USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1076 hydrogens (28 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 69 GLN : amide:sc= -3.56 K(o=-3.9,f=-5) USER MOD Set 1.2: A 130 GLN : amide:sc= -0.334 K(o=-3.9,f=-1.2) USER MOD Set 2.1: A 122 THR OG1 : rot -15:sc= 0.812 USER MOD Set 2.2: A 125 ASN : amide:sc= 0 X(o=0.81,f=0.64) USER MOD Set 3.1: A 109 ASN : amide:sc= -0.471 K(o=-0.62,f=0) USER MOD Set 3.2: A 112 LYS NZ :NH3+ -123:sc= -0.145 (180deg=0) USER MOD Set 4.1: A 29 TYR OH : rot 154:sc= 0.488 USER MOD Set 4.2: A 97 THR OG1 : rot 67:sc= 0.623 USER MOD Single : A 6 SER OG : rot -112:sc= 0.644 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 134:sc= -0.448 (180deg=-2.94!) USER MOD Single : A 28 GLN : amide:sc= 0.0459 K(o=0.046,f=-1.8!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 157:sc= -0.0176 (180deg=-0.445) USER MOD Single : A 33 HIS : no HD1:sc= -0.226 K(o=-0.23,f=-6.7!) USER MOD Single : A 38 SER OG : rot 180:sc= -0.754 USER MOD Single : A 47 ASN : amide:sc= -0.0285 K(o=-0.029,f=-1.4) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.339 USER MOD Single : A 54 SER OG : rot 180:sc= -0.811 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.0313 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc=-0.00629 K(o=-0.0063,f=-1.2) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 SER OG : rot 92:sc= 0.584 USER MOD Single : A 70 THR OG1 : rot 180:sc=-0.00169 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -155:sc= 0.247 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.603 USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=0.7) USER MOD Single : A 81 THR OG1 : rot 79:sc=-0.00865 USER MOD Single : A 86 TYR OH : rot -150:sc= 1.18 USER MOD Single : A 87 CYS SG : rot 88:sc=0.000711 USER MOD Single : A 89 HIS : no HE2:sc= -1.76! C(o=-1.6!,f=-2.7!) USER MOD Single : A 90 GLN : amide:sc= -0.332 X(o=-0.33,f=-0.33) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 147:sc= -0.476 (180deg=-2.24!) USER MOD Single : A 108 GLN : amide:sc= -0.143 K(o=-0.14,f=-2.1!) USER MOD Single : A 110 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.114) USER MOD Single : A 111 SER OG : rot -46:sc= 0.511 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 117 GLN : amide:sc= -0.0702 X(o=-0.07,f=0) USER MOD Single : A 124 ASN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-2.4) USER MOD Single : A 129 SER OG : rot -29:sc= 0.396 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PBU O2 : rot -155:sc= 0.0663 USER MOD Single : A 300 PBU O3 : rot -127:sc= 0.965 USER MOD Single : A 300 PBU O6 : rot 39:sc= -0.64 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 8.864 11.461 3.739 1.00 13.00 N ATOM 2 CA GLY A 2 9.596 11.481 2.487 1.00 45.03 C ATOM 3 C GLY A 2 9.244 10.311 1.590 1.00 71.42 C ATOM 4 O GLY A 2 9.208 10.445 0.367 1.00 12.33 O ATOM 0 HA2 GLY A 2 9.386 12.413 1.962 1.00 45.03 H new ATOM 0 HA3 GLY A 2 10.666 11.466 2.695 1.00 45.03 H new ATOM 8 N ALA A 3 8.984 9.158 2.199 1.00 60.11 N ATOM 9 CA ALA A 3 8.633 7.959 1.447 1.00 15.02 C ATOM 10 C ALA A 3 7.614 7.115 2.205 1.00 75.01 C ATOM 11 O ALA A 3 7.911 5.997 2.626 1.00 14.42 O ATOM 12 CB ALA A 3 9.879 7.140 1.146 1.00 44.42 C ATOM 0 H ALA A 3 9.010 9.029 3.210 1.00 60.11 H new ATOM 0 HA ALA A 3 8.181 8.271 0.506 1.00 15.02 H new ATOM 0 HB1 ALA A 3 9.601 6.248 0.584 1.00 44.42 H new ATOM 0 HB2 ALA A 3 10.574 7.738 0.557 1.00 44.42 H new ATOM 0 HB3 ALA A 3 10.356 6.846 2.081 1.00 44.42 H new ATOM 18 N ARG A 4 6.413 7.658 2.377 1.00 60.12 N ATOM 19 CA ARG A 4 5.350 6.955 3.086 1.00 44.20 C ATOM 20 C ARG A 4 4.102 6.836 2.216 1.00 4.44 C ATOM 21 O ARG A 4 3.938 7.575 1.246 1.00 15.23 O ATOM 22 CB ARG A 4 5.011 7.682 4.389 1.00 71.41 C ATOM 23 CG ARG A 4 6.198 7.843 5.324 1.00 24.44 C ATOM 24 CD ARG A 4 5.901 7.277 6.705 1.00 70.04 C ATOM 25 NE ARG A 4 7.119 7.043 7.474 1.00 4.04 N ATOM 26 CZ ARG A 4 7.877 8.018 7.965 1.00 61.01 C ATOM 27 NH1 ARG A 4 7.543 9.286 7.765 1.00 2.32 N ATOM 28 NH2 ARG A 4 8.971 7.726 8.655 1.00 2.04 N ATOM 0 H ARG A 4 6.152 8.583 2.035 1.00 60.12 H new ATOM 0 HA ARG A 4 5.705 5.951 3.320 1.00 44.20 H new ATOM 0 HB2 ARG A 4 4.610 8.667 4.151 1.00 71.41 H new ATOM 0 HB3 ARG A 4 4.224 7.134 4.906 1.00 71.41 H new ATOM 0 HG2 ARG A 4 7.066 7.338 4.902 1.00 24.44 H new ATOM 0 HG3 ARG A 4 6.454 8.899 5.410 1.00 24.44 H new ATOM 0 HD2 ARG A 4 5.256 7.967 7.249 1.00 70.04 H new ATOM 0 HD3 ARG A 4 5.352 6.341 6.603 1.00 70.04 H new ATOM 0 HE ARG A 4 7.404 6.079 7.644 1.00 4.04 H new ATOM 0 HH11 ARG A 4 6.703 9.514 7.233 1.00 2.32 H new ATOM 0 HH12 ARG A 4 8.126 10.033 8.143 1.00 2.32 H new ATOM 0 HH21 ARG A 4 9.232 6.752 8.809 1.00 2.04 H new ATOM 0 HH22 ARG A 4 9.552 8.475 9.031 1.00 2.04 H new ATOM 42 N ALA A 5 3.227 5.903 2.573 1.00 72.25 N ATOM 43 CA ALA A 5 1.993 5.688 1.826 1.00 72.31 C ATOM 44 C ALA A 5 0.862 6.551 2.377 1.00 52.04 C ATOM 45 O ALA A 5 -0.024 6.059 3.075 1.00 24.55 O ATOM 46 CB ALA A 5 1.604 4.217 1.862 1.00 14.42 C ATOM 0 H ALA A 5 3.349 5.284 3.374 1.00 72.25 H new ATOM 0 HA ALA A 5 2.167 5.981 0.791 1.00 72.31 H new ATOM 0 HB1 ALA A 5 0.681 4.071 1.301 1.00 14.42 H new ATOM 0 HB2 ALA A 5 2.399 3.619 1.416 1.00 14.42 H new ATOM 0 HB3 ALA A 5 1.453 3.906 2.896 1.00 14.42 H new ATOM 52 N SER A 6 0.898 7.840 2.056 1.00 62.44 N ATOM 53 CA SER A 6 -0.122 8.772 2.521 1.00 12.54 C ATOM 54 C SER A 6 -0.579 9.688 1.390 1.00 42.31 C ATOM 55 O SER A 6 0.118 9.851 0.388 1.00 22.20 O ATOM 56 CB SER A 6 0.414 9.608 3.685 1.00 61.31 C ATOM 57 OG SER A 6 -0.226 10.871 3.744 1.00 63.15 O ATOM 0 H SER A 6 1.623 8.263 1.476 1.00 62.44 H new ATOM 0 HA SER A 6 -0.979 8.192 2.863 1.00 12.54 H new ATOM 0 HB2 SER A 6 0.258 9.074 4.622 1.00 61.31 H new ATOM 0 HB3 SER A 6 1.489 9.747 3.572 1.00 61.31 H new ATOM 0 HG SER A 6 0.418 11.575 3.520 1.00 63.15 H new ATOM 63 N VAL A 7 -1.754 10.286 1.558 1.00 12.02 N ATOM 64 CA VAL A 7 -2.304 11.187 0.553 1.00 14.31 C ATOM 65 C VAL A 7 -1.369 12.364 0.300 1.00 33.02 C ATOM 66 O VAL A 7 -1.165 12.773 -0.844 1.00 1.41 O ATOM 67 CB VAL A 7 -3.684 11.724 0.976 1.00 34.51 C ATOM 68 CG1 VAL A 7 -4.214 12.707 -0.057 1.00 34.44 C ATOM 69 CG2 VAL A 7 -4.661 10.576 1.182 1.00 75.21 C ATOM 0 H VAL A 7 -2.343 10.162 2.381 1.00 12.02 H new ATOM 0 HA VAL A 7 -2.413 10.609 -0.365 1.00 14.31 H new ATOM 0 HB VAL A 7 -3.575 12.253 1.923 1.00 34.51 H new ATOM 0 HG11 VAL A 7 -5.190 13.076 0.259 1.00 34.44 H new ATOM 0 HG12 VAL A 7 -3.523 13.544 -0.151 1.00 34.44 H new ATOM 0 HG13 VAL A 7 -4.310 12.206 -1.020 1.00 34.44 H new ATOM 0 HG21 VAL A 7 -5.631 10.973 1.481 1.00 75.21 H new ATOM 0 HG22 VAL A 7 -4.768 10.018 0.252 1.00 75.21 H new ATOM 0 HG23 VAL A 7 -4.285 9.913 1.961 1.00 75.21 H new ATOM 79 N LEU A 8 -0.804 12.906 1.373 1.00 31.30 N ATOM 80 CA LEU A 8 0.111 14.037 1.268 1.00 33.31 C ATOM 81 C LEU A 8 1.360 13.808 2.112 1.00 22.54 C ATOM 82 O LEU A 8 1.289 13.232 3.198 1.00 23.32 O ATOM 83 CB LEU A 8 -0.587 15.325 1.708 1.00 21.02 C ATOM 84 CG LEU A 8 -1.684 15.846 0.778 1.00 43.03 C ATOM 85 CD1 LEU A 8 -2.552 16.867 1.496 1.00 22.31 C ATOM 86 CD2 LEU A 8 -1.075 16.450 -0.479 1.00 3.42 C ATOM 0 H LEU A 8 -0.964 12.580 2.326 1.00 31.30 H new ATOM 0 HA LEU A 8 0.413 14.132 0.225 1.00 33.31 H new ATOM 0 HB2 LEU A 8 -1.022 15.160 2.694 1.00 21.02 H new ATOM 0 HB3 LEU A 8 0.168 16.104 1.819 1.00 21.02 H new ATOM 0 HG LEU A 8 -2.314 15.006 0.485 1.00 43.03 H new ATOM 0 HD11 LEU A 8 -3.327 17.226 0.819 1.00 22.31 H new ATOM 0 HD12 LEU A 8 -3.017 16.402 2.365 1.00 22.31 H new ATOM 0 HD13 LEU A 8 -1.935 17.706 1.819 1.00 22.31 H new ATOM 0 HD21 LEU A 8 -1.870 16.815 -1.129 1.00 3.42 H new ATOM 0 HD22 LEU A 8 -0.421 17.278 -0.205 1.00 3.42 H new ATOM 0 HD23 LEU A 8 -0.497 15.690 -1.005 1.00 3.42 H new ATOM 98 N SER A 9 2.502 14.264 1.608 1.00 74.12 N ATOM 99 CA SER A 9 3.767 14.107 2.315 1.00 13.10 C ATOM 100 C SER A 9 4.028 15.298 3.233 1.00 32.20 C ATOM 101 O SER A 9 3.498 16.387 3.020 1.00 12.01 O ATOM 102 CB SER A 9 4.917 13.955 1.318 1.00 4.51 C ATOM 103 OG SER A 9 5.605 15.181 1.142 1.00 4.42 O ATOM 0 H SER A 9 2.577 14.746 0.712 1.00 74.12 H new ATOM 0 HA SER A 9 3.704 13.207 2.926 1.00 13.10 H new ATOM 0 HB2 SER A 9 5.611 13.193 1.672 1.00 4.51 H new ATOM 0 HB3 SER A 9 4.528 13.612 0.359 1.00 4.51 H new ATOM 0 HG SER A 9 6.336 15.057 0.501 1.00 4.42 H new ATOM 109 N GLY A 10 4.849 15.081 4.255 1.00 3.10 N ATOM 110 CA GLY A 10 5.167 16.144 5.190 1.00 3.41 C ATOM 111 C GLY A 10 5.223 17.504 4.525 1.00 53.02 C ATOM 112 O GLY A 10 4.682 18.480 5.043 1.00 50.13 O ATOM 0 H GLY A 10 5.300 14.188 4.452 1.00 3.10 H new ATOM 0 HA2 GLY A 10 4.420 16.161 5.983 1.00 3.41 H new ATOM 0 HA3 GLY A 10 6.127 15.934 5.661 1.00 3.41 H new ATOM 116 N GLY A 11 5.882 17.570 3.372 1.00 53.13 N ATOM 117 CA GLY A 11 5.997 18.827 2.654 1.00 74.34 C ATOM 118 C GLY A 11 4.652 19.360 2.200 1.00 71.31 C ATOM 119 O GLY A 11 4.322 20.518 2.449 1.00 43.42 O ATOM 0 H GLY A 11 6.338 16.776 2.922 1.00 53.13 H new ATOM 0 HA2 GLY A 11 6.480 19.565 3.295 1.00 74.34 H new ATOM 0 HA3 GLY A 11 6.641 18.689 1.786 1.00 74.34 H new ATOM 123 N GLU A 12 3.876 18.512 1.532 1.00 14.31 N ATOM 124 CA GLU A 12 2.560 18.907 1.040 1.00 4.05 C ATOM 125 C GLU A 12 1.613 19.204 2.200 1.00 61.15 C ATOM 126 O GLU A 12 0.820 20.144 2.143 1.00 1.54 O ATOM 127 CB GLU A 12 1.971 17.807 0.155 1.00 43.55 C ATOM 128 CG GLU A 12 2.958 17.246 -0.856 1.00 52.31 C ATOM 129 CD GLU A 12 2.361 16.134 -1.697 1.00 24.12 C ATOM 130 OE1 GLU A 12 2.463 14.960 -1.283 1.00 11.21 O ATOM 131 OE2 GLU A 12 1.794 16.437 -2.767 1.00 4.15 O ATOM 0 H GLU A 12 4.135 17.549 1.319 1.00 14.31 H new ATOM 0 HA GLU A 12 2.678 19.815 0.448 1.00 4.05 H new ATOM 0 HB2 GLU A 12 1.612 16.996 0.788 1.00 43.55 H new ATOM 0 HB3 GLU A 12 1.106 18.204 -0.376 1.00 43.55 H new ATOM 0 HG2 GLU A 12 3.299 18.049 -1.510 1.00 52.31 H new ATOM 0 HG3 GLU A 12 3.836 16.869 -0.331 1.00 52.31 H new ATOM 138 N LEU A 13 1.702 18.396 3.250 1.00 21.43 N ATOM 139 CA LEU A 13 0.853 18.569 4.424 1.00 3.32 C ATOM 140 C LEU A 13 0.851 20.024 4.883 1.00 11.13 C ATOM 141 O LEU A 13 -0.193 20.573 5.235 1.00 32.32 O ATOM 142 CB LEU A 13 1.329 17.664 5.561 1.00 62.44 C ATOM 143 CG LEU A 13 0.452 17.640 6.813 1.00 52.02 C ATOM 144 CD1 LEU A 13 -0.722 16.692 6.623 1.00 35.24 C ATOM 145 CD2 LEU A 13 1.271 17.240 8.031 1.00 12.52 C ATOM 0 H LEU A 13 2.354 17.614 3.313 1.00 21.43 H new ATOM 0 HA LEU A 13 -0.165 18.291 4.150 1.00 3.32 H new ATOM 0 HB2 LEU A 13 1.409 16.646 5.179 1.00 62.44 H new ATOM 0 HB3 LEU A 13 2.332 17.976 5.851 1.00 62.44 H new ATOM 0 HG LEU A 13 0.060 18.644 6.978 1.00 52.02 H new ATOM 0 HD11 LEU A 13 -1.336 16.687 7.524 1.00 35.24 H new ATOM 0 HD12 LEU A 13 -1.323 17.023 5.776 1.00 35.24 H new ATOM 0 HD13 LEU A 13 -0.350 15.685 6.433 1.00 35.24 H new ATOM 0 HD21 LEU A 13 0.630 17.228 8.913 1.00 12.52 H new ATOM 0 HD22 LEU A 13 1.693 16.247 7.876 1.00 12.52 H new ATOM 0 HD23 LEU A 13 2.078 17.958 8.179 1.00 12.52 H new ATOM 157 N ASP A 14 2.027 20.643 4.875 1.00 1.11 N ATOM 158 CA ASP A 14 2.160 22.035 5.288 1.00 31.13 C ATOM 159 C ASP A 14 1.147 22.916 4.565 1.00 52.10 C ATOM 160 O ASP A 14 0.270 23.515 5.190 1.00 44.13 O ATOM 161 CB ASP A 14 3.578 22.537 5.013 1.00 45.14 C ATOM 162 CG ASP A 14 4.214 23.174 6.233 1.00 52.11 C ATOM 163 OD1 ASP A 14 3.466 23.656 7.109 1.00 54.55 O ATOM 164 OD2 ASP A 14 5.460 23.189 6.312 1.00 1.25 O ATOM 0 H ASP A 14 2.901 20.203 4.587 1.00 1.11 H new ATOM 0 HA ASP A 14 1.964 22.091 6.359 1.00 31.13 H new ATOM 0 HB2 ASP A 14 4.196 21.704 4.678 1.00 45.14 H new ATOM 0 HB3 ASP A 14 3.552 23.262 4.200 1.00 45.14 H new ATOM 169 N LYS A 15 1.272 22.992 3.245 1.00 41.25 N ATOM 170 CA LYS A 15 0.367 23.800 2.434 1.00 33.22 C ATOM 171 C LYS A 15 -1.085 23.403 2.682 1.00 12.21 C ATOM 172 O LYS A 15 -1.952 24.261 2.847 1.00 30.13 O ATOM 173 CB LYS A 15 0.703 23.644 0.949 1.00 11.33 C ATOM 174 CG LYS A 15 1.959 24.389 0.529 1.00 52.21 C ATOM 175 CD LYS A 15 2.778 23.584 -0.466 1.00 52.51 C ATOM 176 CE LYS A 15 4.139 24.217 -0.708 1.00 43.23 C ATOM 177 NZ LYS A 15 5.220 23.196 -0.780 1.00 64.54 N ATOM 0 H LYS A 15 1.992 22.504 2.713 1.00 41.25 H new ATOM 0 HA LYS A 15 0.495 24.844 2.721 1.00 33.22 H new ATOM 0 HB2 LYS A 15 0.826 22.585 0.722 1.00 11.33 H new ATOM 0 HB3 LYS A 15 -0.138 24.002 0.355 1.00 11.33 H new ATOM 0 HG2 LYS A 15 1.684 25.346 0.086 1.00 52.21 H new ATOM 0 HG3 LYS A 15 2.565 24.607 1.408 1.00 52.21 H new ATOM 0 HD2 LYS A 15 2.909 22.568 -0.094 1.00 52.51 H new ATOM 0 HD3 LYS A 15 2.237 23.510 -1.409 1.00 52.51 H new ATOM 0 HE2 LYS A 15 4.115 24.786 -1.637 1.00 43.23 H new ATOM 0 HE3 LYS A 15 4.359 24.923 0.093 1.00 43.23 H new ATOM 0 HZ1 LYS A 15 6.132 23.667 -0.946 1.00 64.54 H new ATOM 0 HZ2 LYS A 15 5.260 22.669 0.116 1.00 64.54 H new ATOM 0 HZ3 LYS A 15 5.024 22.537 -1.560 1.00 64.54 H new ATOM 191 N TRP A 16 -1.341 22.101 2.707 1.00 35.44 N ATOM 192 CA TRP A 16 -2.689 21.591 2.936 1.00 11.25 C ATOM 193 C TRP A 16 -3.288 22.187 4.205 1.00 14.54 C ATOM 194 O TRP A 16 -4.403 22.709 4.189 1.00 11.03 O ATOM 195 CB TRP A 16 -2.670 20.065 3.035 1.00 61.11 C ATOM 196 CG TRP A 16 -3.971 19.483 3.498 1.00 12.13 C ATOM 197 CD1 TRP A 16 -4.270 19.041 4.755 1.00 12.11 C ATOM 198 CD2 TRP A 16 -5.148 19.280 2.709 1.00 62.12 C ATOM 199 NE1 TRP A 16 -5.561 18.575 4.795 1.00 35.21 N ATOM 200 CE2 TRP A 16 -6.123 18.710 3.553 1.00 45.21 C ATOM 201 CE3 TRP A 16 -5.474 19.524 1.373 1.00 71.15 C ATOM 202 CZ2 TRP A 16 -7.398 18.383 3.101 1.00 22.12 C ATOM 203 CZ3 TRP A 16 -6.741 19.198 0.926 1.00 71.03 C ATOM 204 CH2 TRP A 16 -7.690 18.632 1.787 1.00 0.54 C ATOM 0 H TRP A 16 -0.634 21.378 2.572 1.00 35.44 H new ATOM 0 HA TRP A 16 -3.310 21.885 2.090 1.00 11.25 H new ATOM 0 HB2 TRP A 16 -2.421 19.648 2.059 1.00 61.11 H new ATOM 0 HB3 TRP A 16 -1.880 19.763 3.722 1.00 61.11 H new ATOM 0 HD1 TRP A 16 -3.591 19.056 5.594 1.00 12.11 H new ATOM 0 HE1 TRP A 16 -6.027 18.190 5.617 1.00 35.21 H new ATOM 0 HE3 TRP A 16 -4.749 19.960 0.701 1.00 71.15 H new ATOM 0 HZ2 TRP A 16 -8.131 17.948 3.764 1.00 22.12 H new ATOM 0 HZ3 TRP A 16 -7.004 19.383 -0.105 1.00 71.03 H new ATOM 0 HH2 TRP A 16 -8.671 18.387 1.407 1.00 0.54 H new ATOM 215 N GLU A 17 -2.540 22.108 5.302 1.00 15.40 N ATOM 216 CA GLU A 17 -3.000 22.640 6.579 1.00 13.43 C ATOM 217 C GLU A 17 -3.204 24.151 6.497 1.00 41.13 C ATOM 218 O GLU A 17 -3.923 24.737 7.306 1.00 14.24 O ATOM 219 CB GLU A 17 -1.996 22.309 7.685 1.00 10.42 C ATOM 220 CG GLU A 17 -2.101 20.883 8.195 1.00 62.52 C ATOM 221 CD GLU A 17 -1.465 20.702 9.560 1.00 53.54 C ATOM 222 OE1 GLU A 17 -2.002 21.253 10.543 1.00 34.12 O ATOM 223 OE2 GLU A 17 -0.429 20.009 9.644 1.00 52.04 O ATOM 0 H GLU A 17 -1.614 21.681 5.331 1.00 15.40 H new ATOM 0 HA GLU A 17 -3.957 22.174 6.815 1.00 13.43 H new ATOM 0 HB2 GLU A 17 -0.987 22.478 7.310 1.00 10.42 H new ATOM 0 HB3 GLU A 17 -2.146 22.996 8.518 1.00 10.42 H new ATOM 0 HG2 GLU A 17 -3.151 20.596 8.247 1.00 62.52 H new ATOM 0 HG3 GLU A 17 -1.622 20.211 7.483 1.00 62.52 H new ATOM 230 N LYS A 18 -2.565 24.776 5.514 1.00 63.14 N ATOM 231 CA LYS A 18 -2.675 26.217 5.324 1.00 2.43 C ATOM 232 C LYS A 18 -4.064 26.595 4.819 1.00 40.13 C ATOM 233 O LYS A 18 -4.794 27.337 5.476 1.00 0.14 O ATOM 234 CB LYS A 18 -1.612 26.705 4.338 1.00 72.33 C ATOM 235 CG LYS A 18 -0.789 27.871 4.858 1.00 61.44 C ATOM 236 CD LYS A 18 0.187 28.377 3.809 1.00 61.43 C ATOM 237 CE LYS A 18 1.479 27.574 3.816 1.00 53.14 C ATOM 238 NZ LYS A 18 2.575 28.280 3.097 1.00 3.51 N ATOM 0 H LYS A 18 -1.965 24.306 4.836 1.00 63.14 H new ATOM 0 HA LYS A 18 -2.515 26.698 6.289 1.00 2.43 H new ATOM 0 HB2 LYS A 18 -0.944 25.878 4.098 1.00 72.33 H new ATOM 0 HB3 LYS A 18 -2.099 27.001 3.409 1.00 72.33 H new ATOM 0 HG2 LYS A 18 -1.454 28.681 5.159 1.00 61.44 H new ATOM 0 HG3 LYS A 18 -0.240 27.562 5.748 1.00 61.44 H new ATOM 0 HD2 LYS A 18 -0.274 28.318 2.823 1.00 61.43 H new ATOM 0 HD3 LYS A 18 0.409 29.428 3.994 1.00 61.43 H new ATOM 0 HE2 LYS A 18 1.783 27.385 4.845 1.00 53.14 H new ATOM 0 HE3 LYS A 18 1.306 26.603 3.351 1.00 53.14 H new ATOM 0 HZ1 LYS A 18 3.438 27.700 3.124 1.00 3.51 H new ATOM 0 HZ2 LYS A 18 2.296 28.439 2.108 1.00 3.51 H new ATOM 0 HZ3 LYS A 18 2.758 29.195 3.556 1.00 3.51 H new ATOM 252 N ILE A 19 -4.423 26.078 3.647 1.00 3.24 N ATOM 253 CA ILE A 19 -5.726 26.360 3.057 1.00 42.44 C ATOM 254 C ILE A 19 -6.843 26.182 4.079 1.00 63.11 C ATOM 255 O ILE A 19 -6.771 25.311 4.946 1.00 1.34 O ATOM 256 CB ILE A 19 -6.003 25.450 1.845 1.00 23.31 C ATOM 257 CG1 ILE A 19 -4.898 25.608 0.798 1.00 4.13 C ATOM 258 CG2 ILE A 19 -7.362 25.771 1.242 1.00 65.43 C ATOM 259 CD1 ILE A 19 -4.607 24.337 0.031 1.00 43.11 C ATOM 0 H ILE A 19 -3.831 25.463 3.089 1.00 3.24 H new ATOM 0 HA ILE A 19 -5.704 27.398 2.725 1.00 42.44 H new ATOM 0 HB ILE A 19 -6.013 24.413 2.182 1.00 23.31 H new ATOM 0 HG12 ILE A 19 -5.184 26.390 0.095 1.00 4.13 H new ATOM 0 HG13 ILE A 19 -3.985 25.942 1.292 1.00 4.13 H new ATOM 0 HG21 ILE A 19 -7.544 25.120 0.387 1.00 65.43 H new ATOM 0 HG22 ILE A 19 -8.139 25.612 1.990 1.00 65.43 H new ATOM 0 HG23 ILE A 19 -7.379 26.811 0.916 1.00 65.43 H new ATOM 0 HD11 ILE A 19 -3.814 24.523 -0.693 1.00 43.11 H new ATOM 0 HD12 ILE A 19 -4.290 23.558 0.724 1.00 43.11 H new ATOM 0 HD13 ILE A 19 -5.507 24.013 -0.492 1.00 43.11 H new ATOM 271 N ARG A 20 -7.876 27.010 3.968 1.00 72.24 N ATOM 272 CA ARG A 20 -9.010 26.944 4.882 1.00 33.22 C ATOM 273 C ARG A 20 -10.278 26.518 4.146 1.00 52.41 C ATOM 274 O ARG A 20 -10.408 26.729 2.939 1.00 71.22 O ATOM 275 CB ARG A 20 -9.229 28.299 5.556 1.00 31.21 C ATOM 276 CG ARG A 20 -8.305 28.549 6.736 1.00 22.33 C ATOM 277 CD ARG A 20 -8.410 29.983 7.232 1.00 32.44 C ATOM 278 NE ARG A 20 -7.150 30.706 7.087 1.00 60.31 N ATOM 279 CZ ARG A 20 -6.150 30.624 7.958 1.00 22.21 C ATOM 280 NH1 ARG A 20 -6.264 29.853 9.031 1.00 22.34 N ATOM 281 NH2 ARG A 20 -5.035 31.313 7.756 1.00 25.12 N ATOM 0 H ARG A 20 -7.951 27.735 3.254 1.00 72.24 H new ATOM 0 HA ARG A 20 -8.786 26.199 5.645 1.00 33.22 H new ATOM 0 HB2 ARG A 20 -9.085 29.089 4.819 1.00 31.21 H new ATOM 0 HB3 ARG A 20 -10.263 28.364 5.895 1.00 31.21 H new ATOM 0 HG2 ARG A 20 -8.554 27.864 7.546 1.00 22.33 H new ATOM 0 HG3 ARG A 20 -7.276 28.338 6.445 1.00 22.33 H new ATOM 0 HD2 ARG A 20 -9.192 30.502 6.677 1.00 32.44 H new ATOM 0 HD3 ARG A 20 -8.709 29.983 8.280 1.00 32.44 H new ATOM 0 HE ARG A 20 -7.031 31.307 6.272 1.00 60.31 H new ATOM 0 HH11 ARG A 20 -7.120 29.322 9.189 1.00 22.34 H new ATOM 0 HH12 ARG A 20 -5.495 29.791 9.699 1.00 22.34 H new ATOM 0 HH21 ARG A 20 -4.945 31.907 6.931 1.00 25.12 H new ATOM 0 HH22 ARG A 20 -4.268 31.249 8.425 1.00 25.12 H new ATOM 295 N LEU A 21 -11.209 25.920 4.880 1.00 73.14 N ATOM 296 CA LEU A 21 -12.467 25.464 4.297 1.00 45.42 C ATOM 297 C LEU A 21 -13.220 26.624 3.653 1.00 14.34 C ATOM 298 O LEU A 21 -13.853 26.463 2.610 1.00 52.41 O ATOM 299 CB LEU A 21 -13.339 24.806 5.367 1.00 3.35 C ATOM 300 CG LEU A 21 -12.728 23.603 6.084 1.00 64.32 C ATOM 301 CD1 LEU A 21 -13.518 23.272 7.341 1.00 1.13 C ATOM 302 CD2 LEU A 21 -12.674 22.399 5.154 1.00 2.33 C ATOM 0 H LEU A 21 -11.117 25.739 5.880 1.00 73.14 H new ATOM 0 HA LEU A 21 -12.236 24.731 3.524 1.00 45.42 H new ATOM 0 HB2 LEU A 21 -13.592 25.558 6.114 1.00 3.35 H new ATOM 0 HB3 LEU A 21 -14.273 24.491 4.902 1.00 3.35 H new ATOM 0 HG LEU A 21 -11.709 23.858 6.377 1.00 64.32 H new ATOM 0 HD11 LEU A 21 -13.068 22.413 7.838 1.00 1.13 H new ATOM 0 HD12 LEU A 21 -13.505 24.129 8.015 1.00 1.13 H new ATOM 0 HD13 LEU A 21 -14.548 23.037 7.072 1.00 1.13 H new ATOM 0 HD21 LEU A 21 -12.236 21.551 5.681 1.00 2.33 H new ATOM 0 HD22 LEU A 21 -13.683 22.143 4.831 1.00 2.33 H new ATOM 0 HD23 LEU A 21 -12.064 22.639 4.283 1.00 2.33 H new ATOM 314 N ARG A 22 -13.146 27.793 4.281 1.00 44.01 N ATOM 315 CA ARG A 22 -13.819 28.980 3.769 1.00 73.43 C ATOM 316 C ARG A 22 -12.840 30.141 3.623 1.00 2.42 C ATOM 317 O ARG A 22 -11.773 30.166 4.238 1.00 51.23 O ATOM 318 CB ARG A 22 -14.967 29.381 4.697 1.00 10.21 C ATOM 319 CG ARG A 22 -16.343 29.038 4.147 1.00 25.21 C ATOM 320 CD ARG A 22 -17.332 28.746 5.265 1.00 53.44 C ATOM 321 NE ARG A 22 -17.292 29.765 6.311 1.00 74.43 N ATOM 322 CZ ARG A 22 -17.907 30.940 6.215 1.00 25.32 C ATOM 323 NH1 ARG A 22 -18.603 31.241 5.128 1.00 14.11 N ATOM 324 NH2 ARG A 22 -17.825 31.815 7.209 1.00 64.03 N ATOM 0 H ARG A 22 -12.626 27.943 5.146 1.00 44.01 H new ATOM 0 HA ARG A 22 -14.222 28.742 2.785 1.00 73.43 H new ATOM 0 HB2 ARG A 22 -14.836 28.885 5.659 1.00 10.21 H new ATOM 0 HB3 ARG A 22 -14.916 30.454 4.882 1.00 10.21 H new ATOM 0 HG2 ARG A 22 -16.711 29.866 3.541 1.00 25.21 H new ATOM 0 HG3 ARG A 22 -16.268 28.171 3.490 1.00 25.21 H new ATOM 0 HD2 ARG A 22 -18.339 28.689 4.852 1.00 53.44 H new ATOM 0 HD3 ARG A 22 -17.110 27.771 5.700 1.00 53.44 H new ATOM 0 HE ARG A 22 -16.764 29.564 7.160 1.00 74.43 H new ATOM 0 HH11 ARG A 22 -18.668 30.570 4.362 1.00 14.11 H new ATOM 0 HH12 ARG A 22 -19.074 32.143 5.057 1.00 14.11 H new ATOM 0 HH21 ARG A 22 -17.290 31.586 8.047 1.00 64.03 H new ATOM 0 HH22 ARG A 22 -18.297 32.716 7.135 1.00 64.03 H new ATOM 338 N PRO A 23 -13.208 31.126 2.792 1.00 74.11 N ATOM 339 CA PRO A 23 -12.377 32.308 2.546 1.00 13.11 C ATOM 340 C PRO A 23 -12.304 33.228 3.760 1.00 63.32 C ATOM 341 O PRO A 23 -11.270 33.839 4.026 1.00 11.42 O ATOM 342 CB PRO A 23 -13.089 33.009 1.386 1.00 15.12 C ATOM 343 CG PRO A 23 -14.509 32.568 1.492 1.00 24.33 C ATOM 344 CD PRO A 23 -14.466 31.162 2.027 1.00 12.23 C ATOM 0 HA PRO A 23 -11.343 32.040 2.329 1.00 13.11 H new ATOM 0 HB2 PRO A 23 -13.004 34.093 1.466 1.00 15.12 H new ATOM 0 HB3 PRO A 23 -12.657 32.725 0.426 1.00 15.12 H new ATOM 0 HG2 PRO A 23 -15.072 33.222 2.158 1.00 24.33 H new ATOM 0 HG3 PRO A 23 -15.002 32.601 0.520 1.00 24.33 H new ATOM 0 HD2 PRO A 23 -15.327 30.946 2.659 1.00 12.23 H new ATOM 0 HD3 PRO A 23 -14.469 30.426 1.223 1.00 12.23 H new ATOM 352 N GLY A 24 -13.409 33.321 4.494 1.00 43.11 N ATOM 353 CA GLY A 24 -13.447 34.169 5.671 1.00 33.41 C ATOM 354 C GLY A 24 -13.638 33.377 6.949 1.00 21.41 C ATOM 355 O GLY A 24 -14.223 33.870 7.912 1.00 33.12 O ATOM 0 H GLY A 24 -14.278 32.825 4.295 1.00 43.11 H new ATOM 0 HA2 GLY A 24 -12.520 34.738 5.735 1.00 33.41 H new ATOM 0 HA3 GLY A 24 -14.258 34.890 5.569 1.00 33.41 H new ATOM 359 N GLY A 25 -13.143 32.142 6.959 1.00 43.43 N ATOM 360 CA GLY A 25 -13.272 31.299 8.133 1.00 53.12 C ATOM 361 C GLY A 25 -11.963 31.136 8.877 1.00 1.11 C ATOM 362 O GLY A 25 -10.937 31.684 8.473 1.00 63.24 O ATOM 0 H GLY A 25 -12.655 31.711 6.174 1.00 43.43 H new ATOM 0 HA2 GLY A 25 -14.017 31.728 8.804 1.00 53.12 H new ATOM 0 HA3 GLY A 25 -13.640 30.318 7.833 1.00 53.12 H new ATOM 366 N LYS A 26 -11.995 30.380 9.970 1.00 44.45 N ATOM 367 CA LYS A 26 -10.802 30.146 10.774 1.00 65.53 C ATOM 368 C LYS A 26 -10.466 28.658 10.828 1.00 1.13 C ATOM 369 O LYS A 26 -9.426 28.265 11.358 1.00 72.40 O ATOM 370 CB LYS A 26 -11.002 30.686 12.191 1.00 51.21 C ATOM 371 CG LYS A 26 -9.764 31.350 12.770 1.00 33.22 C ATOM 372 CD LYS A 26 -10.108 32.236 13.954 1.00 10.13 C ATOM 373 CE LYS A 26 -9.466 33.609 13.828 1.00 1.51 C ATOM 374 NZ LYS A 26 -10.357 34.577 13.129 1.00 24.55 N ATOM 0 H LYS A 26 -12.835 29.919 10.319 1.00 44.45 H new ATOM 0 HA LYS A 26 -9.970 30.672 10.306 1.00 65.53 H new ATOM 0 HB2 LYS A 26 -11.820 31.406 12.184 1.00 51.21 H new ATOM 0 HB3 LYS A 26 -11.303 29.867 12.844 1.00 51.21 H new ATOM 0 HG2 LYS A 26 -9.052 30.586 13.081 1.00 33.22 H new ATOM 0 HG3 LYS A 26 -9.275 31.945 11.999 1.00 33.22 H new ATOM 0 HD2 LYS A 26 -11.190 32.344 14.026 1.00 10.13 H new ATOM 0 HD3 LYS A 26 -9.773 31.760 14.876 1.00 10.13 H new ATOM 0 HE2 LYS A 26 -9.225 33.989 14.821 1.00 1.51 H new ATOM 0 HE3 LYS A 26 -8.526 33.522 13.283 1.00 1.51 H new ATOM 0 HZ1 LYS A 26 -9.883 35.500 13.063 1.00 24.55 H new ATOM 0 HZ2 LYS A 26 -10.567 34.227 12.172 1.00 24.55 H new ATOM 0 HZ3 LYS A 26 -11.244 34.680 13.662 1.00 24.55 H new ATOM 388 N LYS A 27 -11.352 27.836 10.277 1.00 70.43 N ATOM 389 CA LYS A 27 -11.150 26.392 10.260 1.00 54.42 C ATOM 390 C LYS A 27 -10.269 25.980 9.086 1.00 62.12 C ATOM 391 O LYS A 27 -10.722 25.940 7.942 1.00 1.01 O ATOM 392 CB LYS A 27 -12.496 25.668 10.180 1.00 42.43 C ATOM 393 CG LYS A 27 -12.470 24.267 10.764 1.00 2.43 C ATOM 394 CD LYS A 27 -13.852 23.636 10.763 1.00 40.20 C ATOM 395 CE LYS A 27 -13.771 22.118 10.691 1.00 1.41 C ATOM 396 NZ LYS A 27 -14.807 21.467 11.540 1.00 51.45 N ATOM 0 H LYS A 27 -12.218 28.145 9.836 1.00 70.43 H new ATOM 0 HA LYS A 27 -10.648 26.110 11.185 1.00 54.42 H new ATOM 0 HB2 LYS A 27 -13.248 26.257 10.705 1.00 42.43 H new ATOM 0 HB3 LYS A 27 -12.807 25.612 9.137 1.00 42.43 H new ATOM 0 HG2 LYS A 27 -11.785 23.645 10.188 1.00 2.43 H new ATOM 0 HG3 LYS A 27 -12.087 24.304 11.784 1.00 2.43 H new ATOM 0 HD2 LYS A 27 -14.388 23.931 11.665 1.00 40.20 H new ATOM 0 HD3 LYS A 27 -14.424 24.012 9.915 1.00 40.20 H new ATOM 0 HE2 LYS A 27 -13.894 21.796 9.657 1.00 1.41 H new ATOM 0 HE3 LYS A 27 -12.781 21.791 11.011 1.00 1.41 H new ATOM 0 HZ1 LYS A 27 -15.267 20.705 11.003 1.00 51.45 H new ATOM 0 HZ2 LYS A 27 -14.359 21.070 12.391 1.00 51.45 H new ATOM 0 HZ3 LYS A 27 -15.519 22.171 11.820 1.00 51.45 H new ATOM 410 N GLN A 28 -9.008 25.673 9.377 1.00 14.40 N ATOM 411 CA GLN A 28 -8.065 25.263 8.344 1.00 64.01 C ATOM 412 C GLN A 28 -8.268 23.799 7.971 1.00 62.23 C ATOM 413 O GLN A 28 -9.071 23.097 8.585 1.00 73.12 O ATOM 414 CB GLN A 28 -6.627 25.486 8.819 1.00 72.21 C ATOM 415 CG GLN A 28 -6.428 26.799 9.558 1.00 31.31 C ATOM 416 CD GLN A 28 -6.200 26.603 11.044 1.00 32.21 C ATOM 417 OE1 GLN A 28 -6.790 25.718 11.663 1.00 34.35 O ATOM 418 NE2 GLN A 28 -5.340 27.430 11.626 1.00 51.31 N ATOM 0 H GLN A 28 -8.617 25.701 10.319 1.00 14.40 H new ATOM 0 HA GLN A 28 -8.247 25.873 7.459 1.00 64.01 H new ATOM 0 HB2 GLN A 28 -6.337 24.663 9.473 1.00 72.21 H new ATOM 0 HB3 GLN A 28 -5.960 25.459 7.957 1.00 72.21 H new ATOM 0 HG2 GLN A 28 -5.576 27.327 9.130 1.00 31.31 H new ATOM 0 HG3 GLN A 28 -7.303 27.432 9.409 1.00 31.31 H new ATOM 0 HE21 GLN A 28 -4.872 28.150 11.075 1.00 51.31 H new ATOM 0 HE22 GLN A 28 -5.147 27.345 12.624 1.00 51.31 H new ATOM 427 N TYR A 29 -7.536 23.344 6.960 1.00 21.44 N ATOM 428 CA TYR A 29 -7.638 21.963 6.503 1.00 2.42 C ATOM 429 C TYR A 29 -6.775 21.041 7.359 1.00 63.14 C ATOM 430 O TYR A 29 -5.691 21.419 7.802 1.00 11.43 O ATOM 431 CB TYR A 29 -7.219 21.857 5.036 1.00 43.31 C ATOM 432 CG TYR A 29 -8.380 21.899 4.069 1.00 43.01 C ATOM 433 CD1 TYR A 29 -9.276 20.841 3.983 1.00 73.10 C ATOM 434 CD2 TYR A 29 -8.581 22.997 3.241 1.00 31.31 C ATOM 435 CE1 TYR A 29 -10.339 20.875 3.101 1.00 10.02 C ATOM 436 CE2 TYR A 29 -9.641 23.040 2.357 1.00 54.05 C ATOM 437 CZ TYR A 29 -10.518 21.976 2.290 1.00 10.31 C ATOM 438 OH TYR A 29 -11.575 22.015 1.410 1.00 21.12 O ATOM 0 H TYR A 29 -6.866 23.911 6.441 1.00 21.44 H new ATOM 0 HA TYR A 29 -8.678 21.650 6.600 1.00 2.42 H new ATOM 0 HB2 TYR A 29 -6.534 22.672 4.803 1.00 43.31 H new ATOM 0 HB3 TYR A 29 -6.669 20.927 4.890 1.00 43.31 H new ATOM 0 HD1 TYR A 29 -9.139 19.977 4.616 1.00 73.10 H new ATOM 0 HD2 TYR A 29 -7.896 23.831 3.290 1.00 31.31 H new ATOM 0 HE1 TYR A 29 -11.026 20.044 3.047 1.00 10.02 H new ATOM 0 HE2 TYR A 29 -9.783 23.902 1.721 1.00 54.05 H new ATOM 0 HH TYR A 29 -11.817 22.948 1.231 1.00 21.12 H new ATOM 448 N LYS A 30 -7.264 19.826 7.585 1.00 11.02 N ATOM 449 CA LYS A 30 -6.539 18.846 8.385 1.00 14.31 C ATOM 450 C LYS A 30 -6.661 17.451 7.780 1.00 44.43 C ATOM 451 O LYS A 30 -7.459 17.227 6.869 1.00 11.31 O ATOM 452 CB LYS A 30 -7.068 18.837 9.821 1.00 13.11 C ATOM 453 CG LYS A 30 -6.186 19.594 10.799 1.00 34.04 C ATOM 454 CD LYS A 30 -6.303 19.031 12.206 1.00 71.33 C ATOM 455 CE LYS A 30 -5.093 19.394 13.054 1.00 35.40 C ATOM 456 NZ LYS A 30 -5.423 19.423 14.506 1.00 40.13 N ATOM 0 H LYS A 30 -8.160 19.497 7.225 1.00 11.02 H new ATOM 0 HA LYS A 30 -5.486 19.129 8.393 1.00 14.31 H new ATOM 0 HB2 LYS A 30 -8.067 19.272 9.834 1.00 13.11 H new ATOM 0 HB3 LYS A 30 -7.166 17.805 10.157 1.00 13.11 H new ATOM 0 HG2 LYS A 30 -5.148 19.542 10.470 1.00 34.04 H new ATOM 0 HG3 LYS A 30 -6.466 20.647 10.803 1.00 34.04 H new ATOM 0 HD2 LYS A 30 -7.208 19.414 12.678 1.00 71.33 H new ATOM 0 HD3 LYS A 30 -6.403 17.947 12.158 1.00 71.33 H new ATOM 0 HE2 LYS A 30 -4.296 18.672 12.877 1.00 35.40 H new ATOM 0 HE3 LYS A 30 -4.714 20.369 12.748 1.00 35.40 H new ATOM 0 HZ1 LYS A 30 -4.573 19.674 15.050 1.00 40.13 H new ATOM 0 HZ2 LYS A 30 -6.166 20.130 14.679 1.00 40.13 H new ATOM 0 HZ3 LYS A 30 -5.761 18.486 14.804 1.00 40.13 H new ATOM 470 N LEU A 31 -5.865 16.519 8.290 1.00 62.23 N ATOM 471 CA LEU A 31 -5.885 15.144 7.800 1.00 45.20 C ATOM 472 C LEU A 31 -7.305 14.589 7.793 1.00 62.03 C ATOM 473 O LEU A 31 -7.692 13.856 6.883 1.00 54.12 O ATOM 474 CB LEU A 31 -4.983 14.261 8.663 1.00 11.45 C ATOM 475 CG LEU A 31 -3.865 13.521 7.929 1.00 73.22 C ATOM 476 CD1 LEU A 31 -4.445 12.477 6.987 1.00 13.21 C ATOM 477 CD2 LEU A 31 -2.988 14.501 7.165 1.00 4.31 C ATOM 0 H LEU A 31 -5.198 16.689 9.042 1.00 62.23 H new ATOM 0 HA LEU A 31 -5.510 15.144 6.776 1.00 45.20 H new ATOM 0 HB2 LEU A 31 -4.532 14.883 9.436 1.00 11.45 H new ATOM 0 HB3 LEU A 31 -5.607 13.525 9.169 1.00 11.45 H new ATOM 0 HG LEU A 31 -3.247 13.011 8.668 1.00 73.22 H new ATOM 0 HD11 LEU A 31 -3.634 11.960 6.473 1.00 13.21 H new ATOM 0 HD12 LEU A 31 -5.030 11.756 7.558 1.00 13.21 H new ATOM 0 HD13 LEU A 31 -5.087 12.965 6.253 1.00 13.21 H new ATOM 0 HD21 LEU A 31 -2.198 13.956 6.649 1.00 4.31 H new ATOM 0 HD22 LEU A 31 -3.594 15.039 6.436 1.00 4.31 H new ATOM 0 HD23 LEU A 31 -2.543 15.211 7.862 1.00 4.31 H new ATOM 489 N LYS A 32 -8.079 14.944 8.813 1.00 22.44 N ATOM 490 CA LYS A 32 -9.458 14.485 8.925 1.00 41.14 C ATOM 491 C LYS A 32 -10.196 14.653 7.601 1.00 51.44 C ATOM 492 O LYS A 32 -10.798 13.709 7.090 1.00 61.04 O ATOM 493 CB LYS A 32 -10.186 15.255 10.028 1.00 50.31 C ATOM 494 CG LYS A 32 -10.354 14.463 11.314 1.00 71.22 C ATOM 495 CD LYS A 32 -11.706 13.771 11.369 1.00 62.42 C ATOM 496 CE LYS A 32 -12.008 13.248 12.765 1.00 22.24 C ATOM 497 NZ LYS A 32 -12.195 11.771 12.775 1.00 75.32 N ATOM 0 H LYS A 32 -7.774 15.549 9.575 1.00 22.44 H new ATOM 0 HA LYS A 32 -9.442 13.425 9.180 1.00 41.14 H new ATOM 0 HB2 LYS A 32 -9.636 16.171 10.244 1.00 50.31 H new ATOM 0 HB3 LYS A 32 -11.169 15.553 9.663 1.00 50.31 H new ATOM 0 HG2 LYS A 32 -9.560 13.720 11.391 1.00 71.22 H new ATOM 0 HG3 LYS A 32 -10.250 15.130 12.170 1.00 71.22 H new ATOM 0 HD2 LYS A 32 -12.486 14.469 11.064 1.00 62.42 H new ATOM 0 HD3 LYS A 32 -11.722 12.945 10.658 1.00 62.42 H new ATOM 0 HE2 LYS A 32 -11.193 13.515 13.437 1.00 22.24 H new ATOM 0 HE3 LYS A 32 -12.908 13.731 13.147 1.00 22.24 H new ATOM 0 HZ1 LYS A 32 -12.011 11.404 13.731 1.00 75.32 H new ATOM 0 HZ2 LYS A 32 -13.171 11.543 12.498 1.00 75.32 H new ATOM 0 HZ3 LYS A 32 -11.533 11.333 12.103 1.00 75.32 H new ATOM 511 N HIS A 33 -10.145 15.862 7.050 1.00 41.14 N ATOM 512 CA HIS A 33 -10.807 16.153 5.783 1.00 51.53 C ATOM 513 C HIS A 33 -10.279 15.249 4.673 1.00 65.21 C ATOM 514 O HIS A 33 -11.061 14.942 3.773 1.00 72.12 O ATOM 515 CB HIS A 33 -10.602 17.620 5.401 1.00 23.03 C ATOM 516 CG HIS A 33 -10.901 18.576 6.514 1.00 30.12 C ATOM 517 ND1 HIS A 33 -10.059 19.610 6.867 1.00 32.11 N ATOM 518 CD2 HIS A 33 -11.959 18.652 7.356 1.00 21.23 C ATOM 519 CE1 HIS A 33 -10.586 20.278 7.877 1.00 23.23 C ATOM 520 NE2 HIS A 33 -11.739 19.718 8.193 1.00 63.40 N ATOM 0 H HIS A 33 -9.653 16.655 7.461 1.00 41.14 H new ATOM 0 HA HIS A 33 -11.873 15.962 5.907 1.00 51.53 H new ATOM 0 HB2 HIS A 33 -9.571 17.762 5.078 1.00 23.03 H new ATOM 0 HB3 HIS A 33 -11.238 17.857 4.548 1.00 23.03 H new ATOM 0 HD2 HIS A 33 -12.817 17.996 7.367 1.00 21.23 H new ATOM 0 HE1 HIS A 33 -10.148 21.137 8.363 1.00 23.23 H new ATOM 0 HE2 HIS A 33 -12.364 20.027 8.937 1.00 63.40 H new ATOM 528 N ILE A 34 -9.018 14.830 4.711 1.00 55.41 N ATOM 529 CA ILE A 34 -8.470 13.964 3.674 1.00 2.11 C ATOM 530 C ILE A 34 -8.970 12.532 3.832 1.00 13.44 C ATOM 531 O ILE A 34 -9.741 12.037 3.009 1.00 4.44 O ATOM 532 CB ILE A 34 -6.930 13.964 3.697 1.00 23.23 C ATOM 533 CG1 ILE A 34 -6.397 15.397 3.643 1.00 60.44 C ATOM 534 CG2 ILE A 34 -6.383 13.144 2.538 1.00 51.22 C ATOM 535 CD1 ILE A 34 -4.899 15.492 3.831 1.00 34.14 C ATOM 0 H ILE A 34 -8.357 15.076 5.448 1.00 55.41 H new ATOM 0 HA ILE A 34 -8.811 14.361 2.718 1.00 2.11 H new ATOM 0 HB ILE A 34 -6.595 13.508 4.629 1.00 23.23 H new ATOM 0 HG12 ILE A 34 -6.663 15.839 2.683 1.00 60.44 H new ATOM 0 HG13 ILE A 34 -6.890 15.989 4.414 1.00 60.44 H new ATOM 0 HG21 ILE A 34 -5.293 13.154 2.568 1.00 51.22 H new ATOM 0 HG22 ILE A 34 -6.739 12.117 2.619 1.00 51.22 H new ATOM 0 HG23 ILE A 34 -6.724 13.573 1.596 1.00 51.22 H new ATOM 0 HD11 ILE A 34 -4.592 16.537 3.781 1.00 34.14 H new ATOM 0 HD12 ILE A 34 -4.627 15.080 4.803 1.00 34.14 H new ATOM 0 HD13 ILE A 34 -4.397 14.928 3.045 1.00 34.14 H new ATOM 547 N VAL A 35 -8.528 11.871 4.898 1.00 11.33 N ATOM 548 CA VAL A 35 -8.933 10.497 5.167 1.00 34.30 C ATOM 549 C VAL A 35 -10.446 10.339 5.063 1.00 54.12 C ATOM 550 O VAL A 35 -10.944 9.296 4.640 1.00 63.05 O ATOM 551 CB VAL A 35 -8.475 10.041 6.565 1.00 34.51 C ATOM 552 CG1 VAL A 35 -8.956 8.625 6.849 1.00 64.32 C ATOM 553 CG2 VAL A 35 -6.962 10.133 6.685 1.00 23.41 C ATOM 0 H VAL A 35 -7.890 12.265 5.589 1.00 11.33 H new ATOM 0 HA VAL A 35 -8.453 9.872 4.414 1.00 34.30 H new ATOM 0 HB VAL A 35 -8.917 10.705 7.308 1.00 34.51 H new ATOM 0 HG11 VAL A 35 -8.623 8.320 7.841 1.00 64.32 H new ATOM 0 HG12 VAL A 35 -10.045 8.595 6.807 1.00 64.32 H new ATOM 0 HG13 VAL A 35 -8.545 7.945 6.103 1.00 64.32 H new ATOM 0 HG21 VAL A 35 -6.655 9.807 7.679 1.00 23.41 H new ATOM 0 HG22 VAL A 35 -6.498 9.493 5.934 1.00 23.41 H new ATOM 0 HG23 VAL A 35 -6.647 11.164 6.528 1.00 23.41 H new ATOM 563 N TRP A 36 -11.172 11.382 5.451 1.00 23.44 N ATOM 564 CA TRP A 36 -12.629 11.359 5.401 1.00 42.42 C ATOM 565 C TRP A 36 -13.121 11.009 4.001 1.00 31.13 C ATOM 566 O TRP A 36 -13.829 10.020 3.811 1.00 43.32 O ATOM 567 CB TRP A 36 -13.196 12.713 5.830 1.00 50.23 C ATOM 568 CG TRP A 36 -14.683 12.813 5.670 1.00 11.11 C ATOM 569 CD1 TRP A 36 -15.632 12.452 6.583 1.00 63.54 C ATOM 570 CD2 TRP A 36 -15.391 13.306 4.527 1.00 24.41 C ATOM 571 NE1 TRP A 36 -16.886 12.688 6.077 1.00 54.34 N ATOM 572 CE2 TRP A 36 -16.766 13.213 4.817 1.00 32.02 C ATOM 573 CE3 TRP A 36 -14.997 13.817 3.287 1.00 64.32 C ATOM 574 CZ2 TRP A 36 -17.745 13.613 3.912 1.00 0.30 C ATOM 575 CZ3 TRP A 36 -15.970 14.212 2.389 1.00 15.05 C ATOM 576 CH2 TRP A 36 -17.331 14.109 2.706 1.00 15.03 C ATOM 0 H TRP A 36 -10.775 12.253 5.803 1.00 23.44 H new ATOM 0 HA TRP A 36 -12.979 10.591 6.091 1.00 42.42 H new ATOM 0 HB2 TRP A 36 -12.937 12.893 6.873 1.00 50.23 H new ATOM 0 HB3 TRP A 36 -12.721 13.500 5.244 1.00 50.23 H new ATOM 0 HD1 TRP A 36 -15.426 12.041 7.560 1.00 63.54 H new ATOM 0 HE1 TRP A 36 -17.765 12.503 6.561 1.00 54.34 H new ATOM 0 HE3 TRP A 36 -13.950 13.902 3.035 1.00 64.32 H new ATOM 0 HZ2 TRP A 36 -18.795 13.535 4.153 1.00 0.30 H new ATOM 0 HZ3 TRP A 36 -15.677 14.606 1.427 1.00 15.05 H new ATOM 0 HH2 TRP A 36 -18.068 14.428 1.984 1.00 15.03 H new ATOM 587 N ALA A 37 -12.741 11.825 3.024 1.00 64.44 N ATOM 588 CA ALA A 37 -13.141 11.599 1.640 1.00 25.20 C ATOM 589 C ALA A 37 -12.717 10.213 1.166 1.00 42.11 C ATOM 590 O ALA A 37 -13.403 9.587 0.358 1.00 51.23 O ATOM 591 CB ALA A 37 -12.549 12.672 0.737 1.00 33.44 C ATOM 0 H ALA A 37 -12.156 12.649 3.165 1.00 64.44 H new ATOM 0 HA ALA A 37 -14.228 11.656 1.588 1.00 25.20 H new ATOM 0 HB1 ALA A 37 -12.856 12.491 -0.293 1.00 33.44 H new ATOM 0 HB2 ALA A 37 -12.905 13.652 1.055 1.00 33.44 H new ATOM 0 HB3 ALA A 37 -11.461 12.643 0.802 1.00 33.44 H new ATOM 597 N SER A 38 -11.583 9.741 1.672 1.00 24.31 N ATOM 598 CA SER A 38 -11.066 8.430 1.295 1.00 4.34 C ATOM 599 C SER A 38 -12.045 7.327 1.685 1.00 54.05 C ATOM 600 O SER A 38 -12.107 6.280 1.039 1.00 14.31 O ATOM 601 CB SER A 38 -9.711 8.182 1.962 1.00 44.32 C ATOM 602 OG SER A 38 -8.647 8.387 1.047 1.00 14.14 O ATOM 0 H SER A 38 -11.005 10.246 2.344 1.00 24.31 H new ATOM 0 HA SER A 38 -10.940 8.415 0.212 1.00 4.34 H new ATOM 0 HB2 SER A 38 -9.595 8.850 2.816 1.00 44.32 H new ATOM 0 HB3 SER A 38 -9.673 7.163 2.347 1.00 44.32 H new ATOM 0 HG SER A 38 -7.792 8.224 1.498 1.00 14.14 H new ATOM 608 N ARG A 39 -12.810 7.570 2.744 1.00 2.04 N ATOM 609 CA ARG A 39 -13.786 6.597 3.221 1.00 41.22 C ATOM 610 C ARG A 39 -15.071 6.670 2.401 1.00 12.32 C ATOM 611 O ARG A 39 -15.786 5.680 2.262 1.00 73.31 O ATOM 612 CB ARG A 39 -14.096 6.839 4.699 1.00 33.35 C ATOM 613 CG ARG A 39 -14.988 5.772 5.316 1.00 54.53 C ATOM 614 CD ARG A 39 -14.792 5.684 6.821 1.00 10.53 C ATOM 615 NE ARG A 39 -15.212 4.391 7.353 1.00 22.41 N ATOM 616 CZ ARG A 39 -14.993 4.005 8.605 1.00 51.00 C ATOM 617 NH1 ARG A 39 -14.364 4.810 9.450 1.00 0.01 N ATOM 618 NH2 ARG A 39 -15.406 2.812 9.015 1.00 43.11 N ATOM 0 H ARG A 39 -12.773 8.432 3.288 1.00 2.04 H new ATOM 0 HA ARG A 39 -13.358 5.601 3.105 1.00 41.22 H new ATOM 0 HB2 ARG A 39 -13.160 6.885 5.255 1.00 33.35 H new ATOM 0 HB3 ARG A 39 -14.578 7.811 4.806 1.00 33.35 H new ATOM 0 HG2 ARG A 39 -16.032 5.997 5.097 1.00 54.53 H new ATOM 0 HG3 ARG A 39 -14.768 4.806 4.862 1.00 54.53 H new ATOM 0 HD2 ARG A 39 -13.742 5.850 7.060 1.00 10.53 H new ATOM 0 HD3 ARG A 39 -15.359 6.478 7.307 1.00 10.53 H new ATOM 0 HE ARG A 39 -15.700 3.749 6.729 1.00 22.41 H new ATOM 0 HH11 ARG A 39 -14.047 5.728 9.139 1.00 0.01 H new ATOM 0 HH12 ARG A 39 -14.197 4.511 10.411 1.00 0.01 H new ATOM 0 HH21 ARG A 39 -15.892 2.191 8.368 1.00 43.11 H new ATOM 0 HH22 ARG A 39 -15.237 2.517 9.977 1.00 43.11 H new ATOM 632 N GLU A 40 -15.357 7.852 1.862 1.00 20.33 N ATOM 633 CA GLU A 40 -16.556 8.054 1.059 1.00 71.10 C ATOM 634 C GLU A 40 -16.358 7.523 -0.359 1.00 4.35 C ATOM 635 O GLU A 40 -17.269 6.945 -0.951 1.00 32.31 O ATOM 636 CB GLU A 40 -16.922 9.539 1.012 1.00 0.30 C ATOM 637 CG GLU A 40 -18.413 9.794 0.873 1.00 10.42 C ATOM 638 CD GLU A 40 -18.834 10.031 -0.565 1.00 24.11 C ATOM 639 OE1 GLU A 40 -18.313 9.330 -1.458 1.00 50.42 O ATOM 640 OE2 GLU A 40 -19.683 10.917 -0.796 1.00 72.22 O ATOM 0 H GLU A 40 -14.775 8.683 1.967 1.00 20.33 H new ATOM 0 HA GLU A 40 -17.371 7.501 1.525 1.00 71.10 H new ATOM 0 HB2 GLU A 40 -16.562 10.022 1.921 1.00 0.30 H new ATOM 0 HB3 GLU A 40 -16.402 10.006 0.175 1.00 0.30 H new ATOM 0 HG2 GLU A 40 -18.962 8.941 1.272 1.00 10.42 H new ATOM 0 HG3 GLU A 40 -18.687 10.660 1.475 1.00 10.42 H new ATOM 647 N LEU A 41 -15.159 7.724 -0.896 1.00 73.41 N ATOM 648 CA LEU A 41 -14.839 7.266 -2.244 1.00 30.45 C ATOM 649 C LEU A 41 -14.845 5.742 -2.317 1.00 2.12 C ATOM 650 O LEU A 41 -15.331 5.161 -3.286 1.00 11.33 O ATOM 651 CB LEU A 41 -13.473 7.803 -2.675 1.00 1.13 C ATOM 652 CG LEU A 41 -13.315 9.325 -2.662 1.00 75.31 C ATOM 653 CD1 LEU A 41 -11.871 9.709 -2.383 1.00 32.22 C ATOM 654 CD2 LEU A 41 -13.783 9.920 -3.982 1.00 70.32 C ATOM 0 H LEU A 41 -14.393 8.200 -0.419 1.00 73.41 H new ATOM 0 HA LEU A 41 -15.603 7.647 -2.922 1.00 30.45 H new ATOM 0 HB2 LEU A 41 -12.713 7.373 -2.022 1.00 1.13 H new ATOM 0 HB3 LEU A 41 -13.266 7.445 -3.683 1.00 1.13 H new ATOM 0 HG LEU A 41 -13.937 9.730 -1.863 1.00 75.31 H new ATOM 0 HD11 LEU A 41 -11.778 10.795 -2.378 1.00 32.22 H new ATOM 0 HD12 LEU A 41 -11.571 9.314 -1.412 1.00 32.22 H new ATOM 0 HD13 LEU A 41 -11.228 9.294 -3.159 1.00 32.22 H new ATOM 0 HD21 LEU A 41 -13.664 11.003 -3.956 1.00 70.32 H new ATOM 0 HD22 LEU A 41 -13.188 9.509 -4.798 1.00 70.32 H new ATOM 0 HD23 LEU A 41 -14.833 9.674 -4.140 1.00 70.32 H new ATOM 666 N GLU A 42 -14.304 5.103 -1.285 1.00 63.35 N ATOM 667 CA GLU A 42 -14.248 3.647 -1.233 1.00 12.34 C ATOM 668 C GLU A 42 -15.646 3.054 -1.083 1.00 14.41 C ATOM 669 O GLU A 42 -15.873 1.884 -1.391 1.00 60.04 O ATOM 670 CB GLU A 42 -13.361 3.189 -0.074 1.00 35.22 C ATOM 671 CG GLU A 42 -13.046 1.703 -0.098 1.00 71.01 C ATOM 672 CD GLU A 42 -12.623 1.173 1.258 1.00 12.22 C ATOM 673 OE1 GLU A 42 -11.539 1.567 1.736 1.00 30.52 O ATOM 674 OE2 GLU A 42 -13.376 0.366 1.841 1.00 62.21 O ATOM 0 H GLU A 42 -13.898 5.570 -0.474 1.00 63.35 H new ATOM 0 HA GLU A 42 -13.820 3.292 -2.170 1.00 12.34 H new ATOM 0 HB2 GLU A 42 -12.427 3.750 -0.099 1.00 35.22 H new ATOM 0 HB3 GLU A 42 -13.854 3.432 0.867 1.00 35.22 H new ATOM 0 HG2 GLU A 42 -13.924 1.155 -0.440 1.00 71.01 H new ATOM 0 HG3 GLU A 42 -12.252 1.516 -0.821 1.00 71.01 H new ATOM 681 N ARG A 43 -16.580 3.871 -0.607 1.00 14.35 N ATOM 682 CA ARG A 43 -17.956 3.428 -0.413 1.00 42.13 C ATOM 683 C ARG A 43 -18.784 3.657 -1.675 1.00 44.24 C ATOM 684 O ARG A 43 -19.716 2.907 -1.963 1.00 45.14 O ATOM 685 CB ARG A 43 -18.591 4.166 0.767 1.00 52.33 C ATOM 686 CG ARG A 43 -20.064 3.846 0.965 1.00 62.35 C ATOM 687 CD ARG A 43 -20.368 3.498 2.413 1.00 2.43 C ATOM 688 NE ARG A 43 -21.776 3.708 2.743 1.00 62.33 N ATOM 689 CZ ARG A 43 -22.229 3.839 3.985 1.00 64.23 C ATOM 690 NH1 ARG A 43 -21.389 3.782 5.009 1.00 4.12 N ATOM 691 NH2 ARG A 43 -23.523 4.027 4.204 1.00 72.23 N ATOM 0 H ARG A 43 -16.409 4.843 -0.349 1.00 14.35 H new ATOM 0 HA ARG A 43 -17.940 2.360 -0.198 1.00 42.13 H new ATOM 0 HB2 ARG A 43 -18.048 3.913 1.677 1.00 52.33 H new ATOM 0 HB3 ARG A 43 -18.478 5.240 0.616 1.00 52.33 H new ATOM 0 HG2 ARG A 43 -20.667 4.701 0.661 1.00 62.35 H new ATOM 0 HG3 ARG A 43 -20.346 3.012 0.322 1.00 62.35 H new ATOM 0 HD2 ARG A 43 -20.104 2.457 2.599 1.00 2.43 H new ATOM 0 HD3 ARG A 43 -19.747 4.107 3.070 1.00 2.43 H new ATOM 0 HE ARG A 43 -22.448 3.757 1.977 1.00 62.33 H new ATOM 0 HH11 ARG A 43 -20.393 3.637 4.844 1.00 4.12 H new ATOM 0 HH12 ARG A 43 -21.739 3.883 5.962 1.00 4.12 H new ATOM 0 HH21 ARG A 43 -24.172 4.071 3.418 1.00 72.23 H new ATOM 0 HH22 ARG A 43 -23.869 4.127 5.158 1.00 72.23 H new ATOM 705 N PHE A 44 -18.436 4.699 -2.423 1.00 51.13 N ATOM 706 CA PHE A 44 -19.147 5.029 -3.654 1.00 31.24 C ATOM 707 C PHE A 44 -18.817 4.028 -4.757 1.00 21.11 C ATOM 708 O PHE A 44 -19.693 3.312 -5.242 1.00 43.32 O ATOM 709 CB PHE A 44 -18.790 6.445 -4.111 1.00 33.44 C ATOM 710 CG PHE A 44 -19.898 7.438 -3.902 1.00 42.24 C ATOM 711 CD1 PHE A 44 -20.594 7.479 -2.705 1.00 65.13 C ATOM 712 CD2 PHE A 44 -20.241 8.332 -4.904 1.00 65.11 C ATOM 713 CE1 PHE A 44 -21.613 8.392 -2.512 1.00 40.11 C ATOM 714 CE2 PHE A 44 -21.260 9.248 -4.716 1.00 63.25 C ATOM 715 CZ PHE A 44 -21.946 9.278 -3.518 1.00 64.03 C ATOM 0 H PHE A 44 -17.666 5.330 -2.199 1.00 51.13 H new ATOM 0 HA PHE A 44 -20.217 4.980 -3.451 1.00 31.24 H new ATOM 0 HB2 PHE A 44 -17.905 6.781 -3.571 1.00 33.44 H new ATOM 0 HB3 PHE A 44 -18.528 6.422 -5.169 1.00 33.44 H new ATOM 0 HD1 PHE A 44 -20.337 6.790 -1.914 1.00 65.13 H new ATOM 0 HD2 PHE A 44 -19.706 8.313 -5.842 1.00 65.11 H new ATOM 0 HE1 PHE A 44 -22.149 8.413 -1.575 1.00 40.11 H new ATOM 0 HE2 PHE A 44 -21.519 9.939 -5.505 1.00 63.25 H new ATOM 0 HZ PHE A 44 -22.741 9.993 -3.368 1.00 64.03 H new ATOM 725 N ALA A 45 -17.547 3.983 -5.147 1.00 53.12 N ATOM 726 CA ALA A 45 -17.101 3.070 -6.191 1.00 51.25 C ATOM 727 C ALA A 45 -15.700 3.431 -6.674 1.00 62.32 C ATOM 728 O ALA A 45 -15.241 2.939 -7.705 1.00 34.33 O ATOM 729 CB ALA A 45 -18.081 3.079 -7.355 1.00 60.33 C ATOM 0 H ALA A 45 -16.809 4.568 -4.755 1.00 53.12 H new ATOM 0 HA ALA A 45 -17.064 2.066 -5.769 1.00 51.25 H new ATOM 0 HB1 ALA A 45 -17.735 2.392 -8.127 1.00 60.33 H new ATOM 0 HB2 ALA A 45 -19.065 2.765 -7.005 1.00 60.33 H new ATOM 0 HB3 ALA A 45 -18.147 4.086 -7.768 1.00 60.33 H new ATOM 735 N VAL A 46 -15.025 4.295 -5.923 1.00 64.22 N ATOM 736 CA VAL A 46 -13.676 4.722 -6.274 1.00 0.43 C ATOM 737 C VAL A 46 -12.678 4.346 -5.184 1.00 75.35 C ATOM 738 O VAL A 46 -13.007 4.355 -3.998 1.00 60.23 O ATOM 739 CB VAL A 46 -13.611 6.243 -6.510 1.00 13.11 C ATOM 740 CG1 VAL A 46 -12.200 6.666 -6.887 1.00 12.23 C ATOM 741 CG2 VAL A 46 -14.606 6.658 -7.583 1.00 33.43 C ATOM 0 H VAL A 46 -15.390 4.713 -5.067 1.00 64.22 H new ATOM 0 HA VAL A 46 -13.413 4.206 -7.198 1.00 0.43 H new ATOM 0 HB VAL A 46 -13.879 6.749 -5.582 1.00 13.11 H new ATOM 0 HG11 VAL A 46 -12.174 7.743 -7.050 1.00 12.23 H new ATOM 0 HG12 VAL A 46 -11.514 6.404 -6.081 1.00 12.23 H new ATOM 0 HG13 VAL A 46 -11.899 6.154 -7.801 1.00 12.23 H new ATOM 0 HG21 VAL A 46 -14.547 7.735 -7.737 1.00 33.43 H new ATOM 0 HG22 VAL A 46 -14.371 6.145 -8.515 1.00 33.43 H new ATOM 0 HG23 VAL A 46 -15.614 6.392 -7.267 1.00 33.43 H new ATOM 751 N ASN A 47 -11.459 4.015 -5.595 1.00 22.21 N ATOM 752 CA ASN A 47 -10.412 3.634 -4.652 1.00 50.43 C ATOM 753 C ASN A 47 -9.795 4.866 -3.998 1.00 41.41 C ATOM 754 O ASN A 47 -9.587 5.899 -4.635 1.00 0.25 O ATOM 755 CB ASN A 47 -9.327 2.824 -5.364 1.00 20.33 C ATOM 756 CG ASN A 47 -9.862 1.532 -5.953 1.00 3.43 C ATOM 757 OD1 ASN A 47 -11.025 1.182 -5.754 1.00 72.31 O ATOM 758 ND2 ASN A 47 -9.012 0.818 -6.683 1.00 15.13 N ATOM 0 H ASN A 47 -11.171 4.003 -6.573 1.00 22.21 H new ATOM 0 HA ASN A 47 -10.864 3.019 -3.874 1.00 50.43 H new ATOM 0 HB2 ASN A 47 -8.889 3.428 -6.158 1.00 20.33 H new ATOM 0 HB3 ASN A 47 -8.527 2.595 -4.660 1.00 20.33 H new ATOM 0 HD21 ASN A 47 -9.315 -0.060 -7.105 1.00 15.13 H new ATOM 0 HD22 ASN A 47 -8.057 1.148 -6.821 1.00 15.13 H new ATOM 765 N PRO A 48 -9.496 4.757 -2.695 1.00 70.14 N ATOM 766 CA PRO A 48 -8.897 5.852 -1.925 1.00 32.22 C ATOM 767 C PRO A 48 -7.455 6.127 -2.335 1.00 1.30 C ATOM 768 O PRO A 48 -6.905 7.186 -2.034 1.00 64.10 O ATOM 769 CB PRO A 48 -8.957 5.344 -0.483 1.00 2.45 C ATOM 770 CG PRO A 48 -8.971 3.859 -0.603 1.00 14.01 C ATOM 771 CD PRO A 48 -9.717 3.555 -1.873 1.00 70.41 C ATOM 0 HA PRO A 48 -9.420 6.795 -2.081 1.00 32.22 H new ATOM 0 HB2 PRO A 48 -8.097 5.686 0.093 1.00 2.45 H new ATOM 0 HB3 PRO A 48 -9.848 5.708 0.028 1.00 2.45 H new ATOM 0 HG2 PRO A 48 -7.957 3.461 -0.641 1.00 14.01 H new ATOM 0 HG3 PRO A 48 -9.461 3.402 0.257 1.00 14.01 H new ATOM 0 HD2 PRO A 48 -9.333 2.659 -2.360 1.00 70.41 H new ATOM 0 HD3 PRO A 48 -10.777 3.386 -1.685 1.00 70.41 H new ATOM 779 N GLY A 49 -6.846 5.166 -3.023 1.00 44.32 N ATOM 780 CA GLY A 49 -5.471 5.325 -3.462 1.00 74.54 C ATOM 781 C GLY A 49 -5.327 6.377 -4.544 1.00 42.33 C ATOM 782 O GLY A 49 -4.231 6.890 -4.780 1.00 35.05 O ATOM 0 H GLY A 49 -7.280 4.281 -3.284 1.00 44.32 H new ATOM 0 HA2 GLY A 49 -4.850 5.598 -2.609 1.00 74.54 H new ATOM 0 HA3 GLY A 49 -5.099 4.371 -3.835 1.00 74.54 H new ATOM 786 N LEU A 50 -6.433 6.700 -5.205 1.00 31.42 N ATOM 787 CA LEU A 50 -6.425 7.697 -6.270 1.00 23.41 C ATOM 788 C LEU A 50 -6.035 9.068 -5.728 1.00 61.32 C ATOM 789 O LEU A 50 -5.672 9.967 -6.488 1.00 54.51 O ATOM 790 CB LEU A 50 -7.800 7.771 -6.936 1.00 1.31 C ATOM 791 CG LEU A 50 -8.120 6.662 -7.938 1.00 55.32 C ATOM 792 CD1 LEU A 50 -9.500 6.873 -8.544 1.00 51.13 C ATOM 793 CD2 LEU A 50 -7.060 6.605 -9.029 1.00 14.13 C ATOM 0 H LEU A 50 -7.347 6.286 -5.022 1.00 31.42 H new ATOM 0 HA LEU A 50 -5.685 7.396 -7.012 1.00 23.41 H new ATOM 0 HB2 LEU A 50 -8.561 7.759 -6.156 1.00 1.31 H new ATOM 0 HB3 LEU A 50 -7.883 8.730 -7.447 1.00 1.31 H new ATOM 0 HG LEU A 50 -8.119 5.709 -7.409 1.00 55.32 H new ATOM 0 HD11 LEU A 50 -9.711 6.074 -9.255 1.00 51.13 H new ATOM 0 HD12 LEU A 50 -10.250 6.863 -7.753 1.00 51.13 H new ATOM 0 HD13 LEU A 50 -9.528 7.834 -9.058 1.00 51.13 H new ATOM 0 HD21 LEU A 50 -7.305 5.810 -9.733 1.00 14.13 H new ATOM 0 HD22 LEU A 50 -7.028 7.559 -9.556 1.00 14.13 H new ATOM 0 HD23 LEU A 50 -6.087 6.406 -8.581 1.00 14.13 H new ATOM 805 N LEU A 51 -6.109 9.221 -4.411 1.00 34.01 N ATOM 806 CA LEU A 51 -5.761 10.482 -3.766 1.00 11.32 C ATOM 807 C LEU A 51 -4.252 10.606 -3.589 1.00 65.21 C ATOM 808 O LEU A 51 -3.744 11.665 -3.223 1.00 11.31 O ATOM 809 CB LEU A 51 -6.457 10.593 -2.409 1.00 3.15 C ATOM 810 CG LEU A 51 -7.980 10.721 -2.442 1.00 74.15 C ATOM 811 CD1 LEU A 51 -8.528 10.943 -1.041 1.00 54.41 C ATOM 812 CD2 LEU A 51 -8.399 11.854 -3.368 1.00 75.30 C ATOM 0 H LEU A 51 -6.407 8.487 -3.768 1.00 34.01 H new ATOM 0 HA LEU A 51 -6.100 11.295 -4.408 1.00 11.32 H new ATOM 0 HB2 LEU A 51 -6.199 9.714 -1.819 1.00 3.15 H new ATOM 0 HB3 LEU A 51 -6.051 11.459 -1.885 1.00 3.15 H new ATOM 0 HG LEU A 51 -8.396 9.790 -2.828 1.00 74.15 H new ATOM 0 HD11 LEU A 51 -9.614 11.032 -1.085 1.00 54.41 H new ATOM 0 HD12 LEU A 51 -8.258 10.099 -0.407 1.00 54.41 H new ATOM 0 HD13 LEU A 51 -8.106 11.858 -0.626 1.00 54.41 H new ATOM 0 HD21 LEU A 51 -9.486 11.931 -3.380 1.00 75.30 H new ATOM 0 HD22 LEU A 51 -7.972 12.792 -3.012 1.00 75.30 H new ATOM 0 HD23 LEU A 51 -8.039 11.652 -4.377 1.00 75.30 H new ATOM 824 N GLU A 52 -3.539 9.515 -3.852 1.00 61.24 N ATOM 825 CA GLU A 52 -2.087 9.501 -3.723 1.00 45.43 C ATOM 826 C GLU A 52 -1.418 9.759 -5.070 1.00 64.21 C ATOM 827 O GLU A 52 -0.282 9.343 -5.302 1.00 40.24 O ATOM 828 CB GLU A 52 -1.615 8.162 -3.155 1.00 70.51 C ATOM 829 CG GLU A 52 -0.164 8.169 -2.702 1.00 34.12 C ATOM 830 CD GLU A 52 0.154 7.035 -1.748 1.00 33.52 C ATOM 831 OE1 GLU A 52 -0.115 7.184 -0.537 1.00 51.12 O ATOM 832 OE2 GLU A 52 0.673 5.997 -2.210 1.00 42.41 O ATOM 0 H GLU A 52 -3.944 8.629 -4.156 1.00 61.24 H new ATOM 0 HA GLU A 52 -1.802 10.298 -3.037 1.00 45.43 H new ATOM 0 HB2 GLU A 52 -2.249 7.892 -2.311 1.00 70.51 H new ATOM 0 HB3 GLU A 52 -1.746 7.389 -3.912 1.00 70.51 H new ATOM 0 HG2 GLU A 52 0.486 8.098 -3.574 1.00 34.12 H new ATOM 0 HG3 GLU A 52 0.057 9.120 -2.217 1.00 34.12 H new ATOM 839 N THR A 53 -2.130 10.447 -5.957 1.00 13.03 N ATOM 840 CA THR A 53 -1.609 10.759 -7.281 1.00 4.24 C ATOM 841 C THR A 53 -2.394 11.894 -7.928 1.00 0.52 C ATOM 842 O THR A 53 -3.586 11.760 -8.202 1.00 62.31 O ATOM 843 CB THR A 53 -1.651 9.528 -8.206 1.00 2.03 C ATOM 844 OG1 THR A 53 -2.568 9.755 -9.282 1.00 12.54 O ATOM 845 CG2 THR A 53 -2.065 8.285 -7.433 1.00 74.11 C ATOM 0 H THR A 53 -3.071 10.799 -5.781 1.00 13.03 H new ATOM 0 HA THR A 53 -0.572 11.068 -7.147 1.00 4.24 H new ATOM 0 HB THR A 53 -0.651 9.369 -8.609 1.00 2.03 H new ATOM 0 HG1 THR A 53 -2.588 8.968 -9.866 1.00 12.54 H new ATOM 0 HG21 THR A 53 -2.088 7.428 -8.107 1.00 74.11 H new ATOM 0 HG22 THR A 53 -1.349 8.099 -6.633 1.00 74.11 H new ATOM 0 HG23 THR A 53 -3.056 8.436 -7.005 1.00 74.11 H new ATOM 853 N SER A 54 -1.717 13.013 -8.170 1.00 60.25 N ATOM 854 CA SER A 54 -2.353 14.173 -8.783 1.00 63.10 C ATOM 855 C SER A 54 -3.169 13.763 -10.005 1.00 51.14 C ATOM 856 O SER A 54 -4.270 14.266 -10.227 1.00 1.15 O ATOM 857 CB SER A 54 -1.298 15.207 -9.182 1.00 53.23 C ATOM 858 OG SER A 54 -1.810 16.524 -9.075 1.00 72.24 O ATOM 0 H SER A 54 -0.729 13.140 -7.951 1.00 60.25 H new ATOM 0 HA SER A 54 -3.028 14.617 -8.051 1.00 63.10 H new ATOM 0 HB2 SER A 54 -0.421 15.101 -8.544 1.00 53.23 H new ATOM 0 HB3 SER A 54 -0.972 15.022 -10.205 1.00 53.23 H new ATOM 0 HG SER A 54 -1.117 17.167 -9.334 1.00 72.24 H new ATOM 864 N GLU A 55 -2.619 12.846 -10.796 1.00 20.03 N ATOM 865 CA GLU A 55 -3.295 12.369 -11.997 1.00 21.15 C ATOM 866 C GLU A 55 -4.649 11.756 -11.652 1.00 23.44 C ATOM 867 O GLU A 55 -5.596 11.837 -12.431 1.00 71.02 O ATOM 868 CB GLU A 55 -2.426 11.340 -12.723 1.00 42.11 C ATOM 869 CG GLU A 55 -2.324 11.578 -14.220 1.00 4.31 C ATOM 870 CD GLU A 55 -1.411 12.739 -14.566 1.00 14.24 C ATOM 871 OE1 GLU A 55 -1.214 13.618 -13.700 1.00 33.30 O ATOM 872 OE2 GLU A 55 -0.893 12.767 -15.701 1.00 14.32 O ATOM 0 H GLU A 55 -1.708 12.419 -10.627 1.00 20.03 H new ATOM 0 HA GLU A 55 -3.460 13.223 -12.654 1.00 21.15 H new ATOM 0 HB2 GLU A 55 -1.425 11.354 -12.292 1.00 42.11 H new ATOM 0 HB3 GLU A 55 -2.834 10.344 -12.549 1.00 42.11 H new ATOM 0 HG2 GLU A 55 -1.954 10.674 -14.703 1.00 4.31 H new ATOM 0 HG3 GLU A 55 -3.319 11.771 -14.622 1.00 4.31 H new ATOM 879 N GLY A 56 -4.730 11.140 -10.476 1.00 71.31 N ATOM 880 CA GLY A 56 -5.970 10.519 -10.047 1.00 55.23 C ATOM 881 C GLY A 56 -6.972 11.529 -9.522 1.00 74.05 C ATOM 882 O GLY A 56 -8.169 11.424 -9.793 1.00 0.23 O ATOM 0 H GLY A 56 -3.959 11.060 -9.813 1.00 71.31 H new ATOM 0 HA2 GLY A 56 -6.410 9.977 -10.884 1.00 55.23 H new ATOM 0 HA3 GLY A 56 -5.756 9.786 -9.269 1.00 55.23 H new ATOM 886 N CYS A 57 -6.483 12.508 -8.770 1.00 14.53 N ATOM 887 CA CYS A 57 -7.345 13.540 -8.203 1.00 51.11 C ATOM 888 C CYS A 57 -8.088 14.292 -9.303 1.00 63.21 C ATOM 889 O CYS A 57 -9.180 14.815 -9.081 1.00 51.33 O ATOM 890 CB CYS A 57 -6.520 14.520 -7.367 1.00 70.04 C ATOM 891 SG CYS A 57 -6.918 14.501 -5.604 1.00 24.25 S ATOM 0 H CYS A 57 -5.495 12.610 -8.538 1.00 14.53 H new ATOM 0 HA CYS A 57 -8.079 13.053 -7.560 1.00 51.11 H new ATOM 0 HB2 CYS A 57 -5.462 14.288 -7.493 1.00 70.04 H new ATOM 0 HB3 CYS A 57 -6.673 15.528 -7.752 1.00 70.04 H new ATOM 0 HG CYS A 57 -6.168 15.360 -4.980 1.00 24.25 H new ATOM 897 N ARG A 58 -7.488 14.342 -10.488 1.00 31.55 N ATOM 898 CA ARG A 58 -8.092 15.032 -11.622 1.00 22.34 C ATOM 899 C ARG A 58 -9.295 14.257 -12.152 1.00 22.21 C ATOM 900 O ARG A 58 -10.312 14.845 -12.516 1.00 2.11 O ATOM 901 CB ARG A 58 -7.063 15.223 -12.737 1.00 20.11 C ATOM 902 CG ARG A 58 -7.659 15.748 -14.033 1.00 1.33 C ATOM 903 CD ARG A 58 -6.576 16.107 -15.038 1.00 70.01 C ATOM 904 NE ARG A 58 -6.203 14.967 -15.871 1.00 30.12 N ATOM 905 CZ ARG A 58 -5.269 15.019 -16.814 1.00 0.01 C ATOM 906 NH1 ARG A 58 -4.616 16.151 -17.043 1.00 73.10 N ATOM 907 NH2 ARG A 58 -4.986 13.939 -17.531 1.00 2.31 N ATOM 0 H ARG A 58 -6.584 13.913 -10.688 1.00 31.55 H new ATOM 0 HA ARG A 58 -8.433 16.009 -11.281 1.00 22.34 H new ATOM 0 HB2 ARG A 58 -6.293 15.915 -12.395 1.00 20.11 H new ATOM 0 HB3 ARG A 58 -6.571 14.270 -12.933 1.00 20.11 H new ATOM 0 HG2 ARG A 58 -8.320 14.995 -14.462 1.00 1.33 H new ATOM 0 HG3 ARG A 58 -8.269 16.627 -13.825 1.00 1.33 H new ATOM 0 HD2 ARG A 58 -6.926 16.921 -15.673 1.00 70.01 H new ATOM 0 HD3 ARG A 58 -5.696 16.472 -14.508 1.00 70.01 H new ATOM 0 HE ARG A 58 -6.687 14.082 -15.720 1.00 30.12 H new ATOM 0 HH11 ARG A 58 -4.831 16.984 -16.494 1.00 73.10 H new ATOM 0 HH12 ARG A 58 -3.899 16.189 -17.768 1.00 73.10 H new ATOM 0 HH21 ARG A 58 -5.486 13.067 -17.358 1.00 2.31 H new ATOM 0 HH22 ARG A 58 -4.268 13.981 -18.255 1.00 2.31 H new ATOM 921 N GLN A 59 -9.169 12.934 -12.193 1.00 3.31 N ATOM 922 CA GLN A 59 -10.244 12.080 -12.680 1.00 71.11 C ATOM 923 C GLN A 59 -11.442 12.122 -11.738 1.00 33.50 C ATOM 924 O GLN A 59 -12.592 12.124 -12.179 1.00 1.01 O ATOM 925 CB GLN A 59 -9.752 10.639 -12.833 1.00 4.43 C ATOM 926 CG GLN A 59 -10.314 9.930 -14.053 1.00 50.44 C ATOM 927 CD GLN A 59 -9.913 8.470 -14.116 1.00 73.44 C ATOM 928 OE1 GLN A 59 -9.043 8.086 -14.898 1.00 74.52 O ATOM 929 NE2 GLN A 59 -10.547 7.645 -13.290 1.00 14.14 N ATOM 0 H GLN A 59 -8.333 12.431 -11.895 1.00 3.31 H new ATOM 0 HA GLN A 59 -10.557 12.455 -13.654 1.00 71.11 H new ATOM 0 HB2 GLN A 59 -8.664 10.640 -12.893 1.00 4.43 H new ATOM 0 HB3 GLN A 59 -10.021 10.075 -11.940 1.00 4.43 H new ATOM 0 HG2 GLN A 59 -11.401 10.004 -14.043 1.00 50.44 H new ATOM 0 HG3 GLN A 59 -9.969 10.437 -14.954 1.00 50.44 H new ATOM 0 HE21 GLN A 59 -11.262 8.006 -12.658 1.00 14.14 H new ATOM 0 HE22 GLN A 59 -10.319 6.651 -13.288 1.00 14.14 H new ATOM 938 N ILE A 60 -11.166 12.154 -10.439 1.00 13.22 N ATOM 939 CA ILE A 60 -12.221 12.197 -9.434 1.00 14.10 C ATOM 940 C ILE A 60 -13.116 13.417 -9.629 1.00 75.43 C ATOM 941 O ILE A 60 -14.337 13.293 -9.739 1.00 73.42 O ATOM 942 CB ILE A 60 -11.641 12.224 -8.008 1.00 25.14 C ATOM 943 CG1 ILE A 60 -10.721 11.022 -7.786 1.00 65.35 C ATOM 944 CG2 ILE A 60 -12.762 12.236 -6.979 1.00 73.44 C ATOM 945 CD1 ILE A 60 -9.852 11.144 -6.555 1.00 5.43 C ATOM 0 H ILE A 60 -10.220 12.151 -10.057 1.00 13.22 H new ATOM 0 HA ILE A 60 -12.813 11.290 -9.559 1.00 14.10 H new ATOM 0 HB ILE A 60 -11.055 13.135 -7.888 1.00 25.14 H new ATOM 0 HG12 ILE A 60 -11.328 10.121 -7.704 1.00 65.35 H new ATOM 0 HG13 ILE A 60 -10.082 10.898 -8.660 1.00 65.35 H new ATOM 0 HG21 ILE A 60 -12.335 12.255 -5.976 1.00 73.44 H new ATOM 0 HG22 ILE A 60 -13.382 13.120 -7.126 1.00 73.44 H new ATOM 0 HG23 ILE A 60 -13.373 11.341 -7.096 1.00 73.44 H new ATOM 0 HD11 ILE A 60 -9.227 10.256 -6.462 1.00 5.43 H new ATOM 0 HD12 ILE A 60 -9.218 12.027 -6.643 1.00 5.43 H new ATOM 0 HD13 ILE A 60 -10.484 11.237 -5.672 1.00 5.43 H new ATOM 957 N LEU A 61 -12.502 14.593 -9.672 1.00 14.14 N ATOM 958 CA LEU A 61 -13.244 15.837 -9.855 1.00 4.23 C ATOM 959 C LEU A 61 -14.038 15.810 -11.157 1.00 73.31 C ATOM 960 O LEU A 61 -15.173 16.279 -11.213 1.00 15.14 O ATOM 961 CB LEU A 61 -12.285 17.030 -9.854 1.00 24.34 C ATOM 962 CG LEU A 61 -11.481 17.243 -8.571 1.00 70.43 C ATOM 963 CD1 LEU A 61 -10.291 18.153 -8.831 1.00 50.25 C ATOM 964 CD2 LEU A 61 -12.367 17.820 -7.477 1.00 13.32 C ATOM 0 H LEU A 61 -11.493 14.713 -9.583 1.00 14.14 H new ATOM 0 HA LEU A 61 -13.944 15.940 -9.026 1.00 4.23 H new ATOM 0 HB2 LEU A 61 -11.586 16.909 -10.681 1.00 24.34 H new ATOM 0 HB3 LEU A 61 -12.861 17.934 -10.053 1.00 24.34 H new ATOM 0 HG LEU A 61 -11.106 16.276 -8.235 1.00 70.43 H new ATOM 0 HD11 LEU A 61 -9.731 18.293 -7.906 1.00 50.25 H new ATOM 0 HD12 LEU A 61 -9.644 17.700 -9.582 1.00 50.25 H new ATOM 0 HD13 LEU A 61 -10.644 19.119 -9.191 1.00 50.25 H new ATOM 0 HD21 LEU A 61 -11.779 17.965 -6.571 1.00 13.32 H new ATOM 0 HD22 LEU A 61 -12.772 18.778 -7.804 1.00 13.32 H new ATOM 0 HD23 LEU A 61 -13.186 17.131 -7.271 1.00 13.32 H new ATOM 976 N GLY A 62 -13.433 15.256 -12.203 1.00 21.31 N ATOM 977 CA GLY A 62 -14.099 15.175 -13.489 1.00 53.45 C ATOM 978 C GLY A 62 -15.339 14.305 -13.447 1.00 23.51 C ATOM 979 O GLY A 62 -16.212 14.416 -14.307 1.00 32.44 O ATOM 0 H GLY A 62 -12.493 14.862 -12.182 1.00 21.31 H new ATOM 0 HA2 GLY A 62 -14.374 16.178 -13.816 1.00 53.45 H new ATOM 0 HA3 GLY A 62 -13.405 14.777 -14.229 1.00 53.45 H new ATOM 983 N GLN A 63 -15.415 13.435 -12.445 1.00 23.13 N ATOM 984 CA GLN A 63 -16.556 12.540 -12.296 1.00 73.22 C ATOM 985 C GLN A 63 -17.701 13.234 -11.566 1.00 12.43 C ATOM 986 O GLN A 63 -18.840 13.239 -12.036 1.00 64.52 O ATOM 987 CB GLN A 63 -16.145 11.276 -11.539 1.00 30.21 C ATOM 988 CG GLN A 63 -16.066 10.038 -12.418 1.00 14.35 C ATOM 989 CD GLN A 63 -15.454 8.851 -11.701 1.00 33.21 C ATOM 990 OE1 GLN A 63 -14.915 8.985 -10.602 1.00 34.42 O ATOM 991 NE2 GLN A 63 -15.535 7.679 -12.320 1.00 11.24 N ATOM 0 H GLN A 63 -14.700 13.331 -11.725 1.00 23.13 H new ATOM 0 HA GLN A 63 -16.900 12.262 -13.292 1.00 73.22 H new ATOM 0 HB2 GLN A 63 -15.174 11.442 -11.072 1.00 30.21 H new ATOM 0 HB3 GLN A 63 -16.859 11.096 -10.735 1.00 30.21 H new ATOM 0 HG2 GLN A 63 -17.067 9.775 -12.759 1.00 14.35 H new ATOM 0 HG3 GLN A 63 -15.476 10.265 -13.306 1.00 14.35 H new ATOM 0 HE21 GLN A 63 -15.991 7.613 -13.230 1.00 11.24 H new ATOM 0 HE22 GLN A 63 -15.142 6.844 -11.885 1.00 11.24 H new ATOM 1000 N LEU A 64 -17.393 13.821 -10.415 1.00 21.54 N ATOM 1001 CA LEU A 64 -18.396 14.518 -9.618 1.00 0.30 C ATOM 1002 C LEU A 64 -18.848 15.799 -10.313 1.00 73.12 C ATOM 1003 O LEU A 64 -20.003 16.206 -10.192 1.00 53.43 O ATOM 1004 CB LEU A 64 -17.838 14.847 -8.232 1.00 55.14 C ATOM 1005 CG LEU A 64 -17.198 13.684 -7.473 1.00 74.35 C ATOM 1006 CD1 LEU A 64 -16.597 14.168 -6.163 1.00 61.20 C ATOM 1007 CD2 LEU A 64 -18.221 12.587 -7.219 1.00 75.42 C ATOM 0 H LEU A 64 -16.456 13.828 -10.013 1.00 21.54 H new ATOM 0 HA LEU A 64 -19.258 13.860 -9.509 1.00 0.30 H new ATOM 0 HB2 LEU A 64 -17.095 15.637 -8.340 1.00 55.14 H new ATOM 0 HB3 LEU A 64 -18.647 15.251 -7.623 1.00 55.14 H new ATOM 0 HG LEU A 64 -16.397 13.272 -8.086 1.00 74.35 H new ATOM 0 HD11 LEU A 64 -16.146 13.327 -5.637 1.00 61.20 H new ATOM 0 HD12 LEU A 64 -15.834 14.919 -6.368 1.00 61.20 H new ATOM 0 HD13 LEU A 64 -17.380 14.606 -5.544 1.00 61.20 H new ATOM 0 HD21 LEU A 64 -17.749 11.767 -6.678 1.00 75.42 H new ATOM 0 HD22 LEU A 64 -19.044 12.987 -6.626 1.00 75.42 H new ATOM 0 HD23 LEU A 64 -18.605 12.220 -8.171 1.00 75.42 H new ATOM 1019 N GLN A 65 -17.932 16.425 -11.042 1.00 44.23 N ATOM 1020 CA GLN A 65 -18.238 17.658 -11.758 1.00 43.32 C ATOM 1021 C GLN A 65 -19.564 17.542 -12.501 1.00 21.41 C ATOM 1022 O GLN A 65 -20.518 18.275 -12.238 1.00 10.31 O ATOM 1023 CB GLN A 65 -17.115 17.994 -12.743 1.00 34.11 C ATOM 1024 CG GLN A 65 -16.243 19.156 -12.298 1.00 42.14 C ATOM 1025 CD GLN A 65 -16.081 20.210 -13.376 1.00 71.14 C ATOM 1026 OE1 GLN A 65 -15.109 20.197 -14.132 1.00 53.22 O ATOM 1027 NE2 GLN A 65 -17.035 21.130 -13.453 1.00 32.01 N ATOM 0 H GLN A 65 -16.972 16.100 -11.153 1.00 44.23 H new ATOM 0 HA GLN A 65 -18.322 18.461 -11.026 1.00 43.32 H new ATOM 0 HB2 GLN A 65 -16.489 17.113 -12.881 1.00 34.11 H new ATOM 0 HB3 GLN A 65 -17.552 18.230 -13.713 1.00 34.11 H new ATOM 0 HG2 GLN A 65 -16.679 19.614 -11.410 1.00 42.14 H new ATOM 0 HG3 GLN A 65 -15.261 18.780 -12.012 1.00 42.14 H new ATOM 0 HE21 GLN A 65 -17.823 21.103 -12.806 1.00 32.01 H new ATOM 0 HE22 GLN A 65 -16.980 21.864 -14.159 1.00 32.01 H new ATOM 1036 N PRO A 66 -19.629 16.599 -13.452 1.00 60.20 N ATOM 1037 CA PRO A 66 -20.835 16.363 -14.253 1.00 2.32 C ATOM 1038 C PRO A 66 -21.965 15.753 -13.432 1.00 33.50 C ATOM 1039 O PRO A 66 -23.073 15.557 -13.933 1.00 72.53 O ATOM 1040 CB PRO A 66 -20.361 15.380 -15.326 1.00 71.21 C ATOM 1041 CG PRO A 66 -19.199 14.679 -14.712 1.00 43.31 C ATOM 1042 CD PRO A 66 -18.532 15.688 -13.819 1.00 41.43 C ATOM 0 HA PRO A 66 -21.245 17.289 -14.656 1.00 2.32 H new ATOM 0 HB2 PRO A 66 -21.150 14.678 -15.595 1.00 71.21 H new ATOM 0 HB3 PRO A 66 -20.072 15.900 -16.239 1.00 71.21 H new ATOM 0 HG2 PRO A 66 -19.525 13.809 -14.142 1.00 43.31 H new ATOM 0 HG3 PRO A 66 -18.511 14.320 -15.477 1.00 43.31 H new ATOM 0 HD2 PRO A 66 -18.090 15.217 -12.941 1.00 41.43 H new ATOM 0 HD3 PRO A 66 -17.729 16.214 -14.336 1.00 41.43 H new ATOM 1050 N SER A 67 -21.680 15.454 -12.169 1.00 65.04 N ATOM 1051 CA SER A 67 -22.672 14.863 -11.280 1.00 22.12 C ATOM 1052 C SER A 67 -23.141 15.875 -10.239 1.00 12.11 C ATOM 1053 O SER A 67 -24.017 15.583 -9.423 1.00 0.10 O ATOM 1054 CB SER A 67 -22.094 13.629 -10.584 1.00 11.33 C ATOM 1055 OG SER A 67 -21.692 12.652 -11.529 1.00 20.33 O ATOM 0 H SER A 67 -20.769 15.612 -11.738 1.00 65.04 H new ATOM 0 HA SER A 67 -23.530 14.563 -11.882 1.00 22.12 H new ATOM 0 HB2 SER A 67 -21.241 13.920 -9.971 1.00 11.33 H new ATOM 0 HB3 SER A 67 -22.839 13.204 -9.912 1.00 11.33 H new ATOM 0 HG SER A 67 -20.747 12.782 -11.752 1.00 20.33 H new ATOM 1061 N LEU A 68 -22.552 17.065 -10.273 1.00 72.52 N ATOM 1062 CA LEU A 68 -22.909 18.122 -9.333 1.00 61.24 C ATOM 1063 C LEU A 68 -24.361 18.551 -9.521 1.00 70.41 C ATOM 1064 O LEU A 68 -25.055 18.861 -8.554 1.00 51.21 O ATOM 1065 CB LEU A 68 -21.982 19.326 -9.515 1.00 20.04 C ATOM 1066 CG LEU A 68 -20.593 19.204 -8.889 1.00 12.03 C ATOM 1067 CD1 LEU A 68 -19.669 20.287 -9.423 1.00 61.31 C ATOM 1068 CD2 LEU A 68 -20.683 19.278 -7.371 1.00 73.20 C ATOM 0 H LEU A 68 -21.825 17.322 -10.941 1.00 72.52 H new ATOM 0 HA LEU A 68 -22.794 17.731 -8.322 1.00 61.24 H new ATOM 0 HB2 LEU A 68 -21.862 19.509 -10.583 1.00 20.04 H new ATOM 0 HB3 LEU A 68 -22.472 20.204 -9.094 1.00 20.04 H new ATOM 0 HG LEU A 68 -20.177 18.234 -9.162 1.00 12.03 H new ATOM 0 HD11 LEU A 68 -18.685 20.184 -8.966 1.00 61.31 H new ATOM 0 HD12 LEU A 68 -19.579 20.187 -10.505 1.00 61.31 H new ATOM 0 HD13 LEU A 68 -20.080 21.267 -9.182 1.00 61.31 H new ATOM 0 HD21 LEU A 68 -19.685 19.189 -6.943 1.00 73.20 H new ATOM 0 HD22 LEU A 68 -21.120 20.233 -7.079 1.00 73.20 H new ATOM 0 HD23 LEU A 68 -21.309 18.465 -7.004 1.00 73.20 H new ATOM 1080 N GLN A 69 -24.812 18.563 -10.771 1.00 43.14 N ATOM 1081 CA GLN A 69 -26.182 18.952 -11.084 1.00 52.15 C ATOM 1082 C GLN A 69 -27.176 18.204 -10.202 1.00 21.31 C ATOM 1083 O GLN A 69 -28.110 18.796 -9.660 1.00 35.54 O ATOM 1084 CB GLN A 69 -26.487 18.682 -12.559 1.00 33.04 C ATOM 1085 CG GLN A 69 -27.875 19.132 -12.985 1.00 51.03 C ATOM 1086 CD GLN A 69 -28.049 19.139 -14.491 1.00 45.14 C ATOM 1087 OE1 GLN A 69 -28.035 18.090 -15.134 1.00 64.23 O ATOM 1088 NE2 GLN A 69 -28.214 20.327 -15.062 1.00 3.12 N ATOM 0 H GLN A 69 -24.249 18.308 -11.583 1.00 43.14 H new ATOM 0 HA GLN A 69 -26.283 20.020 -10.889 1.00 52.15 H new ATOM 0 HB2 GLN A 69 -25.744 19.190 -13.174 1.00 33.04 H new ATOM 0 HB3 GLN A 69 -26.385 17.614 -12.753 1.00 33.04 H new ATOM 0 HG2 GLN A 69 -28.619 18.472 -12.540 1.00 51.03 H new ATOM 0 HG3 GLN A 69 -28.064 20.133 -12.597 1.00 51.03 H new ATOM 0 HE21 GLN A 69 -28.219 21.171 -14.490 1.00 3.12 H new ATOM 0 HE22 GLN A 69 -28.336 20.395 -16.072 1.00 3.12 H new ATOM 1097 N THR A 70 -26.968 16.898 -10.061 1.00 14.24 N ATOM 1098 CA THR A 70 -27.846 16.068 -9.246 1.00 14.14 C ATOM 1099 C THR A 70 -27.068 15.365 -8.140 1.00 42.14 C ATOM 1100 O THR A 70 -27.388 14.238 -7.761 1.00 12.40 O ATOM 1101 CB THR A 70 -28.573 15.012 -10.099 1.00 4.23 C ATOM 1102 OG1 THR A 70 -27.654 13.988 -10.497 1.00 62.33 O ATOM 1103 CG2 THR A 70 -29.197 15.648 -11.331 1.00 52.23 C ATOM 0 H THR A 70 -26.199 16.393 -10.501 1.00 14.24 H new ATOM 0 HA THR A 70 -28.585 16.734 -8.799 1.00 14.14 H new ATOM 0 HB THR A 70 -29.367 14.573 -9.496 1.00 4.23 H new ATOM 0 HG1 THR A 70 -28.124 13.319 -11.038 1.00 62.33 H new ATOM 0 HG21 THR A 70 -29.705 14.883 -11.918 1.00 52.23 H new ATOM 0 HG22 THR A 70 -29.917 16.407 -11.024 1.00 52.23 H new ATOM 0 HG23 THR A 70 -28.417 16.111 -11.936 1.00 52.23 H new ATOM 1111 N GLY A 71 -26.042 16.036 -7.625 1.00 43.02 N ATOM 1112 CA GLY A 71 -25.233 15.459 -6.567 1.00 34.22 C ATOM 1113 C GLY A 71 -25.675 15.911 -5.189 1.00 21.44 C ATOM 1114 O GLY A 71 -25.778 17.108 -4.923 1.00 45.13 O ATOM 0 H GLY A 71 -25.757 16.969 -7.922 1.00 43.02 H new ATOM 0 HA2 GLY A 71 -25.287 14.372 -6.624 1.00 34.22 H new ATOM 0 HA3 GLY A 71 -24.190 15.735 -6.720 1.00 34.22 H new ATOM 1118 N SER A 72 -25.937 14.949 -4.309 1.00 72.42 N ATOM 1119 CA SER A 72 -26.375 15.254 -2.952 1.00 2.05 C ATOM 1120 C SER A 72 -25.284 15.992 -2.182 1.00 14.11 C ATOM 1121 O SER A 72 -24.280 16.412 -2.756 1.00 72.42 O ATOM 1122 CB SER A 72 -26.754 13.967 -2.214 1.00 42.14 C ATOM 1123 OG SER A 72 -25.624 13.132 -2.034 1.00 25.42 O ATOM 0 H SER A 72 -25.854 13.953 -4.512 1.00 72.42 H new ATOM 0 HA SER A 72 -27.251 15.900 -3.016 1.00 2.05 H new ATOM 0 HB2 SER A 72 -27.186 14.214 -1.244 1.00 42.14 H new ATOM 0 HB3 SER A 72 -27.519 13.433 -2.777 1.00 42.14 H new ATOM 0 HG SER A 72 -25.891 12.318 -1.559 1.00 25.42 H new ATOM 1129 N GLU A 73 -25.491 16.147 -0.878 1.00 4.20 N ATOM 1130 CA GLU A 73 -24.526 16.835 -0.028 1.00 42.14 C ATOM 1131 C GLU A 73 -23.260 16.000 0.145 1.00 10.51 C ATOM 1132 O GLU A 73 -22.154 16.537 0.204 1.00 72.53 O ATOM 1133 CB GLU A 73 -25.141 17.138 1.339 1.00 0.45 C ATOM 1134 CG GLU A 73 -25.702 15.913 2.040 1.00 23.21 C ATOM 1135 CD GLU A 73 -26.191 16.215 3.442 1.00 33.41 C ATOM 1136 OE1 GLU A 73 -26.484 17.395 3.728 1.00 35.21 O ATOM 1137 OE2 GLU A 73 -26.281 15.271 4.255 1.00 73.32 O ATOM 0 H GLU A 73 -26.318 15.806 -0.387 1.00 4.20 H new ATOM 0 HA GLU A 73 -24.258 17.773 -0.513 1.00 42.14 H new ATOM 0 HB2 GLU A 73 -24.383 17.595 1.975 1.00 0.45 H new ATOM 0 HB3 GLU A 73 -25.938 17.872 1.215 1.00 0.45 H new ATOM 0 HG2 GLU A 73 -26.525 15.508 1.452 1.00 23.21 H new ATOM 0 HG3 GLU A 73 -24.933 15.142 2.086 1.00 23.21 H new ATOM 1144 N GLU A 74 -23.433 14.684 0.226 1.00 52.33 N ATOM 1145 CA GLU A 74 -22.305 13.776 0.394 1.00 50.13 C ATOM 1146 C GLU A 74 -21.308 13.930 -0.750 1.00 61.51 C ATOM 1147 O GLU A 74 -20.117 13.654 -0.592 1.00 74.04 O ATOM 1148 CB GLU A 74 -22.795 12.328 0.467 1.00 1.31 C ATOM 1149 CG GLU A 74 -22.365 11.604 1.732 1.00 63.51 C ATOM 1150 CD GLU A 74 -23.322 10.495 2.124 1.00 75.35 C ATOM 1151 OE1 GLU A 74 -23.573 9.603 1.285 1.00 53.01 O ATOM 1152 OE2 GLU A 74 -23.820 10.519 3.268 1.00 73.01 O ATOM 0 H GLU A 74 -24.342 14.224 0.178 1.00 52.33 H new ATOM 0 HA GLU A 74 -21.802 14.030 1.327 1.00 50.13 H new ATOM 0 HB2 GLU A 74 -23.883 12.318 0.404 1.00 1.31 H new ATOM 0 HB3 GLU A 74 -22.421 11.782 -0.399 1.00 1.31 H new ATOM 0 HG2 GLU A 74 -21.370 11.185 1.586 1.00 63.51 H new ATOM 0 HG3 GLU A 74 -22.292 12.321 2.549 1.00 63.51 H new ATOM 1159 N LEU A 75 -21.801 14.370 -1.903 1.00 22.24 N ATOM 1160 CA LEU A 75 -20.954 14.560 -3.075 1.00 40.44 C ATOM 1161 C LEU A 75 -20.333 15.954 -3.078 1.00 33.33 C ATOM 1162 O LEU A 75 -19.235 16.153 -3.598 1.00 10.22 O ATOM 1163 CB LEU A 75 -21.765 14.348 -4.354 1.00 43.12 C ATOM 1164 CG LEU A 75 -20.957 14.159 -5.639 1.00 25.14 C ATOM 1165 CD1 LEU A 75 -21.502 12.992 -6.447 1.00 34.25 C ATOM 1166 CD2 LEU A 75 -20.966 15.435 -6.467 1.00 62.45 C ATOM 0 H LEU A 75 -22.783 14.602 -2.051 1.00 22.24 H new ATOM 0 HA LEU A 75 -20.151 13.825 -3.035 1.00 40.44 H new ATOM 0 HB2 LEU A 75 -22.400 13.473 -4.216 1.00 43.12 H new ATOM 0 HB3 LEU A 75 -22.426 15.204 -4.487 1.00 43.12 H new ATOM 0 HG LEU A 75 -19.926 13.934 -5.367 1.00 25.14 H new ATOM 0 HD11 LEU A 75 -20.914 12.874 -7.357 1.00 34.25 H new ATOM 0 HD12 LEU A 75 -21.441 12.079 -5.854 1.00 34.25 H new ATOM 0 HD13 LEU A 75 -22.542 13.185 -6.709 1.00 34.25 H new ATOM 0 HD21 LEU A 75 -20.386 15.282 -7.377 1.00 62.45 H new ATOM 0 HD22 LEU A 75 -21.992 15.691 -6.729 1.00 62.45 H new ATOM 0 HD23 LEU A 75 -20.526 16.247 -5.889 1.00 62.45 H new ATOM 1178 N ARG A 76 -21.042 16.912 -2.493 1.00 52.53 N ATOM 1179 CA ARG A 76 -20.560 18.287 -2.427 1.00 34.11 C ATOM 1180 C ARG A 76 -19.235 18.363 -1.676 1.00 13.00 C ATOM 1181 O ARG A 76 -18.248 18.891 -2.190 1.00 41.31 O ATOM 1182 CB ARG A 76 -21.597 19.181 -1.745 1.00 53.12 C ATOM 1183 CG ARG A 76 -21.618 20.605 -2.277 1.00 23.11 C ATOM 1184 CD ARG A 76 -22.630 21.463 -1.533 1.00 63.05 C ATOM 1185 NE ARG A 76 -22.036 22.132 -0.379 1.00 32.03 N ATOM 1186 CZ ARG A 76 -22.693 22.993 0.390 1.00 51.11 C ATOM 1187 NH1 ARG A 76 -23.959 23.289 0.127 1.00 34.21 N ATOM 1188 NH2 ARG A 76 -22.084 23.561 1.423 1.00 35.22 N ATOM 0 H ARG A 76 -21.952 16.763 -2.058 1.00 52.53 H new ATOM 0 HA ARG A 76 -20.401 18.639 -3.446 1.00 34.11 H new ATOM 0 HB2 ARG A 76 -22.585 18.740 -1.873 1.00 53.12 H new ATOM 0 HB3 ARG A 76 -21.395 19.205 -0.674 1.00 53.12 H new ATOM 0 HG2 ARG A 76 -20.626 21.045 -2.181 1.00 23.11 H new ATOM 0 HG3 ARG A 76 -21.860 20.594 -3.340 1.00 23.11 H new ATOM 0 HD2 ARG A 76 -23.042 22.209 -2.212 1.00 63.05 H new ATOM 0 HD3 ARG A 76 -23.461 20.840 -1.203 1.00 63.05 H new ATOM 0 HE ARG A 76 -21.063 21.927 -0.151 1.00 32.03 H new ATOM 0 HH11 ARG A 76 -24.430 22.855 -0.667 1.00 34.21 H new ATOM 0 HH12 ARG A 76 -24.462 23.950 0.719 1.00 34.21 H new ATOM 0 HH21 ARG A 76 -21.110 23.337 1.627 1.00 35.22 H new ATOM 0 HH22 ARG A 76 -22.590 24.222 2.013 1.00 35.22 H new ATOM 1202 N SER A 77 -19.220 17.833 -0.457 1.00 61.03 N ATOM 1203 CA SER A 77 -18.017 17.845 0.366 1.00 10.23 C ATOM 1204 C SER A 77 -16.828 17.272 -0.400 1.00 13.24 C ATOM 1205 O SER A 77 -15.733 17.835 -0.380 1.00 42.55 O ATOM 1206 CB SER A 77 -18.245 17.044 1.650 1.00 24.32 C ATOM 1207 OG SER A 77 -18.797 17.860 2.669 1.00 50.11 O ATOM 0 H SER A 77 -20.027 17.390 -0.018 1.00 61.03 H new ATOM 0 HA SER A 77 -17.794 18.880 0.626 1.00 10.23 H new ATOM 0 HB2 SER A 77 -18.914 16.208 1.447 1.00 24.32 H new ATOM 0 HB3 SER A 77 -17.300 16.620 1.991 1.00 24.32 H new ATOM 0 HG SER A 77 -18.572 17.485 3.546 1.00 50.11 H new ATOM 1213 N LEU A 78 -17.053 16.149 -1.072 1.00 64.05 N ATOM 1214 CA LEU A 78 -16.000 15.498 -1.847 1.00 71.11 C ATOM 1215 C LEU A 78 -15.414 16.454 -2.881 1.00 15.22 C ATOM 1216 O LEU A 78 -14.223 16.765 -2.848 1.00 72.05 O ATOM 1217 CB LEU A 78 -16.549 14.251 -2.542 1.00 33.21 C ATOM 1218 CG LEU A 78 -16.043 12.910 -2.010 1.00 63.34 C ATOM 1219 CD1 LEU A 78 -16.131 12.868 -0.493 1.00 1.25 C ATOM 1220 CD2 LEU A 78 -16.831 11.762 -2.624 1.00 35.23 C ATOM 0 H LEU A 78 -17.953 15.670 -1.097 1.00 64.05 H new ATOM 0 HA LEU A 78 -15.206 15.204 -1.160 1.00 71.11 H new ATOM 0 HB2 LEU A 78 -17.636 14.264 -2.463 1.00 33.21 H new ATOM 0 HB3 LEU A 78 -16.306 14.314 -3.603 1.00 33.21 H new ATOM 0 HG LEU A 78 -14.997 12.800 -2.294 1.00 63.34 H new ATOM 0 HD11 LEU A 78 -15.766 11.906 -0.134 1.00 1.25 H new ATOM 0 HD12 LEU A 78 -15.522 13.667 -0.071 1.00 1.25 H new ATOM 0 HD13 LEU A 78 -17.168 13.001 -0.185 1.00 1.25 H new ATOM 0 HD21 LEU A 78 -16.458 10.815 -2.234 1.00 35.23 H new ATOM 0 HD22 LEU A 78 -17.886 11.868 -2.371 1.00 35.23 H new ATOM 0 HD23 LEU A 78 -16.715 11.779 -3.708 1.00 35.23 H new ATOM 1232 N TYR A 79 -16.259 16.918 -3.795 1.00 70.22 N ATOM 1233 CA TYR A 79 -15.825 17.838 -4.840 1.00 13.41 C ATOM 1234 C TYR A 79 -15.015 18.989 -4.249 1.00 55.31 C ATOM 1235 O TYR A 79 -13.947 19.334 -4.754 1.00 12.45 O ATOM 1236 CB TYR A 79 -17.034 18.388 -5.599 1.00 64.31 C ATOM 1237 CG TYR A 79 -16.666 19.160 -6.846 1.00 64.21 C ATOM 1238 CD1 TYR A 79 -16.046 18.531 -7.919 1.00 2.11 C ATOM 1239 CD2 TYR A 79 -16.936 20.519 -6.950 1.00 52.14 C ATOM 1240 CE1 TYR A 79 -15.706 19.233 -9.059 1.00 42.04 C ATOM 1241 CE2 TYR A 79 -16.602 21.228 -8.088 1.00 31.34 C ATOM 1242 CZ TYR A 79 -15.987 20.581 -9.139 1.00 70.02 C ATOM 1243 OH TYR A 79 -15.651 21.285 -10.273 1.00 75.41 O ATOM 0 H TYR A 79 -17.248 16.672 -3.834 1.00 70.22 H new ATOM 0 HA TYR A 79 -15.189 17.287 -5.533 1.00 13.41 H new ATOM 0 HB2 TYR A 79 -17.687 17.560 -5.874 1.00 64.31 H new ATOM 0 HB3 TYR A 79 -17.605 19.037 -4.935 1.00 64.31 H new ATOM 0 HD1 TYR A 79 -15.826 17.475 -7.861 1.00 2.11 H new ATOM 0 HD2 TYR A 79 -17.415 21.030 -6.128 1.00 52.14 H new ATOM 0 HE1 TYR A 79 -15.223 18.729 -9.883 1.00 42.04 H new ATOM 0 HE2 TYR A 79 -16.821 22.283 -8.154 1.00 31.34 H new ATOM 0 HH TYR A 79 -15.919 22.222 -10.168 1.00 75.41 H new ATOM 1253 N ASN A 80 -15.533 19.579 -3.177 1.00 32.33 N ATOM 1254 CA ASN A 80 -14.860 20.691 -2.516 1.00 22.15 C ATOM 1255 C ASN A 80 -13.476 20.275 -2.025 1.00 43.33 C ATOM 1256 O ASN A 80 -12.462 20.840 -2.439 1.00 21.52 O ATOM 1257 CB ASN A 80 -15.698 21.197 -1.340 1.00 40.02 C ATOM 1258 CG ASN A 80 -16.844 22.084 -1.788 1.00 1.44 C ATOM 1259 OD1 ASN A 80 -17.762 21.633 -2.474 1.00 53.21 O ATOM 1260 ND2 ASN A 80 -16.796 23.353 -1.401 1.00 21.22 N ATOM 0 H ASN A 80 -16.417 19.306 -2.747 1.00 32.33 H new ATOM 0 HA ASN A 80 -14.743 21.495 -3.243 1.00 22.15 H new ATOM 0 HB2 ASN A 80 -16.095 20.346 -0.787 1.00 40.02 H new ATOM 0 HB3 ASN A 80 -15.059 21.752 -0.654 1.00 40.02 H new ATOM 0 HD21 ASN A 80 -17.539 23.997 -1.672 1.00 21.22 H new ATOM 0 HD22 ASN A 80 -16.016 23.684 -0.833 1.00 21.22 H new ATOM 1267 N THR A 81 -13.440 19.283 -1.142 1.00 13.35 N ATOM 1268 CA THR A 81 -12.182 18.791 -0.594 1.00 54.33 C ATOM 1269 C THR A 81 -11.214 18.402 -1.705 1.00 40.34 C ATOM 1270 O THR A 81 -10.124 18.964 -1.816 1.00 51.23 O ATOM 1271 CB THR A 81 -12.407 17.576 0.325 1.00 32.30 C ATOM 1272 OG1 THR A 81 -13.469 17.847 1.246 1.00 25.52 O ATOM 1273 CG2 THR A 81 -11.137 17.236 1.091 1.00 35.25 C ATOM 0 H THR A 81 -14.269 18.804 -0.790 1.00 13.35 H new ATOM 0 HA THR A 81 -11.752 19.604 -0.009 1.00 54.33 H new ATOM 0 HB THR A 81 -12.677 16.723 -0.297 1.00 32.30 H new ATOM 0 HG1 THR A 81 -14.331 17.740 0.792 1.00 25.52 H new ATOM 0 HG21 THR A 81 -11.319 16.375 1.734 1.00 35.25 H new ATOM 0 HG22 THR A 81 -10.339 17.001 0.387 1.00 35.25 H new ATOM 0 HG23 THR A 81 -10.841 18.089 1.702 1.00 35.25 H new ATOM 1281 N ILE A 82 -11.619 17.439 -2.526 1.00 22.30 N ATOM 1282 CA ILE A 82 -10.787 16.977 -3.630 1.00 24.41 C ATOM 1283 C ILE A 82 -10.210 18.151 -4.413 1.00 54.43 C ATOM 1284 O ILE A 82 -9.040 18.142 -4.793 1.00 0.23 O ATOM 1285 CB ILE A 82 -11.578 16.072 -4.592 1.00 34.33 C ATOM 1286 CG1 ILE A 82 -12.121 14.850 -3.847 1.00 61.10 C ATOM 1287 CG2 ILE A 82 -10.702 15.642 -5.758 1.00 22.43 C ATOM 1288 CD1 ILE A 82 -13.486 14.406 -4.326 1.00 4.50 C ATOM 0 H ILE A 82 -12.518 16.964 -2.448 1.00 22.30 H new ATOM 0 HA ILE A 82 -9.972 16.401 -3.191 1.00 24.41 H new ATOM 0 HB ILE A 82 -12.421 16.638 -4.987 1.00 34.33 H new ATOM 0 HG12 ILE A 82 -11.419 14.024 -3.961 1.00 61.10 H new ATOM 0 HG13 ILE A 82 -12.175 15.078 -2.783 1.00 61.10 H new ATOM 0 HG21 ILE A 82 -11.277 15.003 -6.428 1.00 22.43 H new ATOM 0 HG22 ILE A 82 -10.361 16.523 -6.301 1.00 22.43 H new ATOM 0 HG23 ILE A 82 -9.840 15.091 -5.382 1.00 22.43 H new ATOM 0 HD11 ILE A 82 -13.807 13.536 -3.754 1.00 4.50 H new ATOM 0 HD12 ILE A 82 -14.202 15.216 -4.187 1.00 4.50 H new ATOM 0 HD13 ILE A 82 -13.434 14.146 -5.383 1.00 4.50 H new ATOM 1300 N ALA A 83 -11.041 19.161 -4.650 1.00 2.44 N ATOM 1301 CA ALA A 83 -10.613 20.345 -5.384 1.00 70.13 C ATOM 1302 C ALA A 83 -9.375 20.968 -4.750 1.00 22.20 C ATOM 1303 O ALA A 83 -8.433 21.349 -5.445 1.00 2.41 O ATOM 1304 CB ALA A 83 -11.743 21.362 -5.450 1.00 5.31 C ATOM 0 H ALA A 83 -12.014 19.183 -4.344 1.00 2.44 H new ATOM 0 HA ALA A 83 -10.354 20.039 -6.398 1.00 70.13 H new ATOM 0 HB1 ALA A 83 -11.409 22.241 -6.001 1.00 5.31 H new ATOM 0 HB2 ALA A 83 -12.601 20.920 -5.957 1.00 5.31 H new ATOM 0 HB3 ALA A 83 -12.029 21.654 -4.440 1.00 5.31 H new ATOM 1310 N VAL A 84 -9.381 21.068 -3.424 1.00 71.23 N ATOM 1311 CA VAL A 84 -8.257 21.643 -2.695 1.00 11.51 C ATOM 1312 C VAL A 84 -7.031 20.741 -2.773 1.00 43.12 C ATOM 1313 O VAL A 84 -5.927 21.199 -3.070 1.00 13.13 O ATOM 1314 CB VAL A 84 -8.612 21.883 -1.215 1.00 41.23 C ATOM 1315 CG1 VAL A 84 -7.447 22.536 -0.486 1.00 71.32 C ATOM 1316 CG2 VAL A 84 -9.867 22.733 -1.100 1.00 33.35 C ATOM 0 H VAL A 84 -10.152 20.758 -2.833 1.00 71.23 H new ATOM 0 HA VAL A 84 -8.030 22.599 -3.166 1.00 11.51 H new ATOM 0 HB VAL A 84 -8.809 20.919 -0.745 1.00 41.23 H new ATOM 0 HG11 VAL A 84 -7.716 22.698 0.558 1.00 71.32 H new ATOM 0 HG12 VAL A 84 -6.574 21.886 -0.539 1.00 71.32 H new ATOM 0 HG13 VAL A 84 -7.216 23.493 -0.954 1.00 71.32 H new ATOM 0 HG21 VAL A 84 -10.103 22.893 -0.048 1.00 33.35 H new ATOM 0 HG22 VAL A 84 -9.701 23.695 -1.585 1.00 33.35 H new ATOM 0 HG23 VAL A 84 -10.699 22.222 -1.585 1.00 33.35 H new ATOM 1326 N LEU A 85 -7.232 19.455 -2.505 1.00 45.42 N ATOM 1327 CA LEU A 85 -6.142 18.485 -2.546 1.00 2.50 C ATOM 1328 C LEU A 85 -5.494 18.453 -3.927 1.00 21.33 C ATOM 1329 O LEU A 85 -4.283 18.628 -4.059 1.00 41.02 O ATOM 1330 CB LEU A 85 -6.658 17.093 -2.178 1.00 53.23 C ATOM 1331 CG LEU A 85 -5.670 16.183 -1.450 1.00 25.43 C ATOM 1332 CD1 LEU A 85 -5.880 16.261 0.055 1.00 12.50 C ATOM 1333 CD2 LEU A 85 -5.810 14.747 -1.935 1.00 3.14 C ATOM 0 H LEU A 85 -8.139 19.060 -2.257 1.00 45.42 H new ATOM 0 HA LEU A 85 -5.389 18.789 -1.819 1.00 2.50 H new ATOM 0 HB2 LEU A 85 -7.543 17.209 -1.553 1.00 53.23 H new ATOM 0 HB3 LEU A 85 -6.977 16.592 -3.092 1.00 53.23 H new ATOM 0 HG LEU A 85 -4.659 16.525 -1.674 1.00 25.43 H new ATOM 0 HD11 LEU A 85 -5.167 15.606 0.556 1.00 12.50 H new ATOM 0 HD12 LEU A 85 -5.729 17.287 0.391 1.00 12.50 H new ATOM 0 HD13 LEU A 85 -6.895 15.946 0.298 1.00 12.50 H new ATOM 0 HD21 LEU A 85 -5.099 14.113 -1.406 1.00 3.14 H new ATOM 0 HD22 LEU A 85 -6.823 14.395 -1.742 1.00 3.14 H new ATOM 0 HD23 LEU A 85 -5.608 14.703 -3.005 1.00 3.14 H new ATOM 1345 N TYR A 86 -6.308 18.227 -4.951 1.00 13.21 N ATOM 1346 CA TYR A 86 -5.814 18.171 -6.322 1.00 74.02 C ATOM 1347 C TYR A 86 -4.868 19.332 -6.608 1.00 1.13 C ATOM 1348 O TYR A 86 -3.771 19.138 -7.135 1.00 20.32 O ATOM 1349 CB TYR A 86 -6.983 18.196 -7.308 1.00 53.33 C ATOM 1350 CG TYR A 86 -6.561 18.435 -8.741 1.00 30.32 C ATOM 1351 CD1 TYR A 86 -5.812 17.492 -9.432 1.00 22.54 C ATOM 1352 CD2 TYR A 86 -6.913 19.605 -9.403 1.00 33.21 C ATOM 1353 CE1 TYR A 86 -5.424 17.705 -10.739 1.00 42.55 C ATOM 1354 CE2 TYR A 86 -6.531 19.827 -10.712 1.00 63.33 C ATOM 1355 CZ TYR A 86 -5.785 18.875 -11.376 1.00 53.40 C ATOM 1356 OH TYR A 86 -5.402 19.092 -12.679 1.00 61.33 O ATOM 0 H TYR A 86 -7.313 18.080 -4.858 1.00 13.21 H new ATOM 0 HA TYR A 86 -5.263 17.239 -6.445 1.00 74.02 H new ATOM 0 HB2 TYR A 86 -7.518 17.248 -7.249 1.00 53.33 H new ATOM 0 HB3 TYR A 86 -7.683 18.976 -7.009 1.00 53.33 H new ATOM 0 HD1 TYR A 86 -5.528 16.575 -8.937 1.00 22.54 H new ATOM 0 HD2 TYR A 86 -7.495 20.353 -8.886 1.00 33.21 H new ATOM 0 HE1 TYR A 86 -4.841 16.960 -11.261 1.00 42.55 H new ATOM 0 HE2 TYR A 86 -6.815 20.741 -11.213 1.00 63.33 H new ATOM 0 HH TYR A 86 -5.287 20.053 -12.830 1.00 61.33 H new ATOM 1366 N CYS A 87 -5.298 20.538 -6.257 1.00 32.02 N ATOM 1367 CA CYS A 87 -4.489 21.732 -6.476 1.00 0.15 C ATOM 1368 C CYS A 87 -3.146 21.617 -5.761 1.00 14.20 C ATOM 1369 O CYS A 87 -2.110 22.009 -6.299 1.00 31.22 O ATOM 1370 CB CYS A 87 -5.236 22.975 -5.988 1.00 4.44 C ATOM 1371 SG CYS A 87 -6.478 23.592 -7.147 1.00 53.23 S ATOM 0 H CYS A 87 -6.202 20.716 -5.820 1.00 32.02 H new ATOM 0 HA CYS A 87 -4.303 21.825 -7.546 1.00 0.15 H new ATOM 0 HB2 CYS A 87 -5.722 22.745 -5.040 1.00 4.44 H new ATOM 0 HB3 CYS A 87 -4.513 23.767 -5.792 1.00 4.44 H new ATOM 0 HG CYS A 87 -7.610 22.991 -6.930 1.00 53.23 H new ATOM 1377 N VAL A 88 -3.172 21.080 -4.546 1.00 71.11 N ATOM 1378 CA VAL A 88 -1.957 20.915 -3.757 1.00 34.41 C ATOM 1379 C VAL A 88 -0.915 20.102 -4.517 1.00 74.13 C ATOM 1380 O VAL A 88 0.248 20.494 -4.609 1.00 51.41 O ATOM 1381 CB VAL A 88 -2.251 20.223 -2.412 1.00 53.31 C ATOM 1382 CG1 VAL A 88 -0.981 20.102 -1.585 1.00 63.10 C ATOM 1383 CG2 VAL A 88 -3.326 20.982 -1.647 1.00 22.41 C ATOM 0 H VAL A 88 -4.021 20.752 -4.086 1.00 71.11 H new ATOM 0 HA VAL A 88 -1.565 21.914 -3.565 1.00 34.41 H new ATOM 0 HB VAL A 88 -2.621 19.218 -2.613 1.00 53.31 H new ATOM 0 HG11 VAL A 88 -1.208 19.611 -0.639 1.00 63.10 H new ATOM 0 HG12 VAL A 88 -0.245 19.513 -2.132 1.00 63.10 H new ATOM 0 HG13 VAL A 88 -0.578 21.096 -1.390 1.00 63.10 H new ATOM 0 HG21 VAL A 88 -3.522 20.480 -0.700 1.00 22.41 H new ATOM 0 HG22 VAL A 88 -2.986 22.000 -1.455 1.00 22.41 H new ATOM 0 HG23 VAL A 88 -4.241 21.011 -2.238 1.00 22.41 H new ATOM 1393 N HIS A 89 -1.341 18.965 -5.061 1.00 41.21 N ATOM 1394 CA HIS A 89 -0.444 18.096 -5.815 1.00 72.10 C ATOM 1395 C HIS A 89 0.135 18.830 -7.021 1.00 61.35 C ATOM 1396 O HIS A 89 1.302 18.584 -7.324 1.00 1.21 O ATOM 1397 CB HIS A 89 -1.186 16.839 -6.276 1.00 4.44 C ATOM 1398 CG HIS A 89 -1.545 15.913 -5.155 1.00 50.11 C ATOM 1399 ND1 HIS A 89 -0.769 15.760 -4.026 1.00 21.42 N ATOM 1400 CD2 HIS A 89 -2.607 15.088 -4.994 1.00 4.41 C ATOM 1401 CE1 HIS A 89 -1.337 14.881 -3.220 1.00 2.22 C ATOM 1402 NE2 HIS A 89 -2.455 14.459 -3.784 1.00 60.13 N ATOM 0 H HIS A 89 -2.300 18.625 -4.994 1.00 41.21 H new ATOM 0 HA HIS A 89 0.377 17.805 -5.160 1.00 72.10 H new ATOM 0 HB2 HIS A 89 -2.096 17.135 -6.798 1.00 4.44 H new ATOM 0 HB3 HIS A 89 -0.566 16.303 -6.995 1.00 4.44 H new ATOM 0 HD1 HIS A 89 0.107 16.249 -3.842 1.00 21.42 H new ATOM 0 HD2 HIS A 89 -3.422 14.951 -5.689 1.00 4.41 H new ATOM 0 HE1 HIS A 89 -0.953 14.561 -2.263 1.00 2.22 H new ATOM 1411 N GLN A 90 -0.623 19.690 -7.694 1.00 4.11 N ATOM 1412 CA GLN A 90 -0.113 20.413 -8.852 1.00 43.04 C ATOM 1413 C GLN A 90 0.629 21.674 -8.424 1.00 65.04 C ATOM 1414 O GLN A 90 0.766 22.620 -9.200 1.00 53.31 O ATOM 1415 CB GLN A 90 -1.258 20.778 -9.798 1.00 75.40 C ATOM 1416 CG GLN A 90 -0.802 21.092 -11.214 1.00 34.12 C ATOM 1417 CD GLN A 90 0.000 19.964 -11.832 1.00 54.22 C ATOM 1418 OE1 GLN A 90 1.194 20.106 -12.091 1.00 65.31 O ATOM 1419 NE2 GLN A 90 -0.656 18.834 -12.073 1.00 25.41 N ATOM 0 H GLN A 90 -1.592 19.903 -7.457 1.00 4.11 H new ATOM 0 HA GLN A 90 0.587 19.761 -9.375 1.00 43.04 H new ATOM 0 HB2 GLN A 90 -1.969 19.953 -9.829 1.00 75.40 H new ATOM 0 HB3 GLN A 90 -1.789 21.641 -9.396 1.00 75.40 H new ATOM 0 HG2 GLN A 90 -1.674 21.296 -11.836 1.00 34.12 H new ATOM 0 HG3 GLN A 90 -0.198 21.999 -11.204 1.00 34.12 H new ATOM 0 HE21 GLN A 90 -1.647 18.760 -11.842 1.00 25.41 H new ATOM 0 HE22 GLN A 90 -0.169 18.040 -12.489 1.00 25.41 H new ATOM 1428 N ARG A 91 1.108 21.681 -7.184 1.00 33.30 N ATOM 1429 CA ARG A 91 1.836 22.828 -6.652 1.00 34.43 C ATOM 1430 C ARG A 91 1.022 24.109 -6.811 1.00 62.11 C ATOM 1431 O ARG A 91 1.565 25.161 -7.151 1.00 11.54 O ATOM 1432 CB ARG A 91 3.184 22.975 -7.358 1.00 24.12 C ATOM 1433 CG ARG A 91 4.114 21.791 -7.149 1.00 3.42 C ATOM 1434 CD ARG A 91 5.295 21.835 -8.106 1.00 72.34 C ATOM 1435 NE ARG A 91 6.563 22.011 -7.403 1.00 64.31 N ATOM 1436 CZ ARG A 91 7.102 21.086 -6.617 1.00 31.43 C ATOM 1437 NH1 ARG A 91 6.486 19.926 -6.434 1.00 20.00 N ATOM 1438 NH2 ARG A 91 8.259 21.320 -6.012 1.00 2.54 N ATOM 0 H ARG A 91 1.005 20.906 -6.529 1.00 33.30 H new ATOM 0 HA ARG A 91 2.008 22.657 -5.589 1.00 34.43 H new ATOM 0 HB2 ARG A 91 3.012 23.107 -8.426 1.00 24.12 H new ATOM 0 HB3 ARG A 91 3.675 23.880 -7.000 1.00 24.12 H new ATOM 0 HG2 ARG A 91 4.477 21.789 -6.121 1.00 3.42 H new ATOM 0 HG3 ARG A 91 3.561 20.863 -7.294 1.00 3.42 H new ATOM 0 HD2 ARG A 91 5.327 20.912 -8.685 1.00 72.34 H new ATOM 0 HD3 ARG A 91 5.157 22.652 -8.815 1.00 72.34 H new ATOM 0 HE ARG A 91 7.062 22.893 -7.522 1.00 64.31 H new ATOM 0 HH11 ARG A 91 5.596 19.742 -6.897 1.00 20.00 H new ATOM 0 HH12 ARG A 91 6.902 19.217 -5.830 1.00 20.00 H new ATOM 0 HH21 ARG A 91 8.736 22.211 -6.150 1.00 2.54 H new ATOM 0 HH22 ARG A 91 8.672 20.609 -5.409 1.00 2.54 H new ATOM 1452 N ILE A 92 -0.280 24.012 -6.566 1.00 20.11 N ATOM 1453 CA ILE A 92 -1.166 25.163 -6.681 1.00 53.15 C ATOM 1454 C ILE A 92 -1.584 25.676 -5.307 1.00 64.03 C ATOM 1455 O ILE A 92 -2.213 24.957 -4.530 1.00 61.33 O ATOM 1456 CB ILE A 92 -2.428 24.821 -7.495 1.00 12.00 C ATOM 1457 CG1 ILE A 92 -2.045 24.355 -8.901 1.00 74.42 C ATOM 1458 CG2 ILE A 92 -3.355 26.026 -7.565 1.00 34.52 C ATOM 1459 CD1 ILE A 92 -3.224 23.884 -9.724 1.00 45.40 C ATOM 0 H ILE A 92 -0.745 23.148 -6.287 1.00 20.11 H new ATOM 0 HA ILE A 92 -0.607 25.941 -7.201 1.00 53.15 H new ATOM 0 HB ILE A 92 -2.956 24.009 -6.995 1.00 12.00 H new ATOM 0 HG12 ILE A 92 -1.551 25.174 -9.424 1.00 74.42 H new ATOM 0 HG13 ILE A 92 -1.321 23.544 -8.822 1.00 74.42 H new ATOM 0 HG21 ILE A 92 -4.242 25.769 -8.143 1.00 34.52 H new ATOM 0 HG22 ILE A 92 -3.650 26.317 -6.557 1.00 34.52 H new ATOM 0 HG23 ILE A 92 -2.837 26.856 -8.045 1.00 34.52 H new ATOM 0 HD11 ILE A 92 -2.878 23.569 -10.708 1.00 45.40 H new ATOM 0 HD12 ILE A 92 -3.705 23.044 -9.223 1.00 45.40 H new ATOM 0 HD13 ILE A 92 -3.939 24.699 -9.835 1.00 45.40 H new ATOM 1471 N ASP A 93 -1.232 26.923 -5.016 1.00 21.52 N ATOM 1472 CA ASP A 93 -1.573 27.534 -3.736 1.00 63.43 C ATOM 1473 C ASP A 93 -2.880 28.313 -3.837 1.00 32.13 C ATOM 1474 O ASP A 93 -2.974 29.299 -4.568 1.00 64.23 O ATOM 1475 CB ASP A 93 -0.448 28.461 -3.273 1.00 62.45 C ATOM 1476 CG ASP A 93 0.859 27.723 -3.061 1.00 22.24 C ATOM 1477 OD1 ASP A 93 1.352 27.099 -4.023 1.00 70.44 O ATOM 1478 OD2 ASP A 93 1.390 27.768 -1.931 1.00 2.24 O ATOM 0 H ASP A 93 -0.711 27.531 -5.648 1.00 21.52 H new ATOM 0 HA ASP A 93 -1.701 26.737 -3.004 1.00 63.43 H new ATOM 0 HB2 ASP A 93 -0.302 29.248 -4.013 1.00 62.45 H new ATOM 0 HB3 ASP A 93 -0.742 28.948 -2.343 1.00 62.45 H new ATOM 1483 N VAL A 94 -3.890 27.862 -3.099 1.00 2.25 N ATOM 1484 CA VAL A 94 -5.193 28.517 -3.104 1.00 62.34 C ATOM 1485 C VAL A 94 -5.440 29.261 -1.797 1.00 55.11 C ATOM 1486 O VAL A 94 -4.996 28.832 -0.732 1.00 4.33 O ATOM 1487 CB VAL A 94 -6.329 27.501 -3.327 1.00 14.10 C ATOM 1488 CG1 VAL A 94 -6.040 26.634 -4.543 1.00 11.43 C ATOM 1489 CG2 VAL A 94 -6.529 26.645 -2.086 1.00 72.25 C ATOM 0 H VAL A 94 -3.831 27.046 -2.490 1.00 2.25 H new ATOM 0 HA VAL A 94 -5.186 29.231 -3.928 1.00 62.34 H new ATOM 0 HB VAL A 94 -7.252 28.050 -3.514 1.00 14.10 H new ATOM 0 HG11 VAL A 94 -6.854 25.923 -4.684 1.00 11.43 H new ATOM 0 HG12 VAL A 94 -5.952 27.265 -5.427 1.00 11.43 H new ATOM 0 HG13 VAL A 94 -5.107 26.092 -4.390 1.00 11.43 H new ATOM 0 HG21 VAL A 94 -7.335 25.933 -2.261 1.00 72.25 H new ATOM 0 HG22 VAL A 94 -5.609 26.104 -1.865 1.00 72.25 H new ATOM 0 HG23 VAL A 94 -6.786 27.284 -1.241 1.00 72.25 H new ATOM 1499 N LYS A 95 -6.153 30.379 -1.885 1.00 74.33 N ATOM 1500 CA LYS A 95 -6.462 31.184 -0.709 1.00 34.10 C ATOM 1501 C LYS A 95 -7.511 30.497 0.160 1.00 70.50 C ATOM 1502 O LYS A 95 -7.583 30.734 1.366 1.00 53.22 O ATOM 1503 CB LYS A 95 -6.962 32.567 -1.130 1.00 43.23 C ATOM 1504 CG LYS A 95 -5.901 33.414 -1.814 1.00 51.31 C ATOM 1505 CD LYS A 95 -6.449 34.772 -2.220 1.00 60.23 C ATOM 1506 CE LYS A 95 -5.914 35.880 -1.325 1.00 72.35 C ATOM 1507 NZ LYS A 95 -4.493 36.202 -1.631 1.00 41.13 N ATOM 0 H LYS A 95 -6.528 30.748 -2.759 1.00 74.33 H new ATOM 0 HA LYS A 95 -5.548 31.296 -0.126 1.00 34.10 H new ATOM 0 HB2 LYS A 95 -7.810 32.448 -1.804 1.00 43.23 H new ATOM 0 HB3 LYS A 95 -7.326 33.096 -0.249 1.00 43.23 H new ATOM 0 HG2 LYS A 95 -5.053 33.549 -1.143 1.00 51.31 H new ATOM 0 HG3 LYS A 95 -5.530 32.892 -2.696 1.00 51.31 H new ATOM 0 HD2 LYS A 95 -6.181 34.979 -3.256 1.00 60.23 H new ATOM 0 HD3 LYS A 95 -7.538 34.756 -2.170 1.00 60.23 H new ATOM 0 HE2 LYS A 95 -6.524 36.774 -1.450 1.00 72.35 H new ATOM 0 HE3 LYS A 95 -6.001 35.578 -0.281 1.00 72.35 H new ATOM 0 HZ1 LYS A 95 -4.165 36.961 -1.000 1.00 41.13 H new ATOM 0 HZ2 LYS A 95 -3.906 35.355 -1.487 1.00 41.13 H new ATOM 0 HZ3 LYS A 95 -4.413 36.515 -2.620 1.00 41.13 H new ATOM 1521 N ASP A 96 -8.320 29.644 -0.459 1.00 73.33 N ATOM 1522 CA ASP A 96 -9.363 28.921 0.258 1.00 34.14 C ATOM 1523 C ASP A 96 -10.050 27.909 -0.654 1.00 2.23 C ATOM 1524 O ASP A 96 -9.772 27.849 -1.852 1.00 61.42 O ATOM 1525 CB ASP A 96 -10.395 29.898 0.824 1.00 44.21 C ATOM 1526 CG ASP A 96 -10.626 31.088 -0.087 1.00 72.44 C ATOM 1527 OD1 ASP A 96 -11.214 30.898 -1.172 1.00 73.13 O ATOM 1528 OD2 ASP A 96 -10.219 32.208 0.284 1.00 34.44 O ATOM 0 H ASP A 96 -8.273 29.436 -1.457 1.00 73.33 H new ATOM 0 HA ASP A 96 -8.895 28.382 1.081 1.00 34.14 H new ATOM 0 HB2 ASP A 96 -11.339 29.375 0.980 1.00 44.21 H new ATOM 0 HB3 ASP A 96 -10.060 30.251 1.800 1.00 44.21 H new ATOM 1533 N THR A 97 -10.946 27.114 -0.079 1.00 73.21 N ATOM 1534 CA THR A 97 -11.671 26.104 -0.839 1.00 63.11 C ATOM 1535 C THR A 97 -12.507 26.741 -1.944 1.00 32.12 C ATOM 1536 O THR A 97 -12.945 26.063 -2.874 1.00 10.33 O ATOM 1537 CB THR A 97 -12.593 25.270 0.070 1.00 65.31 C ATOM 1538 OG1 THR A 97 -11.850 24.755 1.181 1.00 73.13 O ATOM 1539 CG2 THR A 97 -13.220 24.120 -0.703 1.00 21.41 C ATOM 0 H THR A 97 -11.187 27.150 0.911 1.00 73.21 H new ATOM 0 HA THR A 97 -10.923 25.448 -1.285 1.00 63.11 H new ATOM 0 HB THR A 97 -13.390 25.919 0.435 1.00 65.31 H new ATOM 0 HG1 THR A 97 -11.566 25.496 1.756 1.00 73.13 H new ATOM 0 HG21 THR A 97 -13.867 23.546 -0.040 1.00 21.41 H new ATOM 0 HG22 THR A 97 -13.809 24.516 -1.531 1.00 21.41 H new ATOM 0 HG23 THR A 97 -12.434 23.473 -1.094 1.00 21.41 H new ATOM 1547 N LYS A 98 -12.724 28.047 -1.837 1.00 20.03 N ATOM 1548 CA LYS A 98 -13.506 28.777 -2.827 1.00 44.41 C ATOM 1549 C LYS A 98 -12.680 29.049 -4.080 1.00 24.53 C ATOM 1550 O LYS A 98 -13.026 28.600 -5.172 1.00 73.21 O ATOM 1551 CB LYS A 98 -14.007 30.098 -2.238 1.00 2.11 C ATOM 1552 CG LYS A 98 -15.210 30.671 -2.967 1.00 41.33 C ATOM 1553 CD LYS A 98 -14.803 31.765 -3.942 1.00 24.23 C ATOM 1554 CE LYS A 98 -15.715 31.795 -5.158 1.00 0.14 C ATOM 1555 NZ LYS A 98 -16.995 32.503 -4.874 1.00 64.13 N ATOM 0 H LYS A 98 -12.369 28.622 -1.073 1.00 20.03 H new ATOM 0 HA LYS A 98 -14.362 28.161 -3.103 1.00 44.41 H new ATOM 0 HB2 LYS A 98 -14.267 29.944 -1.191 1.00 2.11 H new ATOM 0 HB3 LYS A 98 -13.197 30.827 -2.262 1.00 2.11 H new ATOM 0 HG2 LYS A 98 -15.723 29.875 -3.506 1.00 41.33 H new ATOM 0 HG3 LYS A 98 -15.918 31.073 -2.242 1.00 41.33 H new ATOM 0 HD2 LYS A 98 -14.833 32.732 -3.439 1.00 24.23 H new ATOM 0 HD3 LYS A 98 -13.773 31.604 -4.262 1.00 24.23 H new ATOM 0 HE2 LYS A 98 -15.203 32.288 -5.984 1.00 0.14 H new ATOM 0 HE3 LYS A 98 -15.927 30.775 -5.478 1.00 0.14 H new ATOM 0 HZ1 LYS A 98 -17.589 32.502 -5.728 1.00 64.13 H new ATOM 0 HZ2 LYS A 98 -17.496 32.018 -4.103 1.00 64.13 H new ATOM 0 HZ3 LYS A 98 -16.794 33.484 -4.593 1.00 64.13 H new ATOM 1569 N GLU A 99 -11.584 29.783 -3.914 1.00 53.40 N ATOM 1570 CA GLU A 99 -10.709 30.113 -5.033 1.00 23.12 C ATOM 1571 C GLU A 99 -10.135 28.848 -5.665 1.00 3.03 C ATOM 1572 O GLU A 99 -9.683 28.864 -6.810 1.00 20.43 O ATOM 1573 CB GLU A 99 -9.572 31.025 -4.569 1.00 45.42 C ATOM 1574 CG GLU A 99 -8.787 31.648 -5.711 1.00 1.41 C ATOM 1575 CD GLU A 99 -9.263 33.047 -6.051 1.00 50.45 C ATOM 1576 OE1 GLU A 99 -10.404 33.182 -6.542 1.00 64.21 O ATOM 1577 OE2 GLU A 99 -8.495 34.006 -5.828 1.00 55.30 O ATOM 0 H GLU A 99 -11.281 30.160 -3.016 1.00 53.40 H new ATOM 0 HA GLU A 99 -11.302 30.637 -5.783 1.00 23.12 H new ATOM 0 HB2 GLU A 99 -9.985 31.819 -3.948 1.00 45.42 H new ATOM 0 HB3 GLU A 99 -8.890 30.451 -3.941 1.00 45.42 H new ATOM 0 HG2 GLU A 99 -7.731 31.682 -5.445 1.00 1.41 H new ATOM 0 HG3 GLU A 99 -8.873 31.015 -6.594 1.00 1.41 H new ATOM 1584 N ALA A 100 -10.156 27.754 -4.910 1.00 31.23 N ATOM 1585 CA ALA A 100 -9.640 26.481 -5.396 1.00 31.43 C ATOM 1586 C ALA A 100 -10.552 25.889 -6.464 1.00 54.25 C ATOM 1587 O ALA A 100 -10.086 25.268 -7.420 1.00 53.43 O ATOM 1588 CB ALA A 100 -9.474 25.503 -4.241 1.00 43.54 C ATOM 0 H ALA A 100 -10.525 27.724 -3.960 1.00 31.23 H new ATOM 0 HA ALA A 100 -8.665 26.663 -5.848 1.00 31.43 H new ATOM 0 HB1 ALA A 100 -9.088 24.556 -4.619 1.00 43.54 H new ATOM 0 HB2 ALA A 100 -8.776 25.915 -3.513 1.00 43.54 H new ATOM 0 HB3 ALA A 100 -10.440 25.336 -3.764 1.00 43.54 H new ATOM 1594 N LEU A 101 -11.856 26.086 -6.297 1.00 33.41 N ATOM 1595 CA LEU A 101 -12.836 25.571 -7.248 1.00 2.51 C ATOM 1596 C LEU A 101 -12.789 26.356 -8.555 1.00 64.53 C ATOM 1597 O LEU A 101 -13.048 25.809 -9.628 1.00 34.52 O ATOM 1598 CB LEU A 101 -14.241 25.640 -6.649 1.00 34.11 C ATOM 1599 CG LEU A 101 -14.616 24.513 -5.685 1.00 71.50 C ATOM 1600 CD1 LEU A 101 -15.907 24.844 -4.953 1.00 2.12 C ATOM 1601 CD2 LEU A 101 -14.748 23.194 -6.433 1.00 23.23 C ATOM 0 H LEU A 101 -12.259 26.598 -5.512 1.00 33.41 H new ATOM 0 HA LEU A 101 -12.589 24.531 -7.461 1.00 2.51 H new ATOM 0 HB2 LEU A 101 -14.344 26.590 -6.124 1.00 34.11 H new ATOM 0 HB3 LEU A 101 -14.963 25.647 -7.466 1.00 34.11 H new ATOM 0 HG LEU A 101 -13.820 24.412 -4.947 1.00 71.50 H new ATOM 0 HD11 LEU A 101 -16.158 24.031 -4.272 1.00 2.12 H new ATOM 0 HD12 LEU A 101 -15.778 25.766 -4.386 1.00 2.12 H new ATOM 0 HD13 LEU A 101 -16.712 24.973 -5.676 1.00 2.12 H new ATOM 0 HD21 LEU A 101 -15.015 22.403 -5.732 1.00 23.23 H new ATOM 0 HD22 LEU A 101 -15.524 23.283 -7.193 1.00 23.23 H new ATOM 0 HD23 LEU A 101 -13.799 22.950 -6.911 1.00 23.23 H new ATOM 1613 N ASP A 102 -12.455 27.637 -8.459 1.00 74.13 N ATOM 1614 CA ASP A 102 -12.370 28.496 -9.634 1.00 53.42 C ATOM 1615 C ASP A 102 -11.046 28.291 -10.363 1.00 54.01 C ATOM 1616 O ASP A 102 -10.988 28.335 -11.593 1.00 31.44 O ATOM 1617 CB ASP A 102 -12.524 29.964 -9.233 1.00 11.14 C ATOM 1618 CG ASP A 102 -12.870 30.853 -10.411 1.00 14.35 C ATOM 1619 OD1 ASP A 102 -13.881 30.574 -11.089 1.00 0.21 O ATOM 1620 OD2 ASP A 102 -12.132 31.830 -10.652 1.00 41.25 O ATOM 0 H ASP A 102 -12.238 28.105 -7.579 1.00 74.13 H new ATOM 0 HA ASP A 102 -13.182 28.226 -10.309 1.00 53.42 H new ATOM 0 HB2 ASP A 102 -13.303 30.051 -8.475 1.00 11.14 H new ATOM 0 HB3 ASP A 102 -11.597 30.313 -8.779 1.00 11.14 H new ATOM 1625 N LYS A 103 -9.983 28.068 -9.598 1.00 53.42 N ATOM 1626 CA LYS A 103 -8.659 27.857 -10.170 1.00 34.45 C ATOM 1627 C LYS A 103 -8.632 26.596 -11.026 1.00 71.25 C ATOM 1628 O LYS A 103 -8.053 26.585 -12.113 1.00 73.23 O ATOM 1629 CB LYS A 103 -7.612 27.754 -9.058 1.00 11.22 C ATOM 1630 CG LYS A 103 -6.511 28.794 -9.161 1.00 2.33 C ATOM 1631 CD LYS A 103 -6.758 29.964 -8.222 1.00 34.34 C ATOM 1632 CE LYS A 103 -5.454 30.589 -7.753 1.00 63.44 C ATOM 1633 NZ LYS A 103 -5.494 30.940 -6.307 1.00 42.45 N ATOM 0 H LYS A 103 -10.013 28.029 -8.579 1.00 53.42 H new ATOM 0 HA LYS A 103 -8.424 28.711 -10.805 1.00 34.45 H new ATOM 0 HB2 LYS A 103 -8.108 27.857 -8.093 1.00 11.22 H new ATOM 0 HB3 LYS A 103 -7.165 26.760 -9.082 1.00 11.22 H new ATOM 0 HG2 LYS A 103 -5.551 28.334 -8.925 1.00 2.33 H new ATOM 0 HG3 LYS A 103 -6.447 29.157 -10.187 1.00 2.33 H new ATOM 0 HD2 LYS A 103 -7.362 30.717 -8.729 1.00 34.34 H new ATOM 0 HD3 LYS A 103 -7.331 29.624 -7.359 1.00 34.34 H new ATOM 0 HE2 LYS A 103 -4.633 29.896 -7.935 1.00 63.44 H new ATOM 0 HE3 LYS A 103 -5.250 31.486 -8.338 1.00 63.44 H new ATOM 0 HZ1 LYS A 103 -4.546 30.824 -5.895 1.00 42.45 H new ATOM 0 HZ2 LYS A 103 -5.800 31.928 -6.198 1.00 42.45 H new ATOM 0 HZ3 LYS A 103 -6.164 30.314 -5.816 1.00 42.45 H new ATOM 1647 N ILE A 104 -9.261 25.535 -10.531 1.00 74.24 N ATOM 1648 CA ILE A 104 -9.311 24.270 -11.253 1.00 41.42 C ATOM 1649 C ILE A 104 -9.946 24.447 -12.628 1.00 63.33 C ATOM 1650 O ILE A 104 -9.419 23.968 -13.632 1.00 43.02 O ATOM 1651 CB ILE A 104 -10.099 23.205 -10.469 1.00 61.33 C ATOM 1652 CG1 ILE A 104 -9.360 22.839 -9.179 1.00 74.24 C ATOM 1653 CG2 ILE A 104 -10.318 21.969 -11.329 1.00 33.35 C ATOM 1654 CD1 ILE A 104 -10.227 22.116 -8.172 1.00 4.22 C ATOM 0 H ILE A 104 -9.743 25.527 -9.632 1.00 74.24 H new ATOM 0 HA ILE A 104 -8.281 23.933 -11.372 1.00 41.42 H new ATOM 0 HB ILE A 104 -11.073 23.617 -10.203 1.00 61.33 H new ATOM 0 HG12 ILE A 104 -8.503 22.212 -9.426 1.00 74.24 H new ATOM 0 HG13 ILE A 104 -8.969 23.748 -8.723 1.00 74.24 H new ATOM 0 HG21 ILE A 104 -10.876 21.225 -10.761 1.00 33.35 H new ATOM 0 HG22 ILE A 104 -10.881 22.242 -12.222 1.00 33.35 H new ATOM 0 HG23 ILE A 104 -9.354 21.554 -11.621 1.00 33.35 H new ATOM 0 HD11 ILE A 104 -9.639 21.888 -7.283 1.00 4.22 H new ATOM 0 HD12 ILE A 104 -11.070 22.750 -7.896 1.00 4.22 H new ATOM 0 HD13 ILE A 104 -10.598 21.189 -8.610 1.00 4.22 H new ATOM 1666 N GLU A 105 -11.081 25.139 -12.666 1.00 60.11 N ATOM 1667 CA GLU A 105 -11.787 25.379 -13.918 1.00 42.13 C ATOM 1668 C GLU A 105 -10.903 26.137 -14.904 1.00 64.22 C ATOM 1669 O GLU A 105 -10.956 25.899 -16.111 1.00 52.32 O ATOM 1670 CB GLU A 105 -13.074 26.166 -13.661 1.00 43.14 C ATOM 1671 CG GLU A 105 -14.016 26.198 -14.853 1.00 20.45 C ATOM 1672 CD GLU A 105 -15.401 25.681 -14.515 1.00 50.13 C ATOM 1673 OE1 GLU A 105 -16.177 26.430 -13.885 1.00 31.51 O ATOM 1674 OE2 GLU A 105 -15.709 24.527 -14.882 1.00 61.11 O ATOM 0 H GLU A 105 -11.530 25.543 -11.844 1.00 60.11 H new ATOM 0 HA GLU A 105 -12.041 24.412 -14.353 1.00 42.13 H new ATOM 0 HB2 GLU A 105 -13.594 25.728 -12.809 1.00 43.14 H new ATOM 0 HB3 GLU A 105 -12.816 27.188 -13.385 1.00 43.14 H new ATOM 0 HG2 GLU A 105 -14.094 27.220 -15.223 1.00 20.45 H new ATOM 0 HG3 GLU A 105 -13.595 25.598 -15.660 1.00 20.45 H new ATOM 1681 N GLU A 106 -10.091 27.051 -14.381 1.00 71.10 N ATOM 1682 CA GLU A 106 -9.197 27.845 -15.216 1.00 63.21 C ATOM 1683 C GLU A 106 -8.213 26.950 -15.964 1.00 73.40 C ATOM 1684 O GLU A 106 -7.869 27.216 -17.115 1.00 23.52 O ATOM 1685 CB GLU A 106 -8.433 28.859 -14.362 1.00 54.24 C ATOM 1686 CG GLU A 106 -8.629 30.299 -14.807 1.00 64.04 C ATOM 1687 CD GLU A 106 -9.029 31.213 -13.666 1.00 3.44 C ATOM 1688 OE1 GLU A 106 -8.291 31.262 -12.659 1.00 75.43 O ATOM 1689 OE2 GLU A 106 -10.078 31.880 -13.779 1.00 13.14 O ATOM 0 H GLU A 106 -10.034 27.260 -13.384 1.00 71.10 H new ATOM 0 HA GLU A 106 -9.803 28.380 -15.947 1.00 63.21 H new ATOM 0 HB2 GLU A 106 -8.752 28.761 -13.324 1.00 54.24 H new ATOM 0 HB3 GLU A 106 -7.370 28.620 -14.392 1.00 54.24 H new ATOM 0 HG2 GLU A 106 -7.705 30.666 -15.255 1.00 64.04 H new ATOM 0 HG3 GLU A 106 -9.395 30.335 -15.582 1.00 64.04 H new ATOM 1696 N GLU A 107 -7.764 25.888 -15.300 1.00 54.45 N ATOM 1697 CA GLU A 107 -6.820 24.956 -15.901 1.00 61.23 C ATOM 1698 C GLU A 107 -7.467 24.193 -17.054 1.00 31.52 C ATOM 1699 O GLU A 107 -6.855 23.998 -18.104 1.00 41.30 O ATOM 1700 CB GLU A 107 -6.302 23.972 -14.850 1.00 22.40 C ATOM 1701 CG GLU A 107 -5.114 23.149 -15.320 1.00 62.44 C ATOM 1702 CD GLU A 107 -4.365 22.497 -14.174 1.00 30.00 C ATOM 1703 OE1 GLU A 107 -4.993 21.727 -13.417 1.00 12.11 O ATOM 1704 OE2 GLU A 107 -3.152 22.758 -14.032 1.00 61.15 O ATOM 0 H GLU A 107 -8.040 25.653 -14.346 1.00 54.45 H new ATOM 0 HA GLU A 107 -5.982 25.531 -16.294 1.00 61.23 H new ATOM 0 HB2 GLU A 107 -6.018 24.525 -13.955 1.00 22.40 H new ATOM 0 HB3 GLU A 107 -7.110 23.298 -14.566 1.00 22.40 H new ATOM 0 HG2 GLU A 107 -5.461 22.378 -16.008 1.00 62.44 H new ATOM 0 HG3 GLU A 107 -4.431 23.790 -15.878 1.00 62.44 H new ATOM 1711 N GLN A 108 -8.707 23.761 -16.847 1.00 50.13 N ATOM 1712 CA GLN A 108 -9.437 23.018 -17.868 1.00 1.12 C ATOM 1713 C GLN A 108 -9.841 23.931 -19.020 1.00 72.24 C ATOM 1714 O GLN A 108 -9.755 23.549 -20.187 1.00 2.41 O ATOM 1715 CB GLN A 108 -10.679 22.362 -17.261 1.00 24.44 C ATOM 1716 CG GLN A 108 -10.711 20.851 -17.427 1.00 24.11 C ATOM 1717 CD GLN A 108 -10.026 20.124 -16.287 1.00 22.22 C ATOM 1718 OE1 GLN A 108 -9.801 20.692 -15.218 1.00 44.42 O ATOM 1719 NE2 GLN A 108 -9.690 18.858 -16.509 1.00 54.41 N ATOM 0 H GLN A 108 -9.227 23.912 -15.983 1.00 50.13 H new ATOM 0 HA GLN A 108 -8.779 22.242 -18.258 1.00 1.12 H new ATOM 0 HB2 GLN A 108 -10.725 22.604 -16.199 1.00 24.44 H new ATOM 0 HB3 GLN A 108 -11.568 22.789 -17.724 1.00 24.44 H new ATOM 0 HG2 GLN A 108 -11.747 20.519 -17.494 1.00 24.11 H new ATOM 0 HG3 GLN A 108 -10.228 20.582 -18.367 1.00 24.11 H new ATOM 0 HE21 GLN A 108 -9.895 18.426 -17.410 1.00 54.41 H new ATOM 0 HE22 GLN A 108 -9.227 18.318 -15.778 1.00 54.41 H new ATOM 1728 N ASN A 109 -10.285 25.138 -18.686 1.00 32.13 N ATOM 1729 CA ASN A 109 -10.705 26.105 -19.693 1.00 45.13 C ATOM 1730 C ASN A 109 -9.573 26.391 -20.676 1.00 54.24 C ATOM 1731 O ASN A 109 -9.811 26.635 -21.860 1.00 2.43 O ATOM 1732 CB ASN A 109 -11.157 27.405 -19.026 1.00 23.23 C ATOM 1733 CG ASN A 109 -12.639 27.666 -19.213 1.00 40.31 C ATOM 1734 OD1 ASN A 109 -13.377 27.839 -18.243 1.00 54.14 O ATOM 1735 ND2 ASN A 109 -13.080 27.697 -20.465 1.00 73.42 N ATOM 0 H ASN A 109 -10.363 25.470 -17.725 1.00 32.13 H new ATOM 0 HA ASN A 109 -11.543 25.678 -20.244 1.00 45.13 H new ATOM 0 HB2 ASN A 109 -10.930 27.362 -17.961 1.00 23.23 H new ATOM 0 HB3 ASN A 109 -10.589 28.239 -19.439 1.00 23.23 H new ATOM 0 HD21 ASN A 109 -14.067 27.870 -20.654 1.00 73.42 H new ATOM 0 HD22 ASN A 109 -12.431 27.548 -21.238 1.00 73.42 H new ATOM 1742 N LYS A 110 -8.342 26.360 -20.179 1.00 11.15 N ATOM 1743 CA LYS A 110 -7.173 26.614 -21.011 1.00 44.24 C ATOM 1744 C LYS A 110 -7.052 25.567 -22.114 1.00 32.42 C ATOM 1745 O LYS A 110 -6.354 25.774 -23.106 1.00 42.34 O ATOM 1746 CB LYS A 110 -5.904 26.618 -20.156 1.00 61.25 C ATOM 1747 CG LYS A 110 -4.636 26.881 -20.951 1.00 74.02 C ATOM 1748 CD LYS A 110 -3.545 27.479 -20.078 1.00 44.35 C ATOM 1749 CE LYS A 110 -3.741 28.975 -19.886 1.00 54.05 C ATOM 1750 NZ LYS A 110 -4.160 29.306 -18.496 1.00 74.25 N ATOM 0 H LYS A 110 -8.128 26.161 -19.202 1.00 11.15 H new ATOM 0 HA LYS A 110 -7.294 27.593 -21.475 1.00 44.24 H new ATOM 0 HB2 LYS A 110 -6.001 27.378 -19.380 1.00 61.25 H new ATOM 0 HB3 LYS A 110 -5.813 25.656 -19.651 1.00 61.25 H new ATOM 0 HG2 LYS A 110 -4.281 25.949 -21.391 1.00 74.02 H new ATOM 0 HG3 LYS A 110 -4.856 27.559 -21.775 1.00 74.02 H new ATOM 0 HD2 LYS A 110 -3.543 26.984 -19.107 1.00 44.35 H new ATOM 0 HD3 LYS A 110 -2.572 27.294 -20.533 1.00 44.35 H new ATOM 0 HE2 LYS A 110 -2.812 29.496 -20.119 1.00 54.05 H new ATOM 0 HE3 LYS A 110 -4.493 29.336 -20.588 1.00 54.05 H new ATOM 0 HZ1 LYS A 110 -4.778 30.143 -18.510 1.00 74.25 H new ATOM 0 HZ2 LYS A 110 -4.677 28.501 -18.088 1.00 74.25 H new ATOM 0 HZ3 LYS A 110 -3.319 29.506 -17.918 1.00 74.25 H new ATOM 1764 N SER A 111 -7.739 24.443 -21.933 1.00 63.15 N ATOM 1765 CA SER A 111 -7.706 23.362 -22.913 1.00 13.32 C ATOM 1766 C SER A 111 -9.069 23.189 -23.576 1.00 33.35 C ATOM 1767 O SER A 111 -9.294 22.237 -24.324 1.00 5.44 O ATOM 1768 CB SER A 111 -7.281 22.054 -22.245 1.00 65.34 C ATOM 1769 OG SER A 111 -7.024 21.049 -23.211 1.00 24.25 O ATOM 0 H SER A 111 -8.324 24.257 -21.119 1.00 63.15 H new ATOM 0 HA SER A 111 -6.978 23.622 -23.682 1.00 13.32 H new ATOM 0 HB2 SER A 111 -6.387 22.222 -21.644 1.00 65.34 H new ATOM 0 HB3 SER A 111 -8.064 21.718 -21.565 1.00 65.34 H new ATOM 0 HG SER A 111 -7.750 21.034 -23.869 1.00 24.25 H new ATOM 1775 N LYS A 112 -9.979 24.116 -23.294 1.00 62.13 N ATOM 1776 CA LYS A 112 -11.322 24.069 -23.863 1.00 65.32 C ATOM 1777 C LYS A 112 -11.352 24.722 -25.241 1.00 63.43 C ATOM 1778 O LYS A 112 -12.120 24.317 -26.115 1.00 21.41 O ATOM 1779 CB LYS A 112 -12.315 24.769 -22.933 1.00 74.25 C ATOM 1780 CG LYS A 112 -13.752 24.713 -23.426 1.00 64.01 C ATOM 1781 CD LYS A 112 -14.698 25.412 -22.466 1.00 12.44 C ATOM 1782 CE LYS A 112 -15.246 26.700 -23.062 1.00 22.41 C ATOM 1783 NZ LYS A 112 -16.005 27.497 -22.058 1.00 62.32 N ATOM 0 H LYS A 112 -9.811 24.909 -22.675 1.00 62.13 H new ATOM 0 HA LYS A 112 -11.609 23.023 -23.970 1.00 65.32 H new ATOM 0 HB2 LYS A 112 -12.260 24.311 -21.945 1.00 74.25 H new ATOM 0 HB3 LYS A 112 -12.019 25.812 -22.818 1.00 74.25 H new ATOM 0 HG2 LYS A 112 -13.819 25.180 -24.409 1.00 64.01 H new ATOM 0 HG3 LYS A 112 -14.056 23.673 -23.546 1.00 64.01 H new ATOM 0 HD2 LYS A 112 -15.523 24.745 -22.217 1.00 12.44 H new ATOM 0 HD3 LYS A 112 -14.175 25.634 -21.536 1.00 12.44 H new ATOM 0 HE2 LYS A 112 -14.423 27.298 -23.453 1.00 22.41 H new ATOM 0 HE3 LYS A 112 -15.896 26.463 -23.904 1.00 22.41 H new ATOM 0 HZ1 LYS A 112 -16.971 27.663 -22.405 1.00 62.32 H new ATOM 0 HZ2 LYS A 112 -16.045 26.975 -21.159 1.00 62.32 H new ATOM 0 HZ3 LYS A 112 -15.529 28.410 -21.908 1.00 62.32 H new ATOM 1797 N LYS A 113 -10.511 25.733 -25.432 1.00 22.33 N ATOM 1798 CA LYS A 113 -10.439 26.439 -26.705 1.00 5.15 C ATOM 1799 C LYS A 113 -9.870 25.538 -27.796 1.00 74.22 C ATOM 1800 O LYS A 113 -10.151 25.727 -28.980 1.00 4.24 O ATOM 1801 CB LYS A 113 -9.576 27.696 -26.565 1.00 50.02 C ATOM 1802 CG LYS A 113 -10.321 28.884 -25.984 1.00 34.20 C ATOM 1803 CD LYS A 113 -10.933 29.747 -27.074 1.00 41.12 C ATOM 1804 CE LYS A 113 -11.430 31.074 -26.522 1.00 43.13 C ATOM 1805 NZ LYS A 113 -10.837 32.234 -27.245 1.00 20.51 N ATOM 0 H LYS A 113 -9.869 26.082 -24.720 1.00 22.33 H new ATOM 0 HA LYS A 113 -11.451 26.729 -26.989 1.00 5.15 H new ATOM 0 HB2 LYS A 113 -8.719 27.469 -25.930 1.00 50.02 H new ATOM 0 HB3 LYS A 113 -9.184 27.968 -27.545 1.00 50.02 H new ATOM 0 HG2 LYS A 113 -11.106 28.531 -25.315 1.00 34.20 H new ATOM 0 HG3 LYS A 113 -9.638 29.485 -25.384 1.00 34.20 H new ATOM 0 HD2 LYS A 113 -10.193 29.930 -27.853 1.00 41.12 H new ATOM 0 HD3 LYS A 113 -11.761 29.213 -27.540 1.00 41.12 H new ATOM 0 HE2 LYS A 113 -12.516 31.115 -26.599 1.00 43.13 H new ATOM 0 HE3 LYS A 113 -11.183 31.142 -25.463 1.00 43.13 H new ATOM 0 HZ1 LYS A 113 -11.201 33.119 -26.839 1.00 20.51 H new ATOM 0 HZ2 LYS A 113 -9.802 32.210 -27.150 1.00 20.51 H new ATOM 0 HZ3 LYS A 113 -11.094 32.184 -28.252 1.00 20.51 H new ATOM 1819 N LYS A 114 -9.072 24.557 -27.390 1.00 62.52 N ATOM 1820 CA LYS A 114 -8.466 23.624 -28.333 1.00 31.04 C ATOM 1821 C LYS A 114 -9.250 22.317 -28.385 1.00 32.42 C ATOM 1822 O LYS A 114 -8.835 21.358 -29.035 1.00 22.32 O ATOM 1823 CB LYS A 114 -7.013 23.345 -27.943 1.00 23.42 C ATOM 1824 CG LYS A 114 -6.140 22.920 -29.111 1.00 23.41 C ATOM 1825 CD LYS A 114 -4.889 22.197 -28.640 1.00 13.51 C ATOM 1826 CE LYS A 114 -3.854 23.171 -28.099 1.00 5.12 C ATOM 1827 NZ LYS A 114 -3.808 23.162 -26.610 1.00 52.21 N ATOM 0 H LYS A 114 -8.829 24.387 -26.414 1.00 62.52 H new ATOM 0 HA LYS A 114 -8.489 24.080 -29.323 1.00 31.04 H new ATOM 0 HB2 LYS A 114 -6.589 24.241 -27.491 1.00 23.42 H new ATOM 0 HB3 LYS A 114 -6.993 22.564 -27.183 1.00 23.42 H new ATOM 0 HG2 LYS A 114 -6.710 22.269 -29.774 1.00 23.41 H new ATOM 0 HG3 LYS A 114 -5.857 23.797 -29.693 1.00 23.41 H new ATOM 0 HD2 LYS A 114 -5.153 21.477 -27.865 1.00 13.51 H new ATOM 0 HD3 LYS A 114 -4.461 21.632 -29.468 1.00 13.51 H new ATOM 0 HE2 LYS A 114 -2.871 22.913 -28.494 1.00 5.12 H new ATOM 0 HE3 LYS A 114 -4.084 24.177 -28.449 1.00 5.12 H new ATOM 0 HZ1 LYS A 114 -3.090 23.839 -26.281 1.00 52.21 H new ATOM 0 HZ2 LYS A 114 -4.738 23.433 -26.232 1.00 52.21 H new ATOM 0 HZ3 LYS A 114 -3.563 22.208 -26.276 1.00 52.21 H new ATOM 1841 N ALA A 115 -10.386 22.286 -27.695 1.00 64.12 N ATOM 1842 CA ALA A 115 -11.229 21.097 -27.666 1.00 32.04 C ATOM 1843 C ALA A 115 -12.205 21.088 -28.837 1.00 73.34 C ATOM 1844 O ALA A 115 -12.513 20.032 -29.390 1.00 54.34 O ATOM 1845 CB ALA A 115 -11.985 21.019 -26.348 1.00 24.34 C ATOM 0 H ALA A 115 -10.743 23.070 -27.149 1.00 64.12 H new ATOM 0 HA ALA A 115 -10.585 20.223 -27.756 1.00 32.04 H new ATOM 0 HB1 ALA A 115 -12.611 20.126 -26.340 1.00 24.34 H new ATOM 0 HB2 ALA A 115 -11.274 20.972 -25.523 1.00 24.34 H new ATOM 0 HB3 ALA A 115 -12.613 21.903 -26.236 1.00 24.34 H new ATOM 1851 N GLN A 116 -12.688 22.268 -29.210 1.00 13.42 N ATOM 1852 CA GLN A 116 -13.631 22.394 -30.315 1.00 5.52 C ATOM 1853 C GLN A 116 -13.680 23.830 -30.827 1.00 43.02 C ATOM 1854 O GLN A 116 -14.753 24.422 -30.937 1.00 41.31 O ATOM 1855 CB GLN A 116 -15.026 21.948 -29.876 1.00 52.31 C ATOM 1856 CG GLN A 116 -15.525 22.655 -28.625 1.00 60.43 C ATOM 1857 CD GLN A 116 -17.033 22.589 -28.481 1.00 21.15 C ATOM 1858 OE1 GLN A 116 -17.696 21.778 -29.127 1.00 62.12 O ATOM 1859 NE2 GLN A 116 -17.583 23.445 -27.628 1.00 52.52 N ATOM 0 H GLN A 116 -12.442 23.151 -28.763 1.00 13.42 H new ATOM 0 HA GLN A 116 -13.291 21.750 -31.126 1.00 5.52 H new ATOM 0 HB2 GLN A 116 -15.729 22.128 -30.690 1.00 52.31 H new ATOM 0 HB3 GLN A 116 -15.015 20.873 -29.696 1.00 52.31 H new ATOM 0 HG2 GLN A 116 -15.060 22.205 -27.748 1.00 60.43 H new ATOM 0 HG3 GLN A 116 -15.212 23.699 -28.652 1.00 60.43 H new ATOM 0 HE21 GLN A 116 -16.995 24.100 -27.113 1.00 52.52 H new ATOM 0 HE22 GLN A 116 -18.593 23.447 -27.488 1.00 52.52 H new ATOM 1868 N GLN A 117 -12.512 24.382 -31.139 1.00 43.31 N ATOM 1869 CA GLN A 117 -12.423 25.749 -31.639 1.00 22.00 C ATOM 1870 C GLN A 117 -13.177 25.897 -32.956 1.00 55.14 C ATOM 1871 O GLN A 117 -13.494 27.008 -33.380 1.00 34.05 O ATOM 1872 CB GLN A 117 -10.959 26.151 -31.828 1.00 15.30 C ATOM 1873 CG GLN A 117 -10.658 27.575 -31.387 1.00 14.22 C ATOM 1874 CD GLN A 117 -9.584 28.232 -32.232 1.00 15.32 C ATOM 1875 OE1 GLN A 117 -8.504 28.558 -31.739 1.00 13.52 O ATOM 1876 NE2 GLN A 117 -9.876 28.432 -33.511 1.00 72.44 N ATOM 0 H GLN A 117 -11.615 23.904 -31.055 1.00 43.31 H new ATOM 0 HA GLN A 117 -12.882 26.409 -30.903 1.00 22.00 H new ATOM 0 HB2 GLN A 117 -10.327 25.464 -31.266 1.00 15.30 H new ATOM 0 HB3 GLN A 117 -10.693 26.041 -32.879 1.00 15.30 H new ATOM 0 HG2 GLN A 117 -11.571 28.169 -31.440 1.00 14.22 H new ATOM 0 HG3 GLN A 117 -10.342 27.569 -30.344 1.00 14.22 H new ATOM 0 HE21 GLN A 117 -10.784 28.146 -33.878 1.00 72.44 H new ATOM 0 HE22 GLN A 117 -9.193 28.872 -34.127 1.00 72.44 H new ATOM 1885 N ALA A 118 -13.461 24.770 -33.600 1.00 23.32 N ATOM 1886 CA ALA A 118 -14.179 24.774 -34.868 1.00 52.13 C ATOM 1887 C ALA A 118 -15.668 24.520 -34.657 1.00 53.34 C ATOM 1888 O ALA A 118 -16.498 24.936 -35.465 1.00 33.41 O ATOM 1889 CB ALA A 118 -13.593 23.733 -35.810 1.00 72.04 C ATOM 0 H ALA A 118 -13.204 23.842 -33.264 1.00 23.32 H new ATOM 0 HA ALA A 118 -14.065 25.760 -35.318 1.00 52.13 H new ATOM 0 HB1 ALA A 118 -14.139 23.747 -36.753 1.00 72.04 H new ATOM 0 HB2 ALA A 118 -12.543 23.960 -35.995 1.00 72.04 H new ATOM 0 HB3 ALA A 118 -13.676 22.745 -35.357 1.00 72.04 H new ATOM 1895 N ALA A 119 -15.998 23.835 -33.567 1.00 55.52 N ATOM 1896 CA ALA A 119 -17.387 23.529 -33.249 1.00 72.44 C ATOM 1897 C ALA A 119 -17.802 24.165 -31.927 1.00 5.13 C ATOM 1898 O ALA A 119 -18.611 23.608 -31.186 1.00 33.41 O ATOM 1899 CB ALA A 119 -17.596 22.022 -33.201 1.00 54.11 C ATOM 0 H ALA A 119 -15.322 23.482 -32.890 1.00 55.52 H new ATOM 0 HA ALA A 119 -18.015 23.948 -34.035 1.00 72.44 H new ATOM 0 HB1 ALA A 119 -18.638 21.807 -32.963 1.00 54.11 H new ATOM 0 HB2 ALA A 119 -17.349 21.589 -34.170 1.00 54.11 H new ATOM 0 HB3 ALA A 119 -16.952 21.590 -32.436 1.00 54.11 H new ATOM 1905 N ALA A 120 -17.241 25.334 -31.637 1.00 2.11 N ATOM 1906 CA ALA A 120 -17.554 26.047 -30.405 1.00 75.20 C ATOM 1907 C ALA A 120 -18.588 27.140 -30.650 1.00 74.41 C ATOM 1908 O ALA A 120 -19.436 27.407 -29.798 1.00 53.42 O ATOM 1909 CB ALA A 120 -16.289 26.640 -29.802 1.00 41.11 C ATOM 0 H ALA A 120 -16.567 25.808 -32.239 1.00 2.11 H new ATOM 0 HA ALA A 120 -17.979 25.333 -29.700 1.00 75.20 H new ATOM 0 HB1 ALA A 120 -16.538 27.170 -28.882 1.00 41.11 H new ATOM 0 HB2 ALA A 120 -15.582 25.840 -29.580 1.00 41.11 H new ATOM 0 HB3 ALA A 120 -15.839 27.335 -30.511 1.00 41.11 H new ATOM 1915 N ASP A 121 -18.512 27.768 -31.818 1.00 12.22 N ATOM 1916 CA ASP A 121 -19.443 28.834 -32.175 1.00 71.44 C ATOM 1917 C ASP A 121 -20.827 28.267 -32.477 1.00 63.12 C ATOM 1918 O ASP A 121 -21.704 28.246 -31.613 1.00 75.25 O ATOM 1919 CB ASP A 121 -18.922 29.611 -33.384 1.00 2.32 C ATOM 1920 CG ASP A 121 -18.174 30.867 -32.985 1.00 45.44 C ATOM 1921 OD1 ASP A 121 -17.138 30.748 -32.296 1.00 55.43 O ATOM 1922 OD2 ASP A 121 -18.622 31.970 -33.362 1.00 42.34 O ATOM 0 H ASP A 121 -17.816 27.558 -32.534 1.00 12.22 H new ATOM 0 HA ASP A 121 -19.525 29.512 -31.325 1.00 71.44 H new ATOM 0 HB2 ASP A 121 -18.263 28.969 -33.968 1.00 2.32 H new ATOM 0 HB3 ASP A 121 -19.759 29.879 -34.028 1.00 2.32 H new ATOM 1927 N THR A 122 -21.017 27.808 -33.711 1.00 40.32 N ATOM 1928 CA THR A 122 -22.293 27.244 -34.128 1.00 71.34 C ATOM 1929 C THR A 122 -23.448 28.176 -33.779 1.00 45.43 C ATOM 1930 O THR A 122 -23.234 29.310 -33.350 1.00 73.44 O ATOM 1931 CB THR A 122 -22.542 25.871 -33.475 1.00 25.33 C ATOM 1932 OG1 THR A 122 -22.929 26.043 -32.107 1.00 64.03 O ATOM 1933 CG2 THR A 122 -21.294 25.003 -33.549 1.00 12.22 C ATOM 0 H THR A 122 -20.302 27.817 -34.438 1.00 40.32 H new ATOM 0 HA THR A 122 -22.244 27.120 -35.210 1.00 71.34 H new ATOM 0 HB THR A 122 -23.344 25.374 -34.020 1.00 25.33 H new ATOM 0 HG1 THR A 122 -22.725 26.958 -31.822 1.00 64.03 H new ATOM 0 HG21 THR A 122 -21.493 24.039 -33.082 1.00 12.22 H new ATOM 0 HG22 THR A 122 -21.018 24.851 -34.592 1.00 12.22 H new ATOM 0 HG23 THR A 122 -20.475 25.497 -33.026 1.00 12.22 H new ATOM 1941 N GLY A 123 -24.672 27.692 -33.966 1.00 70.31 N ATOM 1942 CA GLY A 123 -25.842 28.495 -33.666 1.00 1.35 C ATOM 1943 C GLY A 123 -26.386 28.229 -32.276 1.00 1.54 C ATOM 1944 O GLY A 123 -27.163 29.022 -31.745 1.00 31.20 O ATOM 0 H GLY A 123 -24.874 26.757 -34.320 1.00 70.31 H new ATOM 0 HA2 GLY A 123 -25.588 29.551 -33.757 1.00 1.35 H new ATOM 0 HA3 GLY A 123 -26.619 28.289 -34.402 1.00 1.35 H new ATOM 1948 N ASN A 124 -25.977 27.110 -31.686 1.00 15.40 N ATOM 1949 CA ASN A 124 -26.432 26.741 -30.350 1.00 42.44 C ATOM 1950 C ASN A 124 -25.446 25.784 -29.687 1.00 33.12 C ATOM 1951 O ASN A 124 -24.937 24.861 -30.322 1.00 14.50 O ATOM 1952 CB ASN A 124 -27.818 26.097 -30.421 1.00 22.23 C ATOM 1953 CG ASN A 124 -27.985 25.216 -31.643 1.00 31.31 C ATOM 1954 OD1 ASN A 124 -27.740 24.011 -31.592 1.00 33.54 O ATOM 1955 ND2 ASN A 124 -28.404 25.815 -32.752 1.00 11.13 N ATOM 0 H ASN A 124 -25.332 26.444 -32.111 1.00 15.40 H new ATOM 0 HA ASN A 124 -26.492 27.648 -29.748 1.00 42.44 H new ATOM 0 HB2 ASN A 124 -27.986 25.503 -29.523 1.00 22.23 H new ATOM 0 HB3 ASN A 124 -28.578 26.878 -30.433 1.00 22.23 H new ATOM 0 HD21 ASN A 124 -28.534 25.273 -33.606 1.00 11.13 H new ATOM 0 HD22 ASN A 124 -28.595 26.817 -32.749 1.00 11.13 H new ATOM 1962 N ASN A 125 -25.184 26.009 -28.403 1.00 44.45 N ATOM 1963 CA ASN A 125 -24.259 25.167 -27.653 1.00 53.42 C ATOM 1964 C ASN A 125 -24.989 24.413 -26.546 1.00 64.44 C ATOM 1965 O ASN A 125 -25.812 24.982 -25.830 1.00 25.04 O ATOM 1966 CB ASN A 125 -23.136 26.016 -27.053 1.00 30.41 C ATOM 1967 CG ASN A 125 -22.249 26.635 -28.115 1.00 50.22 C ATOM 1968 OD1 ASN A 125 -21.904 25.990 -29.105 1.00 42.32 O ATOM 1969 ND2 ASN A 125 -21.875 27.893 -27.914 1.00 3.35 N ATOM 0 H ASN A 125 -25.599 26.767 -27.861 1.00 44.45 H new ATOM 0 HA ASN A 125 -23.827 24.440 -28.341 1.00 53.42 H new ATOM 0 HB2 ASN A 125 -23.570 26.806 -26.440 1.00 30.41 H new ATOM 0 HB3 ASN A 125 -22.529 25.397 -26.392 1.00 30.41 H new ATOM 0 HD21 ASN A 125 -21.278 28.363 -28.595 1.00 3.35 H new ATOM 0 HD22 ASN A 125 -22.185 28.390 -27.079 1.00 3.35 H new ATOM 1976 N SER A 126 -24.679 23.127 -26.412 1.00 70.23 N ATOM 1977 CA SER A 126 -25.308 22.292 -25.394 1.00 63.34 C ATOM 1978 C SER A 126 -25.061 22.858 -24.000 1.00 74.52 C ATOM 1979 O SER A 126 -23.963 23.321 -23.692 1.00 35.31 O ATOM 1980 CB SER A 126 -24.773 20.861 -25.478 1.00 72.42 C ATOM 1981 OG SER A 126 -25.821 19.937 -25.712 1.00 53.23 O ATOM 0 H SER A 126 -23.997 22.641 -26.995 1.00 70.23 H new ATOM 0 HA SER A 126 -26.382 22.283 -25.578 1.00 63.34 H new ATOM 0 HB2 SER A 126 -24.037 20.791 -26.279 1.00 72.42 H new ATOM 0 HB3 SER A 126 -24.260 20.606 -24.551 1.00 72.42 H new ATOM 0 HG SER A 126 -25.452 19.030 -25.763 1.00 53.23 H new ATOM 1987 N GLN A 127 -26.092 22.818 -23.161 1.00 62.25 N ATOM 1988 CA GLN A 127 -25.988 23.327 -21.799 1.00 52.34 C ATOM 1989 C GLN A 127 -26.811 22.477 -20.836 1.00 51.01 C ATOM 1990 O GLN A 127 -27.953 22.120 -21.127 1.00 2.23 O ATOM 1991 CB GLN A 127 -26.456 24.783 -21.740 1.00 64.30 C ATOM 1992 CG GLN A 127 -25.326 25.776 -21.525 1.00 70.12 C ATOM 1993 CD GLN A 127 -24.896 25.866 -20.074 1.00 23.02 C ATOM 1994 OE1 GLN A 127 -24.619 24.852 -19.432 1.00 34.12 O ATOM 1995 NE2 GLN A 127 -24.839 27.084 -19.547 1.00 41.54 N ATOM 0 H GLN A 127 -27.008 22.439 -23.401 1.00 62.25 H new ATOM 0 HA GLN A 127 -24.942 23.276 -21.497 1.00 52.34 H new ATOM 0 HB2 GLN A 127 -26.972 25.028 -22.668 1.00 64.30 H new ATOM 0 HB3 GLN A 127 -27.182 24.890 -20.934 1.00 64.30 H new ATOM 0 HG2 GLN A 127 -24.471 25.486 -22.136 1.00 70.12 H new ATOM 0 HG3 GLN A 127 -25.643 26.761 -21.868 1.00 70.12 H new ATOM 0 HE21 GLN A 127 -25.077 27.897 -20.115 1.00 41.54 H new ATOM 0 HE22 GLN A 127 -24.557 27.206 -18.574 1.00 41.54 H new ATOM 2004 N VAL A 128 -26.222 22.156 -19.688 1.00 11.23 N ATOM 2005 CA VAL A 128 -26.900 21.349 -18.681 1.00 31.23 C ATOM 2006 C VAL A 128 -28.169 22.037 -18.188 1.00 24.23 C ATOM 2007 O VAL A 128 -28.191 23.251 -17.989 1.00 45.10 O ATOM 2008 CB VAL A 128 -25.982 21.065 -17.477 1.00 73.14 C ATOM 2009 CG1 VAL A 128 -24.709 20.366 -17.931 1.00 10.51 C ATOM 2010 CG2 VAL A 128 -25.659 22.354 -16.739 1.00 35.33 C ATOM 0 H VAL A 128 -25.277 22.443 -19.433 1.00 11.23 H new ATOM 0 HA VAL A 128 -27.164 20.405 -19.158 1.00 31.23 H new ATOM 0 HB VAL A 128 -26.506 20.402 -16.789 1.00 73.14 H new ATOM 0 HG11 VAL A 128 -24.072 20.173 -17.068 1.00 10.51 H new ATOM 0 HG12 VAL A 128 -24.964 19.422 -18.412 1.00 10.51 H new ATOM 0 HG13 VAL A 128 -24.177 21.002 -18.639 1.00 10.51 H new ATOM 0 HG21 VAL A 128 -25.010 22.135 -15.891 1.00 35.33 H new ATOM 0 HG22 VAL A 128 -25.153 23.043 -17.415 1.00 35.33 H new ATOM 0 HG23 VAL A 128 -26.582 22.809 -16.381 1.00 35.33 H new ATOM 2020 N SER A 129 -29.223 21.252 -17.991 1.00 33.12 N ATOM 2021 CA SER A 129 -30.497 21.785 -17.524 1.00 52.21 C ATOM 2022 C SER A 129 -31.367 20.678 -16.936 1.00 41.15 C ATOM 2023 O SER A 129 -32.033 19.944 -17.666 1.00 44.23 O ATOM 2024 CB SER A 129 -31.237 22.476 -18.671 1.00 43.01 C ATOM 2025 OG SER A 129 -30.377 23.354 -19.376 1.00 13.30 O ATOM 0 H SER A 129 -29.220 20.244 -18.148 1.00 33.12 H new ATOM 0 HA SER A 129 -30.291 22.516 -16.742 1.00 52.21 H new ATOM 0 HB2 SER A 129 -31.636 21.727 -19.354 1.00 43.01 H new ATOM 0 HB3 SER A 129 -32.087 23.033 -18.277 1.00 43.01 H new ATOM 0 HG SER A 129 -29.685 23.692 -18.769 1.00 13.30 H new ATOM 2031 N GLN A 130 -31.355 20.565 -15.611 1.00 71.35 N ATOM 2032 CA GLN A 130 -32.142 19.547 -14.925 1.00 40.34 C ATOM 2033 C GLN A 130 -32.632 20.058 -13.575 1.00 34.35 C ATOM 2034 O GLN A 130 -31.845 20.238 -12.646 1.00 53.43 O ATOM 2035 CB GLN A 130 -31.315 18.275 -14.734 1.00 63.12 C ATOM 2036 CG GLN A 130 -30.849 17.651 -16.040 1.00 23.35 C ATOM 2037 CD GLN A 130 -30.464 16.192 -15.884 1.00 52.31 C ATOM 2038 OE1 GLN A 130 -29.415 15.871 -15.327 1.00 23.55 O ATOM 2039 NE2 GLN A 130 -31.315 15.301 -16.378 1.00 73.21 N ATOM 0 H GLN A 130 -30.810 21.165 -14.992 1.00 71.35 H new ATOM 0 HA GLN A 130 -33.010 19.317 -15.543 1.00 40.34 H new ATOM 0 HB2 GLN A 130 -30.444 18.506 -14.120 1.00 63.12 H new ATOM 0 HB3 GLN A 130 -31.908 17.545 -14.183 1.00 63.12 H new ATOM 0 HG2 GLN A 130 -31.642 17.736 -16.783 1.00 23.35 H new ATOM 0 HG3 GLN A 130 -29.994 18.210 -16.421 1.00 23.35 H new ATOM 0 HE21 GLN A 130 -32.173 15.613 -16.832 1.00 73.21 H new ATOM 0 HE22 GLN A 130 -31.110 14.305 -16.304 1.00 73.21 H new ATOM 2048 N ASN A 131 -33.937 20.287 -13.472 1.00 43.20 N ATOM 2049 CA ASN A 131 -34.532 20.778 -12.234 1.00 43.32 C ATOM 2050 C ASN A 131 -35.823 20.030 -11.917 1.00 62.24 C ATOM 2051 O ASN A 131 -36.662 19.818 -12.793 1.00 43.24 O ATOM 2052 CB ASN A 131 -34.811 22.279 -12.337 1.00 61.21 C ATOM 2053 CG ASN A 131 -33.701 23.117 -11.732 1.00 14.12 C ATOM 2054 OD1 ASN A 131 -32.665 23.339 -12.358 1.00 51.55 O ATOM 2055 ND2 ASN A 131 -33.915 23.585 -10.508 1.00 44.32 N ATOM 0 H ASN A 131 -34.603 20.141 -14.231 1.00 43.20 H new ATOM 0 HA ASN A 131 -33.823 20.602 -11.425 1.00 43.32 H new ATOM 0 HB2 ASN A 131 -34.938 22.551 -13.385 1.00 61.21 H new ATOM 0 HB3 ASN A 131 -35.750 22.507 -11.833 1.00 61.21 H new ATOM 0 HD21 ASN A 131 -33.205 24.155 -10.048 1.00 44.32 H new ATOM 0 HD22 ASN A 131 -34.790 23.375 -10.027 1.00 44.32 H new ATOM 2062 N TYR A 132 -35.976 19.632 -10.659 1.00 44.04 N ATOM 2063 CA TYR A 132 -37.164 18.905 -10.226 1.00 4.22 C ATOM 2064 C TYR A 132 -37.793 19.570 -9.005 1.00 32.41 C ATOM 2065 O TYR A 132 -38.774 20.298 -9.153 1.00 24.43 O ATOM 2066 CB TYR A 132 -36.810 17.453 -9.904 1.00 71.45 C ATOM 2067 CG TYR A 132 -36.299 16.676 -11.097 1.00 74.42 C ATOM 2068 CD1 TYR A 132 -37.017 16.640 -12.287 1.00 1.31 C ATOM 2069 CD2 TYR A 132 -35.100 15.976 -11.035 1.00 33.25 C ATOM 2070 CE1 TYR A 132 -36.555 15.931 -13.379 1.00 53.33 C ATOM 2071 CE2 TYR A 132 -34.630 15.266 -12.122 1.00 54.33 C ATOM 2072 CZ TYR A 132 -35.361 15.246 -13.292 1.00 61.12 C ATOM 2073 OH TYR A 132 -34.897 14.538 -14.377 1.00 1.25 O ATOM 0 H TYR A 132 -35.292 19.800 -9.921 1.00 44.04 H new ATOM 0 HA TYR A 132 -37.888 18.923 -11.041 1.00 4.22 H new ATOM 0 HB2 TYR A 132 -36.053 17.438 -9.120 1.00 71.45 H new ATOM 0 HB3 TYR A 132 -37.692 16.952 -9.506 1.00 71.45 H new ATOM 0 HD1 TYR A 132 -37.952 17.176 -12.359 1.00 1.31 H new ATOM 0 HD2 TYR A 132 -34.526 15.988 -10.120 1.00 33.25 H new ATOM 0 HE1 TYR A 132 -37.126 15.913 -14.296 1.00 53.33 H new ATOM 0 HE2 TYR A 132 -33.695 14.729 -12.057 1.00 54.33 H new ATOM 0 HH TYR A 132 -34.043 14.114 -14.150 1.00 1.25 H new TER 2083 TYR A 132 HETATM 2084 P1 PBU A 300 -16.372 17.998 10.232 1.00 2.33 P HETATM 2085 P4 PBU A 300 -18.264 25.984 7.476 1.00 21.30 P HETATM 2086 P5 PBU A 300 -17.505 22.895 4.085 1.00 75.11 P HETATM 2087 C3' PBU A 300 -17.190 16.217 8.666 1.00 32.12 C HETATM 2088 C2' PBU A 300 -15.910 16.083 7.804 1.00 22.34 C HETATM 2089 O2' PBU A 300 -16.261 15.487 6.566 1.00 44.51 O HETATM 2090 C1' PBU A 300 -14.835 15.210 8.496 1.00 70.55 C HETATM 2091 O1' PBU A 300 -15.439 14.030 8.986 1.00 30.32 O HETATM 2092 C1 PBU A 300 -17.048 20.476 8.816 1.00 42.22 C HETATM 2093 O1 PBU A 300 -17.279 19.034 9.284 1.00 21.25 O HETATM 2094 C2 PBU A 300 -17.661 21.587 9.734 1.00 20.04 C HETATM 2095 O2 PBU A 300 -19.061 21.426 9.948 1.00 41.45 O HETATM 2096 C3 PBU A 300 -17.400 22.990 9.140 1.00 50.14 C HETATM 2097 O3 PBU A 300 -17.989 23.956 10.021 1.00 72.03 O HETATM 2098 C4 PBU A 300 -17.968 23.105 7.673 1.00 44.25 C HETATM 2099 O4 PBU A 300 -17.646 24.478 7.111 1.00 1.44 O HETATM 2100 C5 PBU A 300 -17.317 21.970 6.786 1.00 22.51 C HETATM 2101 O5 PBU A 300 -17.891 22.039 5.441 1.00 62.04 O HETATM 2102 C6 PBU A 300 -17.556 20.553 7.365 1.00 72.14 C HETATM 2103 O6 PBU A 300 -16.866 19.536 6.622 1.00 42.54 O HETATM 2104 C7 PBU A 300 -16.400 16.344 5.447 1.00 53.54 C HETATM 2105 O7 PBU A 300 -17.414 16.332 4.786 1.00 54.13 O HETATM 2106 C8 PBU A 300 -15.260 17.310 5.078 1.00 62.33 C HETATM 2107 C9 PBU A 300 -15.418 17.790 3.622 1.00 23.43 C HETATM 2108 C10 PBU A 300 -14.724 19.154 3.454 1.00 35.31 C HETATM 2109 C11 PBU A 300 -15.177 13.541 10.282 1.00 34.15 C HETATM 2110 O11 PBU A 300 -15.050 14.239 11.270 1.00 24.40 O HETATM 2111 C12 PBU A 300 -14.992 12.001 10.388 1.00 2.32 C HETATM 2112 C13 PBU A 300 -15.760 11.372 11.563 1.00 64.12 C HETATM 2113 C14 PBU A 300 -17.235 11.812 11.561 1.00 21.41 C HETATM 2114 O41 PBU A 300 -16.958 26.691 7.827 1.00 32.24 O HETATM 2115 O42 PBU A 300 -18.918 26.468 6.210 1.00 64.12 O HETATM 2116 O43 PBU A 300 -19.273 25.867 8.606 1.00 0.03 O HETATM 2117 O51 PBU A 300 -18.888 23.307 3.622 1.00 51.44 O HETATM 2118 O52 PBU A 300 -16.584 23.985 4.607 1.00 52.21 O HETATM 2119 O53 PBU A 300 -16.837 21.865 3.204 1.00 50.42 O HETATM 2120 OP1 PBU A 300 -16.887 16.611 9.988 1.00 12.40 O HETATM 2121 OP2 PBU A 300 -14.949 18.228 9.718 1.00 51.33 O HETATM 2122 OP3 PBU A 300 -16.670 18.428 11.646 1.00 42.33 O HETATM 0 H3'2 PBU A 300 -17.860 16.947 8.212 1.00 32.12 H new HETATM 0 H3'1 PBU A 300 -17.720 15.265 8.682 1.00 32.12 H new HETATM 0 H143 PBU A 300 -17.291 12.897 11.649 1.00 21.41 H new HETATM 0 H142 PBU A 300 -17.707 11.499 10.630 1.00 21.41 H new HETATM 0 H141 PBU A 300 -17.753 11.352 12.402 1.00 21.41 H new HETATM 0 H132 PBU A 300 -15.702 10.285 11.499 1.00 64.12 H new HETATM 0 H131 PBU A 300 -15.292 11.662 12.504 1.00 64.12 H new HETATM 0 H122 PBU A 300 -15.323 11.538 9.458 1.00 2.32 H new HETATM 0 H121 PBU A 300 -13.931 11.777 10.496 1.00 2.32 H new HETATM 0 H1'2 PBU A 300 -14.042 14.961 7.790 1.00 70.55 H new HETATM 0 H1'1 PBU A 300 -14.372 15.762 9.314 1.00 70.55 H new HETATM 0 H92 PBU A 300 -14.982 17.061 2.938 1.00 23.43 H new HETATM 0 H91 PBU A 300 -16.475 17.874 3.368 1.00 23.43 H new HETATM 0 H82 PBU A 300 -15.266 18.166 5.753 1.00 62.33 H new HETATM 0 H81 PBU A 300 -14.298 16.813 5.202 1.00 62.33 H new HETATM 0 H6 PBU A 300 -18.630 20.379 7.308 1.00 72.14 H new HETATM 0 H5 PBU A 300 -16.240 22.138 6.768 1.00 22.51 H new HETATM 0 H4 PBU A 300 -19.051 22.980 7.674 1.00 44.25 H new HETATM 0 H3 PBU A 300 -16.328 23.174 9.062 1.00 50.14 H new HETATM 0 H2' PBU A 300 -15.489 17.078 7.659 1.00 22.34 H new HETATM 0 H2 PBU A 300 -17.165 21.487 10.699 1.00 20.04 H new HETATM 0 H13 PBU A 300 -15.180 19.880 4.127 1.00 35.31 H new HETATM 0 H12 PBU A 300 -13.665 19.055 3.691 1.00 35.31 H new HETATM 0 H11 PBU A 300 -14.835 19.494 2.425 1.00 35.31 H new HETATM 0 H1 PBU A 300 -15.982 20.697 8.879 1.00 42.22 H new HETATM 0 H06 PBU A 300 -16.769 18.734 7.177 1.00 42.54 H new HETATM 0 H03 PBU A 300 -18.579 24.548 9.510 1.00 72.03 H new HETATM 0 H02 PBU A 300 -19.461 22.294 10.166 1.00 41.45 H new