GLU A 103 -12.804 -1.518 12.060 1.00 0.00 C ATOM 1600 OE1 GLU A 103 -13.498 -2.449 11.598 1.00 0.00 O ATOM 1601 OE2 GLU A 103 -13.134 -0.744 12.984 1.00 0.00 O ATOM 0 H GLU A 103 -9.327 -2.114 9.421 1.00 0.00 H new ATOM 0 HA GLU A 103 -8.770 -1.341 12.211 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -10.773 -3.337 11.105 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -10.634 -2.809 12.770 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -10.980 -0.390 11.828 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -11.520 -1.180 10.360 1.00 0.00 H new ATOM 1608 N GLY A 104 -7.038 -3.361 10.966 1.00 0.00 N ATOM 1609 CA GLY A 104 -6.079 -4.446 11.080 1.00 0.00 C ATOM 1610 C GLY A 104 -6.787 -5.782 11.315 1.00 0.00 C ATOM 1611 O GLY A 104 -6.234 -6.679 11.950 1.00 0.00 O ATOM 0 H GLY A 104 -6.806 -2.658 10.264 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.480 -4.503 10.171 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.393 -4.245 11.903 1.00 0.00 H new ATOM 1615 N LYS A 105 -8.000 -5.873 10.789 1.00 0.00 N ATOM 1616 CA LYS A 105 -8.789 -7.084 10.934 1.00 0.00 C ATOM 1617 C LYS A 105 -7.923 -8.296 10.587 1.00 0.00 C ATOM 1618 O LYS A 105 -8.046 -9.350 11.210 1.00 0.00 O ATOM 1619 CB LYS A 105 -10.073 -6.989 10.107 1.00 0.00 C ATOM 1620 CG LYS A 105 -11.309 -7.012 11.008 1.00 0.00 C ATOM 1621 CD LYS A 105 -12.241 -8.165 10.632 1.00 0.00 C ATOM 1622 CE LYS A 105 -13.468 -7.654 9.876 1.00 0.00 C ATOM 1623 NZ LYS A 105 -14.673 -7.730 10.732 1.00 0.00 N ATOM 0 H LYS A 105 -8.455 -5.128 10.262 1.00 0.00 H new ATOM 0 HA LYS A 105 -9.111 -7.207 11.968 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -10.064 -6.071 9.519 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -10.117 -7.819 9.401 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -11.002 -7.112 12.049 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.843 -6.066 10.923 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -11.704 -8.885 10.015 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -12.557 -8.690 11.533 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.304 -6.624 9.559 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -13.618 -8.245 8.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.497 -7.379 10.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -14.837 -8.718 11.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.533 -7.147 11.581 1.00 0.00 H new ATOM 1637 N ASP A 106 -7.066 -8.107 9.594 1.00 0.00 N ATOM 1638 CA ASP A 106 -6.179 -9.172 9.157 1.00 0.00 C ATOM 1639 C ASP A 106 -4.909 -8.561 8.563 1.00 0.00 C ATOM 1640 O ASP A 106 -4.957 -7.921 7.513 1.00 0.00 O ATOM 1641 CB ASP A 106 -6.841 -10.031 8.078 1.00 0.00 C ATOM 1642 CG ASP A 106 -7.990 -10.915 8.568 1.00 0.00 C ATOM 1643 OD1 ASP A 106 -8.935 -10.343 9.152 1.00 0.00 O ATOM 1644 OD2 ASP A 106 -7.896 -12.141 8.348 1.00 0.00 O ATOM 0 H ASP A 106 -6.967 -7.232 9.079 1.00 0.00 H new ATOM 0 HA ASP A 106 -5.947 -9.794 10.021 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -7.217 -9.375 7.293 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -6.081 -10.667 7.625 1.00 0.00 H new ATOM 1649 N MET A 107 -3.803 -8.779 9.259 1.00 0.00 N ATOM 1650 CA MET A 107 -2.523 -8.258 8.813 1.00 0.00 C ATOM 1651 C MET A 107 -1.852 -9.219 7.830 1.00 0.00 C ATOM 1652 O MET A 107 -1.140 -8.789 6.924 1.00 0.00 O ATOM 1653 CB MET A 107 -1.610 -8.044 10.022 1.00 0.00 C ATOM 1654 CG MET A 107 -2.352 -7.323 11.149 1.00 0.00 C ATOM 1655 SD MET A 107 -3.014 -5.777 10.553 1.00 0.00 S ATOM 1656 CE MET A 107 -1.576 -5.124 9.721 1.00 0.00 C ATOM 0 H MET A 107 -3.767 -9.310 10.129 1.00 0.00 H new ATOM 0 HA MET A 107 -2.695 -7.310 8.304 1.00 0.00 H new ATOM 0 HB2 MET A 107 -1.244 -9.006 10.380 1.00 0.00 H new ATOM 0 HB3 MET A 107 -0.738 -7.461 9.725 1.00 0.00 H new ATOM 0 HG2 MET A 107 -3.158 -7.952 11.525 1.00 0.00 H new ATOM 0 HG3 MET A 107 -1.674 -7.140 11.983 1.00 0.00 H new ATOM 0 HE1 MET A 107 -1.800 -4.130 9.333 1.00 0.00 H new ATOM 0 HE2 MET A 107 -0.746 -5.061 10.425 1.00 0.00 H new ATOM 0 HE3 MET A 107 -1.303 -5.782 8.896 1.00 0.00 H new ATOM 1666 N ALA A 108 -2.103 -10.503 8.042 1.00 0.00 N ATOM 1667 CA ALA A 108 -1.532 -11.528 7.186 1.00 0.00 C ATOM 1668 C ALA A 108 -1.920 -11.248 5.733 1.00 0.00 C ATOM 1669 O ALA A 108 -1.171 -11.573 4.813 1.00 0.00 O ATOM 1670 CB ALA A 108 -1.999 -12.906 7.659 1.00 0.00 C ATOM 0 H ALA A 108 -2.694 -10.856 8.794 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.444 -11.514 7.245 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -1.571 -13.676 7.017 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -1.673 -13.068 8.686 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.087 -12.958 7.611 1.00 0.00 H new ATOM 1676 N ALA A 109 -3.090 -10.647 5.572 1.00 0.00 N ATOM 1677 CA ALA A 109 -3.586 -10.319 4.246 1.00 0.00 C ATOM 1678 C ALA A 109 -2.897 -9.047 3.748 1.00 0.00 C ATOM 1679 O ALA A 109 -2.360 -9.021 2.642 1.00 0.00 O ATOM 1680 CB ALA A 109 -5.109 -10.176 4.292 1.00 0.00 C ATOM 0 H ALA A 109 -3.709 -10.379 6.337 1.00 0.00 H new ATOM 0 HA ALA A 109 -3.354 -11.117 3.541 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -5.482 -9.930 3.298 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -5.553 -11.115 4.624 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -5.379 -9.381 4.987 1.00 0.00 H new ATOM 1686 N VAL A 110 -2.933 -8.024 4.590 1.00 0.00 N ATOM 1687 CA VAL A 110 -2.318 -6.753 4.249 1.00 0.00 C ATOM 1688 C VAL A 110 -0.989 -7.009 3.535 1.00 0.00 C ATOM 1689 O VAL A 110 -0.566 -6.212 2.698 1.00 0.00 O ATOM 1690 CB VAL A 110 -2.166 -5.892 5.504 1.00 0.00 C ATOM 1691 CG1 VAL A 110 -1.367 -4.622 5.204 1.00 0.00 C ATOM 1692 CG2 VAL A 110 -3.531 -5.552 6.105 1.00 0.00 C ATOM 0 H VAL A 110 -3.378 -8.050 5.507 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.953 -6.194 3.562 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.611 -6.471 6.242 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -1.274 -4.028 6.113 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.375 -4.893 4.844 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.883 -4.039 4.441 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -3.394 -4.939 6.996 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -4.124 -5.002 5.374 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.050 -6.472 6.374 1.00 0.00 H new ATOM 1702 N GLN A 111 -0.368 -8.124 3.891 1.00 0.00 N ATOM 1703 CA GLN A 111 0.904 -8.495 3.295 1.00 0.00 C ATOM 1704 C GLN A 111 0.680 -9.147 1.929 1.00 0.00 C ATOM 1705 O GLN A 111 1.252 -8.715 0.929 1.00 0.00 O ATOM 1706 CB GLN A 111 1.694 -9.421 4.221 1.00 0.00 C ATOM 1707 CG GLN A 111 2.174 -8.672 5.466 1.00 0.00 C ATOM 1708 CD GLN A 111 2.642 -9.648 6.547 1.00 0.00 C ATOM 1709 OE1 GLN A 111 1.870 -10.406 7.111 1.00 0.00 O ATOM 1710 NE2 GLN A 111 3.945 -9.588 6.804 1.00 0.00 N ATOM 0 H GLN A 111 -0.722 -8.783 4.585 1.00 0.00 H new ATOM 0 HA GLN A 111 1.494 -7.589 3.152 1.00 0.00 H new ATOM 0 HB2 GLN A 111 1.070 -10.264 4.517 1.00 0.00 H new ATOM 0 HB3 GLN A 111 2.551 -9.831 3.686 1.00 0.00 H new ATOM 0 HG2 GLN A 111 2.990 -8.001 5.199 1.00 0.00 H new ATOM 0 HG3 GLN A 111 1.367 -8.052 5.856 1.00 0.00 H new ATOM 0 HE21 GLN A 111 4.535 -8.930 6.295 1.00 0.00 H new ATOM 0 HE22 GLN A 111 4.354 -10.200 7.510 1.00 0.00 H new ATOM 1719 N ARG A 112 -0.154 -10.176 1.930 1.00 0.00 N ATOM 1720 CA ARG A 112 -0.461 -10.892 0.703 1.00 0.00 C ATOM 1721 C ARG A 112 -0.676 -9.906 -0.447 1.00 0.00 C ATOM 1722 O ARG A 112 -0.302 -10.184 -1.586 1.00 0.00 O ATOM 1723 CB ARG A 112 -1.714 -11.755 0.867 1.00 0.00 C ATOM 1724 CG ARG A 112 -1.536 -13.115 0.190 1.00 0.00 C ATOM 1725 CD ARG A 112 -2.086 -14.241 1.068 1.00 0.00 C ATOM 1726 NE ARG A 112 -1.009 -15.202 1.394 1.00 0.00 N ATOM 1727 CZ ARG A 112 -0.107 -15.017 2.368 1.00 0.00 C ATOM 1728 NH1 ARG A 112 -0.147 -13.907 3.117 1.00 0.00 N ATOM 1729 NH2 ARG A 112 0.835 -15.943 2.593 1.00 0.00 N ATOM 0 H ARG A 112 -0.627 -10.531 2.761 1.00 0.00 H new ATOM 0 HA ARG A 112 0.385 -11.540 0.477 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -1.926 -11.897 1.927 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -2.573 -11.240 0.437 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -2.048 -13.116 -0.772 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.479 -13.289 -0.011 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.504 -13.826 1.985 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -2.897 -14.753 0.551 1.00 0.00 H new ATOM 0 HE ARG A 112 -0.949 -16.058 0.843 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -0.864 -13.202 2.946 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.540 -13.767 3.858 1.00 0.00 H new ATOM 0 HH21 ARG A 112 0.866 -16.788 2.023 1.00 0.00 H new ATOM 0 HH22 ARG A 112 1.522 -15.802 3.334 1.00 0.00 H new ATOM 1743 N THR A 113 -1.279 -8.775 -0.110 1.00 0.00 N ATOM 1744 CA THR A 113 -1.548 -7.747 -1.100 1.00 0.00 C ATOM 1745 C THR A 113 -0.239 -7.149 -1.619 1.00 0.00 C ATOM 1746 O THR A 113 0.126 -7.354 -2.776 1.00 0.00 O ATOM 1747 CB THR A 113 -2.479 -6.711 -0.466 1.00 0.00 C ATOM 1748 OG1 THR A 113 -3.744 -7.365 -0.419 1.00 0.00 O ATOM 1749 CG2 THR A 113 -2.717 -5.503 -1.374 1.00 0.00 C ATOM 0 H THR A 113 -1.589 -8.548 0.835 1.00 0.00 H new ATOM 0 HA THR A 113 -2.048 -8.163 -1.975 1.00 0.00 H new ATOM 0 HB THR A 113 -2.056 -6.375 0.481 1.00 0.00 H new ATOM 0 HG1 THR A 113 -3.611 -8.336 -0.424 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.384 -4.799 -0.876 1.00 0.00 H new ATOM 0 HG22 THR A 113 -1.766 -5.014 -1.586 1.00 0.00 H new ATOM 0 HG23 THR A 113 -3.171 -5.834 -2.308 1.00 0.00 H new ATOM 1757 N LEU A 114 0.433 -6.423 -0.738 1.00 0.00 N ATOM 1758 CA LEU A 114 1.695 -5.795 -1.092 1.00 0.00 C ATOM 1759 C LEU A 114 2.617 -6.836 -1.729 1.00 0.00 C ATOM 1760 O LEU A 114 3.229 -6.578 -2.764 1.00 0.00 O ATOM 1761 CB LEU A 114 2.305 -5.095 0.124 1.00 0.00 C ATOM 1762 CG LEU A 114 1.419 -4.055 0.814 1.00 0.00 C ATOM 1763 CD1 LEU A 114 1.883 -3.805 2.250 1.00 0.00 C ATOM 1764 CD2 LEU A 114 1.354 -2.762 -0.001 1.00 0.00 C ATOM 0 H LEU A 114 0.127 -6.255 0.221 1.00 0.00 H new ATOM 0 HA LEU A 114 1.536 -5.013 -1.834 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.578 -5.855 0.857 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.228 -4.607 -0.188 1.00 0.00 H new ATOM 0 HG LEU A 114 0.405 -4.452 0.868 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.236 -3.062 2.717 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.834 -4.736 2.815 1.00 0.00 H new ATOM 0 HD13 LEU A 114 2.910 -3.439 2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.718 -2.040 0.512 1.00 0.00 H new ATOM 0 HD22 LEU A 114 2.357 -2.349 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 114 0.940 -2.974 -0.987 1.00 0.00 H new ATOM 1776 N MET A 115 2.688 -7.991 -1.083 1.00 0.00 N ATOM 1777 CA MET A 115 3.525 -9.073 -1.574 1.00 0.00 C ATOM 1778 C MET A 115 3.350 -9.261 -3.082 1.00 0.00 C ATOM 1779 O MET A 115 4.301 -9.602 -3.783 1.00 0.00 O ATOM 1780 CB MET A 115 3.159 -10.370 -0.851 1.00 0.00 C ATOM 1781 CG MET A 115 4.131 -10.653 0.296 1.00 0.00 C ATOM 1782 SD MET A 115 4.973 -12.201 0.015 1.00 0.00 S ATOM 1783 CE MET A 115 6.637 -11.607 -0.242 1.00 0.00 C ATOM 0 H MET A 115 2.180 -8.201 -0.224 1.00 0.00 H new ATOM 0 HA MET A 115 4.567 -8.819 -1.378 1.00 0.00 H new ATOM 0 HB2 MET A 115 2.143 -10.299 -0.462 1.00 0.00 H new ATOM 0 HB3 MET A 115 3.173 -11.200 -1.557 1.00 0.00 H new ATOM 0 HG2 MET A 115 4.857 -9.844 0.376 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.590 -10.690 1.241 1.00 0.00 H new ATOM 0 HE1 MET A 115 7.061 -12.084 -1.125 1.00 0.00 H new ATOM 0 HE2 MET A 115 6.620 -10.527 -0.386 1.00 0.00 H new ATOM 0 HE3 MET A 115 7.248 -11.847 0.628 1.00 0.00 H new ATOM 1793 N ALA A 116 2.127 -9.031 -3.537 1.00 0.00 N ATOM 1794 CA ALA A 116 1.815 -9.171 -4.949 1.00 0.00 C ATOM 1795 C ALA A 116 2.304 -7.932 -5.700 1.00 0.00 C ATOM 1796 O ALA A 116 3.046 -8.045 -6.675 1.00 0.00 O ATOM 1797 CB ALA A 116 0.311 -9.401 -5.119 1.00 0.00 C ATOM 0 H ALA A 116 1.340 -8.749 -2.952 1.00 0.00 H new ATOM 0 HA ALA A 116 2.327 -10.036 -5.372 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.076 -9.506 -6.178 1.00 0.00 H new ATOM 0 HB2 ALA A 116 0.020 -10.309 -4.591 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.236 -8.552 -4.709 1.00 0.00 H new ATOM 1803 N LEU A 117 1.870 -6.777 -5.218 1.00 0.00 N ATOM 1804 CA LEU A 117 2.255 -5.518 -5.832 1.00 0.00 C ATOM 1805 C LEU A 117 3.756 -5.536 -6.127 1.00 0.00 C ATOM 1806 O LEU A 117 4.164 -5.636 -7.283 1.00 0.00 O ATOM 1807 CB LEU A 117 1.814 -4.340 -4.961 1.00 0.00 C ATOM 1808 CG LEU A 117 1.716 -2.985 -5.665 1.00 0.00 C ATOM 1809 CD1 LEU A 117 0.733 -3.045 -6.835 1.00 0.00 C ATOM 1810 CD2 LEU A 117 1.358 -1.876 -4.672 1.00 0.00 C ATOM 0 H LEU A 117 1.255 -6.687 -4.409 1.00 0.00 H new ATOM 0 HA LEU A 117 1.744 -5.388 -6.786 1.00 0.00 H new ATOM 0 HB2 LEU A 117 0.840 -4.576 -4.532 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.514 -4.246 -4.131 1.00 0.00 H new ATOM 0 HG LEU A 117 2.695 -2.744 -6.079 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.682 -2.069 -7.318 1.00 0.00 H new ATOM 0 HD12 LEU A 117 1.071 -3.790 -7.556 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -0.255 -3.319 -6.466 1.00 0.00 H new ATOM 0 HD21 LEU A 117 1.295 -0.923 -5.198 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.397 -2.099 -4.208 1.00 0.00 H new ATOM 0 HD23 LEU A 117 2.127 -1.815 -3.902 1.00 0.00 H new ATOM 1822 N GLY A 118 4.537 -5.439 -5.061 1.00 0.00 N ATOM 1823 CA GLY A 118 5.984 -5.444 -5.191 1.00 0.00 C ATOM 1824 C GLY A 118 6.438 -6.468 -6.233 1.00 0.00 C ATOM 1825 O GLY A 118 6.996 -6.102 -7.267 1.00 0.00 O ATOM 0 H GLY A 118 4.195 -5.357 -4.104 1.00 0.00 H new ATOM 0 HA2 GLY A 118 6.330 -4.451 -5.477 1.00 0.00 H new ATOM 0 HA3 GLY A 118 6.438 -5.675 -4.227 1.00 0.00 H new ATOM 1829 N SER A 119 6.181 -7.731 -5.926 1.00 0.00 N ATOM 1830 CA SER A 119 6.556 -8.811 -6.824 1.00 0.00 C ATOM 1831 C SER A 119 6.152 -8.463 -8.258 1.00 0.00 C ATOM 1832 O SER A 119 6.954 -8.595 -9.181 1.00 0.00 O ATOM 1833 CB SER A 119 5.911 -10.131 -6.396 1.00 0.00 C ATOM 1834 OG SER A 119 6.659 -11.259 -6.843 1.00 0.00 O ATOM 0 H SER A 119 5.718 -8.031 -5.068 1.00 0.00 H new ATOM 0 HA SER A 119 7.638 -8.935 -6.778 1.00 0.00 H new ATOM 0 HB2 SER A 119 5.828 -10.158 -5.310 1.00 0.00 H new ATOM 0 HB3 SER A 119 4.898 -10.186 -6.795 1.00 0.00 H new ATOM 0 HG SER A 119 6.216 -12.082 -6.549 1.00 0.00 H new ATOM 1840 N LEU A 120 4.910 -8.025 -8.400 1.00 0.00 N ATOM 1841 CA LEU A 120 4.390 -7.657 -9.706 1.00 0.00 C ATOM 1842 C LEU A 120 5.319 -6.624 -10.347 1.00 0.00 C ATOM 1843 O LEU A 120 5.626 -6.712 -11.535 1.00 0.00 O ATOM 1844 CB LEU A 120 2.937 -7.192 -9.593 1.00 0.00 C ATOM 1845 CG LEU A 120 1.875 -8.195 -10.047 1.00 0.00 C ATOM 1846 CD1 LEU A 120 0.495 -7.814 -9.509 1.00 0.00 C ATOM 1847 CD2 LEU A 120 1.875 -8.343 -11.570 1.00 0.00 C ATOM 0 H LEU A 120 4.248 -7.917 -7.632 1.00 0.00 H new ATOM 0 HA LEU A 120 4.372 -8.524 -10.367 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.740 -6.930 -8.553 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.821 -6.280 -10.179 1.00 0.00 H new ATOM 0 HG LEU A 120 2.126 -9.170 -9.629 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.241 -8.543 -9.847 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.520 -7.801 -8.419 1.00 0.00 H new ATOM 0 HD13 LEU A 120 0.221 -6.825 -9.877 1.00 0.00 H new ATOM 0 HD21 LEU A 120 1.111 -9.062 -11.866 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.662 -7.378 -12.029 1.00 0.00 H new ATOM 0 HD23 LEU A 120 2.852 -8.695 -11.901 1.00 0.00 H new ATOM 1859 N ALA A 121 5.740 -5.668 -9.532 1.00 0.00 N ATOM 1860 CA ALA A 121 6.628 -4.619 -10.004 1.00 0.00 C ATOM 1861 C ALA A 121 8.014 -5.210 -10.267 1.00 0.00 C ATOM 1862 O ALA A 121 8.686 -4.824 -11.222 1.00 0.00 O ATOM 1863 CB ALA A 121 6.663 -3.481 -8.982 1.00 0.00 C ATOM 0 H ALA A 121 5.483 -5.598 -8.548 1.00 0.00 H new ATOM 0 HA ALA A 121 6.264 -4.202 -10.943 1.00 0.00 H new ATOM 0 HB1 ALA A 121 7.329 -2.694 -9.336 1.00 0.00 H new ATOM 0 HB2 ALA A 121 5.659 -3.076 -8.854 1.00 0.00 H new ATOM 0 HB3 ALA A 121 7.026 -3.861 -8.027 1.00 0.00 H new ATOM 1869 N VAL A 122 8.401 -6.136 -9.403 1.00 0.00 N ATOM 1870 CA VAL A 122 9.696 -6.784 -9.530 1.00 0.00 C ATOM 1871 C VAL A 122 9.749 -7.554 -10.851 1.00 0.00 C ATOM 1872 O VAL A 122 10.805 -7.656 -11.472 1.00 0.00 O ATOM 1873 CB VAL A 122 9.959 -7.670 -8.310 1.00 0.00 C ATOM 1874 CG1 VAL A 122 11.253 -8.469 -8.483 1.00 0.00 C ATOM 1875 CG2 VAL A 122 9.995 -6.839 -7.026 1.00 0.00 C ATOM 0 H VAL A 122 7.841 -6.454 -8.612 1.00 0.00 H new ATOM 0 HA VAL A 122 10.494 -6.042 -9.555 1.00 0.00 H new ATOM 0 HB VAL A 122 9.135 -8.379 -8.226 1.00 0.00 H new ATOM 0 HG11 VAL A 122 11.417 -9.091 -7.603 1.00 0.00 H new ATOM 0 HG12 VAL A 122 11.174 -9.104 -9.366 1.00 0.00 H new ATOM 0 HG13 VAL A 122 12.091 -7.783 -8.604 1.00 0.00 H new ATOM 0 HG21 VAL A 122 10.183 -7.493 -6.175 1.00 0.00 H new ATOM 0 HG22 VAL A 122 10.789 -6.096 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL A 122 9.038 -6.335 -6.892 1.00 0.00 H new ATOM 1885 N THR A 123 8.595 -8.076 -11.241 1.00 0.00 N ATOM 1886 CA THR A 123 8.497 -8.834 -12.477 1.00 0.00 C ATOM 1887 C THR A 123 8.639 -7.905 -13.684 1.00 0.00 C ATOM 1888 O THR A 123 9.384 -8.202 -14.616 1.00 0.00 O ATOM 1889 CB THR A 123 7.175 -9.604 -12.455 1.00 0.00 C ATOM 1890 OG1 THR A 123 7.372 -10.603 -11.458 1.00 0.00 O ATOM 1891 CG2 THR A 123 6.941 -10.402 -13.740 1.00 0.00 C ATOM 0 H THR A 123 7.721 -7.989 -10.723 1.00 0.00 H new ATOM 0 HA THR A 123 9.309 -9.556 -12.565 1.00 0.00 H new ATOM 0 HB THR A 123 6.351 -8.906 -12.305 1.00 0.00 H new ATOM 0 HG1 THR A 123 7.287 -10.199 -10.569 1.00 0.00 H new ATOM 0 HG21 THR A 123 5.990 -10.930 -13.672 1.00 0.00 H new ATOM 0 HG22 THR A 123 6.919 -9.722 -14.592 1.00 0.00 H new ATOM 0 HG23 THR A 123 7.747 -11.123 -13.872 1.00 0.00 H new ATOM 1899 N LYS A 124 7.911 -6.799 -13.629 1.00 0.00 N ATOM 1900 CA LYS A 124 7.947 -5.825 -14.706 1.00 0.00 C ATOM 1901 C LYS A 124 9.273 -5.064 -14.657 1.00 0.00 C ATOM 1902 O LYS A 124 10.177 -5.333 -15.446 1.00 0.00 O ATOM 1903 CB LYS A 124 6.715 -4.918 -14.649 1.00 0.00 C ATOM 1904 CG LYS A 124 5.449 -5.690 -15.024 1.00 0.00 C ATOM 1905 CD LYS A 124 4.413 -4.766 -15.667 1.00 0.00 C ATOM 1906 CE LYS A 124 3.026 -4.991 -15.061 1.00 0.00 C ATOM 1907 NZ LYS A 124 2.154 -3.823 -15.315 1.00 0.00 N ATOM 0 H LYS A 124 7.293 -6.556 -12.855 1.00 0.00 H new ATOM 0 HA LYS A 124 7.902 -6.325 -15.673 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.609 -4.504 -13.646 1.00 0.00 H new ATOM 0 HB3 LYS A 124 6.847 -4.076 -15.329 1.00 0.00 H new ATOM 0 HG2 LYS A 124 5.701 -6.495 -15.714 1.00 0.00 H new ATOM 0 HG3 LYS A 124 5.025 -6.154 -14.134 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.711 -3.727 -15.527 1.00 0.00 H new ATOM 0 HD3 LYS A 124 4.378 -4.945 -16.742 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.577 -5.887 -15.489 1.00 0.00 H new ATOM 0 HE3 LYS A 124 3.115 -5.160 -13.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 1.217 -3.992 -14.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 2.576 -2.975 -14.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 2.055 -3.680 -16.340 1.00 0.00 H new ATOM 1921 N ASN A 125 9.348 -4.128 -13.721 1.00 0.00 N ATOM 1922 CA ASN A 125 10.549 -3.327 -13.558 1.00 0.00 C ATOM 1923 C ASN A 125 10.908 -2.677 -14.896 1.00 0.00 C ATOM 1924 O ASN A 125 11.522 -3.312 -15.753 1.00 0.00 O ATOM 1925 CB ASN A 125 11.732 -4.191 -13.119 1.00 0.00 C ATOM 1926 CG ASN A 125 12.207 -3.798 -11.719 1.00 0.00 C ATOM 1927 OD1 ASN A 125 11.562 -3.051 -11.003 1.00 0.00 O ATOM 1928 ND2 ASN A 125 13.369 -4.343 -11.369 1.00 0.00 N ATOM 0 H ASN A 125 8.596 -3.907 -13.068 1.00 0.00 H new ATOM 0 HA ASN A 125 10.351 -2.573 -12.796 1.00 0.00 H new ATOM 0 HB2 ASN A 125 11.442 -5.242 -13.127 1.00 0.00 H new ATOM 0 HB3 ASN A 125 12.551 -4.081 -13.829 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.771 -4.143 -10.453 1.00 0.00 H new ATOM 0 HD22 ASN A 125 13.858 -4.961 -12.017 1.00 0.00 H new ATOM 1935 N ASP A 126 10.511 -1.421 -15.034 1.00 0.00 N ATOM 1936 CA ASP A 126 10.784 -0.679 -16.253 1.00 0.00 C ATOM 1937 C ASP A 126 10.837 0.817 -15.933 1.00 0.00 C ATOM 1938 O ASP A 126 10.550 1.649 -16.791 1.00 0.00 O ATOM 1939 CB ASP A 126 9.682 -0.901 -17.291 1.00 0.00 C ATOM 1940 CG ASP A 126 10.059 -0.521 -18.724 1.00 0.00 C ATOM 1941 OD1 ASP A 126 10.625 -1.397 -19.413 1.00 0.00 O ATOM 1942 OD2 ASP A 126 9.772 0.636 -19.099 1.00 0.00 O ATOM 0 H ASP A 126 10.002 -0.898 -14.321 1.00 0.00 H new ATOM 0 HA ASP A 126 11.735 -1.029 -16.655 1.00 0.00 H new ATOM 0 HB2 ASP A 126 9.393 -1.952 -17.274 1.00 0.00 H new ATOM 0 HB3 ASP A 126 8.805 -0.325 -16.997 1.00 0.00 H new ATOM 1947 N GLY A 127 11.208 1.112 -14.696 1.00 0.00 N ATOM 1948 CA GLY A 127 11.303 2.492 -14.252 1.00 0.00 C ATOM 1949 C GLY A 127 10.121 2.862 -13.354 1.00 0.00 C ATOM 1950 O GLY A 127 9.326 3.737 -13.697 1.00 0.00 O ATOM 0 H GLY A 127 11.446 0.419 -13.987 1.00 0.00 H new ATOM 0 HA2 GLY A 127 12.237 2.640 -13.709 1.00 0.00 H new ATOM 0 HA3 GLY A 127 11.329 3.155 -15.117 1.00 0.00 H new ATOM 1954 N ASN A 128 10.041 2.178 -12.223 1.00 0.00 N ATOM 1955 CA ASN A 128 8.969 2.424 -11.273 1.00 0.00 C ATOM 1956 C ASN A 128 9.484 2.177 -9.854 1.00 0.00 C ATOM 1957 O ASN A 128 9.281 3.002 -8.964 1.00 0.00 O ATOM 1958 CB ASN A 128 7.789 1.481 -11.518 1.00 0.00 C ATOM 1959 CG ASN A 128 7.270 1.614 -12.951 1.00 0.00 C ATOM 1960 OD1 ASN A 128 8.080 1.097 -13.870 1.00 0.00 O flip ATOM 1961 ND2 ASN A 128 6.204 2.151 -13.205 1.00 0.00 N flip ATOM 0 H ASN A 128 10.701 1.453 -11.942 1.00 0.00 H new ATOM 0 HA ASN A 128 8.639 3.455 -11.397 1.00 0.00 H new ATOM 0 HB2 ASN A 128 8.097 0.452 -11.333 1.00 0.00 H new ATOM 0 HB3 ASN A 128 6.987 1.705 -10.815 1.00 0.00 H new ATOM 0 HD21 ASN A 128 5.630 2.527 -12.451 1.00 0.00 H new ATOM 0 HD22 ASN A 128 5.887 2.223 -14.172 1.00 0.00 H new ATOM 1968 N TYR A 129 10.141 1.039 -9.686 1.00 0.00 N ATOM 1969 CA TYR A 129 10.687 0.674 -8.390 1.00 0.00 C ATOM 1970 C TYR A 129 11.960 1.467 -8.088 1.00 0.00 C ATOM 1971 O TYR A 129 12.944 1.371 -8.819 1.00 0.00 O ATOM 1972 CB TYR A 129 11.037 -0.813 -8.484 1.00 0.00 C ATOM 1973 CG TYR A 129 10.664 -1.620 -7.238 1.00 0.00 C ATOM 1974 CD1 TYR A 129 11.284 -1.355 -6.034 1.00 0.00 C ATOM 1975 CD2 TYR A 129 9.708 -2.611 -7.320 1.00 0.00 C ATOM 1976 CE1 TYR A 129 10.933 -2.115 -4.862 1.00 0.00 C ATOM 1977 CE2 TYR A 129 9.357 -3.371 -6.148 1.00 0.00 C ATOM 1978 CZ TYR A 129 9.986 -3.085 -4.977 1.00 0.00 C ATOM 1979 OH TYR A 129 9.655 -3.802 -3.870 1.00 0.00 O ATOM 0 H TYR A 129 10.308 0.357 -10.426 1.00 0.00 H new ATOM 0 HA TYR A 129 9.969 0.886 -7.598 1.00 0.00 H new ATOM 0 HB2 TYR A 129 10.529 -1.242 -9.348 1.00 0.00 H new ATOM 0 HB3 TYR A 129 12.108 -0.913 -8.662 1.00 0.00 H new ATOM 0 HD1 TYR A 129 12.032 -0.578 -5.971 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.223 -2.817 -8.263 1.00 0.00 H new ATOM 0 HE1 TYR A 129 11.411 -1.919 -3.913 1.00 0.00 H new ATOM 0 HE2 TYR A 129 8.611 -4.150 -6.198 1.00 0.00 H new ATOM 0 HH TYR A 129 9.110 -3.248 -3.272 1.00 0.00 H new ATOM 1989 N ARG A 130 11.899 2.234 -7.009 1.00 0.00 N ATOM 1990 CA ARG A 130 13.035 3.043 -6.601 1.00 0.00 C ATOM 1991 C ARG A 130 13.839 2.321 -5.518 1.00 0.00 C ATOM 1992 O ARG A 130 14.306 2.945 -4.566 1.00 0.00 O ATOM 1993 CB ARG A 130 12.578 4.402 -6.066 1.00 0.00 C ATOM 1994 CG ARG A 130 11.705 5.129 -7.091 1.00 0.00 C ATOM 1995 CD ARG A 130 12.556 5.998 -8.019 1.00 0.00 C ATOM 1996 NE ARG A 130 11.839 6.230 -9.293 1.00 0.00 N ATOM 1997 CZ ARG A 130 11.548 5.267 -10.178 1.00 0.00 C ATOM 1998 NH1 ARG A 130 11.912 4.000 -9.933 1.00 0.00 N ATOM 1999 NH2 ARG A 130 10.895 5.570 -11.308 1.00 0.00 N ATOM 0 H ARG A 130 11.081 2.312 -6.405 1.00 0.00 H new ATOM 0 HA ARG A 130 13.662 3.202 -7.478 1.00 0.00 H new ATOM 0 HB2 ARG A 130 12.019 4.263 -5.140 1.00 0.00 H new ATOM 0 HB3 ARG A 130 13.448 5.013 -5.825 1.00 0.00 H new ATOM 0 HG2 ARG A 130 11.147 4.401 -7.680 1.00 0.00 H new ATOM 0 HG3 ARG A 130 10.973 5.750 -6.575 1.00 0.00 H new ATOM 0 HD2 ARG A 130 12.777 6.951 -7.538 1.00 0.00 H new ATOM 0 HD3 ARG A 130 13.511 5.510 -8.213 1.00 0.00 H new ATOM 0 HE ARG A 130 11.548 7.183 -9.511 1.00 0.00 H new ATOM 0 HH11 ARG A 130 12.410 3.770 -9.073 1.00 0.00 H new ATOM 0 HH12 ARG A 130 11.691 3.267 -10.606 1.00 0.00 H new ATOM 0 HH21 ARG A 130 10.619 6.534 -11.495 1.00 0.00 H new ATOM 0 HH22 ARG A 130 10.674 4.837 -11.981 1.00 0.00 H new ATOM 2013 N GLY A 131 13.978 1.016 -5.701 1.00 0.00 N ATOM 2014 CA GLY A 131 14.719 0.203 -4.751 1.00 0.00 C ATOM 2015 C GLY A 131 15.488 -0.910 -5.466 1.00 0.00 C ATOM 2016 O GLY A 131 16.408 -0.639 -6.235 1.00 0.00 O ATOM 0 H GLY A 131 13.591 0.502 -6.492 1.00 0.00 H new ATOM 0 HA2 GLY A 131 15.414 0.831 -4.194 1.00 0.00 H new ATOM 0 HA3 GLY A 131 14.032 -0.233 -4.026 1.00 0.00 H new ATOM 2020 N ASP A 132 15.081 -2.140 -5.187 1.00 0.00 N ATOM 2021 CA ASP A 132 15.720 -3.296 -5.793 1.00 0.00 C ATOM 2022 C ASP A 132 14.681 -4.400 -5.997 1.00 0.00 C ATOM 2023 O ASP A 132 13.761 -4.547 -5.194 1.00 0.00 O ATOM 2024 CB ASP A 132 16.827 -3.848 -4.893 1.00 0.00 C ATOM 2025 CG ASP A 132 18.239 -3.372 -5.238 1.00 0.00 C ATOM 2026 OD1 ASP A 132 18.585 -3.443 -6.437 1.00 0.00 O ATOM 2027 OD2 ASP A 132 18.941 -2.948 -4.294 1.00 0.00 O ATOM 0 H ASP A 132 14.316 -2.361 -4.549 1.00 0.00 H new ATOM 0 HA ASP A 132 16.151 -2.983 -6.744 1.00 0.00 H new ATOM 0 HB2 ASP A 132 16.608 -3.571 -3.862 1.00 0.00 H new ATOM 0 HB3 ASP A 132 16.805 -4.937 -4.942 1.00 0.00 H new ATOM 2032 N PRO A 133 14.867 -5.167 -7.104 1.00 0.00 N ATOM 2033 CA PRO A 133 13.956 -6.253 -7.423 1.00 0.00 C ATOM 2034 C PRO A 133 14.194 -7.456 -6.508 1.00 0.00 C ATOM 2035 O PRO A 133 13.308 -8.290 -6.330 1.00 0.00 O ATOM 2036 CB PRO A 133 14.212 -6.563 -8.889 1.00 0.00 C ATOM 2037 CG PRO A 133 15.571 -5.963 -9.211 1.00 0.00 C ATOM 2038 CD PRO A 133 15.945 -5.022 -8.077 1.00 0.00 C ATOM 0 HA PRO A 133 12.911 -5.986 -7.262 1.00 0.00 H new ATOM 0 HB2 PRO A 133 14.208 -7.638 -9.067 1.00 0.00 H new ATOM 0 HB3 PRO A 133 13.435 -6.132 -9.521 1.00 0.00 H new ATOM 0 HG2 PRO A 133 16.319 -6.748 -9.318 1.00 0.00 H new ATOM 0 HG3 PRO A 133 15.536 -5.425 -10.158 1.00 0.00 H new ATOM 0 HD2 PRO A 133 16.909 -5.288 -7.643 1.00 0.00 H new ATOM 0 HD3 PRO A 133 16.027 -3.993 -8.427 1.00 0.00 H new ATOM 2046 N ASN A 134 15.395 -7.506 -5.951 1.00 0.00 N ATOM 2047 CA ASN A 134 15.761 -8.592 -5.058 1.00 0.00 C ATOM 2048 C ASN A 134 15.366 -8.225 -3.626 1.00 0.00 C ATOM 2049 O ASN A 134 16.147 -8.415 -2.695 1.00 0.00 O ATOM 2050 CB ASN A 134 17.270 -8.841 -5.083 1.00 0.00 C ATOM 2051 CG ASN A 134 17.670 -9.662 -6.310 1.00 0.00 C ATOM 2052 OD1 ASN A 134 17.487 -10.867 -6.370 1.00 0.00 O ATOM 2053 ND2 ASN A 134 18.226 -8.945 -7.283 1.00 0.00 N ATOM 0 H ASN A 134 16.127 -6.812 -6.101 1.00 0.00 H new ATOM 0 HA ASN A 134 15.242 -9.491 -5.390 1.00 0.00 H new ATOM 0 HB2 ASN A 134 17.799 -7.888 -5.090 1.00 0.00 H new ATOM 0 HB3 ASN A 134 17.571 -9.366 -4.176 1.00 0.00 H new ATOM 0 HD21 ASN A 134 18.528 -9.401 -8.144 1.00 0.00 H new ATOM 0 HD22 ASN A 134 18.350 -7.939 -7.168 1.00 0.00 H new ATOM 2060 N TRP A 135 14.154 -7.706 -3.495 1.00 0.00 N ATOM 2061 CA TRP A 135 13.646 -7.310 -2.193 1.00 0.00 C ATOM 2062 C TRP A 135 12.530 -8.282 -1.805 1.00 0.00 C ATOM 2063 O TRP A 135 12.569 -8.881 -0.731 1.00 0.00 O ATOM 2064 CB TRP A 135 13.190 -5.850 -2.203 1.00 0.00 C ATOM 2065 CG TRP A 135 14.320 -4.843 -1.978 1.00 0.00 C ATOM 2066 CD1 TRP A 135 15.620 -5.094 -1.771 1.00 0.00 C ATOM 2067 CD2 TRP A 135 14.197 -3.405 -1.946 1.00 0.00 C ATOM 2068 NE1 TRP A 135 16.341 -3.929 -1.608 1.00 0.00 N ATOM 2069 CE2 TRP A 135 15.448 -2.869 -1.718 1.00 0.00 C ATOM 2070 CE3 TRP A 135 13.066 -2.585 -2.104 1.00 0.00 C ATOM 2071 CZ2 TRP A 135 15.687 -1.493 -1.628 1.00 0.00 C ATOM 2072 CZ3 TRP A 135 13.322 -1.212 -2.011 1.00 0.00 C ATOM 2073 CH2 TRP A 135 14.575 -0.656 -1.782 1.00 0.00 C ATOM 0 H TRP A 135 13.509 -7.551 -4.270 1.00 0.00 H new ATOM 0 HA TRP A 135 14.432 -7.364 -1.440 1.00 0.00 H new ATOM 0 HB2 TRP A 135 12.712 -5.636 -3.159 1.00 0.00 H new ATOM 0 HB3 TRP A 135 12.434 -5.711 -1.430 1.00 0.00 H new ATOM 0 HD1 TRP A 135 16.050 -6.084 -1.736 1.00 0.00 H new ATOM 0 HE1 TRP A 135 17.344 -3.858 -1.438 1.00 0.00 H new ATOM 0 HE3 TRP A 135 12.078 -2.983 -2.283 1.00 0.00 H new ATOM 0 HZ2 TRP A 135 16.676 -1.098 -1.449 1.00 0.00 H new ATOM 0 HZ3 TRP A 135 12.487 -0.537 -2.125 1.00 0.00 H new ATOM 0 HH2 TRP A 135 14.690 0.416 -1.723 1.00 0.00 H new ATOM 2084 N PHE A 136 11.562 -8.410 -2.701 1.00 0.00 N ATOM 2085 CA PHE A 136 10.438 -9.299 -2.466 1.00 0.00 C ATOM 2086 C PHE A 136 10.768 -10.728 -2.903 1.00 0.00 C ATOM 2087 O PHE A 136 10.550 -11.677 -2.151 1.00 0.00 O ATOM 2088 CB PHE A 136 9.272 -8.778 -3.308 1.00 0.00 C ATOM 2089 CG PHE A 136 8.482 -7.647 -2.646 1.00 0.00 C ATOM 2090 CD1 PHE A 136 9.056 -6.426 -2.475 1.00 0.00 C ATOM 2091 CD2 PHE A 136 7.206 -7.863 -2.228 1.00 0.00 C ATOM 2092 CE1 PHE A 136 8.324 -5.377 -1.860 1.00 0.00 C ATOM 2093 CE2 PHE A 136 6.473 -6.813 -1.613 1.00 0.00 C ATOM 2094 CZ PHE A 136 7.048 -5.592 -1.442 1.00 0.00 C ATOM 0 H PHE A 136 11.533 -7.912 -3.591 1.00 0.00 H new ATOM 0 HA PHE A 136 10.196 -9.319 -1.403 1.00 0.00 H new ATOM 0 HB2 PHE A 136 9.657 -8.426 -4.265 1.00 0.00 H new ATOM 0 HB3 PHE A 136 8.594 -9.604 -3.522 1.00 0.00 H new ATOM 0 HD1 PHE A 136 10.069 -6.255 -2.807 1.00 0.00 H new ATOM 0 HD2 PHE A 136 6.750 -8.833 -2.364 1.00 0.00 H new ATOM 0 HE1 PHE A 136 8.781 -4.408 -1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 136 5.460 -6.984 -1.281 1.00 0.00 H new ATOM 0 HZ PHE A 136 6.491 -4.794 -0.974 1.00 0.00 H new ATOM 2104 N MET A 137 11.289 -10.836 -4.116 1.00 0.00 N ATOM 2105 CA MET A 137 11.651 -12.133 -4.662 1.00 0.00 C ATOM 2106 C MET A 137 12.383 -12.981 -3.620 1.00 0.00 C ATOM 2107 O MET A 137 13.230 -12.474 -2.886 1.00 0.00 O ATOM 2108 CB MET A 137 12.549 -11.939 -5.885 1.00 0.00 C ATOM 2109 CG MET A 137 11.844 -12.404 -7.162 1.00 0.00 C ATOM 2110 SD MET A 137 12.928 -12.202 -8.565 1.00 0.00 S ATOM 2111 CE MET A 137 11.750 -12.381 -9.895 1.00 0.00 C ATOM 0 H MET A 137 11.469 -10.047 -4.736 1.00 0.00 H new ATOM 0 HA MET A 137 10.738 -12.653 -4.950 1.00 0.00 H new ATOM 0 HB2 MET A 137 12.821 -10.888 -5.978 1.00 0.00 H new ATOM 0 HB3 MET A 137 13.476 -12.498 -5.753 1.00 0.00 H new ATOM 0 HG2 MET A 137 11.551 -13.450 -7.066 1.00 0.00 H new ATOM 0 HG3 MET A 137 10.930 -11.830 -7.312 1.00 0.00 H new ATOM 0 HE1 MET A 137 12.263 -12.281 -10.851 1.00 0.00 H new ATOM 0 HE2 MET A 137 11.281 -13.363 -9.836 1.00 0.00 H new ATOM 0 HE3 MET A 137 10.986 -11.608 -9.811 1.00 0.00 H new ATOM 2121 N LYS A 138 12.031 -14.258 -3.589 1.00 0.00 N ATOM 2122 CA LYS A 138 12.644 -15.181 -2.649 1.00 0.00 C ATOM 2123 C LYS A 138 12.396 -16.617 -3.116 1.00 0.00 C ATOM 2124 O LYS A 138 13.332 -17.321 -3.492 1.00 0.00 O ATOM 2125 CB LYS A 138 12.153 -14.903 -1.227 1.00 0.00 C ATOM 2126 CG LYS A 138 13.303 -14.440 -0.330 1.00 0.00 C ATOM 2127 CD LYS A 138 12.775 -13.881 0.992 1.00 0.00 C ATOM 2128 CE LYS A 138 13.565 -14.439 2.178 1.00 0.00 C ATOM 2129 NZ LYS A 138 12.680 -15.225 3.067 1.00 0.00 N ATOM 0 H LYS A 138 11.329 -14.675 -4.200 1.00 0.00 H new ATOM 0 HA LYS A 138 13.724 -15.036 -2.622 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.375 -14.140 -1.250 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.703 -15.804 -0.811 1.00 0.00 H new ATOM 0 HG2 LYS A 138 13.975 -15.276 -0.133 1.00 0.00 H new ATOM 0 HG3 LYS A 138 13.886 -13.677 -0.845 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.844 -12.793 0.984 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.720 -14.133 1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.379 -15.068 1.817 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.019 -13.621 2.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 13.232 -15.596 3.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 11.918 -14.615 3.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 12.267 -16.017 2.534 1.00 0.00 H new ATOM 2143 N SER A 139 11.131 -17.008 -3.077 1.00 0.00 N ATOM 2144 CA SER A 139 10.748 -18.347 -3.492 1.00 0.00 C ATOM 2145 C SER A 139 9.228 -18.433 -3.645 1.00 0.00 C ATOM 2146 O SER A 139 8.495 -18.338 -2.662 1.00 0.00 O ATOM 2147 CB SER A 139 11.240 -19.395 -2.491 1.00 0.00 C ATOM 2148 OG SER A 139 12.039 -20.396 -3.117 1.00 0.00 O ATOM 0 H SER A 139 10.358 -16.421 -2.764 1.00 0.00 H new ATOM 0 HA SER A 139 11.216 -18.554 -4.454 1.00 0.00 H new ATOM 0 HB2 SER A 139 11.819 -18.905 -1.708 1.00 0.00 H new ATOM 0 HB3 SER A 139 10.384 -19.865 -2.007 1.00 0.00 H new ATOM 0 HG SER A 139 12.335 -21.045 -2.445 1.00 0.00 H new ATOM 2154 N GLY A 140 8.800 -18.611 -4.886 1.00 0.00 N ATOM 2155 CA GLY A 140 7.381 -18.711 -5.181 1.00 0.00 C ATOM 2156 C GLY A 140 7.146 -18.938 -6.676 1.00 0.00 C ATOM 2157 O GLY A 140 8.044 -19.385 -7.388 1.00 0.00 O ATOM 0 H GLY A 140 9.411 -18.689 -5.699 1.00 0.00 H new ATOM 0 HA2 GLY A 140 6.945 -19.532 -4.612 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.875 -17.799 -4.864 1.00 0.00 H new ATOM 2161 N PRO A 141 5.902 -18.613 -7.118 1.00 0.00 N ATOM 2162 CA PRO A 141 5.538 -18.778 -8.515 1.00 0.00 C ATOM 2163 C PRO A 141 6.168 -17.684 -9.379 1.00 0.00 C ATOM 2164 O PRO A 141 6.444 -16.587 -8.895 1.00 0.00 O ATOM 2165 CB PRO A 141 4.018 -18.746 -8.532 1.00 0.00 C ATOM 2166 CG PRO A 141 3.600 -18.103 -7.220 1.00 0.00 C ATOM 2167 CD PRO A 141 4.813 -18.083 -6.304 1.00 0.00 C ATOM 0 HA PRO A 141 5.909 -19.711 -8.938 1.00 0.00 H new ATOM 0 HB2 PRO A 141 3.649 -18.173 -9.383 1.00 0.00 H new ATOM 0 HB3 PRO A 141 3.607 -19.752 -8.622 1.00 0.00 H new ATOM 0 HG2 PRO A 141 3.234 -17.091 -7.391 1.00 0.00 H new ATOM 0 HG3 PRO A 141 2.785 -18.664 -6.762 1.00 0.00 H new ATOM 0 HD2 PRO A 141 5.032 -17.072 -5.959 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.649 -18.694 -5.416 1.00 0.00 H new ATOM 2175 N SER A 142 6.379 -18.020 -10.643 1.00 0.00 N ATOM 2176 CA SER A 142 6.972 -17.080 -11.579 1.00 0.00 C ATOM 2177 C SER A 142 6.000 -16.802 -12.728 1.00 0.00 C ATOM 2178 O SER A 142 5.660 -17.705 -13.490 1.00 0.00 O ATOM 2179 CB SER A 142 8.300 -17.608 -12.123 1.00 0.00 C ATOM 2180 OG SER A 142 9.244 -16.562 -12.336 1.00 0.00 O ATOM 0 H SER A 142 6.150 -18.931 -11.041 1.00 0.00 H new ATOM 0 HA SER A 142 7.173 -16.149 -11.048 1.00 0.00 H new ATOM 0 HB2 SER A 142 8.715 -18.334 -11.424 1.00 0.00 H new ATOM 0 HB3 SER A 142 8.124 -18.134 -13.061 1.00 0.00 H new ATOM 0 HG SER A 142 10.079 -16.941 -12.682 1.00 0.00 H new ATOM 2186 N SER A 143 5.582 -15.548 -12.816 1.00 0.00 N ATOM 2187 CA SER A 143 4.657 -15.140 -13.860 1.00 0.00 C ATOM 2188 C SER A 143 3.375 -15.971 -13.777 1.00 0.00 C ATOM 2189 O SER A 143 3.366 -17.047 -13.182 1.00 0.00 O ATOM 2190 CB SER A 143 5.291 -15.280 -15.245 1.00 0.00 C ATOM 2191 OG SER A 143 5.227 -14.065 -15.987 1.00 0.00 O ATOM 0 H SER A 143 5.866 -14.801 -12.182 1.00 0.00 H new ATOM 0 HA SER A 143 4.412 -14.089 -13.707 1.00 0.00 H new ATOM 0 HB2 SER A 143 6.332 -15.585 -15.138 1.00 0.00 H new ATOM 0 HB3 SER A 143 4.783 -16.070 -15.798 1.00 0.00 H new ATOM 0 HG SER A 143 5.644 -14.195 -16.864 1.00 0.00 H new ATOM 2197 N GLY A 144 2.323 -15.440 -14.382 1.00 0.00 N ATOM 2198 CA GLY A 144 1.038 -16.119 -14.385 1.00 0.00 C ATOM 2199 C GLY A 144 -0.114 -15.113 -14.377 1.00 0.00 C ATOM 2200 O GLY A 144 -0.708 -14.852 -13.331 1.00 0.00 O ATOM 0 H GLY A 144 2.334 -14.547 -14.874 1.00 0.00 H new ATOM 0 HA2 GLY A 144 0.962 -16.757 -15.265 1.00 0.00 H new ATOM 0 HA3 GLY A 144 0.964 -16.769 -13.513 1.00 0.00 H new TER 2204 GLY A 144