USER MOD reduce.3.24.130724 H: found=0, std=0, add=985, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 985 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: B -14 HIS : no HD1:sc= -0.148 K(o=-0.3,f=-4.4) USER MOD Set 1.2: B -15 HIS : no HD1:sc= -0.148 K(o=-0.3,f=-1.6) USER MOD Set 2.1: B -10 SER OG : rot 33:sc= 0.543 USER MOD Set 2.2: B -11 HIS : no HD1:sc= -0.119 X(o=0.42,f=0.34) USER MOD Set 3.1: B 31 ASN : amide:sc= -0.522 K(o=-0.52,f=-5.5!) USER MOD Set 3.2: B 56 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: B 1 GLN : amide:sc= -2.22 K(o=-5.4,f=-6.9) USER MOD Set 4.2: B 22 GLN :FLIP amide:sc= -3.21! F(o=-8.5,f=-5.4!) USER MOD Single : B 0 MET CE :methyl -109:sc= -0.534 (180deg=-2.25!) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0.0072 USER MOD Single : B -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -2 SER OG : rot 180:sc= 0 USER MOD Single : B -9 SER OG : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= -1.02 USER MOD Single : B 17 LYS NZ :NH3+ 166:sc=-0.00708 (180deg=-0.142) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 GLN :FLIP amide:sc= -1.98! C(o=-5.2!,f=-2!) USER MOD Single : B 27 THR OG1 : rot 180:sc= 0 USER MOD Single : B 30 SER OG : rot 90:sc= -1.27 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 34 THR OG1 : rot -3:sc= 0.732 USER MOD Single : B 42 ASN : amide:sc= -0.646 K(o=-0.65,f=-7.4!) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 SER OG : rot 136:sc= -0.125 USER MOD Single : B 58 ASN : amide:sc= -0.156 X(o=-0.16,f=-0.19) USER MOD Single : B 59 SER OG : rot 180:sc= 0 USER MOD Single : B 63 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 180:sc=-0.00759 USER MOD Single : B 72 SER OG : rot -143:sc= 1.48 USER MOD Single : B 73 THR OG1 : rot -133:sc= -0.375 USER MOD Single : B 81 SER OG : rot 180:sc= -0.0193 USER MOD Single : B 90 TYR OH : rot 137:sc= 0.668 USER MOD Single : B 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B -12 HIS : no HD1:sc=-0.00834 K(o=-0.0083,f=-1) USER MOD Single : B -13 HIS : no HD1:sc= -0.0224 X(o=-0.022,f=-0.0017) USER MOD Single : B -16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B -17 SER OG : rot 180:sc= -0.217 USER MOD Single : B -18 SER OG : rot 180:sc= 0 USER MOD Single : B -20 MET CE :methyl -163:sc= -0.0862 (180deg=-0.58) USER MOD Single : B -20 MET N :NH3+ -169:sc= -0.124 (180deg=-0.419) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 SER OG : rot 38:sc= 0.758 USER MOD Single : B 109 GLN : amide:sc= -2.46! C(o=-2.5!,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET B -20 11.017 8.548 18.111 1.00 0.00 N ATOM 2 CA MET B -20 9.999 9.297 17.330 1.00 0.00 C ATOM 3 C MET B -20 10.130 10.797 17.566 1.00 0.00 C ATOM 4 O MET B -20 9.609 11.605 16.794 1.00 0.00 O ATOM 5 CB MET B -20 8.592 8.833 17.716 1.00 0.00 C ATOM 6 CG MET B -20 8.346 7.356 17.454 1.00 0.00 C ATOM 7 SD MET B -20 8.543 6.914 15.716 1.00 0.00 S ATOM 8 CE MET B -20 7.258 7.909 14.965 1.00 0.00 C ATOM 0 H1 MET B -20 11.035 7.556 17.798 1.00 0.00 H new ATOM 0 H2 MET B -20 11.953 8.975 17.961 1.00 0.00 H new ATOM 0 H3 MET B -20 10.777 8.587 19.122 1.00 0.00 H new ATOM 0 HA MET B -20 10.167 9.096 16.272 1.00 0.00 H new ATOM 0 HB2 MET B -20 8.428 9.038 18.774 1.00 0.00 H new ATOM 0 HB3 MET B -20 7.860 9.419 17.160 1.00 0.00 H new ATOM 0 HG2 MET B -20 9.037 6.765 18.055 1.00 0.00 H new ATOM 0 HG3 MET B -20 7.338 7.097 17.778 1.00 0.00 H new ATOM 0 HE1 MET B -20 7.047 7.535 13.963 1.00 0.00 H new ATOM 0 HE2 MET B -20 6.354 7.853 15.571 1.00 0.00 H new ATOM 0 HE3 MET B -20 7.590 8.945 14.903 1.00 0.00 H new ATOM 20 N GLY B -19 10.829 11.166 18.636 1.00 0.00 N ATOM 21 CA GLY B -19 11.015 12.570 18.954 1.00 0.00 C ATOM 22 C GLY B -19 12.246 12.811 19.807 1.00 0.00 C ATOM 23 O GLY B -19 12.736 11.900 20.476 1.00 0.00 O ATOM 0 H GLY B -19 11.270 10.517 19.288 1.00 0.00 H new ATOM 0 HA2 GLY B -19 11.099 13.141 18.029 1.00 0.00 H new ATOM 0 HA3 GLY B -19 10.134 12.941 19.479 1.00 0.00 H new ATOM 27 N SER B -18 12.747 14.043 19.782 1.00 0.00 N ATOM 28 CA SER B -18 13.928 14.404 20.557 1.00 0.00 C ATOM 29 C SER B -18 13.535 15.008 21.902 1.00 0.00 C ATOM 30 O SER B -18 12.709 15.918 21.965 1.00 0.00 O ATOM 31 CB SER B -18 14.794 15.392 19.775 1.00 0.00 C ATOM 32 OG SER B -18 15.233 14.831 18.550 1.00 0.00 O ATOM 0 H SER B -18 12.353 14.807 19.233 1.00 0.00 H new ATOM 0 HA SER B -18 14.501 13.495 20.742 1.00 0.00 H new ATOM 0 HB2 SER B -18 14.226 16.301 19.579 1.00 0.00 H new ATOM 0 HB3 SER B -18 15.657 15.679 20.376 1.00 0.00 H new ATOM 0 HG SER B -18 15.783 15.484 18.070 1.00 0.00 H new ATOM 38 N SER B -17 14.132 14.493 22.972 1.00 0.00 N ATOM 39 CA SER B -17 13.843 14.981 24.317 1.00 0.00 C ATOM 40 C SER B -17 15.059 14.818 25.225 1.00 0.00 C ATOM 41 O SER B -17 16.006 14.109 24.888 1.00 0.00 O ATOM 42 CB SER B -17 12.646 14.235 24.908 1.00 0.00 C ATOM 43 OG SER B -17 12.343 14.704 26.209 1.00 0.00 O ATOM 0 H SER B -17 14.818 13.739 22.935 1.00 0.00 H new ATOM 0 HA SER B -17 13.601 16.042 24.249 1.00 0.00 H new ATOM 0 HB2 SER B -17 11.778 14.363 24.261 1.00 0.00 H new ATOM 0 HB3 SER B -17 12.861 13.167 24.944 1.00 0.00 H new ATOM 0 HG SER B -17 11.573 14.212 26.563 1.00 0.00 H new ATOM 49 N HIS B -16 15.021 15.476 26.379 1.00 0.00 N ATOM 50 CA HIS B -16 16.118 15.405 27.336 1.00 0.00 C ATOM 51 C HIS B -16 16.069 14.102 28.127 1.00 0.00 C ATOM 52 O HIS B -16 16.889 13.874 29.017 1.00 0.00 O ATOM 53 CB HIS B -16 16.066 16.598 28.294 1.00 0.00 C ATOM 54 CG HIS B -16 16.192 17.923 27.609 1.00 0.00 C ATOM 55 ND1 HIS B -16 17.370 18.637 27.564 1.00 0.00 N ATOM 56 CD2 HIS B -16 15.277 18.666 26.941 1.00 0.00 C ATOM 57 CE1 HIS B -16 17.176 19.762 26.896 1.00 0.00 C ATOM 58 NE2 HIS B -16 15.915 19.803 26.508 1.00 0.00 N ATOM 0 H HIS B -16 14.242 16.065 26.674 1.00 0.00 H new ATOM 0 HA HIS B -16 17.054 15.435 26.778 1.00 0.00 H new ATOM 0 HB2 HIS B -16 15.125 16.571 28.844 1.00 0.00 H new ATOM 0 HB3 HIS B -16 16.867 16.500 29.027 1.00 0.00 H new ATOM 0 HD2 HIS B -16 14.240 18.412 26.779 1.00 0.00 H new ATOM 0 HE1 HIS B -16 17.922 20.518 26.701 1.00 0.00 H new ATOM 0 HE2 HIS B -16 15.484 20.557 25.973 1.00 0.00 H new ATOM 67 N HIS B -15 15.105 13.249 27.793 1.00 0.00 N ATOM 68 CA HIS B -15 14.949 11.968 28.470 1.00 0.00 C ATOM 69 C HIS B -15 16.159 11.071 28.220 1.00 0.00 C ATOM 70 O HIS B -15 16.252 10.415 27.184 1.00 0.00 O ATOM 71 CB HIS B -15 13.672 11.270 27.996 1.00 0.00 C ATOM 72 CG HIS B -15 13.408 9.965 28.678 1.00 0.00 C ATOM 73 ND1 HIS B -15 12.737 9.866 29.879 1.00 0.00 N ATOM 74 CD2 HIS B -15 13.725 8.697 28.320 1.00 0.00 C ATOM 75 CE1 HIS B -15 12.655 8.594 30.230 1.00 0.00 C ATOM 76 NE2 HIS B -15 13.246 7.866 29.301 1.00 0.00 N ATOM 0 H HIS B -15 14.420 13.423 27.057 1.00 0.00 H new ATOM 0 HA HIS B -15 14.875 12.156 29.541 1.00 0.00 H new ATOM 0 HB2 HIS B -15 12.823 11.934 28.162 1.00 0.00 H new ATOM 0 HB3 HIS B -15 13.739 11.101 26.921 1.00 0.00 H new ATOM 0 HD2 HIS B -15 14.256 8.397 27.429 1.00 0.00 H new ATOM 0 HE1 HIS B -15 12.184 8.215 31.125 1.00 0.00 H new ATOM 0 HE2 HIS B -15 13.333 6.850 29.311 1.00 0.00 H new ATOM 85 N HIS B -14 17.081 11.054 29.181 1.00 0.00 N ATOM 86 CA HIS B -14 18.293 10.244 29.079 1.00 0.00 C ATOM 87 C HIS B -14 19.118 10.639 27.857 1.00 0.00 C ATOM 88 O HIS B -14 20.041 11.448 27.957 1.00 0.00 O ATOM 89 CB HIS B -14 17.944 8.755 29.019 1.00 0.00 C ATOM 90 CG HIS B -14 17.303 8.239 30.270 1.00 0.00 C ATOM 91 ND1 HIS B -14 16.054 7.651 30.289 1.00 0.00 N ATOM 92 CD2 HIS B -14 17.742 8.222 31.550 1.00 0.00 C ATOM 93 CE1 HIS B -14 15.756 7.294 31.526 1.00 0.00 C ATOM 94 NE2 HIS B -14 16.764 7.629 32.310 1.00 0.00 N ATOM 0 H HIS B -14 17.011 11.595 30.043 1.00 0.00 H new ATOM 0 HA HIS B -14 18.892 10.429 29.971 1.00 0.00 H new ATOM 0 HB2 HIS B -14 17.272 8.581 28.178 1.00 0.00 H new ATOM 0 HB3 HIS B -14 18.852 8.185 28.824 1.00 0.00 H new ATOM 0 HD2 HIS B -14 18.687 8.604 31.908 1.00 0.00 H new ATOM 0 HE1 HIS B -14 14.843 6.811 31.842 1.00 0.00 H new ATOM 0 HE2 HIS B -14 16.809 7.473 33.317 1.00 0.00 H new ATOM 103 N HIS B -13 18.785 10.063 26.705 1.00 0.00 N ATOM 104 CA HIS B -13 19.498 10.357 25.468 1.00 0.00 C ATOM 105 C HIS B -13 18.523 10.629 24.328 1.00 0.00 C ATOM 106 O HIS B -13 17.336 10.316 24.426 1.00 0.00 O ATOM 107 CB HIS B -13 20.422 9.195 25.098 1.00 0.00 C ATOM 108 CG HIS B -13 21.468 8.908 26.129 1.00 0.00 C ATOM 109 ND1 HIS B -13 22.760 9.384 26.046 1.00 0.00 N ATOM 110 CD2 HIS B -13 21.409 8.187 27.274 1.00 0.00 C ATOM 111 CE1 HIS B -13 23.450 8.967 27.093 1.00 0.00 C ATOM 112 NE2 HIS B -13 22.652 8.241 27.853 1.00 0.00 N ATOM 0 H HIS B -13 18.025 9.390 26.604 1.00 0.00 H new ATOM 0 HA HIS B -13 20.098 11.252 25.629 1.00 0.00 H new ATOM 0 HB2 HIS B -13 19.821 8.299 24.944 1.00 0.00 H new ATOM 0 HB3 HIS B -13 20.911 9.418 24.150 1.00 0.00 H new ATOM 0 HD2 HIS B -13 20.545 7.667 27.660 1.00 0.00 H new ATOM 0 HE1 HIS B -13 24.489 9.183 27.293 1.00 0.00 H new ATOM 0 HE2 HIS B -13 22.917 7.792 28.730 1.00 0.00 H new ATOM 121 N HIS B -12 19.031 11.214 23.249 1.00 0.00 N ATOM 122 CA HIS B -12 18.207 11.529 22.088 1.00 0.00 C ATOM 123 C HIS B -12 18.221 10.381 21.083 1.00 0.00 C ATOM 124 O HIS B -12 17.172 9.856 20.710 1.00 0.00 O ATOM 125 CB HIS B -12 18.701 12.814 21.419 1.00 0.00 C ATOM 126 CG HIS B -12 18.654 14.012 22.314 1.00 0.00 C ATOM 127 ND1 HIS B -12 17.675 14.979 22.229 1.00 0.00 N ATOM 128 CD2 HIS B -12 19.476 14.399 23.319 1.00 0.00 C ATOM 129 CE1 HIS B -12 17.897 15.908 23.141 1.00 0.00 C ATOM 130 NE2 HIS B -12 18.982 15.581 23.815 1.00 0.00 N ATOM 0 H HIS B -12 20.011 11.480 23.154 1.00 0.00 H new ATOM 0 HA HIS B -12 17.183 11.676 22.430 1.00 0.00 H new ATOM 0 HB2 HIS B -12 19.726 12.665 21.078 1.00 0.00 H new ATOM 0 HB3 HIS B -12 18.096 13.008 20.534 1.00 0.00 H new ATOM 0 HD2 HIS B -12 20.355 13.876 23.665 1.00 0.00 H new ATOM 0 HE1 HIS B -12 17.292 16.787 23.307 1.00 0.00 H new ATOM 0 HE2 HIS B -12 19.389 16.119 24.581 1.00 0.00 H new ATOM 139 N HIS B -11 19.418 9.999 20.649 1.00 0.00 N ATOM 140 CA HIS B -11 19.571 8.913 19.688 1.00 0.00 C ATOM 141 C HIS B -11 20.809 8.080 20.005 1.00 0.00 C ATOM 142 O HIS B -11 21.782 8.585 20.569 1.00 0.00 O ATOM 143 CB HIS B -11 19.667 9.475 18.267 1.00 0.00 C ATOM 144 CG HIS B -11 19.762 8.420 17.208 1.00 0.00 C ATOM 145 ND1 HIS B -11 20.950 8.068 16.602 1.00 0.00 N ATOM 146 CD2 HIS B -11 18.810 7.639 16.647 1.00 0.00 C ATOM 147 CE1 HIS B -11 20.723 7.117 15.714 1.00 0.00 C ATOM 148 NE2 HIS B -11 19.433 6.839 15.722 1.00 0.00 N ATOM 0 H HIS B -11 20.295 10.425 20.947 1.00 0.00 H new ATOM 0 HA HIS B -11 18.695 8.269 19.758 1.00 0.00 H new ATOM 0 HB2 HIS B -11 18.793 10.096 18.071 1.00 0.00 H new ATOM 0 HB3 HIS B -11 20.540 10.124 18.201 1.00 0.00 H new ATOM 0 HD2 HIS B -11 17.756 7.644 16.883 1.00 0.00 H new ATOM 0 HE1 HIS B -11 21.467 6.647 15.088 1.00 0.00 H new ATOM 0 HE2 HIS B -11 18.973 6.142 15.136 1.00 0.00 H new ATOM 157 N SER B -10 20.766 6.801 19.643 1.00 0.00 N ATOM 158 CA SER B -10 21.884 5.897 19.887 1.00 0.00 C ATOM 159 C SER B -10 23.154 6.407 19.212 1.00 0.00 C ATOM 160 O SER B -10 23.220 6.507 17.988 1.00 0.00 O ATOM 161 CB SER B -10 21.551 4.493 19.379 1.00 0.00 C ATOM 162 OG SER B -10 21.284 4.502 17.987 1.00 0.00 O ATOM 0 H SER B -10 19.968 6.367 19.179 1.00 0.00 H new ATOM 0 HA SER B -10 22.058 5.856 20.962 1.00 0.00 H new ATOM 0 HB2 SER B -10 22.383 3.821 19.588 1.00 0.00 H new ATOM 0 HB3 SER B -10 20.685 4.105 19.916 1.00 0.00 H new ATOM 0 HG SER B -10 21.834 5.187 17.553 1.00 0.00 H new ATOM 168 N SER B -9 24.159 6.724 20.021 1.00 0.00 N ATOM 169 CA SER B -9 25.428 7.225 19.503 1.00 0.00 C ATOM 170 C SER B -9 26.304 6.078 19.007 1.00 0.00 C ATOM 171 O SER B -9 25.917 4.911 19.083 1.00 0.00 O ATOM 172 CB SER B -9 26.168 8.015 20.585 1.00 0.00 C ATOM 173 OG SER B -9 25.402 9.124 21.021 1.00 0.00 O ATOM 0 H SER B -9 24.120 6.643 21.037 1.00 0.00 H new ATOM 0 HA SER B -9 25.214 7.885 18.662 1.00 0.00 H new ATOM 0 HB2 SER B -9 26.384 7.363 21.431 1.00 0.00 H new ATOM 0 HB3 SER B -9 27.126 8.361 20.196 1.00 0.00 H new ATOM 0 HG SER B -9 25.896 9.611 21.713 1.00 0.00 H new ATOM 179 N GLY B -8 27.485 6.420 18.501 1.00 0.00 N ATOM 180 CA GLY B -8 28.398 5.409 18.000 1.00 0.00 C ATOM 181 C GLY B -8 28.368 5.301 16.487 1.00 0.00 C ATOM 182 O GLY B -8 28.654 6.270 15.783 1.00 0.00 O ATOM 0 H GLY B -8 27.826 7.379 18.429 1.00 0.00 H new ATOM 0 HA2 GLY B -8 29.411 5.646 18.325 1.00 0.00 H new ATOM 0 HA3 GLY B -8 28.141 4.443 18.436 1.00 0.00 H new ATOM 186 N LEU B -7 28.020 4.120 15.986 1.00 0.00 N ATOM 187 CA LEU B -7 27.952 3.890 14.550 1.00 0.00 C ATOM 188 C LEU B -7 26.663 4.459 13.967 1.00 0.00 C ATOM 189 O LEU B -7 25.582 4.274 14.526 1.00 0.00 O ATOM 190 CB LEU B -7 28.043 2.392 14.247 1.00 0.00 C ATOM 191 CG LEU B -7 29.325 1.707 14.728 1.00 0.00 C ATOM 192 CD1 LEU B -7 29.270 0.214 14.447 1.00 0.00 C ATOM 193 CD2 LEU B -7 30.546 2.329 14.067 1.00 0.00 C ATOM 0 H LEU B -7 27.781 3.308 16.555 1.00 0.00 H new ATOM 0 HA LEU B -7 28.796 4.401 14.086 1.00 0.00 H new ATOM 0 HB2 LEU B -7 27.189 1.892 14.705 1.00 0.00 H new ATOM 0 HB3 LEU B -7 27.956 2.249 13.170 1.00 0.00 H new ATOM 0 HG LEU B -7 29.407 1.852 15.805 1.00 0.00 H new ATOM 0 HD11 LEU B -7 30.190 -0.256 14.796 1.00 0.00 H new ATOM 0 HD12 LEU B -7 28.419 -0.223 14.969 1.00 0.00 H new ATOM 0 HD13 LEU B -7 29.162 0.049 13.375 1.00 0.00 H new ATOM 0 HD21 LEU B -7 31.447 1.828 14.422 1.00 0.00 H new ATOM 0 HD22 LEU B -7 30.471 2.217 12.985 1.00 0.00 H new ATOM 0 HD23 LEU B -7 30.596 3.388 14.319 1.00 0.00 H new ATOM 205 N VAL B -6 26.787 5.157 12.842 1.00 0.00 N ATOM 206 CA VAL B -6 25.630 5.757 12.185 1.00 0.00 C ATOM 207 C VAL B -6 25.586 5.388 10.703 1.00 0.00 C ATOM 208 O VAL B -6 26.627 5.234 10.063 1.00 0.00 O ATOM 209 CB VAL B -6 25.642 7.292 12.321 1.00 0.00 C ATOM 210 CG1 VAL B -6 25.584 7.698 13.786 1.00 0.00 C ATOM 211 CG2 VAL B -6 26.871 7.883 11.646 1.00 0.00 C ATOM 0 H VAL B -6 27.675 5.321 12.367 1.00 0.00 H new ATOM 0 HA VAL B -6 24.743 5.362 12.681 1.00 0.00 H new ATOM 0 HB VAL B -6 24.758 7.687 11.821 1.00 0.00 H new ATOM 0 HG11 VAL B -6 25.593 8.785 13.863 1.00 0.00 H new ATOM 0 HG12 VAL B -6 24.670 7.310 14.235 1.00 0.00 H new ATOM 0 HG13 VAL B -6 26.447 7.290 14.311 1.00 0.00 H new ATOM 0 HG21 VAL B -6 26.859 8.968 11.754 1.00 0.00 H new ATOM 0 HG22 VAL B -6 27.771 7.482 12.112 1.00 0.00 H new ATOM 0 HG23 VAL B -6 26.865 7.624 10.587 1.00 0.00 H new ATOM 221 N PRO B -5 24.375 5.239 10.133 1.00 0.00 N ATOM 222 CA PRO B -5 24.204 4.887 8.719 1.00 0.00 C ATOM 223 C PRO B -5 24.826 5.924 7.788 1.00 0.00 C ATOM 224 O PRO B -5 24.952 7.096 8.146 1.00 0.00 O ATOM 225 CB PRO B -5 22.683 4.848 8.531 1.00 0.00 C ATOM 226 CG PRO B -5 22.125 4.687 9.904 1.00 0.00 C ATOM 227 CD PRO B -5 23.079 5.396 10.819 1.00 0.00 C ATOM 0 HA PRO B -5 24.697 3.946 8.476 1.00 0.00 H new ATOM 0 HB2 PRO B -5 22.320 5.763 8.063 1.00 0.00 H new ATOM 0 HB3 PRO B -5 22.387 4.021 7.886 1.00 0.00 H new ATOM 0 HG2 PRO B -5 21.125 5.116 9.973 1.00 0.00 H new ATOM 0 HG3 PRO B -5 22.038 3.633 10.170 1.00 0.00 H new ATOM 0 HD2 PRO B -5 22.813 6.446 10.944 1.00 0.00 H new ATOM 0 HD3 PRO B -5 23.092 4.949 11.813 1.00 0.00 H new ATOM 235 N ARG B -4 25.211 5.486 6.595 1.00 0.00 N ATOM 236 CA ARG B -4 25.817 6.375 5.612 1.00 0.00 C ATOM 237 C ARG B -4 25.746 5.771 4.213 1.00 0.00 C ATOM 238 O ARG B -4 25.925 4.566 4.037 1.00 0.00 O ATOM 239 CB ARG B -4 27.274 6.665 5.983 1.00 0.00 C ATOM 240 CG ARG B -4 28.142 5.421 6.067 1.00 0.00 C ATOM 241 CD ARG B -4 29.577 5.765 6.426 1.00 0.00 C ATOM 242 NE ARG B -4 30.186 6.658 5.444 1.00 0.00 N ATOM 243 CZ ARG B -4 31.391 7.203 5.589 1.00 0.00 C ATOM 244 NH1 ARG B -4 32.113 6.950 6.673 1.00 0.00 N ATOM 245 NH2 ARG B -4 31.875 8.004 4.651 1.00 0.00 N ATOM 0 H ARG B -4 25.114 4.519 6.285 1.00 0.00 H new ATOM 0 HA ARG B -4 25.257 7.310 5.612 1.00 0.00 H new ATOM 0 HB2 ARG B -4 27.699 7.345 5.245 1.00 0.00 H new ATOM 0 HB3 ARG B -4 27.300 7.181 6.943 1.00 0.00 H new ATOM 0 HG2 ARG B -4 27.733 4.740 6.814 1.00 0.00 H new ATOM 0 HG3 ARG B -4 28.121 4.896 5.112 1.00 0.00 H new ATOM 0 HD2 ARG B -4 29.602 6.235 7.409 1.00 0.00 H new ATOM 0 HD3 ARG B -4 30.163 4.849 6.496 1.00 0.00 H new ATOM 0 HE ARG B -4 29.658 6.876 4.599 1.00 0.00 H new ATOM 0 HH11 ARG B -4 31.745 6.336 7.399 1.00 0.00 H new ATOM 0 HH12 ARG B -4 33.036 7.370 6.780 1.00 0.00 H new ATOM 0 HH21 ARG B -4 31.324 8.204 3.816 1.00 0.00 H new ATOM 0 HH22 ARG B -4 32.799 8.421 4.764 1.00 0.00 H new ATOM 259 N GLY B -3 25.484 6.618 3.221 1.00 0.00 N ATOM 260 CA GLY B -3 25.392 6.151 1.850 1.00 0.00 C ATOM 261 C GLY B -3 23.999 6.313 1.275 1.00 0.00 C ATOM 262 O GLY B -3 23.559 7.431 1.004 1.00 0.00 O ATOM 0 H GLY B -3 25.334 7.619 3.343 1.00 0.00 H new ATOM 0 HA2 GLY B -3 26.103 6.701 1.233 1.00 0.00 H new ATOM 0 HA3 GLY B -3 25.680 5.101 1.807 1.00 0.00 H new ATOM 266 N SER B -2 23.305 5.196 1.086 1.00 0.00 N ATOM 267 CA SER B -2 21.953 5.217 0.539 1.00 0.00 C ATOM 268 C SER B -2 20.913 5.089 1.648 1.00 0.00 C ATOM 269 O SER B -2 21.008 4.209 2.502 1.00 0.00 O ATOM 270 CB SER B -2 21.774 4.087 -0.477 1.00 0.00 C ATOM 271 OG SER B -2 22.695 4.210 -1.546 1.00 0.00 O ATOM 0 H SER B -2 23.657 4.264 1.304 1.00 0.00 H new ATOM 0 HA SER B -2 21.806 6.174 0.038 1.00 0.00 H new ATOM 0 HB2 SER B -2 21.912 3.125 0.017 1.00 0.00 H new ATOM 0 HB3 SER B -2 20.756 4.102 -0.867 1.00 0.00 H new ATOM 0 HG SER B -2 22.560 3.475 -2.180 1.00 0.00 H new ATOM 277 N HIS B -1 19.921 5.973 1.626 1.00 0.00 N ATOM 278 CA HIS B -1 18.862 5.961 2.628 1.00 0.00 C ATOM 279 C HIS B -1 17.529 5.559 2.005 1.00 0.00 C ATOM 280 O HIS B -1 16.750 4.819 2.607 1.00 0.00 O ATOM 281 CB HIS B -1 18.736 7.334 3.289 1.00 0.00 C ATOM 282 CG HIS B -1 19.984 7.781 3.985 1.00 0.00 C ATOM 283 ND1 HIS B -1 20.861 8.698 3.445 1.00 0.00 N ATOM 284 CD2 HIS B -1 20.500 7.433 5.187 1.00 0.00 C ATOM 285 CE1 HIS B -1 21.862 8.894 4.284 1.00 0.00 C ATOM 286 NE2 HIS B -1 21.667 8.140 5.349 1.00 0.00 N ATOM 0 H HIS B -1 19.829 6.707 0.924 1.00 0.00 H new ATOM 0 HA HIS B -1 19.125 5.225 3.388 1.00 0.00 H new ATOM 0 HB2 HIS B -1 18.470 8.070 2.530 1.00 0.00 H new ATOM 0 HB3 HIS B -1 17.918 7.308 4.009 1.00 0.00 H new ATOM 0 HD2 HIS B -1 20.074 6.731 5.888 1.00 0.00 H new ATOM 0 HE1 HIS B -1 22.698 9.559 4.125 1.00 0.00 H new ATOM 0 HE2 HIS B -1 22.283 8.090 6.161 1.00 0.00 H new ATOM 295 N MET B 0 17.272 6.054 0.799 1.00 0.00 N ATOM 296 CA MET B 0 16.034 5.748 0.094 1.00 0.00 C ATOM 297 C MET B 0 15.999 4.285 -0.337 1.00 0.00 C ATOM 298 O MET B 0 14.935 3.735 -0.619 1.00 0.00 O ATOM 299 CB MET B 0 15.880 6.655 -1.129 1.00 0.00 C ATOM 300 CG MET B 0 15.862 8.141 -0.797 1.00 0.00 C ATOM 301 SD MET B 0 14.399 8.637 0.139 1.00 0.00 S ATOM 302 CE MET B 0 14.955 8.376 1.822 1.00 0.00 C ATOM 0 H MET B 0 17.906 6.670 0.289 1.00 0.00 H new ATOM 0 HA MET B 0 15.204 5.927 0.777 1.00 0.00 H new ATOM 0 HB2 MET B 0 16.699 6.457 -1.821 1.00 0.00 H new ATOM 0 HB3 MET B 0 14.956 6.397 -1.646 1.00 0.00 H new ATOM 0 HG2 MET B 0 16.755 8.391 -0.224 1.00 0.00 H new ATOM 0 HG3 MET B 0 15.906 8.715 -1.723 1.00 0.00 H new ATOM 0 HE1 MET B 0 14.441 7.513 2.245 1.00 0.00 H new ATOM 0 HE2 MET B 0 16.030 8.196 1.826 1.00 0.00 H new ATOM 0 HE3 MET B 0 14.733 9.260 2.420 1.00 0.00 H new ATOM 312 N GLN B 1 17.174 3.662 -0.387 1.00 0.00 N ATOM 313 CA GLN B 1 17.279 2.263 -0.783 1.00 0.00 C ATOM 314 C GLN B 1 17.954 1.443 0.313 1.00 0.00 C ATOM 315 O GLN B 1 19.174 1.487 0.473 1.00 0.00 O ATOM 316 CB GLN B 1 18.062 2.143 -2.095 1.00 0.00 C ATOM 317 CG GLN B 1 17.996 0.767 -2.735 1.00 0.00 C ATOM 318 CD GLN B 1 18.893 -0.249 -2.054 1.00 0.00 C ATOM 319 OE1 GLN B 1 19.948 0.097 -1.522 1.00 0.00 O ATOM 320 NE2 GLN B 1 18.479 -1.510 -2.071 1.00 0.00 N ATOM 0 H GLN B 1 18.064 4.104 -0.158 1.00 0.00 H new ATOM 0 HA GLN B 1 16.274 1.870 -0.936 1.00 0.00 H new ATOM 0 HB2 GLN B 1 17.680 2.879 -2.802 1.00 0.00 H new ATOM 0 HB3 GLN B 1 19.106 2.394 -1.907 1.00 0.00 H new ATOM 0 HG2 GLN B 1 16.967 0.410 -2.709 1.00 0.00 H new ATOM 0 HG3 GLN B 1 18.279 0.847 -3.785 1.00 0.00 H new ATOM 0 HE21 GLN B 1 17.597 -1.751 -2.524 1.00 0.00 H new ATOM 0 HE22 GLN B 1 19.042 -2.238 -1.631 1.00 0.00 H new ATOM 329 N LYS B 2 17.149 0.705 1.073 1.00 0.00 N ATOM 330 CA LYS B 2 17.666 -0.125 2.155 1.00 0.00 C ATOM 331 C LYS B 2 16.809 -1.365 2.355 1.00 0.00 C ATOM 332 O LYS B 2 15.673 -1.419 1.883 1.00 0.00 O ATOM 333 CB LYS B 2 17.762 0.679 3.448 1.00 0.00 C ATOM 334 CG LYS B 2 18.967 1.601 3.486 1.00 0.00 C ATOM 335 CD LYS B 2 19.114 2.269 4.838 1.00 0.00 C ATOM 336 CE LYS B 2 19.480 1.267 5.920 1.00 0.00 C ATOM 337 NZ LYS B 2 19.646 1.920 7.249 1.00 0.00 N ATOM 0 H LYS B 2 16.136 0.666 0.959 1.00 0.00 H new ATOM 0 HA LYS B 2 18.667 -0.454 1.877 1.00 0.00 H new ATOM 0 HB2 LYS B 2 16.855 1.271 3.569 1.00 0.00 H new ATOM 0 HB3 LYS B 2 17.810 -0.007 4.293 1.00 0.00 H new ATOM 0 HG2 LYS B 2 19.869 1.032 3.260 1.00 0.00 H new ATOM 0 HG3 LYS B 2 18.868 2.362 2.712 1.00 0.00 H new ATOM 0 HD2 LYS B 2 19.881 3.041 4.782 1.00 0.00 H new ATOM 0 HD3 LYS B 2 18.181 2.766 5.102 1.00 0.00 H new ATOM 0 HE2 LYS B 2 18.705 0.504 5.985 1.00 0.00 H new ATOM 0 HE3 LYS B 2 20.405 0.759 5.647 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 19.895 1.203 7.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 20.403 2.631 7.194 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 18.756 2.383 7.522 1.00 0.00 H new ATOM 351 N PRO B 3 17.340 -2.377 3.069 1.00 0.00 N ATOM 352 CA PRO B 3 16.640 -3.637 3.322 1.00 0.00 C ATOM 353 C PRO B 3 15.269 -3.428 3.927 1.00 0.00 C ATOM 354 O PRO B 3 14.521 -4.378 4.122 1.00 0.00 O ATOM 355 CB PRO B 3 17.565 -4.371 4.301 1.00 0.00 C ATOM 356 CG PRO B 3 18.455 -3.317 4.848 1.00 0.00 C ATOM 357 CD PRO B 3 18.662 -2.386 3.705 1.00 0.00 C ATOM 0 HA PRO B 3 16.454 -4.191 2.402 1.00 0.00 H new ATOM 0 HB2 PRO B 3 16.996 -4.858 5.093 1.00 0.00 H new ATOM 0 HB3 PRO B 3 18.138 -5.149 3.796 1.00 0.00 H new ATOM 0 HG2 PRO B 3 17.997 -2.810 5.697 1.00 0.00 H new ATOM 0 HG3 PRO B 3 19.399 -3.735 5.198 1.00 0.00 H new ATOM 0 HD2 PRO B 3 18.960 -1.392 4.038 1.00 0.00 H new ATOM 0 HD3 PRO B 3 19.438 -2.741 3.026 1.00 0.00 H new ATOM 365 N VAL B 4 14.960 -2.180 4.236 1.00 0.00 N ATOM 366 CA VAL B 4 13.664 -1.829 4.804 1.00 0.00 C ATOM 367 C VAL B 4 13.243 -0.408 4.429 1.00 0.00 C ATOM 368 O VAL B 4 12.468 -0.210 3.498 1.00 0.00 O ATOM 369 CB VAL B 4 13.648 -1.956 6.340 1.00 0.00 C ATOM 370 CG1 VAL B 4 12.273 -1.592 6.869 1.00 0.00 C ATOM 371 CG2 VAL B 4 14.039 -3.359 6.780 1.00 0.00 C ATOM 0 H VAL B 4 15.590 -1.389 4.103 1.00 0.00 H new ATOM 0 HA VAL B 4 12.956 -2.541 4.379 1.00 0.00 H new ATOM 0 HB VAL B 4 14.383 -1.265 6.753 1.00 0.00 H new ATOM 0 HG11 VAL B 4 12.265 -1.683 7.955 1.00 0.00 H new ATOM 0 HG12 VAL B 4 12.035 -0.566 6.589 1.00 0.00 H new ATOM 0 HG13 VAL B 4 11.529 -2.266 6.443 1.00 0.00 H new ATOM 0 HG21 VAL B 4 14.019 -3.418 7.868 1.00 0.00 H new ATOM 0 HG22 VAL B 4 13.335 -4.080 6.364 1.00 0.00 H new ATOM 0 HG23 VAL B 4 15.044 -3.586 6.423 1.00 0.00 H new ATOM 381 N VAL B 5 13.768 0.573 5.160 1.00 0.00 N ATOM 382 CA VAL B 5 13.439 1.979 4.939 1.00 0.00 C ATOM 383 C VAL B 5 12.083 2.311 5.551 1.00 0.00 C ATOM 384 O VAL B 5 11.041 1.947 5.008 1.00 0.00 O ATOM 385 CB VAL B 5 13.414 2.364 3.446 1.00 0.00 C ATOM 386 CG1 VAL B 5 13.183 3.855 3.300 1.00 0.00 C ATOM 387 CG2 VAL B 5 14.702 1.950 2.754 1.00 0.00 C ATOM 0 H VAL B 5 14.431 0.416 5.919 1.00 0.00 H new ATOM 0 HA VAL B 5 14.229 2.554 5.421 1.00 0.00 H new ATOM 0 HB VAL B 5 12.593 1.832 2.965 1.00 0.00 H new ATOM 0 HG11 VAL B 5 13.167 4.119 2.243 1.00 0.00 H new ATOM 0 HG12 VAL B 5 12.229 4.122 3.755 1.00 0.00 H new ATOM 0 HG13 VAL B 5 13.987 4.398 3.797 1.00 0.00 H new ATOM 0 HG21 VAL B 5 14.657 2.233 1.702 1.00 0.00 H new ATOM 0 HG22 VAL B 5 15.547 2.449 3.229 1.00 0.00 H new ATOM 0 HG23 VAL B 5 14.827 0.870 2.834 1.00 0.00 H new ATOM 397 N THR B 6 12.103 3.003 6.683 1.00 0.00 N ATOM 398 CA THR B 6 10.876 3.373 7.370 1.00 0.00 C ATOM 399 C THR B 6 10.267 4.637 6.770 1.00 0.00 C ATOM 400 O THR B 6 10.972 5.467 6.196 1.00 0.00 O ATOM 401 CB THR B 6 11.124 3.598 8.873 1.00 0.00 C ATOM 402 OG1 THR B 6 12.319 2.921 9.279 1.00 0.00 O ATOM 403 CG2 THR B 6 9.949 3.088 9.688 1.00 0.00 C ATOM 0 H THR B 6 12.957 3.319 7.144 1.00 0.00 H new ATOM 0 HA THR B 6 10.179 2.545 7.243 1.00 0.00 H new ATOM 0 HB THR B 6 11.237 4.668 9.048 1.00 0.00 H new ATOM 0 HG1 THR B 6 12.471 3.070 10.236 1.00 0.00 H new ATOM 0 HG21 THR B 6 10.141 3.255 10.748 1.00 0.00 H new ATOM 0 HG22 THR B 6 9.044 3.621 9.395 1.00 0.00 H new ATOM 0 HG23 THR B 6 9.816 2.021 9.507 1.00 0.00 H new ATOM 411 N LEU B 7 8.951 4.771 6.908 1.00 0.00 N ATOM 412 CA LEU B 7 8.240 5.932 6.381 1.00 0.00 C ATOM 413 C LEU B 7 7.159 6.389 7.355 1.00 0.00 C ATOM 414 O LEU B 7 6.608 5.586 8.109 1.00 0.00 O ATOM 415 CB LEU B 7 7.614 5.595 5.024 1.00 0.00 C ATOM 416 CG LEU B 7 6.836 6.737 4.363 1.00 0.00 C ATOM 417 CD1 LEU B 7 7.755 7.913 4.069 1.00 0.00 C ATOM 418 CD2 LEU B 7 6.166 6.251 3.087 1.00 0.00 C ATOM 0 H LEU B 7 8.356 4.091 7.380 1.00 0.00 H new ATOM 0 HA LEU B 7 8.955 6.744 6.252 1.00 0.00 H new ATOM 0 HB2 LEU B 7 8.406 5.276 4.346 1.00 0.00 H new ATOM 0 HB3 LEU B 7 6.943 4.746 5.152 1.00 0.00 H new ATOM 0 HG LEU B 7 6.063 7.073 5.054 1.00 0.00 H new ATOM 0 HD11 LEU B 7 7.183 8.713 3.600 1.00 0.00 H new ATOM 0 HD12 LEU B 7 8.191 8.276 5.000 1.00 0.00 H new ATOM 0 HD13 LEU B 7 8.551 7.593 3.396 1.00 0.00 H new ATOM 0 HD21 LEU B 7 5.617 7.073 2.628 1.00 0.00 H new ATOM 0 HD22 LEU B 7 6.925 5.889 2.393 1.00 0.00 H new ATOM 0 HD23 LEU B 7 5.476 5.441 3.324 1.00 0.00 H new ATOM 430 N ASP B 8 6.861 7.685 7.339 1.00 0.00 N ATOM 431 CA ASP B 8 5.847 8.246 8.222 1.00 0.00 C ATOM 432 C ASP B 8 5.050 9.339 7.515 1.00 0.00 C ATOM 433 O ASP B 8 3.865 9.529 7.783 1.00 0.00 O ATOM 434 CB ASP B 8 6.496 8.810 9.486 1.00 0.00 C ATOM 435 CG ASP B 8 7.257 7.757 10.267 1.00 0.00 C ATOM 436 OD1 ASP B 8 8.467 7.584 10.008 1.00 0.00 O ATOM 437 OD2 ASP B 8 6.643 7.104 11.136 1.00 0.00 O ATOM 0 H ASP B 8 7.308 8.365 6.724 1.00 0.00 H new ATOM 0 HA ASP B 8 5.162 7.445 8.500 1.00 0.00 H new ATOM 0 HB2 ASP B 8 7.176 9.617 9.212 1.00 0.00 H new ATOM 0 HB3 ASP B 8 5.726 9.244 10.123 1.00 0.00 H new ATOM 442 N ASP B 9 5.712 10.055 6.610 1.00 0.00 N ATOM 443 CA ASP B 9 5.067 11.129 5.865 1.00 0.00 C ATOM 444 C ASP B 9 4.445 10.599 4.576 1.00 0.00 C ATOM 445 O ASP B 9 4.539 9.410 4.271 1.00 0.00 O ATOM 446 CB ASP B 9 6.077 12.230 5.540 1.00 0.00 C ATOM 447 CG ASP B 9 6.692 12.835 6.788 1.00 0.00 C ATOM 448 OD1 ASP B 9 7.739 12.324 7.242 1.00 0.00 O ATOM 449 OD2 ASP B 9 6.129 13.819 7.311 1.00 0.00 O ATOM 0 H ASP B 9 6.694 9.910 6.376 1.00 0.00 H new ATOM 0 HA ASP B 9 4.274 11.544 6.487 1.00 0.00 H new ATOM 0 HB2 ASP B 9 6.867 11.821 4.910 1.00 0.00 H new ATOM 0 HB3 ASP B 9 5.584 13.013 4.964 1.00 0.00 H new ATOM 454 N ALA B 10 3.805 11.490 3.822 1.00 0.00 N ATOM 455 CA ALA B 10 3.166 11.115 2.567 1.00 0.00 C ATOM 456 C ALA B 10 3.676 11.970 1.413 1.00 0.00 C ATOM 457 O ALA B 10 3.577 11.582 0.249 1.00 0.00 O ATOM 458 CB ALA B 10 1.655 11.236 2.688 1.00 0.00 C ATOM 0 H ALA B 10 3.716 12.478 4.061 1.00 0.00 H new ATOM 0 HA ALA B 10 3.421 10.077 2.355 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.191 10.953 1.743 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.299 10.576 3.479 1.00 0.00 H new ATOM 0 HB3 ALA B 10 1.391 12.266 2.928 1.00 0.00 H new ATOM 464 N ASP B 11 4.225 13.136 1.744 1.00 0.00 N ATOM 465 CA ASP B 11 4.753 14.047 0.735 1.00 0.00 C ATOM 466 C ASP B 11 6.125 13.587 0.254 1.00 0.00 C ATOM 467 O ASP B 11 6.604 14.022 -0.793 1.00 0.00 O ATOM 468 CB ASP B 11 4.844 15.465 1.300 1.00 0.00 C ATOM 469 CG ASP B 11 5.362 16.462 0.282 1.00 0.00 C ATOM 470 OD1 ASP B 11 6.594 16.661 0.221 1.00 0.00 O ATOM 471 OD2 ASP B 11 4.538 17.043 -0.453 1.00 0.00 O ATOM 0 H ASP B 11 4.315 13.471 2.703 1.00 0.00 H new ATOM 0 HA ASP B 11 4.072 14.046 -0.116 1.00 0.00 H new ATOM 0 HB2 ASP B 11 3.859 15.780 1.644 1.00 0.00 H new ATOM 0 HB3 ASP B 11 5.500 15.465 2.170 1.00 0.00 H new ATOM 476 N ASP B 12 6.751 12.704 1.025 1.00 0.00 N ATOM 477 CA ASP B 12 8.068 12.181 0.681 1.00 0.00 C ATOM 478 C ASP B 12 7.952 10.978 -0.248 1.00 0.00 C ATOM 479 O ASP B 12 8.935 10.282 -0.502 1.00 0.00 O ATOM 480 CB ASP B 12 8.830 11.792 1.949 1.00 0.00 C ATOM 481 CG ASP B 12 9.145 12.987 2.826 1.00 0.00 C ATOM 482 OD1 ASP B 12 8.297 13.344 3.670 1.00 0.00 O ATOM 483 OD2 ASP B 12 10.241 13.566 2.668 1.00 0.00 O ATOM 0 H ASP B 12 6.366 12.335 1.894 1.00 0.00 H new ATOM 0 HA ASP B 12 8.618 12.964 0.160 1.00 0.00 H new ATOM 0 HB2 ASP B 12 8.240 11.073 2.518 1.00 0.00 H new ATOM 0 HB3 ASP B 12 9.759 11.293 1.672 1.00 0.00 H new ATOM 488 N CYS B 13 6.747 10.738 -0.754 1.00 0.00 N ATOM 489 CA CYS B 13 6.506 9.616 -1.655 1.00 0.00 C ATOM 490 C CYS B 13 6.629 10.040 -3.113 1.00 0.00 C ATOM 491 O CYS B 13 6.396 11.200 -3.457 1.00 0.00 O ATOM 492 CB CYS B 13 5.121 9.016 -1.400 1.00 0.00 C ATOM 493 SG CYS B 13 5.036 7.951 0.074 1.00 0.00 S ATOM 0 H CYS B 13 5.922 11.305 -0.556 1.00 0.00 H new ATOM 0 HA CYS B 13 7.266 8.860 -1.456 1.00 0.00 H new ATOM 0 HB2 CYS B 13 4.400 9.826 -1.293 1.00 0.00 H new ATOM 0 HB3 CYS B 13 4.821 8.436 -2.273 1.00 0.00 H new ATOM 498 N SER B 14 6.996 9.087 -3.962 1.00 0.00 N ATOM 499 CA SER B 14 7.160 9.341 -5.389 1.00 0.00 C ATOM 500 C SER B 14 7.441 8.037 -6.129 1.00 0.00 C ATOM 501 O SER B 14 8.020 7.114 -5.557 1.00 0.00 O ATOM 502 CB SER B 14 8.306 10.322 -5.620 1.00 0.00 C ATOM 503 OG SER B 14 8.350 10.756 -6.969 1.00 0.00 O ATOM 0 H SER B 14 7.187 8.124 -3.684 1.00 0.00 H new ATOM 0 HA SER B 14 6.236 9.774 -5.773 1.00 0.00 H new ATOM 0 HB2 SER B 14 8.188 11.183 -4.963 1.00 0.00 H new ATOM 0 HB3 SER B 14 9.252 9.848 -5.357 1.00 0.00 H new ATOM 0 HG SER B 14 9.093 11.385 -7.086 1.00 0.00 H new ATOM 509 N PRO B 15 7.031 7.933 -7.408 1.00 0.00 N ATOM 510 CA PRO B 15 7.262 6.726 -8.206 1.00 0.00 C ATOM 511 C PRO B 15 8.740 6.358 -8.262 1.00 0.00 C ATOM 512 O PRO B 15 9.458 6.747 -9.183 1.00 0.00 O ATOM 513 CB PRO B 15 6.758 7.103 -9.599 1.00 0.00 C ATOM 514 CG PRO B 15 5.807 8.229 -9.374 1.00 0.00 C ATOM 515 CD PRO B 15 6.314 8.972 -8.170 1.00 0.00 C ATOM 0 HA PRO B 15 6.757 5.858 -7.783 1.00 0.00 H new ATOM 0 HB2 PRO B 15 7.580 7.405 -10.248 1.00 0.00 H new ATOM 0 HB3 PRO B 15 6.264 6.260 -10.082 1.00 0.00 H new ATOM 0 HG2 PRO B 15 5.764 8.883 -10.245 1.00 0.00 H new ATOM 0 HG3 PRO B 15 4.796 7.857 -9.205 1.00 0.00 H new ATOM 0 HD2 PRO B 15 6.974 9.792 -8.452 1.00 0.00 H new ATOM 0 HD3 PRO B 15 5.498 9.405 -7.591 1.00 0.00 H new ATOM 523 N LEU B 16 9.183 5.615 -7.261 1.00 0.00 N ATOM 524 CA LEU B 16 10.569 5.194 -7.164 1.00 0.00 C ATOM 525 C LEU B 16 10.749 3.752 -7.629 1.00 0.00 C ATOM 526 O LEU B 16 9.828 2.942 -7.543 1.00 0.00 O ATOM 527 CB LEU B 16 11.052 5.335 -5.721 1.00 0.00 C ATOM 528 CG LEU B 16 12.492 4.896 -5.474 1.00 0.00 C ATOM 529 CD1 LEU B 16 13.443 5.710 -6.334 1.00 0.00 C ATOM 530 CD2 LEU B 16 12.843 5.034 -4.001 1.00 0.00 C ATOM 0 H LEU B 16 8.593 5.288 -6.496 1.00 0.00 H new ATOM 0 HA LEU B 16 11.162 5.835 -7.816 1.00 0.00 H new ATOM 0 HB2 LEU B 16 10.950 6.378 -5.420 1.00 0.00 H new ATOM 0 HB3 LEU B 16 10.395 4.752 -5.076 1.00 0.00 H new ATOM 0 HG LEU B 16 12.592 3.846 -5.750 1.00 0.00 H new ATOM 0 HD11 LEU B 16 14.468 5.387 -6.149 1.00 0.00 H new ATOM 0 HD12 LEU B 16 13.200 5.561 -7.386 1.00 0.00 H new ATOM 0 HD13 LEU B 16 13.345 6.767 -6.085 1.00 0.00 H new ATOM 0 HD21 LEU B 16 13.874 4.717 -3.841 1.00 0.00 H new ATOM 0 HD22 LEU B 16 12.732 6.075 -3.697 1.00 0.00 H new ATOM 0 HD23 LEU B 16 12.175 4.409 -3.408 1.00 0.00 H new ATOM 542 N LYS B 17 11.945 3.444 -8.123 1.00 0.00 N ATOM 543 CA LYS B 17 12.259 2.100 -8.594 1.00 0.00 C ATOM 544 C LYS B 17 13.084 1.345 -7.557 1.00 0.00 C ATOM 545 O LYS B 17 14.310 1.460 -7.520 1.00 0.00 O ATOM 546 CB LYS B 17 13.015 2.166 -9.919 1.00 0.00 C ATOM 547 CG LYS B 17 12.157 2.647 -11.076 1.00 0.00 C ATOM 548 CD LYS B 17 12.962 3.483 -12.053 1.00 0.00 C ATOM 549 CE LYS B 17 12.058 4.187 -13.048 1.00 0.00 C ATOM 550 NZ LYS B 17 11.302 5.303 -12.417 1.00 0.00 N ATOM 0 H LYS B 17 12.714 4.109 -8.207 1.00 0.00 H new ATOM 0 HA LYS B 17 11.323 1.564 -8.748 1.00 0.00 H new ATOM 0 HB2 LYS B 17 13.871 2.832 -9.809 1.00 0.00 H new ATOM 0 HB3 LYS B 17 13.409 1.177 -10.154 1.00 0.00 H new ATOM 0 HG2 LYS B 17 11.730 1.789 -11.595 1.00 0.00 H new ATOM 0 HG3 LYS B 17 11.323 3.235 -10.693 1.00 0.00 H new ATOM 0 HD2 LYS B 17 13.550 4.221 -11.506 1.00 0.00 H new ATOM 0 HD3 LYS B 17 13.667 2.845 -12.586 1.00 0.00 H new ATOM 0 HE2 LYS B 17 12.657 4.574 -13.872 1.00 0.00 H new ATOM 0 HE3 LYS B 17 11.357 3.469 -13.474 1.00 0.00 H new ATOM 0 HZ1 LYS B 17 10.885 5.902 -13.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 17 10.545 4.915 -11.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 17 11.947 5.873 -11.833 1.00 0.00 H new ATOM 564 N LEU B 18 12.401 0.579 -6.715 1.00 0.00 N ATOM 565 CA LEU B 18 13.060 -0.199 -5.675 1.00 0.00 C ATOM 566 C LEU B 18 13.902 -1.319 -6.277 1.00 0.00 C ATOM 567 O LEU B 18 14.138 -1.353 -7.484 1.00 0.00 O ATOM 568 CB LEU B 18 12.019 -0.786 -4.718 1.00 0.00 C ATOM 569 CG LEU B 18 11.533 0.151 -3.623 1.00 0.00 C ATOM 570 CD1 LEU B 18 10.978 1.440 -4.209 1.00 0.00 C ATOM 571 CD2 LEU B 18 10.490 -0.540 -2.759 1.00 0.00 C ATOM 0 H LEU B 18 11.386 0.480 -6.733 1.00 0.00 H new ATOM 0 HA LEU B 18 13.723 0.467 -5.123 1.00 0.00 H new ATOM 0 HB2 LEU B 18 11.158 -1.112 -5.301 1.00 0.00 H new ATOM 0 HB3 LEU B 18 12.442 -1.675 -4.250 1.00 0.00 H new ATOM 0 HG LEU B 18 12.386 0.411 -2.997 1.00 0.00 H new ATOM 0 HD11 LEU B 18 10.638 2.090 -3.402 1.00 0.00 H new ATOM 0 HD12 LEU B 18 11.757 1.946 -4.779 1.00 0.00 H new ATOM 0 HD13 LEU B 18 10.140 1.209 -4.866 1.00 0.00 H new ATOM 0 HD21 LEU B 18 10.152 0.143 -1.980 1.00 0.00 H new ATOM 0 HD22 LEU B 18 9.642 -0.833 -3.377 1.00 0.00 H new ATOM 0 HD23 LEU B 18 10.928 -1.426 -2.299 1.00 0.00 H new ATOM 583 N THR B 19 14.353 -2.233 -5.424 1.00 0.00 N ATOM 584 CA THR B 19 15.169 -3.354 -5.867 1.00 0.00 C ATOM 585 C THR B 19 14.717 -4.651 -5.208 1.00 0.00 C ATOM 586 O THR B 19 14.288 -4.661 -4.054 1.00 0.00 O ATOM 587 CB THR B 19 16.659 -3.123 -5.552 1.00 0.00 C ATOM 588 OG1 THR B 19 17.080 -1.857 -6.073 1.00 0.00 O ATOM 589 CG2 THR B 19 17.518 -4.230 -6.148 1.00 0.00 C ATOM 0 H THR B 19 14.166 -2.218 -4.421 1.00 0.00 H new ATOM 0 HA THR B 19 15.043 -3.433 -6.947 1.00 0.00 H new ATOM 0 HB THR B 19 16.782 -3.131 -4.469 1.00 0.00 H new ATOM 0 HG1 THR B 19 18.028 -1.717 -5.867 1.00 0.00 H new ATOM 0 HG21 THR B 19 18.566 -4.044 -5.912 1.00 0.00 H new ATOM 0 HG22 THR B 19 17.216 -5.190 -5.729 1.00 0.00 H new ATOM 0 HG23 THR B 19 17.388 -4.249 -7.230 1.00 0.00 H new ATOM 597 N GLN B 20 14.815 -5.745 -5.953 1.00 0.00 N ATOM 598 CA GLN B 20 14.420 -7.055 -5.452 1.00 0.00 C ATOM 599 C GLN B 20 15.443 -7.586 -4.452 1.00 0.00 C ATOM 600 O GLN B 20 16.481 -8.125 -4.837 1.00 0.00 O ATOM 601 CB GLN B 20 14.262 -8.041 -6.612 1.00 0.00 C ATOM 602 CG GLN B 20 13.175 -7.645 -7.598 1.00 0.00 C ATOM 603 CD GLN B 20 13.280 -8.393 -8.913 1.00 0.00 C ATOM 604 OE1 GLN B 20 12.152 -8.565 -9.589 1.00 0.00 O flip ATOM 605 NE2 GLN B 20 14.367 -8.803 -9.321 1.00 0.00 N flip ATOM 0 H GLN B 20 15.166 -5.750 -6.911 1.00 0.00 H new ATOM 0 HA GLN B 20 13.462 -6.949 -4.942 1.00 0.00 H new ATOM 0 HB2 GLN B 20 15.211 -8.122 -7.142 1.00 0.00 H new ATOM 0 HB3 GLN B 20 14.036 -9.029 -6.211 1.00 0.00 H new ATOM 0 HG2 GLN B 20 12.199 -7.836 -7.153 1.00 0.00 H new ATOM 0 HG3 GLN B 20 13.235 -6.573 -7.788 1.00 0.00 H new ATOM 0 HE21 GLN B 20 15.210 -8.649 -8.768 1.00 0.00 H new ATOM 0 HE22 GLN B 20 14.424 -9.297 -10.212 1.00 0.00 H new ATOM 614 N GLY B 21 15.146 -7.420 -3.168 1.00 0.00 N ATOM 615 CA GLY B 21 16.048 -7.887 -2.130 1.00 0.00 C ATOM 616 C GLY B 21 15.901 -7.103 -0.841 1.00 0.00 C ATOM 617 O GLY B 21 16.303 -7.569 0.226 1.00 0.00 O ATOM 0 H GLY B 21 14.297 -6.970 -2.827 1.00 0.00 H new ATOM 0 HA2 GLY B 21 15.857 -8.942 -1.934 1.00 0.00 H new ATOM 0 HA3 GLY B 21 17.076 -7.810 -2.484 1.00 0.00 H new ATOM 621 N GLN B 22 15.319 -5.910 -0.938 1.00 0.00 N ATOM 622 CA GLN B 22 15.117 -5.060 0.227 1.00 0.00 C ATOM 623 C GLN B 22 13.688 -5.180 0.741 1.00 0.00 C ATOM 624 O GLN B 22 12.941 -6.067 0.324 1.00 0.00 O ATOM 625 CB GLN B 22 15.422 -3.604 -0.123 1.00 0.00 C ATOM 626 CG GLN B 22 14.661 -3.092 -1.335 1.00 0.00 C ATOM 627 CD GLN B 22 14.806 -1.595 -1.528 1.00 0.00 C ATOM 628 OE1 GLN B 22 15.940 -1.048 -1.104 1.00 0.00 O flip ATOM 629 NE2 GLN B 22 13.908 -0.937 -2.052 1.00 0.00 N flip ATOM 0 H GLN B 22 14.979 -5.512 -1.814 1.00 0.00 H new ATOM 0 HA GLN B 22 15.798 -5.389 1.012 1.00 0.00 H new ATOM 0 HB2 GLN B 22 15.184 -2.976 0.736 1.00 0.00 H new ATOM 0 HB3 GLN B 22 16.491 -3.501 -0.307 1.00 0.00 H new ATOM 0 HG2 GLN B 22 15.019 -3.606 -2.227 1.00 0.00 H new ATOM 0 HG3 GLN B 22 13.605 -3.340 -1.227 1.00 0.00 H new ATOM 0 HE21 GLN B 22 13.053 -1.398 -2.363 1.00 0.00 H new ATOM 0 HE22 GLN B 22 14.019 0.069 -2.175 1.00 0.00 H new ATOM 638 N GLU B 23 13.308 -4.285 1.652 1.00 0.00 N ATOM 639 CA GLU B 23 11.955 -4.308 2.220 1.00 0.00 C ATOM 640 C GLU B 23 11.459 -2.901 2.518 1.00 0.00 C ATOM 641 O GLU B 23 11.932 -1.928 1.933 1.00 0.00 O ATOM 642 CB GLU B 23 11.916 -5.136 3.509 1.00 0.00 C ATOM 643 CG GLU B 23 12.565 -6.503 3.386 1.00 0.00 C ATOM 644 CD GLU B 23 12.658 -7.228 4.714 1.00 0.00 C ATOM 645 OE1 GLU B 23 11.709 -7.966 5.053 1.00 0.00 O ATOM 646 OE2 GLU B 23 13.679 -7.060 5.412 1.00 0.00 O ATOM 0 H GLU B 23 13.908 -3.542 2.011 1.00 0.00 H new ATOM 0 HA GLU B 23 11.302 -4.766 1.477 1.00 0.00 H new ATOM 0 HB2 GLU B 23 12.415 -4.579 4.302 1.00 0.00 H new ATOM 0 HB3 GLU B 23 10.878 -5.265 3.815 1.00 0.00 H new ATOM 0 HG2 GLU B 23 11.993 -7.110 2.684 1.00 0.00 H new ATOM 0 HG3 GLU B 23 13.565 -6.390 2.968 1.00 0.00 H new ATOM 653 N LEU B 24 10.483 -2.814 3.423 1.00 0.00 N ATOM 654 CA LEU B 24 9.911 -1.536 3.837 1.00 0.00 C ATOM 655 C LEU B 24 8.854 -1.746 4.915 1.00 0.00 C ATOM 656 O LEU B 24 8.065 -2.689 4.850 1.00 0.00 O ATOM 657 CB LEU B 24 9.302 -0.800 2.641 1.00 0.00 C ATOM 658 CG LEU B 24 8.929 0.660 2.906 1.00 0.00 C ATOM 659 CD1 LEU B 24 9.058 1.483 1.634 1.00 0.00 C ATOM 660 CD2 LEU B 24 7.522 0.764 3.474 1.00 0.00 C ATOM 0 H LEU B 24 10.070 -3.624 3.886 1.00 0.00 H new ATOM 0 HA LEU B 24 10.715 -0.925 4.248 1.00 0.00 H new ATOM 0 HB2 LEU B 24 10.010 -0.835 1.813 1.00 0.00 H new ATOM 0 HB3 LEU B 24 8.409 -1.336 2.320 1.00 0.00 H new ATOM 0 HG LEU B 24 9.622 1.061 3.646 1.00 0.00 H new ATOM 0 HD11 LEU B 24 8.789 2.519 1.842 1.00 0.00 H new ATOM 0 HD12 LEU B 24 10.087 1.440 1.276 1.00 0.00 H new ATOM 0 HD13 LEU B 24 8.391 1.081 0.871 1.00 0.00 H new ATOM 0 HD21 LEU B 24 7.279 1.811 3.654 1.00 0.00 H new ATOM 0 HD22 LEU B 24 6.811 0.344 2.763 1.00 0.00 H new ATOM 0 HD23 LEU B 24 7.467 0.212 4.412 1.00 0.00 H new ATOM 672 N VAL B 25 8.847 -0.865 5.912 1.00 0.00 N ATOM 673 CA VAL B 25 7.888 -0.959 7.008 1.00 0.00 C ATOM 674 C VAL B 25 7.238 0.390 7.297 1.00 0.00 C ATOM 675 O VAL B 25 7.892 1.432 7.236 1.00 0.00 O ATOM 676 CB VAL B 25 8.559 -1.482 8.296 1.00 0.00 C ATOM 677 CG1 VAL B 25 7.552 -1.563 9.434 1.00 0.00 C ATOM 678 CG2 VAL B 25 9.203 -2.838 8.049 1.00 0.00 C ATOM 0 H VAL B 25 9.494 -0.079 5.983 1.00 0.00 H new ATOM 0 HA VAL B 25 7.119 -1.664 6.693 1.00 0.00 H new ATOM 0 HB VAL B 25 9.340 -0.779 8.585 1.00 0.00 H new ATOM 0 HG11 VAL B 25 8.047 -1.934 10.332 1.00 0.00 H new ATOM 0 HG12 VAL B 25 7.142 -0.572 9.629 1.00 0.00 H new ATOM 0 HG13 VAL B 25 6.745 -2.241 9.158 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.671 -3.191 8.968 1.00 0.00 H new ATOM 0 HG22 VAL B 25 8.441 -3.550 7.733 1.00 0.00 H new ATOM 0 HG23 VAL B 25 9.959 -2.745 7.269 1.00 0.00 H new ATOM 688 N LEU B 26 5.947 0.361 7.609 1.00 0.00 N ATOM 689 CA LEU B 26 5.201 1.578 7.913 1.00 0.00 C ATOM 690 C LEU B 26 4.660 1.537 9.338 1.00 0.00 C ATOM 691 O LEU B 26 4.181 0.499 9.799 1.00 0.00 O ATOM 692 CB LEU B 26 4.048 1.754 6.920 1.00 0.00 C ATOM 693 CG LEU B 26 3.185 3.002 7.137 1.00 0.00 C ATOM 694 CD1 LEU B 26 4.011 4.264 6.946 1.00 0.00 C ATOM 695 CD2 LEU B 26 1.993 2.993 6.194 1.00 0.00 C ATOM 0 H LEU B 26 5.393 -0.494 7.658 1.00 0.00 H new ATOM 0 HA LEU B 26 5.879 2.427 7.824 1.00 0.00 H new ATOM 0 HB2 LEU B 26 4.460 1.788 5.911 1.00 0.00 H new ATOM 0 HB3 LEU B 26 3.406 0.874 6.973 1.00 0.00 H new ATOM 0 HG LEU B 26 2.813 2.991 8.162 1.00 0.00 H new ATOM 0 HD11 LEU B 26 3.381 5.139 7.104 1.00 0.00 H new ATOM 0 HD12 LEU B 26 4.832 4.274 7.663 1.00 0.00 H new ATOM 0 HD13 LEU B 26 4.414 4.285 5.933 1.00 0.00 H new ATOM 0 HD21 LEU B 26 1.390 3.886 6.361 1.00 0.00 H new ATOM 0 HD22 LEU B 26 2.345 2.980 5.163 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.387 2.106 6.381 1.00 0.00 H new ATOM 707 N THR B 27 4.740 2.667 10.034 1.00 0.00 N ATOM 708 CA THR B 27 4.259 2.753 11.409 1.00 0.00 C ATOM 709 C THR B 27 3.468 4.036 11.640 1.00 0.00 C ATOM 710 O THR B 27 4.019 5.134 11.588 1.00 0.00 O ATOM 711 CB THR B 27 5.425 2.692 12.415 1.00 0.00 C ATOM 712 OG1 THR B 27 6.186 1.497 12.210 1.00 0.00 O ATOM 713 CG2 THR B 27 4.909 2.730 13.846 1.00 0.00 C ATOM 0 H THR B 27 5.133 3.535 9.669 1.00 0.00 H new ATOM 0 HA THR B 27 3.604 1.896 11.568 1.00 0.00 H new ATOM 0 HB THR B 27 6.062 3.562 12.252 1.00 0.00 H new ATOM 0 HG1 THR B 27 6.926 1.466 12.852 1.00 0.00 H new ATOM 0 HG21 THR B 27 5.750 2.686 14.537 1.00 0.00 H new ATOM 0 HG22 THR B 27 4.354 3.654 14.008 1.00 0.00 H new ATOM 0 HG23 THR B 27 4.252 1.877 14.019 1.00 0.00 H new ATOM 721 N LEU B 28 2.172 3.886 11.897 1.00 0.00 N ATOM 722 CA LEU B 28 1.298 5.029 12.141 1.00 0.00 C ATOM 723 C LEU B 28 0.235 4.686 13.182 1.00 0.00 C ATOM 724 O LEU B 28 -0.164 3.528 13.309 1.00 0.00 O ATOM 725 CB LEU B 28 0.626 5.472 10.838 1.00 0.00 C ATOM 726 CG LEU B 28 1.575 5.996 9.759 1.00 0.00 C ATOM 727 CD1 LEU B 28 0.821 6.236 8.460 1.00 0.00 C ATOM 728 CD2 LEU B 28 2.258 7.275 10.221 1.00 0.00 C ATOM 0 H LEU B 28 1.703 2.981 11.942 1.00 0.00 H new ATOM 0 HA LEU B 28 1.908 5.847 12.524 1.00 0.00 H new ATOM 0 HB2 LEU B 28 0.069 4.628 10.430 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -0.100 6.251 11.070 1.00 0.00 H new ATOM 0 HG LEU B 28 2.342 5.242 9.581 1.00 0.00 H new ATOM 0 HD11 LEU B 28 1.511 6.609 7.703 1.00 0.00 H new ATOM 0 HD12 LEU B 28 0.378 5.301 8.118 1.00 0.00 H new ATOM 0 HD13 LEU B 28 0.034 6.971 8.627 1.00 0.00 H new ATOM 0 HD21 LEU B 28 2.929 7.632 9.440 1.00 0.00 H new ATOM 0 HD22 LEU B 28 1.505 8.035 10.428 1.00 0.00 H new ATOM 0 HD23 LEU B 28 2.830 7.075 11.127 1.00 0.00 H new ATOM 740 N PRO B 29 -0.239 5.688 13.947 1.00 0.00 N ATOM 741 CA PRO B 29 -1.263 5.480 14.978 1.00 0.00 C ATOM 742 C PRO B 29 -2.513 4.809 14.416 1.00 0.00 C ATOM 743 O PRO B 29 -3.029 5.214 13.374 1.00 0.00 O ATOM 744 CB PRO B 29 -1.589 6.897 15.455 1.00 0.00 C ATOM 745 CG PRO B 29 -0.376 7.699 15.127 1.00 0.00 C ATOM 746 CD PRO B 29 0.184 7.099 13.868 1.00 0.00 C ATOM 0 HA PRO B 29 -0.912 4.822 15.773 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -2.471 7.291 14.951 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -1.798 6.916 16.525 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -0.629 8.749 14.981 1.00 0.00 H new ATOM 0 HG3 PRO B 29 0.352 7.657 15.937 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -0.212 7.588 12.978 1.00 0.00 H new ATOM 0 HD3 PRO B 29 1.269 7.192 13.826 1.00 0.00 H new ATOM 754 N SER B 30 -2.998 3.782 15.111 1.00 0.00 N ATOM 755 CA SER B 30 -4.183 3.059 14.665 1.00 0.00 C ATOM 756 C SER B 30 -5.062 2.642 15.838 1.00 0.00 C ATOM 757 O SER B 30 -6.278 2.512 15.690 1.00 0.00 O ATOM 758 CB SER B 30 -3.777 1.825 13.859 1.00 0.00 C ATOM 759 OG SER B 30 -2.887 1.005 14.594 1.00 0.00 O ATOM 0 H SER B 30 -2.591 3.435 15.979 1.00 0.00 H new ATOM 0 HA SER B 30 -4.761 3.733 14.033 1.00 0.00 H new ATOM 0 HB2 SER B 30 -4.666 1.253 13.591 1.00 0.00 H new ATOM 0 HB3 SER B 30 -3.305 2.135 12.927 1.00 0.00 H new ATOM 0 HG SER B 30 -3.399 0.352 15.115 1.00 0.00 H new ATOM 765 N ASN B 31 -4.455 2.431 17.002 1.00 0.00 N ATOM 766 CA ASN B 31 -5.215 2.022 18.180 1.00 0.00 C ATOM 767 C ASN B 31 -4.889 2.865 19.418 1.00 0.00 C ATOM 768 O ASN B 31 -4.712 2.320 20.506 1.00 0.00 O ATOM 769 CB ASN B 31 -4.959 0.544 18.481 1.00 0.00 C ATOM 770 CG ASN B 31 -5.418 -0.366 17.357 1.00 0.00 C ATOM 771 OD1 ASN B 31 -6.377 -0.060 16.650 1.00 0.00 O ATOM 772 ND2 ASN B 31 -4.732 -1.490 17.189 1.00 0.00 N ATOM 0 H ASN B 31 -3.452 2.535 17.155 1.00 0.00 H new ATOM 0 HA ASN B 31 -6.268 2.181 17.949 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -3.894 0.391 18.656 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -5.476 0.269 19.401 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -4.994 -2.141 16.449 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -3.943 -1.702 17.800 1.00 0.00 H new ATOM 779 N PRO B 32 -4.808 4.206 19.283 1.00 0.00 N ATOM 780 CA PRO B 32 -4.529 5.086 20.421 1.00 0.00 C ATOM 781 C PRO B 32 -5.553 4.887 21.532 1.00 0.00 C ATOM 782 O PRO B 32 -5.219 4.903 22.717 1.00 0.00 O ATOM 783 CB PRO B 32 -4.646 6.496 19.838 1.00 0.00 C ATOM 784 CG PRO B 32 -4.447 6.329 18.371 1.00 0.00 C ATOM 785 CD PRO B 32 -4.972 4.963 18.029 1.00 0.00 C ATOM 0 HA PRO B 32 -3.554 4.888 20.866 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -5.621 6.933 20.056 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -3.896 7.162 20.264 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -4.980 7.101 17.816 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -3.393 6.418 18.109 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -6.016 5.001 17.717 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -4.411 4.511 17.211 1.00 0.00 H new ATOM 793 N THR B 33 -6.805 4.700 21.126 1.00 0.00 N ATOM 794 CA THR B 33 -7.902 4.486 22.061 1.00 0.00 C ATOM 795 C THR B 33 -8.901 3.486 21.487 1.00 0.00 C ATOM 796 O THR B 33 -9.991 3.303 22.029 1.00 0.00 O ATOM 797 CB THR B 33 -8.638 5.801 22.382 1.00 0.00 C ATOM 798 OG1 THR B 33 -9.121 6.402 21.177 1.00 0.00 O ATOM 799 CG2 THR B 33 -7.719 6.774 23.106 1.00 0.00 C ATOM 0 H THR B 33 -7.086 4.693 20.145 1.00 0.00 H new ATOM 0 HA THR B 33 -7.470 4.094 22.982 1.00 0.00 H new ATOM 0 HB THR B 33 -9.481 5.568 23.033 1.00 0.00 H new ATOM 0 HG1 THR B 33 -9.589 7.236 21.392 1.00 0.00 H new ATOM 0 HG21 THR B 33 -8.261 7.695 23.322 1.00 0.00 H new ATOM 0 HG22 THR B 33 -7.378 6.326 24.040 1.00 0.00 H new ATOM 0 HG23 THR B 33 -6.858 6.999 22.476 1.00 0.00 H new ATOM 807 N THR B 34 -8.507 2.848 20.383 1.00 0.00 N ATOM 808 CA THR B 34 -9.337 1.856 19.698 1.00 0.00 C ATOM 809 C THR B 34 -10.660 2.450 19.224 1.00 0.00 C ATOM 810 O THR B 34 -11.192 3.384 19.824 1.00 0.00 O ATOM 811 CB THR B 34 -9.621 0.625 20.582 1.00 0.00 C ATOM 812 OG1 THR B 34 -10.490 0.973 21.666 1.00 0.00 O ATOM 813 CG2 THR B 34 -8.326 0.046 21.128 1.00 0.00 C ATOM 0 H THR B 34 -7.602 3.005 19.939 1.00 0.00 H new ATOM 0 HA THR B 34 -8.761 1.537 18.829 1.00 0.00 H new ATOM 0 HB THR B 34 -10.110 -0.127 19.964 1.00 0.00 H new ATOM 0 HG1 THR B 34 -10.672 1.936 21.643 1.00 0.00 H new ATOM 0 HG21 THR B 34 -8.549 -0.822 21.749 1.00 0.00 H new ATOM 0 HG22 THR B 34 -7.685 -0.256 20.300 1.00 0.00 H new ATOM 0 HG23 THR B 34 -7.815 0.799 21.727 1.00 0.00 H new ATOM 821 N GLY B 35 -11.184 1.896 18.134 1.00 0.00 N ATOM 822 CA GLY B 35 -12.438 2.374 17.585 1.00 0.00 C ATOM 823 C GLY B 35 -12.318 2.735 16.118 1.00 0.00 C ATOM 824 O GLY B 35 -13.320 2.823 15.409 1.00 0.00 O ATOM 0 H GLY B 35 -10.760 1.123 17.621 1.00 0.00 H new ATOM 0 HA2 GLY B 35 -13.203 1.607 17.708 1.00 0.00 H new ATOM 0 HA3 GLY B 35 -12.770 3.247 18.147 1.00 0.00 H new ATOM 828 N PHE B 36 -11.086 2.944 15.664 1.00 0.00 N ATOM 829 CA PHE B 36 -10.828 3.297 14.279 1.00 0.00 C ATOM 830 C PHE B 36 -9.546 2.638 13.781 1.00 0.00 C ATOM 831 O PHE B 36 -8.455 2.934 14.271 1.00 0.00 O ATOM 832 CB PHE B 36 -10.718 4.810 14.145 1.00 0.00 C ATOM 833 CG PHE B 36 -12.034 5.494 13.904 1.00 0.00 C ATOM 834 CD1 PHE B 36 -12.798 5.947 14.969 1.00 0.00 C ATOM 835 CD2 PHE B 36 -12.503 5.688 12.616 1.00 0.00 C ATOM 836 CE1 PHE B 36 -14.008 6.577 14.752 1.00 0.00 C ATOM 837 CE2 PHE B 36 -13.713 6.318 12.392 1.00 0.00 C ATOM 838 CZ PHE B 36 -14.466 6.763 13.462 1.00 0.00 C ATOM 0 H PHE B 36 -10.249 2.874 16.242 1.00 0.00 H new ATOM 0 HA PHE B 36 -11.658 2.938 13.671 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -10.270 5.214 15.053 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -10.041 5.045 13.323 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -12.443 5.806 15.979 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -11.917 5.343 11.777 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -14.595 6.924 15.590 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -14.069 6.462 11.383 1.00 0.00 H new ATOM 0 HZ PHE B 36 -15.412 7.256 13.290 1.00 0.00 H new ATOM 848 N ARG B 37 -9.683 1.742 12.810 1.00 0.00 N ATOM 849 CA ARG B 37 -8.534 1.044 12.242 1.00 0.00 C ATOM 850 C ARG B 37 -8.223 1.536 10.835 1.00 0.00 C ATOM 851 O ARG B 37 -8.741 2.559 10.394 1.00 0.00 O ATOM 852 CB ARG B 37 -8.788 -0.460 12.202 1.00 0.00 C ATOM 853 CG ARG B 37 -8.509 -1.168 13.519 1.00 0.00 C ATOM 854 CD ARG B 37 -7.026 -1.169 13.849 1.00 0.00 C ATOM 855 NE ARG B 37 -6.237 -1.854 12.829 1.00 0.00 N ATOM 856 CZ ARG B 37 -4.944 -2.136 12.962 1.00 0.00 C ATOM 857 NH1 ARG B 37 -4.297 -1.797 14.068 1.00 0.00 N ATOM 858 NH2 ARG B 37 -4.298 -2.761 11.987 1.00 0.00 N ATOM 0 H ARG B 37 -10.579 1.481 12.399 1.00 0.00 H new ATOM 0 HA ARG B 37 -7.678 1.255 12.883 1.00 0.00 H new ATOM 0 HB2 ARG B 37 -9.826 -0.636 11.919 1.00 0.00 H new ATOM 0 HB3 ARG B 37 -8.166 -0.903 11.424 1.00 0.00 H new ATOM 0 HG2 ARG B 37 -9.061 -0.677 14.321 1.00 0.00 H new ATOM 0 HG3 ARG B 37 -8.871 -2.195 13.465 1.00 0.00 H new ATOM 0 HD2 ARG B 37 -6.676 -0.141 13.948 1.00 0.00 H new ATOM 0 HD3 ARG B 37 -6.870 -1.653 14.813 1.00 0.00 H new ATOM 0 HE ARG B 37 -6.704 -2.132 11.966 1.00 0.00 H new ATOM 0 HH11 ARG B 37 -4.791 -1.318 14.821 1.00 0.00 H new ATOM 0 HH12 ARG B 37 -3.305 -2.015 14.166 1.00 0.00 H new ATOM 0 HH21 ARG B 37 -4.793 -3.025 11.135 1.00 0.00 H new ATOM 0 HH22 ARG B 37 -3.306 -2.977 12.089 1.00 0.00 H new ATOM 872 N TRP B 38 -7.372 0.788 10.134 1.00 0.00 N ATOM 873 CA TRP B 38 -6.995 1.135 8.771 1.00 0.00 C ATOM 874 C TRP B 38 -7.499 0.087 7.786 1.00 0.00 C ATOM 875 O TRP B 38 -7.765 -1.055 8.162 1.00 0.00 O ATOM 876 CB TRP B 38 -5.473 1.270 8.644 1.00 0.00 C ATOM 877 CG TRP B 38 -4.910 2.469 9.344 1.00 0.00 C ATOM 878 CD1 TRP B 38 -4.486 2.535 10.638 1.00 0.00 C ATOM 879 CD2 TRP B 38 -4.701 3.774 8.787 1.00 0.00 C ATOM 880 NE1 TRP B 38 -4.030 3.799 10.923 1.00 0.00 N ATOM 881 CE2 TRP B 38 -4.151 4.579 9.803 1.00 0.00 C ATOM 882 CE3 TRP B 38 -4.925 4.340 7.529 1.00 0.00 C ATOM 883 CZ2 TRP B 38 -3.824 5.917 9.599 1.00 0.00 C ATOM 884 CZ3 TRP B 38 -4.600 5.669 7.327 1.00 0.00 C ATOM 885 CH2 TRP B 38 -4.056 6.446 8.359 1.00 0.00 C ATOM 0 H TRP B 38 -6.933 -0.061 10.490 1.00 0.00 H new ATOM 0 HA TRP B 38 -7.456 2.094 8.534 1.00 0.00 H new ATOM 0 HB2 TRP B 38 -5.004 0.373 9.047 1.00 0.00 H new ATOM 0 HB3 TRP B 38 -5.209 1.321 7.588 1.00 0.00 H new ATOM 0 HD1 TRP B 38 -4.506 1.713 11.338 1.00 0.00 H new ATOM 0 HE1 TRP B 38 -3.661 4.107 11.823 1.00 0.00 H new ATOM 0 HE3 TRP B 38 -5.345 3.750 6.728 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 -3.402 6.516 10.392 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 -4.768 6.116 6.358 1.00 0.00 H new ATOM 0 HH2 TRP B 38 -3.815 7.482 8.172 1.00 0.00 H new ATOM 896 N GLU B 39 -7.627 0.484 6.525 1.00 0.00 N ATOM 897 CA GLU B 39 -8.096 -0.417 5.479 1.00 0.00 C ATOM 898 C GLU B 39 -7.139 -0.401 4.292 1.00 0.00 C ATOM 899 O GLU B 39 -6.952 0.634 3.650 1.00 0.00 O ATOM 900 CB GLU B 39 -9.501 -0.022 5.024 1.00 0.00 C ATOM 901 CG GLU B 39 -10.559 -0.179 6.106 1.00 0.00 C ATOM 902 CD GLU B 39 -10.770 -1.624 6.511 1.00 0.00 C ATOM 903 OE1 GLU B 39 -10.156 -2.056 7.508 1.00 0.00 O ATOM 904 OE2 GLU B 39 -11.549 -2.324 5.830 1.00 0.00 O ATOM 0 H GLU B 39 -7.412 1.427 6.202 1.00 0.00 H new ATOM 0 HA GLU B 39 -8.130 -1.427 5.887 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -9.487 1.015 4.689 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.780 -0.631 4.164 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -10.266 0.401 6.982 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -11.502 0.236 5.750 1.00 0.00 H new ATOM 911 N LEU B 40 -6.535 -1.551 4.010 1.00 0.00 N ATOM 912 CA LEU B 40 -5.593 -1.664 2.904 1.00 0.00 C ATOM 913 C LEU B 40 -6.319 -1.702 1.564 1.00 0.00 C ATOM 914 O LEU B 40 -6.778 -2.757 1.125 1.00 0.00 O ATOM 915 CB LEU B 40 -4.731 -2.918 3.062 1.00 0.00 C ATOM 916 CG LEU B 40 -3.810 -2.923 4.286 1.00 0.00 C ATOM 917 CD1 LEU B 40 -3.080 -4.251 4.396 1.00 0.00 C ATOM 918 CD2 LEU B 40 -2.819 -1.770 4.215 1.00 0.00 C ATOM 0 H LEU B 40 -6.681 -2.416 4.531 1.00 0.00 H new ATOM 0 HA LEU B 40 -4.951 -0.783 2.923 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -5.387 -3.787 3.117 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -4.121 -3.036 2.167 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.422 -2.792 5.178 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -2.430 -4.238 5.271 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.806 -5.058 4.496 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -2.480 -4.411 3.500 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -2.174 -1.790 5.093 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -2.211 -1.868 3.315 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.362 -0.825 4.185 1.00 0.00 H new ATOM 930 N ARG B 41 -6.422 -0.545 0.921 1.00 0.00 N ATOM 931 CA ARG B 41 -7.080 -0.448 -0.375 1.00 0.00 C ATOM 932 C ARG B 41 -6.133 -0.903 -1.478 1.00 0.00 C ATOM 933 O ARG B 41 -6.551 -1.160 -2.607 1.00 0.00 O ATOM 934 CB ARG B 41 -7.535 0.992 -0.636 1.00 0.00 C ATOM 935 CG ARG B 41 -8.510 1.522 0.402 1.00 0.00 C ATOM 936 CD ARG B 41 -9.823 0.755 0.383 1.00 0.00 C ATOM 937 NE ARG B 41 -10.488 0.839 -0.914 1.00 0.00 N ATOM 938 CZ ARG B 41 -11.652 0.257 -1.188 1.00 0.00 C ATOM 939 NH1 ARG B 41 -12.277 -0.451 -0.255 1.00 0.00 N ATOM 940 NH2 ARG B 41 -12.191 0.380 -2.392 1.00 0.00 N ATOM 0 H ARG B 41 -6.058 0.339 1.277 1.00 0.00 H new ATOM 0 HA ARG B 41 -7.956 -1.096 -0.370 1.00 0.00 H new ATOM 0 HB2 ARG B 41 -6.660 1.641 -0.664 1.00 0.00 H new ATOM 0 HB3 ARG B 41 -8.002 1.044 -1.620 1.00 0.00 H new ATOM 0 HG2 ARG B 41 -8.061 1.451 1.393 1.00 0.00 H new ATOM 0 HG3 ARG B 41 -8.703 2.578 0.214 1.00 0.00 H new ATOM 0 HD2 ARG B 41 -9.635 -0.291 0.627 1.00 0.00 H new ATOM 0 HD3 ARG B 41 -10.484 1.149 1.155 1.00 0.00 H new ATOM 0 HE ARG B 41 -10.033 1.375 -1.653 1.00 0.00 H new ATOM 0 HH11 ARG B 41 -11.864 -0.549 0.673 1.00 0.00 H new ATOM 0 HH12 ARG B 41 -13.170 -0.897 -0.466 1.00 0.00 H new ATOM 0 HH21 ARG B 41 -11.713 0.922 -3.112 1.00 0.00 H new ATOM 0 HH22 ARG B 41 -13.084 -0.068 -2.599 1.00 0.00 H new ATOM 954 N ASN B 42 -4.853 -1.001 -1.134 1.00 0.00 N ATOM 955 CA ASN B 42 -3.829 -1.424 -2.081 1.00 0.00 C ATOM 956 C ASN B 42 -2.499 -1.651 -1.359 1.00 0.00 C ATOM 957 O ASN B 42 -1.629 -0.784 -1.374 1.00 0.00 O ATOM 958 CB ASN B 42 -3.652 -0.375 -3.180 1.00 0.00 C ATOM 959 CG ASN B 42 -2.762 -0.855 -4.310 1.00 0.00 C ATOM 960 OD1 ASN B 42 -1.908 -1.722 -4.122 1.00 0.00 O ATOM 961 ND2 ASN B 42 -2.950 -0.282 -5.495 1.00 0.00 N ATOM 0 H ASN B 42 -4.499 -0.792 -0.200 1.00 0.00 H new ATOM 0 HA ASN B 42 -4.149 -2.361 -2.537 1.00 0.00 H new ATOM 0 HB2 ASN B 42 -4.629 -0.107 -3.582 1.00 0.00 H new ATOM 0 HB3 ASN B 42 -3.226 0.530 -2.747 1.00 0.00 H new ATOM 0 HD21 ASN B 42 -2.375 -0.557 -6.291 1.00 0.00 H new ATOM 0 HD22 ASN B 42 -3.669 0.433 -5.608 1.00 0.00 H new ATOM 968 N PRO B 43 -2.328 -2.820 -0.718 1.00 0.00 N ATOM 969 CA PRO B 43 -1.098 -3.150 0.016 1.00 0.00 C ATOM 970 C PRO B 43 0.079 -3.440 -0.908 1.00 0.00 C ATOM 971 O PRO B 43 1.112 -3.947 -0.466 1.00 0.00 O ATOM 972 CB PRO B 43 -1.482 -4.405 0.799 1.00 0.00 C ATOM 973 CG PRO B 43 -2.551 -5.043 -0.018 1.00 0.00 C ATOM 974 CD PRO B 43 -3.317 -3.915 -0.654 1.00 0.00 C ATOM 0 HA PRO B 43 -0.765 -2.321 0.641 1.00 0.00 H new ATOM 0 HB2 PRO B 43 -0.628 -5.071 0.925 1.00 0.00 H new ATOM 0 HB3 PRO B 43 -1.841 -4.155 1.797 1.00 0.00 H new ATOM 0 HG2 PRO B 43 -2.123 -5.700 -0.775 1.00 0.00 H new ATOM 0 HG3 PRO B 43 -3.204 -5.656 0.604 1.00 0.00 H new ATOM 0 HD2 PRO B 43 -3.681 -4.186 -1.645 1.00 0.00 H new ATOM 0 HD3 PRO B 43 -4.187 -3.636 -0.060 1.00 0.00 H new ATOM 982 N ALA B 44 -0.078 -3.119 -2.188 1.00 0.00 N ATOM 983 CA ALA B 44 0.976 -3.347 -3.170 1.00 0.00 C ATOM 984 C ALA B 44 1.390 -4.813 -3.198 1.00 0.00 C ATOM 985 O ALA B 44 2.494 -5.148 -3.628 1.00 0.00 O ATOM 986 CB ALA B 44 2.178 -2.463 -2.876 1.00 0.00 C ATOM 0 H ALA B 44 -0.926 -2.700 -2.570 1.00 0.00 H new ATOM 0 HA ALA B 44 0.583 -3.087 -4.153 1.00 0.00 H new ATOM 0 HB1 ALA B 44 2.955 -2.646 -3.618 1.00 0.00 H new ATOM 0 HB2 ALA B 44 1.878 -1.416 -2.916 1.00 0.00 H new ATOM 0 HB3 ALA B 44 2.564 -2.692 -1.883 1.00 0.00 H new ATOM 992 N ALA B 45 0.496 -5.684 -2.743 1.00 0.00 N ATOM 993 CA ALA B 45 0.767 -7.117 -2.714 1.00 0.00 C ATOM 994 C ALA B 45 0.992 -7.662 -4.120 1.00 0.00 C ATOM 995 O ALA B 45 1.390 -8.815 -4.293 1.00 0.00 O ATOM 996 CB ALA B 45 -0.378 -7.855 -2.036 1.00 0.00 C ATOM 0 H ALA B 45 -0.424 -5.422 -2.389 1.00 0.00 H new ATOM 0 HA ALA B 45 1.680 -7.279 -2.141 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -0.164 -8.924 -2.021 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -0.490 -7.493 -1.014 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -1.302 -7.678 -2.587 1.00 0.00 H new ATOM 1002 N SER B 46 0.737 -6.827 -5.122 1.00 0.00 N ATOM 1003 CA SER B 46 0.911 -7.224 -6.512 1.00 0.00 C ATOM 1004 C SER B 46 2.391 -7.366 -6.862 1.00 0.00 C ATOM 1005 O SER B 46 2.759 -8.182 -7.706 1.00 0.00 O ATOM 1006 CB SER B 46 0.253 -6.201 -7.443 1.00 0.00 C ATOM 1007 OG SER B 46 0.411 -6.571 -8.802 1.00 0.00 O ATOM 0 H SER B 46 0.409 -5.870 -4.995 1.00 0.00 H new ATOM 0 HA SER B 46 0.431 -8.193 -6.647 1.00 0.00 H new ATOM 0 HB2 SER B 46 -0.808 -6.119 -7.206 1.00 0.00 H new ATOM 0 HB3 SER B 46 0.693 -5.218 -7.277 1.00 0.00 H new ATOM 0 HG SER B 46 -0.019 -5.903 -9.375 1.00 0.00 H new ATOM 1013 N VAL B 47 3.232 -6.566 -6.210 1.00 0.00 N ATOM 1014 CA VAL B 47 4.668 -6.613 -6.461 1.00 0.00 C ATOM 1015 C VAL B 47 5.455 -6.891 -5.182 1.00 0.00 C ATOM 1016 O VAL B 47 6.372 -7.711 -5.179 1.00 0.00 O ATOM 1017 CB VAL B 47 5.172 -5.303 -7.098 1.00 0.00 C ATOM 1018 CG1 VAL B 47 4.588 -5.134 -8.492 1.00 0.00 C ATOM 1019 CG2 VAL B 47 4.826 -4.108 -6.224 1.00 0.00 C ATOM 0 H VAL B 47 2.945 -5.883 -5.509 1.00 0.00 H new ATOM 0 HA VAL B 47 4.835 -7.433 -7.159 1.00 0.00 H new ATOM 0 HB VAL B 47 6.257 -5.358 -7.181 1.00 0.00 H new ATOM 0 HG11 VAL B 47 4.953 -4.205 -8.929 1.00 0.00 H new ATOM 0 HG12 VAL B 47 4.892 -5.973 -9.118 1.00 0.00 H new ATOM 0 HG13 VAL B 47 3.500 -5.103 -8.429 1.00 0.00 H new ATOM 0 HG21 VAL B 47 5.192 -3.195 -6.694 1.00 0.00 H new ATOM 0 HG22 VAL B 47 3.744 -4.046 -6.104 1.00 0.00 H new ATOM 0 HG23 VAL B 47 5.293 -4.225 -5.246 1.00 0.00 H new ATOM 1029 N LEU B 48 5.096 -6.206 -4.099 1.00 0.00 N ATOM 1030 CA LEU B 48 5.779 -6.398 -2.823 1.00 0.00 C ATOM 1031 C LEU B 48 5.124 -7.517 -2.024 1.00 0.00 C ATOM 1032 O LEU B 48 3.940 -7.449 -1.691 1.00 0.00 O ATOM 1033 CB LEU B 48 5.781 -5.105 -2.003 1.00 0.00 C ATOM 1034 CG LEU B 48 6.114 -3.832 -2.785 1.00 0.00 C ATOM 1035 CD1 LEU B 48 6.115 -2.628 -1.858 1.00 0.00 C ATOM 1036 CD2 LEU B 48 7.457 -3.971 -3.486 1.00 0.00 C ATOM 0 H LEU B 48 4.343 -5.519 -4.079 1.00 0.00 H new ATOM 0 HA LEU B 48 6.811 -6.676 -3.037 1.00 0.00 H new ATOM 0 HB2 LEU B 48 4.799 -4.984 -1.545 1.00 0.00 H new ATOM 0 HB3 LEU B 48 6.500 -5.211 -1.191 1.00 0.00 H new ATOM 0 HG LEU B 48 5.347 -3.682 -3.545 1.00 0.00 H new ATOM 0 HD11 LEU B 48 6.353 -1.730 -2.428 1.00 0.00 H new ATOM 0 HD12 LEU B 48 5.131 -2.518 -1.403 1.00 0.00 H new ATOM 0 HD13 LEU B 48 6.862 -2.771 -1.077 1.00 0.00 H new ATOM 0 HD21 LEU B 48 7.676 -3.056 -4.037 1.00 0.00 H new ATOM 0 HD22 LEU B 48 8.238 -4.145 -2.745 1.00 0.00 H new ATOM 0 HD23 LEU B 48 7.420 -4.812 -4.179 1.00 0.00 H new ATOM 1048 N LYS B 49 5.906 -8.546 -1.722 1.00 0.00 N ATOM 1049 CA LYS B 49 5.418 -9.691 -0.962 1.00 0.00 C ATOM 1050 C LYS B 49 4.891 -9.253 0.401 1.00 0.00 C ATOM 1051 O LYS B 49 5.377 -8.282 0.982 1.00 0.00 O ATOM 1052 CB LYS B 49 6.541 -10.713 -0.786 1.00 0.00 C ATOM 1053 CG LYS B 49 6.059 -12.088 -0.356 1.00 0.00 C ATOM 1054 CD LYS B 49 7.222 -13.052 -0.184 1.00 0.00 C ATOM 1055 CE LYS B 49 6.740 -14.486 -0.068 1.00 0.00 C ATOM 1056 NZ LYS B 49 7.861 -15.433 0.177 1.00 0.00 N ATOM 0 H LYS B 49 6.887 -8.611 -1.994 1.00 0.00 H new ATOM 0 HA LYS B 49 4.597 -10.149 -1.515 1.00 0.00 H new ATOM 0 HB2 LYS B 49 7.085 -10.807 -1.726 1.00 0.00 H new ATOM 0 HB3 LYS B 49 7.247 -10.338 -0.045 1.00 0.00 H new ATOM 0 HG2 LYS B 49 5.510 -12.006 0.582 1.00 0.00 H new ATOM 0 HG3 LYS B 49 5.365 -12.481 -1.099 1.00 0.00 H new ATOM 0 HD2 LYS B 49 7.900 -12.962 -1.033 1.00 0.00 H new ATOM 0 HD3 LYS B 49 7.790 -12.784 0.707 1.00 0.00 H new ATOM 0 HE2 LYS B 49 6.018 -14.561 0.745 1.00 0.00 H new ATOM 0 HE3 LYS B 49 6.220 -14.769 -0.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 7.488 -16.401 0.250 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 8.538 -15.381 -0.611 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 8.342 -15.180 1.064 1.00 0.00 H new ATOM 1070 N ARG B 50 3.895 -9.975 0.907 1.00 0.00 N ATOM 1071 CA ARG B 50 3.302 -9.657 2.200 1.00 0.00 C ATOM 1072 C ARG B 50 3.822 -10.594 3.288 1.00 0.00 C ATOM 1073 O ARG B 50 3.712 -11.815 3.176 1.00 0.00 O ATOM 1074 CB ARG B 50 1.776 -9.740 2.122 1.00 0.00 C ATOM 1075 CG ARG B 50 1.260 -11.081 1.625 1.00 0.00 C ATOM 1076 CD ARG B 50 -0.257 -11.113 1.579 1.00 0.00 C ATOM 1077 NE ARG B 50 -0.764 -12.403 1.117 1.00 0.00 N ATOM 1078 CZ ARG B 50 -2.057 -12.707 1.047 1.00 0.00 C ATOM 1079 NH1 ARG B 50 -2.972 -11.816 1.409 1.00 0.00 N ATOM 1080 NH2 ARG B 50 -2.437 -13.901 0.617 1.00 0.00 N ATOM 0 H ARG B 50 3.483 -10.783 0.441 1.00 0.00 H new ATOM 0 HA ARG B 50 3.589 -8.638 2.459 1.00 0.00 H new ATOM 0 HB2 ARG B 50 1.360 -9.544 3.110 1.00 0.00 H new ATOM 0 HB3 ARG B 50 1.412 -8.953 1.461 1.00 0.00 H new ATOM 0 HG2 ARG B 50 1.659 -11.279 0.630 1.00 0.00 H new ATOM 0 HG3 ARG B 50 1.622 -11.875 2.278 1.00 0.00 H new ATOM 0 HD2 ARG B 50 -0.654 -10.902 2.572 1.00 0.00 H new ATOM 0 HD3 ARG B 50 -0.616 -10.324 0.918 1.00 0.00 H new ATOM 0 HE ARG B 50 -0.088 -13.111 0.832 1.00 0.00 H new ATOM 0 HH11 ARG B 50 -2.684 -10.896 1.742 1.00 0.00 H new ATOM 0 HH12 ARG B 50 -3.963 -12.052 1.354 1.00 0.00 H new ATOM 0 HH21 ARG B 50 -1.738 -14.589 0.339 1.00 0.00 H new ATOM 0 HH22 ARG B 50 -3.429 -14.132 0.564 1.00 0.00 H new ATOM 1094 N LEU B 51 4.394 -10.012 4.338 1.00 0.00 N ATOM 1095 CA LEU B 51 4.930 -10.791 5.449 1.00 0.00 C ATOM 1096 C LEU B 51 4.113 -10.559 6.717 1.00 0.00 C ATOM 1097 O LEU B 51 3.136 -9.809 6.709 1.00 0.00 O ATOM 1098 CB LEU B 51 6.398 -10.425 5.700 1.00 0.00 C ATOM 1099 CG LEU B 51 7.397 -11.010 4.697 1.00 0.00 C ATOM 1100 CD1 LEU B 51 7.201 -10.397 3.318 1.00 0.00 C ATOM 1101 CD2 LEU B 51 8.824 -10.790 5.178 1.00 0.00 C ATOM 0 H LEU B 51 4.498 -9.003 4.443 1.00 0.00 H new ATOM 0 HA LEU B 51 4.868 -11.846 5.183 1.00 0.00 H new ATOM 0 HB2 LEU B 51 6.492 -9.339 5.690 1.00 0.00 H new ATOM 0 HB3 LEU B 51 6.673 -10.760 6.700 1.00 0.00 H new ATOM 0 HG LEU B 51 7.216 -12.082 4.622 1.00 0.00 H new ATOM 0 HD11 LEU B 51 7.921 -10.828 2.623 1.00 0.00 H new ATOM 0 HD12 LEU B 51 6.190 -10.605 2.968 1.00 0.00 H new ATOM 0 HD13 LEU B 51 7.351 -9.319 3.374 1.00 0.00 H new ATOM 0 HD21 LEU B 51 9.521 -11.212 4.454 1.00 0.00 H new ATOM 0 HD22 LEU B 51 9.012 -9.721 5.283 1.00 0.00 H new ATOM 0 HD23 LEU B 51 8.962 -11.279 6.142 1.00 0.00 H new ATOM 1113 N GLY B 52 4.519 -11.206 7.805 1.00 0.00 N ATOM 1114 CA GLY B 52 3.812 -11.059 9.064 1.00 0.00 C ATOM 1115 C GLY B 52 4.251 -9.829 9.837 1.00 0.00 C ATOM 1116 O GLY B 52 5.321 -9.278 9.573 1.00 0.00 O ATOM 0 H GLY B 52 5.325 -11.830 7.837 1.00 0.00 H new ATOM 0 HA2 GLY B 52 2.741 -11.000 8.871 1.00 0.00 H new ATOM 0 HA3 GLY B 52 3.977 -11.946 9.675 1.00 0.00 H new ATOM 1120 N PRO B 53 3.438 -9.370 10.806 1.00 0.00 N ATOM 1121 CA PRO B 53 3.758 -8.190 11.621 1.00 0.00 C ATOM 1122 C PRO B 53 5.070 -8.348 12.381 1.00 0.00 C ATOM 1123 O PRO B 53 5.663 -9.427 12.398 1.00 0.00 O ATOM 1124 CB PRO B 53 2.583 -8.098 12.599 1.00 0.00 C ATOM 1125 CG PRO B 53 1.478 -8.846 11.939 1.00 0.00 C ATOM 1126 CD PRO B 53 2.142 -9.959 11.186 1.00 0.00 C ATOM 0 HA PRO B 53 3.889 -7.298 11.008 1.00 0.00 H new ATOM 0 HB2 PRO B 53 2.836 -8.537 13.564 1.00 0.00 H new ATOM 0 HB3 PRO B 53 2.303 -7.061 12.784 1.00 0.00 H new ATOM 0 HG2 PRO B 53 0.774 -9.235 12.674 1.00 0.00 H new ATOM 0 HG3 PRO B 53 0.913 -8.200 11.267 1.00 0.00 H new ATOM 0 HD2 PRO B 53 2.268 -10.847 11.805 1.00 0.00 H new ATOM 0 HD3 PRO B 53 1.562 -10.258 10.313 1.00 0.00 H new ATOM 1134 N GLU B 54 5.516 -7.265 13.012 1.00 0.00 N ATOM 1135 CA GLU B 54 6.760 -7.282 13.775 1.00 0.00 C ATOM 1136 C GLU B 54 6.552 -6.697 15.169 1.00 0.00 C ATOM 1137 O GLU B 54 7.090 -7.208 16.153 1.00 0.00 O ATOM 1138 CB GLU B 54 7.845 -6.493 13.041 1.00 0.00 C ATOM 1139 CG GLU B 54 8.257 -7.112 11.714 1.00 0.00 C ATOM 1140 CD GLU B 54 8.929 -8.462 11.883 1.00 0.00 C ATOM 1141 OE1 GLU B 54 8.232 -9.492 11.768 1.00 0.00 O ATOM 1142 OE2 GLU B 54 10.153 -8.487 12.127 1.00 0.00 O ATOM 0 H GLU B 54 5.035 -6.366 13.010 1.00 0.00 H new ATOM 0 HA GLU B 54 7.078 -8.320 13.877 1.00 0.00 H new ATOM 0 HB2 GLU B 54 7.487 -5.479 12.864 1.00 0.00 H new ATOM 0 HB3 GLU B 54 8.722 -6.414 13.683 1.00 0.00 H new ATOM 0 HG2 GLU B 54 7.377 -7.225 11.081 1.00 0.00 H new ATOM 0 HG3 GLU B 54 8.936 -6.434 11.197 1.00 0.00 H new ATOM 1149 N VAL B 55 5.770 -5.626 15.248 1.00 0.00 N ATOM 1150 CA VAL B 55 5.493 -4.969 16.519 1.00 0.00 C ATOM 1151 C VAL B 55 4.030 -5.149 16.917 1.00 0.00 C ATOM 1152 O VAL B 55 3.545 -4.517 17.854 1.00 0.00 O ATOM 1153 CB VAL B 55 5.824 -3.464 16.455 1.00 0.00 C ATOM 1154 CG1 VAL B 55 5.900 -2.866 17.853 1.00 0.00 C ATOM 1155 CG2 VAL B 55 7.129 -3.236 15.708 1.00 0.00 C ATOM 0 H VAL B 55 5.316 -5.194 14.444 1.00 0.00 H new ATOM 0 HA VAL B 55 6.130 -5.437 17.270 1.00 0.00 H new ATOM 0 HB VAL B 55 5.022 -2.963 15.913 1.00 0.00 H new ATOM 0 HG11 VAL B 55 6.135 -1.804 17.782 1.00 0.00 H new ATOM 0 HG12 VAL B 55 4.941 -2.993 18.356 1.00 0.00 H new ATOM 0 HG13 VAL B 55 6.679 -3.372 18.423 1.00 0.00 H new ATOM 0 HG21 VAL B 55 7.346 -2.168 15.673 1.00 0.00 H new ATOM 0 HG22 VAL B 55 7.938 -3.754 16.223 1.00 0.00 H new ATOM 0 HG23 VAL B 55 7.039 -3.622 14.692 1.00 0.00 H new ATOM 1165 N TYR B 56 3.334 -6.024 16.200 1.00 0.00 N ATOM 1166 CA TYR B 56 1.925 -6.287 16.476 1.00 0.00 C ATOM 1167 C TYR B 56 1.648 -7.788 16.495 1.00 0.00 C ATOM 1168 O TYR B 56 0.515 -8.219 16.707 1.00 0.00 O ATOM 1169 CB TYR B 56 1.047 -5.604 15.425 1.00 0.00 C ATOM 1170 CG TYR B 56 -0.386 -5.404 15.865 1.00 0.00 C ATOM 1171 CD1 TYR B 56 -1.393 -6.258 15.432 1.00 0.00 C ATOM 1172 CD2 TYR B 56 -0.731 -4.359 16.713 1.00 0.00 C ATOM 1173 CE1 TYR B 56 -2.703 -6.075 15.831 1.00 0.00 C ATOM 1174 CE2 TYR B 56 -2.039 -4.172 17.118 1.00 0.00 C ATOM 1175 CZ TYR B 56 -3.022 -5.032 16.675 1.00 0.00 C ATOM 1176 OH TYR B 56 -4.324 -4.848 17.075 1.00 0.00 O ATOM 0 H TYR B 56 3.721 -6.563 15.425 1.00 0.00 H new ATOM 0 HA TYR B 56 1.686 -5.881 17.459 1.00 0.00 H new ATOM 0 HB2 TYR B 56 1.480 -4.635 15.177 1.00 0.00 H new ATOM 0 HB3 TYR B 56 1.058 -6.200 14.513 1.00 0.00 H new ATOM 0 HD1 TYR B 56 -1.148 -7.078 14.773 1.00 0.00 H new ATOM 0 HD2 TYR B 56 0.035 -3.682 17.061 1.00 0.00 H new ATOM 0 HE1 TYR B 56 -3.474 -6.746 15.483 1.00 0.00 H new ATOM 0 HE2 TYR B 56 -2.290 -3.356 17.779 1.00 0.00 H new ATOM 0 HH TYR B 56 -4.377 -4.070 17.669 1.00 0.00 H new ATOM 1186 N SER B 57 2.695 -8.581 16.278 1.00 0.00 N ATOM 1187 CA SER B 57 2.567 -10.033 16.269 1.00 0.00 C ATOM 1188 C SER B 57 2.096 -10.549 17.624 1.00 0.00 C ATOM 1189 O SER B 57 2.081 -9.813 18.610 1.00 0.00 O ATOM 1190 CB SER B 57 3.902 -10.682 15.902 1.00 0.00 C ATOM 1191 OG SER B 57 4.332 -10.271 14.615 1.00 0.00 O ATOM 0 H SER B 57 3.641 -8.241 16.106 1.00 0.00 H new ATOM 0 HA SER B 57 1.821 -10.300 15.520 1.00 0.00 H new ATOM 0 HB2 SER B 57 4.656 -10.415 16.643 1.00 0.00 H new ATOM 0 HB3 SER B 57 3.801 -11.767 15.926 1.00 0.00 H new ATOM 0 HG SER B 57 5.288 -10.056 14.643 1.00 0.00 H new ATOM 1197 N ASN B 58 1.713 -11.822 17.666 1.00 0.00 N ATOM 1198 CA ASN B 58 1.241 -12.440 18.900 1.00 0.00 C ATOM 1199 C ASN B 58 2.360 -13.225 19.577 1.00 0.00 C ATOM 1200 O ASN B 58 2.260 -13.578 20.754 1.00 0.00 O ATOM 1201 CB ASN B 58 0.056 -13.365 18.612 1.00 0.00 C ATOM 1202 CG ASN B 58 0.408 -14.466 17.633 1.00 0.00 C ATOM 1203 OD1 ASN B 58 0.264 -14.307 16.422 1.00 0.00 O ATOM 1204 ND2 ASN B 58 0.869 -15.597 18.158 1.00 0.00 N ATOM 0 H ASN B 58 1.720 -12.446 16.859 1.00 0.00 H new ATOM 0 HA ASN B 58 0.918 -11.646 19.574 1.00 0.00 H new ATOM 0 HB2 ASN B 58 -0.290 -13.809 19.545 1.00 0.00 H new ATOM 0 HB3 ASN B 58 -0.771 -12.778 18.213 1.00 0.00 H new ATOM 0 HD21 ASN B 58 1.119 -16.377 17.550 1.00 0.00 H new ATOM 0 HD22 ASN B 58 0.972 -15.685 19.169 1.00 0.00 H new ATOM 1211 N SER B 59 3.424 -13.498 18.828 1.00 0.00 N ATOM 1212 CA SER B 59 4.561 -14.243 19.357 1.00 0.00 C ATOM 1213 C SER B 59 5.505 -13.322 20.125 1.00 0.00 C ATOM 1214 O SER B 59 6.574 -13.744 20.569 1.00 0.00 O ATOM 1215 CB SER B 59 5.318 -14.933 18.220 1.00 0.00 C ATOM 1216 OG SER B 59 4.479 -15.842 17.529 1.00 0.00 O ATOM 0 H SER B 59 3.522 -13.214 17.853 1.00 0.00 H new ATOM 0 HA SER B 59 4.181 -14.999 20.044 1.00 0.00 H new ATOM 0 HB2 SER B 59 5.699 -14.184 17.525 1.00 0.00 H new ATOM 0 HB3 SER B 59 6.181 -15.463 18.622 1.00 0.00 H new ATOM 0 HG SER B 59 4.985 -16.269 16.806 1.00 0.00 H new ATOM 1222 N GLU B 60 5.102 -12.065 20.278 1.00 0.00 N ATOM 1223 CA GLU B 60 5.910 -11.083 20.991 1.00 0.00 C ATOM 1224 C GLU B 60 6.028 -11.443 22.470 1.00 0.00 C ATOM 1225 O GLU B 60 5.053 -11.361 23.217 1.00 0.00 O ATOM 1226 CB GLU B 60 5.305 -9.689 20.839 1.00 0.00 C ATOM 1227 CG GLU B 60 6.101 -8.597 21.535 1.00 0.00 C ATOM 1228 CD GLU B 60 5.475 -7.225 21.373 1.00 0.00 C ATOM 1229 OE1 GLU B 60 5.820 -6.527 20.399 1.00 0.00 O ATOM 1230 OE2 GLU B 60 4.640 -6.852 22.223 1.00 0.00 O ATOM 0 H GLU B 60 4.220 -11.702 19.917 1.00 0.00 H new ATOM 0 HA GLU B 60 6.909 -11.087 20.556 1.00 0.00 H new ATOM 0 HB2 GLU B 60 5.228 -9.450 19.778 1.00 0.00 H new ATOM 0 HB3 GLU B 60 4.291 -9.697 21.238 1.00 0.00 H new ATOM 0 HG2 GLU B 60 6.182 -8.832 22.596 1.00 0.00 H new ATOM 0 HG3 GLU B 60 7.114 -8.580 21.134 1.00 0.00 H new ATOM 1237 N GLU B 61 7.227 -11.842 22.882 1.00 0.00 N ATOM 1238 CA GLU B 61 7.474 -12.214 24.270 1.00 0.00 C ATOM 1239 C GLU B 61 7.644 -10.972 25.139 1.00 0.00 C ATOM 1240 O GLU B 61 6.833 -10.709 26.028 1.00 0.00 O ATOM 1241 CB GLU B 61 8.720 -13.098 24.369 1.00 0.00 C ATOM 1242 CG GLU B 61 9.039 -13.550 25.786 1.00 0.00 C ATOM 1243 CD GLU B 61 7.922 -14.371 26.401 1.00 0.00 C ATOM 1244 OE1 GLU B 61 7.938 -15.609 26.237 1.00 0.00 O ATOM 1245 OE2 GLU B 61 7.035 -13.776 27.046 1.00 0.00 O ATOM 0 H GLU B 61 8.043 -11.916 22.274 1.00 0.00 H new ATOM 0 HA GLU B 61 6.612 -12.775 24.632 1.00 0.00 H new ATOM 0 HB2 GLU B 61 8.582 -13.977 23.739 1.00 0.00 H new ATOM 0 HB3 GLU B 61 9.575 -12.552 23.970 1.00 0.00 H new ATOM 0 HG2 GLU B 61 9.956 -14.139 25.778 1.00 0.00 H new ATOM 0 HG3 GLU B 61 9.228 -12.675 26.409 1.00 0.00 H new ATOM 1252 N ASP B 62 8.702 -10.211 24.877 1.00 0.00 N ATOM 1253 CA ASP B 62 8.977 -8.996 25.634 1.00 0.00 C ATOM 1254 C ASP B 62 8.297 -7.794 24.988 1.00 0.00 C ATOM 1255 O ASP B 62 8.228 -7.695 23.762 1.00 0.00 O ATOM 1256 CB ASP B 62 10.486 -8.757 25.725 1.00 0.00 C ATOM 1257 CG ASP B 62 10.826 -7.505 26.509 1.00 0.00 C ATOM 1258 OD1 ASP B 62 10.920 -6.423 25.889 1.00 0.00 O ATOM 1259 OD2 ASP B 62 10.997 -7.603 27.742 1.00 0.00 O ATOM 0 H ASP B 62 9.383 -10.415 24.146 1.00 0.00 H new ATOM 0 HA ASP B 62 8.577 -9.122 26.640 1.00 0.00 H new ATOM 0 HB2 ASP B 62 10.960 -9.618 26.197 1.00 0.00 H new ATOM 0 HB3 ASP B 62 10.900 -8.677 24.720 1.00 0.00 H new ATOM 1264 N SER B 63 7.797 -6.884 25.817 1.00 0.00 N ATOM 1265 CA SER B 63 7.120 -5.690 25.321 1.00 0.00 C ATOM 1266 C SER B 63 8.079 -4.809 24.527 1.00 0.00 C ATOM 1267 O SER B 63 8.870 -4.060 25.103 1.00 0.00 O ATOM 1268 CB SER B 63 6.522 -4.895 26.483 1.00 0.00 C ATOM 1269 OG SER B 63 5.583 -5.671 27.204 1.00 0.00 O ATOM 0 H SER B 63 7.847 -6.950 26.834 1.00 0.00 H new ATOM 0 HA SER B 63 6.316 -6.010 24.658 1.00 0.00 H new ATOM 0 HB2 SER B 63 7.318 -4.569 27.152 1.00 0.00 H new ATOM 0 HB3 SER B 63 6.038 -3.996 26.101 1.00 0.00 H new ATOM 0 HG SER B 63 5.217 -5.140 27.942 1.00 0.00 H new ATOM 1275 N GLY B 64 8.005 -4.907 23.204 1.00 0.00 N ATOM 1276 CA GLY B 64 8.864 -4.112 22.350 1.00 0.00 C ATOM 1277 C GLY B 64 8.079 -3.133 21.502 1.00 0.00 C ATOM 1278 O GLY B 64 7.945 -3.315 20.292 1.00 0.00 O ATOM 0 H GLY B 64 7.363 -5.525 22.708 1.00 0.00 H new ATOM 0 HA2 GLY B 64 9.579 -3.566 22.965 1.00 0.00 H new ATOM 0 HA3 GLY B 64 9.440 -4.772 21.701 1.00 0.00 H new ATOM 1282 N LEU B 65 7.556 -2.090 22.141 1.00 0.00 N ATOM 1283 CA LEU B 65 6.778 -1.081 21.452 1.00 0.00 C ATOM 1284 C LEU B 65 7.560 0.219 21.358 1.00 0.00 C ATOM 1285 O LEU B 65 8.780 0.218 21.186 1.00 0.00 O ATOM 1286 CB LEU B 65 5.454 -0.860 22.193 1.00 0.00 C ATOM 1287 CG LEU B 65 4.698 -2.136 22.572 1.00 0.00 C ATOM 1288 CD1 LEU B 65 3.435 -1.796 23.346 1.00 0.00 C ATOM 1289 CD2 LEU B 65 4.363 -2.951 21.330 1.00 0.00 C ATOM 0 H LEU B 65 7.662 -1.927 23.142 1.00 0.00 H new ATOM 0 HA LEU B 65 6.566 -1.423 20.439 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.655 -0.293 23.102 1.00 0.00 H new ATOM 0 HB3 LEU B 65 4.806 -0.244 21.570 1.00 0.00 H new ATOM 0 HG LEU B 65 5.342 -2.739 23.212 1.00 0.00 H new ATOM 0 HD11 LEU B 65 2.910 -2.715 23.607 1.00 0.00 H new ATOM 0 HD12 LEU B 65 3.700 -1.258 24.256 1.00 0.00 H new ATOM 0 HD13 LEU B 65 2.788 -1.171 22.730 1.00 0.00 H new ATOM 0 HD21 LEU B 65 3.826 -3.854 21.621 1.00 0.00 H new ATOM 0 HD22 LEU B 65 3.739 -2.357 20.662 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.284 -3.227 20.816 1.00 0.00 H new ATOM 1301 N VAL B 66 6.847 1.320 21.473 1.00 0.00 N ATOM 1302 CA VAL B 66 7.451 2.646 21.404 1.00 0.00 C ATOM 1303 C VAL B 66 7.336 3.369 22.741 1.00 0.00 C ATOM 1304 O VAL B 66 8.174 4.203 23.082 1.00 0.00 O ATOM 1305 CB VAL B 66 6.791 3.504 20.305 1.00 0.00 C ATOM 1306 CG1 VAL B 66 7.447 4.875 20.226 1.00 0.00 C ATOM 1307 CG2 VAL B 66 6.862 2.795 18.962 1.00 0.00 C ATOM 0 H VAL B 66 5.837 1.328 21.616 1.00 0.00 H new ATOM 0 HA VAL B 66 8.504 2.506 21.161 1.00 0.00 H new ATOM 0 HB VAL B 66 5.741 3.645 20.563 1.00 0.00 H new ATOM 0 HG11 VAL B 66 6.966 5.464 19.445 1.00 0.00 H new ATOM 0 HG12 VAL B 66 7.340 5.385 21.183 1.00 0.00 H new ATOM 0 HG13 VAL B 66 8.506 4.759 19.994 1.00 0.00 H new ATOM 0 HG21 VAL B 66 6.392 3.414 18.198 1.00 0.00 H new ATOM 0 HG22 VAL B 66 7.905 2.621 18.697 1.00 0.00 H new ATOM 0 HG23 VAL B 66 6.340 1.840 19.027 1.00 0.00 H new ATOM 1317 N GLY B 67 6.294 3.037 23.495 1.00 0.00 N ATOM 1318 CA GLY B 67 6.085 3.662 24.787 1.00 0.00 C ATOM 1319 C GLY B 67 4.616 3.763 25.151 1.00 0.00 C ATOM 1320 O GLY B 67 4.085 2.908 25.860 1.00 0.00 O ATOM 0 H GLY B 67 5.590 2.346 23.234 1.00 0.00 H new ATOM 0 HA2 GLY B 67 6.608 3.089 25.553 1.00 0.00 H new ATOM 0 HA3 GLY B 67 6.524 4.660 24.780 1.00 0.00 H new ATOM 1324 N SER B 68 3.960 4.812 24.664 1.00 0.00 N ATOM 1325 CA SER B 68 2.545 5.024 24.942 1.00 0.00 C ATOM 1326 C SER B 68 1.690 3.963 24.253 1.00 0.00 C ATOM 1327 O SER B 68 0.781 3.395 24.859 1.00 0.00 O ATOM 1328 CB SER B 68 2.116 6.418 24.482 1.00 0.00 C ATOM 1329 OG SER B 68 2.369 6.602 23.101 1.00 0.00 O ATOM 0 H SER B 68 4.386 5.528 24.075 1.00 0.00 H new ATOM 0 HA SER B 68 2.396 4.943 26.019 1.00 0.00 H new ATOM 0 HB2 SER B 68 1.054 6.559 24.682 1.00 0.00 H new ATOM 0 HB3 SER B 68 2.651 7.174 25.056 1.00 0.00 H new ATOM 0 HG SER B 68 2.084 7.501 22.833 1.00 0.00 H new ATOM 1335 N GLY B 69 1.989 3.705 22.983 1.00 0.00 N ATOM 1336 CA GLY B 69 1.240 2.714 22.233 1.00 0.00 C ATOM 1337 C GLY B 69 0.207 3.338 21.314 1.00 0.00 C ATOM 1338 O GLY B 69 0.163 4.559 21.158 1.00 0.00 O ATOM 0 H GLY B 69 2.736 4.164 22.461 1.00 0.00 H new ATOM 0 HA2 GLY B 69 1.931 2.112 21.642 1.00 0.00 H new ATOM 0 HA3 GLY B 69 0.742 2.038 22.928 1.00 0.00 H new ATOM 1342 N GLY B 70 -0.626 2.499 20.706 1.00 0.00 N ATOM 1343 CA GLY B 70 -1.651 2.993 19.805 1.00 0.00 C ATOM 1344 C GLY B 70 -1.118 3.261 18.413 1.00 0.00 C ATOM 1345 O GLY B 70 -1.208 4.382 17.914 1.00 0.00 O ATOM 0 H GLY B 70 -0.609 1.486 20.821 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -2.461 2.266 19.747 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -2.076 3.911 20.211 1.00 0.00 H new ATOM 1349 N GLU B 71 -0.569 2.226 17.784 1.00 0.00 N ATOM 1350 CA GLU B 71 -0.014 2.347 16.438 1.00 0.00 C ATOM 1351 C GLU B 71 -0.134 1.027 15.682 1.00 0.00 C ATOM 1352 O GLU B 71 -0.755 0.079 16.163 1.00 0.00 O ATOM 1353 CB GLU B 71 1.456 2.775 16.503 1.00 0.00 C ATOM 1354 CG GLU B 71 1.665 4.174 17.059 1.00 0.00 C ATOM 1355 CD GLU B 71 3.127 4.572 17.101 1.00 0.00 C ATOM 1356 OE1 GLU B 71 3.782 4.314 18.132 1.00 0.00 O ATOM 1357 OE2 GLU B 71 3.617 5.142 16.105 1.00 0.00 O ATOM 0 H GLU B 71 -0.496 1.291 18.186 1.00 0.00 H new ATOM 0 HA GLU B 71 -0.584 3.108 15.905 1.00 0.00 H new ATOM 0 HB2 GLU B 71 2.005 2.063 17.120 1.00 0.00 H new ATOM 0 HB3 GLU B 71 1.884 2.725 15.502 1.00 0.00 H new ATOM 0 HG2 GLU B 71 1.115 4.890 16.448 1.00 0.00 H new ATOM 0 HG3 GLU B 71 1.249 4.227 18.065 1.00 0.00 H new ATOM 1364 N SER B 72 0.465 0.976 14.495 1.00 0.00 N ATOM 1365 CA SER B 72 0.429 -0.227 13.671 1.00 0.00 C ATOM 1366 C SER B 72 1.796 -0.498 13.050 1.00 0.00 C ATOM 1367 O SER B 72 2.707 0.324 13.152 1.00 0.00 O ATOM 1368 CB SER B 72 -0.625 -0.087 12.572 1.00 0.00 C ATOM 1369 OG SER B 72 -0.701 -1.264 11.783 1.00 0.00 O ATOM 0 H SER B 72 0.981 1.754 14.083 1.00 0.00 H new ATOM 0 HA SER B 72 0.165 -1.069 14.310 1.00 0.00 H new ATOM 0 HB2 SER B 72 -1.597 0.117 13.020 1.00 0.00 H new ATOM 0 HB3 SER B 72 -0.382 0.765 11.937 1.00 0.00 H new ATOM 0 HG SER B 72 -0.870 -1.021 10.849 1.00 0.00 H new ATOM 1375 N THR B 73 1.932 -1.654 12.408 1.00 0.00 N ATOM 1376 CA THR B 73 3.189 -2.031 11.773 1.00 0.00 C ATOM 1377 C THR B 73 2.951 -2.957 10.585 1.00 0.00 C ATOM 1378 O THR B 73 2.484 -4.085 10.749 1.00 0.00 O ATOM 1379 CB THR B 73 4.136 -2.725 12.772 1.00 0.00 C ATOM 1380 OG1 THR B 73 4.361 -1.876 13.903 1.00 0.00 O ATOM 1381 CG2 THR B 73 5.466 -3.061 12.114 1.00 0.00 C ATOM 0 H THR B 73 1.188 -2.345 12.314 1.00 0.00 H new ATOM 0 HA THR B 73 3.655 -1.110 11.422 1.00 0.00 H new ATOM 0 HB THR B 73 3.666 -3.652 13.100 1.00 0.00 H new ATOM 0 HG1 THR B 73 5.320 -1.845 14.103 1.00 0.00 H new ATOM 0 HG21 THR B 73 6.117 -3.550 12.839 1.00 0.00 H new ATOM 0 HG22 THR B 73 5.296 -3.730 11.270 1.00 0.00 H new ATOM 0 HG23 THR B 73 5.939 -2.145 11.761 1.00 0.00 H new ATOM 1389 N TRP B 74 3.273 -2.473 9.390 1.00 0.00 N ATOM 1390 CA TRP B 74 3.101 -3.259 8.173 1.00 0.00 C ATOM 1391 C TRP B 74 4.448 -3.541 7.515 1.00 0.00 C ATOM 1392 O TRP B 74 5.152 -2.620 7.102 1.00 0.00 O ATOM 1393 CB TRP B 74 2.185 -2.524 7.190 1.00 0.00 C ATOM 1394 CG TRP B 74 0.811 -2.269 7.729 1.00 0.00 C ATOM 1395 CD1 TRP B 74 -0.196 -3.181 7.871 1.00 0.00 C ATOM 1396 CD2 TRP B 74 0.289 -1.018 8.191 1.00 0.00 C ATOM 1397 NE1 TRP B 74 -1.310 -2.573 8.396 1.00 0.00 N ATOM 1398 CE2 TRP B 74 -1.038 -1.245 8.601 1.00 0.00 C ATOM 1399 CE3 TRP B 74 0.816 0.272 8.300 1.00 0.00 C ATOM 1400 CZ2 TRP B 74 -1.845 -0.231 9.111 1.00 0.00 C ATOM 1401 CZ3 TRP B 74 0.013 1.277 8.805 1.00 0.00 C ATOM 1402 CH2 TRP B 74 -1.302 1.022 9.206 1.00 0.00 C ATOM 0 H TRP B 74 3.655 -1.539 9.238 1.00 0.00 H new ATOM 0 HA TRP B 74 2.642 -4.209 8.445 1.00 0.00 H new ATOM 0 HB2 TRP B 74 2.643 -1.572 6.921 1.00 0.00 H new ATOM 0 HB3 TRP B 74 2.104 -3.109 6.274 1.00 0.00 H new ATOM 0 HD1 TRP B 74 -0.126 -4.226 7.609 1.00 0.00 H new ATOM 0 HE1 TRP B 74 -2.196 -3.035 8.600 1.00 0.00 H new ATOM 0 HE3 TRP B 74 1.831 0.479 7.995 1.00 0.00 H new ATOM 0 HZ2 TRP B 74 -2.861 -0.426 9.420 1.00 0.00 H new ATOM 0 HZ3 TRP B 74 0.409 2.278 8.892 1.00 0.00 H new ATOM 0 HH2 TRP B 74 -1.901 1.830 9.599 1.00 0.00 H new ATOM 1413 N ARG B 75 4.798 -4.820 7.420 1.00 0.00 N ATOM 1414 CA ARG B 75 6.062 -5.223 6.813 1.00 0.00 C ATOM 1415 C ARG B 75 5.851 -5.734 5.392 1.00 0.00 C ATOM 1416 O ARG B 75 4.905 -6.475 5.122 1.00 0.00 O ATOM 1417 CB ARG B 75 6.734 -6.303 7.662 1.00 0.00 C ATOM 1418 CG ARG B 75 8.090 -6.735 7.128 1.00 0.00 C ATOM 1419 CD ARG B 75 8.812 -7.628 8.119 1.00 0.00 C ATOM 1420 NE ARG B 75 10.114 -8.063 7.618 1.00 0.00 N ATOM 1421 CZ ARG B 75 10.882 -8.956 8.236 1.00 0.00 C ATOM 1422 NH1 ARG B 75 10.481 -9.506 9.373 1.00 0.00 N ATOM 1423 NH2 ARG B 75 12.053 -9.297 7.717 1.00 0.00 N ATOM 0 H ARG B 75 4.225 -5.594 7.755 1.00 0.00 H new ATOM 0 HA ARG B 75 6.709 -4.347 6.768 1.00 0.00 H new ATOM 0 HB2 ARG B 75 6.854 -5.932 8.680 1.00 0.00 H new ATOM 0 HB3 ARG B 75 6.079 -7.173 7.715 1.00 0.00 H new ATOM 0 HG2 ARG B 75 7.960 -7.265 6.185 1.00 0.00 H new ATOM 0 HG3 ARG B 75 8.698 -5.855 6.918 1.00 0.00 H new ATOM 0 HD2 ARG B 75 8.946 -7.092 9.059 1.00 0.00 H new ATOM 0 HD3 ARG B 75 8.197 -8.501 8.335 1.00 0.00 H new ATOM 0 HE ARG B 75 10.453 -7.659 6.745 1.00 0.00 H new ATOM 0 HH11 ARG B 75 9.581 -9.245 9.776 1.00 0.00 H new ATOM 0 HH12 ARG B 75 11.072 -10.191 9.845 1.00 0.00 H new ATOM 0 HH21 ARG B 75 12.366 -8.874 6.843 1.00 0.00 H new ATOM 0 HH22 ARG B 75 12.641 -9.982 8.192 1.00 0.00 H new ATOM 1437 N PHE B 76 6.740 -5.335 4.487 1.00 0.00 N ATOM 1438 CA PHE B 76 6.656 -5.752 3.092 1.00 0.00 C ATOM 1439 C PHE B 76 8.044 -6.032 2.521 1.00 0.00 C ATOM 1440 O PHE B 76 8.975 -5.251 2.720 1.00 0.00 O ATOM 1441 CB PHE B 76 5.960 -4.680 2.252 1.00 0.00 C ATOM 1442 CG PHE B 76 4.528 -4.442 2.640 1.00 0.00 C ATOM 1443 CD1 PHE B 76 4.180 -3.348 3.414 1.00 0.00 C ATOM 1444 CD2 PHE B 76 3.532 -5.312 2.229 1.00 0.00 C ATOM 1445 CE1 PHE B 76 2.864 -3.126 3.771 1.00 0.00 C ATOM 1446 CE2 PHE B 76 2.214 -5.095 2.583 1.00 0.00 C ATOM 1447 CZ PHE B 76 1.878 -4.002 3.356 1.00 0.00 C ATOM 0 H PHE B 76 7.528 -4.722 4.696 1.00 0.00 H new ATOM 0 HA PHE B 76 6.071 -6.671 3.054 1.00 0.00 H new ATOM 0 HB2 PHE B 76 6.512 -3.745 2.343 1.00 0.00 H new ATOM 0 HB3 PHE B 76 5.999 -4.972 1.202 1.00 0.00 H new ATOM 0 HD1 PHE B 76 4.946 -2.661 3.742 1.00 0.00 H new ATOM 0 HD2 PHE B 76 3.788 -6.170 1.625 1.00 0.00 H new ATOM 0 HE1 PHE B 76 2.605 -2.268 4.374 1.00 0.00 H new ATOM 0 HE2 PHE B 76 1.447 -5.781 2.255 1.00 0.00 H new ATOM 0 HZ PHE B 76 0.849 -3.832 3.636 1.00 0.00 H new ATOM 1457 N ARG B 77 8.169 -7.150 1.813 1.00 0.00 N ATOM 1458 CA ARG B 77 9.438 -7.539 1.208 1.00 0.00 C ATOM 1459 C ARG B 77 9.298 -7.615 -0.307 1.00 0.00 C ATOM 1460 O ARG B 77 8.363 -8.223 -0.821 1.00 0.00 O ATOM 1461 CB ARG B 77 9.904 -8.884 1.768 1.00 0.00 C ATOM 1462 CG ARG B 77 11.346 -9.230 1.422 1.00 0.00 C ATOM 1463 CD ARG B 77 11.463 -9.829 0.032 1.00 0.00 C ATOM 1464 NE ARG B 77 12.833 -10.227 -0.279 1.00 0.00 N ATOM 1465 CZ ARG B 77 13.157 -11.032 -1.286 1.00 0.00 C ATOM 1466 NH1 ARG B 77 12.213 -11.526 -2.076 1.00 0.00 N ATOM 1467 NH2 ARG B 77 14.427 -11.345 -1.504 1.00 0.00 N ATOM 0 H ARG B 77 7.405 -7.804 1.644 1.00 0.00 H new ATOM 0 HA ARG B 77 10.186 -6.785 1.451 1.00 0.00 H new ATOM 0 HB2 ARG B 77 9.793 -8.873 2.852 1.00 0.00 H new ATOM 0 HB3 ARG B 77 9.251 -9.670 1.389 1.00 0.00 H new ATOM 0 HG2 ARG B 77 11.960 -8.332 1.484 1.00 0.00 H new ATOM 0 HG3 ARG B 77 11.737 -9.935 2.156 1.00 0.00 H new ATOM 0 HD2 ARG B 77 10.807 -10.696 -0.045 1.00 0.00 H new ATOM 0 HD3 ARG B 77 11.120 -9.103 -0.705 1.00 0.00 H new ATOM 0 HE ARG B 77 13.584 -9.867 0.310 1.00 0.00 H new ATOM 0 HH11 ARG B 77 11.235 -11.288 -1.912 1.00 0.00 H new ATOM 0 HH12 ARG B 77 12.465 -12.143 -2.848 1.00 0.00 H new ATOM 0 HH21 ARG B 77 15.156 -10.968 -0.899 1.00 0.00 H new ATOM 0 HH22 ARG B 77 14.675 -11.963 -2.277 1.00 0.00 H new ATOM 1481 N VAL B 78 10.240 -7.005 -1.017 1.00 0.00 N ATOM 1482 CA VAL B 78 10.212 -6.995 -2.473 1.00 0.00 C ATOM 1483 C VAL B 78 10.531 -8.376 -3.040 1.00 0.00 C ATOM 1484 O VAL B 78 11.640 -8.885 -2.876 1.00 0.00 O ATOM 1485 CB VAL B 78 11.205 -5.966 -3.040 1.00 0.00 C ATOM 1486 CG1 VAL B 78 11.030 -5.821 -4.544 1.00 0.00 C ATOM 1487 CG2 VAL B 78 11.025 -4.627 -2.342 1.00 0.00 C ATOM 0 H VAL B 78 11.033 -6.511 -0.607 1.00 0.00 H new ATOM 0 HA VAL B 78 9.202 -6.715 -2.773 1.00 0.00 H new ATOM 0 HB VAL B 78 12.219 -6.320 -2.854 1.00 0.00 H new ATOM 0 HG11 VAL B 78 11.742 -5.088 -4.924 1.00 0.00 H new ATOM 0 HG12 VAL B 78 11.207 -6.783 -5.025 1.00 0.00 H new ATOM 0 HG13 VAL B 78 10.015 -5.488 -4.762 1.00 0.00 H new ATOM 0 HG21 VAL B 78 11.733 -3.906 -2.751 1.00 0.00 H new ATOM 0 HG22 VAL B 78 10.008 -4.268 -2.501 1.00 0.00 H new ATOM 0 HG23 VAL B 78 11.205 -4.747 -1.274 1.00 0.00 H new ATOM 1497 N ALA B 79 9.550 -8.973 -3.713 1.00 0.00 N ATOM 1498 CA ALA B 79 9.721 -10.301 -4.294 1.00 0.00 C ATOM 1499 C ALA B 79 9.894 -10.244 -5.811 1.00 0.00 C ATOM 1500 O ALA B 79 10.470 -11.152 -6.408 1.00 0.00 O ATOM 1501 CB ALA B 79 8.537 -11.188 -3.932 1.00 0.00 C ATOM 0 H ALA B 79 8.631 -8.559 -3.869 1.00 0.00 H new ATOM 0 HA ALA B 79 10.633 -10.727 -3.877 1.00 0.00 H new ATOM 0 HB1 ALA B 79 8.675 -12.176 -4.371 1.00 0.00 H new ATOM 0 HB2 ALA B 79 8.468 -11.279 -2.848 1.00 0.00 H new ATOM 0 HB3 ALA B 79 7.619 -10.745 -4.318 1.00 0.00 H new ATOM 1507 N ALA B 80 9.396 -9.177 -6.430 1.00 0.00 N ATOM 1508 CA ALA B 80 9.503 -9.027 -7.879 1.00 0.00 C ATOM 1509 C ALA B 80 9.312 -7.582 -8.310 1.00 0.00 C ATOM 1510 O ALA B 80 9.086 -6.696 -7.485 1.00 0.00 O ATOM 1511 CB ALA B 80 8.492 -9.915 -8.585 1.00 0.00 C ATOM 0 H ALA B 80 8.919 -8.410 -5.957 1.00 0.00 H new ATOM 0 HA ALA B 80 10.510 -9.334 -8.163 1.00 0.00 H new ATOM 0 HB1 ALA B 80 8.588 -9.789 -9.663 1.00 0.00 H new ATOM 0 HB2 ALA B 80 8.678 -10.957 -8.324 1.00 0.00 H new ATOM 0 HB3 ALA B 80 7.485 -9.637 -8.275 1.00 0.00 H new ATOM 1517 N SER B 81 9.408 -7.355 -9.615 1.00 0.00 N ATOM 1518 CA SER B 81 9.253 -6.027 -10.180 1.00 0.00 C ATOM 1519 C SER B 81 7.782 -5.705 -10.425 1.00 0.00 C ATOM 1520 O SER B 81 6.893 -6.427 -9.974 1.00 0.00 O ATOM 1521 CB SER B 81 10.030 -5.930 -11.486 1.00 0.00 C ATOM 1522 OG SER B 81 9.251 -6.377 -12.582 1.00 0.00 O ATOM 0 H SER B 81 9.594 -8.083 -10.304 1.00 0.00 H new ATOM 0 HA SER B 81 9.646 -5.302 -9.468 1.00 0.00 H new ATOM 0 HB2 SER B 81 10.338 -4.898 -11.653 1.00 0.00 H new ATOM 0 HB3 SER B 81 10.939 -6.527 -11.416 1.00 0.00 H new ATOM 0 HG SER B 81 9.774 -6.302 -13.407 1.00 0.00 H new ATOM 1528 N GLY B 82 7.542 -4.619 -11.148 1.00 0.00 N ATOM 1529 CA GLY B 82 6.183 -4.206 -11.449 1.00 0.00 C ATOM 1530 C GLY B 82 5.823 -2.882 -10.809 1.00 0.00 C ATOM 1531 O GLY B 82 6.420 -2.483 -9.810 1.00 0.00 O ATOM 0 H GLY B 82 8.267 -4.014 -11.533 1.00 0.00 H new ATOM 0 HA2 GLY B 82 6.061 -4.128 -12.529 1.00 0.00 H new ATOM 0 HA3 GLY B 82 5.489 -4.973 -11.104 1.00 0.00 H new ATOM 1535 N ASP B 83 4.842 -2.198 -11.390 1.00 0.00 N ATOM 1536 CA ASP B 83 4.396 -0.912 -10.877 1.00 0.00 C ATOM 1537 C ASP B 83 3.193 -1.082 -9.952 1.00 0.00 C ATOM 1538 O ASP B 83 2.362 -1.967 -10.156 1.00 0.00 O ATOM 1539 CB ASP B 83 4.036 0.010 -12.039 1.00 0.00 C ATOM 1540 CG ASP B 83 3.051 -0.627 -13.000 1.00 0.00 C ATOM 1541 OD1 ASP B 83 1.829 -0.477 -12.784 1.00 0.00 O ATOM 1542 OD2 ASP B 83 3.500 -1.274 -13.970 1.00 0.00 O ATOM 0 H ASP B 83 4.341 -2.516 -12.219 1.00 0.00 H new ATOM 0 HA ASP B 83 5.208 -0.469 -10.301 1.00 0.00 H new ATOM 0 HB2 ASP B 83 3.611 0.934 -11.647 1.00 0.00 H new ATOM 0 HB3 ASP B 83 4.943 0.280 -12.579 1.00 0.00 H new ATOM 1547 N ASP B 84 3.107 -0.227 -8.939 1.00 0.00 N ATOM 1548 CA ASP B 84 2.005 -0.283 -7.985 1.00 0.00 C ATOM 1549 C ASP B 84 1.944 0.995 -7.152 1.00 0.00 C ATOM 1550 O ASP B 84 2.745 1.912 -7.346 1.00 0.00 O ATOM 1551 CB ASP B 84 2.157 -1.501 -7.071 1.00 0.00 C ATOM 1552 CG ASP B 84 0.844 -1.923 -6.440 1.00 0.00 C ATOM 1553 OD1 ASP B 84 0.507 -1.395 -5.362 1.00 0.00 O ATOM 1554 OD2 ASP B 84 0.155 -2.782 -7.029 1.00 0.00 O ATOM 0 H ASP B 84 3.786 0.512 -8.757 1.00 0.00 H new ATOM 0 HA ASP B 84 1.074 -0.374 -8.544 1.00 0.00 H new ATOM 0 HB2 ASP B 84 2.564 -2.333 -7.645 1.00 0.00 H new ATOM 0 HB3 ASP B 84 2.877 -1.273 -6.285 1.00 0.00 H new ATOM 1559 N ARG B 85 0.996 1.051 -6.223 1.00 0.00 N ATOM 1560 CA ARG B 85 0.832 2.220 -5.366 1.00 0.00 C ATOM 1561 C ARG B 85 0.127 1.848 -4.065 1.00 0.00 C ATOM 1562 O ARG B 85 -1.046 1.470 -4.071 1.00 0.00 O ATOM 1563 CB ARG B 85 0.038 3.302 -6.096 1.00 0.00 C ATOM 1564 CG ARG B 85 -0.179 4.558 -5.270 1.00 0.00 C ATOM 1565 CD ARG B 85 -0.997 5.592 -6.029 1.00 0.00 C ATOM 1566 NE ARG B 85 -0.348 5.999 -7.270 1.00 0.00 N ATOM 1567 CZ ARG B 85 -0.872 6.872 -8.124 1.00 0.00 C ATOM 1568 NH1 ARG B 85 -2.048 7.430 -7.871 1.00 0.00 N ATOM 1569 NH2 ARG B 85 -0.219 7.190 -9.233 1.00 0.00 N ATOM 0 H ARG B 85 0.329 0.300 -6.044 1.00 0.00 H new ATOM 0 HA ARG B 85 1.823 2.604 -5.124 1.00 0.00 H new ATOM 0 HB2 ARG B 85 0.561 3.567 -7.015 1.00 0.00 H new ATOM 0 HB3 ARG B 85 -0.931 2.896 -6.387 1.00 0.00 H new ATOM 0 HG2 ARG B 85 -0.688 4.300 -4.341 1.00 0.00 H new ATOM 0 HG3 ARG B 85 0.786 4.986 -4.996 1.00 0.00 H new ATOM 0 HD2 ARG B 85 -1.982 5.182 -6.253 1.00 0.00 H new ATOM 0 HD3 ARG B 85 -1.152 6.467 -5.397 1.00 0.00 H new ATOM 0 HE ARG B 85 0.559 5.591 -7.495 1.00 0.00 H new ATOM 0 HH11 ARG B 85 -2.554 7.190 -7.018 1.00 0.00 H new ATOM 0 HH12 ARG B 85 -2.447 8.100 -8.529 1.00 0.00 H new ATOM 0 HH21 ARG B 85 0.687 6.764 -9.431 1.00 0.00 H new ATOM 0 HH22 ARG B 85 -0.622 7.860 -9.888 1.00 0.00 H new ATOM 1583 N LEU B 86 0.844 1.959 -2.951 1.00 0.00 N ATOM 1584 CA LEU B 86 0.278 1.638 -1.645 1.00 0.00 C ATOM 1585 C LEU B 86 -0.896 2.555 -1.323 1.00 0.00 C ATOM 1586 O LEU B 86 -0.850 3.756 -1.594 1.00 0.00 O ATOM 1587 CB LEU B 86 1.350 1.750 -0.556 1.00 0.00 C ATOM 1588 CG LEU B 86 1.851 0.413 -0.003 1.00 0.00 C ATOM 1589 CD1 LEU B 86 2.997 0.633 0.969 1.00 0.00 C ATOM 1590 CD2 LEU B 86 0.722 -0.342 0.676 1.00 0.00 C ATOM 0 H LEU B 86 1.816 2.268 -2.926 1.00 0.00 H new ATOM 0 HA LEU B 86 -0.086 0.611 -1.676 1.00 0.00 H new ATOM 0 HB2 LEU B 86 2.200 2.301 -0.959 1.00 0.00 H new ATOM 0 HB3 LEU B 86 0.949 2.340 0.268 1.00 0.00 H new ATOM 0 HG LEU B 86 2.215 -0.186 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU B 86 3.339 -0.329 1.351 1.00 0.00 H new ATOM 0 HD12 LEU B 86 3.818 1.133 0.456 1.00 0.00 H new ATOM 0 HD13 LEU B 86 2.657 1.253 1.798 1.00 0.00 H new ATOM 0 HD21 LEU B 86 1.098 -1.289 1.062 1.00 0.00 H new ATOM 0 HD22 LEU B 86 0.329 0.255 1.499 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -0.072 -0.534 -0.045 1.00 0.00 H new ATOM 1602 N GLU B 87 -1.949 1.984 -0.745 1.00 0.00 N ATOM 1603 CA GLU B 87 -3.140 2.752 -0.395 1.00 0.00 C ATOM 1604 C GLU B 87 -3.683 2.331 0.967 1.00 0.00 C ATOM 1605 O GLU B 87 -4.103 1.189 1.154 1.00 0.00 O ATOM 1606 CB GLU B 87 -4.222 2.573 -1.462 1.00 0.00 C ATOM 1607 CG GLU B 87 -3.768 2.953 -2.862 1.00 0.00 C ATOM 1608 CD GLU B 87 -4.927 3.137 -3.822 1.00 0.00 C ATOM 1609 OE1 GLU B 87 -5.432 4.274 -3.932 1.00 0.00 O ATOM 1610 OE2 GLU B 87 -5.331 2.145 -4.465 1.00 0.00 O ATOM 0 H GLU B 87 -2.002 0.993 -0.509 1.00 0.00 H new ATOM 0 HA GLU B 87 -2.857 3.803 -0.344 1.00 0.00 H new ATOM 0 HB2 GLU B 87 -4.548 1.533 -1.465 1.00 0.00 H new ATOM 0 HB3 GLU B 87 -5.088 3.178 -1.194 1.00 0.00 H new ATOM 0 HG2 GLU B 87 -3.191 3.876 -2.814 1.00 0.00 H new ATOM 0 HG3 GLU B 87 -3.102 2.180 -3.246 1.00 0.00 H new ATOM 1617 N LEU B 88 -3.671 3.263 1.917 1.00 0.00 N ATOM 1618 CA LEU B 88 -4.167 2.993 3.263 1.00 0.00 C ATOM 1619 C LEU B 88 -5.096 4.108 3.730 1.00 0.00 C ATOM 1620 O LEU B 88 -4.698 5.271 3.803 1.00 0.00 O ATOM 1621 CB LEU B 88 -3.003 2.850 4.248 1.00 0.00 C ATOM 1622 CG LEU B 88 -2.026 1.710 3.948 1.00 0.00 C ATOM 1623 CD1 LEU B 88 -0.998 2.143 2.914 1.00 0.00 C ATOM 1624 CD2 LEU B 88 -1.338 1.250 5.225 1.00 0.00 C ATOM 0 H LEU B 88 -3.323 4.212 1.779 1.00 0.00 H new ATOM 0 HA LEU B 88 -4.725 2.057 3.232 1.00 0.00 H new ATOM 0 HB2 LEU B 88 -2.447 3.787 4.266 1.00 0.00 H new ATOM 0 HB3 LEU B 88 -3.411 2.703 5.248 1.00 0.00 H new ATOM 0 HG LEU B 88 -2.591 0.872 3.539 1.00 0.00 H new ATOM 0 HD11 LEU B 88 -0.313 1.319 2.715 1.00 0.00 H new ATOM 0 HD12 LEU B 88 -1.506 2.424 1.991 1.00 0.00 H new ATOM 0 HD13 LEU B 88 -0.437 2.997 3.294 1.00 0.00 H new ATOM 0 HD21 LEU B 88 -0.647 0.439 4.994 1.00 0.00 H new ATOM 0 HD22 LEU B 88 -0.787 2.083 5.662 1.00 0.00 H new ATOM 0 HD23 LEU B 88 -2.086 0.898 5.935 1.00 0.00 H new ATOM 1636 N VAL B 89 -6.337 3.750 4.050 1.00 0.00 N ATOM 1637 CA VAL B 89 -7.316 4.726 4.515 1.00 0.00 C ATOM 1638 C VAL B 89 -7.743 4.436 5.952 1.00 0.00 C ATOM 1639 O VAL B 89 -7.936 3.282 6.331 1.00 0.00 O ATOM 1640 CB VAL B 89 -8.558 4.756 3.605 1.00 0.00 C ATOM 1641 CG1 VAL B 89 -8.162 5.063 2.169 1.00 0.00 C ATOM 1642 CG2 VAL B 89 -9.321 3.441 3.683 1.00 0.00 C ATOM 0 H VAL B 89 -6.687 2.793 3.996 1.00 0.00 H new ATOM 0 HA VAL B 89 -6.833 5.703 4.478 1.00 0.00 H new ATOM 0 HB VAL B 89 -9.217 5.550 3.957 1.00 0.00 H new ATOM 0 HG11 VAL B 89 -9.053 5.080 1.542 1.00 0.00 H new ATOM 0 HG12 VAL B 89 -7.670 6.035 2.127 1.00 0.00 H new ATOM 0 HG13 VAL B 89 -7.478 4.295 1.808 1.00 0.00 H new ATOM 0 HG21 VAL B 89 -10.194 3.487 3.032 1.00 0.00 H new ATOM 0 HG22 VAL B 89 -8.673 2.625 3.364 1.00 0.00 H new ATOM 0 HG23 VAL B 89 -9.644 3.268 4.710 1.00 0.00 H new ATOM 1652 N TYR B 90 -7.884 5.492 6.746 1.00 0.00 N ATOM 1653 CA TYR B 90 -8.277 5.354 8.147 1.00 0.00 C ATOM 1654 C TYR B 90 -9.794 5.317 8.288 1.00 0.00 C ATOM 1655 O TYR B 90 -10.470 6.326 8.090 1.00 0.00 O ATOM 1656 CB TYR B 90 -7.702 6.514 8.964 1.00 0.00 C ATOM 1657 CG TYR B 90 -7.665 6.272 10.457 1.00 0.00 C ATOM 1658 CD1 TYR B 90 -8.127 7.236 11.344 1.00 0.00 C ATOM 1659 CD2 TYR B 90 -7.158 5.089 10.979 1.00 0.00 C ATOM 1660 CE1 TYR B 90 -8.085 7.026 12.710 1.00 0.00 C ATOM 1661 CE2 TYR B 90 -7.112 4.871 12.342 1.00 0.00 C ATOM 1662 CZ TYR B 90 -7.576 5.843 13.203 1.00 0.00 C ATOM 1663 OH TYR B 90 -7.533 5.630 14.562 1.00 0.00 O ATOM 0 H TYR B 90 -7.732 6.455 6.445 1.00 0.00 H new ATOM 0 HA TYR B 90 -7.878 4.413 8.525 1.00 0.00 H new ATOM 0 HB2 TYR B 90 -6.689 6.720 8.617 1.00 0.00 H new ATOM 0 HB3 TYR B 90 -8.294 7.408 8.768 1.00 0.00 H new ATOM 0 HD1 TYR B 90 -8.525 8.164 10.961 1.00 0.00 H new ATOM 0 HD2 TYR B 90 -6.793 4.326 10.307 1.00 0.00 H new ATOM 0 HE1 TYR B 90 -8.449 7.784 13.387 1.00 0.00 H new ATOM 0 HE2 TYR B 90 -6.715 3.945 12.731 1.00 0.00 H new ATOM 0 HH TYR B 90 -7.822 4.715 14.759 1.00 0.00 H new ATOM 1673 N ARG B 91 -10.323 4.146 8.633 1.00 0.00 N ATOM 1674 CA ARG B 91 -11.762 3.977 8.802 1.00 0.00 C ATOM 1675 C ARG B 91 -12.078 2.648 9.480 1.00 0.00 C ATOM 1676 O ARG B 91 -11.276 1.713 9.439 1.00 0.00 O ATOM 1677 CB ARG B 91 -12.468 4.048 7.447 1.00 0.00 C ATOM 1678 CG ARG B 91 -11.944 3.046 6.435 1.00 0.00 C ATOM 1679 CD ARG B 91 -12.735 3.099 5.139 1.00 0.00 C ATOM 1680 NE ARG B 91 -14.111 2.641 5.321 1.00 0.00 N ATOM 1681 CZ ARG B 91 -14.899 2.260 4.323 1.00 0.00 C ATOM 1682 NH1 ARG B 91 -14.455 2.287 3.073 1.00 0.00 N ATOM 1683 NH2 ARG B 91 -16.136 1.853 4.571 1.00 0.00 N ATOM 0 H ARG B 91 -9.777 3.301 8.801 1.00 0.00 H new ATOM 0 HA ARG B 91 -12.124 4.785 9.437 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -13.535 3.880 7.593 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -12.357 5.053 7.041 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -10.893 3.250 6.230 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -11.998 2.041 6.855 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -12.740 4.120 4.758 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -12.243 2.481 4.388 1.00 0.00 H new ATOM 0 HE ARG B 91 -14.487 2.613 6.269 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -13.505 2.601 2.876 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -15.064 1.993 2.309 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -16.484 1.832 5.530 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -16.740 1.561 3.803 1.00 0.00 H new ATOM 1697 N ARG B 92 -13.249 2.571 10.104 1.00 0.00 N ATOM 1698 CA ARG B 92 -13.672 1.356 10.788 1.00 0.00 C ATOM 1699 C ARG B 92 -13.856 0.212 9.786 1.00 0.00 C ATOM 1700 O ARG B 92 -14.597 0.347 8.813 1.00 0.00 O ATOM 1701 CB ARG B 92 -14.975 1.607 11.551 1.00 0.00 C ATOM 1702 CG ARG B 92 -14.840 2.656 12.645 1.00 0.00 C ATOM 1703 CD ARG B 92 -16.183 2.976 13.284 1.00 0.00 C ATOM 1704 NE ARG B 92 -16.078 4.041 14.279 1.00 0.00 N ATOM 1705 CZ ARG B 92 -17.129 4.618 14.854 1.00 0.00 C ATOM 1706 NH1 ARG B 92 -18.357 4.236 14.535 1.00 0.00 N ATOM 1707 NH2 ARG B 92 -16.950 5.578 15.753 1.00 0.00 N ATOM 0 H ARG B 92 -13.922 3.336 10.150 1.00 0.00 H new ATOM 0 HA ARG B 92 -12.897 1.070 11.499 1.00 0.00 H new ATOM 0 HB2 ARG B 92 -15.745 1.923 10.847 1.00 0.00 H new ATOM 0 HB3 ARG B 92 -15.314 0.671 11.995 1.00 0.00 H new ATOM 0 HG2 ARG B 92 -14.149 2.299 13.409 1.00 0.00 H new ATOM 0 HG3 ARG B 92 -14.410 3.566 12.226 1.00 0.00 H new ATOM 0 HD2 ARG B 92 -16.891 3.272 12.510 1.00 0.00 H new ATOM 0 HD3 ARG B 92 -16.583 2.078 13.755 1.00 0.00 H new ATOM 0 HE ARG B 92 -15.147 4.359 14.547 1.00 0.00 H new ATOM 0 HH11 ARG B 92 -18.499 3.497 13.846 1.00 0.00 H new ATOM 0 HH12 ARG B 92 -19.161 4.681 14.978 1.00 0.00 H new ATOM 0 HH21 ARG B 92 -16.006 5.873 16.003 1.00 0.00 H new ATOM 0 HH22 ARG B 92 -17.756 6.021 16.194 1.00 0.00 H new ATOM 1721 N PRO B 93 -13.180 -0.933 10.011 1.00 0.00 N ATOM 1722 CA PRO B 93 -13.260 -2.094 9.113 1.00 0.00 C ATOM 1723 C PRO B 93 -14.658 -2.705 9.042 1.00 0.00 C ATOM 1724 O PRO B 93 -15.021 -3.318 8.038 1.00 0.00 O ATOM 1725 CB PRO B 93 -12.274 -3.100 9.725 1.00 0.00 C ATOM 1726 CG PRO B 93 -11.413 -2.299 10.639 1.00 0.00 C ATOM 1727 CD PRO B 93 -12.284 -1.191 11.150 1.00 0.00 C ATOM 0 HA PRO B 93 -13.027 -1.811 8.087 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -12.800 -3.886 10.268 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -11.680 -3.589 8.953 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -11.037 -2.911 11.459 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -10.545 -1.903 10.112 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -12.837 -1.489 12.041 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -11.702 -0.308 11.416 1.00 0.00 H new ATOM 1735 N TRP B 94 -15.439 -2.539 10.104 1.00 0.00 N ATOM 1736 CA TRP B 94 -16.791 -3.092 10.147 1.00 0.00 C ATOM 1737 C TRP B 94 -17.784 -2.200 9.405 1.00 0.00 C ATOM 1738 O TRP B 94 -18.994 -2.304 9.610 1.00 0.00 O ATOM 1739 CB TRP B 94 -17.242 -3.290 11.597 1.00 0.00 C ATOM 1740 CG TRP B 94 -17.147 -2.049 12.431 1.00 0.00 C ATOM 1741 CD1 TRP B 94 -17.976 -0.966 12.385 1.00 0.00 C ATOM 1742 CD2 TRP B 94 -16.171 -1.767 13.438 1.00 0.00 C ATOM 1743 NE1 TRP B 94 -17.572 -0.026 13.299 1.00 0.00 N ATOM 1744 CE2 TRP B 94 -16.466 -0.494 13.959 1.00 0.00 C ATOM 1745 CE3 TRP B 94 -15.073 -2.466 13.951 1.00 0.00 C ATOM 1746 CZ2 TRP B 94 -15.706 0.094 14.965 1.00 0.00 C ATOM 1747 CZ3 TRP B 94 -14.321 -1.882 14.952 1.00 0.00 C ATOM 1748 CH2 TRP B 94 -14.639 -0.612 15.449 1.00 0.00 C ATOM 0 H TRP B 94 -15.163 -2.029 10.943 1.00 0.00 H new ATOM 0 HA TRP B 94 -16.768 -4.060 9.646 1.00 0.00 H new ATOM 0 HB2 TRP B 94 -18.273 -3.643 11.603 1.00 0.00 H new ATOM 0 HB3 TRP B 94 -16.635 -4.072 12.054 1.00 0.00 H new ATOM 0 HD1 TRP B 94 -18.825 -0.864 11.726 1.00 0.00 H new ATOM 0 HE1 TRP B 94 -18.022 0.875 13.461 1.00 0.00 H new ATOM 0 HE3 TRP B 94 -14.818 -3.444 13.571 1.00 0.00 H new ATOM 0 HZ2 TRP B 94 -15.950 1.073 15.350 1.00 0.00 H new ATOM 0 HZ3 TRP B 94 -13.473 -2.414 15.358 1.00 0.00 H new ATOM 0 HH2 TRP B 94 -14.030 -0.181 16.230 1.00 0.00 H new ATOM 1759 N GLU B 95 -17.272 -1.329 8.542 1.00 0.00 N ATOM 1760 CA GLU B 95 -18.123 -0.429 7.770 1.00 0.00 C ATOM 1761 C GLU B 95 -18.386 -0.986 6.375 1.00 0.00 C ATOM 1762 O GLU B 95 -17.789 -1.986 5.972 1.00 0.00 O ATOM 1763 CB GLU B 95 -17.482 0.956 7.662 1.00 0.00 C ATOM 1764 CG GLU B 95 -17.461 1.720 8.971 1.00 0.00 C ATOM 1765 CD GLU B 95 -16.886 3.114 8.823 1.00 0.00 C ATOM 1766 OE1 GLU B 95 -17.674 4.064 8.621 1.00 0.00 O ATOM 1767 OE2 GLU B 95 -15.650 3.259 8.910 1.00 0.00 O ATOM 0 H GLU B 95 -16.274 -1.227 8.359 1.00 0.00 H new ATOM 0 HA GLU B 95 -19.075 -0.341 8.294 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -16.460 0.847 7.299 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -18.024 1.541 6.919 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -18.476 1.789 9.363 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -16.874 1.165 9.702 1.00 0.00 H new ATOM 1774 N LYS B 96 -19.284 -0.337 5.644 1.00 0.00 N ATOM 1775 CA LYS B 96 -19.629 -0.763 4.294 1.00 0.00 C ATOM 1776 C LYS B 96 -19.521 0.406 3.317 1.00 0.00 C ATOM 1777 O LYS B 96 -20.456 1.194 3.177 1.00 0.00 O ATOM 1778 CB LYS B 96 -21.044 -1.346 4.269 1.00 0.00 C ATOM 1779 CG LYS B 96 -21.397 -2.054 2.970 1.00 0.00 C ATOM 1780 CD LYS B 96 -20.514 -3.270 2.737 1.00 0.00 C ATOM 1781 CE LYS B 96 -20.877 -3.983 1.443 1.00 0.00 C ATOM 1782 NZ LYS B 96 -20.024 -5.181 1.211 1.00 0.00 N ATOM 0 H LYS B 96 -19.788 0.489 5.965 1.00 0.00 H new ATOM 0 HA LYS B 96 -18.925 -1.536 3.985 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -21.151 -2.049 5.095 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -21.760 -0.542 4.439 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -22.442 -2.362 2.995 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -21.289 -1.360 2.136 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -19.469 -2.961 2.703 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -20.615 -3.960 3.575 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -21.924 -4.284 1.476 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -20.769 -3.293 0.606 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -20.303 -5.638 0.320 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -19.027 -4.891 1.154 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -20.146 -5.851 1.997 1.00 0.00 H new ATOM 1796 N ASP B 97 -18.370 0.503 2.649 1.00 0.00 N ATOM 1797 CA ASP B 97 -18.107 1.574 1.685 1.00 0.00 C ATOM 1798 C ASP B 97 -18.620 2.922 2.188 1.00 0.00 C ATOM 1799 O ASP B 97 -19.740 3.330 1.882 1.00 0.00 O ATOM 1800 CB ASP B 97 -18.715 1.245 0.316 1.00 0.00 C ATOM 1801 CG ASP B 97 -20.187 0.883 0.385 1.00 0.00 C ATOM 1802 OD1 ASP B 97 -20.495 -0.321 0.503 1.00 0.00 O ATOM 1803 OD2 ASP B 97 -21.031 1.800 0.317 1.00 0.00 O ATOM 0 H ASP B 97 -17.598 -0.154 2.760 1.00 0.00 H new ATOM 0 HA ASP B 97 -17.025 1.649 1.573 1.00 0.00 H new ATOM 0 HB2 ASP B 97 -18.589 2.102 -0.345 1.00 0.00 H new ATOM 0 HB3 ASP B 97 -18.164 0.416 -0.129 1.00 0.00 H new ATOM 1808 N ALA B 98 -17.788 3.608 2.965 1.00 0.00 N ATOM 1809 CA ALA B 98 -18.149 4.911 3.513 1.00 0.00 C ATOM 1810 C ALA B 98 -16.960 5.866 3.469 1.00 0.00 C ATOM 1811 O ALA B 98 -15.885 5.512 2.985 1.00 0.00 O ATOM 1812 CB ALA B 98 -18.657 4.761 4.938 1.00 0.00 C ATOM 0 H ALA B 98 -16.858 3.283 3.230 1.00 0.00 H new ATOM 0 HA ALA B 98 -18.946 5.332 2.900 1.00 0.00 H new ATOM 0 HB1 ALA B 98 -18.923 5.741 5.335 1.00 0.00 H new ATOM 0 HB2 ALA B 98 -19.536 4.116 4.945 1.00 0.00 H new ATOM 0 HB3 ALA B 98 -17.877 4.318 5.558 1.00 0.00 H new ATOM 1818 N GLU B 99 -17.160 7.078 3.976 1.00 0.00 N ATOM 1819 CA GLU B 99 -16.102 8.081 3.992 1.00 0.00 C ATOM 1820 C GLU B 99 -15.191 7.900 5.206 1.00 0.00 C ATOM 1821 O GLU B 99 -15.669 7.742 6.329 1.00 0.00 O ATOM 1822 CB GLU B 99 -16.699 9.488 3.991 1.00 0.00 C ATOM 1823 CG GLU B 99 -17.285 9.890 2.652 1.00 0.00 C ATOM 1824 CD GLU B 99 -17.742 11.336 2.623 1.00 0.00 C ATOM 1825 OE1 GLU B 99 -18.917 11.593 2.957 1.00 0.00 O ATOM 1826 OE2 GLU B 99 -16.923 12.210 2.271 1.00 0.00 O ATOM 0 H GLU B 99 -18.043 7.389 4.380 1.00 0.00 H new ATOM 0 HA GLU B 99 -15.503 7.950 3.091 1.00 0.00 H new ATOM 0 HB2 GLU B 99 -17.477 9.546 4.752 1.00 0.00 H new ATOM 0 HB3 GLU B 99 -15.926 10.203 4.271 1.00 0.00 H new ATOM 0 HG2 GLU B 99 -16.540 9.733 1.872 1.00 0.00 H new ATOM 0 HG3 GLU B 99 -18.130 9.242 2.420 1.00 0.00 H new ATOM 1833 N PRO B 100 -13.862 7.919 4.992 1.00 0.00 N ATOM 1834 CA PRO B 100 -12.883 7.753 6.052 1.00 0.00 C ATOM 1835 C PRO B 100 -12.387 9.084 6.608 1.00 0.00 C ATOM 1836 O PRO B 100 -12.759 10.150 6.119 1.00 0.00 O ATOM 1837 CB PRO B 100 -11.754 7.020 5.330 1.00 0.00 C ATOM 1838 CG PRO B 100 -11.828 7.486 3.905 1.00 0.00 C ATOM 1839 CD PRO B 100 -13.199 8.093 3.693 1.00 0.00 C ATOM 0 HA PRO B 100 -13.286 7.229 6.918 1.00 0.00 H new ATOM 0 HB2 PRO B 100 -10.786 7.256 5.771 1.00 0.00 H new ATOM 0 HB3 PRO B 100 -11.880 5.939 5.398 1.00 0.00 H new ATOM 0 HG2 PRO B 100 -11.048 8.220 3.701 1.00 0.00 H new ATOM 0 HG3 PRO B 100 -11.668 6.653 3.221 1.00 0.00 H new ATOM 0 HD2 PRO B 100 -13.132 9.145 3.415 1.00 0.00 H new ATOM 0 HD3 PRO B 100 -13.742 7.586 2.895 1.00 0.00 H new ATOM 1847 N ALA B 101 -11.545 9.011 7.634 1.00 0.00 N ATOM 1848 CA ALA B 101 -10.990 10.207 8.256 1.00 0.00 C ATOM 1849 C ALA B 101 -9.683 10.609 7.582 1.00 0.00 C ATOM 1850 O ALA B 101 -9.570 11.704 7.027 1.00 0.00 O ATOM 1851 CB ALA B 101 -10.770 9.975 9.744 1.00 0.00 C ATOM 0 H ALA B 101 -11.232 8.135 8.052 1.00 0.00 H new ATOM 0 HA ALA B 101 -11.703 11.021 8.131 1.00 0.00 H new ATOM 0 HB1 ALA B 101 -10.355 10.876 10.195 1.00 0.00 H new ATOM 0 HB2 ALA B 101 -11.721 9.736 10.219 1.00 0.00 H new ATOM 0 HB3 ALA B 101 -10.076 9.147 9.884 1.00 0.00 H new ATOM 1857 N GLU B 102 -8.698 9.716 7.632 1.00 0.00 N ATOM 1858 CA GLU B 102 -7.400 9.971 7.019 1.00 0.00 C ATOM 1859 C GLU B 102 -7.293 9.285 5.665 1.00 0.00 C ATOM 1860 O GLU B 102 -8.264 8.717 5.164 1.00 0.00 O ATOM 1861 CB GLU B 102 -6.273 9.482 7.930 1.00 0.00 C ATOM 1862 CG GLU B 102 -5.828 10.504 8.959 1.00 0.00 C ATOM 1863 CD GLU B 102 -4.753 9.971 9.884 1.00 0.00 C ATOM 1864 OE1 GLU B 102 -5.108 9.393 10.933 1.00 0.00 O ATOM 1865 OE2 GLU B 102 -3.557 10.129 9.561 1.00 0.00 O ATOM 0 H GLU B 102 -8.775 8.809 8.092 1.00 0.00 H new ATOM 0 HA GLU B 102 -7.305 11.047 6.875 1.00 0.00 H new ATOM 0 HB2 GLU B 102 -6.602 8.580 8.446 1.00 0.00 H new ATOM 0 HB3 GLU B 102 -5.417 9.203 7.315 1.00 0.00 H new ATOM 0 HG2 GLU B 102 -5.454 11.391 8.447 1.00 0.00 H new ATOM 0 HG3 GLU B 102 -6.689 10.817 9.550 1.00 0.00 H new ATOM 1872 N SER B 103 -6.102 9.344 5.081 1.00 0.00 N ATOM 1873 CA SER B 103 -5.854 8.726 3.785 1.00 0.00 C ATOM 1874 C SER B 103 -4.358 8.647 3.506 1.00 0.00 C ATOM 1875 O SER B 103 -3.583 9.475 3.988 1.00 0.00 O ATOM 1876 CB SER B 103 -6.549 9.507 2.671 1.00 0.00 C ATOM 1877 OG SER B 103 -6.088 10.847 2.622 1.00 0.00 O ATOM 0 H SER B 103 -5.292 9.814 5.485 1.00 0.00 H new ATOM 0 HA SER B 103 -6.262 7.716 3.811 1.00 0.00 H new ATOM 0 HB2 SER B 103 -6.365 9.021 1.713 1.00 0.00 H new ATOM 0 HB3 SER B 103 -7.627 9.496 2.833 1.00 0.00 H new ATOM 0 HG SER B 103 -6.547 11.325 1.900 1.00 0.00 H new ATOM 1883 N PHE B 104 -3.957 7.649 2.728 1.00 0.00 N ATOM 1884 CA PHE B 104 -2.550 7.469 2.392 1.00 0.00 C ATOM 1885 C PHE B 104 -2.388 6.877 0.996 1.00 0.00 C ATOM 1886 O PHE B 104 -3.080 5.929 0.625 1.00 0.00 O ATOM 1887 CB PHE B 104 -1.872 6.567 3.425 1.00 0.00 C ATOM 1888 CG PHE B 104 -0.373 6.542 3.316 1.00 0.00 C ATOM 1889 CD1 PHE B 104 0.392 7.547 3.884 1.00 0.00 C ATOM 1890 CD2 PHE B 104 0.269 5.512 2.649 1.00 0.00 C ATOM 1891 CE1 PHE B 104 1.769 7.528 3.789 1.00 0.00 C ATOM 1892 CE2 PHE B 104 1.648 5.486 2.550 1.00 0.00 C ATOM 1893 CZ PHE B 104 2.399 6.497 3.121 1.00 0.00 C ATOM 0 H PHE B 104 -4.583 6.955 2.320 1.00 0.00 H new ATOM 0 HA PHE B 104 -2.073 8.449 2.403 1.00 0.00 H new ATOM 0 HB2 PHE B 104 -2.149 6.903 4.424 1.00 0.00 H new ATOM 0 HB3 PHE B 104 -2.252 5.552 3.313 1.00 0.00 H new ATOM 0 HD1 PHE B 104 -0.095 8.356 4.408 1.00 0.00 H new ATOM 0 HD2 PHE B 104 -0.314 4.721 2.201 1.00 0.00 H new ATOM 0 HE1 PHE B 104 2.353 8.319 4.237 1.00 0.00 H new ATOM 0 HE2 PHE B 104 2.138 4.677 2.028 1.00 0.00 H new ATOM 0 HZ PHE B 104 3.476 6.480 3.045 1.00 0.00 H new ATOM 1903 N SER B 105 -1.465 7.446 0.225 1.00 0.00 N ATOM 1904 CA SER B 105 -1.197 6.980 -1.130 1.00 0.00 C ATOM 1905 C SER B 105 0.268 7.196 -1.491 1.00 0.00 C ATOM 1906 O SER B 105 0.693 8.322 -1.754 1.00 0.00 O ATOM 1907 CB SER B 105 -2.097 7.708 -2.131 1.00 0.00 C ATOM 1908 OG SER B 105 -1.899 9.109 -2.073 1.00 0.00 O ATOM 0 H SER B 105 -0.888 8.234 0.519 1.00 0.00 H new ATOM 0 HA SER B 105 -1.413 5.912 -1.174 1.00 0.00 H new ATOM 0 HB2 SER B 105 -1.888 7.350 -3.139 1.00 0.00 H new ATOM 0 HB3 SER B 105 -3.141 7.477 -1.920 1.00 0.00 H new ATOM 0 HG SER B 105 -0.949 9.299 -1.927 1.00 0.00 H new ATOM 1914 N CYS B 106 1.038 6.113 -1.497 1.00 0.00 N ATOM 1915 CA CYS B 106 2.457 6.186 -1.816 1.00 0.00 C ATOM 1916 C CYS B 106 2.767 5.445 -3.113 1.00 0.00 C ATOM 1917 O CYS B 106 2.278 4.339 -3.341 1.00 0.00 O ATOM 1918 CB CYS B 106 3.283 5.596 -0.670 1.00 0.00 C ATOM 1919 SG CYS B 106 5.040 6.072 -0.694 1.00 0.00 S ATOM 0 H CYS B 106 0.702 5.174 -1.284 1.00 0.00 H new ATOM 0 HA CYS B 106 2.721 7.235 -1.950 1.00 0.00 H new ATOM 0 HB2 CYS B 106 2.846 5.911 0.278 1.00 0.00 H new ATOM 0 HB3 CYS B 106 3.212 4.509 -0.708 1.00 0.00 H new ATOM 1924 N ALA B 107 3.585 6.065 -3.961 1.00 0.00 N ATOM 1925 CA ALA B 107 3.962 5.464 -5.235 1.00 0.00 C ATOM 1926 C ALA B 107 5.124 4.493 -5.056 1.00 0.00 C ATOM 1927 O ALA B 107 6.103 4.802 -4.378 1.00 0.00 O ATOM 1928 CB ALA B 107 4.325 6.545 -6.242 1.00 0.00 C ATOM 0 H ALA B 107 3.998 6.981 -3.788 1.00 0.00 H new ATOM 0 HA ALA B 107 3.107 4.904 -5.614 1.00 0.00 H new ATOM 0 HB1 ALA B 107 4.604 6.082 -7.188 1.00 0.00 H new ATOM 0 HB2 ALA B 107 3.468 7.200 -6.398 1.00 0.00 H new ATOM 0 HB3 ALA B 107 5.163 7.129 -5.863 1.00 0.00 H new ATOM 1934 N ILE B 108 5.007 3.317 -5.668 1.00 0.00 N ATOM 1935 CA ILE B 108 6.043 2.295 -5.565 1.00 0.00 C ATOM 1936 C ILE B 108 6.177 1.513 -6.868 1.00 0.00 C ATOM 1937 O ILE B 108 5.206 0.942 -7.363 1.00 0.00 O ATOM 1938 CB ILE B 108 5.743 1.303 -4.422 1.00 0.00 C ATOM 1939 CG1 ILE B 108 5.558 2.050 -3.097 1.00 0.00 C ATOM 1940 CG2 ILE B 108 6.861 0.276 -4.307 1.00 0.00 C ATOM 1941 CD1 ILE B 108 5.153 1.154 -1.946 1.00 0.00 C ATOM 0 H ILE B 108 4.206 3.049 -6.240 1.00 0.00 H new ATOM 0 HA ILE B 108 6.977 2.816 -5.355 1.00 0.00 H new ATOM 0 HB ILE B 108 4.815 0.779 -4.651 1.00 0.00 H new ATOM 0 HG12 ILE B 108 6.489 2.556 -2.842 1.00 0.00 H new ATOM 0 HG13 ILE B 108 4.801 2.823 -3.228 1.00 0.00 H new ATOM 0 HG21 ILE B 108 6.636 -0.417 -3.497 1.00 0.00 H new ATOM 0 HG22 ILE B 108 6.946 -0.275 -5.243 1.00 0.00 H new ATOM 0 HG23 ILE B 108 7.802 0.785 -4.099 1.00 0.00 H new ATOM 0 HD11 ILE B 108 5.041 1.752 -1.042 1.00 0.00 H new ATOM 0 HD12 ILE B 108 4.206 0.668 -2.179 1.00 0.00 H new ATOM 0 HD13 ILE B 108 5.920 0.396 -1.787 1.00 0.00 H new ATOM 1953 N GLN B 109 7.387 1.489 -7.415 1.00 0.00 N ATOM 1954 CA GLN B 109 7.652 0.767 -8.655 1.00 0.00 C ATOM 1955 C GLN B 109 8.948 -0.025 -8.545 1.00 0.00 C ATOM 1956 O GLN B 109 9.838 0.335 -7.780 1.00 0.00 O ATOM 1957 CB GLN B 109 7.733 1.737 -9.834 1.00 0.00 C ATOM 1958 CG GLN B 109 6.433 2.481 -10.102 1.00 0.00 C ATOM 1959 CD GLN B 109 6.499 3.334 -11.354 1.00 0.00 C ATOM 1960 OE1 GLN B 109 6.881 4.502 -11.304 1.00 0.00 O ATOM 1961 NE2 GLN B 109 6.124 2.750 -12.486 1.00 0.00 N ATOM 0 H GLN B 109 8.200 1.961 -7.020 1.00 0.00 H new ATOM 0 HA GLN B 109 6.829 0.073 -8.827 1.00 0.00 H new ATOM 0 HB2 GLN B 109 8.524 2.462 -9.643 1.00 0.00 H new ATOM 0 HB3 GLN B 109 8.017 1.184 -10.730 1.00 0.00 H new ATOM 0 HG2 GLN B 109 5.620 1.762 -10.199 1.00 0.00 H new ATOM 0 HG3 GLN B 109 6.198 3.114 -9.247 1.00 0.00 H new ATOM 0 HE21 GLN B 109 5.814 1.778 -12.480 1.00 0.00 H new ATOM 0 HE22 GLN B 109 6.146 3.273 -13.361 1.00 0.00 H new ATOM 1970 N VAL B 110 9.046 -1.112 -9.304 1.00 0.00 N ATOM 1971 CA VAL B 110 10.242 -1.948 -9.284 1.00 0.00 C ATOM 1972 C VAL B 110 10.568 -2.474 -10.674 1.00 0.00 C ATOM 1973 O VAL B 110 9.683 -2.617 -11.520 1.00 0.00 O ATOM 1974 CB VAL B 110 10.083 -3.148 -8.332 1.00 0.00 C ATOM 1975 CG1 VAL B 110 11.410 -3.872 -8.156 1.00 0.00 C ATOM 1976 CG2 VAL B 110 9.537 -2.703 -6.987 1.00 0.00 C ATOM 0 H VAL B 110 8.315 -1.434 -9.938 1.00 0.00 H new ATOM 0 HA VAL B 110 11.055 -1.315 -8.929 1.00 0.00 H new ATOM 0 HB VAL B 110 9.368 -3.840 -8.777 1.00 0.00 H new ATOM 0 HG11 VAL B 110 11.277 -4.717 -7.480 1.00 0.00 H new ATOM 0 HG12 VAL B 110 11.759 -4.233 -9.124 1.00 0.00 H new ATOM 0 HG13 VAL B 110 12.146 -3.186 -7.738 1.00 0.00 H new ATOM 0 HG21 VAL B 110 9.434 -3.568 -6.332 1.00 0.00 H new ATOM 0 HG22 VAL B 110 10.222 -1.986 -6.535 1.00 0.00 H new ATOM 0 HG23 VAL B 110 8.562 -2.235 -7.127 1.00 0.00 H new ATOM 1986 N ARG B 111 11.845 -2.760 -10.902 1.00 0.00 N ATOM 1987 CA ARG B 111 12.299 -3.280 -12.185 1.00 0.00 C ATOM 1988 C ARG B 111 13.788 -3.609 -12.141 1.00 0.00 C ATOM 1989 O ARG B 111 14.602 -2.701 -12.413 1.00 0.00 O ATOM 1990 CB ARG B 111 12.020 -2.275 -13.302 1.00 0.00 C ATOM 1991 CG ARG B 111 12.132 -2.875 -14.685 1.00 0.00 C ATOM 1992 CD ARG B 111 10.966 -3.793 -14.957 1.00 0.00 C ATOM 1993 NE ARG B 111 11.031 -4.395 -16.285 1.00 0.00 N ATOM 1994 CZ ARG B 111 10.100 -5.211 -16.771 1.00 0.00 C ATOM 1995 NH1 ARG B 111 9.036 -5.519 -16.043 1.00 0.00 N ATOM 1996 NH2 ARG B 111 10.232 -5.718 -17.990 1.00 0.00 N ATOM 1997 OXT ARG B 111 14.127 -4.772 -11.834 1.00 0.00 O ATOM 0 H ARG B 111 12.586 -2.640 -10.212 1.00 0.00 H new ATOM 0 HA ARG B 111 11.746 -4.197 -12.390 1.00 0.00 H new ATOM 0 HB2 ARG B 111 11.019 -1.865 -13.171 1.00 0.00 H new ATOM 0 HB3 ARG B 111 12.719 -1.443 -13.216 1.00 0.00 H new ATOM 0 HG2 ARG B 111 12.160 -2.081 -15.431 1.00 0.00 H new ATOM 0 HG3 ARG B 111 13.067 -3.428 -14.773 1.00 0.00 H new ATOM 0 HD2 ARG B 111 10.944 -4.581 -14.204 1.00 0.00 H new ATOM 0 HD3 ARG B 111 10.036 -3.233 -14.860 1.00 0.00 H new ATOM 0 HE ARG B 111 11.835 -4.178 -16.873 1.00 0.00 H new ATOM 0 HH11 ARG B 111 8.929 -5.130 -15.106 1.00 0.00 H new ATOM 0 HH12 ARG B 111 8.324 -6.145 -16.420 1.00 0.00 H new ATOM 0 HH21 ARG B 111 11.048 -5.482 -18.555 1.00 0.00 H new ATOM 0 HH22 ARG B 111 9.518 -6.344 -18.362 1.00 0.00 H new TER 2011 ARG B 111