USER MOD reduce.3.24.130724 H: found=0, std=0, add=859, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 859 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 91 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 95 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.258) USER MOD Set 2.1: A 38 LYS NZ :NH3+ -156:sc= 1.17 (180deg=0.514) USER MOD Set 2.2: A 101 GLN : amide:sc= 0.0311 K(o=1.2,f=-2.1!) USER MOD Set 3.1: A 34 TYR OH : rot 22:sc= 0.00458 USER MOD Set 3.2: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 MET CE :methyl -118:sc= -1.52 (180deg=-1.65) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.325 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 53:sc= 1.26 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.0721) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 67:sc= 0.034 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -39:sc= 0.208 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 SER OG : rot 180:sc= 0.628 USER MOD Single : A 78 SER OG : rot -31:sc= 1.1 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ 167:sc= 0.969 (180deg=0.826) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 ASN : amide:sc= -0.474 K(o=-0.47,f=-8.8!) USER MOD Single : A 98 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.00883) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc=0.000424 USER MOD Single : A 111 TYR OH : rot 30:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 11 5.321 20.844 12.072 1.00 0.00 N ATOM 2 CA GLY A 11 4.855 22.053 11.355 1.00 0.00 C ATOM 3 C GLY A 11 4.768 21.838 9.848 1.00 0.00 C ATOM 4 O GLY A 11 5.021 20.743 9.344 1.00 0.00 O ATOM 0 HA2 GLY A 11 3.875 22.342 11.735 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.534 22.880 11.563 1.00 0.00 H new ATOM 8 N SER A 12 4.420 22.889 9.105 1.00 0.00 N ATOM 9 CA SER A 12 4.237 22.871 7.640 1.00 0.00 C ATOM 10 C SER A 12 4.327 24.286 7.031 1.00 0.00 C ATOM 11 O SER A 12 4.000 25.284 7.684 1.00 0.00 O ATOM 12 CB SER A 12 2.904 22.191 7.262 1.00 0.00 C ATOM 13 OG SER A 12 1.781 22.793 7.905 1.00 0.00 O ATOM 0 H SER A 12 4.251 23.809 9.512 1.00 0.00 H new ATOM 0 HA SER A 12 5.054 22.286 7.217 1.00 0.00 H new ATOM 0 HB2 SER A 12 2.769 22.240 6.182 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.949 21.136 7.530 1.00 0.00 H new ATOM 0 HG SER A 12 0.961 22.330 7.633 1.00 0.00 H new ATOM 19 N GLU A 13 4.795 24.374 5.779 1.00 0.00 N ATOM 20 CA GLU A 13 5.055 25.626 5.041 1.00 0.00 C ATOM 21 C GLU A 13 4.792 25.510 3.521 1.00 0.00 C ATOM 22 O GLU A 13 4.732 26.527 2.824 1.00 0.00 O ATOM 23 CB GLU A 13 6.520 26.066 5.244 1.00 0.00 C ATOM 24 CG GLU A 13 6.874 26.447 6.688 1.00 0.00 C ATOM 25 CD GLU A 13 8.291 27.030 6.766 1.00 0.00 C ATOM 26 OE1 GLU A 13 9.266 26.255 6.916 1.00 0.00 O ATOM 27 OE2 GLU A 13 8.447 28.273 6.685 1.00 0.00 O ATOM 0 H GLU A 13 5.013 23.544 5.227 1.00 0.00 H new ATOM 0 HA GLU A 13 4.360 26.361 5.446 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.177 25.258 4.923 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.724 26.919 4.596 1.00 0.00 H new ATOM 0 HG2 GLU A 13 6.155 27.175 7.063 1.00 0.00 H new ATOM 0 HG3 GLU A 13 6.802 25.568 7.329 1.00 0.00 H new ATOM 34 N GLU A 14 4.647 24.292 2.989 1.00 0.00 N ATOM 35 CA GLU A 14 4.452 23.995 1.568 1.00 0.00 C ATOM 36 C GLU A 14 3.067 24.438 1.042 1.00 0.00 C ATOM 37 O GLU A 14 2.062 24.376 1.757 1.00 0.00 O ATOM 38 CB GLU A 14 4.723 22.501 1.281 1.00 0.00 C ATOM 39 CG GLU A 14 4.029 21.481 2.205 1.00 0.00 C ATOM 40 CD GLU A 14 4.880 21.132 3.439 1.00 0.00 C ATOM 41 OE1 GLU A 14 4.885 21.919 4.416 1.00 0.00 O ATOM 42 OE2 GLU A 14 5.556 20.076 3.436 1.00 0.00 O ATOM 0 H GLU A 14 4.663 23.449 3.564 1.00 0.00 H new ATOM 0 HA GLU A 14 5.181 24.588 1.016 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.420 22.291 0.255 1.00 0.00 H new ATOM 0 HB3 GLU A 14 5.799 22.334 1.337 1.00 0.00 H new ATOM 0 HG2 GLU A 14 3.070 21.884 2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.818 20.571 1.643 1.00 0.00 H new ATOM 49 N VAL A 15 3.015 24.873 -0.227 1.00 0.00 N ATOM 50 CA VAL A 15 1.804 25.444 -0.874 1.00 0.00 C ATOM 51 C VAL A 15 0.795 24.387 -1.370 1.00 0.00 C ATOM 52 O VAL A 15 -0.302 24.737 -1.803 1.00 0.00 O ATOM 53 CB VAL A 15 2.157 26.416 -2.030 1.00 0.00 C ATOM 54 CG1 VAL A 15 2.961 27.622 -1.515 1.00 0.00 C ATOM 55 CG2 VAL A 15 2.917 25.737 -3.185 1.00 0.00 C ATOM 0 H VAL A 15 3.822 24.841 -0.850 1.00 0.00 H new ATOM 0 HA VAL A 15 1.314 26.002 -0.076 1.00 0.00 H new ATOM 0 HB VAL A 15 1.203 26.759 -2.430 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.194 28.286 -2.347 1.00 0.00 H new ATOM 0 HG12 VAL A 15 2.372 28.162 -0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.887 27.274 -1.058 1.00 0.00 H new ATOM 0 HG21 VAL A 15 3.133 26.472 -3.960 1.00 0.00 H new ATOM 0 HG22 VAL A 15 3.852 25.320 -2.810 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.305 24.938 -3.603 1.00 0.00 H new ATOM 65 N SER A 16 1.147 23.101 -1.296 1.00 0.00 N ATOM 66 CA SER A 16 0.326 21.953 -1.718 1.00 0.00 C ATOM 67 C SER A 16 0.502 20.772 -0.741 1.00 0.00 C ATOM 68 O SER A 16 1.528 20.671 -0.059 1.00 0.00 O ATOM 69 CB SER A 16 0.712 21.516 -3.145 1.00 0.00 C ATOM 70 OG SER A 16 0.410 22.505 -4.129 1.00 0.00 O ATOM 0 H SER A 16 2.052 22.814 -0.924 1.00 0.00 H new ATOM 0 HA SER A 16 -0.720 22.259 -1.711 1.00 0.00 H new ATOM 0 HB2 SER A 16 1.779 21.294 -3.176 1.00 0.00 H new ATOM 0 HB3 SER A 16 0.187 20.593 -3.392 1.00 0.00 H new ATOM 0 HG SER A 16 0.676 22.178 -5.014 1.00 0.00 H new ATOM 76 N GLU A 17 -0.503 19.891 -0.643 1.00 0.00 N ATOM 77 CA GLU A 17 -0.599 18.844 0.388 1.00 0.00 C ATOM 78 C GLU A 17 -1.114 17.501 -0.186 1.00 0.00 C ATOM 79 O GLU A 17 -1.852 17.509 -1.181 1.00 0.00 O ATOM 80 CB GLU A 17 -1.550 19.313 1.509 1.00 0.00 C ATOM 81 CG GLU A 17 -1.005 20.500 2.312 1.00 0.00 C ATOM 82 CD GLU A 17 -1.957 20.865 3.458 1.00 0.00 C ATOM 83 OE1 GLU A 17 -2.892 21.673 3.243 1.00 0.00 O ATOM 84 OE2 GLU A 17 -1.780 20.349 4.588 1.00 0.00 O ATOM 0 H GLU A 17 -1.290 19.885 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 17 0.405 18.676 0.779 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.508 19.590 1.070 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -1.739 18.481 2.187 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -0.023 20.252 2.714 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -0.873 21.360 1.655 1.00 0.00 H new ATOM 91 N PRO A 18 -0.768 16.355 0.443 1.00 0.00 N ATOM 92 CA PRO A 18 -1.244 15.028 0.051 1.00 0.00 C ATOM 93 C PRO A 18 -2.711 14.788 0.439 1.00 0.00 C ATOM 94 O PRO A 18 -3.284 15.505 1.264 1.00 0.00 O ATOM 95 CB PRO A 18 -0.318 14.044 0.775 1.00 0.00 C ATOM 96 CG PRO A 18 0.059 14.790 2.050 1.00 0.00 C ATOM 97 CD PRO A 18 0.157 16.235 1.566 1.00 0.00 C ATOM 0 HA PRO A 18 -1.216 14.909 -1.032 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -0.823 13.103 0.994 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.560 13.803 0.176 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.695 14.672 2.828 1.00 0.00 H new ATOM 0 HG3 PRO A 18 1.003 14.435 2.465 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -0.107 16.931 2.363 1.00 0.00 H new ATOM 0 HD3 PRO A 18 1.175 16.474 1.258 1.00 0.00 H new ATOM 105 N GLY A 19 -3.298 13.730 -0.137 1.00 0.00 N ATOM 106 CA GLY A 19 -4.601 13.173 0.250 1.00 0.00 C ATOM 107 C GLY A 19 -4.425 11.791 0.873 1.00 0.00 C ATOM 108 O GLY A 19 -3.781 10.925 0.286 1.00 0.00 O ATOM 0 H GLY A 19 -2.866 13.223 -0.909 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -5.092 13.839 0.960 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.249 13.105 -0.624 1.00 0.00 H new ATOM 112 N ASP A 20 -4.979 11.565 2.060 1.00 0.00 N ATOM 113 CA ASP A 20 -4.813 10.319 2.821 1.00 0.00 C ATOM 114 C ASP A 20 -6.070 9.423 2.744 1.00 0.00 C ATOM 115 O ASP A 20 -7.187 9.913 2.555 1.00 0.00 O ATOM 116 CB ASP A 20 -4.466 10.708 4.271 1.00 0.00 C ATOM 117 CG ASP A 20 -4.070 9.527 5.171 1.00 0.00 C ATOM 118 OD1 ASP A 20 -4.975 8.879 5.745 1.00 0.00 O ATOM 119 OD2 ASP A 20 -2.848 9.287 5.327 1.00 0.00 O ATOM 0 H ASP A 20 -5.567 12.251 2.533 1.00 0.00 H new ATOM 0 HA ASP A 20 -4.008 9.721 2.393 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.647 11.427 4.255 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.324 11.214 4.713 1.00 0.00 H new ATOM 124 N ALA A 21 -5.886 8.105 2.887 1.00 0.00 N ATOM 125 CA ALA A 21 -6.907 7.071 2.700 1.00 0.00 C ATOM 126 C ALA A 21 -6.709 5.879 3.668 1.00 0.00 C ATOM 127 O ALA A 21 -6.610 4.717 3.261 1.00 0.00 O ATOM 128 CB ALA A 21 -6.908 6.667 1.220 1.00 0.00 C ATOM 0 H ALA A 21 -4.981 7.714 3.148 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.892 7.463 2.953 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.661 5.897 1.054 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -7.137 7.537 0.605 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -5.926 6.279 0.948 1.00 0.00 H new ATOM 134 N ASN A 22 -6.633 6.184 4.969 1.00 0.00 N ATOM 135 CA ASN A 22 -6.796 5.268 6.110 1.00 0.00 C ATOM 136 C ASN A 22 -5.676 4.209 6.229 1.00 0.00 C ATOM 137 O ASN A 22 -4.820 4.307 7.112 1.00 0.00 O ATOM 138 CB ASN A 22 -8.202 4.629 6.092 1.00 0.00 C ATOM 139 CG ASN A 22 -9.317 5.672 6.167 1.00 0.00 C ATOM 140 OD1 ASN A 22 -9.893 6.068 5.161 1.00 0.00 O ATOM 141 ND2 ASN A 22 -9.644 6.155 7.354 1.00 0.00 N ATOM 0 H ASN A 22 -6.444 7.138 5.275 1.00 0.00 H new ATOM 0 HA ASN A 22 -6.701 5.873 7.011 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -8.319 4.041 5.182 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -8.296 3.940 6.931 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -10.378 6.859 7.434 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -9.163 5.823 8.190 1.00 0.00 H new ATOM 148 N ILE A 23 -5.678 3.192 5.356 1.00 0.00 N ATOM 149 CA ILE A 23 -4.632 2.152 5.259 1.00 0.00 C ATOM 150 C ILE A 23 -3.498 2.601 4.317 1.00 0.00 C ATOM 151 O ILE A 23 -2.384 2.082 4.394 1.00 0.00 O ATOM 152 CB ILE A 23 -5.247 0.797 4.815 1.00 0.00 C ATOM 153 CG1 ILE A 23 -6.571 0.450 5.542 1.00 0.00 C ATOM 154 CG2 ILE A 23 -4.253 -0.360 5.045 1.00 0.00 C ATOM 155 CD1 ILE A 23 -7.811 0.804 4.709 1.00 0.00 C ATOM 0 H ILE A 23 -6.427 3.062 4.676 1.00 0.00 H new ATOM 0 HA ILE A 23 -4.195 2.007 6.247 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.465 0.916 3.754 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.586 -0.615 5.774 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.611 0.984 6.491 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -4.707 -1.298 4.726 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.346 -0.181 4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -4.003 -0.419 6.104 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -8.710 0.540 5.265 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.815 1.874 4.499 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.789 0.250 3.771 1.00 0.00 H new ATOM 167 N PHE A 24 -3.755 3.585 3.446 1.00 0.00 N ATOM 168 CA PHE A 24 -2.777 4.151 2.528 1.00 0.00 C ATOM 169 C PHE A 24 -2.892 5.683 2.428 1.00 0.00 C ATOM 170 O PHE A 24 -3.717 6.304 3.098 1.00 0.00 O ATOM 171 CB PHE A 24 -2.921 3.437 1.175 1.00 0.00 C ATOM 172 CG PHE A 24 -4.207 3.685 0.411 1.00 0.00 C ATOM 173 CD1 PHE A 24 -5.388 3.006 0.766 1.00 0.00 C ATOM 174 CD2 PHE A 24 -4.215 4.575 -0.681 1.00 0.00 C ATOM 175 CE1 PHE A 24 -6.572 3.217 0.040 1.00 0.00 C ATOM 176 CE2 PHE A 24 -5.403 4.797 -1.397 1.00 0.00 C ATOM 177 CZ PHE A 24 -6.580 4.115 -1.040 1.00 0.00 C ATOM 0 H PHE A 24 -4.676 4.016 3.364 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.769 3.981 2.906 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -2.085 3.735 0.542 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -2.826 2.364 1.344 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -5.384 2.320 1.600 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.308 5.086 -0.968 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -7.474 2.690 0.312 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -5.413 5.493 -2.223 1.00 0.00 H new ATOM 0 HZ PHE A 24 -7.490 4.282 -1.597 1.00 0.00 H new ATOM 187 N ARG A 25 -2.056 6.299 1.590 1.00 0.00 N ATOM 188 CA ARG A 25 -2.038 7.742 1.314 1.00 0.00 C ATOM 189 C ARG A 25 -1.545 7.983 -0.112 1.00 0.00 C ATOM 190 O ARG A 25 -0.772 7.173 -0.613 1.00 0.00 O ATOM 191 CB ARG A 25 -1.140 8.433 2.360 1.00 0.00 C ATOM 192 CG ARG A 25 -0.938 9.945 2.148 1.00 0.00 C ATOM 193 CD ARG A 25 -0.361 10.679 3.366 1.00 0.00 C ATOM 194 NE ARG A 25 0.881 10.060 3.861 1.00 0.00 N ATOM 195 CZ ARG A 25 1.011 9.271 4.923 1.00 0.00 C ATOM 196 NH1 ARG A 25 -0.017 8.882 5.652 1.00 0.00 N ATOM 197 NH2 ARG A 25 2.209 8.850 5.267 1.00 0.00 N ATOM 0 H ARG A 25 -1.345 5.790 1.064 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.040 8.164 1.389 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.571 8.275 3.348 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.164 7.947 2.356 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.272 10.096 1.298 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.896 10.395 1.887 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -0.165 11.718 3.101 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -1.102 10.688 4.165 1.00 0.00 H new ATOM 0 HE ARG A 25 1.731 10.258 3.333 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -0.959 9.187 5.409 1.00 0.00 H new ATOM 0 HH12 ARG A 25 0.130 8.276 6.459 1.00 0.00 H new ATOM 0 HH21 ARG A 25 3.024 9.129 4.721 1.00 0.00 H new ATOM 0 HH22 ARG A 25 2.323 8.244 6.080 1.00 0.00 H new ATOM 211 N VAL A 26 -1.980 9.072 -0.745 1.00 0.00 N ATOM 212 CA VAL A 26 -1.445 9.542 -2.038 1.00 0.00 C ATOM 213 C VAL A 26 -0.756 10.907 -1.901 1.00 0.00 C ATOM 214 O VAL A 26 -1.342 11.864 -1.400 1.00 0.00 O ATOM 215 CB VAL A 26 -2.516 9.532 -3.155 1.00 0.00 C ATOM 216 CG1 VAL A 26 -3.766 10.388 -2.887 1.00 0.00 C ATOM 217 CG2 VAL A 26 -1.914 9.931 -4.515 1.00 0.00 C ATOM 0 H VAL A 26 -2.723 9.665 -0.376 1.00 0.00 H new ATOM 0 HA VAL A 26 -0.680 8.829 -2.345 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.857 8.497 -3.171 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -4.450 10.309 -3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.263 10.034 -1.984 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -3.472 11.429 -2.755 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -2.693 9.914 -5.277 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -1.495 10.935 -4.447 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.127 9.227 -4.785 1.00 0.00 H new ATOM 227 N ASP A 27 0.488 10.989 -2.375 1.00 0.00 N ATOM 228 CA ASP A 27 1.290 12.212 -2.453 1.00 0.00 C ATOM 229 C ASP A 27 1.374 12.665 -3.919 1.00 0.00 C ATOM 230 O ASP A 27 2.144 12.122 -4.712 1.00 0.00 O ATOM 231 CB ASP A 27 2.686 11.958 -1.861 1.00 0.00 C ATOM 232 CG ASP A 27 2.726 12.067 -0.326 1.00 0.00 C ATOM 233 OD1 ASP A 27 2.351 11.097 0.376 1.00 0.00 O ATOM 234 OD2 ASP A 27 3.178 13.125 0.177 1.00 0.00 O ATOM 0 H ASP A 27 0.985 10.172 -2.730 1.00 0.00 H new ATOM 0 HA ASP A 27 0.822 13.007 -1.872 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.023 10.964 -2.157 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.389 12.673 -2.287 1.00 0.00 H new ATOM 239 N LYS A 28 0.571 13.670 -4.283 1.00 0.00 N ATOM 240 CA LYS A 28 0.455 14.170 -5.665 1.00 0.00 C ATOM 241 C LYS A 28 1.642 15.042 -6.128 1.00 0.00 C ATOM 242 O LYS A 28 1.787 15.287 -7.327 1.00 0.00 O ATOM 243 CB LYS A 28 -0.863 14.958 -5.800 1.00 0.00 C ATOM 244 CG LYS A 28 -2.118 14.071 -5.733 1.00 0.00 C ATOM 245 CD LYS A 28 -3.367 14.908 -6.059 1.00 0.00 C ATOM 246 CE LYS A 28 -4.648 14.067 -6.195 1.00 0.00 C ATOM 247 NZ LYS A 28 -5.177 13.596 -4.886 1.00 0.00 N ATOM 0 H LYS A 28 -0.025 14.168 -3.622 1.00 0.00 H new ATOM 0 HA LYS A 28 0.464 13.297 -6.317 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.913 15.705 -5.008 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.859 15.497 -6.747 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -2.029 13.245 -6.438 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.212 13.633 -4.739 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.511 15.652 -5.276 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -3.198 15.452 -6.988 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -5.413 14.659 -6.698 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.444 13.205 -6.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.039 13.036 -5.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -4.462 13.007 -4.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -5.400 14.416 -4.287 1.00 0.00 H new ATOM 261 N ASP A 29 2.491 15.509 -5.207 1.00 0.00 N ATOM 262 CA ASP A 29 3.596 16.439 -5.493 1.00 0.00 C ATOM 263 C ASP A 29 4.714 15.751 -6.290 1.00 0.00 C ATOM 264 O ASP A 29 5.173 16.263 -7.311 1.00 0.00 O ATOM 265 CB ASP A 29 4.144 17.000 -4.173 1.00 0.00 C ATOM 266 CG ASP A 29 3.131 17.923 -3.481 1.00 0.00 C ATOM 267 OD1 ASP A 29 3.091 19.126 -3.833 1.00 0.00 O ATOM 268 OD2 ASP A 29 2.388 17.446 -2.591 1.00 0.00 O ATOM 0 H ASP A 29 2.431 15.248 -4.223 1.00 0.00 H new ATOM 0 HA ASP A 29 3.214 17.256 -6.105 1.00 0.00 H new ATOM 0 HB2 ASP A 29 4.400 16.176 -3.506 1.00 0.00 H new ATOM 0 HB3 ASP A 29 5.064 17.551 -4.367 1.00 0.00 H new ATOM 273 N SER A 30 5.110 14.558 -5.841 1.00 0.00 N ATOM 274 CA SER A 30 6.041 13.663 -6.551 1.00 0.00 C ATOM 275 C SER A 30 5.324 12.516 -7.298 1.00 0.00 C ATOM 276 O SER A 30 5.948 11.818 -8.101 1.00 0.00 O ATOM 277 CB SER A 30 7.024 13.090 -5.524 1.00 0.00 C ATOM 278 OG SER A 30 7.890 14.101 -5.011 1.00 0.00 O ATOM 0 H SER A 30 4.787 14.174 -4.953 1.00 0.00 H new ATOM 0 HA SER A 30 6.560 14.244 -7.314 1.00 0.00 H new ATOM 0 HB2 SER A 30 6.470 12.633 -4.704 1.00 0.00 H new ATOM 0 HB3 SER A 30 7.617 12.301 -5.987 1.00 0.00 H new ATOM 0 HG SER A 30 8.504 13.705 -4.358 1.00 0.00 H new ATOM 284 N ARG A 31 4.017 12.329 -7.041 1.00 0.00 N ATOM 285 CA ARG A 31 3.112 11.333 -7.634 1.00 0.00 C ATOM 286 C ARG A 31 3.482 9.908 -7.184 1.00 0.00 C ATOM 287 O ARG A 31 4.105 9.134 -7.913 1.00 0.00 O ATOM 288 CB ARG A 31 2.990 11.528 -9.159 1.00 0.00 C ATOM 289 CG ARG A 31 1.656 10.971 -9.680 1.00 0.00 C ATOM 290 CD ARG A 31 1.393 11.380 -11.134 1.00 0.00 C ATOM 291 NE ARG A 31 2.214 10.602 -12.084 1.00 0.00 N ATOM 292 CZ ARG A 31 2.844 11.051 -13.166 1.00 0.00 C ATOM 293 NH1 ARG A 31 2.898 12.330 -13.475 1.00 0.00 N ATOM 294 NH2 ARG A 31 3.433 10.194 -13.968 1.00 0.00 N ATOM 0 H ARG A 31 3.531 12.915 -6.362 1.00 0.00 H new ATOM 0 HA ARG A 31 2.103 11.491 -7.253 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.065 12.588 -9.401 1.00 0.00 H new ATOM 0 HB3 ARG A 31 3.818 11.027 -9.661 1.00 0.00 H new ATOM 0 HG2 ARG A 31 1.663 9.884 -9.605 1.00 0.00 H new ATOM 0 HG3 ARG A 31 0.842 11.329 -9.049 1.00 0.00 H new ATOM 0 HD2 ARG A 31 0.337 11.237 -11.366 1.00 0.00 H new ATOM 0 HD3 ARG A 31 1.606 12.442 -11.256 1.00 0.00 H new ATOM 0 HE ARG A 31 2.309 9.606 -11.888 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.446 13.019 -12.874 1.00 0.00 H new ATOM 0 HH12 ARG A 31 3.392 12.631 -14.315 1.00 0.00 H new ATOM 0 HH21 ARG A 31 3.404 9.196 -13.758 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.919 10.526 -14.801 1.00 0.00 H new ATOM 308 N GLU A 32 3.109 9.585 -5.943 1.00 0.00 N ATOM 309 CA GLU A 32 3.495 8.367 -5.214 1.00 0.00 C ATOM 310 C GLU A 32 2.432 7.986 -4.165 1.00 0.00 C ATOM 311 O GLU A 32 1.590 8.814 -3.825 1.00 0.00 O ATOM 312 CB GLU A 32 4.908 8.546 -4.624 1.00 0.00 C ATOM 313 CG GLU A 32 5.098 9.737 -3.673 1.00 0.00 C ATOM 314 CD GLU A 32 6.586 10.017 -3.372 1.00 0.00 C ATOM 315 OE1 GLU A 32 7.409 10.089 -4.316 1.00 0.00 O ATOM 316 OE2 GLU A 32 6.937 10.233 -2.187 1.00 0.00 O ATOM 0 H GLU A 32 2.502 10.191 -5.391 1.00 0.00 H new ATOM 0 HA GLU A 32 3.538 7.523 -5.902 1.00 0.00 H new ATOM 0 HB2 GLU A 32 5.174 7.634 -4.089 1.00 0.00 H new ATOM 0 HB3 GLU A 32 5.613 8.650 -5.449 1.00 0.00 H new ATOM 0 HG2 GLU A 32 4.645 10.626 -4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 32 4.572 9.540 -2.739 1.00 0.00 H new ATOM 323 N VAL A 33 2.427 6.734 -3.688 1.00 0.00 N ATOM 324 CA VAL A 33 1.343 6.133 -2.885 1.00 0.00 C ATOM 325 C VAL A 33 1.904 5.229 -1.778 1.00 0.00 C ATOM 326 O VAL A 33 2.647 4.290 -2.043 1.00 0.00 O ATOM 327 CB VAL A 33 0.318 5.355 -3.756 1.00 0.00 C ATOM 328 CG1 VAL A 33 -0.649 6.315 -4.443 1.00 0.00 C ATOM 329 CG2 VAL A 33 0.962 4.455 -4.830 1.00 0.00 C ATOM 0 H VAL A 33 3.199 6.088 -3.853 1.00 0.00 H new ATOM 0 HA VAL A 33 0.809 6.962 -2.420 1.00 0.00 H new ATOM 0 HB VAL A 33 -0.210 4.705 -3.058 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -1.357 5.748 -5.047 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -1.191 6.887 -3.690 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.091 6.997 -5.084 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.181 3.947 -5.395 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.560 5.066 -5.506 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.602 3.715 -4.349 1.00 0.00 H new ATOM 339 N TYR A 34 1.582 5.518 -0.517 1.00 0.00 N ATOM 340 CA TYR A 34 2.224 4.921 0.661 1.00 0.00 C ATOM 341 C TYR A 34 1.251 3.986 1.378 1.00 0.00 C ATOM 342 O TYR A 34 0.159 4.427 1.729 1.00 0.00 O ATOM 343 CB TYR A 34 2.673 6.035 1.628 1.00 0.00 C ATOM 344 CG TYR A 34 4.006 6.712 1.339 1.00 0.00 C ATOM 345 CD1 TYR A 34 4.349 7.144 0.042 1.00 0.00 C ATOM 346 CD2 TYR A 34 4.905 6.943 2.402 1.00 0.00 C ATOM 347 CE1 TYR A 34 5.579 7.780 -0.196 1.00 0.00 C ATOM 348 CE2 TYR A 34 6.130 7.600 2.175 1.00 0.00 C ATOM 349 CZ TYR A 34 6.473 8.020 0.871 1.00 0.00 C ATOM 350 OH TYR A 34 7.658 8.656 0.648 1.00 0.00 O ATOM 0 H TYR A 34 0.851 6.188 -0.278 1.00 0.00 H new ATOM 0 HA TYR A 34 3.092 4.348 0.335 1.00 0.00 H new ATOM 0 HB2 TYR A 34 1.900 6.803 1.641 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.719 5.613 2.632 1.00 0.00 H new ATOM 0 HD1 TYR A 34 3.661 6.985 -0.775 1.00 0.00 H new ATOM 0 HD2 TYR A 34 4.651 6.613 3.399 1.00 0.00 H new ATOM 0 HE1 TYR A 34 5.842 8.086 -1.198 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.806 7.782 2.997 1.00 0.00 H new ATOM 0 HH TYR A 34 7.599 9.177 -0.180 1.00 0.00 H new ATOM 360 N MET A 35 1.623 2.720 1.607 1.00 0.00 N ATOM 361 CA MET A 35 0.857 1.770 2.414 1.00 0.00 C ATOM 362 C MET A 35 1.321 1.853 3.871 1.00 0.00 C ATOM 363 O MET A 35 2.497 2.103 4.136 1.00 0.00 O ATOM 364 CB MET A 35 1.055 0.330 1.885 1.00 0.00 C ATOM 365 CG MET A 35 0.429 0.047 0.513 1.00 0.00 C ATOM 366 SD MET A 35 1.143 0.927 -0.903 1.00 0.00 S ATOM 367 CE MET A 35 -0.154 2.158 -1.185 1.00 0.00 C ATOM 0 H MET A 35 2.482 2.323 1.228 1.00 0.00 H new ATOM 0 HA MET A 35 -0.201 2.022 2.350 1.00 0.00 H new ATOM 0 HB2 MET A 35 2.124 0.124 1.828 1.00 0.00 H new ATOM 0 HB3 MET A 35 0.634 -0.367 2.609 1.00 0.00 H new ATOM 0 HG2 MET A 35 0.501 -1.023 0.320 1.00 0.00 H new ATOM 0 HG3 MET A 35 -0.632 0.291 0.566 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.582 2.015 -2.177 1.00 0.00 H new ATOM 0 HE2 MET A 35 -0.935 2.043 -0.433 1.00 0.00 H new ATOM 0 HE3 MET A 35 0.273 3.159 -1.115 1.00 0.00 H new ATOM 377 N HIS A 36 0.440 1.520 4.816 1.00 0.00 N ATOM 378 CA HIS A 36 0.778 1.338 6.238 1.00 0.00 C ATOM 379 C HIS A 36 1.985 0.391 6.472 1.00 0.00 C ATOM 380 O HIS A 36 2.713 0.532 7.458 1.00 0.00 O ATOM 381 CB HIS A 36 -0.491 0.818 6.933 1.00 0.00 C ATOM 382 CG HIS A 36 -0.319 0.546 8.402 1.00 0.00 C ATOM 383 ND1 HIS A 36 -0.103 -0.712 8.970 1.00 0.00 N ATOM 384 CD2 HIS A 36 -0.348 1.484 9.392 1.00 0.00 C ATOM 385 CE1 HIS A 36 -0.006 -0.497 10.294 1.00 0.00 C ATOM 386 NE2 HIS A 36 -0.149 0.811 10.577 1.00 0.00 N ATOM 0 H HIS A 36 -0.548 1.365 4.616 1.00 0.00 H new ATOM 0 HA HIS A 36 1.098 2.292 6.657 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -1.290 1.548 6.801 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -0.812 -0.099 6.440 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -0.498 2.547 9.270 1.00 0.00 H new ATOM 0 HE1 HIS A 36 0.164 -1.269 11.030 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -0.116 1.230 11.506 1.00 0.00 H new ATOM 394 N GLU A 37 2.217 -0.542 5.538 1.00 0.00 N ATOM 395 CA GLU A 37 3.335 -1.490 5.554 1.00 0.00 C ATOM 396 C GLU A 37 4.655 -0.870 5.055 1.00 0.00 C ATOM 397 O GLU A 37 5.697 -1.252 5.584 1.00 0.00 O ATOM 398 CB GLU A 37 2.965 -2.744 4.728 1.00 0.00 C ATOM 399 CG GLU A 37 1.753 -3.467 5.345 1.00 0.00 C ATOM 400 CD GLU A 37 1.271 -4.672 4.519 1.00 0.00 C ATOM 401 OE1 GLU A 37 1.260 -4.592 3.268 1.00 0.00 O ATOM 402 OE2 GLU A 37 0.841 -5.678 5.133 1.00 0.00 O ATOM 0 H GLU A 37 1.611 -0.660 4.726 1.00 0.00 H new ATOM 0 HA GLU A 37 3.509 -1.774 6.592 1.00 0.00 H new ATOM 0 HB2 GLU A 37 2.738 -2.455 3.702 1.00 0.00 H new ATOM 0 HB3 GLU A 37 3.817 -3.423 4.687 1.00 0.00 H new ATOM 0 HG2 GLU A 37 2.014 -3.805 6.348 1.00 0.00 H new ATOM 0 HG3 GLU A 37 0.932 -2.758 5.451 1.00 0.00 H new ATOM 409 N LYS A 38 4.629 0.060 4.075 1.00 0.00 N ATOM 410 CA LYS A 38 5.785 0.661 3.347 1.00 0.00 C ATOM 411 C LYS A 38 5.387 1.469 2.077 1.00 0.00 C ATOM 412 O LYS A 38 4.262 1.383 1.587 1.00 0.00 O ATOM 413 CB LYS A 38 6.920 -0.367 3.081 1.00 0.00 C ATOM 414 CG LYS A 38 6.494 -1.678 2.383 1.00 0.00 C ATOM 415 CD LYS A 38 7.483 -2.841 2.591 1.00 0.00 C ATOM 416 CE LYS A 38 7.239 -3.683 3.859 1.00 0.00 C ATOM 417 NZ LYS A 38 7.786 -3.075 5.105 1.00 0.00 N ATOM 0 H LYS A 38 3.743 0.441 3.744 1.00 0.00 H new ATOM 0 HA LYS A 38 6.195 1.406 4.029 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.684 0.115 2.471 1.00 0.00 H new ATOM 0 HB3 LYS A 38 7.385 -0.620 4.034 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.514 -1.975 2.756 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.386 -1.492 1.315 1.00 0.00 H new ATOM 0 HD2 LYS A 38 7.437 -3.498 1.722 1.00 0.00 H new ATOM 0 HD3 LYS A 38 8.494 -2.436 2.631 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.167 -3.834 3.981 1.00 0.00 H new ATOM 0 HE3 LYS A 38 7.686 -4.667 3.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 7.958 -3.821 5.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.680 -2.589 4.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 7.102 -2.390 5.486 1.00 0.00 H new ATOM 431 N LYS A 39 6.299 2.290 1.534 1.00 0.00 N ATOM 432 CA LYS A 39 6.041 3.250 0.447 1.00 0.00 C ATOM 433 C LYS A 39 6.103 2.670 -0.988 1.00 0.00 C ATOM 434 O LYS A 39 6.923 1.798 -1.255 1.00 0.00 O ATOM 435 CB LYS A 39 7.022 4.417 0.646 1.00 0.00 C ATOM 436 CG LYS A 39 8.517 4.087 0.455 1.00 0.00 C ATOM 437 CD LYS A 39 9.410 5.332 0.576 1.00 0.00 C ATOM 438 CE LYS A 39 9.427 5.908 2.003 1.00 0.00 C ATOM 439 NZ LYS A 39 10.250 7.146 2.090 1.00 0.00 N ATOM 0 H LYS A 39 7.269 2.305 1.849 1.00 0.00 H new ATOM 0 HA LYS A 39 5.003 3.575 0.519 1.00 0.00 H new ATOM 0 HB2 LYS A 39 6.755 5.212 -0.050 1.00 0.00 H new ATOM 0 HB3 LYS A 39 6.884 4.814 1.652 1.00 0.00 H new ATOM 0 HG2 LYS A 39 8.822 3.350 1.198 1.00 0.00 H new ATOM 0 HG3 LYS A 39 8.664 3.631 -0.524 1.00 0.00 H new ATOM 0 HD2 LYS A 39 10.427 5.076 0.279 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.058 6.096 -0.117 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.407 6.127 2.319 1.00 0.00 H new ATOM 0 HE3 LYS A 39 9.821 5.161 2.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 10.237 7.504 3.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 11.229 6.932 1.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.859 7.868 1.451 1.00 0.00 H new ATOM 453 N LEU A 40 5.287 3.170 -1.926 1.00 0.00 N ATOM 454 CA LEU A 40 5.342 2.855 -3.367 1.00 0.00 C ATOM 455 C LEU A 40 5.179 4.121 -4.221 1.00 0.00 C ATOM 456 O LEU A 40 4.705 5.154 -3.757 1.00 0.00 O ATOM 457 CB LEU A 40 4.290 1.776 -3.724 1.00 0.00 C ATOM 458 CG LEU A 40 4.727 0.346 -3.349 1.00 0.00 C ATOM 459 CD1 LEU A 40 3.596 -0.664 -3.589 1.00 0.00 C ATOM 460 CD2 LEU A 40 5.949 -0.098 -4.175 1.00 0.00 C ATOM 0 H LEU A 40 4.543 3.829 -1.698 1.00 0.00 H new ATOM 0 HA LEU A 40 6.327 2.447 -3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 40 3.355 2.008 -3.213 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.087 1.817 -4.794 1.00 0.00 H new ATOM 0 HG LEU A 40 4.984 0.367 -2.290 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.936 -1.663 -3.315 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.733 -0.395 -2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.315 -0.653 -4.642 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.234 -1.110 -3.888 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.698 -0.078 -5.236 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.781 0.580 -3.987 1.00 0.00 H new ATOM 472 N ASP A 41 5.610 4.057 -5.481 1.00 0.00 N ATOM 473 CA ASP A 41 6.034 5.256 -6.230 1.00 0.00 C ATOM 474 C ASP A 41 5.590 5.250 -7.711 1.00 0.00 C ATOM 475 O ASP A 41 6.256 5.821 -8.578 1.00 0.00 O ATOM 476 CB ASP A 41 7.562 5.393 -6.090 1.00 0.00 C ATOM 477 CG ASP A 41 8.049 5.445 -4.629 1.00 0.00 C ATOM 478 OD1 ASP A 41 8.060 6.549 -4.035 1.00 0.00 O ATOM 479 OD2 ASP A 41 8.458 4.385 -4.097 1.00 0.00 O ATOM 0 H ASP A 41 5.677 3.189 -6.012 1.00 0.00 H new ATOM 0 HA ASP A 41 5.535 6.125 -5.801 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.041 4.553 -6.593 1.00 0.00 H new ATOM 0 HB3 ASP A 41 7.885 6.298 -6.604 1.00 0.00 H new ATOM 484 N LEU A 42 4.492 4.546 -8.015 1.00 0.00 N ATOM 485 CA LEU A 42 4.044 4.241 -9.385 1.00 0.00 C ATOM 486 C LEU A 42 3.049 5.279 -9.958 1.00 0.00 C ATOM 487 O LEU A 42 2.707 6.257 -9.286 1.00 0.00 O ATOM 488 CB LEU A 42 3.555 2.770 -9.392 1.00 0.00 C ATOM 489 CG LEU A 42 4.122 1.842 -10.499 1.00 0.00 C ATOM 490 CD1 LEU A 42 5.644 1.988 -10.628 1.00 0.00 C ATOM 491 CD2 LEU A 42 3.855 0.379 -10.108 1.00 0.00 C ATOM 0 H LEU A 42 3.874 4.162 -7.300 1.00 0.00 H new ATOM 0 HA LEU A 42 4.872 4.331 -10.088 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.796 2.329 -8.425 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.468 2.775 -9.479 1.00 0.00 H new ATOM 0 HG LEU A 42 3.641 2.116 -11.438 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.008 1.324 -11.412 1.00 0.00 H new ATOM 0 HD12 LEU A 42 5.890 3.019 -10.882 1.00 0.00 H new ATOM 0 HD13 LEU A 42 6.116 1.725 -9.682 1.00 0.00 H new ATOM 0 HD21 LEU A 42 4.250 -0.282 -10.880 1.00 0.00 H new ATOM 0 HD22 LEU A 42 4.344 0.161 -9.159 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.781 0.219 -10.008 1.00 0.00 H new ATOM 503 N THR A 43 2.635 5.104 -11.226 1.00 0.00 N ATOM 504 CA THR A 43 1.955 6.162 -12.020 1.00 0.00 C ATOM 505 C THR A 43 0.461 6.181 -11.765 1.00 0.00 C ATOM 506 O THR A 43 -0.048 5.249 -11.165 1.00 0.00 O ATOM 507 CB THR A 43 2.287 6.065 -13.519 1.00 0.00 C ATOM 508 OG1 THR A 43 2.396 7.394 -13.981 1.00 0.00 O ATOM 509 CG2 THR A 43 1.263 5.357 -14.411 1.00 0.00 C ATOM 0 H THR A 43 2.759 4.229 -11.735 1.00 0.00 H new ATOM 0 HA THR A 43 2.348 7.119 -11.678 1.00 0.00 H new ATOM 0 HB THR A 43 3.190 5.458 -13.591 1.00 0.00 H new ATOM 0 HG1 THR A 43 2.610 7.391 -14.937 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.617 5.357 -15.442 1.00 0.00 H new ATOM 0 HG22 THR A 43 1.134 4.329 -14.072 1.00 0.00 H new ATOM 0 HG23 THR A 43 0.308 5.880 -14.355 1.00 0.00 H new ATOM 517 N ARG A 44 -0.262 7.176 -12.287 1.00 0.00 N ATOM 518 CA ARG A 44 -1.704 7.376 -12.050 1.00 0.00 C ATOM 519 C ARG A 44 -2.544 6.096 -12.163 1.00 0.00 C ATOM 520 O ARG A 44 -3.380 5.835 -11.301 1.00 0.00 O ATOM 521 CB ARG A 44 -2.266 8.434 -13.018 1.00 0.00 C ATOM 522 CG ARG A 44 -1.667 9.826 -12.779 1.00 0.00 C ATOM 523 CD ARG A 44 -2.316 10.878 -13.687 1.00 0.00 C ATOM 524 NE ARG A 44 -1.682 12.200 -13.527 1.00 0.00 N ATOM 525 CZ ARG A 44 -1.940 13.113 -12.594 1.00 0.00 C ATOM 526 NH1 ARG A 44 -2.807 12.904 -11.625 1.00 0.00 N ATOM 527 NH2 ARG A 44 -1.313 14.268 -12.626 1.00 0.00 N ATOM 0 H ARG A 44 0.143 7.883 -12.900 1.00 0.00 H new ATOM 0 HA ARG A 44 -1.783 7.714 -11.017 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.064 8.127 -14.044 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.349 8.484 -12.907 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.805 10.109 -11.735 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -0.593 9.798 -12.962 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.238 10.560 -14.727 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.379 10.953 -13.456 1.00 0.00 H new ATOM 0 HE ARG A 44 -0.964 12.442 -14.210 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.308 12.017 -11.571 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -2.977 13.629 -10.928 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -0.634 14.459 -13.363 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -1.506 14.973 -11.914 1.00 0.00 H new ATOM 541 N ALA A 45 -2.293 5.268 -13.184 1.00 0.00 N ATOM 542 CA ALA A 45 -3.044 4.027 -13.409 1.00 0.00 C ATOM 543 C ALA A 45 -2.701 2.965 -12.350 1.00 0.00 C ATOM 544 O ALA A 45 -3.593 2.388 -11.723 1.00 0.00 O ATOM 545 CB ALA A 45 -2.742 3.558 -14.839 1.00 0.00 C ATOM 0 H ALA A 45 -1.564 5.439 -13.877 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.115 4.200 -13.305 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.285 2.635 -15.042 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.054 4.326 -15.547 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -1.672 3.380 -14.945 1.00 0.00 H new ATOM 551 N GLU A 46 -1.405 2.772 -12.099 1.00 0.00 N ATOM 552 CA GLU A 46 -0.890 1.846 -11.097 1.00 0.00 C ATOM 553 C GLU A 46 -1.305 2.246 -9.673 1.00 0.00 C ATOM 554 O GLU A 46 -1.712 1.409 -8.875 1.00 0.00 O ATOM 555 CB GLU A 46 0.633 1.784 -11.237 1.00 0.00 C ATOM 556 CG GLU A 46 1.079 0.910 -12.415 1.00 0.00 C ATOM 557 CD GLU A 46 1.357 1.729 -13.681 1.00 0.00 C ATOM 558 OE1 GLU A 46 2.449 2.339 -13.761 1.00 0.00 O ATOM 559 OE2 GLU A 46 0.493 1.762 -14.586 1.00 0.00 O ATOM 0 H GLU A 46 -0.669 3.269 -12.601 1.00 0.00 H new ATOM 0 HA GLU A 46 -1.319 0.859 -11.268 1.00 0.00 H new ATOM 0 HB2 GLU A 46 1.024 2.793 -11.369 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.064 1.393 -10.315 1.00 0.00 H new ATOM 0 HG2 GLU A 46 1.979 0.361 -12.136 1.00 0.00 H new ATOM 0 HG3 GLU A 46 0.307 0.170 -12.627 1.00 0.00 H new ATOM 566 N TYR A 47 -1.297 3.542 -9.376 1.00 0.00 N ATOM 567 CA TYR A 47 -1.888 4.119 -8.166 1.00 0.00 C ATOM 568 C TYR A 47 -3.364 3.743 -8.064 1.00 0.00 C ATOM 569 O TYR A 47 -3.756 3.203 -7.033 1.00 0.00 O ATOM 570 CB TYR A 47 -1.643 5.645 -8.114 1.00 0.00 C ATOM 571 CG TYR A 47 -2.734 6.551 -7.527 1.00 0.00 C ATOM 572 CD1 TYR A 47 -3.463 6.225 -6.362 1.00 0.00 C ATOM 573 CD2 TYR A 47 -3.012 7.773 -8.166 1.00 0.00 C ATOM 574 CE1 TYR A 47 -4.459 7.085 -5.862 1.00 0.00 C ATOM 575 CE2 TYR A 47 -4.007 8.642 -7.683 1.00 0.00 C ATOM 576 CZ TYR A 47 -4.743 8.298 -6.528 1.00 0.00 C ATOM 577 OH TYR A 47 -5.706 9.140 -6.058 1.00 0.00 O ATOM 0 H TYR A 47 -0.869 4.241 -9.984 1.00 0.00 H new ATOM 0 HA TYR A 47 -1.398 3.699 -7.288 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -0.731 5.813 -7.541 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -1.447 5.982 -9.132 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -3.253 5.300 -5.846 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -2.450 8.050 -9.046 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -5.006 6.818 -4.970 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -4.208 9.571 -8.195 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.765 9.926 -6.640 1.00 0.00 H new ATOM 587 N GLU A 48 -4.156 3.980 -9.111 1.00 0.00 N ATOM 588 CA GLU A 48 -5.586 3.686 -9.110 1.00 0.00 C ATOM 589 C GLU A 48 -5.861 2.216 -8.745 1.00 0.00 C ATOM 590 O GLU A 48 -6.698 1.956 -7.877 1.00 0.00 O ATOM 591 CB GLU A 48 -6.189 4.052 -10.476 1.00 0.00 C ATOM 592 CG GLU A 48 -7.695 4.305 -10.428 1.00 0.00 C ATOM 593 CD GLU A 48 -8.049 5.582 -9.647 1.00 0.00 C ATOM 594 OE1 GLU A 48 -7.867 6.696 -10.193 1.00 0.00 O ATOM 595 OE2 GLU A 48 -8.539 5.485 -8.498 1.00 0.00 O ATOM 0 H GLU A 48 -3.820 4.383 -9.986 1.00 0.00 H new ATOM 0 HA GLU A 48 -6.067 4.293 -8.343 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.691 4.943 -10.857 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.986 3.247 -11.182 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -8.080 4.385 -11.445 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -8.190 3.451 -9.966 1.00 0.00 H new ATOM 602 N ILE A 49 -5.118 1.251 -9.317 1.00 0.00 N ATOM 603 CA ILE A 49 -5.290 -0.159 -8.930 1.00 0.00 C ATOM 604 C ILE A 49 -4.805 -0.462 -7.515 1.00 0.00 C ATOM 605 O ILE A 49 -5.530 -1.137 -6.794 1.00 0.00 O ATOM 606 CB ILE A 49 -4.742 -1.160 -9.973 1.00 0.00 C ATOM 607 CG1 ILE A 49 -3.378 -0.869 -10.641 1.00 0.00 C ATOM 608 CG2 ILE A 49 -5.851 -1.392 -11.008 1.00 0.00 C ATOM 609 CD1 ILE A 49 -2.182 -1.484 -9.902 1.00 0.00 C ATOM 0 H ILE A 49 -4.409 1.416 -10.032 1.00 0.00 H new ATOM 0 HA ILE A 49 -6.369 -0.312 -8.916 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.487 -2.056 -9.408 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -3.396 -1.249 -11.663 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.238 0.210 -10.704 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.502 -2.095 -11.764 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -6.732 -1.800 -10.512 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.108 -0.446 -11.484 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -1.261 -1.237 -10.431 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -2.137 -1.086 -8.888 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -2.297 -2.567 -9.861 1.00 0.00 H new ATOM 621 N LEU A 50 -3.639 0.029 -7.089 1.00 0.00 N ATOM 622 CA LEU A 50 -3.077 -0.241 -5.757 1.00 0.00 C ATOM 623 C LEU A 50 -3.994 0.354 -4.666 1.00 0.00 C ATOM 624 O LEU A 50 -4.423 -0.354 -3.761 1.00 0.00 O ATOM 625 CB LEU A 50 -1.658 0.372 -5.757 1.00 0.00 C ATOM 626 CG LEU A 50 -0.631 -0.111 -4.713 1.00 0.00 C ATOM 627 CD1 LEU A 50 0.397 1.009 -4.529 1.00 0.00 C ATOM 628 CD2 LEU A 50 -1.224 -0.518 -3.360 1.00 0.00 C ATOM 0 H LEU A 50 -3.050 0.632 -7.663 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.013 -1.307 -5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.227 0.203 -6.744 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.766 1.450 -5.637 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.182 -1.027 -5.097 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.142 0.702 -3.795 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.888 1.212 -5.481 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.106 1.911 -4.180 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -0.424 -0.842 -2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.740 0.334 -2.918 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.930 -1.336 -3.503 1.00 0.00 H new ATOM 640 N SER A 51 -4.350 1.633 -4.795 1.00 0.00 N ATOM 641 CA SER A 51 -5.416 2.326 -4.052 1.00 0.00 C ATOM 642 C SER A 51 -6.692 1.490 -3.905 1.00 0.00 C ATOM 643 O SER A 51 -7.069 1.147 -2.777 1.00 0.00 O ATOM 644 CB SER A 51 -5.743 3.649 -4.769 1.00 0.00 C ATOM 645 OG SER A 51 -6.875 4.310 -4.223 1.00 0.00 O ATOM 0 H SER A 51 -3.879 2.251 -5.456 1.00 0.00 H new ATOM 0 HA SER A 51 -5.045 2.507 -3.043 1.00 0.00 H new ATOM 0 HB2 SER A 51 -4.879 4.311 -4.710 1.00 0.00 H new ATOM 0 HB3 SER A 51 -5.920 3.449 -5.826 1.00 0.00 H new ATOM 0 HG SER A 51 -6.756 4.418 -3.256 1.00 0.00 H new ATOM 651 N LEU A 52 -7.357 1.123 -5.015 1.00 0.00 N ATOM 652 CA LEU A 52 -8.637 0.415 -4.923 1.00 0.00 C ATOM 653 C LEU A 52 -8.446 -0.979 -4.320 1.00 0.00 C ATOM 654 O LEU A 52 -9.319 -1.470 -3.606 1.00 0.00 O ATOM 655 CB LEU A 52 -9.295 0.356 -6.316 1.00 0.00 C ATOM 656 CG LEU A 52 -10.826 0.571 -6.375 1.00 0.00 C ATOM 657 CD1 LEU A 52 -11.630 -0.605 -5.812 1.00 0.00 C ATOM 658 CD2 LEU A 52 -11.278 1.883 -5.714 1.00 0.00 C ATOM 0 H LEU A 52 -7.034 1.302 -5.966 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.304 0.959 -4.254 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.822 1.108 -6.947 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -9.071 -0.616 -6.756 1.00 0.00 H new ATOM 0 HG LEU A 52 -11.044 0.639 -7.441 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -12.695 -0.386 -5.885 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -11.405 -1.506 -6.383 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -11.363 -0.761 -4.767 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -12.362 1.974 -5.789 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -10.986 1.881 -4.664 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -10.807 2.726 -6.220 1.00 0.00 H new ATOM 670 N LEU A 53 -7.288 -1.597 -4.558 1.00 0.00 N ATOM 671 CA LEU A 53 -6.970 -2.931 -4.062 1.00 0.00 C ATOM 672 C LEU A 53 -6.751 -2.935 -2.545 1.00 0.00 C ATOM 673 O LEU A 53 -7.361 -3.738 -1.851 1.00 0.00 O ATOM 674 CB LEU A 53 -5.791 -3.455 -4.886 1.00 0.00 C ATOM 675 CG LEU A 53 -5.276 -4.827 -4.435 1.00 0.00 C ATOM 676 CD1 LEU A 53 -5.098 -5.758 -5.641 1.00 0.00 C ATOM 677 CD2 LEU A 53 -4.005 -4.671 -3.587 1.00 0.00 C ATOM 0 H LEU A 53 -6.538 -1.178 -5.107 1.00 0.00 H new ATOM 0 HA LEU A 53 -7.806 -3.617 -4.196 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -6.091 -3.517 -5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.974 -2.736 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.017 -5.302 -3.791 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -4.732 -6.727 -5.302 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.056 -5.888 -6.145 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -4.380 -5.321 -6.335 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.653 -5.654 -3.275 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.232 -4.179 -4.177 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.227 -4.069 -2.706 1.00 0.00 H new ATOM 689 N ILE A 54 -5.956 -2.018 -1.994 1.00 0.00 N ATOM 690 CA ILE A 54 -5.864 -1.840 -0.529 1.00 0.00 C ATOM 691 C ILE A 54 -7.224 -1.452 0.075 1.00 0.00 C ATOM 692 O ILE A 54 -7.588 -1.972 1.131 1.00 0.00 O ATOM 693 CB ILE A 54 -4.780 -0.787 -0.184 1.00 0.00 C ATOM 694 CG1 ILE A 54 -3.363 -1.184 -0.654 1.00 0.00 C ATOM 695 CG2 ILE A 54 -4.759 -0.468 1.321 1.00 0.00 C ATOM 696 CD1 ILE A 54 -2.702 -2.347 0.094 1.00 0.00 C ATOM 0 H ILE A 54 -5.364 -1.384 -2.531 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.573 -2.793 -0.088 1.00 0.00 H new ATOM 0 HB ILE A 54 -5.064 0.108 -0.738 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -3.413 -1.442 -1.712 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -2.717 -0.310 -0.569 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -3.987 0.274 1.525 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.729 -0.074 1.623 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -4.546 -1.377 1.883 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -1.713 -2.533 -0.324 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.608 -2.094 1.150 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -3.315 -3.242 -0.011 1.00 0.00 H new ATOM 708 N SER A 55 -7.993 -0.583 -0.586 1.00 0.00 N ATOM 709 CA SER A 55 -9.321 -0.170 -0.109 1.00 0.00 C ATOM 710 C SER A 55 -10.315 -1.349 0.003 1.00 0.00 C ATOM 711 O SER A 55 -11.052 -1.442 0.990 1.00 0.00 O ATOM 712 CB SER A 55 -9.880 0.923 -1.035 1.00 0.00 C ATOM 713 OG SER A 55 -11.019 1.571 -0.477 1.00 0.00 O ATOM 0 H SER A 55 -7.716 -0.145 -1.465 1.00 0.00 H new ATOM 0 HA SER A 55 -9.199 0.223 0.900 1.00 0.00 H new ATOM 0 HB2 SER A 55 -9.104 1.662 -1.231 1.00 0.00 H new ATOM 0 HB3 SER A 55 -10.149 0.481 -1.994 1.00 0.00 H new ATOM 0 HG SER A 55 -11.341 2.258 -1.097 1.00 0.00 H new ATOM 719 N LYS A 56 -10.339 -2.268 -0.978 1.00 0.00 N ATOM 720 CA LYS A 56 -11.262 -3.419 -1.001 1.00 0.00 C ATOM 721 C LYS A 56 -10.744 -4.669 -0.250 1.00 0.00 C ATOM 722 O LYS A 56 -11.566 -5.460 0.219 1.00 0.00 O ATOM 723 CB LYS A 56 -11.667 -3.707 -2.463 1.00 0.00 C ATOM 724 CG LYS A 56 -10.655 -4.513 -3.300 1.00 0.00 C ATOM 725 CD LYS A 56 -10.928 -4.329 -4.805 1.00 0.00 C ATOM 726 CE LYS A 56 -10.136 -5.281 -5.723 1.00 0.00 C ATOM 727 NZ LYS A 56 -10.720 -6.656 -5.728 1.00 0.00 N ATOM 0 H LYS A 56 -9.714 -2.234 -1.784 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.151 -3.146 -0.433 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -12.614 -4.247 -2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -11.846 -2.755 -2.963 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -9.641 -4.188 -3.066 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -10.719 -5.570 -3.040 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -11.993 -4.472 -4.988 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -10.693 -3.301 -5.080 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -10.129 -4.885 -6.738 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -9.099 -5.327 -5.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -10.161 -7.268 -6.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -10.704 -7.043 -4.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -11.702 -6.615 -6.068 1.00 0.00 H new ATOM 741 N LYS A 57 -9.411 -4.814 -0.148 1.00 0.00 N ATOM 742 CA LYS A 57 -8.549 -5.857 0.470 1.00 0.00 C ATOM 743 C LYS A 57 -7.534 -6.414 -0.548 1.00 0.00 C ATOM 744 O LYS A 57 -7.861 -6.593 -1.722 1.00 0.00 O ATOM 745 CB LYS A 57 -9.337 -6.986 1.162 1.00 0.00 C ATOM 746 CG LYS A 57 -8.516 -8.152 1.740 1.00 0.00 C ATOM 747 CD LYS A 57 -9.325 -9.086 2.659 1.00 0.00 C ATOM 748 CE LYS A 57 -10.490 -9.822 1.968 1.00 0.00 C ATOM 749 NZ LYS A 57 -11.780 -9.075 2.025 1.00 0.00 N ATOM 0 H LYS A 57 -8.817 -4.094 -0.559 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.999 -5.357 1.267 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.920 -6.547 1.972 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -10.047 -7.394 0.443 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.102 -8.736 0.918 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -7.673 -7.748 2.300 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -8.649 -9.826 3.087 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.724 -8.501 3.488 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.229 -10.002 0.925 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -10.623 -10.797 2.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -12.569 -9.732 1.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -11.884 -8.633 2.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.787 -8.338 1.292 1.00 0.00 H new ATOM 763 N GLY A 58 -6.323 -6.735 -0.060 1.00 0.00 N ATOM 764 CA GLY A 58 -5.140 -7.085 -0.858 1.00 0.00 C ATOM 765 C GLY A 58 -5.388 -8.076 -1.997 1.00 0.00 C ATOM 766 O GLY A 58 -4.969 -7.798 -3.115 1.00 0.00 O ATOM 0 H GLY A 58 -6.137 -6.758 0.943 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -4.723 -6.170 -1.279 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -4.384 -7.503 -0.193 1.00 0.00 H new ATOM 770 N TYR A 59 -6.093 -9.191 -1.752 1.00 0.00 N ATOM 771 CA TYR A 59 -6.571 -10.102 -2.795 1.00 0.00 C ATOM 772 C TYR A 59 -5.403 -10.534 -3.699 1.00 0.00 C ATOM 773 O TYR A 59 -4.306 -10.848 -3.236 1.00 0.00 O ATOM 774 CB TYR A 59 -7.798 -9.434 -3.468 1.00 0.00 C ATOM 775 CG TYR A 59 -8.579 -10.289 -4.451 1.00 0.00 C ATOM 776 CD1 TYR A 59 -9.171 -11.494 -4.026 1.00 0.00 C ATOM 777 CD2 TYR A 59 -8.677 -9.899 -5.804 1.00 0.00 C ATOM 778 CE1 TYR A 59 -9.848 -12.315 -4.949 1.00 0.00 C ATOM 779 CE2 TYR A 59 -9.348 -10.720 -6.731 1.00 0.00 C ATOM 780 CZ TYR A 59 -9.936 -11.934 -6.306 1.00 0.00 C ATOM 781 OH TYR A 59 -10.587 -12.735 -7.196 1.00 0.00 O ATOM 0 H TYR A 59 -6.349 -9.486 -0.810 1.00 0.00 H new ATOM 0 HA TYR A 59 -6.934 -11.056 -2.413 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -8.480 -9.105 -2.684 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.457 -8.540 -3.989 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -9.106 -11.790 -2.989 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -8.236 -8.968 -6.129 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -10.301 -13.238 -4.618 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.414 -10.422 -7.767 1.00 0.00 H new ATOM 0 HH TYR A 59 -10.557 -12.327 -8.086 1.00 0.00 H new ATOM 791 N VAL A 60 -5.641 -10.528 -4.997 1.00 0.00 N ATOM 792 CA VAL A 60 -4.621 -10.618 -6.039 1.00 0.00 C ATOM 793 C VAL A 60 -4.798 -9.456 -7.029 1.00 0.00 C ATOM 794 O VAL A 60 -5.893 -9.233 -7.543 1.00 0.00 O ATOM 795 CB VAL A 60 -4.694 -11.993 -6.732 1.00 0.00 C ATOM 796 CG1 VAL A 60 -3.571 -12.161 -7.770 1.00 0.00 C ATOM 797 CG2 VAL A 60 -4.578 -13.167 -5.739 1.00 0.00 C ATOM 0 H VAL A 60 -6.586 -10.458 -5.375 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.627 -10.532 -5.600 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.672 -12.018 -7.212 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -3.653 -13.141 -8.239 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.660 -11.386 -8.531 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.603 -12.075 -7.276 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -4.636 -14.110 -6.282 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.624 -13.108 -5.215 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -5.392 -13.114 -5.016 1.00 0.00 H new ATOM 807 N PHE A 61 -3.708 -8.727 -7.293 1.00 0.00 N ATOM 808 CA PHE A 61 -3.549 -7.840 -8.447 1.00 0.00 C ATOM 809 C PHE A 61 -3.562 -8.699 -9.726 1.00 0.00 C ATOM 810 O PHE A 61 -2.546 -9.304 -10.067 1.00 0.00 O ATOM 811 CB PHE A 61 -2.207 -7.085 -8.337 1.00 0.00 C ATOM 812 CG PHE A 61 -2.121 -5.880 -7.415 1.00 0.00 C ATOM 813 CD1 PHE A 61 -2.653 -4.646 -7.821 1.00 0.00 C ATOM 814 CD2 PHE A 61 -1.406 -5.937 -6.204 1.00 0.00 C ATOM 815 CE1 PHE A 61 -2.399 -3.488 -7.076 1.00 0.00 C ATOM 816 CE2 PHE A 61 -1.115 -4.779 -5.476 1.00 0.00 C ATOM 817 CZ PHE A 61 -1.590 -3.548 -5.931 1.00 0.00 C ATOM 0 H PHE A 61 -2.886 -8.740 -6.689 1.00 0.00 H new ATOM 0 HA PHE A 61 -4.360 -7.113 -8.479 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.450 -7.801 -8.017 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.930 -6.755 -9.338 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.261 -4.590 -8.712 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.075 -6.894 -5.829 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -2.827 -2.545 -7.384 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.529 -4.837 -4.571 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.335 -2.642 -5.402 1.00 0.00 H new ATOM 827 N SER A 62 -4.708 -8.779 -10.408 1.00 0.00 N ATOM 828 CA SER A 62 -4.968 -9.717 -11.519 1.00 0.00 C ATOM 829 C SER A 62 -5.285 -8.992 -12.831 1.00 0.00 C ATOM 830 O SER A 62 -6.144 -8.116 -12.838 1.00 0.00 O ATOM 831 CB SER A 62 -6.219 -10.548 -11.207 1.00 0.00 C ATOM 832 OG SER A 62 -6.068 -11.346 -10.039 1.00 0.00 O ATOM 0 H SER A 62 -5.507 -8.179 -10.202 1.00 0.00 H new ATOM 0 HA SER A 62 -4.066 -10.320 -11.625 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.071 -9.881 -11.079 1.00 0.00 H new ATOM 0 HB3 SER A 62 -6.444 -11.193 -12.057 1.00 0.00 H new ATOM 0 HG SER A 62 -6.008 -10.765 -9.252 1.00 0.00 H new ATOM 838 N ARG A 63 -4.688 -9.412 -13.952 1.00 0.00 N ATOM 839 CA ARG A 63 -4.863 -8.857 -15.308 1.00 0.00 C ATOM 840 C ARG A 63 -6.265 -8.285 -15.632 1.00 0.00 C ATOM 841 O ARG A 63 -6.397 -7.091 -15.902 1.00 0.00 O ATOM 842 CB ARG A 63 -4.459 -9.955 -16.311 1.00 0.00 C ATOM 843 CG ARG A 63 -2.928 -10.129 -16.371 1.00 0.00 C ATOM 844 CD ARG A 63 -2.500 -11.442 -17.029 1.00 0.00 C ATOM 845 NE ARG A 63 -2.908 -11.537 -18.442 1.00 0.00 N ATOM 846 CZ ARG A 63 -2.751 -12.615 -19.200 1.00 0.00 C ATOM 847 NH1 ARG A 63 -2.205 -13.724 -18.739 1.00 0.00 N ATOM 848 NH2 ARG A 63 -3.149 -12.600 -20.451 1.00 0.00 N ATOM 0 H ARG A 63 -4.031 -10.193 -13.942 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.222 -7.978 -15.380 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -4.923 -10.899 -16.025 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -4.837 -9.701 -17.302 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.495 -9.295 -16.922 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.523 -10.087 -15.360 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -1.416 -11.539 -16.962 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.930 -12.277 -16.475 1.00 0.00 H new ATOM 0 HE ARG A 63 -3.341 -10.717 -18.867 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -1.888 -13.772 -17.771 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.100 -14.533 -19.351 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.578 -11.760 -20.840 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.029 -13.428 -21.034 1.00 0.00 H new ATOM 862 N GLU A 64 -7.325 -9.093 -15.559 1.00 0.00 N ATOM 863 CA GLU A 64 -8.699 -8.670 -15.829 1.00 0.00 C ATOM 864 C GLU A 64 -9.208 -7.632 -14.807 1.00 0.00 C ATOM 865 O GLU A 64 -9.786 -6.615 -15.181 1.00 0.00 O ATOM 866 CB GLU A 64 -9.607 -9.908 -15.811 1.00 0.00 C ATOM 867 CG GLU A 64 -9.398 -10.890 -16.979 1.00 0.00 C ATOM 868 CD GLU A 64 -8.090 -11.702 -16.920 1.00 0.00 C ATOM 869 OE1 GLU A 64 -7.518 -11.886 -15.819 1.00 0.00 O ATOM 870 OE2 GLU A 64 -7.627 -12.169 -17.989 1.00 0.00 O ATOM 0 H GLU A 64 -7.250 -10.078 -15.306 1.00 0.00 H new ATOM 0 HA GLU A 64 -8.720 -8.189 -16.807 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -9.447 -10.443 -14.875 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -10.646 -9.577 -15.816 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.238 -11.584 -17.005 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -9.418 -10.329 -17.914 1.00 0.00 H new ATOM 877 N SER A 65 -8.960 -7.845 -13.511 1.00 0.00 N ATOM 878 CA SER A 65 -9.325 -6.890 -12.450 1.00 0.00 C ATOM 879 C SER A 65 -8.598 -5.543 -12.624 1.00 0.00 C ATOM 880 O SER A 65 -9.188 -4.477 -12.460 1.00 0.00 O ATOM 881 CB SER A 65 -9.008 -7.510 -11.082 1.00 0.00 C ATOM 882 OG SER A 65 -9.532 -6.723 -10.021 1.00 0.00 O ATOM 0 H SER A 65 -8.499 -8.686 -13.163 1.00 0.00 H new ATOM 0 HA SER A 65 -10.393 -6.685 -12.517 1.00 0.00 H new ATOM 0 HB2 SER A 65 -9.425 -8.516 -11.031 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.928 -7.607 -10.966 1.00 0.00 H new ATOM 0 HG SER A 65 -9.315 -7.144 -9.163 1.00 0.00 H new ATOM 888 N ILE A 66 -7.331 -5.576 -13.050 1.00 0.00 N ATOM 889 CA ILE A 66 -6.535 -4.379 -13.397 1.00 0.00 C ATOM 890 C ILE A 66 -7.165 -3.615 -14.566 1.00 0.00 C ATOM 891 O ILE A 66 -7.405 -2.414 -14.465 1.00 0.00 O ATOM 892 CB ILE A 66 -5.080 -4.788 -13.724 1.00 0.00 C ATOM 893 CG1 ILE A 66 -4.393 -5.465 -12.524 1.00 0.00 C ATOM 894 CG2 ILE A 66 -4.249 -3.615 -14.263 1.00 0.00 C ATOM 895 CD1 ILE A 66 -3.809 -4.552 -11.450 1.00 0.00 C ATOM 0 H ILE A 66 -6.815 -6.448 -13.168 1.00 0.00 H new ATOM 0 HA ILE A 66 -6.525 -3.710 -12.537 1.00 0.00 H new ATOM 0 HB ILE A 66 -5.138 -5.525 -14.525 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.118 -6.126 -12.048 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.589 -6.095 -12.906 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.236 -3.955 -14.477 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.705 -3.236 -15.177 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.215 -2.820 -13.518 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.356 -5.157 -10.665 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -3.051 -3.907 -11.894 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -4.602 -3.939 -11.023 1.00 0.00 H new ATOM 907 N ALA A 67 -7.480 -4.309 -15.657 1.00 0.00 N ATOM 908 CA ALA A 67 -8.159 -3.747 -16.824 1.00 0.00 C ATOM 909 C ALA A 67 -9.548 -3.186 -16.475 1.00 0.00 C ATOM 910 O ALA A 67 -9.999 -2.239 -17.117 1.00 0.00 O ATOM 911 CB ALA A 67 -8.272 -4.826 -17.904 1.00 0.00 C ATOM 0 H ALA A 67 -7.266 -5.301 -15.757 1.00 0.00 H new ATOM 0 HA ALA A 67 -7.567 -2.910 -17.193 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -8.777 -4.415 -18.778 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -7.275 -5.163 -18.187 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -8.844 -5.669 -17.517 1.00 0.00 H new ATOM 917 N ILE A 68 -10.209 -3.734 -15.449 1.00 0.00 N ATOM 918 CA ILE A 68 -11.453 -3.170 -14.905 1.00 0.00 C ATOM 919 C ILE A 68 -11.176 -1.905 -14.067 1.00 0.00 C ATOM 920 O ILE A 68 -11.898 -0.917 -14.229 1.00 0.00 O ATOM 921 CB ILE A 68 -12.243 -4.258 -14.137 1.00 0.00 C ATOM 922 CG1 ILE A 68 -12.836 -5.279 -15.141 1.00 0.00 C ATOM 923 CG2 ILE A 68 -13.370 -3.658 -13.272 1.00 0.00 C ATOM 924 CD1 ILE A 68 -13.322 -6.581 -14.492 1.00 0.00 C ATOM 0 H ILE A 68 -9.898 -4.580 -14.972 1.00 0.00 H new ATOM 0 HA ILE A 68 -12.087 -2.842 -15.729 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.546 -4.758 -13.464 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -13.670 -4.814 -15.667 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -12.081 -5.518 -15.889 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -13.896 -4.459 -12.753 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -12.942 -2.972 -12.541 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -14.070 -3.118 -13.910 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -13.723 -7.243 -15.260 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -12.488 -7.071 -13.990 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -14.102 -6.356 -13.764 1.00 0.00 H new ATOM 936 N GLU A 69 -10.162 -1.908 -13.189 1.00 0.00 N ATOM 937 CA GLU A 69 -10.019 -0.874 -12.154 1.00 0.00 C ATOM 938 C GLU A 69 -9.037 0.272 -12.488 1.00 0.00 C ATOM 939 O GLU A 69 -9.259 1.385 -12.008 1.00 0.00 O ATOM 940 CB GLU A 69 -9.680 -1.522 -10.798 1.00 0.00 C ATOM 941 CG GLU A 69 -10.399 -0.862 -9.621 1.00 0.00 C ATOM 942 CD GLU A 69 -11.925 -1.051 -9.680 1.00 0.00 C ATOM 943 OE1 GLU A 69 -12.411 -2.178 -9.421 1.00 0.00 O ATOM 944 OE2 GLU A 69 -12.654 -0.069 -9.960 1.00 0.00 O ATOM 0 H GLU A 69 -9.428 -2.616 -13.175 1.00 0.00 H new ATOM 0 HA GLU A 69 -10.991 -0.383 -12.103 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.944 -2.579 -10.831 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.604 -1.468 -10.635 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.020 -1.280 -8.688 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.168 0.203 -9.610 1.00 0.00 H new ATOM 951 N SER A 70 -7.990 0.074 -13.306 1.00 0.00 N ATOM 952 CA SER A 70 -7.171 1.204 -13.809 1.00 0.00 C ATOM 953 C SER A 70 -7.561 1.592 -15.246 1.00 0.00 C ATOM 954 O SER A 70 -7.766 2.776 -15.522 1.00 0.00 O ATOM 955 CB SER A 70 -5.657 0.936 -13.714 1.00 0.00 C ATOM 956 OG SER A 70 -5.258 -0.147 -14.543 1.00 0.00 O ATOM 0 H SER A 70 -7.688 -0.844 -13.633 1.00 0.00 H new ATOM 0 HA SER A 70 -7.389 2.046 -13.152 1.00 0.00 H new ATOM 0 HB2 SER A 70 -5.110 1.834 -14.002 1.00 0.00 H new ATOM 0 HB3 SER A 70 -5.391 0.719 -12.680 1.00 0.00 H new ATOM 0 HG SER A 70 -5.938 -0.852 -14.510 1.00 0.00 H new ATOM 962 N GLU A 71 -7.692 0.607 -16.150 1.00 0.00 N ATOM 963 CA GLU A 71 -8.334 0.724 -17.476 1.00 0.00 C ATOM 964 C GLU A 71 -7.580 1.653 -18.468 1.00 0.00 C ATOM 965 O GLU A 71 -8.108 2.047 -19.508 1.00 0.00 O ATOM 966 CB GLU A 71 -9.822 1.102 -17.284 1.00 0.00 C ATOM 967 CG GLU A 71 -10.727 0.769 -18.481 1.00 0.00 C ATOM 968 CD GLU A 71 -12.212 0.944 -18.129 1.00 0.00 C ATOM 969 OE1 GLU A 71 -12.637 2.081 -17.807 1.00 0.00 O ATOM 970 OE2 GLU A 71 -12.987 -0.040 -18.214 1.00 0.00 O ATOM 0 H GLU A 71 -7.340 -0.333 -15.972 1.00 0.00 H new ATOM 0 HA GLU A 71 -8.280 -0.249 -17.965 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -10.203 0.586 -16.403 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.888 2.171 -17.082 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -10.473 1.415 -19.322 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.546 -0.257 -18.801 1.00 0.00 H new ATOM 977 N SER A 72 -6.329 2.026 -18.172 1.00 0.00 N ATOM 978 CA SER A 72 -5.570 3.017 -18.962 1.00 0.00 C ATOM 979 C SER A 72 -5.071 2.472 -20.322 1.00 0.00 C ATOM 980 O SER A 72 -4.817 3.239 -21.256 1.00 0.00 O ATOM 981 CB SER A 72 -4.396 3.522 -18.106 1.00 0.00 C ATOM 982 OG SER A 72 -3.742 4.660 -18.659 1.00 0.00 O ATOM 0 H SER A 72 -5.809 1.652 -17.378 1.00 0.00 H new ATOM 0 HA SER A 72 -6.244 3.836 -19.213 1.00 0.00 H new ATOM 0 HB2 SER A 72 -4.763 3.771 -17.110 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.670 2.717 -17.987 1.00 0.00 H new ATOM 0 HG SER A 72 -3.008 4.934 -18.070 1.00 0.00 H new ATOM 988 N ILE A 73 -4.956 1.143 -20.451 1.00 0.00 N ATOM 989 CA ILE A 73 -4.476 0.423 -21.646 1.00 0.00 C ATOM 990 C ILE A 73 -5.618 -0.433 -22.231 1.00 0.00 C ATOM 991 O ILE A 73 -6.402 -1.030 -21.491 1.00 0.00 O ATOM 992 CB ILE A 73 -3.228 -0.411 -21.263 1.00 0.00 C ATOM 993 CG1 ILE A 73 -2.071 0.444 -20.685 1.00 0.00 C ATOM 994 CG2 ILE A 73 -2.708 -1.264 -22.433 1.00 0.00 C ATOM 995 CD1 ILE A 73 -1.498 1.516 -21.623 1.00 0.00 C ATOM 0 H ILE A 73 -5.206 0.509 -19.692 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.176 1.121 -22.428 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.575 -1.077 -20.473 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.425 0.934 -19.778 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -1.262 -0.225 -20.391 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.833 -1.828 -22.111 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.487 -1.955 -22.754 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.435 -0.614 -23.264 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.696 2.052 -21.116 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.105 1.041 -22.522 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.286 2.217 -21.898 1.00 0.00 H new ATOM 1007 N ASN A 74 -5.730 -0.471 -23.564 1.00 0.00 N ATOM 1008 CA ASN A 74 -6.962 -0.856 -24.271 1.00 0.00 C ATOM 1009 C ASN A 74 -7.453 -2.319 -24.074 1.00 0.00 C ATOM 1010 O ASN A 74 -8.630 -2.480 -23.729 1.00 0.00 O ATOM 1011 CB ASN A 74 -6.825 -0.491 -25.763 1.00 0.00 C ATOM 1012 CG ASN A 74 -6.667 1.013 -25.981 1.00 0.00 C ATOM 1013 OD1 ASN A 74 -5.560 1.535 -26.044 1.00 0.00 O ATOM 1014 ND2 ASN A 74 -7.759 1.752 -26.080 1.00 0.00 N ATOM 0 H ASN A 74 -4.961 -0.233 -24.191 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.758 -0.279 -23.801 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -5.963 -1.009 -26.184 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -7.704 -0.844 -26.303 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -7.682 2.761 -26.209 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.678 1.313 -26.027 1.00 0.00 H new ATOM 1021 N PRO A 75 -6.643 -3.381 -24.306 1.00 0.00 N ATOM 1022 CA PRO A 75 -7.119 -4.768 -24.252 1.00 0.00 C ATOM 1023 C PRO A 75 -7.393 -5.248 -22.820 1.00 0.00 C ATOM 1024 O PRO A 75 -6.622 -4.974 -21.901 1.00 0.00 O ATOM 1025 CB PRO A 75 -6.034 -5.612 -24.930 1.00 0.00 C ATOM 1026 CG PRO A 75 -4.764 -4.794 -24.708 1.00 0.00 C ATOM 1027 CD PRO A 75 -5.281 -3.362 -24.830 1.00 0.00 C ATOM 0 HA PRO A 75 -8.078 -4.860 -24.762 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -5.957 -6.603 -24.483 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.240 -5.756 -25.991 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.321 -4.986 -23.731 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.000 -5.017 -25.453 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.655 -2.672 -24.265 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -5.267 -3.029 -25.868 1.00 0.00 H new ATOM 1035 N GLU A 76 -8.468 -6.028 -22.648 1.00 0.00 N ATOM 1036 CA GLU A 76 -8.923 -6.561 -21.353 1.00 0.00 C ATOM 1037 C GLU A 76 -7.993 -7.655 -20.783 1.00 0.00 C ATOM 1038 O GLU A 76 -7.997 -7.919 -19.582 1.00 0.00 O ATOM 1039 CB GLU A 76 -10.347 -7.114 -21.514 1.00 0.00 C ATOM 1040 CG GLU A 76 -11.382 -6.024 -21.826 1.00 0.00 C ATOM 1041 CD GLU A 76 -12.783 -6.632 -21.984 1.00 0.00 C ATOM 1042 OE1 GLU A 76 -13.149 -7.036 -23.114 1.00 0.00 O ATOM 1043 OE2 GLU A 76 -13.535 -6.709 -20.982 1.00 0.00 O ATOM 0 H GLU A 76 -9.063 -6.315 -23.425 1.00 0.00 H new ATOM 0 HA GLU A 76 -8.904 -5.739 -20.637 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -10.355 -7.854 -22.314 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -10.636 -7.630 -20.599 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -11.390 -5.284 -21.026 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -11.102 -5.501 -22.741 1.00 0.00 H new ATOM 1050 N SER A 77 -7.165 -8.273 -21.633 1.00 0.00 N ATOM 1051 CA SER A 77 -6.096 -9.206 -21.228 1.00 0.00 C ATOM 1052 C SER A 77 -4.935 -8.486 -20.509 1.00 0.00 C ATOM 1053 O SER A 77 -4.211 -9.096 -19.718 1.00 0.00 O ATOM 1054 CB SER A 77 -5.606 -9.922 -22.498 1.00 0.00 C ATOM 1055 OG SER A 77 -4.629 -10.920 -22.237 1.00 0.00 O ATOM 0 H SER A 77 -7.217 -8.139 -22.643 1.00 0.00 H new ATOM 0 HA SER A 77 -6.489 -9.924 -20.508 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.458 -10.380 -23.001 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.189 -9.185 -23.185 1.00 0.00 H new ATOM 0 HG SER A 77 -4.358 -11.340 -23.080 1.00 0.00 H new ATOM 1061 N SER A 78 -4.768 -7.177 -20.758 1.00 0.00 N ATOM 1062 CA SER A 78 -3.924 -6.205 -20.030 1.00 0.00 C ATOM 1063 C SER A 78 -2.407 -6.434 -20.111 1.00 0.00 C ATOM 1064 O SER A 78 -1.655 -5.669 -19.511 1.00 0.00 O ATOM 1065 CB SER A 78 -4.348 -6.130 -18.552 1.00 0.00 C ATOM 1066 OG SER A 78 -3.813 -7.210 -17.817 1.00 0.00 O ATOM 0 H SER A 78 -5.257 -6.732 -21.535 1.00 0.00 H new ATOM 0 HA SER A 78 -4.100 -5.262 -20.547 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.009 -5.188 -18.120 1.00 0.00 H new ATOM 0 HB3 SER A 78 -5.436 -6.140 -18.481 1.00 0.00 H new ATOM 0 HG SER A 78 -3.733 -7.994 -18.399 1.00 0.00 H new ATOM 1072 N ASN A 79 -1.931 -7.484 -20.787 1.00 0.00 N ATOM 1073 CA ASN A 79 -0.632 -8.103 -20.497 1.00 0.00 C ATOM 1074 C ASN A 79 0.560 -7.124 -20.474 1.00 0.00 C ATOM 1075 O ASN A 79 1.387 -7.194 -19.569 1.00 0.00 O ATOM 1076 CB ASN A 79 -0.414 -9.256 -21.486 1.00 0.00 C ATOM 1077 CG ASN A 79 0.813 -10.088 -21.117 1.00 0.00 C ATOM 1078 OD1 ASN A 79 0.807 -10.835 -20.145 1.00 0.00 O ATOM 1079 ND2 ASN A 79 1.896 -9.978 -21.867 1.00 0.00 N ATOM 0 H ASN A 79 -2.436 -7.930 -21.553 1.00 0.00 H new ATOM 0 HA ASN A 79 -0.669 -8.480 -19.475 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -1.297 -9.895 -21.501 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.293 -8.855 -22.492 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.732 -10.516 -21.638 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.896 -9.355 -22.675 1.00 0.00 H new ATOM 1086 N LYS A 80 0.624 -6.158 -21.403 1.00 0.00 N ATOM 1087 CA LYS A 80 1.689 -5.135 -21.423 1.00 0.00 C ATOM 1088 C LYS A 80 1.423 -3.918 -20.521 1.00 0.00 C ATOM 1089 O LYS A 80 2.374 -3.268 -20.091 1.00 0.00 O ATOM 1090 CB LYS A 80 2.017 -4.747 -22.874 1.00 0.00 C ATOM 1091 CG LYS A 80 2.374 -5.985 -23.724 1.00 0.00 C ATOM 1092 CD LYS A 80 3.394 -5.694 -24.837 1.00 0.00 C ATOM 1093 CE LYS A 80 4.813 -5.385 -24.318 1.00 0.00 C ATOM 1094 NZ LYS A 80 5.449 -6.544 -23.629 1.00 0.00 N ATOM 0 H LYS A 80 -0.055 -6.061 -22.158 1.00 0.00 H new ATOM 0 HA LYS A 80 2.573 -5.591 -20.977 1.00 0.00 H new ATOM 0 HB2 LYS A 80 1.163 -4.235 -23.317 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.850 -4.045 -22.884 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.773 -6.761 -23.071 1.00 0.00 H new ATOM 0 HG3 LYS A 80 1.463 -6.383 -24.172 1.00 0.00 H new ATOM 0 HD2 LYS A 80 3.442 -6.553 -25.507 1.00 0.00 H new ATOM 0 HD3 LYS A 80 3.041 -4.848 -25.428 1.00 0.00 H new ATOM 0 HE2 LYS A 80 5.441 -5.078 -25.155 1.00 0.00 H new ATOM 0 HE3 LYS A 80 4.766 -4.542 -23.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 6.464 -6.357 -23.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 5.001 -6.684 -22.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 5.326 -7.401 -24.206 1.00 0.00 H new ATOM 1108 N SER A 81 0.176 -3.678 -20.111 1.00 0.00 N ATOM 1109 CA SER A 81 -0.091 -2.874 -18.908 1.00 0.00 C ATOM 1110 C SER A 81 0.532 -3.575 -17.696 1.00 0.00 C ATOM 1111 O SER A 81 1.416 -3.015 -17.054 1.00 0.00 O ATOM 1112 CB SER A 81 -1.600 -2.663 -18.701 1.00 0.00 C ATOM 1113 OG SER A 81 -1.822 -1.582 -17.809 1.00 0.00 O ATOM 0 H SER A 81 -0.659 -4.023 -20.585 1.00 0.00 H new ATOM 0 HA SER A 81 0.357 -1.888 -19.031 1.00 0.00 H new ATOM 0 HB2 SER A 81 -2.082 -2.460 -19.658 1.00 0.00 H new ATOM 0 HB3 SER A 81 -2.051 -3.572 -18.303 1.00 0.00 H new ATOM 0 HG SER A 81 -2.785 -1.453 -17.684 1.00 0.00 H new ATOM 1119 N ILE A 82 0.182 -4.847 -17.452 1.00 0.00 N ATOM 1120 CA ILE A 82 0.719 -5.650 -16.338 1.00 0.00 C ATOM 1121 C ILE A 82 2.257 -5.775 -16.367 1.00 0.00 C ATOM 1122 O ILE A 82 2.870 -5.710 -15.300 1.00 0.00 O ATOM 1123 CB ILE A 82 -0.077 -6.983 -16.217 1.00 0.00 C ATOM 1124 CG1 ILE A 82 -1.100 -6.900 -15.057 1.00 0.00 C ATOM 1125 CG2 ILE A 82 0.793 -8.247 -16.104 1.00 0.00 C ATOM 1126 CD1 ILE A 82 -0.509 -6.921 -13.637 1.00 0.00 C ATOM 0 H ILE A 82 -0.489 -5.355 -18.028 1.00 0.00 H new ATOM 0 HA ILE A 82 0.556 -5.121 -15.399 1.00 0.00 H new ATOM 0 HB ILE A 82 -0.606 -7.095 -17.163 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -1.680 -5.985 -15.175 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -1.796 -7.733 -15.152 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.151 -9.124 -16.024 1.00 0.00 H new ATOM 0 HG22 ILE A 82 1.422 -8.336 -16.990 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.423 -8.177 -15.218 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -1.315 -6.858 -12.906 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.045 -7.848 -13.487 1.00 0.00 H new ATOM 0 HD13 ILE A 82 0.163 -6.072 -13.510 1.00 0.00 H new ATOM 1138 N ASP A 83 2.893 -5.822 -17.545 1.00 0.00 N ATOM 1139 CA ASP A 83 4.356 -5.718 -17.689 1.00 0.00 C ATOM 1140 C ASP A 83 4.900 -4.375 -17.167 1.00 0.00 C ATOM 1141 O ASP A 83 5.908 -4.377 -16.458 1.00 0.00 O ATOM 1142 CB ASP A 83 4.816 -5.868 -19.151 1.00 0.00 C ATOM 1143 CG ASP A 83 4.664 -7.265 -19.777 1.00 0.00 C ATOM 1144 OD1 ASP A 83 4.777 -8.287 -19.060 1.00 0.00 O ATOM 1145 OD2 ASP A 83 4.523 -7.319 -21.025 1.00 0.00 O ATOM 0 H ASP A 83 2.405 -5.934 -18.434 1.00 0.00 H new ATOM 0 HA ASP A 83 4.753 -6.539 -17.091 1.00 0.00 H new ATOM 0 HB2 ASP A 83 4.256 -5.158 -19.760 1.00 0.00 H new ATOM 0 HB3 ASP A 83 5.866 -5.580 -19.210 1.00 0.00 H new ATOM 1150 N VAL A 84 4.244 -3.244 -17.478 1.00 0.00 N ATOM 1151 CA VAL A 84 4.600 -1.941 -16.859 1.00 0.00 C ATOM 1152 C VAL A 84 4.388 -1.993 -15.350 1.00 0.00 C ATOM 1153 O VAL A 84 5.260 -1.531 -14.623 1.00 0.00 O ATOM 1154 CB VAL A 84 3.839 -0.709 -17.415 1.00 0.00 C ATOM 1155 CG1 VAL A 84 4.188 0.600 -16.681 1.00 0.00 C ATOM 1156 CG2 VAL A 84 4.192 -0.503 -18.898 1.00 0.00 C ATOM 0 H VAL A 84 3.473 -3.197 -18.145 1.00 0.00 H new ATOM 0 HA VAL A 84 5.649 -1.800 -17.118 1.00 0.00 H new ATOM 0 HB VAL A 84 2.780 -0.921 -17.270 1.00 0.00 H new ATOM 0 HG11 VAL A 84 3.623 1.424 -17.117 1.00 0.00 H new ATOM 0 HG12 VAL A 84 3.933 0.504 -15.625 1.00 0.00 H new ATOM 0 HG13 VAL A 84 5.255 0.799 -16.780 1.00 0.00 H new ATOM 0 HG21 VAL A 84 3.655 0.364 -19.283 1.00 0.00 H new ATOM 0 HG22 VAL A 84 5.265 -0.338 -18.997 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.907 -1.388 -19.466 1.00 0.00 H new ATOM 1166 N ILE A 85 3.276 -2.554 -14.858 1.00 0.00 N ATOM 1167 CA ILE A 85 3.023 -2.596 -13.408 1.00 0.00 C ATOM 1168 C ILE A 85 4.110 -3.404 -12.702 1.00 0.00 C ATOM 1169 O ILE A 85 4.824 -2.842 -11.879 1.00 0.00 O ATOM 1170 CB ILE A 85 1.597 -3.085 -13.044 1.00 0.00 C ATOM 1171 CG1 ILE A 85 0.529 -2.390 -13.922 1.00 0.00 C ATOM 1172 CG2 ILE A 85 1.352 -2.874 -11.535 1.00 0.00 C ATOM 1173 CD1 ILE A 85 -0.917 -2.437 -13.428 1.00 0.00 C ATOM 0 H ILE A 85 2.546 -2.979 -15.430 1.00 0.00 H new ATOM 0 HA ILE A 85 3.068 -1.569 -13.046 1.00 0.00 H new ATOM 0 HB ILE A 85 1.513 -4.152 -13.252 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.814 -1.344 -14.036 1.00 0.00 H new ATOM 0 HG13 ILE A 85 0.562 -2.840 -14.914 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.350 -3.217 -11.278 1.00 0.00 H new ATOM 0 HG22 ILE A 85 2.088 -3.441 -10.964 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.445 -1.815 -11.296 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -1.560 -1.914 -14.135 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.239 -3.475 -13.344 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.984 -1.956 -12.452 1.00 0.00 H new ATOM 1185 N ILE A 86 4.298 -4.677 -13.051 1.00 0.00 N ATOM 1186 CA ILE A 86 5.285 -5.551 -12.390 1.00 0.00 C ATOM 1187 C ILE A 86 6.700 -4.999 -12.561 1.00 0.00 C ATOM 1188 O ILE A 86 7.430 -4.887 -11.578 1.00 0.00 O ATOM 1189 CB ILE A 86 5.175 -6.995 -12.932 1.00 0.00 C ATOM 1190 CG1 ILE A 86 3.795 -7.598 -12.587 1.00 0.00 C ATOM 1191 CG2 ILE A 86 6.300 -7.885 -12.358 1.00 0.00 C ATOM 1192 CD1 ILE A 86 3.514 -8.870 -13.388 1.00 0.00 C ATOM 0 H ILE A 86 3.775 -5.136 -13.797 1.00 0.00 H new ATOM 0 HA ILE A 86 5.068 -5.574 -11.322 1.00 0.00 H new ATOM 0 HB ILE A 86 5.283 -6.958 -14.016 1.00 0.00 H new ATOM 0 HG12 ILE A 86 3.753 -7.823 -11.521 1.00 0.00 H new ATOM 0 HG13 ILE A 86 3.016 -6.862 -12.788 1.00 0.00 H new ATOM 0 HG21 ILE A 86 6.202 -8.896 -12.754 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.269 -7.476 -12.644 1.00 0.00 H new ATOM 0 HG23 ILE A 86 6.224 -7.912 -11.271 1.00 0.00 H new ATOM 0 HD11 ILE A 86 2.534 -9.262 -13.116 1.00 0.00 H new ATOM 0 HD12 ILE A 86 3.530 -8.640 -14.453 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.278 -9.616 -13.167 1.00 0.00 H new ATOM 1204 N GLY A 87 7.084 -4.635 -13.788 1.00 0.00 N ATOM 1205 CA GLY A 87 8.446 -4.213 -14.123 1.00 0.00 C ATOM 1206 C GLY A 87 8.808 -2.869 -13.507 1.00 0.00 C ATOM 1207 O GLY A 87 9.911 -2.722 -12.978 1.00 0.00 O ATOM 0 H GLY A 87 6.449 -4.625 -14.586 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.152 -4.969 -13.779 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.548 -4.152 -15.207 1.00 0.00 H new ATOM 1211 N ARG A 88 7.884 -1.898 -13.502 1.00 0.00 N ATOM 1212 CA ARG A 88 8.146 -0.569 -12.936 1.00 0.00 C ATOM 1213 C ARG A 88 8.024 -0.574 -11.404 1.00 0.00 C ATOM 1214 O ARG A 88 8.824 0.097 -10.757 1.00 0.00 O ATOM 1215 CB ARG A 88 7.266 0.488 -13.638 1.00 0.00 C ATOM 1216 CG ARG A 88 7.760 1.938 -13.456 1.00 0.00 C ATOM 1217 CD ARG A 88 8.972 2.304 -14.327 1.00 0.00 C ATOM 1218 NE ARG A 88 8.614 2.394 -15.758 1.00 0.00 N ATOM 1219 CZ ARG A 88 9.439 2.672 -16.763 1.00 0.00 C ATOM 1220 NH1 ARG A 88 10.726 2.887 -16.575 1.00 0.00 N ATOM 1221 NH2 ARG A 88 8.973 2.743 -17.990 1.00 0.00 N ATOM 0 H ARG A 88 6.945 -2.010 -13.885 1.00 0.00 H new ATOM 0 HA ARG A 88 9.181 -0.289 -13.132 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.223 0.261 -14.703 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.249 0.411 -13.255 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.942 2.620 -13.686 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.019 2.093 -12.409 1.00 0.00 H new ATOM 0 HD2 ARG A 88 9.383 3.257 -13.995 1.00 0.00 H new ATOM 0 HD3 ARG A 88 9.754 1.556 -14.194 1.00 0.00 H new ATOM 0 HE ARG A 88 7.637 2.226 -15.999 1.00 0.00 H new ATOM 0 HH11 ARG A 88 11.118 2.843 -15.635 1.00 0.00 H new ATOM 0 HH12 ARG A 88 11.329 3.098 -17.370 1.00 0.00 H new ATOM 0 HH21 ARG A 88 7.981 2.585 -18.169 1.00 0.00 H new ATOM 0 HH22 ARG A 88 9.603 2.956 -18.763 1.00 0.00 H new ATOM 1235 N LEU A 89 7.134 -1.381 -10.802 1.00 0.00 N ATOM 1236 CA LEU A 89 7.131 -1.655 -9.357 1.00 0.00 C ATOM 1237 C LEU A 89 8.470 -2.285 -8.957 1.00 0.00 C ATOM 1238 O LEU A 89 9.146 -1.725 -8.097 1.00 0.00 O ATOM 1239 CB LEU A 89 5.896 -2.528 -9.022 1.00 0.00 C ATOM 1240 CG LEU A 89 5.400 -2.515 -7.566 1.00 0.00 C ATOM 1241 CD1 LEU A 89 4.073 -3.285 -7.482 1.00 0.00 C ATOM 1242 CD2 LEU A 89 6.393 -3.136 -6.577 1.00 0.00 C ATOM 0 H LEU A 89 6.392 -1.864 -11.309 1.00 0.00 H new ATOM 0 HA LEU A 89 7.040 -0.741 -8.771 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.073 -2.209 -9.662 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.128 -3.559 -9.291 1.00 0.00 H new ATOM 0 HG LEU A 89 5.278 -1.469 -7.284 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.714 -3.281 -6.453 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.334 -2.808 -8.126 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.228 -4.314 -7.808 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.978 -3.093 -5.570 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.577 -4.175 -6.850 1.00 0.00 H new ATOM 0 HD23 LEU A 89 7.331 -2.582 -6.607 1.00 0.00 H new ATOM 1254 N ARG A 90 8.912 -3.353 -9.644 1.00 0.00 N ATOM 1255 CA ARG A 90 10.246 -3.955 -9.434 1.00 0.00 C ATOM 1256 C ARG A 90 11.373 -2.923 -9.549 1.00 0.00 C ATOM 1257 O ARG A 90 12.225 -2.856 -8.670 1.00 0.00 O ATOM 1258 CB ARG A 90 10.504 -5.149 -10.377 1.00 0.00 C ATOM 1259 CG ARG A 90 10.280 -6.499 -9.678 1.00 0.00 C ATOM 1260 CD ARG A 90 8.821 -6.800 -9.299 1.00 0.00 C ATOM 1261 NE ARG A 90 8.743 -7.831 -8.243 1.00 0.00 N ATOM 1262 CZ ARG A 90 9.054 -9.121 -8.337 1.00 0.00 C ATOM 1263 NH1 ARG A 90 9.408 -9.681 -9.474 1.00 0.00 N ATOM 1264 NH2 ARG A 90 9.006 -9.880 -7.264 1.00 0.00 N ATOM 0 H ARG A 90 8.358 -3.824 -10.359 1.00 0.00 H new ATOM 0 HA ARG A 90 10.246 -4.334 -8.412 1.00 0.00 H new ATOM 0 HB2 ARG A 90 9.845 -5.076 -11.242 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.527 -5.100 -10.751 1.00 0.00 H new ATOM 0 HG2 ARG A 90 10.641 -7.294 -10.331 1.00 0.00 H new ATOM 0 HG3 ARG A 90 10.888 -6.528 -8.774 1.00 0.00 H new ATOM 0 HD2 ARG A 90 8.336 -5.886 -8.955 1.00 0.00 H new ATOM 0 HD3 ARG A 90 8.276 -7.137 -10.181 1.00 0.00 H new ATOM 0 HE ARG A 90 8.410 -7.515 -7.332 1.00 0.00 H new ATOM 0 HH11 ARG A 90 9.452 -9.122 -10.326 1.00 0.00 H new ATOM 0 HH12 ARG A 90 9.639 -10.674 -9.503 1.00 0.00 H new ATOM 0 HH21 ARG A 90 8.732 -9.479 -6.367 1.00 0.00 H new ATOM 0 HH22 ARG A 90 9.243 -10.870 -7.329 1.00 0.00 H new ATOM 1278 N SER A 91 11.355 -2.075 -10.577 1.00 0.00 N ATOM 1279 CA SER A 91 12.359 -1.015 -10.760 1.00 0.00 C ATOM 1280 C SER A 91 12.410 -0.044 -9.574 1.00 0.00 C ATOM 1281 O SER A 91 13.490 0.225 -9.039 1.00 0.00 O ATOM 1282 CB SER A 91 12.109 -0.273 -12.081 1.00 0.00 C ATOM 1283 OG SER A 91 13.125 0.692 -12.330 1.00 0.00 O ATOM 0 H SER A 91 10.646 -2.100 -11.309 1.00 0.00 H new ATOM 0 HA SER A 91 13.338 -1.492 -10.805 1.00 0.00 H new ATOM 0 HB2 SER A 91 12.075 -0.989 -12.902 1.00 0.00 H new ATOM 0 HB3 SER A 91 11.137 0.219 -12.046 1.00 0.00 H new ATOM 0 HG SER A 91 12.942 1.148 -13.178 1.00 0.00 H new ATOM 1289 N LYS A 92 11.251 0.423 -9.090 1.00 0.00 N ATOM 1290 CA LYS A 92 11.198 1.263 -7.888 1.00 0.00 C ATOM 1291 C LYS A 92 11.732 0.533 -6.642 1.00 0.00 C ATOM 1292 O LYS A 92 12.611 1.068 -5.971 1.00 0.00 O ATOM 1293 CB LYS A 92 9.763 1.799 -7.696 1.00 0.00 C ATOM 1294 CG LYS A 92 9.367 2.907 -8.692 1.00 0.00 C ATOM 1295 CD LYS A 92 10.212 4.188 -8.520 1.00 0.00 C ATOM 1296 CE LYS A 92 9.580 5.436 -9.163 1.00 0.00 C ATOM 1297 NZ LYS A 92 9.580 5.398 -10.653 1.00 0.00 N ATOM 0 H LYS A 92 10.341 0.234 -9.511 1.00 0.00 H new ATOM 0 HA LYS A 92 11.864 2.115 -8.027 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.061 0.971 -7.793 1.00 0.00 H new ATOM 0 HB3 LYS A 92 9.663 2.185 -6.681 1.00 0.00 H new ATOM 0 HG2 LYS A 92 9.482 2.534 -9.710 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.313 3.151 -8.559 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.362 4.374 -7.456 1.00 0.00 H new ATOM 0 HD3 LYS A 92 11.197 4.024 -8.957 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.554 5.538 -8.809 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.121 6.321 -8.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 9.142 6.266 -11.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 10.559 5.330 -10.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.040 4.571 -10.979 1.00 0.00 H new ATOM 1311 N ILE A 93 11.269 -0.689 -6.347 1.00 0.00 N ATOM 1312 CA ILE A 93 11.638 -1.418 -5.104 1.00 0.00 C ATOM 1313 C ILE A 93 13.049 -2.034 -5.127 1.00 0.00 C ATOM 1314 O ILE A 93 13.586 -2.377 -4.074 1.00 0.00 O ATOM 1315 CB ILE A 93 10.533 -2.416 -4.673 1.00 0.00 C ATOM 1316 CG1 ILE A 93 10.299 -3.634 -5.593 1.00 0.00 C ATOM 1317 CG2 ILE A 93 9.218 -1.635 -4.507 1.00 0.00 C ATOM 1318 CD1 ILE A 93 11.370 -4.731 -5.554 1.00 0.00 C ATOM 0 H ILE A 93 10.631 -1.206 -6.952 1.00 0.00 H new ATOM 0 HA ILE A 93 11.699 -0.661 -4.322 1.00 0.00 H new ATOM 0 HB ILE A 93 10.890 -2.857 -3.742 1.00 0.00 H new ATOM 0 HG12 ILE A 93 9.341 -4.082 -5.330 1.00 0.00 H new ATOM 0 HG13 ILE A 93 10.213 -3.276 -6.619 1.00 0.00 H new ATOM 0 HG21 ILE A 93 8.425 -2.318 -4.203 1.00 0.00 H new ATOM 0 HG22 ILE A 93 9.345 -0.866 -3.745 1.00 0.00 H new ATOM 0 HG23 ILE A 93 8.951 -1.167 -5.454 1.00 0.00 H new ATOM 0 HD11 ILE A 93 11.096 -5.532 -6.241 1.00 0.00 H new ATOM 0 HD12 ILE A 93 12.331 -4.312 -5.851 1.00 0.00 H new ATOM 0 HD13 ILE A 93 11.445 -5.130 -4.542 1.00 0.00 H new ATOM 1330 N GLU A 94 13.666 -2.149 -6.308 1.00 0.00 N ATOM 1331 CA GLU A 94 15.072 -2.527 -6.475 1.00 0.00 C ATOM 1332 C GLU A 94 15.997 -1.305 -6.323 1.00 0.00 C ATOM 1333 O GLU A 94 17.029 -1.390 -5.654 1.00 0.00 O ATOM 1334 CB GLU A 94 15.254 -3.193 -7.850 1.00 0.00 C ATOM 1335 CG GLU A 94 16.675 -3.725 -8.072 1.00 0.00 C ATOM 1336 CD GLU A 94 16.772 -4.480 -9.405 1.00 0.00 C ATOM 1337 OE1 GLU A 94 16.977 -3.832 -10.460 1.00 0.00 O ATOM 1338 OE2 GLU A 94 16.653 -5.729 -9.411 1.00 0.00 O ATOM 0 H GLU A 94 13.190 -1.978 -7.194 1.00 0.00 H new ATOM 0 HA GLU A 94 15.348 -3.236 -5.694 1.00 0.00 H new ATOM 0 HB2 GLU A 94 14.545 -4.015 -7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 94 15.015 -2.472 -8.632 1.00 0.00 H new ATOM 0 HG2 GLU A 94 17.383 -2.897 -8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 94 16.952 -4.388 -7.252 1.00 0.00 H new ATOM 1345 N LYS A 95 15.640 -0.161 -6.927 1.00 0.00 N ATOM 1346 CA LYS A 95 16.470 1.052 -6.898 1.00 0.00 C ATOM 1347 C LYS A 95 16.397 1.819 -5.558 1.00 0.00 C ATOM 1348 O LYS A 95 17.418 2.324 -5.083 1.00 0.00 O ATOM 1349 CB LYS A 95 16.067 1.902 -8.112 1.00 0.00 C ATOM 1350 CG LYS A 95 16.908 3.176 -8.285 1.00 0.00 C ATOM 1351 CD LYS A 95 16.820 3.784 -9.697 1.00 0.00 C ATOM 1352 CE LYS A 95 15.392 4.053 -10.214 1.00 0.00 C ATOM 1353 NZ LYS A 95 14.807 2.889 -10.946 1.00 0.00 N ATOM 0 H LYS A 95 14.770 -0.051 -7.448 1.00 0.00 H new ATOM 0 HA LYS A 95 17.524 0.781 -6.966 1.00 0.00 H new ATOM 0 HB2 LYS A 95 16.154 1.295 -9.013 1.00 0.00 H new ATOM 0 HB3 LYS A 95 15.018 2.181 -8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 95 16.581 3.919 -7.557 1.00 0.00 H new ATOM 0 HG3 LYS A 95 17.950 2.947 -8.061 1.00 0.00 H new ATOM 0 HD2 LYS A 95 17.374 4.723 -9.705 1.00 0.00 H new ATOM 0 HD3 LYS A 95 17.320 3.113 -10.395 1.00 0.00 H new ATOM 0 HE2 LYS A 95 14.748 4.306 -9.372 1.00 0.00 H new ATOM 0 HE3 LYS A 95 15.408 4.920 -10.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 14.013 3.213 -11.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 15.535 2.459 -11.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 14.466 2.184 -10.261 1.00 0.00 H new ATOM 1367 N ASN A 96 15.217 1.893 -4.932 1.00 0.00 N ATOM 1368 CA ASN A 96 15.013 2.456 -3.588 1.00 0.00 C ATOM 1369 C ASN A 96 15.243 1.390 -2.474 1.00 0.00 C ATOM 1370 O ASN A 96 15.403 0.206 -2.794 1.00 0.00 O ATOM 1371 CB ASN A 96 13.664 3.222 -3.578 1.00 0.00 C ATOM 1372 CG ASN A 96 12.409 2.407 -3.281 1.00 0.00 C ATOM 1373 OD1 ASN A 96 12.457 1.250 -2.900 1.00 0.00 O ATOM 1374 ND2 ASN A 96 11.241 3.007 -3.413 1.00 0.00 N ATOM 0 H ASN A 96 14.353 1.555 -5.356 1.00 0.00 H new ATOM 0 HA ASN A 96 15.770 3.199 -3.338 1.00 0.00 H new ATOM 0 HB2 ASN A 96 13.733 4.020 -2.839 1.00 0.00 H new ATOM 0 HB3 ASN A 96 13.537 3.698 -4.550 1.00 0.00 H new ATOM 0 HD21 ASN A 96 10.381 2.503 -3.196 1.00 0.00 H new ATOM 0 HD22 ASN A 96 11.198 3.975 -3.732 1.00 0.00 H new ATOM 1381 N PRO A 97 15.297 1.770 -1.175 1.00 0.00 N ATOM 1382 CA PRO A 97 15.595 0.838 -0.082 1.00 0.00 C ATOM 1383 C PRO A 97 14.373 0.021 0.382 1.00 0.00 C ATOM 1384 O PRO A 97 14.504 -0.800 1.290 1.00 0.00 O ATOM 1385 CB PRO A 97 16.150 1.723 1.041 1.00 0.00 C ATOM 1386 CG PRO A 97 15.373 3.023 0.865 1.00 0.00 C ATOM 1387 CD PRO A 97 15.218 3.131 -0.651 1.00 0.00 C ATOM 0 HA PRO A 97 16.304 0.075 -0.404 1.00 0.00 H new ATOM 0 HB2 PRO A 97 15.982 1.282 2.023 1.00 0.00 H new ATOM 0 HB3 PRO A 97 17.224 1.877 0.940 1.00 0.00 H new ATOM 0 HG2 PRO A 97 14.406 2.986 1.367 1.00 0.00 H new ATOM 0 HG3 PRO A 97 15.914 3.875 1.277 1.00 0.00 H new ATOM 0 HD2 PRO A 97 14.265 3.592 -0.911 1.00 0.00 H new ATOM 0 HD3 PRO A 97 16.002 3.757 -1.077 1.00 0.00 H new ATOM 1395 N LYS A 98 13.189 0.223 -0.213 1.00 0.00 N ATOM 1396 CA LYS A 98 11.952 -0.476 0.169 1.00 0.00 C ATOM 1397 C LYS A 98 11.948 -1.930 -0.341 1.00 0.00 C ATOM 1398 O LYS A 98 11.531 -2.190 -1.467 1.00 0.00 O ATOM 1399 CB LYS A 98 10.741 0.331 -0.352 1.00 0.00 C ATOM 1400 CG LYS A 98 9.387 -0.097 0.245 1.00 0.00 C ATOM 1401 CD LYS A 98 8.379 -0.728 -0.740 1.00 0.00 C ATOM 1402 CE LYS A 98 8.487 -2.255 -0.913 1.00 0.00 C ATOM 1403 NZ LYS A 98 7.230 -2.849 -1.477 1.00 0.00 N ATOM 0 H LYS A 98 13.061 0.882 -0.981 1.00 0.00 H new ATOM 0 HA LYS A 98 11.888 -0.539 1.255 1.00 0.00 H new ATOM 0 HB2 LYS A 98 10.903 1.387 -0.135 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.694 0.232 -1.437 1.00 0.00 H new ATOM 0 HG2 LYS A 98 9.576 -0.811 1.047 1.00 0.00 H new ATOM 0 HG3 LYS A 98 8.921 0.777 0.700 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.370 -0.489 -0.403 1.00 0.00 H new ATOM 0 HD3 LYS A 98 8.509 -0.259 -1.715 1.00 0.00 H new ATOM 0 HE2 LYS A 98 9.324 -2.487 -1.572 1.00 0.00 H new ATOM 0 HE3 LYS A 98 8.704 -2.714 0.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 6.926 -3.646 -0.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 6.483 -2.126 -1.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 7.409 -3.187 -2.444 1.00 0.00 H new ATOM 1417 N GLN A 99 12.348 -2.902 0.481 1.00 0.00 N ATOM 1418 CA GLN A 99 12.260 -4.328 0.125 1.00 0.00 C ATOM 1419 C GLN A 99 10.834 -4.875 0.389 1.00 0.00 C ATOM 1420 O GLN A 99 10.186 -4.428 1.341 1.00 0.00 O ATOM 1421 CB GLN A 99 13.328 -5.133 0.890 1.00 0.00 C ATOM 1422 CG GLN A 99 14.753 -4.776 0.430 1.00 0.00 C ATOM 1423 CD GLN A 99 15.813 -5.636 1.123 1.00 0.00 C ATOM 1424 OE1 GLN A 99 16.243 -6.668 0.621 1.00 0.00 O ATOM 1425 NE2 GLN A 99 16.267 -5.263 2.304 1.00 0.00 N ATOM 0 H GLN A 99 12.740 -2.730 1.407 1.00 0.00 H new ATOM 0 HA GLN A 99 12.456 -4.437 -0.942 1.00 0.00 H new ATOM 0 HB2 GLN A 99 13.232 -4.940 1.958 1.00 0.00 H new ATOM 0 HB3 GLN A 99 13.155 -6.199 0.742 1.00 0.00 H new ATOM 0 HG2 GLN A 99 14.829 -4.907 -0.649 1.00 0.00 H new ATOM 0 HG3 GLN A 99 14.948 -3.724 0.637 1.00 0.00 H new ATOM 0 HE21 GLN A 99 15.920 -4.407 2.737 1.00 0.00 H new ATOM 0 HE22 GLN A 99 16.965 -5.831 2.785 1.00 0.00 H new ATOM 1434 N PRO A 100 10.319 -5.813 -0.436 1.00 0.00 N ATOM 1435 CA PRO A 100 9.010 -6.444 -0.249 1.00 0.00 C ATOM 1436 C PRO A 100 9.052 -7.542 0.821 1.00 0.00 C ATOM 1437 O PRO A 100 10.100 -8.118 1.114 1.00 0.00 O ATOM 1438 CB PRO A 100 8.650 -7.023 -1.623 1.00 0.00 C ATOM 1439 CG PRO A 100 10.011 -7.405 -2.202 1.00 0.00 C ATOM 1440 CD PRO A 100 10.932 -6.309 -1.666 1.00 0.00 C ATOM 0 HA PRO A 100 8.268 -5.727 0.103 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.991 -7.887 -1.537 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.137 -6.292 -2.247 1.00 0.00 H new ATOM 0 HG2 PRO A 100 10.327 -8.395 -1.872 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.996 -7.422 -3.292 1.00 0.00 H new ATOM 0 HD2 PRO A 100 11.929 -6.703 -1.470 1.00 0.00 H new ATOM 0 HD3 PRO A 100 11.043 -5.506 -2.395 1.00 0.00 H new ATOM 1448 N GLN A 101 7.866 -7.859 1.352 1.00 0.00 N ATOM 1449 CA GLN A 101 7.631 -9.011 2.231 1.00 0.00 C ATOM 1450 C GLN A 101 6.149 -9.429 2.243 1.00 0.00 C ATOM 1451 O GLN A 101 5.871 -10.628 2.270 1.00 0.00 O ATOM 1452 CB GLN A 101 8.187 -8.745 3.649 1.00 0.00 C ATOM 1453 CG GLN A 101 7.382 -7.724 4.469 1.00 0.00 C ATOM 1454 CD GLN A 101 8.111 -7.255 5.731 1.00 0.00 C ATOM 1455 OE1 GLN A 101 8.409 -6.078 5.902 1.00 0.00 O ATOM 1456 NE2 GLN A 101 8.430 -8.136 6.659 1.00 0.00 N ATOM 0 H GLN A 101 7.024 -7.310 1.179 1.00 0.00 H new ATOM 0 HA GLN A 101 8.180 -9.861 1.826 1.00 0.00 H new ATOM 0 HB2 GLN A 101 8.218 -9.687 4.196 1.00 0.00 H new ATOM 0 HB3 GLN A 101 9.215 -8.393 3.562 1.00 0.00 H new ATOM 0 HG2 GLN A 101 7.159 -6.860 3.843 1.00 0.00 H new ATOM 0 HG3 GLN A 101 6.427 -8.167 4.752 1.00 0.00 H new ATOM 0 HE21 GLN A 101 8.190 -9.119 6.533 1.00 0.00 H new ATOM 0 HE22 GLN A 101 8.917 -7.834 7.503 1.00 0.00 H new ATOM 1465 N TYR A 102 5.193 -8.479 2.177 1.00 0.00 N ATOM 1466 CA TYR A 102 3.754 -8.824 2.219 1.00 0.00 C ATOM 1467 C TYR A 102 3.083 -9.003 0.848 1.00 0.00 C ATOM 1468 O TYR A 102 1.965 -9.516 0.777 1.00 0.00 O ATOM 1469 CB TYR A 102 3.020 -7.774 3.063 1.00 0.00 C ATOM 1470 CG TYR A 102 3.580 -7.597 4.466 1.00 0.00 C ATOM 1471 CD1 TYR A 102 3.493 -8.648 5.400 1.00 0.00 C ATOM 1472 CD2 TYR A 102 4.208 -6.389 4.829 1.00 0.00 C ATOM 1473 CE1 TYR A 102 4.025 -8.490 6.694 1.00 0.00 C ATOM 1474 CE2 TYR A 102 4.729 -6.218 6.127 1.00 0.00 C ATOM 1475 CZ TYR A 102 4.640 -7.273 7.065 1.00 0.00 C ATOM 1476 OH TYR A 102 5.151 -7.127 8.320 1.00 0.00 O ATOM 0 H TYR A 102 5.386 -7.481 2.096 1.00 0.00 H new ATOM 0 HA TYR A 102 3.684 -9.811 2.675 1.00 0.00 H new ATOM 0 HB2 TYR A 102 3.060 -6.816 2.545 1.00 0.00 H new ATOM 0 HB3 TYR A 102 1.969 -8.054 3.136 1.00 0.00 H new ATOM 0 HD1 TYR A 102 3.017 -9.577 5.123 1.00 0.00 H new ATOM 0 HD2 TYR A 102 4.291 -5.589 4.108 1.00 0.00 H new ATOM 0 HE1 TYR A 102 3.963 -9.301 7.405 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.195 -5.284 6.405 1.00 0.00 H new ATOM 0 HH TYR A 102 5.540 -6.232 8.413 1.00 0.00 H new ATOM 1486 N ILE A 103 3.753 -8.620 -0.246 1.00 0.00 N ATOM 1487 CA ILE A 103 3.306 -8.914 -1.617 1.00 0.00 C ATOM 1488 C ILE A 103 4.016 -10.211 -2.068 1.00 0.00 C ATOM 1489 O ILE A 103 5.241 -10.311 -1.964 1.00 0.00 O ATOM 1490 CB ILE A 103 3.635 -7.759 -2.608 1.00 0.00 C ATOM 1491 CG1 ILE A 103 3.071 -6.353 -2.287 1.00 0.00 C ATOM 1492 CG2 ILE A 103 3.081 -8.125 -4.000 1.00 0.00 C ATOM 1493 CD1 ILE A 103 3.613 -5.658 -1.030 1.00 0.00 C ATOM 0 H ILE A 103 4.626 -8.094 -0.207 1.00 0.00 H new ATOM 0 HA ILE A 103 2.222 -9.028 -1.621 1.00 0.00 H new ATOM 0 HB ILE A 103 4.720 -7.676 -2.540 1.00 0.00 H new ATOM 0 HG12 ILE A 103 3.265 -5.706 -3.143 1.00 0.00 H new ATOM 0 HG13 ILE A 103 1.989 -6.436 -2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 103 3.305 -7.323 -4.703 1.00 0.00 H new ATOM 0 HG22 ILE A 103 3.544 -9.050 -4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 103 2.001 -8.261 -3.938 1.00 0.00 H new ATOM 0 HD11 ILE A 103 3.138 -4.683 -0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.395 -6.269 -0.154 1.00 0.00 H new ATOM 0 HD13 ILE A 103 4.691 -5.528 -1.123 1.00 0.00 H new ATOM 1505 N ILE A 104 3.270 -11.186 -2.592 1.00 0.00 N ATOM 1506 CA ILE A 104 3.782 -12.462 -3.146 1.00 0.00 C ATOM 1507 C ILE A 104 3.478 -12.561 -4.656 1.00 0.00 C ATOM 1508 O ILE A 104 2.410 -12.161 -5.109 1.00 0.00 O ATOM 1509 CB ILE A 104 3.206 -13.675 -2.362 1.00 0.00 C ATOM 1510 CG1 ILE A 104 3.337 -13.537 -0.822 1.00 0.00 C ATOM 1511 CG2 ILE A 104 3.917 -14.973 -2.792 1.00 0.00 C ATOM 1512 CD1 ILE A 104 2.099 -12.923 -0.149 1.00 0.00 C ATOM 0 H ILE A 104 2.254 -11.116 -2.649 1.00 0.00 H new ATOM 0 HA ILE A 104 4.865 -12.482 -3.027 1.00 0.00 H new ATOM 0 HB ILE A 104 2.144 -13.706 -2.605 1.00 0.00 H new ATOM 0 HG12 ILE A 104 3.522 -14.521 -0.392 1.00 0.00 H new ATOM 0 HG13 ILE A 104 4.207 -12.921 -0.594 1.00 0.00 H new ATOM 0 HG21 ILE A 104 3.505 -15.815 -2.236 1.00 0.00 H new ATOM 0 HG22 ILE A 104 3.766 -15.134 -3.859 1.00 0.00 H new ATOM 0 HG23 ILE A 104 4.984 -14.889 -2.585 1.00 0.00 H new ATOM 0 HD11 ILE A 104 2.264 -12.858 0.926 1.00 0.00 H new ATOM 0 HD12 ILE A 104 1.924 -11.925 -0.550 1.00 0.00 H new ATOM 0 HD13 ILE A 104 1.229 -13.550 -0.345 1.00 0.00 H new ATOM 1524 N SER A 105 4.389 -13.103 -5.462 1.00 0.00 N ATOM 1525 CA SER A 105 4.222 -13.291 -6.905 1.00 0.00 C ATOM 1526 C SER A 105 3.502 -14.617 -7.242 1.00 0.00 C ATOM 1527 O SER A 105 3.808 -15.672 -6.678 1.00 0.00 O ATOM 1528 CB SER A 105 5.603 -13.239 -7.588 1.00 0.00 C ATOM 1529 OG SER A 105 6.540 -14.137 -6.998 1.00 0.00 O ATOM 0 H SER A 105 5.291 -13.434 -5.120 1.00 0.00 H new ATOM 0 HA SER A 105 3.592 -12.485 -7.281 1.00 0.00 H new ATOM 0 HB2 SER A 105 5.491 -13.480 -8.645 1.00 0.00 H new ATOM 0 HB3 SER A 105 5.994 -12.223 -7.532 1.00 0.00 H new ATOM 0 HG SER A 105 7.398 -14.068 -7.466 1.00 0.00 H new ATOM 1535 N VAL A 106 2.559 -14.575 -8.194 1.00 0.00 N ATOM 1536 CA VAL A 106 1.864 -15.753 -8.762 1.00 0.00 C ATOM 1537 C VAL A 106 1.864 -15.625 -10.297 1.00 0.00 C ATOM 1538 O VAL A 106 0.847 -15.312 -10.917 1.00 0.00 O ATOM 1539 CB VAL A 106 0.431 -15.936 -8.185 1.00 0.00 C ATOM 1540 CG1 VAL A 106 -0.124 -17.322 -8.559 1.00 0.00 C ATOM 1541 CG2 VAL A 106 0.367 -15.795 -6.652 1.00 0.00 C ATOM 0 H VAL A 106 2.245 -13.697 -8.607 1.00 0.00 H new ATOM 0 HA VAL A 106 2.401 -16.657 -8.474 1.00 0.00 H new ATOM 0 HB VAL A 106 -0.168 -15.138 -8.625 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -1.127 -17.435 -8.148 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -0.163 -17.418 -9.644 1.00 0.00 H new ATOM 0 HG13 VAL A 106 0.525 -18.096 -8.150 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -0.661 -15.934 -6.316 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.005 -16.549 -6.190 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.712 -14.802 -6.363 1.00 0.00 H new ATOM 1551 N ARG A 107 3.050 -15.786 -10.902 1.00 0.00 N ATOM 1552 CA ARG A 107 3.344 -15.424 -12.302 1.00 0.00 C ATOM 1553 C ARG A 107 2.311 -15.980 -13.297 1.00 0.00 C ATOM 1554 O ARG A 107 2.007 -17.173 -13.306 1.00 0.00 O ATOM 1555 CB ARG A 107 4.790 -15.845 -12.644 1.00 0.00 C ATOM 1556 CG ARG A 107 5.316 -15.308 -13.991 1.00 0.00 C ATOM 1557 CD ARG A 107 5.043 -16.226 -15.193 1.00 0.00 C ATOM 1558 NE ARG A 107 5.545 -15.626 -16.442 1.00 0.00 N ATOM 1559 CZ ARG A 107 5.428 -16.135 -17.665 1.00 0.00 C ATOM 1560 NH1 ARG A 107 4.840 -17.294 -17.889 1.00 0.00 N ATOM 1561 NH2 ARG A 107 5.909 -15.473 -18.695 1.00 0.00 N ATOM 0 H ARG A 107 3.856 -16.183 -10.419 1.00 0.00 H new ATOM 0 HA ARG A 107 3.263 -14.342 -12.401 1.00 0.00 H new ATOM 0 HB2 ARG A 107 5.452 -15.502 -11.848 1.00 0.00 H new ATOM 0 HB3 ARG A 107 4.844 -16.934 -12.656 1.00 0.00 H new ATOM 0 HG2 ARG A 107 4.862 -14.335 -14.182 1.00 0.00 H new ATOM 0 HG3 ARG A 107 6.391 -15.148 -13.909 1.00 0.00 H new ATOM 0 HD2 ARG A 107 5.520 -17.193 -15.032 1.00 0.00 H new ATOM 0 HD3 ARG A 107 3.972 -16.410 -15.279 1.00 0.00 H new ATOM 0 HE ARG A 107 6.030 -14.732 -16.360 1.00 0.00 H new ATOM 0 HH11 ARG A 107 4.457 -17.830 -17.111 1.00 0.00 H new ATOM 0 HH12 ARG A 107 4.768 -17.654 -18.841 1.00 0.00 H new ATOM 0 HH21 ARG A 107 6.369 -14.574 -18.554 1.00 0.00 H new ATOM 0 HH22 ARG A 107 5.822 -15.859 -19.635 1.00 0.00 H new ATOM 1575 N GLY A 108 1.764 -15.086 -14.131 1.00 0.00 N ATOM 1576 CA GLY A 108 0.724 -15.354 -15.142 1.00 0.00 C ATOM 1577 C GLY A 108 -0.700 -15.073 -14.649 1.00 0.00 C ATOM 1578 O GLY A 108 -1.535 -14.618 -15.431 1.00 0.00 O ATOM 0 H GLY A 108 2.047 -14.106 -14.121 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.921 -14.744 -16.024 1.00 0.00 H new ATOM 0 HA3 GLY A 108 0.792 -16.396 -15.454 1.00 0.00 H new ATOM 1582 N ILE A 109 -0.968 -15.303 -13.357 1.00 0.00 N ATOM 1583 CA ILE A 109 -2.262 -15.031 -12.701 1.00 0.00 C ATOM 1584 C ILE A 109 -2.271 -13.591 -12.159 1.00 0.00 C ATOM 1585 O ILE A 109 -3.196 -12.827 -12.447 1.00 0.00 O ATOM 1586 CB ILE A 109 -2.538 -16.075 -11.580 1.00 0.00 C ATOM 1587 CG1 ILE A 109 -2.803 -17.512 -12.100 1.00 0.00 C ATOM 1588 CG2 ILE A 109 -3.767 -15.674 -10.737 1.00 0.00 C ATOM 1589 CD1 ILE A 109 -1.601 -18.244 -12.710 1.00 0.00 C ATOM 0 H ILE A 109 -0.275 -15.694 -12.719 1.00 0.00 H new ATOM 0 HA ILE A 109 -3.067 -15.125 -13.430 1.00 0.00 H new ATOM 0 HB ILE A 109 -1.622 -16.080 -10.989 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -3.185 -18.111 -11.273 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -3.592 -17.465 -12.850 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -3.936 -16.421 -9.962 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -3.589 -14.704 -10.273 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -4.645 -15.613 -11.380 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.908 -19.237 -13.038 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -1.227 -17.680 -13.564 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -0.813 -18.336 -11.962 1.00 0.00 H new ATOM 1601 N GLY A 110 -1.237 -13.218 -11.392 1.00 0.00 N ATOM 1602 CA GLY A 110 -1.140 -11.918 -10.726 1.00 0.00 C ATOM 1603 C GLY A 110 -0.185 -11.879 -9.535 1.00 0.00 C ATOM 1604 O GLY A 110 0.669 -12.750 -9.370 1.00 0.00 O ATOM 0 H GLY A 110 -0.434 -13.822 -11.216 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -0.819 -11.175 -11.456 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.133 -11.624 -10.387 1.00 0.00 H new ATOM 1608 N TYR A 111 -0.310 -10.841 -8.706 1.00 0.00 N ATOM 1609 CA TYR A 111 0.456 -10.710 -7.450 1.00 0.00 C ATOM 1610 C TYR A 111 -0.476 -10.591 -6.241 1.00 0.00 C ATOM 1611 O TYR A 111 -1.338 -9.722 -6.165 1.00 0.00 O ATOM 1612 CB TYR A 111 1.422 -9.520 -7.496 1.00 0.00 C ATOM 1613 CG TYR A 111 2.723 -9.749 -8.257 1.00 0.00 C ATOM 1614 CD1 TYR A 111 2.723 -10.166 -9.603 1.00 0.00 C ATOM 1615 CD2 TYR A 111 3.957 -9.576 -7.596 1.00 0.00 C ATOM 1616 CE1 TYR A 111 3.928 -10.483 -10.254 1.00 0.00 C ATOM 1617 CE2 TYR A 111 5.171 -9.837 -8.259 1.00 0.00 C ATOM 1618 CZ TYR A 111 5.159 -10.316 -9.588 1.00 0.00 C ATOM 1619 OH TYR A 111 6.321 -10.631 -10.225 1.00 0.00 O ATOM 0 H TYR A 111 -0.945 -10.062 -8.881 1.00 0.00 H new ATOM 0 HA TYR A 111 1.047 -11.619 -7.342 1.00 0.00 H new ATOM 0 HB2 TYR A 111 0.904 -8.673 -7.947 1.00 0.00 H new ATOM 0 HB3 TYR A 111 1.667 -9.236 -6.473 1.00 0.00 H new ATOM 0 HD1 TYR A 111 1.789 -10.243 -10.139 1.00 0.00 H new ATOM 0 HD2 TYR A 111 3.971 -9.240 -6.570 1.00 0.00 H new ATOM 0 HE1 TYR A 111 3.910 -10.856 -11.268 1.00 0.00 H new ATOM 0 HE2 TYR A 111 6.110 -9.671 -7.752 1.00 0.00 H new ATOM 0 HH TYR A 111 6.214 -10.491 -11.189 1.00 0.00 H new ATOM 1629 N LYS A 112 -0.282 -11.484 -5.281 1.00 0.00 N ATOM 1630 CA LYS A 112 -1.080 -11.622 -4.061 1.00 0.00 C ATOM 1631 C LYS A 112 -0.649 -10.603 -2.996 1.00 0.00 C ATOM 1632 O LYS A 112 0.545 -10.412 -2.758 1.00 0.00 O ATOM 1633 CB LYS A 112 -0.959 -13.079 -3.567 1.00 0.00 C ATOM 1634 CG LYS A 112 -1.776 -13.365 -2.292 1.00 0.00 C ATOM 1635 CD LYS A 112 -1.588 -14.793 -1.758 1.00 0.00 C ATOM 1636 CE LYS A 112 -2.199 -15.853 -2.689 1.00 0.00 C ATOM 1637 NZ LYS A 112 -2.060 -17.225 -2.124 1.00 0.00 N ATOM 0 H LYS A 112 0.473 -12.168 -5.330 1.00 0.00 H new ATOM 0 HA LYS A 112 -2.128 -11.406 -4.270 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -1.289 -13.751 -4.359 1.00 0.00 H new ATOM 0 HB3 LYS A 112 0.090 -13.303 -3.375 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -1.489 -12.654 -1.517 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -2.833 -13.199 -2.501 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -0.524 -14.994 -1.633 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -2.046 -14.872 -0.772 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -3.254 -15.631 -2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -1.710 -15.808 -3.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -2.483 -17.914 -2.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -1.052 -17.446 -1.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -2.548 -17.274 -1.207 1.00 0.00 H new ATOM 1651 N LEU A 113 -1.616 -10.006 -2.304 1.00 0.00 N ATOM 1652 CA LEU A 113 -1.409 -9.143 -1.135 1.00 0.00 C ATOM 1653 C LEU A 113 -2.512 -9.417 -0.098 1.00 0.00 C ATOM 1654 O LEU A 113 -3.512 -10.064 -0.398 1.00 0.00 O ATOM 1655 CB LEU A 113 -1.357 -7.681 -1.641 1.00 0.00 C ATOM 1656 CG LEU A 113 -1.061 -6.569 -0.609 1.00 0.00 C ATOM 1657 CD1 LEU A 113 0.187 -6.857 0.238 1.00 0.00 C ATOM 1658 CD2 LEU A 113 -0.870 -5.238 -1.348 1.00 0.00 C ATOM 0 H LEU A 113 -2.601 -10.111 -2.547 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.469 -9.346 -0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -0.598 -7.624 -2.421 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.314 -7.455 -2.111 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.911 -6.524 0.072 1.00 0.00 H new ATOM 0 HD11 LEU A 113 0.344 -6.041 0.944 1.00 0.00 H new ATOM 0 HD12 LEU A 113 0.048 -7.789 0.785 1.00 0.00 H new ATOM 0 HD13 LEU A 113 1.056 -6.945 -0.413 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.661 -4.448 -0.627 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.035 -5.325 -2.044 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -1.778 -4.994 -1.899 1.00 0.00 H new ATOM 1670 N GLU A 114 -2.347 -8.915 1.122 1.00 0.00 N ATOM 1671 CA GLU A 114 -3.347 -9.018 2.196 1.00 0.00 C ATOM 1672 C GLU A 114 -3.453 -7.734 3.043 1.00 0.00 C ATOM 1673 O GLU A 114 -2.544 -6.900 3.054 1.00 0.00 O ATOM 1674 CB GLU A 114 -3.053 -10.262 3.056 1.00 0.00 C ATOM 1675 CG GLU A 114 -1.697 -10.237 3.776 1.00 0.00 C ATOM 1676 CD GLU A 114 -1.486 -11.535 4.572 1.00 0.00 C ATOM 1677 OE1 GLU A 114 -0.951 -12.518 4.008 1.00 0.00 O ATOM 1678 OE2 GLU A 114 -1.854 -11.585 5.771 1.00 0.00 O ATOM 0 H GLU A 114 -1.503 -8.416 1.403 1.00 0.00 H new ATOM 0 HA GLU A 114 -4.328 -9.135 1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -3.842 -10.368 3.800 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -3.095 -11.146 2.419 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -0.895 -10.115 3.048 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -1.651 -9.380 4.448 1.00 0.00 H new ATOM 1685 N TYR A 115 -4.598 -7.579 3.724 1.00 0.00 N ATOM 1686 CA TYR A 115 -4.936 -6.455 4.617 1.00 0.00 C ATOM 1687 C TYR A 115 -4.320 -6.631 6.022 1.00 0.00 C ATOM 1688 O TYR A 115 -4.503 -7.709 6.640 1.00 0.00 O ATOM 1689 CB TYR A 115 -6.469 -6.325 4.666 1.00 0.00 C ATOM 1690 CG TYR A 115 -7.032 -5.171 5.478 1.00 0.00 C ATOM 1691 CD1 TYR A 115 -7.161 -5.286 6.877 1.00 0.00 C ATOM 1692 CD2 TYR A 115 -7.503 -4.013 4.825 1.00 0.00 C ATOM 1693 CE1 TYR A 115 -7.748 -4.245 7.623 1.00 0.00 C ATOM 1694 CE2 TYR A 115 -8.109 -2.979 5.566 1.00 0.00 C ATOM 1695 CZ TYR A 115 -8.228 -3.090 6.970 1.00 0.00 C ATOM 1696 OH TYR A 115 -8.815 -2.099 7.700 1.00 0.00 O ATOM 1697 OXT TYR A 115 -3.651 -5.690 6.510 1.00 0.00 O ATOM 0 H TYR A 115 -5.351 -8.265 3.666 1.00 0.00 H new ATOM 0 HA TYR A 115 -4.507 -5.533 4.225 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -6.835 -6.232 3.644 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -6.876 -7.253 5.067 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -6.809 -6.175 7.379 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -7.399 -3.919 3.754 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -7.831 -4.331 8.696 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -8.483 -2.101 5.061 1.00 0.00 H new ATOM 0 HH TYR A 115 -9.091 -1.372 7.103 1.00 0.00 H new TER 1707 TYR A 115