USER MOD reduce.3.24.130724 H: found=0, std=0, add=1277, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1277 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 TYR OH : rot 69:sc= 0.199 USER MOD Set 1.2: A 129 GLN : amide:sc= -0.608 X(o=-0.41,f=-0.043) USER MOD Set 2.1: A 37 THR OG1 : rot -92:sc= 1.63 USER MOD Set 2.2: A 38 HIS :FLIP no HE2:sc= -0.999! F(o=-1.3,f=0.63!) USER MOD Single : A 1 MET CE :methyl -142:sc=-0.00235 (180deg=-1.47!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 1.21 K(o=1.2,f=-4.2!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0304 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -20:sc= 1.17 USER MOD Single : A 42 LYS NZ :NH3+ 144:sc= 1.24 (180deg=0.909) USER MOD Single : A 45 ASN : amide:sc= -0.171 K(o=-0.17,f=-0.88) USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 0.746 (180deg=0.37) USER MOD Single : A 49 LYS NZ :NH3+ 172:sc=-0.00631 (180deg=-0.0922) USER MOD Single : A 50 SER OG : rot 170:sc= -0.525 USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 58 HIS : no HE2:sc= -0.974 K(o=-0.97,f=-2.1) USER MOD Single : A 63 LYS NZ :NH3+ 177:sc= 0.941 (180deg=0.89) USER MOD Single : A 67 SER OG : rot 150:sc= -0.755 USER MOD Single : A 69 SER OG : rot 180:sc= -0.0459 USER MOD Single : A 71 SER OG : rot -5:sc= 0.975 USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.0541 K(o=-0.054,f=-0.74) USER MOD Single : A 117 LYS NZ :NH3+ -150:sc= -2.84! (180deg=-4.22!) USER MOD Single : A 123 MET CE :methyl -124:sc= -1.15 (180deg=-4.02!) USER MOD Single : A 125 TYR OH : rot 180:sc= 0.9 USER MOD Single : A 126 LYS NZ :NH3+ -141:sc= 1.27 (180deg=0.814) USER MOD Single : A 128 MET CE :methyl -135:sc= -0.808 (180deg=-1.44) USER MOD Single : A 130 LYS NZ :NH3+ -132:sc= 1.24 (180deg=0.153) USER MOD Single : A 134 GLN :FLIP amide:sc= -0.134 F(o=-0.83,f=-0.13) USER MOD Single : A 135 GLN : amide:sc= -0.774 K(o=-0.77,f=-5!) USER MOD Single : A 139 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.16) USER MOD Single : A 141 SER OG : rot -84:sc= 0.395 USER MOD Single : A 144 THR OG1 : rot -20:sc= 0.598 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 152 HIS : no HE2:sc= 0.394 K(o=0.39,f=-1.4) USER MOD Single : A 153 HIS : no HD1:sc= -0.0928 X(o=-0.093,f=0) USER MOD Single : A 154 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.710 29.023 -9.017 1.00 12.24 N ATOM 2 CA MET A 1 11.400 28.393 -9.324 1.00 74.24 C ATOM 3 C MET A 1 10.251 29.407 -9.190 1.00 45.32 C ATOM 4 O MET A 1 9.932 29.852 -8.088 1.00 63.04 O ATOM 5 CB MET A 1 11.158 27.201 -8.391 1.00 63.25 C ATOM 6 CG MET A 1 9.869 26.449 -8.679 1.00 30.34 C ATOM 7 SD MET A 1 9.606 25.074 -7.542 1.00 11.35 S ATOM 8 CE MET A 1 8.043 24.440 -8.139 1.00 55.41 C ATOM 0 H1 MET A 1 13.467 28.316 -9.115 1.00 12.24 H new ATOM 0 H2 MET A 1 12.881 29.808 -9.678 1.00 12.24 H new ATOM 0 H3 MET A 1 12.700 29.387 -8.043 1.00 12.24 H new ATOM 0 HA MET A 1 11.426 28.043 -10.356 1.00 74.24 H new ATOM 0 HB2 MET A 1 11.997 26.510 -8.474 1.00 63.25 H new ATOM 0 HB3 MET A 1 11.138 27.556 -7.361 1.00 63.25 H new ATOM 0 HG2 MET A 1 9.027 27.138 -8.612 1.00 30.34 H new ATOM 0 HG3 MET A 1 9.892 26.072 -9.701 1.00 30.34 H new ATOM 0 HE1 MET A 1 7.432 24.123 -7.294 1.00 55.41 H new ATOM 0 HE2 MET A 1 7.521 25.221 -8.692 1.00 55.41 H new ATOM 0 HE3 MET A 1 8.223 23.589 -8.796 1.00 55.41 H new ATOM 20 N GLY A 2 9.630 29.763 -10.316 1.00 72.34 N ATOM 21 CA GLY A 2 8.542 30.743 -10.300 1.00 12.55 C ATOM 22 C GLY A 2 7.295 30.293 -11.058 1.00 72.21 C ATOM 23 O GLY A 2 6.219 30.865 -10.885 1.00 50.10 O ATOM 0 H GLY A 2 9.857 29.393 -11.239 1.00 72.34 H new ATOM 0 HA2 GLY A 2 8.271 30.954 -9.266 1.00 12.55 H new ATOM 0 HA3 GLY A 2 8.901 31.677 -10.732 1.00 12.55 H new ATOM 27 N PHE A 3 7.433 29.263 -11.896 1.00 12.05 N ATOM 28 CA PHE A 3 6.309 28.759 -12.693 1.00 42.10 C ATOM 29 C PHE A 3 5.413 27.810 -11.874 1.00 71.42 C ATOM 30 O PHE A 3 5.726 27.466 -10.731 1.00 55.41 O ATOM 31 CB PHE A 3 6.828 28.054 -13.954 1.00 64.42 C ATOM 32 CG PHE A 3 7.530 28.977 -14.924 1.00 4.15 C ATOM 33 CD1 PHE A 3 8.877 29.281 -14.772 1.00 52.12 C ATOM 34 CD2 PHE A 3 6.839 29.545 -15.988 1.00 43.33 C ATOM 35 CE1 PHE A 3 9.517 30.130 -15.657 1.00 30.41 C ATOM 36 CE2 PHE A 3 7.476 30.395 -16.875 1.00 5.22 C ATOM 37 CZ PHE A 3 8.816 30.687 -16.710 1.00 54.23 C ATOM 0 H PHE A 3 8.309 28.762 -12.041 1.00 12.05 H new ATOM 0 HA PHE A 3 5.699 29.613 -12.989 1.00 42.10 H new ATOM 0 HB2 PHE A 3 7.516 27.261 -13.659 1.00 64.42 H new ATOM 0 HB3 PHE A 3 5.991 27.576 -14.463 1.00 64.42 H new ATOM 0 HD1 PHE A 3 9.432 28.849 -13.952 1.00 52.12 H new ATOM 0 HD2 PHE A 3 5.792 29.320 -16.124 1.00 43.33 H new ATOM 0 HE1 PHE A 3 10.564 30.358 -15.525 1.00 30.41 H new ATOM 0 HE2 PHE A 3 6.926 30.830 -17.696 1.00 5.22 H new ATOM 0 HZ PHE A 3 9.315 31.349 -17.402 1.00 54.23 H new ATOM 47 N LYS A 4 4.311 27.367 -12.478 1.00 43.45 N ATOM 48 CA LYS A 4 3.285 26.577 -11.773 1.00 41.53 C ATOM 49 C LYS A 4 3.658 25.080 -11.678 1.00 63.44 C ATOM 50 O LYS A 4 2.805 24.200 -11.818 1.00 75.11 O ATOM 51 CB LYS A 4 1.930 26.762 -12.487 1.00 64.20 C ATOM 52 CG LYS A 4 0.724 26.177 -11.745 1.00 23.32 C ATOM 53 CD LYS A 4 0.498 26.842 -10.389 1.00 11.14 C ATOM 54 CE LYS A 4 0.188 28.328 -10.525 1.00 54.30 C ATOM 55 NZ LYS A 4 -0.077 28.965 -9.207 1.00 23.01 N ATOM 0 H LYS A 4 4.099 27.540 -13.461 1.00 43.45 H new ATOM 0 HA LYS A 4 3.216 26.941 -10.748 1.00 41.53 H new ATOM 0 HB2 LYS A 4 1.760 27.827 -12.643 1.00 64.20 H new ATOM 0 HB3 LYS A 4 1.990 26.301 -13.473 1.00 64.20 H new ATOM 0 HG2 LYS A 4 -0.169 26.295 -12.358 1.00 23.32 H new ATOM 0 HG3 LYS A 4 0.873 25.107 -11.602 1.00 23.32 H new ATOM 0 HD2 LYS A 4 -0.325 26.346 -9.875 1.00 11.14 H new ATOM 0 HD3 LYS A 4 1.385 26.712 -9.769 1.00 11.14 H new ATOM 0 HE2 LYS A 4 1.026 28.830 -11.008 1.00 54.30 H new ATOM 0 HE3 LYS A 4 -0.679 28.460 -11.172 1.00 54.30 H new ATOM 0 HZ1 LYS A 4 -0.283 29.975 -9.345 1.00 23.01 H new ATOM 0 HZ2 LYS A 4 -0.893 28.503 -8.756 1.00 23.01 H new ATOM 0 HZ3 LYS A 4 0.759 28.863 -8.597 1.00 23.01 H new ATOM 69 N LEU A 5 4.927 24.786 -11.399 1.00 51.33 N ATOM 70 CA LEU A 5 5.368 23.395 -11.198 1.00 52.32 C ATOM 71 C LEU A 5 5.004 22.896 -9.785 1.00 4.34 C ATOM 72 O LEU A 5 5.859 22.445 -9.022 1.00 21.14 O ATOM 73 CB LEU A 5 6.882 23.252 -11.450 1.00 2.02 C ATOM 74 CG LEU A 5 7.322 23.263 -12.928 1.00 2.44 C ATOM 75 CD1 LEU A 5 6.651 22.130 -13.703 1.00 12.24 C ATOM 76 CD2 LEU A 5 7.031 24.615 -13.576 1.00 21.23 C ATOM 0 H LEU A 5 5.667 25.482 -11.306 1.00 51.33 H new ATOM 0 HA LEU A 5 4.842 22.774 -11.923 1.00 52.32 H new ATOM 0 HB2 LEU A 5 7.395 24.062 -10.932 1.00 2.02 H new ATOM 0 HB3 LEU A 5 7.220 22.320 -10.997 1.00 2.02 H new ATOM 0 HG LEU A 5 8.400 23.102 -12.960 1.00 2.44 H new ATOM 0 HD11 LEU A 5 6.976 22.158 -14.743 1.00 12.24 H new ATOM 0 HD12 LEU A 5 6.929 21.173 -13.261 1.00 12.24 H new ATOM 0 HD13 LEU A 5 5.569 22.250 -13.658 1.00 12.24 H new ATOM 0 HD21 LEU A 5 7.351 24.596 -14.618 1.00 21.23 H new ATOM 0 HD22 LEU A 5 5.961 24.818 -13.529 1.00 21.23 H new ATOM 0 HD23 LEU A 5 7.573 25.397 -13.045 1.00 21.23 H new ATOM 88 N ARG A 6 3.716 22.978 -9.459 1.00 63.13 N ATOM 89 CA ARG A 6 3.191 22.557 -8.154 1.00 2.41 C ATOM 90 C ARG A 6 1.734 22.081 -8.299 1.00 22.11 C ATOM 91 O ARG A 6 0.939 22.710 -9.002 1.00 21.22 O ATOM 92 CB ARG A 6 3.254 23.726 -7.152 1.00 25.13 C ATOM 93 CG ARG A 6 2.773 23.367 -5.745 1.00 61.22 C ATOM 94 CD ARG A 6 2.582 24.603 -4.864 1.00 22.30 C ATOM 95 NE ARG A 6 3.819 25.358 -4.667 1.00 43.23 N ATOM 96 CZ ARG A 6 3.913 26.426 -3.916 1.00 65.31 C ATOM 97 NH1 ARG A 6 2.878 26.889 -3.288 1.00 11.32 N ATOM 98 NH2 ARG A 6 5.045 27.034 -3.803 1.00 52.20 N ATOM 0 H ARG A 6 3.002 23.339 -10.092 1.00 63.13 H new ATOM 0 HA ARG A 6 3.803 21.735 -7.782 1.00 2.41 H new ATOM 0 HB2 ARG A 6 4.281 24.085 -7.093 1.00 25.13 H new ATOM 0 HB3 ARG A 6 2.650 24.550 -7.532 1.00 25.13 H new ATOM 0 HG2 ARG A 6 1.831 22.823 -5.813 1.00 61.22 H new ATOM 0 HG3 ARG A 6 3.494 22.698 -5.277 1.00 61.22 H new ATOM 0 HD2 ARG A 6 1.833 25.253 -5.317 1.00 22.30 H new ATOM 0 HD3 ARG A 6 2.192 24.295 -3.894 1.00 22.30 H new ATOM 0 HE ARG A 6 4.660 25.032 -5.144 1.00 43.23 H new ATOM 0 HH11 ARG A 6 1.976 26.420 -3.376 1.00 11.32 H new ATOM 0 HH12 ARG A 6 2.965 27.722 -2.706 1.00 11.32 H new ATOM 0 HH21 ARG A 6 5.864 26.682 -4.298 1.00 52.20 H new ATOM 0 HH22 ARG A 6 5.121 27.866 -3.218 1.00 52.20 H new ATOM 112 N GLY A 7 1.390 20.975 -7.647 1.00 14.03 N ATOM 113 CA GLY A 7 0.028 20.451 -7.733 1.00 0.13 C ATOM 114 C GLY A 7 -0.264 19.388 -6.682 1.00 13.30 C ATOM 115 O GLY A 7 -0.714 18.288 -7.005 1.00 11.43 O ATOM 0 H GLY A 7 2.023 20.430 -7.061 1.00 14.03 H new ATOM 0 HA2 GLY A 7 -0.680 21.272 -7.619 1.00 0.13 H new ATOM 0 HA3 GLY A 7 -0.132 20.028 -8.725 1.00 0.13 H new ATOM 119 N GLN A 8 -0.026 19.724 -5.419 1.00 55.10 N ATOM 120 CA GLN A 8 -0.188 18.770 -4.321 1.00 4.55 C ATOM 121 C GLN A 8 -1.676 18.594 -3.964 1.00 65.33 C ATOM 122 O GLN A 8 -2.296 19.490 -3.393 1.00 62.42 O ATOM 123 CB GLN A 8 0.606 19.236 -3.089 1.00 73.20 C ATOM 124 CG GLN A 8 1.993 19.802 -3.406 1.00 24.14 C ATOM 125 CD GLN A 8 2.816 18.924 -4.339 1.00 73.21 C ATOM 126 OE1 GLN A 8 2.774 19.081 -5.557 1.00 75.02 O ATOM 127 NE2 GLN A 8 3.578 18.008 -3.783 1.00 11.41 N ATOM 0 H GLN A 8 0.281 20.652 -5.127 1.00 55.10 H new ATOM 0 HA GLN A 8 0.201 17.805 -4.645 1.00 4.55 H new ATOM 0 HB2 GLN A 8 0.027 19.997 -2.566 1.00 73.20 H new ATOM 0 HB3 GLN A 8 0.718 18.395 -2.405 1.00 73.20 H new ATOM 0 HG2 GLN A 8 1.879 20.788 -3.857 1.00 24.14 H new ATOM 0 HG3 GLN A 8 2.541 19.939 -2.474 1.00 24.14 H new ATOM 0 HE21 GLN A 8 3.591 17.902 -2.769 1.00 11.41 H new ATOM 0 HE22 GLN A 8 4.156 17.403 -4.366 1.00 11.41 H new ATOM 136 N VAL A 9 -2.243 17.437 -4.315 1.00 1.43 N ATOM 137 CA VAL A 9 -3.676 17.164 -4.111 1.00 33.02 C ATOM 138 C VAL A 9 -4.103 17.279 -2.631 1.00 73.12 C ATOM 139 O VAL A 9 -5.187 17.782 -2.324 1.00 74.23 O ATOM 140 CB VAL A 9 -4.050 15.756 -4.649 1.00 41.20 C ATOM 141 CG1 VAL A 9 -3.292 14.663 -3.900 1.00 3.23 C ATOM 142 CG2 VAL A 9 -5.558 15.518 -4.577 1.00 40.32 C ATOM 0 H VAL A 9 -1.731 16.667 -4.745 1.00 1.43 H new ATOM 0 HA VAL A 9 -4.215 17.929 -4.670 1.00 33.02 H new ATOM 0 HB VAL A 9 -3.754 15.715 -5.697 1.00 41.20 H new ATOM 0 HG11 VAL A 9 -3.573 13.688 -4.297 1.00 3.23 H new ATOM 0 HG12 VAL A 9 -2.220 14.811 -4.027 1.00 3.23 H new ATOM 0 HG13 VAL A 9 -3.541 14.709 -2.840 1.00 3.23 H new ATOM 0 HG21 VAL A 9 -5.788 14.524 -4.961 1.00 40.32 H new ATOM 0 HG22 VAL A 9 -5.889 15.593 -3.541 1.00 40.32 H new ATOM 0 HG23 VAL A 9 -6.074 16.267 -5.178 1.00 40.32 H new ATOM 152 N SER A 10 -3.242 16.832 -1.720 1.00 61.33 N ATOM 153 CA SER A 10 -3.552 16.835 -0.281 1.00 13.02 C ATOM 154 C SER A 10 -2.565 17.712 0.498 1.00 1.30 C ATOM 155 O SER A 10 -1.441 17.949 0.052 1.00 74.11 O ATOM 156 CB SER A 10 -3.522 15.402 0.267 1.00 42.43 C ATOM 157 OG SER A 10 -3.829 15.368 1.653 1.00 75.24 O ATOM 0 H SER A 10 -2.320 16.461 -1.948 1.00 61.33 H new ATOM 0 HA SER A 10 -4.551 17.251 -0.153 1.00 13.02 H new ATOM 0 HB2 SER A 10 -4.237 14.787 -0.280 1.00 42.43 H new ATOM 0 HB3 SER A 10 -2.536 14.968 0.101 1.00 42.43 H new ATOM 0 HG SER A 10 -3.803 14.441 1.971 1.00 75.24 H new ATOM 163 N GLU A 11 -2.986 18.197 1.667 1.00 52.01 N ATOM 164 CA GLU A 11 -2.133 19.056 2.500 1.00 55.44 C ATOM 165 C GLU A 11 -1.905 18.456 3.898 1.00 4.10 C ATOM 166 O GLU A 11 -2.685 17.627 4.375 1.00 73.44 O ATOM 167 CB GLU A 11 -2.739 20.464 2.629 1.00 52.22 C ATOM 168 CG GLU A 11 -4.075 20.505 3.365 1.00 44.41 C ATOM 169 CD GLU A 11 -4.589 21.923 3.572 1.00 33.21 C ATOM 170 OE1 GLU A 11 -4.182 22.566 4.562 1.00 65.13 O ATOM 171 OE2 GLU A 11 -5.399 22.400 2.746 1.00 3.23 O ATOM 0 H GLU A 11 -3.909 18.012 2.060 1.00 52.01 H new ATOM 0 HA GLU A 11 -1.166 19.125 2.002 1.00 55.44 H new ATOM 0 HB2 GLU A 11 -2.030 21.106 3.151 1.00 52.22 H new ATOM 0 HB3 GLU A 11 -2.874 20.882 1.631 1.00 52.22 H new ATOM 0 HG2 GLU A 11 -4.813 19.934 2.802 1.00 44.41 H new ATOM 0 HG3 GLU A 11 -3.966 20.017 4.334 1.00 44.41 H new ATOM 178 N LEU A 12 -0.827 18.889 4.548 1.00 13.43 N ATOM 179 CA LEU A 12 -0.476 18.419 5.893 1.00 20.11 C ATOM 180 C LEU A 12 0.401 19.453 6.629 1.00 4.12 C ATOM 181 O LEU A 12 1.191 20.165 6.005 1.00 14.01 O ATOM 182 CB LEU A 12 0.213 17.035 5.823 1.00 20.33 C ATOM 183 CG LEU A 12 1.019 16.735 4.542 1.00 52.33 C ATOM 184 CD1 LEU A 12 2.184 17.704 4.369 1.00 21.00 C ATOM 185 CD2 LEU A 12 1.510 15.287 4.550 1.00 5.23 C ATOM 0 H LEU A 12 -0.174 19.571 4.163 1.00 13.43 H new ATOM 0 HA LEU A 12 -1.395 18.305 6.468 1.00 20.11 H new ATOM 0 HB2 LEU A 12 0.883 16.943 6.678 1.00 20.33 H new ATOM 0 HB3 LEU A 12 -0.552 16.266 5.933 1.00 20.33 H new ATOM 0 HG LEU A 12 0.354 16.873 3.689 1.00 52.33 H new ATOM 0 HD11 LEU A 12 2.727 17.460 3.456 1.00 21.00 H new ATOM 0 HD12 LEU A 12 1.803 18.723 4.304 1.00 21.00 H new ATOM 0 HD13 LEU A 12 2.856 17.622 5.224 1.00 21.00 H new ATOM 0 HD21 LEU A 12 2.077 15.090 3.640 1.00 5.23 H new ATOM 0 HD22 LEU A 12 2.149 15.124 5.418 1.00 5.23 H new ATOM 0 HD23 LEU A 12 0.655 14.613 4.598 1.00 5.23 H new ATOM 197 N PRO A 13 0.272 19.550 7.970 1.00 64.14 N ATOM 198 CA PRO A 13 0.971 20.580 8.770 1.00 2.32 C ATOM 199 C PRO A 13 2.500 20.393 8.838 1.00 22.44 C ATOM 200 O PRO A 13 3.227 21.320 9.203 1.00 41.22 O ATOM 201 CB PRO A 13 0.346 20.425 10.165 1.00 31.25 C ATOM 202 CG PRO A 13 -0.123 19.012 10.215 1.00 65.10 C ATOM 203 CD PRO A 13 -0.572 18.678 8.818 1.00 42.13 C ATOM 0 HA PRO A 13 0.850 21.569 8.327 1.00 2.32 H new ATOM 0 HB2 PRO A 13 1.074 20.628 10.950 1.00 31.25 H new ATOM 0 HB3 PRO A 13 -0.480 21.122 10.308 1.00 31.25 H new ATOM 0 HG2 PRO A 13 0.677 18.346 10.538 1.00 65.10 H new ATOM 0 HG3 PRO A 13 -0.941 18.897 10.926 1.00 65.10 H new ATOM 0 HD2 PRO A 13 -0.419 17.624 8.588 1.00 42.13 H new ATOM 0 HD3 PRO A 13 -1.633 18.885 8.676 1.00 42.13 H new ATOM 211 N PHE A 14 2.983 19.202 8.490 1.00 30.40 N ATOM 212 CA PHE A 14 4.423 18.901 8.534 1.00 25.15 C ATOM 213 C PHE A 14 5.039 18.830 7.123 1.00 23.41 C ATOM 214 O PHE A 14 4.665 17.988 6.309 1.00 31.31 O ATOM 215 CB PHE A 14 4.674 17.597 9.316 1.00 33.45 C ATOM 216 CG PHE A 14 3.713 16.471 8.996 1.00 21.51 C ATOM 217 CD1 PHE A 14 3.984 15.567 7.979 1.00 63.21 C ATOM 218 CD2 PHE A 14 2.535 16.320 9.719 1.00 50.42 C ATOM 219 CE1 PHE A 14 3.106 14.537 7.692 1.00 63.44 C ATOM 220 CE2 PHE A 14 1.653 15.293 9.433 1.00 12.23 C ATOM 221 CZ PHE A 14 1.939 14.401 8.419 1.00 33.32 C ATOM 0 H PHE A 14 2.402 18.425 8.173 1.00 30.40 H new ATOM 0 HA PHE A 14 4.918 19.720 9.056 1.00 25.15 H new ATOM 0 HB2 PHE A 14 5.690 17.258 9.113 1.00 33.45 H new ATOM 0 HB3 PHE A 14 4.617 17.813 10.383 1.00 33.45 H new ATOM 0 HD1 PHE A 14 4.892 15.669 7.404 1.00 63.21 H new ATOM 0 HD2 PHE A 14 2.305 17.014 10.514 1.00 50.42 H new ATOM 0 HE1 PHE A 14 3.333 13.839 6.900 1.00 63.44 H new ATOM 0 HE2 PHE A 14 0.741 15.189 10.003 1.00 12.23 H new ATOM 0 HZ PHE A 14 1.252 13.599 8.194 1.00 33.32 H new ATOM 231 N GLU A 15 5.995 19.720 6.847 1.00 75.34 N ATOM 232 CA GLU A 15 6.612 19.826 5.514 1.00 13.33 C ATOM 233 C GLU A 15 7.805 18.865 5.325 1.00 53.22 C ATOM 234 O GLU A 15 8.406 18.823 4.251 1.00 74.24 O ATOM 235 CB GLU A 15 7.069 21.272 5.266 1.00 44.50 C ATOM 236 CG GLU A 15 8.086 21.786 6.283 1.00 50.41 C ATOM 237 CD GLU A 15 8.638 23.155 5.927 1.00 54.21 C ATOM 238 OE1 GLU A 15 9.517 23.236 5.044 1.00 22.45 O ATOM 239 OE2 GLU A 15 8.199 24.160 6.523 1.00 52.01 O ATOM 0 H GLU A 15 6.363 20.383 7.530 1.00 75.34 H new ATOM 0 HA GLU A 15 5.851 19.538 4.788 1.00 13.33 H new ATOM 0 HB2 GLU A 15 7.503 21.339 4.268 1.00 44.50 H new ATOM 0 HB3 GLU A 15 6.196 21.925 5.279 1.00 44.50 H new ATOM 0 HG2 GLU A 15 7.617 21.833 7.266 1.00 50.41 H new ATOM 0 HG3 GLU A 15 8.910 21.076 6.356 1.00 50.41 H new ATOM 246 N ARG A 16 8.150 18.098 6.362 1.00 64.11 N ATOM 247 CA ARG A 16 9.301 17.176 6.301 1.00 60.25 C ATOM 248 C ARG A 16 8.956 15.815 6.932 1.00 55.50 C ATOM 249 O ARG A 16 8.468 15.757 8.062 1.00 32.41 O ATOM 250 CB ARG A 16 10.505 17.782 7.042 1.00 21.33 C ATOM 251 CG ARG A 16 10.920 19.167 6.552 1.00 15.23 C ATOM 252 CD ARG A 16 11.913 19.830 7.506 1.00 60.22 C ATOM 253 NE ARG A 16 12.155 21.231 7.160 1.00 43.22 N ATOM 254 CZ ARG A 16 11.914 22.237 7.959 1.00 61.03 C ATOM 255 NH1 ARG A 16 11.434 22.038 9.147 1.00 54.54 N ATOM 256 NH2 ARG A 16 12.158 23.446 7.565 1.00 40.13 N ATOM 0 H ARG A 16 7.655 18.092 7.254 1.00 64.11 H new ATOM 0 HA ARG A 16 9.550 17.025 5.251 1.00 60.25 H new ATOM 0 HB2 ARG A 16 10.268 17.842 8.104 1.00 21.33 H new ATOM 0 HB3 ARG A 16 11.354 17.106 6.942 1.00 21.33 H new ATOM 0 HG2 ARG A 16 11.367 19.084 5.561 1.00 15.23 H new ATOM 0 HG3 ARG A 16 10.036 19.797 6.451 1.00 15.23 H new ATOM 0 HD2 ARG A 16 11.532 19.769 8.525 1.00 60.22 H new ATOM 0 HD3 ARG A 16 12.856 19.283 7.485 1.00 60.22 H new ATOM 0 HE ARG A 16 12.536 21.436 6.236 1.00 43.22 H new ATOM 0 HH11 ARG A 16 11.241 21.089 9.467 1.00 54.54 H new ATOM 0 HH12 ARG A 16 11.250 22.831 9.762 1.00 54.54 H new ATOM 0 HH21 ARG A 16 12.537 23.612 6.633 1.00 40.13 H new ATOM 0 HH22 ARG A 16 11.971 24.233 8.187 1.00 40.13 H new ATOM 270 N VAL A 17 9.227 14.722 6.220 1.00 60.11 N ATOM 271 CA VAL A 17 8.978 13.375 6.755 1.00 0.23 C ATOM 272 C VAL A 17 10.159 12.425 6.501 1.00 33.52 C ATOM 273 O VAL A 17 10.795 12.467 5.451 1.00 53.31 O ATOM 274 CB VAL A 17 7.682 12.745 6.171 1.00 13.23 C ATOM 275 CG1 VAL A 17 6.445 13.508 6.639 1.00 51.03 C ATOM 276 CG2 VAL A 17 7.732 12.688 4.644 1.00 23.21 C ATOM 0 H VAL A 17 9.616 14.737 5.277 1.00 60.11 H new ATOM 0 HA VAL A 17 8.854 13.503 7.830 1.00 0.23 H new ATOM 0 HB VAL A 17 7.616 11.723 6.544 1.00 13.23 H new ATOM 0 HG11 VAL A 17 5.552 13.047 6.217 1.00 51.03 H new ATOM 0 HG12 VAL A 17 6.389 13.478 7.727 1.00 51.03 H new ATOM 0 HG13 VAL A 17 6.510 14.544 6.308 1.00 51.03 H new ATOM 0 HG21 VAL A 17 6.812 12.243 4.266 1.00 23.21 H new ATOM 0 HG22 VAL A 17 7.837 13.697 4.245 1.00 23.21 H new ATOM 0 HG23 VAL A 17 8.583 12.084 4.330 1.00 23.21 H new ATOM 286 N TYR A 18 10.450 11.576 7.484 1.00 43.24 N ATOM 287 CA TYR A 18 11.510 10.566 7.368 1.00 44.21 C ATOM 288 C TYR A 18 10.909 9.155 7.289 1.00 62.34 C ATOM 289 O TYR A 18 10.099 8.770 8.130 1.00 52.12 O ATOM 290 CB TYR A 18 12.468 10.670 8.565 1.00 72.32 C ATOM 291 CG TYR A 18 13.531 9.584 8.610 1.00 2.14 C ATOM 292 CD1 TYR A 18 14.411 9.399 7.549 1.00 1.02 C ATOM 293 CD2 TYR A 18 13.662 8.750 9.718 1.00 31.00 C ATOM 294 CE1 TYR A 18 15.383 8.419 7.590 1.00 54.54 C ATOM 295 CE2 TYR A 18 14.633 7.766 9.764 1.00 25.04 C ATOM 296 CZ TYR A 18 15.492 7.607 8.697 1.00 42.32 C ATOM 297 OH TYR A 18 16.472 6.637 8.740 1.00 52.51 O ATOM 0 H TYR A 18 9.963 11.565 8.380 1.00 43.24 H new ATOM 0 HA TYR A 18 12.067 10.752 6.450 1.00 44.21 H new ATOM 0 HB2 TYR A 18 12.959 11.643 8.539 1.00 72.32 H new ATOM 0 HB3 TYR A 18 11.886 10.631 9.486 1.00 72.32 H new ATOM 0 HD1 TYR A 18 14.333 10.033 6.678 1.00 1.02 H new ATOM 0 HD2 TYR A 18 12.993 8.874 10.557 1.00 31.00 H new ATOM 0 HE1 TYR A 18 16.056 8.290 6.756 1.00 54.54 H new ATOM 0 HE2 TYR A 18 14.718 7.126 10.630 1.00 25.04 H new ATOM 0 HH TYR A 18 16.415 6.151 9.589 1.00 52.51 H new ATOM 307 N ILE A 19 11.305 8.392 6.277 1.00 24.13 N ATOM 308 CA ILE A 19 10.785 7.033 6.082 1.00 14.23 C ATOM 309 C ILE A 19 11.850 5.972 6.402 1.00 74.35 C ATOM 310 O ILE A 19 13.038 6.171 6.145 1.00 60.13 O ATOM 311 CB ILE A 19 10.278 6.831 4.630 1.00 73.24 C ATOM 312 CG1 ILE A 19 9.652 5.434 4.461 1.00 52.44 C ATOM 313 CG2 ILE A 19 11.410 7.046 3.627 1.00 50.24 C ATOM 314 CD1 ILE A 19 9.136 5.155 3.063 1.00 35.42 C ATOM 0 H ILE A 19 11.985 8.686 5.576 1.00 24.13 H new ATOM 0 HA ILE A 19 9.950 6.911 6.772 1.00 14.23 H new ATOM 0 HB ILE A 19 9.505 7.574 4.432 1.00 73.24 H new ATOM 0 HG12 ILE A 19 10.395 4.680 4.720 1.00 52.44 H new ATOM 0 HG13 ILE A 19 8.830 5.327 5.169 1.00 52.44 H new ATOM 0 HG21 ILE A 19 11.032 6.899 2.615 1.00 50.24 H new ATOM 0 HG22 ILE A 19 11.797 8.060 3.727 1.00 50.24 H new ATOM 0 HG23 ILE A 19 12.210 6.332 3.823 1.00 50.24 H new ATOM 0 HD11 ILE A 19 8.711 4.152 3.026 1.00 35.42 H new ATOM 0 HD12 ILE A 19 8.368 5.885 2.806 1.00 35.42 H new ATOM 0 HD13 ILE A 19 9.958 5.227 2.351 1.00 35.42 H new ATOM 326 N THR A 20 11.419 4.851 6.975 1.00 11.14 N ATOM 327 CA THR A 20 12.326 3.731 7.269 1.00 45.11 C ATOM 328 C THR A 20 11.624 2.380 7.074 1.00 0.34 C ATOM 329 O THR A 20 10.410 2.267 7.252 1.00 61.15 O ATOM 330 CB THR A 20 12.898 3.812 8.709 1.00 3.42 C ATOM 331 OG1 THR A 20 13.810 2.726 8.946 1.00 21.44 O ATOM 332 CG2 THR A 20 11.783 3.785 9.752 1.00 1.14 C ATOM 0 H THR A 20 10.449 4.689 7.247 1.00 11.14 H new ATOM 0 HA THR A 20 13.153 3.809 6.564 1.00 45.11 H new ATOM 0 HB THR A 20 13.431 4.758 8.801 1.00 3.42 H new ATOM 0 HG1 THR A 20 14.165 2.790 9.857 1.00 21.44 H new ATOM 0 HG21 THR A 20 12.217 3.843 10.750 1.00 1.14 H new ATOM 0 HG22 THR A 20 11.118 4.634 9.595 1.00 1.14 H new ATOM 0 HG23 THR A 20 11.217 2.858 9.656 1.00 1.14 H new ATOM 340 N ALA A 21 12.392 1.357 6.700 1.00 14.42 N ATOM 341 CA ALA A 21 11.845 0.021 6.441 1.00 45.01 C ATOM 342 C ALA A 21 12.839 -1.078 6.857 1.00 33.23 C ATOM 343 O ALA A 21 14.025 -0.993 6.545 1.00 51.11 O ATOM 344 CB ALA A 21 11.487 -0.118 4.962 1.00 2.41 C ATOM 0 H ALA A 21 13.401 1.427 6.568 1.00 14.42 H new ATOM 0 HA ALA A 21 10.943 -0.101 7.040 1.00 45.01 H new ATOM 0 HB1 ALA A 21 11.081 -1.113 4.778 1.00 2.41 H new ATOM 0 HB2 ALA A 21 10.743 0.632 4.696 1.00 2.41 H new ATOM 0 HB3 ALA A 21 12.381 0.027 4.356 1.00 2.41 H new ATOM 350 N PRO A 22 12.359 -2.144 7.532 1.00 63.01 N ATOM 351 CA PRO A 22 13.224 -3.222 8.067 1.00 70.44 C ATOM 352 C PRO A 22 13.719 -4.221 6.997 1.00 34.41 C ATOM 353 O PRO A 22 13.855 -5.417 7.274 1.00 21.40 O ATOM 354 CB PRO A 22 12.292 -3.927 9.061 1.00 40.33 C ATOM 355 CG PRO A 22 10.937 -3.762 8.464 1.00 34.33 C ATOM 356 CD PRO A 22 10.932 -2.395 7.832 1.00 53.00 C ATOM 0 HA PRO A 22 14.143 -2.822 8.495 1.00 70.44 H new ATOM 0 HB2 PRO A 22 12.553 -4.979 9.175 1.00 40.33 H new ATOM 0 HB3 PRO A 22 12.350 -3.475 10.051 1.00 40.33 H new ATOM 0 HG2 PRO A 22 10.739 -4.536 7.723 1.00 34.33 H new ATOM 0 HG3 PRO A 22 10.161 -3.844 9.225 1.00 34.33 H new ATOM 0 HD2 PRO A 22 10.323 -2.373 6.928 1.00 53.00 H new ATOM 0 HD3 PRO A 22 10.526 -1.642 8.508 1.00 53.00 H new ATOM 364 N ALA A 23 14.018 -3.716 5.795 1.00 34.23 N ATOM 365 CA ALA A 23 14.451 -4.558 4.661 1.00 74.45 C ATOM 366 C ALA A 23 14.585 -3.743 3.363 1.00 4.25 C ATOM 367 O ALA A 23 15.362 -4.093 2.473 1.00 5.04 O ATOM 368 CB ALA A 23 13.470 -5.710 4.434 1.00 21.24 C ATOM 0 H ALA A 23 13.969 -2.721 5.576 1.00 34.23 H new ATOM 0 HA ALA A 23 15.431 -4.959 4.921 1.00 74.45 H new ATOM 0 HB1 ALA A 23 13.809 -6.317 3.594 1.00 21.24 H new ATOM 0 HB2 ALA A 23 13.420 -6.327 5.331 1.00 21.24 H new ATOM 0 HB3 ALA A 23 12.481 -5.308 4.215 1.00 21.24 H new ATOM 374 N GLY A 24 13.824 -2.654 3.268 1.00 13.44 N ATOM 375 CA GLY A 24 13.769 -1.870 2.035 1.00 52.11 C ATOM 376 C GLY A 24 12.680 -2.371 1.095 1.00 71.40 C ATOM 377 O GLY A 24 12.951 -2.810 -0.022 1.00 41.12 O ATOM 0 H GLY A 24 13.241 -2.296 4.024 1.00 13.44 H new ATOM 0 HA2 GLY A 24 13.587 -0.823 2.278 1.00 52.11 H new ATOM 0 HA3 GLY A 24 14.734 -1.917 1.531 1.00 52.11 H new ATOM 381 N LEU A 25 11.438 -2.293 1.558 1.00 64.41 N ATOM 382 CA LEU A 25 10.296 -2.883 0.856 1.00 53.40 C ATOM 383 C LEU A 25 9.766 -1.969 -0.267 1.00 53.31 C ATOM 384 O LEU A 25 9.862 -0.744 -0.186 1.00 62.34 O ATOM 385 CB LEU A 25 9.191 -3.183 1.878 1.00 13.34 C ATOM 386 CG LEU A 25 9.632 -4.065 3.065 1.00 74.13 C ATOM 387 CD1 LEU A 25 8.544 -4.137 4.132 1.00 33.14 C ATOM 388 CD2 LEU A 25 10.013 -5.464 2.585 1.00 2.40 C ATOM 0 H LEU A 25 11.191 -1.821 2.428 1.00 64.41 H new ATOM 0 HA LEU A 25 10.623 -3.805 0.376 1.00 53.40 H new ATOM 0 HB2 LEU A 25 8.809 -2.239 2.267 1.00 13.34 H new ATOM 0 HB3 LEU A 25 8.364 -3.675 1.365 1.00 13.34 H new ATOM 0 HG LEU A 25 10.512 -3.605 3.516 1.00 74.13 H new ATOM 0 HD11 LEU A 25 8.883 -4.765 4.956 1.00 33.14 H new ATOM 0 HD12 LEU A 25 8.332 -3.134 4.504 1.00 33.14 H new ATOM 0 HD13 LEU A 25 7.638 -4.563 3.700 1.00 33.14 H new ATOM 0 HD21 LEU A 25 10.321 -6.070 3.437 1.00 2.40 H new ATOM 0 HD22 LEU A 25 9.154 -5.929 2.101 1.00 2.40 H new ATOM 0 HD23 LEU A 25 10.836 -5.393 1.874 1.00 2.40 H new ATOM 400 N THR A 26 9.193 -2.589 -1.301 1.00 25.22 N ATOM 401 CA THR A 26 8.653 -1.873 -2.475 1.00 2.32 C ATOM 402 C THR A 26 7.715 -0.726 -2.086 1.00 44.11 C ATOM 403 O THR A 26 7.817 0.375 -2.623 1.00 5.11 O ATOM 404 CB THR A 26 7.874 -2.832 -3.404 1.00 61.35 C ATOM 405 OG1 THR A 26 6.808 -3.458 -2.672 1.00 23.45 O ATOM 406 CG2 THR A 26 8.790 -3.903 -3.987 1.00 54.24 C ATOM 0 H THR A 26 9.087 -3.602 -1.355 1.00 25.22 H new ATOM 0 HA THR A 26 9.520 -1.462 -2.992 1.00 2.32 H new ATOM 0 HB THR A 26 7.464 -2.247 -4.227 1.00 61.35 H new ATOM 0 HG1 THR A 26 6.316 -4.064 -3.265 1.00 23.45 H new ATOM 0 HG21 THR A 26 8.213 -4.562 -4.636 1.00 54.24 H new ATOM 0 HG22 THR A 26 9.583 -3.428 -4.565 1.00 54.24 H new ATOM 0 HG23 THR A 26 9.230 -4.486 -3.178 1.00 54.24 H new ATOM 414 N ILE A 27 6.801 -1.001 -1.154 1.00 13.14 N ATOM 415 CA ILE A 27 5.846 0.005 -0.661 1.00 30.20 C ATOM 416 C ILE A 27 6.544 1.328 -0.287 1.00 43.51 C ATOM 417 O ILE A 27 5.970 2.406 -0.431 1.00 72.52 O ATOM 418 CB ILE A 27 5.061 -0.532 0.569 1.00 11.43 C ATOM 419 CG1 ILE A 27 3.975 0.469 1.011 1.00 12.23 C ATOM 420 CG2 ILE A 27 6.014 -0.848 1.722 1.00 60.43 C ATOM 421 CD1 ILE A 27 2.911 0.725 -0.041 1.00 44.53 C ATOM 0 H ILE A 27 6.698 -1.918 -0.720 1.00 13.14 H new ATOM 0 HA ILE A 27 5.150 0.204 -1.476 1.00 30.20 H new ATOM 0 HB ILE A 27 4.564 -1.457 0.276 1.00 11.43 H new ATOM 0 HG12 ILE A 27 3.495 0.094 1.915 1.00 12.23 H new ATOM 0 HG13 ILE A 27 4.450 1.415 1.271 1.00 12.23 H new ATOM 0 HG21 ILE A 27 5.444 -1.222 2.573 1.00 60.43 H new ATOM 0 HG22 ILE A 27 6.731 -1.605 1.404 1.00 60.43 H new ATOM 0 HG23 ILE A 27 6.547 0.058 2.012 1.00 60.43 H new ATOM 0 HD11 ILE A 27 2.183 1.439 0.344 1.00 44.53 H new ATOM 0 HD12 ILE A 27 3.377 1.130 -0.939 1.00 44.53 H new ATOM 0 HD13 ILE A 27 2.408 -0.211 -0.284 1.00 44.53 H new ATOM 433 N GLY A 28 7.789 1.235 0.179 1.00 74.54 N ATOM 434 CA GLY A 28 8.560 2.428 0.504 1.00 11.31 C ATOM 435 C GLY A 28 8.842 3.297 -0.719 1.00 74.03 C ATOM 436 O GLY A 28 8.740 4.523 -0.656 1.00 45.23 O ATOM 0 H GLY A 28 8.279 0.354 0.338 1.00 74.54 H new ATOM 0 HA2 GLY A 28 8.018 3.015 1.245 1.00 11.31 H new ATOM 0 HA3 GLY A 28 9.505 2.132 0.960 1.00 11.31 H new ATOM 440 N SER A 29 9.181 2.654 -1.837 1.00 64.34 N ATOM 441 CA SER A 29 9.435 3.358 -3.102 1.00 22.45 C ATOM 442 C SER A 29 8.176 4.098 -3.580 1.00 61.34 C ATOM 443 O SER A 29 8.204 5.310 -3.809 1.00 24.01 O ATOM 444 CB SER A 29 9.903 2.363 -4.177 1.00 1.15 C ATOM 445 OG SER A 29 10.203 3.017 -5.402 1.00 0.53 O ATOM 0 H SER A 29 9.287 1.641 -1.896 1.00 64.34 H new ATOM 0 HA SER A 29 10.221 4.094 -2.931 1.00 22.45 H new ATOM 0 HB2 SER A 29 10.786 1.832 -3.822 1.00 1.15 H new ATOM 0 HB3 SER A 29 9.127 1.616 -4.344 1.00 1.15 H new ATOM 0 HG SER A 29 10.499 2.356 -6.062 1.00 0.53 H new ATOM 451 N ASP A 30 7.074 3.359 -3.717 1.00 1.23 N ATOM 452 CA ASP A 30 5.772 3.940 -4.071 1.00 72.11 C ATOM 453 C ASP A 30 5.389 5.089 -3.118 1.00 35.12 C ATOM 454 O ASP A 30 4.961 6.163 -3.554 1.00 65.05 O ATOM 455 CB ASP A 30 4.685 2.852 -4.025 1.00 14.53 C ATOM 456 CG ASP A 30 4.871 1.768 -5.076 1.00 30.13 C ATOM 457 OD1 ASP A 30 6.015 1.297 -5.264 1.00 12.12 O ATOM 458 OD2 ASP A 30 3.867 1.366 -5.706 1.00 10.54 O ATOM 0 H ASP A 30 7.055 2.347 -3.587 1.00 1.23 H new ATOM 0 HA ASP A 30 5.850 4.345 -5.080 1.00 72.11 H new ATOM 0 HB2 ASP A 30 4.683 2.393 -3.036 1.00 14.53 H new ATOM 0 HB3 ASP A 30 3.709 3.318 -4.163 1.00 14.53 H new ATOM 463 N LEU A 31 5.561 4.856 -1.815 1.00 63.13 N ATOM 464 CA LEU A 31 5.189 5.834 -0.784 1.00 43.54 C ATOM 465 C LEU A 31 5.938 7.166 -0.959 1.00 4.04 C ATOM 466 O LEU A 31 5.314 8.226 -1.037 1.00 1.13 O ATOM 467 CB LEU A 31 5.457 5.257 0.614 1.00 74.33 C ATOM 468 CG LEU A 31 4.977 6.121 1.795 1.00 33.21 C ATOM 469 CD1 LEU A 31 3.471 6.361 1.721 1.00 14.35 C ATOM 470 CD2 LEU A 31 5.350 5.470 3.125 1.00 2.14 C ATOM 0 H LEU A 31 5.958 3.993 -1.445 1.00 63.13 H new ATOM 0 HA LEU A 31 4.124 6.038 -0.894 1.00 43.54 H new ATOM 0 HB2 LEU A 31 4.977 4.281 0.683 1.00 74.33 H new ATOM 0 HB3 LEU A 31 6.529 5.093 0.720 1.00 74.33 H new ATOM 0 HG LEU A 31 5.478 7.087 1.730 1.00 33.21 H new ATOM 0 HD11 LEU A 31 3.158 6.974 2.567 1.00 14.35 H new ATOM 0 HD12 LEU A 31 3.230 6.876 0.791 1.00 14.35 H new ATOM 0 HD13 LEU A 31 2.948 5.405 1.753 1.00 14.35 H new ATOM 0 HD21 LEU A 31 5.002 6.096 3.947 1.00 2.14 H new ATOM 0 HD22 LEU A 31 4.882 4.488 3.193 1.00 2.14 H new ATOM 0 HD23 LEU A 31 6.433 5.361 3.186 1.00 2.14 H new ATOM 482 N GLU A 32 7.271 7.110 -1.029 1.00 5.41 N ATOM 483 CA GLU A 32 8.091 8.324 -1.195 1.00 42.44 C ATOM 484 C GLU A 32 7.624 9.163 -2.393 1.00 43.43 C ATOM 485 O GLU A 32 7.551 10.394 -2.315 1.00 4.33 O ATOM 486 CB GLU A 32 9.574 7.957 -1.358 1.00 12.41 C ATOM 487 CG GLU A 32 10.195 7.348 -0.106 1.00 2.13 C ATOM 488 CD GLU A 32 11.666 7.003 -0.282 1.00 11.10 C ATOM 489 OE1 GLU A 32 12.515 7.919 -0.203 1.00 45.44 O ATOM 490 OE2 GLU A 32 11.981 5.814 -0.500 1.00 45.42 O ATOM 0 H GLU A 32 7.808 6.244 -0.974 1.00 5.41 H new ATOM 0 HA GLU A 32 7.969 8.925 -0.294 1.00 42.44 H new ATOM 0 HB2 GLU A 32 9.676 7.252 -2.183 1.00 12.41 H new ATOM 0 HB3 GLU A 32 10.133 8.852 -1.632 1.00 12.41 H new ATOM 0 HG2 GLU A 32 10.088 8.047 0.723 1.00 2.13 H new ATOM 0 HG3 GLU A 32 9.645 6.446 0.164 1.00 2.13 H new ATOM 497 N ARG A 33 7.301 8.486 -3.494 1.00 32.13 N ATOM 498 CA ARG A 33 6.792 9.157 -4.695 1.00 71.32 C ATOM 499 C ARG A 33 5.483 9.894 -4.399 1.00 2.34 C ATOM 500 O ARG A 33 5.376 11.103 -4.596 1.00 54.42 O ATOM 501 CB ARG A 33 6.549 8.140 -5.818 1.00 52.33 C ATOM 502 CG ARG A 33 7.768 7.306 -6.173 1.00 55.43 C ATOM 503 CD ARG A 33 7.445 6.262 -7.234 1.00 34.10 C ATOM 504 NE ARG A 33 8.581 5.380 -7.474 1.00 2.53 N ATOM 505 CZ ARG A 33 8.522 4.260 -8.138 1.00 65.12 C ATOM 506 NH1 ARG A 33 7.424 3.884 -8.715 1.00 31.52 N ATOM 507 NH2 ARG A 33 9.575 3.520 -8.237 1.00 13.34 N ATOM 0 H ARG A 33 7.382 7.473 -3.582 1.00 32.13 H new ATOM 0 HA ARG A 33 7.545 9.879 -5.012 1.00 71.32 H new ATOM 0 HB2 ARG A 33 5.740 7.473 -5.521 1.00 52.33 H new ATOM 0 HB3 ARG A 33 6.214 8.671 -6.709 1.00 52.33 H new ATOM 0 HG2 ARG A 33 8.563 7.958 -6.534 1.00 55.43 H new ATOM 0 HG3 ARG A 33 8.144 6.811 -5.278 1.00 55.43 H new ATOM 0 HD2 ARG A 33 6.585 5.672 -6.917 1.00 34.10 H new ATOM 0 HD3 ARG A 33 7.165 6.759 -8.163 1.00 34.10 H new ATOM 0 HE ARG A 33 9.486 5.659 -7.095 1.00 2.53 H new ATOM 0 HH11 ARG A 33 6.590 4.468 -8.653 1.00 31.52 H new ATOM 0 HH12 ARG A 33 7.394 3.005 -9.231 1.00 31.52 H new ATOM 0 HH21 ARG A 33 10.447 3.813 -7.797 1.00 13.34 H new ATOM 0 HH22 ARG A 33 9.535 2.642 -8.755 1.00 13.34 H new ATOM 521 N VAL A 34 4.494 9.148 -3.913 1.00 5.13 N ATOM 522 CA VAL A 34 3.163 9.694 -3.641 1.00 43.23 C ATOM 523 C VAL A 34 3.206 10.882 -2.665 1.00 23.51 C ATOM 524 O VAL A 34 2.582 11.912 -2.913 1.00 1.51 O ATOM 525 CB VAL A 34 2.218 8.597 -3.094 1.00 73.54 C ATOM 526 CG1 VAL A 34 0.872 9.184 -2.675 1.00 22.44 C ATOM 527 CG2 VAL A 34 2.025 7.499 -4.140 1.00 71.20 C ATOM 0 H VAL A 34 4.589 8.156 -3.697 1.00 5.13 H new ATOM 0 HA VAL A 34 2.776 10.061 -4.592 1.00 43.23 H new ATOM 0 HB VAL A 34 2.679 8.162 -2.208 1.00 73.54 H new ATOM 0 HG11 VAL A 34 0.231 8.389 -2.295 1.00 22.44 H new ATOM 0 HG12 VAL A 34 1.027 9.929 -1.895 1.00 22.44 H new ATOM 0 HG13 VAL A 34 0.396 9.654 -3.536 1.00 22.44 H new ATOM 0 HG21 VAL A 34 1.358 6.733 -3.744 1.00 71.20 H new ATOM 0 HG22 VAL A 34 1.589 7.928 -5.042 1.00 71.20 H new ATOM 0 HG23 VAL A 34 2.990 7.052 -4.380 1.00 71.20 H new ATOM 537 N ILE A 35 3.943 10.741 -1.569 1.00 64.42 N ATOM 538 CA ILE A 35 4.084 11.830 -0.594 1.00 10.21 C ATOM 539 C ILE A 35 4.618 13.112 -1.259 1.00 32.33 C ATOM 540 O ILE A 35 3.963 14.153 -1.233 1.00 23.40 O ATOM 541 CB ILE A 35 5.023 11.431 0.577 1.00 42.52 C ATOM 542 CG1 ILE A 35 4.463 10.212 1.332 1.00 23.33 C ATOM 543 CG2 ILE A 35 5.226 12.608 1.531 1.00 34.11 C ATOM 544 CD1 ILE A 35 5.334 9.751 2.489 1.00 72.33 C ATOM 0 H ILE A 35 4.452 9.890 -1.329 1.00 64.42 H new ATOM 0 HA ILE A 35 3.088 12.023 -0.196 1.00 10.21 H new ATOM 0 HB ILE A 35 5.992 11.158 0.159 1.00 42.52 H new ATOM 0 HG12 ILE A 35 3.471 10.456 1.712 1.00 23.33 H new ATOM 0 HG13 ILE A 35 4.341 9.387 0.630 1.00 23.33 H new ATOM 0 HG21 ILE A 35 5.887 12.307 2.344 1.00 34.11 H new ATOM 0 HG22 ILE A 35 5.673 13.442 0.990 1.00 34.11 H new ATOM 0 HG23 ILE A 35 4.263 12.915 1.940 1.00 34.11 H new ATOM 0 HD11 ILE A 35 4.873 8.889 2.971 1.00 72.33 H new ATOM 0 HD12 ILE A 35 6.319 9.473 2.115 1.00 72.33 H new ATOM 0 HD13 ILE A 35 5.435 10.560 3.213 1.00 72.33 H new ATOM 556 N SER A 36 5.787 13.016 -1.887 1.00 73.20 N ATOM 557 CA SER A 36 6.440 14.186 -2.496 1.00 2.15 C ATOM 558 C SER A 36 5.636 14.766 -3.676 1.00 72.40 C ATOM 559 O SER A 36 5.764 15.949 -3.997 1.00 62.44 O ATOM 560 CB SER A 36 7.856 13.818 -2.972 1.00 2.53 C ATOM 561 OG SER A 36 8.531 14.935 -3.540 1.00 43.41 O ATOM 0 H SER A 36 6.306 12.144 -1.991 1.00 73.20 H new ATOM 0 HA SER A 36 6.493 14.954 -1.724 1.00 2.15 H new ATOM 0 HB2 SER A 36 8.433 13.434 -2.131 1.00 2.53 H new ATOM 0 HB3 SER A 36 7.795 13.017 -3.709 1.00 2.53 H new ATOM 0 HG SER A 36 9.427 14.663 -3.829 1.00 43.41 H new ATOM 567 N THR A 37 4.818 13.937 -4.330 1.00 35.13 N ATOM 568 CA THR A 37 4.055 14.381 -5.514 1.00 33.11 C ATOM 569 C THR A 37 2.587 14.702 -5.197 1.00 15.32 C ATOM 570 O THR A 37 1.881 15.272 -6.030 1.00 73.21 O ATOM 571 CB THR A 37 4.092 13.324 -6.646 1.00 50.54 C ATOM 572 OG1 THR A 37 3.500 12.095 -6.199 1.00 52.22 O ATOM 573 CG2 THR A 37 5.525 13.058 -7.110 1.00 13.54 C ATOM 0 H THR A 37 4.663 12.963 -4.068 1.00 35.13 H new ATOM 0 HA THR A 37 4.547 15.297 -5.842 1.00 33.11 H new ATOM 0 HB THR A 37 3.522 13.720 -7.487 1.00 50.54 H new ATOM 0 HG1 THR A 37 4.195 11.515 -5.823 1.00 52.22 H new ATOM 0 HG21 THR A 37 5.518 12.312 -7.905 1.00 13.54 H new ATOM 0 HG22 THR A 37 5.964 13.983 -7.485 1.00 13.54 H new ATOM 0 HG23 THR A 37 6.116 12.689 -6.272 1.00 13.54 H new ATOM 581 N HIS A 38 2.114 14.330 -4.007 1.00 33.04 N ATOM 582 CA HIS A 38 0.715 14.590 -3.620 1.00 14.52 C ATOM 583 C HIS A 38 0.599 15.521 -2.400 1.00 32.13 C ATOM 584 O HIS A 38 -0.476 16.062 -2.140 1.00 43.43 O ATOM 585 CB HIS A 38 -0.034 13.272 -3.349 1.00 50.25 C ATOM 586 CG HIS A 38 -0.236 12.422 -4.571 1.00 30.42 C ATOM 587 ND1 HIS A 38 0.657 11.813 -5.385 1.00 4.10 N flip ATOM 588 CD2 HIS A 38 -1.481 12.100 -5.076 1.00 35.51 C flip ATOM 589 CE1 HIS A 38 -0.055 11.148 -6.349 1.00 2.22 C flip ATOM 590 NE2 HIS A 38 -1.340 11.337 -6.141 1.00 62.24 N flip ATOM 0 H HIS A 38 2.668 13.852 -3.296 1.00 33.04 H new ATOM 0 HA HIS A 38 0.252 15.101 -4.464 1.00 14.52 H new ATOM 0 HB2 HIS A 38 0.520 12.697 -2.607 1.00 50.25 H new ATOM 0 HB3 HIS A 38 -1.007 13.502 -2.914 1.00 50.25 H new ATOM 0 HD1 HIS A 38 1.673 11.843 -5.297 1.00 4.10 H new ATOM 0 HD2 HIS A 38 -2.424 12.424 -4.662 1.00 35.51 H new ATOM 0 HE1 HIS A 38 0.371 10.563 -7.151 1.00 2.22 H new ATOM 599 N THR A 39 1.691 15.707 -1.656 1.00 71.34 N ATOM 600 CA THR A 39 1.686 16.601 -0.480 1.00 54.45 C ATOM 601 C THR A 39 2.971 17.436 -0.386 1.00 22.21 C ATOM 602 O THR A 39 3.938 17.199 -1.106 1.00 21.40 O ATOM 603 CB THR A 39 1.515 15.829 0.856 1.00 30.15 C ATOM 604 OG1 THR A 39 2.592 14.900 1.049 1.00 61.54 O ATOM 605 CG2 THR A 39 0.184 15.090 0.908 1.00 61.51 C ATOM 0 H THR A 39 2.588 15.257 -1.839 1.00 71.34 H new ATOM 0 HA THR A 39 0.828 17.257 -0.628 1.00 54.45 H new ATOM 0 HB THR A 39 1.530 16.566 1.659 1.00 30.15 H new ATOM 0 HG1 THR A 39 3.020 14.712 0.188 1.00 61.54 H new ATOM 0 HG21 THR A 39 0.098 14.561 1.857 1.00 61.51 H new ATOM 0 HG22 THR A 39 -0.633 15.805 0.817 1.00 61.51 H new ATOM 0 HG23 THR A 39 0.133 14.374 0.088 1.00 61.51 H new ATOM 613 N ARG A 40 2.964 18.416 0.513 1.00 72.03 N ATOM 614 CA ARG A 40 4.124 19.291 0.738 1.00 30.43 C ATOM 615 C ARG A 40 5.258 18.570 1.493 1.00 10.32 C ATOM 616 O ARG A 40 6.406 19.024 1.485 1.00 33.41 O ATOM 617 CB ARG A 40 3.675 20.539 1.522 1.00 45.24 C ATOM 618 CG ARG A 40 4.780 21.560 1.815 1.00 10.14 C ATOM 619 CD ARG A 40 5.359 22.181 0.542 1.00 52.05 C ATOM 620 NE ARG A 40 6.203 21.250 -0.208 1.00 41.33 N ATOM 621 CZ ARG A 40 6.337 21.257 -1.509 1.00 22.01 C ATOM 622 NH1 ARG A 40 5.665 22.085 -2.245 1.00 62.41 N ATOM 623 NH2 ARG A 40 7.138 20.423 -2.080 1.00 41.23 N ATOM 0 H ARG A 40 2.162 18.630 1.106 1.00 72.03 H new ATOM 0 HA ARG A 40 4.520 19.582 -0.235 1.00 30.43 H new ATOM 0 HB2 ARG A 40 2.884 21.036 0.960 1.00 45.24 H new ATOM 0 HB3 ARG A 40 3.240 20.217 2.468 1.00 45.24 H new ATOM 0 HG2 ARG A 40 4.381 22.350 2.451 1.00 10.14 H new ATOM 0 HG3 ARG A 40 5.580 21.074 2.374 1.00 10.14 H new ATOM 0 HD2 ARG A 40 4.543 22.519 -0.096 1.00 52.05 H new ATOM 0 HD3 ARG A 40 5.943 23.062 0.806 1.00 52.05 H new ATOM 0 HE ARG A 40 6.722 20.548 0.320 1.00 41.33 H new ATOM 0 HH11 ARG A 40 5.019 22.745 -1.811 1.00 62.41 H new ATOM 0 HH12 ARG A 40 5.782 22.077 -3.258 1.00 62.41 H new ATOM 0 HH21 ARG A 40 7.667 19.757 -1.517 1.00 41.23 H new ATOM 0 HH22 ARG A 40 7.242 20.429 -3.095 1.00 41.23 H new ATOM 637 N ALA A 41 4.935 17.451 2.138 1.00 75.55 N ATOM 638 CA ALA A 41 5.909 16.706 2.943 1.00 51.54 C ATOM 639 C ALA A 41 7.086 16.176 2.100 1.00 12.02 C ATOM 640 O ALA A 41 6.926 15.266 1.284 1.00 1.10 O ATOM 641 CB ALA A 41 5.217 15.560 3.673 1.00 3.32 C ATOM 0 H ALA A 41 4.003 17.036 2.120 1.00 75.55 H new ATOM 0 HA ALA A 41 6.328 17.400 3.672 1.00 51.54 H new ATOM 0 HB1 ALA A 41 5.949 15.013 4.268 1.00 3.32 H new ATOM 0 HB2 ALA A 41 4.443 15.960 4.328 1.00 3.32 H new ATOM 0 HB3 ALA A 41 4.764 14.886 2.946 1.00 3.32 H new ATOM 647 N LYS A 42 8.266 16.760 2.302 1.00 33.43 N ATOM 648 CA LYS A 42 9.485 16.312 1.620 1.00 1.35 C ATOM 649 C LYS A 42 10.107 15.125 2.375 1.00 44.23 C ATOM 650 O LYS A 42 10.409 15.225 3.568 1.00 40.24 O ATOM 651 CB LYS A 42 10.490 17.479 1.519 1.00 42.40 C ATOM 652 CG LYS A 42 11.588 17.303 0.458 1.00 73.43 C ATOM 653 CD LYS A 42 12.627 16.242 0.833 1.00 30.14 C ATOM 654 CE LYS A 42 13.689 16.082 -0.248 1.00 63.20 C ATOM 655 NZ LYS A 42 14.651 14.991 0.073 1.00 25.40 N ATOM 0 H LYS A 42 8.407 17.548 2.934 1.00 33.43 H new ATOM 0 HA LYS A 42 9.231 15.984 0.612 1.00 1.35 H new ATOM 0 HB2 LYS A 42 9.940 18.394 1.302 1.00 42.40 H new ATOM 0 HB3 LYS A 42 10.964 17.615 2.491 1.00 42.40 H new ATOM 0 HG2 LYS A 42 11.126 17.030 -0.491 1.00 73.43 H new ATOM 0 HG3 LYS A 42 12.092 18.257 0.305 1.00 73.43 H new ATOM 0 HD2 LYS A 42 13.104 16.517 1.773 1.00 30.14 H new ATOM 0 HD3 LYS A 42 12.128 15.287 0.996 1.00 30.14 H new ATOM 0 HE2 LYS A 42 13.206 15.871 -1.202 1.00 63.20 H new ATOM 0 HE3 LYS A 42 14.231 17.020 -0.366 1.00 63.20 H new ATOM 0 HZ1 LYS A 42 14.928 14.503 -0.803 1.00 25.40 H new ATOM 0 HZ2 LYS A 42 15.496 15.395 0.526 1.00 25.40 H new ATOM 0 HZ3 LYS A 42 14.202 14.312 0.720 1.00 25.40 H new ATOM 669 N VAL A 43 10.290 14.005 1.677 1.00 63.14 N ATOM 670 CA VAL A 43 10.886 12.807 2.278 1.00 12.34 C ATOM 671 C VAL A 43 12.415 12.935 2.389 1.00 1.55 C ATOM 672 O VAL A 43 13.109 13.140 1.388 1.00 64.43 O ATOM 673 CB VAL A 43 10.540 11.530 1.469 1.00 3.04 C ATOM 674 CG1 VAL A 43 11.110 10.287 2.151 1.00 64.42 C ATOM 675 CG2 VAL A 43 9.029 11.400 1.277 1.00 34.04 C ATOM 0 H VAL A 43 10.035 13.900 0.695 1.00 63.14 H new ATOM 0 HA VAL A 43 10.462 12.718 3.278 1.00 12.34 H new ATOM 0 HB VAL A 43 10.999 11.618 0.484 1.00 3.04 H new ATOM 0 HG11 VAL A 43 10.856 9.403 1.567 1.00 64.42 H new ATOM 0 HG12 VAL A 43 12.194 10.376 2.222 1.00 64.42 H new ATOM 0 HG13 VAL A 43 10.687 10.195 3.152 1.00 64.42 H new ATOM 0 HG21 VAL A 43 8.811 10.497 0.707 1.00 34.04 H new ATOM 0 HG22 VAL A 43 8.542 11.341 2.251 1.00 34.04 H new ATOM 0 HG23 VAL A 43 8.655 12.269 0.737 1.00 34.04 H new ATOM 685 N VAL A 44 12.931 12.823 3.611 1.00 62.42 N ATOM 686 CA VAL A 44 14.373 12.918 3.863 1.00 43.12 C ATOM 687 C VAL A 44 14.984 11.553 4.216 1.00 13.23 C ATOM 688 O VAL A 44 14.278 10.623 4.609 1.00 12.32 O ATOM 689 CB VAL A 44 14.681 13.923 5.001 1.00 54.32 C ATOM 690 CG1 VAL A 44 14.298 15.341 4.590 1.00 44.31 C ATOM 691 CG2 VAL A 44 13.966 13.519 6.288 1.00 55.12 C ATOM 0 H VAL A 44 12.371 12.665 4.449 1.00 62.42 H new ATOM 0 HA VAL A 44 14.825 13.274 2.937 1.00 43.12 H new ATOM 0 HB VAL A 44 15.754 13.904 5.189 1.00 54.32 H new ATOM 0 HG11 VAL A 44 14.523 16.029 5.405 1.00 44.31 H new ATOM 0 HG12 VAL A 44 14.865 15.629 3.705 1.00 44.31 H new ATOM 0 HG13 VAL A 44 13.232 15.380 4.367 1.00 44.31 H new ATOM 0 HG21 VAL A 44 14.197 14.239 7.074 1.00 55.12 H new ATOM 0 HG22 VAL A 44 12.890 13.502 6.116 1.00 55.12 H new ATOM 0 HG23 VAL A 44 14.301 12.528 6.594 1.00 55.12 H new ATOM 701 N ASN A 45 16.306 11.443 4.075 1.00 71.54 N ATOM 702 CA ASN A 45 17.019 10.193 4.372 1.00 13.11 C ATOM 703 C ASN A 45 17.541 10.163 5.824 1.00 73.33 C ATOM 704 O ASN A 45 18.146 9.181 6.257 1.00 23.21 O ATOM 705 CB ASN A 45 18.184 10.008 3.388 1.00 3.35 C ATOM 706 CG ASN A 45 18.790 8.616 3.448 1.00 42.43 C ATOM 707 OD1 ASN A 45 18.104 7.632 3.704 1.00 61.22 O ATOM 708 ND2 ASN A 45 20.082 8.520 3.218 1.00 23.53 N ATOM 0 H ASN A 45 16.907 12.203 3.757 1.00 71.54 H new ATOM 0 HA ASN A 45 16.312 9.371 4.259 1.00 13.11 H new ATOM 0 HB2 ASN A 45 17.832 10.203 2.375 1.00 3.35 H new ATOM 0 HB3 ASN A 45 18.957 10.745 3.604 1.00 3.35 H new ATOM 0 HD21 ASN A 45 20.539 7.609 3.250 1.00 23.53 H new ATOM 0 HD22 ASN A 45 20.626 9.357 3.008 1.00 23.53 H new ATOM 715 N LYS A 46 17.306 11.238 6.577 1.00 12.00 N ATOM 716 CA LYS A 46 17.750 11.309 7.980 1.00 41.10 C ATOM 717 C LYS A 46 16.834 12.216 8.821 1.00 33.13 C ATOM 718 O LYS A 46 16.272 13.190 8.319 1.00 32.34 O ATOM 719 CB LYS A 46 19.214 11.776 8.076 1.00 52.21 C ATOM 720 CG LYS A 46 19.493 13.161 7.495 1.00 13.31 C ATOM 721 CD LYS A 46 19.527 13.165 5.968 1.00 4.10 C ATOM 722 CE LYS A 46 20.036 14.494 5.420 1.00 63.10 C ATOM 723 NZ LYS A 46 21.400 14.822 5.918 1.00 11.13 N ATOM 0 H LYS A 46 16.815 12.069 6.247 1.00 12.00 H new ATOM 0 HA LYS A 46 17.685 10.301 8.390 1.00 41.10 H new ATOM 0 HB2 LYS A 46 19.512 11.772 9.124 1.00 52.21 H new ATOM 0 HB3 LYS A 46 19.845 11.050 7.563 1.00 52.21 H new ATOM 0 HG2 LYS A 46 18.727 13.856 7.839 1.00 13.31 H new ATOM 0 HG3 LYS A 46 20.447 13.525 7.876 1.00 13.31 H new ATOM 0 HD2 LYS A 46 20.168 12.357 5.616 1.00 4.10 H new ATOM 0 HD3 LYS A 46 18.527 12.971 5.581 1.00 4.10 H new ATOM 0 HE2 LYS A 46 20.048 14.455 4.331 1.00 63.10 H new ATOM 0 HE3 LYS A 46 19.347 15.290 5.703 1.00 63.10 H new ATOM 0 HZ1 LYS A 46 21.767 15.650 5.406 1.00 11.13 H new ATOM 0 HZ2 LYS A 46 21.356 15.035 6.935 1.00 11.13 H new ATOM 0 HZ3 LYS A 46 22.031 14.011 5.761 1.00 11.13 H new ATOM 737 N ALA A 47 16.719 11.906 10.113 1.00 71.52 N ATOM 738 CA ALA A 47 15.728 12.550 10.991 1.00 21.52 C ATOM 739 C ALA A 47 16.145 13.956 11.462 1.00 4.31 C ATOM 740 O ALA A 47 15.400 14.611 12.196 1.00 33.11 O ATOM 741 CB ALA A 47 15.451 11.656 12.195 1.00 54.31 C ATOM 0 H ALA A 47 17.300 11.211 10.581 1.00 71.52 H new ATOM 0 HA ALA A 47 14.823 12.682 10.398 1.00 21.52 H new ATOM 0 HB1 ALA A 47 14.717 12.135 12.843 1.00 54.31 H new ATOM 0 HB2 ALA A 47 15.062 10.697 11.854 1.00 54.31 H new ATOM 0 HB3 ALA A 47 16.375 11.496 12.750 1.00 54.31 H new ATOM 747 N GLU A 48 17.325 14.420 11.054 1.00 21.23 N ATOM 748 CA GLU A 48 17.788 15.770 11.424 1.00 52.52 C ATOM 749 C GLU A 48 16.873 16.857 10.842 1.00 1.12 C ATOM 750 O GLU A 48 16.682 17.915 11.441 1.00 40.31 O ATOM 751 CB GLU A 48 19.222 16.010 10.936 1.00 44.15 C ATOM 752 CG GLU A 48 19.350 16.073 9.418 1.00 51.01 C ATOM 753 CD GLU A 48 20.761 16.382 8.948 1.00 64.54 C ATOM 754 OE1 GLU A 48 21.094 17.575 8.796 1.00 53.40 O ATOM 755 OE2 GLU A 48 21.539 15.430 8.712 1.00 4.11 O ATOM 0 H GLU A 48 17.977 13.893 10.473 1.00 21.23 H new ATOM 0 HA GLU A 48 17.759 15.829 12.512 1.00 52.52 H new ATOM 0 HB2 GLU A 48 19.590 16.943 11.362 1.00 44.15 H new ATOM 0 HB3 GLU A 48 19.863 15.213 11.313 1.00 44.15 H new ATOM 0 HG2 GLU A 48 19.033 15.120 8.993 1.00 51.01 H new ATOM 0 HG3 GLU A 48 18.671 16.835 9.034 1.00 51.01 H new ATOM 762 N LYS A 49 16.308 16.585 9.670 1.00 64.21 N ATOM 763 CA LYS A 49 15.494 17.569 8.953 1.00 11.13 C ATOM 764 C LYS A 49 14.100 17.002 8.644 1.00 40.41 C ATOM 765 O LYS A 49 13.560 17.196 7.552 1.00 53.32 O ATOM 766 CB LYS A 49 16.213 17.974 7.653 1.00 55.30 C ATOM 767 CG LYS A 49 15.737 19.300 7.062 1.00 40.33 C ATOM 768 CD LYS A 49 16.020 20.473 8.000 1.00 23.42 C ATOM 769 CE LYS A 49 17.511 20.622 8.291 1.00 2.14 C ATOM 770 NZ LYS A 49 18.300 20.894 7.059 1.00 1.40 N ATOM 0 H LYS A 49 16.398 15.688 9.192 1.00 64.21 H new ATOM 0 HA LYS A 49 15.363 18.449 9.582 1.00 11.13 H new ATOM 0 HB2 LYS A 49 17.283 18.039 7.848 1.00 55.30 H new ATOM 0 HB3 LYS A 49 16.071 17.187 6.912 1.00 55.30 H new ATOM 0 HG2 LYS A 49 16.233 19.471 6.106 1.00 40.33 H new ATOM 0 HG3 LYS A 49 14.667 19.245 6.861 1.00 40.33 H new ATOM 0 HD2 LYS A 49 15.643 21.394 7.554 1.00 23.42 H new ATOM 0 HD3 LYS A 49 15.480 20.328 8.936 1.00 23.42 H new ATOM 0 HE2 LYS A 49 17.661 21.434 9.003 1.00 2.14 H new ATOM 0 HE3 LYS A 49 17.880 19.711 8.763 1.00 2.14 H new ATOM 0 HZ1 LYS A 49 19.281 21.121 7.318 1.00 1.40 H new ATOM 0 HZ2 LYS A 49 18.290 20.053 6.447 1.00 1.40 H new ATOM 0 HZ3 LYS A 49 17.881 21.698 6.549 1.00 1.40 H new ATOM 784 N SER A 50 13.518 16.305 9.617 1.00 71.10 N ATOM 785 CA SER A 50 12.177 15.730 9.467 1.00 64.41 C ATOM 786 C SER A 50 11.246 16.180 10.597 1.00 75.43 C ATOM 787 O SER A 50 11.645 16.243 11.759 1.00 55.23 O ATOM 788 CB SER A 50 12.243 14.199 9.445 1.00 63.31 C ATOM 789 OG SER A 50 12.739 13.684 10.670 1.00 72.02 O ATOM 0 H SER A 50 13.953 16.123 10.521 1.00 71.10 H new ATOM 0 HA SER A 50 11.776 16.089 8.519 1.00 64.41 H new ATOM 0 HB2 SER A 50 11.250 13.793 9.254 1.00 63.31 H new ATOM 0 HB3 SER A 50 12.884 13.873 8.626 1.00 63.31 H new ATOM 0 HG SER A 50 12.620 12.711 10.688 1.00 72.02 H new ATOM 795 N GLU A 51 10.004 16.499 10.247 1.00 43.01 N ATOM 796 CA GLU A 51 8.985 16.864 11.237 1.00 54.40 C ATOM 797 C GLU A 51 8.301 15.607 11.797 1.00 64.04 C ATOM 798 O GLU A 51 7.936 15.551 12.973 1.00 12.31 O ATOM 799 CB GLU A 51 7.938 17.792 10.604 1.00 64.43 C ATOM 800 CG GLU A 51 8.524 19.022 9.915 1.00 23.31 C ATOM 801 CD GLU A 51 9.381 19.869 10.841 1.00 61.21 C ATOM 802 OE1 GLU A 51 8.821 20.518 11.750 1.00 10.12 O ATOM 803 OE2 GLU A 51 10.619 19.891 10.666 1.00 45.15 O ATOM 0 H GLU A 51 9.674 16.513 9.282 1.00 43.01 H new ATOM 0 HA GLU A 51 9.475 17.389 12.057 1.00 54.40 H new ATOM 0 HB2 GLU A 51 7.358 17.224 9.876 1.00 64.43 H new ATOM 0 HB3 GLU A 51 7.244 18.120 11.378 1.00 64.43 H new ATOM 0 HG2 GLU A 51 9.125 18.703 9.063 1.00 23.31 H new ATOM 0 HG3 GLU A 51 7.712 19.633 9.521 1.00 23.31 H new ATOM 810 N ALA A 52 8.125 14.605 10.938 1.00 63.23 N ATOM 811 CA ALA A 52 7.517 13.328 11.333 1.00 53.43 C ATOM 812 C ALA A 52 8.312 12.133 10.775 1.00 3.11 C ATOM 813 O ALA A 52 9.199 12.301 9.936 1.00 13.21 O ATOM 814 CB ALA A 52 6.065 13.273 10.859 1.00 44.54 C ATOM 0 H ALA A 52 8.396 14.650 9.956 1.00 63.23 H new ATOM 0 HA ALA A 52 7.540 13.261 12.421 1.00 53.43 H new ATOM 0 HB1 ALA A 52 5.621 12.323 11.156 1.00 44.54 H new ATOM 0 HB2 ALA A 52 5.504 14.092 11.309 1.00 44.54 H new ATOM 0 HB3 ALA A 52 6.033 13.365 9.773 1.00 44.54 H new ATOM 820 N ILE A 53 7.984 10.929 11.243 1.00 63.43 N ATOM 821 CA ILE A 53 8.660 9.695 10.810 1.00 62.43 C ATOM 822 C ILE A 53 7.645 8.582 10.488 1.00 64.11 C ATOM 823 O ILE A 53 6.848 8.183 11.341 1.00 33.11 O ATOM 824 CB ILE A 53 9.652 9.177 11.890 1.00 64.12 C ATOM 825 CG1 ILE A 53 10.816 10.168 12.073 1.00 41.01 C ATOM 826 CG2 ILE A 53 10.180 7.784 11.536 1.00 44.43 C ATOM 827 CD1 ILE A 53 11.873 9.697 13.051 1.00 45.21 C ATOM 0 H ILE A 53 7.246 10.776 11.930 1.00 63.43 H new ATOM 0 HA ILE A 53 9.216 9.947 9.907 1.00 62.43 H new ATOM 0 HB ILE A 53 9.111 9.099 12.833 1.00 64.12 H new ATOM 0 HG12 ILE A 53 11.284 10.347 11.105 1.00 41.01 H new ATOM 0 HG13 ILE A 53 10.417 11.123 12.416 1.00 41.01 H new ATOM 0 HG21 ILE A 53 10.871 7.449 12.310 1.00 44.43 H new ATOM 0 HG22 ILE A 53 9.346 7.085 11.467 1.00 44.43 H new ATOM 0 HG23 ILE A 53 10.699 7.824 10.579 1.00 44.43 H new ATOM 0 HD11 ILE A 53 12.659 10.448 13.126 1.00 45.21 H new ATOM 0 HD12 ILE A 53 11.420 9.546 14.031 1.00 45.21 H new ATOM 0 HD13 ILE A 53 12.301 8.758 12.700 1.00 45.21 H new ATOM 839 N ILE A 54 7.684 8.088 9.253 1.00 3.31 N ATOM 840 CA ILE A 54 6.813 6.984 8.826 1.00 31.04 C ATOM 841 C ILE A 54 7.577 5.650 8.864 1.00 41.42 C ATOM 842 O ILE A 54 8.440 5.386 8.020 1.00 43.22 O ATOM 843 CB ILE A 54 6.239 7.206 7.394 1.00 52.24 C ATOM 844 CG1 ILE A 54 5.294 8.427 7.350 1.00 41.21 C ATOM 845 CG2 ILE A 54 5.505 5.953 6.907 1.00 43.53 C ATOM 846 CD1 ILE A 54 5.986 9.767 7.514 1.00 34.45 C ATOM 0 H ILE A 54 8.310 8.433 8.525 1.00 3.31 H new ATOM 0 HA ILE A 54 5.977 6.954 9.525 1.00 31.04 H new ATOM 0 HB ILE A 54 7.079 7.404 6.729 1.00 52.24 H new ATOM 0 HG12 ILE A 54 4.760 8.423 6.400 1.00 41.21 H new ATOM 0 HG13 ILE A 54 4.547 8.320 8.136 1.00 41.21 H new ATOM 0 HG21 ILE A 54 5.112 6.128 5.906 1.00 43.53 H new ATOM 0 HG22 ILE A 54 6.198 5.112 6.883 1.00 43.53 H new ATOM 0 HG23 ILE A 54 4.683 5.726 7.585 1.00 43.53 H new ATOM 0 HD11 ILE A 54 5.246 10.566 7.470 1.00 34.45 H new ATOM 0 HD12 ILE A 54 6.497 9.797 8.477 1.00 34.45 H new ATOM 0 HD13 ILE A 54 6.713 9.901 6.713 1.00 34.45 H new ATOM 858 N GLN A 55 7.262 4.820 9.856 1.00 4.35 N ATOM 859 CA GLN A 55 7.920 3.521 10.021 1.00 35.14 C ATOM 860 C GLN A 55 7.065 2.391 9.431 1.00 3.40 C ATOM 861 O GLN A 55 6.112 1.926 10.059 1.00 23.44 O ATOM 862 CB GLN A 55 8.193 3.257 11.510 1.00 43.11 C ATOM 863 CG GLN A 55 8.940 1.955 11.784 1.00 54.01 C ATOM 864 CD GLN A 55 9.169 1.710 13.266 1.00 55.23 C ATOM 865 OE1 GLN A 55 9.286 2.642 14.054 1.00 55.03 O ATOM 866 NE2 GLN A 55 9.240 0.454 13.656 1.00 12.41 N ATOM 0 H GLN A 55 6.553 5.023 10.561 1.00 4.35 H new ATOM 0 HA GLN A 55 8.867 3.546 9.482 1.00 35.14 H new ATOM 0 HB2 GLN A 55 8.771 4.087 11.915 1.00 43.11 H new ATOM 0 HB3 GLN A 55 7.243 3.238 12.045 1.00 43.11 H new ATOM 0 HG2 GLN A 55 8.375 1.122 11.365 1.00 54.01 H new ATOM 0 HG3 GLN A 55 9.901 1.978 11.271 1.00 54.01 H new ATOM 0 HE21 GLN A 55 9.138 -0.298 12.975 1.00 12.41 H new ATOM 0 HE22 GLN A 55 9.397 0.233 14.639 1.00 12.41 H new ATOM 875 N ILE A 56 7.394 1.964 8.214 1.00 44.02 N ATOM 876 CA ILE A 56 6.663 0.872 7.565 1.00 72.23 C ATOM 877 C ILE A 56 7.213 -0.484 8.039 1.00 62.21 C ATOM 878 O ILE A 56 8.408 -0.761 7.938 1.00 13.34 O ATOM 879 CB ILE A 56 6.703 1.008 6.008 1.00 14.01 C ATOM 880 CG1 ILE A 56 5.720 0.033 5.315 1.00 61.32 C ATOM 881 CG2 ILE A 56 8.120 0.825 5.470 1.00 42.31 C ATOM 882 CD1 ILE A 56 6.176 -1.414 5.253 1.00 73.53 C ATOM 0 H ILE A 56 8.156 2.353 7.658 1.00 44.02 H new ATOM 0 HA ILE A 56 5.614 0.931 7.856 1.00 72.23 H new ATOM 0 HB ILE A 56 6.379 2.021 5.771 1.00 14.01 H new ATOM 0 HG12 ILE A 56 4.765 0.073 5.838 1.00 61.32 H new ATOM 0 HG13 ILE A 56 5.542 0.384 4.299 1.00 61.32 H new ATOM 0 HG21 ILE A 56 8.113 0.926 4.385 1.00 42.31 H new ATOM 0 HG22 ILE A 56 8.773 1.584 5.900 1.00 42.31 H new ATOM 0 HG23 ILE A 56 8.487 -0.165 5.740 1.00 42.31 H new ATOM 0 HD11 ILE A 56 5.418 -2.013 4.749 1.00 73.53 H new ATOM 0 HD12 ILE A 56 7.114 -1.477 4.701 1.00 73.53 H new ATOM 0 HD13 ILE A 56 6.325 -1.792 6.264 1.00 73.53 H new ATOM 894 N VAL A 57 6.331 -1.317 8.581 1.00 21.22 N ATOM 895 CA VAL A 57 6.735 -2.577 9.210 1.00 10.40 C ATOM 896 C VAL A 57 6.772 -3.749 8.209 1.00 34.02 C ATOM 897 O VAL A 57 7.776 -4.451 8.104 1.00 51.23 O ATOM 898 CB VAL A 57 5.787 -2.936 10.385 1.00 14.44 C ATOM 899 CG1 VAL A 57 6.275 -4.179 11.129 1.00 54.00 C ATOM 900 CG2 VAL A 57 5.645 -1.752 11.343 1.00 64.14 C ATOM 0 H VAL A 57 5.326 -1.144 8.599 1.00 21.22 H new ATOM 0 HA VAL A 57 7.746 -2.423 9.587 1.00 10.40 H new ATOM 0 HB VAL A 57 4.806 -3.161 9.968 1.00 14.44 H new ATOM 0 HG11 VAL A 57 5.591 -4.406 11.947 1.00 54.00 H new ATOM 0 HG12 VAL A 57 6.311 -5.024 10.441 1.00 54.00 H new ATOM 0 HG13 VAL A 57 7.272 -3.995 11.530 1.00 54.00 H new ATOM 0 HG21 VAL A 57 4.977 -2.023 12.160 1.00 64.14 H new ATOM 0 HG22 VAL A 57 6.623 -1.491 11.746 1.00 64.14 H new ATOM 0 HG23 VAL A 57 5.234 -0.897 10.806 1.00 64.14 H new ATOM 910 N HIS A 58 5.674 -3.968 7.478 1.00 21.44 N ATOM 911 CA HIS A 58 5.583 -5.109 6.547 1.00 64.21 C ATOM 912 C HIS A 58 4.852 -4.751 5.244 1.00 24.14 C ATOM 913 O HIS A 58 3.962 -3.897 5.227 1.00 12.40 O ATOM 914 CB HIS A 58 4.864 -6.298 7.206 1.00 52.54 C ATOM 915 CG HIS A 58 5.564 -6.852 8.412 1.00 35.20 C ATOM 916 ND1 HIS A 58 6.932 -7.004 8.492 1.00 41.44 N ATOM 917 CD2 HIS A 58 5.074 -7.289 9.596 1.00 25.24 C ATOM 918 CE1 HIS A 58 7.250 -7.509 9.666 1.00 32.53 C ATOM 919 NE2 HIS A 58 6.143 -7.689 10.352 1.00 22.33 N ATOM 0 H HIS A 58 4.841 -3.380 7.508 1.00 21.44 H new ATOM 0 HA HIS A 58 6.610 -5.381 6.301 1.00 64.21 H new ATOM 0 HB2 HIS A 58 3.860 -5.986 7.495 1.00 52.54 H new ATOM 0 HB3 HIS A 58 4.751 -7.093 6.469 1.00 52.54 H new ATOM 0 HD1 HIS A 58 7.595 -6.763 7.756 1.00 41.44 H new ATOM 0 HD2 HIS A 58 4.035 -7.317 9.889 1.00 25.24 H new ATOM 0 HE1 HIS A 58 8.249 -7.736 10.007 1.00 32.53 H new ATOM 928 N ALA A 59 5.241 -5.426 4.162 1.00 61.33 N ATOM 929 CA ALA A 59 4.565 -5.310 2.865 1.00 13.22 C ATOM 930 C ALA A 59 4.300 -6.706 2.274 1.00 73.33 C ATOM 931 O ALA A 59 5.195 -7.336 1.707 1.00 10.43 O ATOM 932 CB ALA A 59 5.397 -4.469 1.904 1.00 43.12 C ATOM 0 H ALA A 59 6.033 -6.069 4.158 1.00 61.33 H new ATOM 0 HA ALA A 59 3.607 -4.811 3.015 1.00 13.22 H new ATOM 0 HB1 ALA A 59 4.881 -4.393 0.947 1.00 43.12 H new ATOM 0 HB2 ALA A 59 5.537 -3.472 2.321 1.00 43.12 H new ATOM 0 HB3 ALA A 59 6.369 -4.940 1.756 1.00 43.12 H new ATOM 938 N ILE A 60 3.067 -7.187 2.427 1.00 32.32 N ATOM 939 CA ILE A 60 2.699 -8.549 2.013 1.00 23.40 C ATOM 940 C ILE A 60 1.817 -8.544 0.750 1.00 41.14 C ATOM 941 O ILE A 60 0.919 -7.717 0.614 1.00 2.12 O ATOM 942 CB ILE A 60 1.943 -9.280 3.158 1.00 42.34 C ATOM 943 CG1 ILE A 60 2.788 -9.291 4.446 1.00 3.21 C ATOM 944 CG2 ILE A 60 1.561 -10.704 2.751 1.00 61.13 C ATOM 945 CD1 ILE A 60 4.127 -9.991 4.306 1.00 53.13 C ATOM 0 H ILE A 60 2.300 -6.654 2.836 1.00 32.32 H new ATOM 0 HA ILE A 60 3.626 -9.076 1.786 1.00 23.40 H new ATOM 0 HB ILE A 60 1.022 -8.731 3.353 1.00 42.34 H new ATOM 0 HG12 ILE A 60 2.960 -8.262 4.763 1.00 3.21 H new ATOM 0 HG13 ILE A 60 2.217 -9.777 5.237 1.00 3.21 H new ATOM 0 HG21 ILE A 60 1.034 -11.188 3.573 1.00 61.13 H new ATOM 0 HG22 ILE A 60 0.914 -10.671 1.875 1.00 61.13 H new ATOM 0 HG23 ILE A 60 2.463 -11.269 2.515 1.00 61.13 H new ATOM 0 HD11 ILE A 60 4.658 -9.954 5.257 1.00 53.13 H new ATOM 0 HD12 ILE A 60 3.966 -11.031 4.021 1.00 53.13 H new ATOM 0 HD13 ILE A 60 4.720 -9.492 3.539 1.00 53.13 H new ATOM 957 N ARG A 61 2.075 -9.477 -0.167 1.00 24.51 N ATOM 958 CA ARG A 61 1.273 -9.611 -1.393 1.00 12.32 C ATOM 959 C ARG A 61 1.006 -11.091 -1.727 1.00 21.42 C ATOM 960 O ARG A 61 1.832 -11.761 -2.351 1.00 41.21 O ATOM 961 CB ARG A 61 1.965 -8.895 -2.571 1.00 15.35 C ATOM 962 CG ARG A 61 3.414 -9.322 -2.809 1.00 11.13 C ATOM 963 CD ARG A 61 4.029 -8.601 -4.007 1.00 4.00 C ATOM 964 NE ARG A 61 5.401 -9.034 -4.266 1.00 72.35 N ATOM 965 CZ ARG A 61 6.132 -8.607 -5.262 1.00 42.11 C ATOM 966 NH1 ARG A 61 5.671 -7.728 -6.093 1.00 23.54 N ATOM 967 NH2 ARG A 61 7.330 -9.064 -5.416 1.00 65.25 N ATOM 0 H ARG A 61 2.834 -10.154 -0.088 1.00 24.51 H new ATOM 0 HA ARG A 61 0.308 -9.134 -1.220 1.00 12.32 H new ATOM 0 HB2 ARG A 61 1.391 -9.079 -3.479 1.00 15.35 H new ATOM 0 HB3 ARG A 61 1.941 -7.820 -2.391 1.00 15.35 H new ATOM 0 HG2 ARG A 61 4.005 -9.114 -1.917 1.00 11.13 H new ATOM 0 HG3 ARG A 61 3.453 -10.399 -2.974 1.00 11.13 H new ATOM 0 HD2 ARG A 61 3.419 -8.784 -4.892 1.00 4.00 H new ATOM 0 HD3 ARG A 61 4.017 -7.526 -3.828 1.00 4.00 H new ATOM 0 HE ARG A 61 5.815 -9.714 -3.628 1.00 72.35 H new ATOM 0 HH11 ARG A 61 4.727 -7.360 -5.975 1.00 23.54 H new ATOM 0 HH12 ARG A 61 6.252 -7.403 -6.866 1.00 23.54 H new ATOM 0 HH21 ARG A 61 7.701 -9.754 -4.763 1.00 65.25 H new ATOM 0 HH22 ARG A 61 7.906 -8.735 -6.191 1.00 65.25 H new ATOM 981 N GLU A 62 -0.152 -11.599 -1.307 1.00 12.33 N ATOM 982 CA GLU A 62 -0.486 -13.021 -1.485 1.00 51.44 C ATOM 983 C GLU A 62 -1.623 -13.229 -2.498 1.00 74.40 C ATOM 984 O GLU A 62 -2.477 -12.364 -2.689 1.00 42.35 O ATOM 985 CB GLU A 62 -0.867 -13.652 -0.139 1.00 33.42 C ATOM 986 CG GLU A 62 0.261 -13.650 0.892 1.00 32.11 C ATOM 987 CD GLU A 62 1.510 -14.371 0.404 1.00 51.41 C ATOM 988 OE1 GLU A 62 1.512 -15.619 0.366 1.00 11.14 O ATOM 989 OE2 GLU A 62 2.503 -13.696 0.062 1.00 4.14 O ATOM 0 H GLU A 62 -0.877 -11.052 -0.841 1.00 12.33 H new ATOM 0 HA GLU A 62 0.403 -13.512 -1.881 1.00 51.44 H new ATOM 0 HB2 GLU A 62 -1.722 -13.116 0.273 1.00 33.42 H new ATOM 0 HB3 GLU A 62 -1.187 -14.680 -0.309 1.00 33.42 H new ATOM 0 HG2 GLU A 62 0.516 -12.620 1.142 1.00 32.11 H new ATOM 0 HG3 GLU A 62 -0.091 -14.123 1.809 1.00 32.11 H new ATOM 996 N LYS A 63 -1.623 -14.396 -3.140 1.00 12.12 N ATOM 997 CA LYS A 63 -2.639 -14.754 -4.137 1.00 45.41 C ATOM 998 C LYS A 63 -3.194 -16.163 -3.841 1.00 13.10 C ATOM 999 O LYS A 63 -2.432 -17.129 -3.763 1.00 22.44 O ATOM 1000 CB LYS A 63 -2.015 -14.701 -5.541 1.00 32.32 C ATOM 1001 CG LYS A 63 -1.444 -13.332 -5.908 1.00 71.31 C ATOM 1002 CD LYS A 63 -0.721 -13.348 -7.255 1.00 53.21 C ATOM 1003 CE LYS A 63 -1.659 -13.673 -8.415 1.00 30.12 C ATOM 1004 NZ LYS A 63 -0.943 -13.712 -9.717 1.00 22.41 N ATOM 0 H LYS A 63 -0.922 -15.121 -2.987 1.00 12.12 H new ATOM 0 HA LYS A 63 -3.465 -14.044 -4.090 1.00 45.41 H new ATOM 0 HB2 LYS A 63 -1.221 -15.445 -5.604 1.00 32.32 H new ATOM 0 HB3 LYS A 63 -2.771 -14.978 -6.276 1.00 32.32 H new ATOM 0 HG2 LYS A 63 -2.252 -12.601 -5.940 1.00 71.31 H new ATOM 0 HG3 LYS A 63 -0.752 -13.009 -5.130 1.00 71.31 H new ATOM 0 HD2 LYS A 63 -0.258 -12.377 -7.427 1.00 53.21 H new ATOM 0 HD3 LYS A 63 0.083 -14.084 -7.224 1.00 53.21 H new ATOM 0 HE2 LYS A 63 -2.137 -14.636 -8.235 1.00 30.12 H new ATOM 0 HE3 LYS A 63 -2.452 -12.927 -8.460 1.00 30.12 H new ATOM 0 HZ1 LYS A 63 -1.606 -13.986 -10.470 1.00 22.41 H new ATOM 0 HZ2 LYS A 63 -0.551 -12.772 -9.926 1.00 22.41 H new ATOM 0 HZ3 LYS A 63 -0.170 -14.406 -9.668 1.00 22.41 H new ATOM 1018 N ARG A 64 -4.514 -16.286 -3.667 1.00 12.43 N ATOM 1019 CA ARG A 64 -5.107 -17.554 -3.199 1.00 61.35 C ATOM 1020 C ARG A 64 -6.512 -17.817 -3.779 1.00 52.51 C ATOM 1021 O ARG A 64 -7.199 -16.900 -4.225 1.00 62.32 O ATOM 1022 CB ARG A 64 -5.166 -17.534 -1.664 1.00 42.02 C ATOM 1023 CG ARG A 64 -5.939 -16.343 -1.100 1.00 43.04 C ATOM 1024 CD ARG A 64 -5.718 -16.166 0.399 1.00 40.14 C ATOM 1025 NE ARG A 64 -6.127 -17.340 1.170 1.00 14.43 N ATOM 1026 CZ ARG A 64 -7.039 -17.328 2.105 1.00 44.04 C ATOM 1027 NH1 ARG A 64 -7.745 -16.268 2.325 1.00 62.41 N ATOM 1028 NH2 ARG A 64 -7.271 -18.398 2.788 1.00 71.13 N ATOM 0 H ARG A 64 -5.187 -15.539 -3.839 1.00 12.43 H new ATOM 0 HA ARG A 64 -4.473 -18.367 -3.554 1.00 61.35 H new ATOM 0 HB2 ARG A 64 -5.629 -18.456 -1.314 1.00 42.02 H new ATOM 0 HB3 ARG A 64 -4.150 -17.518 -1.269 1.00 42.02 H new ATOM 0 HG2 ARG A 64 -5.633 -15.435 -1.620 1.00 43.04 H new ATOM 0 HG3 ARG A 64 -7.003 -16.478 -1.295 1.00 43.04 H new ATOM 0 HD2 ARG A 64 -4.664 -15.963 0.586 1.00 40.14 H new ATOM 0 HD3 ARG A 64 -6.276 -15.296 0.745 1.00 40.14 H new ATOM 0 HE ARG A 64 -5.669 -18.228 0.964 1.00 14.43 H new ATOM 0 HH11 ARG A 64 -7.593 -15.429 1.766 1.00 62.41 H new ATOM 0 HH12 ARG A 64 -8.454 -16.271 3.058 1.00 62.41 H new ATOM 0 HH21 ARG A 64 -6.743 -19.249 2.597 1.00 71.13 H new ATOM 0 HH22 ARG A 64 -7.982 -18.392 3.519 1.00 71.13 H new ATOM 1042 N ILE A 65 -6.928 -19.088 -3.764 1.00 35.34 N ATOM 1043 CA ILE A 65 -8.258 -19.495 -4.256 1.00 30.43 C ATOM 1044 C ILE A 65 -9.371 -19.205 -3.237 1.00 12.23 C ATOM 1045 O ILE A 65 -9.244 -19.520 -2.054 1.00 32.34 O ATOM 1046 CB ILE A 65 -8.281 -21.009 -4.628 1.00 3.52 C ATOM 1047 CG1 ILE A 65 -7.651 -21.231 -6.009 1.00 14.14 C ATOM 1048 CG2 ILE A 65 -9.704 -21.583 -4.595 1.00 13.25 C ATOM 1049 CD1 ILE A 65 -8.447 -20.610 -7.138 1.00 55.21 C ATOM 0 H ILE A 65 -6.361 -19.861 -3.415 1.00 35.34 H new ATOM 0 HA ILE A 65 -8.449 -18.899 -5.148 1.00 30.43 H new ATOM 0 HB ILE A 65 -7.693 -21.539 -3.878 1.00 3.52 H new ATOM 0 HG12 ILE A 65 -6.644 -20.815 -6.012 1.00 14.14 H new ATOM 0 HG13 ILE A 65 -7.554 -22.302 -6.188 1.00 14.14 H new ATOM 0 HG21 ILE A 65 -9.676 -22.640 -4.860 1.00 13.25 H new ATOM 0 HG22 ILE A 65 -10.118 -21.471 -3.593 1.00 13.25 H new ATOM 0 HG23 ILE A 65 -10.329 -21.046 -5.308 1.00 13.25 H new ATOM 0 HD11 ILE A 65 -7.946 -20.804 -8.086 1.00 55.21 H new ATOM 0 HD12 ILE A 65 -9.447 -21.044 -7.160 1.00 55.21 H new ATOM 0 HD13 ILE A 65 -8.522 -19.534 -6.981 1.00 55.21 H new ATOM 1061 N LEU A 66 -10.469 -18.618 -3.716 1.00 25.21 N ATOM 1062 CA LEU A 66 -11.636 -18.332 -2.871 1.00 55.32 C ATOM 1063 C LEU A 66 -12.684 -19.457 -2.963 1.00 3.22 C ATOM 1064 O LEU A 66 -13.327 -19.806 -1.968 1.00 34.03 O ATOM 1065 CB LEU A 66 -12.267 -16.995 -3.286 1.00 13.25 C ATOM 1066 CG LEU A 66 -13.357 -16.456 -2.342 1.00 33.34 C ATOM 1067 CD1 LEU A 66 -12.776 -16.164 -0.961 1.00 42.05 C ATOM 1068 CD2 LEU A 66 -14.015 -15.208 -2.928 1.00 61.43 C ATOM 0 H LEU A 66 -10.577 -18.329 -4.688 1.00 25.21 H new ATOM 0 HA LEU A 66 -11.297 -18.270 -1.837 1.00 55.32 H new ATOM 0 HB2 LEU A 66 -11.476 -16.249 -3.364 1.00 13.25 H new ATOM 0 HB3 LEU A 66 -12.697 -17.109 -4.281 1.00 13.25 H new ATOM 0 HG LEU A 66 -14.124 -17.223 -2.235 1.00 33.34 H new ATOM 0 HD11 LEU A 66 -13.562 -15.784 -0.308 1.00 42.05 H new ATOM 0 HD12 LEU A 66 -12.365 -17.081 -0.538 1.00 42.05 H new ATOM 0 HD13 LEU A 66 -11.986 -15.419 -1.049 1.00 42.05 H new ATOM 0 HD21 LEU A 66 -14.782 -14.845 -2.243 1.00 61.43 H new ATOM 0 HD22 LEU A 66 -13.262 -14.433 -3.073 1.00 61.43 H new ATOM 0 HD23 LEU A 66 -14.472 -15.454 -3.887 1.00 61.43 H new ATOM 1080 N SER A 67 -12.854 -20.021 -4.161 1.00 44.24 N ATOM 1081 CA SER A 67 -13.825 -21.110 -4.385 1.00 12.12 C ATOM 1082 C SER A 67 -13.488 -21.923 -5.646 1.00 44.14 C ATOM 1083 O SER A 67 -12.698 -21.485 -6.488 1.00 74.10 O ATOM 1084 CB SER A 67 -15.252 -20.551 -4.506 1.00 72.25 C ATOM 1085 OG SER A 67 -16.194 -21.592 -4.730 1.00 74.13 O ATOM 0 H SER A 67 -12.335 -19.746 -4.995 1.00 44.24 H new ATOM 0 HA SER A 67 -13.766 -21.772 -3.521 1.00 12.12 H new ATOM 0 HB2 SER A 67 -15.512 -20.011 -3.596 1.00 72.25 H new ATOM 0 HB3 SER A 67 -15.296 -19.834 -5.326 1.00 72.25 H new ATOM 0 HG SER A 67 -17.058 -21.340 -4.343 1.00 74.13 H new ATOM 1091 N LEU A 68 -14.107 -23.101 -5.771 1.00 21.12 N ATOM 1092 CA LEU A 68 -13.881 -23.997 -6.918 1.00 63.22 C ATOM 1093 C LEU A 68 -15.190 -24.299 -7.669 1.00 34.12 C ATOM 1094 O LEU A 68 -16.190 -24.704 -7.071 1.00 20.42 O ATOM 1095 CB LEU A 68 -13.249 -25.322 -6.457 1.00 4.20 C ATOM 1096 CG LEU A 68 -11.832 -25.214 -5.869 1.00 13.13 C ATOM 1097 CD1 LEU A 68 -11.304 -26.595 -5.473 1.00 14.01 C ATOM 1098 CD2 LEU A 68 -10.885 -24.534 -6.859 1.00 30.34 C ATOM 0 H LEU A 68 -14.774 -23.461 -5.089 1.00 21.12 H new ATOM 0 HA LEU A 68 -13.200 -23.482 -7.596 1.00 63.22 H new ATOM 0 HB2 LEU A 68 -13.900 -25.773 -5.708 1.00 4.20 H new ATOM 0 HB3 LEU A 68 -13.219 -26.004 -7.306 1.00 4.20 H new ATOM 0 HG LEU A 68 -11.882 -24.599 -4.971 1.00 13.13 H new ATOM 0 HD11 LEU A 68 -10.300 -26.496 -5.059 1.00 14.01 H new ATOM 0 HD12 LEU A 68 -11.963 -27.036 -4.725 1.00 14.01 H new ATOM 0 HD13 LEU A 68 -11.272 -27.238 -6.352 1.00 14.01 H new ATOM 0 HD21 LEU A 68 -9.888 -24.468 -6.423 1.00 30.34 H new ATOM 0 HD22 LEU A 68 -10.840 -25.117 -7.779 1.00 30.34 H new ATOM 0 HD23 LEU A 68 -11.250 -23.532 -7.082 1.00 30.34 H new ATOM 1110 N SER A 69 -15.171 -24.123 -8.988 1.00 42.42 N ATOM 1111 CA SER A 69 -16.357 -24.364 -9.825 1.00 63.40 C ATOM 1112 C SER A 69 -16.568 -25.859 -10.095 1.00 20.43 C ATOM 1113 O SER A 69 -15.637 -26.567 -10.483 1.00 73.42 O ATOM 1114 CB SER A 69 -16.236 -23.629 -11.166 1.00 25.04 C ATOM 1115 OG SER A 69 -17.410 -23.801 -11.946 1.00 60.12 O ATOM 0 H SER A 69 -14.349 -23.814 -9.507 1.00 42.42 H new ATOM 0 HA SER A 69 -17.215 -23.983 -9.272 1.00 63.40 H new ATOM 0 HB2 SER A 69 -16.064 -22.567 -10.989 1.00 25.04 H new ATOM 0 HB3 SER A 69 -15.372 -24.004 -11.714 1.00 25.04 H new ATOM 0 HG SER A 69 -17.311 -23.323 -12.796 1.00 60.12 H new ATOM 1121 N GLU A 70 -17.800 -26.329 -9.890 1.00 22.54 N ATOM 1122 CA GLU A 70 -18.169 -27.730 -10.147 1.00 43.24 C ATOM 1123 C GLU A 70 -17.222 -28.719 -9.439 1.00 12.11 C ATOM 1124 O GLU A 70 -16.977 -29.818 -9.935 1.00 31.25 O ATOM 1125 CB GLU A 70 -18.201 -27.997 -11.662 1.00 73.12 C ATOM 1126 CG GLU A 70 -18.998 -26.960 -12.458 1.00 34.43 C ATOM 1127 CD GLU A 70 -20.399 -26.718 -11.904 1.00 62.24 C ATOM 1128 OE1 GLU A 70 -21.336 -27.451 -12.278 1.00 54.20 O ATOM 1129 OE2 GLU A 70 -20.573 -25.785 -11.085 1.00 2.43 O ATOM 0 H GLU A 70 -18.569 -25.756 -9.543 1.00 22.54 H new ATOM 0 HA GLU A 70 -19.165 -27.892 -9.734 1.00 43.24 H new ATOM 0 HB2 GLU A 70 -17.178 -28.022 -12.038 1.00 73.12 H new ATOM 0 HB3 GLU A 70 -18.630 -28.984 -11.838 1.00 73.12 H new ATOM 0 HG2 GLU A 70 -18.450 -26.018 -12.464 1.00 34.43 H new ATOM 0 HG3 GLU A 70 -19.077 -27.290 -13.494 1.00 34.43 H new ATOM 1136 N SER A 71 -16.712 -28.312 -8.270 1.00 74.20 N ATOM 1137 CA SER A 71 -15.797 -29.138 -7.447 1.00 1.31 C ATOM 1138 C SER A 71 -14.525 -29.556 -8.209 1.00 12.15 C ATOM 1139 O SER A 71 -13.878 -30.546 -7.861 1.00 61.02 O ATOM 1140 CB SER A 71 -16.521 -30.390 -6.906 1.00 42.02 C ATOM 1141 OG SER A 71 -16.759 -31.352 -7.924 1.00 64.01 O ATOM 0 H SER A 71 -16.918 -27.401 -7.861 1.00 74.20 H new ATOM 0 HA SER A 71 -15.486 -28.511 -6.611 1.00 1.31 H new ATOM 0 HB2 SER A 71 -15.922 -30.841 -6.115 1.00 42.02 H new ATOM 0 HB3 SER A 71 -17.470 -30.094 -6.458 1.00 42.02 H new ATOM 0 HG SER A 71 -16.479 -30.988 -8.790 1.00 64.01 H new ATOM 1147 N GLY A 72 -14.149 -28.784 -9.231 1.00 24.43 N ATOM 1148 CA GLY A 72 -12.964 -29.117 -10.024 1.00 14.41 C ATOM 1149 C GLY A 72 -12.294 -27.909 -10.678 1.00 61.10 C ATOM 1150 O GLY A 72 -11.067 -27.780 -10.653 1.00 63.01 O ATOM 0 H GLY A 72 -14.638 -27.939 -9.525 1.00 24.43 H new ATOM 0 HA2 GLY A 72 -12.239 -29.618 -9.382 1.00 14.41 H new ATOM 0 HA3 GLY A 72 -13.247 -29.827 -10.801 1.00 14.41 H new ATOM 1154 N ARG A 73 -13.093 -27.040 -11.292 1.00 21.43 N ATOM 1155 CA ARG A 73 -12.572 -25.836 -11.959 1.00 3.21 C ATOM 1156 C ARG A 73 -12.333 -24.694 -10.952 1.00 21.52 C ATOM 1157 O ARG A 73 -12.722 -24.781 -9.790 1.00 0.02 O ATOM 1158 CB ARG A 73 -13.544 -25.357 -13.055 1.00 30.54 C ATOM 1159 CG ARG A 73 -13.608 -26.234 -14.310 1.00 32.41 C ATOM 1160 CD ARG A 73 -14.130 -27.639 -14.029 1.00 43.21 C ATOM 1161 NE ARG A 73 -14.485 -28.335 -15.263 1.00 72.14 N ATOM 1162 CZ ARG A 73 -13.968 -29.467 -15.660 1.00 73.24 C ATOM 1163 NH1 ARG A 73 -13.043 -30.059 -14.974 1.00 32.14 N ATOM 1164 NH2 ARG A 73 -14.374 -29.995 -16.764 1.00 11.35 N ATOM 0 H ARG A 73 -14.107 -27.142 -11.345 1.00 21.43 H new ATOM 0 HA ARG A 73 -11.618 -26.105 -12.414 1.00 3.21 H new ATOM 0 HB2 ARG A 73 -14.544 -25.293 -12.626 1.00 30.54 H new ATOM 0 HB3 ARG A 73 -13.260 -24.348 -13.353 1.00 30.54 H new ATOM 0 HG2 ARG A 73 -14.250 -25.755 -15.049 1.00 32.41 H new ATOM 0 HG3 ARG A 73 -12.613 -26.303 -14.749 1.00 32.41 H new ATOM 0 HD2 ARG A 73 -13.371 -28.210 -13.494 1.00 43.21 H new ATOM 0 HD3 ARG A 73 -15.003 -27.581 -13.379 1.00 43.21 H new ATOM 0 HE ARG A 73 -15.191 -27.904 -15.860 1.00 72.14 H new ATOM 0 HH11 ARG A 73 -12.705 -29.642 -14.107 1.00 32.14 H new ATOM 0 HH12 ARG A 73 -12.652 -30.943 -15.301 1.00 32.14 H new ATOM 0 HH21 ARG A 73 -15.092 -29.529 -17.318 1.00 11.35 H new ATOM 0 HH22 ARG A 73 -13.977 -30.879 -17.083 1.00 11.35 H new ATOM 1178 N VAL A 74 -11.701 -23.618 -11.411 1.00 41.34 N ATOM 1179 CA VAL A 74 -11.467 -22.429 -10.575 1.00 13.22 C ATOM 1180 C VAL A 74 -12.656 -21.449 -10.646 1.00 5.01 C ATOM 1181 O VAL A 74 -13.338 -21.361 -11.667 1.00 13.31 O ATOM 1182 CB VAL A 74 -10.171 -21.695 -11.014 1.00 32.42 C ATOM 1183 CG1 VAL A 74 -9.963 -20.410 -10.218 1.00 72.50 C ATOM 1184 CG2 VAL A 74 -8.958 -22.616 -10.883 1.00 51.54 C ATOM 0 H VAL A 74 -11.338 -23.538 -12.361 1.00 41.34 H new ATOM 0 HA VAL A 74 -11.358 -22.774 -9.547 1.00 13.22 H new ATOM 0 HB VAL A 74 -10.283 -21.420 -12.063 1.00 32.42 H new ATOM 0 HG11 VAL A 74 -9.047 -19.921 -10.550 1.00 72.50 H new ATOM 0 HG12 VAL A 74 -10.810 -19.742 -10.377 1.00 72.50 H new ATOM 0 HG13 VAL A 74 -9.883 -20.648 -9.157 1.00 72.50 H new ATOM 0 HG21 VAL A 74 -8.060 -22.082 -11.196 1.00 51.54 H new ATOM 0 HG22 VAL A 74 -8.850 -22.930 -9.845 1.00 51.54 H new ATOM 0 HG23 VAL A 74 -9.097 -23.493 -11.515 1.00 51.54 H new ATOM 1194 N ARG A 75 -12.918 -20.736 -9.545 1.00 61.52 N ATOM 1195 CA ARG A 75 -13.943 -19.678 -9.526 1.00 11.34 C ATOM 1196 C ARG A 75 -13.325 -18.289 -9.275 1.00 0.04 C ATOM 1197 O ARG A 75 -12.830 -17.643 -10.200 1.00 42.44 O ATOM 1198 CB ARG A 75 -15.009 -19.968 -8.462 1.00 3.34 C ATOM 1199 CG ARG A 75 -16.091 -20.943 -8.898 1.00 61.00 C ATOM 1200 CD ARG A 75 -17.207 -21.026 -7.861 1.00 51.43 C ATOM 1201 NE ARG A 75 -17.711 -19.699 -7.515 1.00 55.33 N ATOM 1202 CZ ARG A 75 -18.549 -19.450 -6.551 1.00 44.13 C ATOM 1203 NH1 ARG A 75 -19.034 -20.407 -5.825 1.00 0.35 N ATOM 1204 NH2 ARG A 75 -18.897 -18.230 -6.315 1.00 34.12 N ATOM 0 H ARG A 75 -12.437 -20.869 -8.655 1.00 61.52 H new ATOM 0 HA ARG A 75 -14.412 -19.671 -10.510 1.00 11.34 H new ATOM 0 HB2 ARG A 75 -14.518 -20.365 -7.573 1.00 3.34 H new ATOM 0 HB3 ARG A 75 -15.480 -19.028 -8.173 1.00 3.34 H new ATOM 0 HG2 ARG A 75 -16.504 -20.628 -9.856 1.00 61.00 H new ATOM 0 HG3 ARG A 75 -15.656 -21.931 -9.048 1.00 61.00 H new ATOM 0 HD2 ARG A 75 -18.022 -21.637 -8.249 1.00 51.43 H new ATOM 0 HD3 ARG A 75 -16.836 -21.522 -6.964 1.00 51.43 H new ATOM 0 HE ARG A 75 -17.382 -18.909 -8.070 1.00 55.33 H new ATOM 0 HH11 ARG A 75 -18.760 -21.373 -6.005 1.00 0.35 H new ATOM 0 HH12 ARG A 75 -19.690 -20.195 -5.073 1.00 0.35 H new ATOM 0 HH21 ARG A 75 -18.516 -17.472 -6.882 1.00 34.12 H new ATOM 0 HH22 ARG A 75 -19.553 -18.023 -5.562 1.00 34.12 H new ATOM 1218 N GLU A 76 -13.362 -17.835 -8.016 1.00 72.22 N ATOM 1219 CA GLU A 76 -12.795 -16.537 -7.642 1.00 53.34 C ATOM 1220 C GLU A 76 -11.383 -16.701 -7.062 1.00 32.44 C ATOM 1221 O GLU A 76 -11.108 -17.644 -6.311 1.00 5.22 O ATOM 1222 CB GLU A 76 -13.687 -15.822 -6.610 1.00 53.12 C ATOM 1223 CG GLU A 76 -15.123 -15.554 -7.070 1.00 23.31 C ATOM 1224 CD GLU A 76 -15.996 -16.799 -7.107 1.00 52.15 C ATOM 1225 OE1 GLU A 76 -15.840 -17.662 -6.221 1.00 21.32 O ATOM 1226 OE2 GLU A 76 -16.844 -16.918 -8.023 1.00 35.14 O ATOM 0 H GLU A 76 -13.779 -18.349 -7.240 1.00 72.22 H new ATOM 0 HA GLU A 76 -12.742 -15.933 -8.548 1.00 53.34 H new ATOM 0 HB2 GLU A 76 -13.719 -16.423 -5.701 1.00 53.12 H new ATOM 0 HB3 GLU A 76 -13.222 -14.872 -6.347 1.00 53.12 H new ATOM 0 HG2 GLU A 76 -15.578 -14.822 -6.403 1.00 23.31 H new ATOM 0 HG3 GLU A 76 -15.099 -15.108 -8.064 1.00 23.31 H new ATOM 1233 N PHE A 77 -10.498 -15.780 -7.412 1.00 41.24 N ATOM 1234 CA PHE A 77 -9.117 -15.797 -6.929 1.00 5.33 C ATOM 1235 C PHE A 77 -8.828 -14.538 -6.085 1.00 2.21 C ATOM 1236 O PHE A 77 -8.786 -13.425 -6.613 1.00 10.11 O ATOM 1237 CB PHE A 77 -8.178 -15.880 -8.143 1.00 72.12 C ATOM 1238 CG PHE A 77 -6.773 -16.323 -7.830 1.00 3.25 C ATOM 1239 CD1 PHE A 77 -6.504 -17.649 -7.523 1.00 22.20 C ATOM 1240 CD2 PHE A 77 -5.720 -15.422 -7.861 1.00 5.34 C ATOM 1241 CE1 PHE A 77 -5.214 -18.065 -7.253 1.00 71.34 C ATOM 1242 CE2 PHE A 77 -4.433 -15.834 -7.590 1.00 33.01 C ATOM 1243 CZ PHE A 77 -4.178 -17.156 -7.285 1.00 55.51 C ATOM 0 H PHE A 77 -10.711 -15.001 -8.036 1.00 41.24 H new ATOM 0 HA PHE A 77 -8.954 -16.663 -6.288 1.00 5.33 H new ATOM 0 HB2 PHE A 77 -8.607 -16.570 -8.869 1.00 72.12 H new ATOM 0 HB3 PHE A 77 -8.137 -14.901 -8.619 1.00 72.12 H new ATOM 0 HD1 PHE A 77 -7.312 -18.365 -7.495 1.00 22.20 H new ATOM 0 HD2 PHE A 77 -5.910 -14.386 -8.100 1.00 5.34 H new ATOM 0 HE1 PHE A 77 -5.018 -19.101 -7.017 1.00 71.34 H new ATOM 0 HE2 PHE A 77 -3.622 -15.121 -7.616 1.00 33.01 H new ATOM 0 HZ PHE A 77 -3.169 -17.477 -7.072 1.00 55.51 H new ATOM 1253 N GLU A 78 -8.653 -14.714 -4.773 1.00 11.33 N ATOM 1254 CA GLU A 78 -8.455 -13.579 -3.858 1.00 54.42 C ATOM 1255 C GLU A 78 -7.038 -12.992 -3.966 1.00 21.30 C ATOM 1256 O GLU A 78 -6.052 -13.614 -3.555 1.00 63.51 O ATOM 1257 CB GLU A 78 -8.744 -13.989 -2.399 1.00 11.32 C ATOM 1258 CG GLU A 78 -8.473 -12.873 -1.380 1.00 22.13 C ATOM 1259 CD GLU A 78 -8.822 -13.250 0.059 1.00 40.14 C ATOM 1260 OE1 GLU A 78 -8.386 -14.326 0.527 1.00 42.10 O ATOM 1261 OE2 GLU A 78 -9.509 -12.459 0.745 1.00 4.45 O ATOM 0 H GLU A 78 -8.644 -15.627 -4.318 1.00 11.33 H new ATOM 0 HA GLU A 78 -9.163 -12.806 -4.157 1.00 54.42 H new ATOM 0 HB2 GLU A 78 -9.786 -14.299 -2.317 1.00 11.32 H new ATOM 0 HB3 GLU A 78 -8.133 -14.856 -2.147 1.00 11.32 H new ATOM 0 HG2 GLU A 78 -7.419 -12.599 -1.428 1.00 22.13 H new ATOM 0 HG3 GLU A 78 -9.045 -11.990 -1.663 1.00 22.13 H new ATOM 1268 N LEU A 79 -6.947 -11.798 -4.547 1.00 1.31 N ATOM 1269 CA LEU A 79 -5.700 -11.026 -4.555 1.00 64.21 C ATOM 1270 C LEU A 79 -5.632 -10.149 -3.296 1.00 62.14 C ATOM 1271 O LEU A 79 -6.333 -9.140 -3.204 1.00 3.40 O ATOM 1272 CB LEU A 79 -5.625 -10.144 -5.813 1.00 14.15 C ATOM 1273 CG LEU A 79 -5.785 -10.888 -7.148 1.00 34.13 C ATOM 1274 CD1 LEU A 79 -5.732 -9.913 -8.323 1.00 14.34 C ATOM 1275 CD2 LEU A 79 -4.720 -11.972 -7.293 1.00 71.24 C ATOM 0 H LEU A 79 -7.725 -11.339 -5.022 1.00 1.31 H new ATOM 0 HA LEU A 79 -4.856 -11.715 -4.563 1.00 64.21 H new ATOM 0 HB2 LEU A 79 -6.399 -9.379 -5.747 1.00 14.15 H new ATOM 0 HB3 LEU A 79 -4.666 -9.627 -5.817 1.00 14.15 H new ATOM 0 HG LEU A 79 -6.763 -11.370 -7.153 1.00 34.13 H new ATOM 0 HD11 LEU A 79 -5.847 -10.463 -9.257 1.00 14.34 H new ATOM 0 HD12 LEU A 79 -6.538 -9.185 -8.228 1.00 14.34 H new ATOM 0 HD13 LEU A 79 -4.773 -9.395 -8.323 1.00 14.34 H new ATOM 0 HD21 LEU A 79 -4.852 -12.486 -8.245 1.00 71.24 H new ATOM 0 HD22 LEU A 79 -3.730 -11.516 -7.260 1.00 71.24 H new ATOM 0 HD23 LEU A 79 -4.817 -12.688 -6.477 1.00 71.24 H new ATOM 1287 N VAL A 80 -4.808 -10.543 -2.324 1.00 63.50 N ATOM 1288 CA VAL A 80 -4.766 -9.862 -1.021 1.00 4.41 C ATOM 1289 C VAL A 80 -3.410 -9.176 -0.746 1.00 11.12 C ATOM 1290 O VAL A 80 -2.375 -9.832 -0.583 1.00 64.21 O ATOM 1291 CB VAL A 80 -5.117 -10.842 0.137 1.00 64.23 C ATOM 1292 CG1 VAL A 80 -4.209 -12.072 0.124 1.00 22.13 C ATOM 1293 CG2 VAL A 80 -5.055 -10.135 1.493 1.00 22.44 C ATOM 0 H VAL A 80 -4.161 -11.327 -2.410 1.00 63.50 H new ATOM 0 HA VAL A 80 -5.521 -9.077 -1.064 1.00 4.41 H new ATOM 0 HB VAL A 80 -6.140 -11.183 -0.022 1.00 64.23 H new ATOM 0 HG11 VAL A 80 -4.482 -12.734 0.946 1.00 22.13 H new ATOM 0 HG12 VAL A 80 -4.326 -12.600 -0.822 1.00 22.13 H new ATOM 0 HG13 VAL A 80 -3.171 -11.759 0.239 1.00 22.13 H new ATOM 0 HG21 VAL A 80 -5.304 -10.842 2.284 1.00 22.44 H new ATOM 0 HG22 VAL A 80 -4.049 -9.748 1.656 1.00 22.44 H new ATOM 0 HG23 VAL A 80 -5.767 -9.310 1.506 1.00 22.44 H new ATOM 1303 N TYR A 81 -3.436 -7.845 -0.686 1.00 41.24 N ATOM 1304 CA TYR A 81 -2.245 -7.042 -0.372 1.00 22.42 C ATOM 1305 C TYR A 81 -2.355 -6.465 1.049 1.00 2.52 C ATOM 1306 O TYR A 81 -3.330 -5.790 1.382 1.00 45.13 O ATOM 1307 CB TYR A 81 -2.100 -5.911 -1.402 1.00 35.24 C ATOM 1308 CG TYR A 81 -0.768 -5.181 -1.366 1.00 22.14 C ATOM 1309 CD1 TYR A 81 0.389 -5.796 -1.829 1.00 23.01 C ATOM 1310 CD2 TYR A 81 -0.665 -3.879 -0.879 1.00 34.43 C ATOM 1311 CE1 TYR A 81 1.605 -5.141 -1.811 1.00 2.32 C ATOM 1312 CE2 TYR A 81 0.549 -3.216 -0.860 1.00 62.10 C ATOM 1313 CZ TYR A 81 1.681 -3.852 -1.324 1.00 63.21 C ATOM 1314 OH TYR A 81 2.892 -3.196 -1.312 1.00 74.52 O ATOM 0 H TYR A 81 -4.276 -7.291 -0.852 1.00 41.24 H new ATOM 0 HA TYR A 81 -1.360 -7.677 -0.417 1.00 22.42 H new ATOM 0 HB2 TYR A 81 -2.243 -6.327 -2.399 1.00 35.24 H new ATOM 0 HB3 TYR A 81 -2.899 -5.187 -1.241 1.00 35.24 H new ATOM 0 HD1 TYR A 81 0.336 -6.805 -2.210 1.00 23.01 H new ATOM 0 HD2 TYR A 81 -1.548 -3.379 -0.510 1.00 34.43 H new ATOM 0 HE1 TYR A 81 2.493 -5.636 -2.177 1.00 2.32 H new ATOM 0 HE2 TYR A 81 0.610 -2.206 -0.484 1.00 62.10 H new ATOM 0 HH TYR A 81 3.168 -3.002 -2.232 1.00 74.52 H new ATOM 1324 N ARG A 82 -1.357 -6.738 1.886 1.00 73.02 N ATOM 1325 CA ARG A 82 -1.394 -6.342 3.300 1.00 54.02 C ATOM 1326 C ARG A 82 -0.277 -5.344 3.644 1.00 64.22 C ATOM 1327 O ARG A 82 0.908 -5.664 3.547 1.00 1.13 O ATOM 1328 CB ARG A 82 -1.259 -7.584 4.191 1.00 30.24 C ATOM 1329 CG ARG A 82 -2.209 -8.721 3.822 1.00 30.21 C ATOM 1330 CD ARG A 82 -2.025 -9.926 4.738 1.00 74.43 C ATOM 1331 NE ARG A 82 -2.837 -11.074 4.324 1.00 24.44 N ATOM 1332 CZ ARG A 82 -3.734 -11.647 5.078 1.00 43.34 C ATOM 1333 NH1 ARG A 82 -4.019 -11.160 6.241 1.00 62.54 N ATOM 1334 NH2 ARG A 82 -4.349 -12.703 4.660 1.00 45.35 N ATOM 0 H ARG A 82 -0.508 -7.233 1.613 1.00 73.02 H new ATOM 0 HA ARG A 82 -2.351 -5.852 3.480 1.00 54.02 H new ATOM 0 HB2 ARG A 82 -0.233 -7.949 4.135 1.00 30.24 H new ATOM 0 HB3 ARG A 82 -1.439 -7.296 5.227 1.00 30.24 H new ATOM 0 HG2 ARG A 82 -3.239 -8.370 3.884 1.00 30.21 H new ATOM 0 HG3 ARG A 82 -2.036 -9.019 2.788 1.00 30.21 H new ATOM 0 HD2 ARG A 82 -0.974 -10.213 4.748 1.00 74.43 H new ATOM 0 HD3 ARG A 82 -2.289 -9.647 5.758 1.00 74.43 H new ATOM 0 HE ARG A 82 -2.691 -11.449 3.387 1.00 24.44 H new ATOM 0 HH11 ARG A 82 -3.541 -10.323 6.574 1.00 62.54 H new ATOM 0 HH12 ARG A 82 -4.722 -11.613 6.825 1.00 62.54 H new ATOM 0 HH21 ARG A 82 -4.133 -13.089 3.741 1.00 45.35 H new ATOM 0 HH22 ARG A 82 -5.050 -13.151 5.249 1.00 45.35 H new ATOM 1348 N VAL A 83 -0.662 -4.139 4.055 1.00 3.15 N ATOM 1349 CA VAL A 83 0.303 -3.115 4.474 1.00 44.14 C ATOM 1350 C VAL A 83 0.293 -2.941 6.002 1.00 54.21 C ATOM 1351 O VAL A 83 -0.764 -2.971 6.628 1.00 71.14 O ATOM 1352 CB VAL A 83 0.001 -1.747 3.809 1.00 33.12 C ATOM 1353 CG1 VAL A 83 1.050 -0.707 4.199 1.00 35.22 C ATOM 1354 CG2 VAL A 83 -0.090 -1.893 2.290 1.00 11.20 C ATOM 0 H VAL A 83 -1.637 -3.843 4.109 1.00 3.15 H new ATOM 0 HA VAL A 83 1.287 -3.456 4.154 1.00 44.14 H new ATOM 0 HB VAL A 83 -0.965 -1.398 4.173 1.00 33.12 H new ATOM 0 HG11 VAL A 83 0.816 0.244 3.720 1.00 35.22 H new ATOM 0 HG12 VAL A 83 1.049 -0.578 5.281 1.00 35.22 H new ATOM 0 HG13 VAL A 83 2.035 -1.044 3.875 1.00 35.22 H new ATOM 0 HG21 VAL A 83 -0.302 -0.922 1.843 1.00 11.20 H new ATOM 0 HG22 VAL A 83 0.856 -2.271 1.903 1.00 11.20 H new ATOM 0 HG23 VAL A 83 -0.889 -2.591 2.039 1.00 11.20 H new ATOM 1364 N ALA A 84 1.475 -2.771 6.596 1.00 2.40 N ATOM 1365 CA ALA A 84 1.596 -2.537 8.044 1.00 41.11 C ATOM 1366 C ALA A 84 2.635 -1.443 8.337 1.00 41.03 C ATOM 1367 O ALA A 84 3.740 -1.472 7.792 1.00 71.21 O ATOM 1368 CB ALA A 84 1.968 -3.833 8.759 1.00 74.42 C ATOM 0 H ALA A 84 2.366 -2.790 6.100 1.00 2.40 H new ATOM 0 HA ALA A 84 0.631 -2.195 8.418 1.00 41.11 H new ATOM 0 HB1 ALA A 84 2.054 -3.646 9.829 1.00 74.42 H new ATOM 0 HB2 ALA A 84 1.195 -4.581 8.582 1.00 74.42 H new ATOM 0 HB3 ALA A 84 2.921 -4.199 8.377 1.00 74.42 H new ATOM 1374 N ALA A 85 2.281 -0.489 9.204 1.00 75.52 N ATOM 1375 CA ALA A 85 3.163 0.649 9.513 1.00 12.01 C ATOM 1376 C ALA A 85 2.731 1.389 10.794 1.00 73.41 C ATOM 1377 O ALA A 85 1.633 1.178 11.307 1.00 31.24 O ATOM 1378 CB ALA A 85 3.192 1.619 8.334 1.00 0.43 C ATOM 0 H ALA A 85 1.393 -0.479 9.705 1.00 75.52 H new ATOM 0 HA ALA A 85 4.163 0.251 9.688 1.00 12.01 H new ATOM 0 HB1 ALA A 85 3.846 2.458 8.569 1.00 0.43 H new ATOM 0 HB2 ALA A 85 3.566 1.105 7.449 1.00 0.43 H new ATOM 0 HB3 ALA A 85 2.184 1.987 8.141 1.00 0.43 H new ATOM 1384 N ARG A 86 3.614 2.251 11.308 1.00 74.32 N ATOM 1385 CA ARG A 86 3.302 3.114 12.459 1.00 43.32 C ATOM 1386 C ARG A 86 3.773 4.555 12.203 1.00 72.34 C ATOM 1387 O ARG A 86 4.667 4.790 11.386 1.00 64.22 O ATOM 1388 CB ARG A 86 3.937 2.566 13.748 1.00 72.43 C ATOM 1389 CG ARG A 86 3.370 1.217 14.180 1.00 41.41 C ATOM 1390 CD ARG A 86 3.882 0.787 15.552 1.00 43.41 C ATOM 1391 NE ARG A 86 3.352 -0.520 15.947 1.00 34.40 N ATOM 1392 CZ ARG A 86 2.836 -0.791 17.118 1.00 24.35 C ATOM 1393 NH1 ARG A 86 2.737 0.124 18.033 1.00 21.14 N ATOM 1394 NH2 ARG A 86 2.415 -1.986 17.369 1.00 24.53 N ATOM 0 H ARG A 86 4.559 2.372 10.944 1.00 74.32 H new ATOM 0 HA ARG A 86 2.220 3.120 12.587 1.00 43.32 H new ATOM 0 HB2 ARG A 86 5.013 2.469 13.601 1.00 72.43 H new ATOM 0 HB3 ARG A 86 3.789 3.287 14.552 1.00 72.43 H new ATOM 0 HG2 ARG A 86 2.282 1.273 14.202 1.00 41.41 H new ATOM 0 HG3 ARG A 86 3.636 0.460 13.442 1.00 41.41 H new ATOM 0 HD2 ARG A 86 4.971 0.748 15.537 1.00 43.41 H new ATOM 0 HD3 ARG A 86 3.600 1.533 16.295 1.00 43.41 H new ATOM 0 HE ARG A 86 3.388 -1.273 15.260 1.00 34.40 H new ATOM 0 HH11 ARG A 86 3.064 1.071 17.844 1.00 21.14 H new ATOM 0 HH12 ARG A 86 2.332 -0.104 18.941 1.00 21.14 H new ATOM 0 HH21 ARG A 86 2.486 -2.712 16.656 1.00 24.53 H new ATOM 0 HH22 ARG A 86 2.012 -2.204 18.280 1.00 24.53 H new ATOM 1408 N LEU A 87 3.178 5.515 12.912 1.00 5.01 N ATOM 1409 CA LEU A 87 3.444 6.938 12.666 1.00 24.13 C ATOM 1410 C LEU A 87 4.040 7.618 13.917 1.00 2.14 C ATOM 1411 O LEU A 87 3.375 7.756 14.947 1.00 22.13 O ATOM 1412 CB LEU A 87 2.134 7.621 12.237 1.00 11.04 C ATOM 1413 CG LEU A 87 2.273 8.883 11.364 1.00 61.31 C ATOM 1414 CD1 LEU A 87 0.929 9.222 10.724 1.00 23.30 C ATOM 1415 CD2 LEU A 87 2.794 10.070 12.175 1.00 32.10 C ATOM 0 H LEU A 87 2.509 5.336 13.661 1.00 5.01 H new ATOM 0 HA LEU A 87 4.181 7.034 11.869 1.00 24.13 H new ATOM 0 HB2 LEU A 87 1.532 6.894 11.692 1.00 11.04 H new ATOM 0 HB3 LEU A 87 1.577 7.887 13.136 1.00 11.04 H new ATOM 0 HG LEU A 87 3.001 8.676 10.580 1.00 61.31 H new ATOM 0 HD11 LEU A 87 1.034 10.115 10.108 1.00 23.30 H new ATOM 0 HD12 LEU A 87 0.602 8.389 10.102 1.00 23.30 H new ATOM 0 HD13 LEU A 87 0.190 9.404 11.504 1.00 23.30 H new ATOM 0 HD21 LEU A 87 2.880 10.943 11.528 1.00 32.10 H new ATOM 0 HD22 LEU A 87 2.101 10.287 12.988 1.00 32.10 H new ATOM 0 HD23 LEU A 87 3.773 9.827 12.588 1.00 32.10 H new ATOM 1427 N LEU A 88 5.302 8.035 13.817 1.00 52.11 N ATOM 1428 CA LEU A 88 6.011 8.683 14.933 1.00 62.04 C ATOM 1429 C LEU A 88 6.511 10.079 14.518 1.00 63.42 C ATOM 1430 O LEU A 88 6.327 10.492 13.375 1.00 50.42 O ATOM 1431 CB LEU A 88 7.207 7.816 15.388 1.00 53.51 C ATOM 1432 CG LEU A 88 6.884 6.353 15.779 1.00 34.31 C ATOM 1433 CD1 LEU A 88 6.649 5.485 14.543 1.00 52.22 C ATOM 1434 CD2 LEU A 88 8.001 5.763 16.635 1.00 54.53 C ATOM 0 H LEU A 88 5.862 7.937 12.970 1.00 52.11 H new ATOM 0 HA LEU A 88 5.313 8.790 15.763 1.00 62.04 H new ATOM 0 HB2 LEU A 88 7.944 7.801 14.585 1.00 53.51 H new ATOM 0 HB3 LEU A 88 7.677 8.303 16.243 1.00 53.51 H new ATOM 0 HG LEU A 88 5.964 6.364 16.364 1.00 34.31 H new ATOM 0 HD11 LEU A 88 6.425 4.464 14.853 1.00 52.22 H new ATOM 0 HD12 LEU A 88 5.810 5.884 13.972 1.00 52.22 H new ATOM 0 HD13 LEU A 88 7.544 5.487 13.921 1.00 52.22 H new ATOM 0 HD21 LEU A 88 7.753 4.735 16.898 1.00 54.53 H new ATOM 0 HD22 LEU A 88 8.936 5.779 16.075 1.00 54.53 H new ATOM 0 HD23 LEU A 88 8.113 6.353 17.544 1.00 54.53 H new ATOM 1446 N ASP A 89 7.118 10.820 15.449 1.00 51.24 N ATOM 1447 CA ASP A 89 7.756 12.108 15.112 1.00 30.21 C ATOM 1448 C ASP A 89 9.289 11.967 15.018 1.00 32.21 C ATOM 1449 O ASP A 89 9.829 10.867 15.129 1.00 15.21 O ATOM 1450 CB ASP A 89 7.387 13.185 16.141 1.00 13.24 C ATOM 1451 CG ASP A 89 8.048 12.963 17.487 1.00 20.25 C ATOM 1452 OD1 ASP A 89 7.543 12.147 18.271 1.00 51.11 O ATOM 1453 OD2 ASP A 89 9.085 13.607 17.757 1.00 41.12 O ATOM 0 H ASP A 89 7.184 10.559 16.433 1.00 51.24 H new ATOM 0 HA ASP A 89 7.381 12.414 14.135 1.00 30.21 H new ATOM 0 HB2 ASP A 89 7.676 14.163 15.756 1.00 13.24 H new ATOM 0 HB3 ASP A 89 6.305 13.201 16.271 1.00 13.24 H new ATOM 1458 N ALA A 90 9.984 13.094 14.829 1.00 11.00 N ATOM 1459 CA ALA A 90 11.447 13.100 14.651 1.00 23.23 C ATOM 1460 C ALA A 90 12.203 12.448 15.828 1.00 11.11 C ATOM 1461 O ALA A 90 13.291 11.896 15.650 1.00 34.22 O ATOM 1462 CB ALA A 90 11.938 14.527 14.445 1.00 51.34 C ATOM 0 H ALA A 90 9.558 14.020 14.795 1.00 11.00 H new ATOM 0 HA ALA A 90 11.660 12.498 13.768 1.00 23.23 H new ATOM 0 HB1 ALA A 90 13.020 14.524 14.314 1.00 51.34 H new ATOM 0 HB2 ALA A 90 11.466 14.950 13.558 1.00 51.34 H new ATOM 0 HB3 ALA A 90 11.679 15.130 15.315 1.00 51.34 H new ATOM 1468 N HIS A 91 11.626 12.522 17.027 1.00 2.51 N ATOM 1469 CA HIS A 91 12.228 11.921 18.226 1.00 24.23 C ATOM 1470 C HIS A 91 11.688 10.501 18.487 1.00 42.13 C ATOM 1471 O HIS A 91 11.842 9.959 19.584 1.00 42.13 O ATOM 1472 CB HIS A 91 11.988 12.819 19.450 1.00 41.33 C ATOM 1473 CG HIS A 91 12.778 14.094 19.418 1.00 24.44 C ATOM 1474 ND1 HIS A 91 13.823 14.349 20.277 1.00 62.25 N ATOM 1475 CD2 HIS A 91 12.681 15.185 18.622 1.00 44.32 C ATOM 1476 CE1 HIS A 91 14.334 15.531 20.012 1.00 71.12 C ATOM 1477 NE2 HIS A 91 13.664 16.063 19.009 1.00 61.43 N ATOM 0 H HIS A 91 10.738 12.994 17.198 1.00 2.51 H new ATOM 0 HA HIS A 91 13.300 11.837 18.050 1.00 24.23 H new ATOM 0 HB2 HIS A 91 10.927 13.059 19.512 1.00 41.33 H new ATOM 0 HB3 HIS A 91 12.243 12.265 20.353 1.00 41.33 H new ATOM 0 HD2 HIS A 91 11.963 15.337 17.829 1.00 44.32 H new ATOM 0 HE1 HIS A 91 15.164 15.989 20.529 1.00 71.12 H new ATOM 0 HE2 HIS A 91 13.845 16.975 18.590 1.00 61.43 H new ATOM 1486 N ASN A 92 11.060 9.910 17.470 1.00 5.15 N ATOM 1487 CA ASN A 92 10.604 8.512 17.515 1.00 54.23 C ATOM 1488 C ASN A 92 9.561 8.255 18.620 1.00 11.43 C ATOM 1489 O ASN A 92 9.427 7.130 19.108 1.00 31.12 O ATOM 1490 CB ASN A 92 11.802 7.567 17.692 1.00 71.24 C ATOM 1491 CG ASN A 92 12.812 7.707 16.567 1.00 15.35 C ATOM 1492 OD1 ASN A 92 13.729 8.518 16.636 1.00 72.01 O ATOM 1493 ND2 ASN A 92 12.659 6.921 15.520 1.00 51.23 N ATOM 0 H ASN A 92 10.851 10.383 16.591 1.00 5.15 H new ATOM 0 HA ASN A 92 10.113 8.312 16.563 1.00 54.23 H new ATOM 0 HB2 ASN A 92 12.290 7.775 18.644 1.00 71.24 H new ATOM 0 HB3 ASN A 92 11.447 6.537 17.734 1.00 71.24 H new ATOM 0 HD21 ASN A 92 13.313 6.978 14.739 1.00 51.23 H new ATOM 0 HD22 ASN A 92 11.886 6.256 15.490 1.00 51.23 H new ATOM 1500 N ALA A 93 8.807 9.284 19.001 1.00 3.03 N ATOM 1501 CA ALA A 93 7.704 9.108 19.952 1.00 13.25 C ATOM 1502 C ALA A 93 6.406 8.763 19.205 1.00 70.14 C ATOM 1503 O ALA A 93 6.146 9.280 18.114 1.00 53.22 O ATOM 1504 CB ALA A 93 7.522 10.355 20.813 1.00 74.01 C ATOM 0 H ALA A 93 8.935 10.241 18.671 1.00 3.03 H new ATOM 0 HA ALA A 93 7.951 8.279 20.615 1.00 13.25 H new ATOM 0 HB1 ALA A 93 6.698 10.199 21.510 1.00 74.01 H new ATOM 0 HB2 ALA A 93 8.438 10.548 21.371 1.00 74.01 H new ATOM 0 HB3 ALA A 93 7.300 11.209 20.174 1.00 74.01 H new ATOM 1510 N GLU A 94 5.596 7.882 19.788 1.00 34.11 N ATOM 1511 CA GLU A 94 4.392 7.383 19.114 1.00 63.53 C ATOM 1512 C GLU A 94 3.301 8.464 18.967 1.00 74.12 C ATOM 1513 O GLU A 94 2.469 8.663 19.857 1.00 65.32 O ATOM 1514 CB GLU A 94 3.836 6.153 19.850 1.00 3.23 C ATOM 1515 CG GLU A 94 3.580 6.375 21.339 1.00 74.43 C ATOM 1516 CD GLU A 94 2.865 5.203 21.989 1.00 64.34 C ATOM 1517 OE1 GLU A 94 1.617 5.154 21.919 1.00 1.21 O ATOM 1518 OE2 GLU A 94 3.543 4.322 22.556 1.00 74.23 O ATOM 0 H GLU A 94 5.747 7.498 20.721 1.00 34.11 H new ATOM 0 HA GLU A 94 4.689 7.095 18.106 1.00 63.53 H new ATOM 0 HB2 GLU A 94 2.903 5.850 19.374 1.00 3.23 H new ATOM 0 HB3 GLU A 94 4.537 5.326 19.733 1.00 3.23 H new ATOM 0 HG2 GLU A 94 4.530 6.543 21.846 1.00 74.43 H new ATOM 0 HG3 GLU A 94 2.984 7.278 21.471 1.00 74.43 H new ATOM 1525 N LEU A 95 3.323 9.166 17.836 1.00 10.24 N ATOM 1526 CA LEU A 95 2.271 10.130 17.501 1.00 13.02 C ATOM 1527 C LEU A 95 0.929 9.420 17.277 1.00 4.23 C ATOM 1528 O LEU A 95 -0.111 9.858 17.777 1.00 41.31 O ATOM 1529 CB LEU A 95 2.648 10.928 16.243 1.00 22.41 C ATOM 1530 CG LEU A 95 3.782 11.950 16.409 1.00 74.31 C ATOM 1531 CD1 LEU A 95 4.006 12.719 15.106 1.00 52.54 C ATOM 1532 CD2 LEU A 95 3.483 12.906 17.562 1.00 33.04 C ATOM 0 H LEU A 95 4.058 9.087 17.133 1.00 10.24 H new ATOM 0 HA LEU A 95 2.170 10.816 18.342 1.00 13.02 H new ATOM 0 HB2 LEU A 95 2.932 10.223 15.461 1.00 22.41 H new ATOM 0 HB3 LEU A 95 1.760 11.454 15.891 1.00 22.41 H new ATOM 0 HG LEU A 95 4.699 11.411 16.648 1.00 74.31 H new ATOM 0 HD11 LEU A 95 4.813 13.439 15.242 1.00 52.54 H new ATOM 0 HD12 LEU A 95 4.273 12.021 14.313 1.00 52.54 H new ATOM 0 HD13 LEU A 95 3.092 13.246 14.833 1.00 52.54 H new ATOM 0 HD21 LEU A 95 4.299 13.622 17.662 1.00 33.04 H new ATOM 0 HD22 LEU A 95 2.555 13.440 17.360 1.00 33.04 H new ATOM 0 HD23 LEU A 95 3.382 12.339 18.488 1.00 33.04 H new ATOM 1544 N ALA A 96 0.965 8.321 16.522 1.00 62.41 N ATOM 1545 CA ALA A 96 -0.238 7.540 16.231 1.00 72.24 C ATOM 1546 C ALA A 96 0.107 6.118 15.762 1.00 63.23 C ATOM 1547 O ALA A 96 0.863 5.932 14.803 1.00 53.54 O ATOM 1548 CB ALA A 96 -1.084 8.251 15.178 1.00 1.21 C ATOM 0 H ALA A 96 1.817 7.951 16.100 1.00 62.41 H new ATOM 0 HA ALA A 96 -0.809 7.454 17.155 1.00 72.24 H new ATOM 0 HB1 ALA A 96 -1.976 7.661 14.969 1.00 1.21 H new ATOM 0 HB2 ALA A 96 -1.377 9.233 15.549 1.00 1.21 H new ATOM 0 HB3 ALA A 96 -0.504 8.367 14.263 1.00 1.21 H new ATOM 1554 N SER A 97 -0.438 5.114 16.442 1.00 13.03 N ATOM 1555 CA SER A 97 -0.263 3.718 16.025 1.00 21.34 C ATOM 1556 C SER A 97 -1.129 3.418 14.794 1.00 71.41 C ATOM 1557 O SER A 97 -2.323 3.131 14.909 1.00 61.51 O ATOM 1558 CB SER A 97 -0.614 2.752 17.164 1.00 12.42 C ATOM 1559 OG SER A 97 -0.343 1.407 16.799 1.00 64.13 O ATOM 0 H SER A 97 -1.004 5.235 17.282 1.00 13.03 H new ATOM 0 HA SER A 97 0.786 3.573 15.767 1.00 21.34 H new ATOM 0 HB2 SER A 97 -0.042 3.012 18.054 1.00 12.42 H new ATOM 0 HB3 SER A 97 -1.668 2.856 17.421 1.00 12.42 H new ATOM 0 HG SER A 97 -0.574 0.813 17.543 1.00 64.13 H new ATOM 1565 N LEU A 98 -0.523 3.522 13.614 1.00 33.13 N ATOM 1566 CA LEU A 98 -1.239 3.329 12.352 1.00 52.54 C ATOM 1567 C LEU A 98 -1.655 1.857 12.163 1.00 23.42 C ATOM 1568 O LEU A 98 -0.908 0.934 12.493 1.00 32.12 O ATOM 1569 CB LEU A 98 -0.370 3.824 11.183 1.00 3.54 C ATOM 1570 CG LEU A 98 -1.047 3.856 9.801 1.00 64.34 C ATOM 1571 CD1 LEU A 98 -2.357 4.643 9.851 1.00 40.01 C ATOM 1572 CD2 LEU A 98 -0.104 4.462 8.762 1.00 72.52 C ATOM 0 H LEU A 98 0.467 3.740 13.504 1.00 33.13 H new ATOM 0 HA LEU A 98 -2.157 3.916 12.376 1.00 52.54 H new ATOM 0 HB2 LEU A 98 -0.021 4.830 11.417 1.00 3.54 H new ATOM 0 HB3 LEU A 98 0.512 3.187 11.118 1.00 3.54 H new ATOM 0 HG LEU A 98 -1.277 2.831 9.512 1.00 64.34 H new ATOM 0 HD11 LEU A 98 -2.815 4.650 8.862 1.00 40.01 H new ATOM 0 HD12 LEU A 98 -3.037 4.173 10.562 1.00 40.01 H new ATOM 0 HD13 LEU A 98 -2.154 5.667 10.165 1.00 40.01 H new ATOM 0 HD21 LEU A 98 -0.596 4.478 7.790 1.00 72.52 H new ATOM 0 HD22 LEU A 98 0.154 5.480 9.055 1.00 72.52 H new ATOM 0 HD23 LEU A 98 0.803 3.861 8.700 1.00 72.52 H new ATOM 1584 N GLN A 99 -2.865 1.655 11.640 1.00 30.00 N ATOM 1585 CA GLN A 99 -3.454 0.315 11.502 1.00 2.33 C ATOM 1586 C GLN A 99 -2.885 -0.461 10.301 1.00 55.32 C ATOM 1587 O GLN A 99 -2.162 0.091 9.469 1.00 21.43 O ATOM 1588 CB GLN A 99 -4.978 0.443 11.345 1.00 10.04 C ATOM 1589 CG GLN A 99 -5.395 1.211 10.090 1.00 33.00 C ATOM 1590 CD GLN A 99 -6.899 1.310 9.923 1.00 71.12 C ATOM 1591 OE1 GLN A 99 -7.534 2.245 10.403 1.00 15.21 O ATOM 1592 NE2 GLN A 99 -7.482 0.350 9.237 1.00 74.35 N ATOM 0 H GLN A 99 -3.464 2.408 11.301 1.00 30.00 H new ATOM 0 HA GLN A 99 -3.202 -0.245 12.402 1.00 2.33 H new ATOM 0 HB2 GLN A 99 -5.418 -0.554 11.315 1.00 10.04 H new ATOM 0 HB3 GLN A 99 -5.386 0.946 12.222 1.00 10.04 H new ATOM 0 HG2 GLN A 99 -4.973 2.215 10.130 1.00 33.00 H new ATOM 0 HG3 GLN A 99 -4.970 0.721 9.214 1.00 33.00 H new ATOM 0 HE21 GLN A 99 -6.925 -0.412 8.852 1.00 74.35 H new ATOM 0 HE22 GLN A 99 -8.491 0.368 9.091 1.00 74.35 H new ATOM 1601 N GLU A 100 -3.223 -1.750 10.226 1.00 1.42 N ATOM 1602 CA GLU A 100 -2.876 -2.579 9.066 1.00 60.41 C ATOM 1603 C GLU A 100 -3.960 -2.469 7.983 1.00 21.04 C ATOM 1604 O GLU A 100 -5.143 -2.271 8.284 1.00 5.30 O ATOM 1605 CB GLU A 100 -2.694 -4.053 9.473 1.00 13.41 C ATOM 1606 CG GLU A 100 -3.953 -4.708 10.038 1.00 25.43 C ATOM 1607 CD GLU A 100 -3.768 -6.188 10.342 1.00 74.35 C ATOM 1608 OE1 GLU A 100 -3.174 -6.517 11.387 1.00 1.33 O ATOM 1609 OE2 GLU A 100 -4.223 -7.032 9.534 1.00 50.02 O ATOM 0 H GLU A 100 -3.737 -2.244 10.955 1.00 1.42 H new ATOM 0 HA GLU A 100 -1.931 -2.211 8.665 1.00 60.41 H new ATOM 0 HB2 GLU A 100 -2.363 -4.620 8.603 1.00 13.41 H new ATOM 0 HB3 GLU A 100 -1.900 -4.117 10.217 1.00 13.41 H new ATOM 0 HG2 GLU A 100 -4.248 -4.189 10.950 1.00 25.43 H new ATOM 0 HG3 GLU A 100 -4.769 -4.588 9.326 1.00 25.43 H new ATOM 1616 N ILE A 101 -3.555 -2.594 6.724 1.00 72.32 N ATOM 1617 CA ILE A 101 -4.481 -2.462 5.593 1.00 1.41 C ATOM 1618 C ILE A 101 -4.549 -3.758 4.766 1.00 3.44 C ATOM 1619 O ILE A 101 -3.609 -4.093 4.044 1.00 75.12 O ATOM 1620 CB ILE A 101 -4.063 -1.286 4.668 1.00 74.43 C ATOM 1621 CG1 ILE A 101 -3.915 0.011 5.484 1.00 65.10 C ATOM 1622 CG2 ILE A 101 -5.074 -1.101 3.534 1.00 74.10 C ATOM 1623 CD1 ILE A 101 -3.446 1.201 4.672 1.00 12.42 C ATOM 0 H ILE A 101 -2.590 -2.787 6.455 1.00 72.32 H new ATOM 0 HA ILE A 101 -5.467 -2.260 6.011 1.00 1.41 H new ATOM 0 HB ILE A 101 -3.097 -1.525 4.223 1.00 74.43 H new ATOM 0 HG12 ILE A 101 -4.875 0.252 5.941 1.00 65.10 H new ATOM 0 HG13 ILE A 101 -3.209 -0.162 6.297 1.00 65.10 H new ATOM 0 HG21 ILE A 101 -4.761 -0.272 2.899 1.00 74.10 H new ATOM 0 HG22 ILE A 101 -5.126 -2.014 2.940 1.00 74.10 H new ATOM 0 HG23 ILE A 101 -6.056 -0.885 3.954 1.00 74.10 H new ATOM 0 HD11 ILE A 101 -3.367 2.075 5.319 1.00 12.42 H new ATOM 0 HD12 ILE A 101 -2.471 0.983 4.236 1.00 12.42 H new ATOM 0 HD13 ILE A 101 -4.162 1.403 3.875 1.00 12.42 H new ATOM 1635 N ARG A 102 -5.659 -4.491 4.882 1.00 5.23 N ATOM 1636 CA ARG A 102 -5.863 -5.714 4.092 1.00 4.12 C ATOM 1637 C ARG A 102 -6.746 -5.427 2.865 1.00 12.01 C ATOM 1638 O ARG A 102 -7.972 -5.376 2.974 1.00 44.03 O ATOM 1639 CB ARG A 102 -6.508 -6.821 4.949 1.00 2.44 C ATOM 1640 CG ARG A 102 -6.569 -8.180 4.245 1.00 72.42 C ATOM 1641 CD ARG A 102 -7.403 -9.205 5.020 1.00 32.10 C ATOM 1642 NE ARG A 102 -7.304 -10.546 4.439 1.00 73.33 N ATOM 1643 CZ ARG A 102 -8.114 -11.030 3.530 1.00 15.24 C ATOM 1644 NH1 ARG A 102 -9.137 -10.357 3.123 1.00 71.54 N ATOM 1645 NH2 ARG A 102 -7.916 -12.213 3.056 1.00 20.52 N ATOM 0 H ARG A 102 -6.429 -4.263 5.511 1.00 5.23 H new ATOM 0 HA ARG A 102 -4.886 -6.058 3.753 1.00 4.12 H new ATOM 0 HB2 ARG A 102 -5.945 -6.926 5.877 1.00 2.44 H new ATOM 0 HB3 ARG A 102 -7.518 -6.516 5.222 1.00 2.44 H new ATOM 0 HG2 ARG A 102 -6.992 -8.051 3.249 1.00 72.42 H new ATOM 0 HG3 ARG A 102 -5.557 -8.564 4.114 1.00 72.42 H new ATOM 0 HD2 ARG A 102 -7.069 -9.234 6.057 1.00 32.10 H new ATOM 0 HD3 ARG A 102 -8.447 -8.890 5.030 1.00 32.10 H new ATOM 0 HE ARG A 102 -6.548 -11.148 4.766 1.00 73.33 H new ATOM 0 HH11 ARG A 102 -9.326 -9.432 3.510 1.00 71.54 H new ATOM 0 HH12 ARG A 102 -9.757 -10.750 2.414 1.00 71.54 H new ATOM 0 HH21 ARG A 102 -7.130 -12.771 3.389 1.00 20.52 H new ATOM 0 HH22 ARG A 102 -8.546 -12.591 2.348 1.00 20.52 H new ATOM 1659 N LEU A 103 -6.120 -5.216 1.710 1.00 54.22 N ATOM 1660 CA LEU A 103 -6.856 -4.988 0.460 1.00 43.44 C ATOM 1661 C LEU A 103 -7.092 -6.307 -0.287 1.00 3.25 C ATOM 1662 O LEU A 103 -6.230 -7.186 -0.299 1.00 53.43 O ATOM 1663 CB LEU A 103 -6.090 -4.012 -0.442 1.00 64.12 C ATOM 1664 CG LEU A 103 -5.889 -2.600 0.129 1.00 2.42 C ATOM 1665 CD1 LEU A 103 -5.139 -1.718 -0.866 1.00 34.52 C ATOM 1666 CD2 LEU A 103 -7.230 -1.973 0.504 1.00 31.24 C ATOM 0 H LEU A 103 -5.105 -5.197 1.609 1.00 54.22 H new ATOM 0 HA LEU A 103 -7.823 -4.555 0.716 1.00 43.44 H new ATOM 0 HB2 LEU A 103 -5.111 -4.439 -0.661 1.00 64.12 H new ATOM 0 HB3 LEU A 103 -6.621 -3.929 -1.391 1.00 64.12 H new ATOM 0 HG LEU A 103 -5.287 -2.681 1.034 1.00 2.42 H new ATOM 0 HD11 LEU A 103 -5.007 -0.722 -0.442 1.00 34.52 H new ATOM 0 HD12 LEU A 103 -4.163 -2.155 -1.076 1.00 34.52 H new ATOM 0 HD13 LEU A 103 -5.711 -1.646 -1.791 1.00 34.52 H new ATOM 0 HD21 LEU A 103 -7.065 -0.974 0.906 1.00 31.24 H new ATOM 0 HD22 LEU A 103 -7.862 -1.908 -0.382 1.00 31.24 H new ATOM 0 HD23 LEU A 103 -7.722 -2.590 1.256 1.00 31.24 H new ATOM 1678 N THR A 104 -8.263 -6.441 -0.908 1.00 71.11 N ATOM 1679 CA THR A 104 -8.617 -7.668 -1.639 1.00 63.32 C ATOM 1680 C THR A 104 -9.283 -7.354 -2.979 1.00 34.34 C ATOM 1681 O THR A 104 -10.122 -6.456 -3.078 1.00 71.21 O ATOM 1682 CB THR A 104 -9.568 -8.576 -0.822 1.00 11.13 C ATOM 1683 OG1 THR A 104 -10.773 -7.869 -0.481 1.00 44.42 O ATOM 1684 CG2 THR A 104 -8.895 -9.075 0.447 1.00 64.20 C ATOM 0 H THR A 104 -8.984 -5.720 -0.923 1.00 71.11 H new ATOM 0 HA THR A 104 -7.678 -8.193 -1.811 1.00 63.32 H new ATOM 0 HB THR A 104 -9.819 -9.435 -1.445 1.00 11.13 H new ATOM 0 HG1 THR A 104 -11.363 -8.458 0.034 1.00 44.42 H new ATOM 0 HG21 THR A 104 -9.587 -9.710 1.000 1.00 64.20 H new ATOM 0 HG22 THR A 104 -8.006 -9.649 0.186 1.00 64.20 H new ATOM 0 HG23 THR A 104 -8.609 -8.224 1.066 1.00 64.20 H new ATOM 1692 N ARG A 105 -8.910 -8.097 -4.011 1.00 14.11 N ATOM 1693 CA ARG A 105 -9.530 -7.945 -5.327 1.00 4.22 C ATOM 1694 C ARG A 105 -9.868 -9.322 -5.920 1.00 53.01 C ATOM 1695 O ARG A 105 -9.010 -10.201 -5.997 1.00 65.01 O ATOM 1696 CB ARG A 105 -8.597 -7.174 -6.273 1.00 5.41 C ATOM 1697 CG ARG A 105 -9.323 -6.427 -7.392 1.00 63.43 C ATOM 1698 CD ARG A 105 -9.817 -5.045 -6.949 1.00 24.54 C ATOM 1699 NE ARG A 105 -10.731 -5.095 -5.804 1.00 55.40 N ATOM 1700 CZ ARG A 105 -11.855 -4.428 -5.734 1.00 35.34 C ATOM 1701 NH1 ARG A 105 -12.237 -3.671 -6.714 1.00 42.43 N ATOM 1702 NH2 ARG A 105 -12.587 -4.508 -4.673 1.00 73.02 N ATOM 0 H ARG A 105 -8.183 -8.811 -3.967 1.00 14.11 H new ATOM 0 HA ARG A 105 -10.454 -7.378 -5.211 1.00 4.22 H new ATOM 0 HB2 ARG A 105 -8.016 -6.459 -5.690 1.00 5.41 H new ATOM 0 HB3 ARG A 105 -7.889 -7.873 -6.717 1.00 5.41 H new ATOM 0 HG2 ARG A 105 -8.653 -6.314 -8.244 1.00 63.43 H new ATOM 0 HG3 ARG A 105 -10.171 -7.021 -7.731 1.00 63.43 H new ATOM 0 HD2 ARG A 105 -8.958 -4.425 -6.692 1.00 24.54 H new ATOM 0 HD3 ARG A 105 -10.321 -4.561 -7.786 1.00 24.54 H new ATOM 0 HE ARG A 105 -10.475 -5.686 -5.013 1.00 55.40 H new ATOM 0 HH11 ARG A 105 -11.660 -3.590 -7.551 1.00 42.43 H new ATOM 0 HH12 ARG A 105 -13.115 -3.156 -6.648 1.00 42.43 H new ATOM 0 HH21 ARG A 105 -12.289 -5.091 -3.891 1.00 73.02 H new ATOM 0 HH22 ARG A 105 -13.463 -3.989 -4.617 1.00 73.02 H new ATOM 1716 N ILE A 106 -11.121 -9.506 -6.325 1.00 34.30 N ATOM 1717 CA ILE A 106 -11.580 -10.787 -6.872 1.00 42.24 C ATOM 1718 C ILE A 106 -11.167 -10.967 -8.341 1.00 72.11 C ATOM 1719 O ILE A 106 -11.678 -10.286 -9.233 1.00 11.52 O ATOM 1720 CB ILE A 106 -13.121 -10.927 -6.749 1.00 41.02 C ATOM 1721 CG1 ILE A 106 -13.552 -10.889 -5.271 1.00 40.43 C ATOM 1722 CG2 ILE A 106 -13.610 -12.212 -7.419 1.00 62.15 C ATOM 1723 CD1 ILE A 106 -12.949 -11.989 -4.417 1.00 45.51 C ATOM 0 H ILE A 106 -11.841 -8.785 -6.286 1.00 34.30 H new ATOM 0 HA ILE A 106 -11.099 -11.567 -6.282 1.00 42.24 H new ATOM 0 HB ILE A 106 -13.579 -10.083 -7.264 1.00 41.02 H new ATOM 0 HG12 ILE A 106 -13.275 -9.923 -4.848 1.00 40.43 H new ATOM 0 HG13 ILE A 106 -14.639 -10.959 -5.219 1.00 40.43 H new ATOM 0 HG21 ILE A 106 -14.693 -12.285 -7.318 1.00 62.15 H new ATOM 0 HG22 ILE A 106 -13.344 -12.195 -8.476 1.00 62.15 H new ATOM 0 HG23 ILE A 106 -13.142 -13.072 -6.941 1.00 62.15 H new ATOM 0 HD11 ILE A 106 -13.304 -11.889 -3.391 1.00 45.51 H new ATOM 0 HD12 ILE A 106 -13.247 -12.960 -4.811 1.00 45.51 H new ATOM 0 HD13 ILE A 106 -11.862 -11.909 -4.434 1.00 45.51 H new ATOM 1735 N LEU A 107 -10.228 -11.879 -8.580 1.00 23.52 N ATOM 1736 CA LEU A 107 -9.821 -12.246 -9.940 1.00 75.41 C ATOM 1737 C LEU A 107 -10.660 -13.448 -10.430 1.00 4.51 C ATOM 1738 O LEU A 107 -10.492 -14.565 -9.941 1.00 5.44 O ATOM 1739 CB LEU A 107 -8.309 -12.579 -9.952 1.00 34.44 C ATOM 1740 CG LEU A 107 -7.610 -12.618 -11.334 1.00 54.01 C ATOM 1741 CD1 LEU A 107 -8.071 -13.809 -12.176 1.00 34.11 C ATOM 1742 CD2 LEU A 107 -7.833 -11.308 -12.088 1.00 2.43 C ATOM 0 H LEU A 107 -9.730 -12.382 -7.846 1.00 23.52 H new ATOM 0 HA LEU A 107 -9.997 -11.411 -10.618 1.00 75.41 H new ATOM 0 HB2 LEU A 107 -7.795 -11.844 -9.333 1.00 34.44 H new ATOM 0 HB3 LEU A 107 -8.172 -13.549 -9.475 1.00 34.44 H new ATOM 0 HG LEU A 107 -6.542 -12.742 -11.154 1.00 54.01 H new ATOM 0 HD11 LEU A 107 -7.556 -13.797 -13.136 1.00 34.11 H new ATOM 0 HD12 LEU A 107 -7.840 -14.736 -11.652 1.00 34.11 H new ATOM 0 HD13 LEU A 107 -9.147 -13.744 -12.341 1.00 34.11 H new ATOM 0 HD21 LEU A 107 -7.334 -11.356 -13.056 1.00 2.43 H new ATOM 0 HD22 LEU A 107 -8.901 -11.152 -12.238 1.00 2.43 H new ATOM 0 HD23 LEU A 107 -7.423 -10.481 -11.509 1.00 2.43 H new ATOM 1754 N PRO A 108 -11.592 -13.234 -11.384 1.00 64.11 N ATOM 1755 CA PRO A 108 -12.464 -14.307 -11.895 1.00 23.14 C ATOM 1756 C PRO A 108 -11.771 -15.210 -12.935 1.00 21.25 C ATOM 1757 O PRO A 108 -10.979 -14.741 -13.754 1.00 43.10 O ATOM 1758 CB PRO A 108 -13.613 -13.524 -12.537 1.00 54.23 C ATOM 1759 CG PRO A 108 -12.978 -12.261 -13.020 1.00 22.13 C ATOM 1760 CD PRO A 108 -11.879 -11.937 -12.031 1.00 32.34 C ATOM 0 HA PRO A 108 -12.770 -14.996 -11.108 1.00 23.14 H new ATOM 0 HB2 PRO A 108 -14.064 -14.081 -13.358 1.00 54.23 H new ATOM 0 HB3 PRO A 108 -14.406 -13.320 -11.817 1.00 54.23 H new ATOM 0 HG2 PRO A 108 -12.573 -12.388 -14.024 1.00 22.13 H new ATOM 0 HG3 PRO A 108 -13.708 -11.453 -13.070 1.00 22.13 H new ATOM 0 HD2 PRO A 108 -10.997 -11.536 -12.530 1.00 32.34 H new ATOM 0 HD3 PRO A 108 -12.202 -11.191 -11.305 1.00 32.34 H new ATOM 1768 N PHE A 109 -12.081 -16.504 -12.901 1.00 35.31 N ATOM 1769 CA PHE A 109 -11.489 -17.473 -13.834 1.00 22.14 C ATOM 1770 C PHE A 109 -12.073 -17.346 -15.256 1.00 31.34 C ATOM 1771 O PHE A 109 -13.288 -17.424 -15.454 1.00 12.53 O ATOM 1772 CB PHE A 109 -11.698 -18.900 -13.304 1.00 55.14 C ATOM 1773 CG PHE A 109 -11.230 -19.981 -14.250 1.00 72.32 C ATOM 1774 CD1 PHE A 109 -9.883 -20.121 -14.557 1.00 63.31 C ATOM 1775 CD2 PHE A 109 -12.136 -20.858 -14.828 1.00 0.42 C ATOM 1776 CE1 PHE A 109 -9.455 -21.108 -15.423 1.00 32.32 C ATOM 1777 CE2 PHE A 109 -11.710 -21.846 -15.693 1.00 51.25 C ATOM 1778 CZ PHE A 109 -10.370 -21.972 -15.990 1.00 74.31 C ATOM 0 H PHE A 109 -12.740 -16.911 -12.237 1.00 35.31 H new ATOM 0 HA PHE A 109 -10.423 -17.256 -13.901 1.00 22.14 H new ATOM 0 HB2 PHE A 109 -11.169 -19.006 -12.357 1.00 55.14 H new ATOM 0 HB3 PHE A 109 -12.758 -19.048 -13.095 1.00 55.14 H new ATOM 0 HD1 PHE A 109 -9.162 -19.450 -14.114 1.00 63.31 H new ATOM 0 HD2 PHE A 109 -13.187 -20.767 -14.599 1.00 0.42 H new ATOM 0 HE1 PHE A 109 -8.405 -21.204 -15.656 1.00 32.32 H new ATOM 0 HE2 PHE A 109 -12.427 -22.520 -16.137 1.00 51.25 H new ATOM 0 HZ PHE A 109 -10.036 -22.746 -16.666 1.00 74.31 H new ATOM 1788 N LEU A 110 -11.195 -17.134 -16.239 1.00 3.24 N ATOM 1789 CA LEU A 110 -11.580 -17.127 -17.662 1.00 1.35 C ATOM 1790 C LEU A 110 -10.753 -18.160 -18.447 1.00 53.11 C ATOM 1791 O LEU A 110 -9.522 -18.077 -18.499 1.00 71.15 O ATOM 1792 CB LEU A 110 -11.408 -15.730 -18.298 1.00 44.41 C ATOM 1793 CG LEU A 110 -12.550 -14.719 -18.037 1.00 2.22 C ATOM 1794 CD1 LEU A 110 -12.628 -14.329 -16.564 1.00 3.34 C ATOM 1795 CD2 LEU A 110 -12.383 -13.478 -18.910 1.00 12.12 C ATOM 0 H LEU A 110 -10.202 -16.963 -16.078 1.00 3.24 H new ATOM 0 HA LEU A 110 -12.636 -17.392 -17.712 1.00 1.35 H new ATOM 0 HB2 LEU A 110 -10.477 -15.298 -17.931 1.00 44.41 H new ATOM 0 HB3 LEU A 110 -11.299 -15.854 -19.375 1.00 44.41 H new ATOM 0 HG LEU A 110 -13.488 -15.208 -18.302 1.00 2.22 H new ATOM 0 HD11 LEU A 110 -13.441 -13.618 -16.418 1.00 3.34 H new ATOM 0 HD12 LEU A 110 -12.812 -15.219 -15.961 1.00 3.34 H new ATOM 0 HD13 LEU A 110 -11.687 -13.872 -16.258 1.00 3.34 H new ATOM 0 HD21 LEU A 110 -13.197 -12.781 -18.710 1.00 12.12 H new ATOM 0 HD22 LEU A 110 -11.431 -12.999 -18.683 1.00 12.12 H new ATOM 0 HD23 LEU A 110 -12.403 -13.767 -19.961 1.00 12.12 H new ATOM 1807 N ASP A 111 -11.444 -19.115 -19.065 1.00 12.54 N ATOM 1808 CA ASP A 111 -10.800 -20.234 -19.763 1.00 70.10 C ATOM 1809 C ASP A 111 -9.962 -19.774 -20.974 1.00 63.21 C ATOM 1810 O ASP A 111 -8.733 -19.872 -20.973 1.00 72.32 O ATOM 1811 CB ASP A 111 -11.871 -21.222 -20.238 1.00 13.31 C ATOM 1812 CG ASP A 111 -12.829 -21.634 -19.132 1.00 22.12 C ATOM 1813 OD1 ASP A 111 -13.698 -20.814 -18.758 1.00 5.00 O ATOM 1814 OD2 ASP A 111 -12.736 -22.777 -18.648 1.00 44.34 O ATOM 0 H ASP A 111 -12.463 -19.139 -19.098 1.00 12.54 H new ATOM 0 HA ASP A 111 -10.121 -20.709 -19.055 1.00 70.10 H new ATOM 0 HB2 ASP A 111 -12.437 -20.772 -21.053 1.00 13.31 H new ATOM 0 HB3 ASP A 111 -11.385 -22.111 -20.640 1.00 13.31 H new ATOM 1819 N ALA A 112 -10.640 -19.266 -22.003 1.00 41.10 N ATOM 1820 CA ALA A 112 -9.996 -18.952 -23.285 1.00 73.04 C ATOM 1821 C ALA A 112 -9.224 -17.625 -23.249 1.00 21.22 C ATOM 1822 O ALA A 112 -8.086 -17.550 -23.718 1.00 12.13 O ATOM 1823 CB ALA A 112 -11.040 -18.921 -24.398 1.00 23.11 C ATOM 0 H ALA A 112 -11.639 -19.061 -21.976 1.00 41.10 H new ATOM 0 HA ALA A 112 -9.268 -19.739 -23.481 1.00 73.04 H new ATOM 0 HB1 ALA A 112 -10.555 -18.687 -25.346 1.00 23.11 H new ATOM 0 HB2 ALA A 112 -11.525 -19.894 -24.469 1.00 23.11 H new ATOM 0 HB3 ALA A 112 -11.787 -18.159 -24.175 1.00 23.11 H new ATOM 1829 N GLN A 113 -9.846 -16.591 -22.689 1.00 22.53 N ATOM 1830 CA GLN A 113 -9.275 -15.234 -22.682 1.00 15.31 C ATOM 1831 C GLN A 113 -7.844 -15.186 -22.107 1.00 32.52 C ATOM 1832 O GLN A 113 -7.642 -15.238 -20.888 1.00 40.44 O ATOM 1833 CB GLN A 113 -10.197 -14.294 -21.897 1.00 64.11 C ATOM 1834 CG GLN A 113 -11.551 -14.065 -22.562 1.00 64.12 C ATOM 1835 CD GLN A 113 -11.435 -13.314 -23.879 1.00 51.23 C ATOM 1836 OE1 GLN A 113 -10.540 -12.498 -24.067 1.00 23.44 O ATOM 1837 NE2 GLN A 113 -12.333 -13.578 -24.801 1.00 54.34 N ATOM 0 H GLN A 113 -10.754 -16.662 -22.229 1.00 22.53 H new ATOM 0 HA GLN A 113 -9.202 -14.907 -23.719 1.00 15.31 H new ATOM 0 HB2 GLN A 113 -10.357 -14.705 -20.900 1.00 64.11 H new ATOM 0 HB3 GLN A 113 -9.698 -13.333 -21.769 1.00 64.11 H new ATOM 0 HG2 GLN A 113 -12.033 -15.027 -22.737 1.00 64.12 H new ATOM 0 HG3 GLN A 113 -12.195 -13.505 -21.884 1.00 64.12 H new ATOM 0 HE21 GLN A 113 -13.067 -14.262 -24.617 1.00 54.34 H new ATOM 0 HE22 GLN A 113 -12.296 -13.099 -25.701 1.00 54.34 H new ATOM 1846 N GLU A 114 -6.854 -15.086 -23.001 1.00 50.05 N ATOM 1847 CA GLU A 114 -5.438 -15.016 -22.603 1.00 1.32 C ATOM 1848 C GLU A 114 -5.062 -13.626 -22.048 1.00 51.35 C ATOM 1849 O GLU A 114 -4.571 -13.510 -20.922 1.00 4.45 O ATOM 1850 CB GLU A 114 -4.522 -15.387 -23.792 1.00 1.32 C ATOM 1851 CG GLU A 114 -4.750 -14.555 -25.053 1.00 72.43 C ATOM 1852 CD GLU A 114 -3.776 -14.890 -26.175 1.00 41.40 C ATOM 1853 OE1 GLU A 114 -3.974 -15.918 -26.857 1.00 74.13 O ATOM 1854 OE2 GLU A 114 -2.809 -14.123 -26.386 1.00 20.21 O ATOM 0 H GLU A 114 -7.005 -15.051 -24.009 1.00 50.05 H new ATOM 0 HA GLU A 114 -5.290 -15.739 -21.801 1.00 1.32 H new ATOM 0 HB2 GLU A 114 -3.483 -15.276 -23.482 1.00 1.32 H new ATOM 0 HB3 GLU A 114 -4.671 -16.439 -24.035 1.00 1.32 H new ATOM 0 HG2 GLU A 114 -5.769 -14.713 -25.406 1.00 72.43 H new ATOM 0 HG3 GLU A 114 -4.659 -13.498 -24.805 1.00 72.43 H new ATOM 1861 N LEU A 115 -5.319 -12.570 -22.822 1.00 64.21 N ATOM 1862 CA LEU A 115 -4.944 -11.208 -22.413 1.00 0.15 C ATOM 1863 C LEU A 115 -5.726 -10.753 -21.181 1.00 5.22 C ATOM 1864 O LEU A 115 -5.231 -9.961 -20.386 1.00 22.40 O ATOM 1865 CB LEU A 115 -5.144 -10.209 -23.568 1.00 63.01 C ATOM 1866 CG LEU A 115 -3.888 -9.907 -24.404 1.00 31.33 C ATOM 1867 CD1 LEU A 115 -2.821 -9.234 -23.545 1.00 53.30 C ATOM 1868 CD2 LEU A 115 -3.342 -11.179 -25.039 1.00 60.25 C ATOM 0 H LEU A 115 -5.782 -12.627 -23.729 1.00 64.21 H new ATOM 0 HA LEU A 115 -3.886 -11.232 -22.151 1.00 0.15 H new ATOM 0 HB2 LEU A 115 -5.917 -10.597 -24.232 1.00 63.01 H new ATOM 0 HB3 LEU A 115 -5.519 -9.272 -23.155 1.00 63.01 H new ATOM 0 HG LEU A 115 -4.168 -9.222 -25.204 1.00 31.33 H new ATOM 0 HD11 LEU A 115 -1.940 -9.028 -24.154 1.00 53.30 H new ATOM 0 HD12 LEU A 115 -3.212 -8.299 -23.145 1.00 53.30 H new ATOM 0 HD13 LEU A 115 -2.547 -9.894 -22.722 1.00 53.30 H new ATOM 0 HD21 LEU A 115 -2.454 -10.941 -25.625 1.00 60.25 H new ATOM 0 HD22 LEU A 115 -3.080 -11.892 -24.258 1.00 60.25 H new ATOM 0 HD23 LEU A 115 -4.100 -11.615 -25.689 1.00 60.25 H new ATOM 1880 N ALA A 116 -6.944 -11.253 -21.028 1.00 55.50 N ATOM 1881 CA ALA A 116 -7.764 -10.934 -19.859 1.00 51.51 C ATOM 1882 C ALA A 116 -7.062 -11.333 -18.552 1.00 61.44 C ATOM 1883 O ALA A 116 -6.885 -10.513 -17.661 1.00 64.32 O ATOM 1884 CB ALA A 116 -9.125 -11.610 -19.962 1.00 61.23 C ATOM 0 H ALA A 116 -7.390 -11.881 -21.696 1.00 55.50 H new ATOM 0 HA ALA A 116 -7.909 -9.854 -19.840 1.00 51.51 H new ATOM 0 HB1 ALA A 116 -9.722 -11.362 -19.084 1.00 61.23 H new ATOM 0 HB2 ALA A 116 -9.637 -11.262 -20.859 1.00 61.23 H new ATOM 0 HB3 ALA A 116 -8.991 -12.690 -20.016 1.00 61.23 H new ATOM 1890 N LYS A 117 -6.634 -12.592 -18.453 1.00 33.45 N ATOM 1891 CA LYS A 117 -6.011 -13.095 -17.220 1.00 13.12 C ATOM 1892 C LYS A 117 -4.599 -12.533 -17.005 1.00 51.14 C ATOM 1893 O LYS A 117 -4.096 -12.520 -15.879 1.00 30.55 O ATOM 1894 CB LYS A 117 -5.993 -14.628 -17.221 1.00 41.11 C ATOM 1895 CG LYS A 117 -7.381 -15.275 -17.302 1.00 64.32 C ATOM 1896 CD LYS A 117 -8.315 -14.835 -16.162 1.00 43.54 C ATOM 1897 CE LYS A 117 -9.079 -13.550 -16.485 1.00 43.01 C ATOM 1898 NZ LYS A 117 -9.900 -13.076 -15.341 1.00 10.12 N ATOM 0 H LYS A 117 -6.705 -13.280 -19.203 1.00 33.45 H new ATOM 0 HA LYS A 117 -6.618 -12.746 -16.384 1.00 13.12 H new ATOM 0 HB2 LYS A 117 -5.395 -14.972 -18.065 1.00 41.11 H new ATOM 0 HB3 LYS A 117 -5.496 -14.975 -16.315 1.00 41.11 H new ATOM 0 HG2 LYS A 117 -7.839 -15.022 -18.258 1.00 64.32 H new ATOM 0 HG3 LYS A 117 -7.273 -16.359 -17.278 1.00 64.32 H new ATOM 0 HD2 LYS A 117 -9.027 -15.633 -15.953 1.00 43.54 H new ATOM 0 HD3 LYS A 117 -7.729 -14.686 -15.255 1.00 43.54 H new ATOM 0 HE2 LYS A 117 -8.371 -12.771 -16.768 1.00 43.01 H new ATOM 0 HE3 LYS A 117 -9.725 -13.721 -17.346 1.00 43.01 H new ATOM 0 HZ1 LYS A 117 -10.736 -12.571 -15.699 1.00 10.12 H new ATOM 0 HZ2 LYS A 117 -10.205 -13.891 -14.772 1.00 10.12 H new ATOM 0 HZ3 LYS A 117 -9.334 -12.433 -14.750 1.00 10.12 H new ATOM 1912 N ALA A 118 -3.964 -12.073 -18.077 1.00 1.22 N ATOM 1913 CA ALA A 118 -2.665 -11.397 -17.972 1.00 13.41 C ATOM 1914 C ALA A 118 -2.836 -9.928 -17.547 1.00 4.12 C ATOM 1915 O ALA A 118 -2.175 -9.450 -16.619 1.00 74.53 O ATOM 1916 CB ALA A 118 -1.922 -11.479 -19.303 1.00 30.32 C ATOM 0 H ALA A 118 -4.322 -12.153 -19.029 1.00 1.22 H new ATOM 0 HA ALA A 118 -2.079 -11.904 -17.205 1.00 13.41 H new ATOM 0 HB1 ALA A 118 -0.960 -10.975 -19.214 1.00 30.32 H new ATOM 0 HB2 ALA A 118 -1.761 -12.524 -19.566 1.00 30.32 H new ATOM 0 HB3 ALA A 118 -2.514 -10.997 -20.081 1.00 30.32 H new ATOM 1922 N ALA A 119 -3.740 -9.228 -18.230 1.00 23.22 N ATOM 1923 CA ALA A 119 -3.990 -7.801 -17.990 1.00 23.31 C ATOM 1924 C ALA A 119 -4.698 -7.552 -16.651 1.00 2.02 C ATOM 1925 O ALA A 119 -4.289 -6.684 -15.886 1.00 5.21 O ATOM 1926 CB ALA A 119 -4.807 -7.210 -19.133 1.00 23.11 C ATOM 0 H ALA A 119 -4.321 -9.630 -18.965 1.00 23.22 H new ATOM 0 HA ALA A 119 -3.020 -7.306 -17.942 1.00 23.31 H new ATOM 0 HB1 ALA A 119 -4.986 -6.152 -18.943 1.00 23.11 H new ATOM 0 HB2 ALA A 119 -4.259 -7.323 -20.068 1.00 23.11 H new ATOM 0 HB3 ALA A 119 -5.761 -7.732 -19.206 1.00 23.11 H new ATOM 1932 N GLU A 120 -5.768 -8.306 -16.374 1.00 33.23 N ATOM 1933 CA GLU A 120 -6.491 -8.185 -15.094 1.00 10.10 C ATOM 1934 C GLU A 120 -5.539 -8.326 -13.896 1.00 44.32 C ATOM 1935 O GLU A 120 -5.485 -7.457 -13.027 1.00 1.31 O ATOM 1936 CB GLU A 120 -7.607 -9.238 -14.987 1.00 74.52 C ATOM 1937 CG GLU A 120 -8.816 -8.983 -15.886 1.00 1.50 C ATOM 1938 CD GLU A 120 -9.834 -10.115 -15.824 1.00 55.32 C ATOM 1939 OE1 GLU A 120 -10.208 -10.526 -14.705 1.00 21.00 O ATOM 1940 OE2 GLU A 120 -10.249 -10.618 -16.889 1.00 10.10 O ATOM 0 H GLU A 120 -6.154 -9.003 -17.011 1.00 33.23 H new ATOM 0 HA GLU A 120 -6.936 -7.190 -15.072 1.00 10.10 H new ATOM 0 HB2 GLU A 120 -7.190 -10.215 -15.231 1.00 74.52 H new ATOM 0 HB3 GLU A 120 -7.945 -9.285 -13.952 1.00 74.52 H new ATOM 0 HG2 GLU A 120 -9.295 -8.050 -15.590 1.00 1.50 H new ATOM 0 HG3 GLU A 120 -8.480 -8.856 -16.915 1.00 1.50 H new ATOM 1947 N GLU A 121 -4.785 -9.420 -13.872 1.00 12.01 N ATOM 1948 CA GLU A 121 -3.832 -9.701 -12.792 1.00 63.23 C ATOM 1949 C GLU A 121 -2.876 -8.510 -12.575 1.00 73.34 C ATOM 1950 O GLU A 121 -2.614 -8.102 -11.442 1.00 64.31 O ATOM 1951 CB GLU A 121 -3.054 -10.982 -13.145 1.00 51.03 C ATOM 1952 CG GLU A 121 -2.325 -11.653 -11.979 1.00 23.12 C ATOM 1953 CD GLU A 121 -0.988 -11.014 -11.615 1.00 74.35 C ATOM 1954 OE1 GLU A 121 -0.264 -10.561 -12.528 1.00 72.23 O ATOM 1955 OE2 GLU A 121 -0.636 -11.010 -10.416 1.00 4.20 O ATOM 0 H GLU A 121 -4.813 -10.138 -14.596 1.00 12.01 H new ATOM 0 HA GLU A 121 -4.372 -9.850 -11.857 1.00 63.23 H new ATOM 0 HB2 GLU A 121 -3.750 -11.701 -13.578 1.00 51.03 H new ATOM 0 HB3 GLU A 121 -2.323 -10.741 -13.917 1.00 51.03 H new ATOM 0 HG2 GLU A 121 -2.973 -11.633 -11.103 1.00 23.12 H new ATOM 0 HG3 GLU A 121 -2.157 -12.701 -12.227 1.00 23.12 H new ATOM 1962 N GLU A 122 -2.393 -7.938 -13.676 1.00 61.32 N ATOM 1963 CA GLU A 122 -1.473 -6.798 -13.623 1.00 41.34 C ATOM 1964 C GLU A 122 -2.179 -5.503 -13.170 1.00 75.34 C ATOM 1965 O GLU A 122 -1.738 -4.840 -12.227 1.00 3.51 O ATOM 1966 CB GLU A 122 -0.836 -6.577 -15.003 1.00 13.22 C ATOM 1967 CG GLU A 122 0.173 -5.431 -15.031 1.00 2.22 C ATOM 1968 CD GLU A 122 0.661 -5.095 -16.432 1.00 72.14 C ATOM 1969 OE1 GLU A 122 0.027 -4.251 -17.104 1.00 64.44 O ATOM 1970 OE2 GLU A 122 1.681 -5.665 -16.866 1.00 15.00 O ATOM 0 H GLU A 122 -2.623 -8.245 -14.621 1.00 61.32 H new ATOM 0 HA GLU A 122 -0.704 -7.034 -12.888 1.00 41.34 H new ATOM 0 HB2 GLU A 122 -0.340 -7.495 -15.317 1.00 13.22 H new ATOM 0 HB3 GLU A 122 -1.623 -6.376 -15.730 1.00 13.22 H new ATOM 0 HG2 GLU A 122 -0.282 -4.544 -14.590 1.00 2.22 H new ATOM 0 HG3 GLU A 122 1.028 -5.694 -14.409 1.00 2.22 H new ATOM 1977 N MET A 123 -3.269 -5.140 -13.852 1.00 64.53 N ATOM 1978 CA MET A 123 -3.977 -3.882 -13.572 1.00 10.43 C ATOM 1979 C MET A 123 -4.501 -3.839 -12.131 1.00 41.12 C ATOM 1980 O MET A 123 -4.443 -2.801 -11.474 1.00 22.33 O ATOM 1981 CB MET A 123 -5.137 -3.655 -14.563 1.00 43.42 C ATOM 1982 CG MET A 123 -6.326 -4.592 -14.373 1.00 13.53 C ATOM 1983 SD MET A 123 -7.719 -4.172 -15.444 1.00 71.12 S ATOM 1984 CE MET A 123 -8.930 -5.396 -14.941 1.00 33.12 C ATOM 0 H MET A 123 -3.682 -5.696 -14.601 1.00 64.53 H new ATOM 0 HA MET A 123 -3.253 -3.077 -13.698 1.00 10.43 H new ATOM 0 HB2 MET A 123 -5.483 -2.626 -14.468 1.00 43.42 H new ATOM 0 HB3 MET A 123 -4.758 -3.771 -15.578 1.00 43.42 H new ATOM 0 HG2 MET A 123 -6.013 -5.616 -14.575 1.00 13.53 H new ATOM 0 HG3 MET A 123 -6.649 -4.557 -13.333 1.00 13.53 H new ATOM 0 HE1 MET A 123 -9.255 -5.965 -15.812 1.00 33.12 H new ATOM 0 HE2 MET A 123 -8.483 -6.072 -14.212 1.00 33.12 H new ATOM 0 HE3 MET A 123 -9.789 -4.896 -14.493 1.00 33.12 H new ATOM 1994 N LEU A 124 -4.995 -4.972 -11.636 1.00 43.31 N ATOM 1995 CA LEU A 124 -5.522 -5.042 -10.271 1.00 63.22 C ATOM 1996 C LEU A 124 -4.394 -4.913 -9.237 1.00 23.13 C ATOM 1997 O LEU A 124 -4.587 -4.334 -8.168 1.00 35.41 O ATOM 1998 CB LEU A 124 -6.308 -6.345 -10.057 1.00 61.55 C ATOM 1999 CG LEU A 124 -7.532 -6.530 -10.975 1.00 4.44 C ATOM 2000 CD1 LEU A 124 -8.256 -7.836 -10.659 1.00 20.41 C ATOM 2001 CD2 LEU A 124 -8.486 -5.338 -10.865 1.00 24.52 C ATOM 0 H LEU A 124 -5.042 -5.849 -12.154 1.00 43.31 H new ATOM 0 HA LEU A 124 -6.204 -4.204 -10.131 1.00 63.22 H new ATOM 0 HB2 LEU A 124 -5.632 -7.187 -10.205 1.00 61.55 H new ATOM 0 HB3 LEU A 124 -6.642 -6.383 -9.020 1.00 61.55 H new ATOM 0 HG LEU A 124 -7.175 -6.581 -12.004 1.00 4.44 H new ATOM 0 HD11 LEU A 124 -9.116 -7.944 -11.320 1.00 20.41 H new ATOM 0 HD12 LEU A 124 -7.576 -8.674 -10.809 1.00 20.41 H new ATOM 0 HD13 LEU A 124 -8.594 -7.823 -9.623 1.00 20.41 H new ATOM 0 HD21 LEU A 124 -9.341 -5.494 -11.523 1.00 24.52 H new ATOM 0 HD22 LEU A 124 -8.833 -5.243 -9.836 1.00 24.52 H new ATOM 0 HD23 LEU A 124 -7.965 -4.427 -11.158 1.00 24.52 H new ATOM 2013 N TYR A 125 -3.215 -5.445 -9.563 1.00 41.31 N ATOM 2014 CA TYR A 125 -2.047 -5.329 -8.685 1.00 65.10 C ATOM 2015 C TYR A 125 -1.532 -3.880 -8.635 1.00 11.15 C ATOM 2016 O TYR A 125 -1.364 -3.309 -7.557 1.00 62.35 O ATOM 2017 CB TYR A 125 -0.924 -6.271 -9.146 1.00 5.40 C ATOM 2018 CG TYR A 125 0.317 -6.210 -8.269 1.00 22.44 C ATOM 2019 CD1 TYR A 125 0.405 -6.961 -7.099 1.00 72.22 C ATOM 2020 CD2 TYR A 125 1.394 -5.391 -8.604 1.00 41.02 C ATOM 2021 CE1 TYR A 125 1.526 -6.896 -6.293 1.00 1.40 C ATOM 2022 CE2 TYR A 125 2.515 -5.325 -7.803 1.00 24.05 C ATOM 2023 CZ TYR A 125 2.578 -6.076 -6.649 1.00 55.54 C ATOM 2024 OH TYR A 125 3.696 -6.004 -5.845 1.00 25.05 O ATOM 0 H TYR A 125 -3.043 -5.960 -10.427 1.00 41.31 H new ATOM 0 HA TYR A 125 -2.358 -5.618 -7.681 1.00 65.10 H new ATOM 0 HB2 TYR A 125 -1.301 -7.294 -9.158 1.00 5.40 H new ATOM 0 HB3 TYR A 125 -0.648 -6.021 -10.170 1.00 5.40 H new ATOM 0 HD1 TYR A 125 -0.416 -7.604 -6.817 1.00 72.22 H new ATOM 0 HD2 TYR A 125 1.350 -4.798 -9.506 1.00 41.02 H new ATOM 0 HE1 TYR A 125 1.579 -7.484 -5.389 1.00 1.40 H new ATOM 0 HE2 TYR A 125 3.341 -4.687 -8.079 1.00 24.05 H new ATOM 0 HH TYR A 125 4.343 -5.382 -6.239 1.00 25.05 H new ATOM 2034 N LYS A 126 -1.286 -3.287 -9.806 1.00 50.42 N ATOM 2035 CA LYS A 126 -0.784 -1.907 -9.878 1.00 42.32 C ATOM 2036 C LYS A 126 -1.788 -0.918 -9.257 1.00 35.23 C ATOM 2037 O LYS A 126 -1.399 0.042 -8.590 1.00 14.42 O ATOM 2038 CB LYS A 126 -0.478 -1.509 -11.335 1.00 50.55 C ATOM 2039 CG LYS A 126 -1.716 -1.358 -12.219 1.00 25.22 C ATOM 2040 CD LYS A 126 -1.363 -1.004 -13.665 1.00 2.13 C ATOM 2041 CE LYS A 126 -0.561 -2.112 -14.338 1.00 30.31 C ATOM 2042 NZ LYS A 126 -0.303 -1.831 -15.776 1.00 22.22 N ATOM 0 H LYS A 126 -1.424 -3.734 -10.712 1.00 50.42 H new ATOM 0 HA LYS A 126 0.141 -1.863 -9.304 1.00 42.32 H new ATOM 0 HB2 LYS A 126 0.071 -0.567 -11.334 1.00 50.55 H new ATOM 0 HB3 LYS A 126 0.178 -2.260 -11.774 1.00 50.55 H new ATOM 0 HG2 LYS A 126 -2.285 -2.288 -12.204 1.00 25.22 H new ATOM 0 HG3 LYS A 126 -2.361 -0.583 -11.806 1.00 25.22 H new ATOM 0 HD2 LYS A 126 -2.278 -0.823 -14.229 1.00 2.13 H new ATOM 0 HD3 LYS A 126 -0.789 -0.077 -13.683 1.00 2.13 H new ATOM 0 HE2 LYS A 126 0.389 -2.236 -13.819 1.00 30.31 H new ATOM 0 HE3 LYS A 126 -1.100 -3.055 -14.246 1.00 30.31 H new ATOM 0 HZ1 LYS A 126 -0.388 -2.712 -16.323 1.00 22.22 H new ATOM 0 HZ2 LYS A 126 -0.997 -1.139 -16.124 1.00 22.22 H new ATOM 0 HZ3 LYS A 126 0.657 -1.446 -15.888 1.00 22.22 H new ATOM 2056 N ASP A 127 -3.079 -1.165 -9.474 1.00 15.41 N ATOM 2057 CA ASP A 127 -4.129 -0.314 -8.917 1.00 2.31 C ATOM 2058 C ASP A 127 -4.240 -0.518 -7.396 1.00 53.21 C ATOM 2059 O ASP A 127 -4.568 0.411 -6.656 1.00 11.24 O ATOM 2060 CB ASP A 127 -5.464 -0.621 -9.602 1.00 1.24 C ATOM 2061 CG ASP A 127 -6.485 0.482 -9.395 1.00 2.23 C ATOM 2062 OD1 ASP A 127 -6.396 1.512 -10.093 1.00 31.53 O ATOM 2063 OD2 ASP A 127 -7.385 0.322 -8.544 1.00 32.20 O ATOM 0 H ASP A 127 -3.423 -1.947 -10.031 1.00 15.41 H new ATOM 0 HA ASP A 127 -3.872 0.729 -9.100 1.00 2.31 H new ATOM 0 HB2 ASP A 127 -5.298 -0.763 -10.670 1.00 1.24 H new ATOM 0 HB3 ASP A 127 -5.862 -1.559 -9.214 1.00 1.24 H new ATOM 2068 N MET A 128 -3.958 -1.740 -6.940 1.00 11.31 N ATOM 2069 CA MET A 128 -3.940 -2.054 -5.508 1.00 43.32 C ATOM 2070 C MET A 128 -2.763 -1.351 -4.809 1.00 3.11 C ATOM 2071 O MET A 128 -2.908 -0.846 -3.699 1.00 44.22 O ATOM 2072 CB MET A 128 -3.863 -3.572 -5.301 1.00 33.12 C ATOM 2073 CG MET A 128 -4.034 -4.010 -3.855 1.00 41.05 C ATOM 2074 SD MET A 128 -4.099 -5.804 -3.685 1.00 71.04 S ATOM 2075 CE MET A 128 -5.544 -6.196 -4.668 1.00 40.23 C ATOM 0 H MET A 128 -3.738 -2.532 -7.544 1.00 11.31 H new ATOM 0 HA MET A 128 -4.864 -1.687 -5.062 1.00 43.32 H new ATOM 0 HB2 MET A 128 -4.632 -4.050 -5.908 1.00 33.12 H new ATOM 0 HB3 MET A 128 -2.900 -3.930 -5.666 1.00 33.12 H new ATOM 0 HG2 MET A 128 -3.208 -3.621 -3.260 1.00 41.05 H new ATOM 0 HG3 MET A 128 -4.949 -3.576 -3.452 1.00 41.05 H new ATOM 0 HE1 MET A 128 -6.167 -6.910 -4.130 1.00 40.23 H new ATOM 0 HE2 MET A 128 -6.114 -5.286 -4.856 1.00 40.23 H new ATOM 0 HE3 MET A 128 -5.231 -6.631 -5.617 1.00 40.23 H new ATOM 2085 N GLN A 129 -1.597 -1.333 -5.467 1.00 0.21 N ATOM 2086 CA GLN A 129 -0.455 -0.524 -5.007 1.00 72.40 C ATOM 2087 C GLN A 129 -0.874 0.944 -4.834 1.00 30.15 C ATOM 2088 O GLN A 129 -0.623 1.562 -3.795 1.00 2.45 O ATOM 2089 CB GLN A 129 0.711 -0.616 -6.013 1.00 32.24 C ATOM 2090 CG GLN A 129 1.459 -1.950 -5.996 1.00 61.22 C ATOM 2091 CD GLN A 129 2.359 -2.124 -4.775 1.00 33.11 C ATOM 2092 OE1 GLN A 129 2.552 -3.235 -4.287 1.00 45.11 O ATOM 2093 NE2 GLN A 129 2.956 -1.044 -4.296 1.00 24.42 N ATOM 0 H GLN A 129 -1.417 -1.867 -6.317 1.00 0.21 H new ATOM 0 HA GLN A 129 -0.125 -0.916 -4.045 1.00 72.40 H new ATOM 0 HB2 GLN A 129 0.323 -0.444 -7.017 1.00 32.24 H new ATOM 0 HB3 GLN A 129 1.419 0.186 -5.804 1.00 32.24 H new ATOM 0 HG2 GLN A 129 0.735 -2.765 -6.024 1.00 61.22 H new ATOM 0 HG3 GLN A 129 2.064 -2.030 -6.899 1.00 61.22 H new ATOM 0 HE21 GLN A 129 2.779 -0.133 -4.719 1.00 24.42 H new ATOM 0 HE22 GLN A 129 3.593 -1.123 -3.504 1.00 24.42 H new ATOM 2102 N LYS A 130 -1.524 1.482 -5.868 1.00 61.44 N ATOM 2103 CA LYS A 130 -2.067 2.843 -5.843 1.00 11.41 C ATOM 2104 C LYS A 130 -3.010 3.047 -4.645 1.00 20.42 C ATOM 2105 O LYS A 130 -2.810 3.946 -3.829 1.00 11.31 O ATOM 2106 CB LYS A 130 -2.834 3.119 -7.142 1.00 63.54 C ATOM 2107 CG LYS A 130 -3.404 4.531 -7.237 1.00 5.14 C ATOM 2108 CD LYS A 130 -4.508 4.626 -8.284 1.00 25.14 C ATOM 2109 CE LYS A 130 -5.751 3.843 -7.865 1.00 24.11 C ATOM 2110 NZ LYS A 130 -6.813 3.876 -8.908 1.00 64.12 N ATOM 0 H LYS A 130 -1.689 0.988 -6.745 1.00 61.44 H new ATOM 0 HA LYS A 130 -1.231 3.536 -5.747 1.00 11.41 H new ATOM 0 HB2 LYS A 130 -2.168 2.949 -7.988 1.00 63.54 H new ATOM 0 HB3 LYS A 130 -3.650 2.402 -7.230 1.00 63.54 H new ATOM 0 HG2 LYS A 130 -3.797 4.830 -6.266 1.00 5.14 H new ATOM 0 HG3 LYS A 130 -2.605 5.230 -7.486 1.00 5.14 H new ATOM 0 HD2 LYS A 130 -4.772 5.672 -8.441 1.00 25.14 H new ATOM 0 HD3 LYS A 130 -4.141 4.244 -9.236 1.00 25.14 H new ATOM 0 HE2 LYS A 130 -5.475 2.808 -7.662 1.00 24.11 H new ATOM 0 HE3 LYS A 130 -6.143 4.257 -6.936 1.00 24.11 H new ATOM 0 HZ1 LYS A 130 -7.724 4.117 -8.468 1.00 64.12 H new ATOM 0 HZ2 LYS A 130 -6.574 4.591 -9.624 1.00 64.12 H new ATOM 0 HZ3 LYS A 130 -6.884 2.943 -9.361 1.00 64.12 H new ATOM 2124 N ASP A 131 -4.038 2.203 -4.546 1.00 43.42 N ATOM 2125 CA ASP A 131 -5.039 2.324 -3.483 1.00 25.44 C ATOM 2126 C ASP A 131 -4.386 2.245 -2.093 1.00 33.32 C ATOM 2127 O ASP A 131 -4.637 3.089 -1.236 1.00 51.34 O ATOM 2128 CB ASP A 131 -6.108 1.233 -3.634 1.00 73.40 C ATOM 2129 CG ASP A 131 -7.317 1.478 -2.745 1.00 25.33 C ATOM 2130 OD1 ASP A 131 -8.187 2.288 -3.135 1.00 24.24 O ATOM 2131 OD2 ASP A 131 -7.402 0.878 -1.654 1.00 60.43 O ATOM 0 H ASP A 131 -4.200 1.428 -5.189 1.00 43.42 H new ATOM 0 HA ASP A 131 -5.515 3.300 -3.575 1.00 25.44 H new ATOM 0 HB2 ASP A 131 -6.429 1.185 -4.674 1.00 73.40 H new ATOM 0 HB3 ASP A 131 -5.672 0.264 -3.390 1.00 73.40 H new ATOM 2136 N ALA A 132 -3.530 1.244 -1.896 1.00 51.41 N ATOM 2137 CA ALA A 132 -2.832 1.039 -0.620 1.00 22.33 C ATOM 2138 C ALA A 132 -2.069 2.295 -0.171 1.00 3.25 C ATOM 2139 O ALA A 132 -2.245 2.775 0.953 1.00 34.51 O ATOM 2140 CB ALA A 132 -1.875 -0.143 -0.734 1.00 53.32 C ATOM 0 H ALA A 132 -3.299 0.553 -2.610 1.00 51.41 H new ATOM 0 HA ALA A 132 -3.587 0.827 0.138 1.00 22.33 H new ATOM 0 HB1 ALA A 132 -1.361 -0.288 0.216 1.00 53.32 H new ATOM 0 HB2 ALA A 132 -2.437 -1.043 -0.984 1.00 53.32 H new ATOM 0 HB3 ALA A 132 -1.142 0.056 -1.516 1.00 53.32 H new ATOM 2146 N VAL A 133 -1.232 2.831 -1.055 1.00 75.34 N ATOM 2147 CA VAL A 133 -0.440 4.020 -0.732 1.00 22.45 C ATOM 2148 C VAL A 133 -1.337 5.265 -0.556 1.00 61.21 C ATOM 2149 O VAL A 133 -1.020 6.166 0.225 1.00 2.24 O ATOM 2150 CB VAL A 133 0.652 4.285 -1.802 1.00 73.34 C ATOM 2151 CG1 VAL A 133 0.034 4.653 -3.149 1.00 54.42 C ATOM 2152 CG2 VAL A 133 1.619 5.367 -1.327 1.00 61.01 C ATOM 0 H VAL A 133 -1.083 2.466 -1.996 1.00 75.34 H new ATOM 0 HA VAL A 133 0.058 3.823 0.217 1.00 22.45 H new ATOM 0 HB VAL A 133 1.215 3.362 -1.942 1.00 73.34 H new ATOM 0 HG11 VAL A 133 0.826 4.832 -3.876 1.00 54.42 H new ATOM 0 HG12 VAL A 133 -0.598 3.835 -3.495 1.00 54.42 H new ATOM 0 HG13 VAL A 133 -0.568 5.555 -3.039 1.00 54.42 H new ATOM 0 HG21 VAL A 133 2.377 5.538 -2.091 1.00 61.01 H new ATOM 0 HG22 VAL A 133 1.070 6.291 -1.146 1.00 61.01 H new ATOM 0 HG23 VAL A 133 2.101 5.045 -0.404 1.00 61.01 H new ATOM 2162 N GLN A 134 -2.466 5.307 -1.274 1.00 62.15 N ATOM 2163 CA GLN A 134 -3.453 6.386 -1.098 1.00 62.51 C ATOM 2164 C GLN A 134 -4.132 6.294 0.274 1.00 14.11 C ATOM 2165 O GLN A 134 -4.402 7.314 0.909 1.00 54.34 O ATOM 2166 CB GLN A 134 -4.518 6.346 -2.209 1.00 1.14 C ATOM 2167 CG GLN A 134 -3.983 6.689 -3.595 1.00 42.13 C ATOM 2168 CD GLN A 134 -3.367 8.077 -3.664 1.00 22.42 C ATOM 2169 OE1 GLN A 134 -2.078 8.172 -3.411 1.00 71.23 O flip ATOM 2170 NE2 GLN A 134 -4.042 9.060 -3.942 1.00 1.32 N flip ATOM 0 H GLN A 134 -2.720 4.614 -1.978 1.00 62.15 H new ATOM 0 HA GLN A 134 -2.916 7.333 -1.160 1.00 62.51 H new ATOM 0 HB2 GLN A 134 -4.960 5.350 -2.238 1.00 1.14 H new ATOM 0 HB3 GLN A 134 -5.317 7.043 -1.957 1.00 1.14 H new ATOM 0 HG2 GLN A 134 -3.235 5.950 -3.883 1.00 42.13 H new ATOM 0 HG3 GLN A 134 -4.795 6.621 -4.319 1.00 42.13 H new ATOM 0 HE21 GLN A 134 -5.039 8.957 -4.133 1.00 1.32 H new ATOM 0 HE22 GLN A 134 -3.608 9.982 -3.982 1.00 1.32 H new ATOM 2179 N GLN A 135 -4.404 5.070 0.723 1.00 42.10 N ATOM 2180 CA GLN A 135 -4.970 4.837 2.056 1.00 24.13 C ATOM 2181 C GLN A 135 -4.026 5.368 3.143 1.00 54.34 C ATOM 2182 O GLN A 135 -4.445 6.090 4.048 1.00 22.14 O ATOM 2183 CB GLN A 135 -5.233 3.337 2.274 1.00 25.43 C ATOM 2184 CG GLN A 135 -6.263 2.734 1.321 1.00 60.05 C ATOM 2185 CD GLN A 135 -7.688 3.198 1.589 1.00 71.24 C ATOM 2186 OE1 GLN A 135 -7.921 4.300 2.079 1.00 21.21 O ATOM 2187 NE2 GLN A 135 -8.651 2.352 1.282 1.00 54.24 N ATOM 0 H GLN A 135 -4.242 4.220 0.183 1.00 42.10 H new ATOM 0 HA GLN A 135 -5.917 5.373 2.123 1.00 24.13 H new ATOM 0 HB2 GLN A 135 -4.293 2.796 2.164 1.00 25.43 H new ATOM 0 HB3 GLN A 135 -5.571 3.185 3.299 1.00 25.43 H new ATOM 0 HG2 GLN A 135 -5.993 2.992 0.297 1.00 60.05 H new ATOM 0 HG3 GLN A 135 -6.223 1.647 1.397 1.00 60.05 H new ATOM 0 HE21 GLN A 135 -8.422 1.445 0.876 1.00 54.24 H new ATOM 0 HE22 GLN A 135 -9.625 2.605 1.450 1.00 54.24 H new ATOM 2196 N ILE A 136 -2.747 5.007 3.036 1.00 11.54 N ATOM 2197 CA ILE A 136 -1.715 5.524 3.942 1.00 62.52 C ATOM 2198 C ILE A 136 -1.699 7.061 3.926 1.00 51.41 C ATOM 2199 O ILE A 136 -1.822 7.709 4.967 1.00 15.41 O ATOM 2200 CB ILE A 136 -0.308 5.001 3.549 1.00 3.33 C ATOM 2201 CG1 ILE A 136 -0.289 3.462 3.527 1.00 11.13 C ATOM 2202 CG2 ILE A 136 0.755 5.541 4.507 1.00 60.30 C ATOM 2203 CD1 ILE A 136 1.019 2.873 3.038 1.00 64.41 C ATOM 0 H ILE A 136 -2.398 4.358 2.331 1.00 11.54 H new ATOM 0 HA ILE A 136 -1.958 5.171 4.944 1.00 62.52 H new ATOM 0 HB ILE A 136 -0.077 5.360 2.546 1.00 3.33 H new ATOM 0 HG12 ILE A 136 -0.490 3.091 4.532 1.00 11.13 H new ATOM 0 HG13 ILE A 136 -1.098 3.107 2.888 1.00 11.13 H new ATOM 0 HG21 ILE A 136 1.734 5.163 4.214 1.00 60.30 H new ATOM 0 HG22 ILE A 136 0.760 6.630 4.468 1.00 60.30 H new ATOM 0 HG23 ILE A 136 0.529 5.215 5.522 1.00 60.30 H new ATOM 0 HD11 ILE A 136 0.955 1.785 3.051 1.00 64.41 H new ATOM 0 HD12 ILE A 136 1.213 3.213 2.021 1.00 64.41 H new ATOM 0 HD13 ILE A 136 1.830 3.197 3.690 1.00 64.41 H new ATOM 2215 N LEU A 137 -1.567 7.628 2.726 1.00 55.43 N ATOM 2216 CA LEU A 137 -1.557 9.083 2.533 1.00 52.33 C ATOM 2217 C LEU A 137 -2.781 9.756 3.180 1.00 31.02 C ATOM 2218 O LEU A 137 -2.674 10.827 3.790 1.00 71.13 O ATOM 2219 CB LEU A 137 -1.523 9.402 1.033 1.00 11.20 C ATOM 2220 CG LEU A 137 -1.530 10.897 0.680 1.00 2.41 C ATOM 2221 CD1 LEU A 137 -0.274 11.579 1.215 1.00 63.03 C ATOM 2222 CD2 LEU A 137 -1.665 11.100 -0.828 1.00 1.11 C ATOM 0 H LEU A 137 -1.464 7.096 1.862 1.00 55.43 H new ATOM 0 HA LEU A 137 -0.666 9.479 3.020 1.00 52.33 H new ATOM 0 HB2 LEU A 137 -0.631 8.948 0.602 1.00 11.20 H new ATOM 0 HB3 LEU A 137 -2.383 8.929 0.558 1.00 11.20 H new ATOM 0 HG LEU A 137 -2.395 11.358 1.156 1.00 2.41 H new ATOM 0 HD11 LEU A 137 -0.296 12.637 0.956 1.00 63.03 H new ATOM 0 HD12 LEU A 137 -0.235 11.472 2.299 1.00 63.03 H new ATOM 0 HD13 LEU A 137 0.608 11.116 0.773 1.00 63.03 H new ATOM 0 HD21 LEU A 137 -1.668 12.167 -1.053 1.00 1.11 H new ATOM 0 HD22 LEU A 137 -0.826 10.624 -1.336 1.00 1.11 H new ATOM 0 HD23 LEU A 137 -2.598 10.654 -1.173 1.00 1.11 H new ATOM 2234 N ARG A 138 -3.942 9.128 3.028 1.00 72.24 N ATOM 2235 CA ARG A 138 -5.181 9.635 3.619 1.00 10.41 C ATOM 2236 C ARG A 138 -5.090 9.687 5.150 1.00 54.53 C ATOM 2237 O ARG A 138 -5.238 10.747 5.759 1.00 61.24 O ATOM 2238 CB ARG A 138 -6.364 8.748 3.205 1.00 54.42 C ATOM 2239 CG ARG A 138 -7.696 9.183 3.812 1.00 42.25 C ATOM 2240 CD ARG A 138 -8.801 8.150 3.589 1.00 10.01 C ATOM 2241 NE ARG A 138 -10.088 8.614 4.115 1.00 11.52 N ATOM 2242 CZ ARG A 138 -10.859 7.927 4.921 1.00 32.23 C ATOM 2243 NH1 ARG A 138 -10.540 6.729 5.293 1.00 34.42 N ATOM 2244 NH2 ARG A 138 -11.963 8.450 5.349 1.00 54.32 N ATOM 0 H ARG A 138 -4.054 8.263 2.499 1.00 72.24 H new ATOM 0 HA ARG A 138 -5.335 10.649 3.250 1.00 10.41 H new ATOM 0 HB2 ARG A 138 -6.450 8.755 2.118 1.00 54.42 H new ATOM 0 HB3 ARG A 138 -6.158 7.720 3.502 1.00 54.42 H new ATOM 0 HG2 ARG A 138 -7.568 9.350 4.882 1.00 42.25 H new ATOM 0 HG3 ARG A 138 -7.998 10.135 3.375 1.00 42.25 H new ATOM 0 HD2 ARG A 138 -8.896 7.943 2.523 1.00 10.01 H new ATOM 0 HD3 ARG A 138 -8.526 7.213 4.073 1.00 10.01 H new ATOM 0 HE ARG A 138 -10.407 9.541 3.832 1.00 11.52 H new ATOM 0 HH11 ARG A 138 -9.675 6.304 4.958 1.00 34.42 H new ATOM 0 HH12 ARG A 138 -11.153 6.210 5.921 1.00 34.42 H new ATOM 0 HH21 ARG A 138 -12.228 9.391 5.058 1.00 54.32 H new ATOM 0 HH22 ARG A 138 -12.568 7.921 5.977 1.00 54.32 H new ATOM 2258 N GLN A 139 -4.823 8.534 5.759 1.00 54.04 N ATOM 2259 CA GLN A 139 -4.803 8.412 7.221 1.00 54.31 C ATOM 2260 C GLN A 139 -3.747 9.325 7.865 1.00 23.21 C ATOM 2261 O GLN A 139 -4.036 10.009 8.848 1.00 63.43 O ATOM 2262 CB GLN A 139 -4.571 6.949 7.632 1.00 72.21 C ATOM 2263 CG GLN A 139 -5.609 5.982 7.065 1.00 62.21 C ATOM 2264 CD GLN A 139 -7.039 6.366 7.426 1.00 5.40 C ATOM 2265 OE1 GLN A 139 -7.695 7.107 6.701 1.00 45.13 O ATOM 2266 NE2 GLN A 139 -7.536 5.869 8.545 1.00 14.10 N ATOM 0 H GLN A 139 -4.616 7.666 5.264 1.00 54.04 H new ATOM 0 HA GLN A 139 -5.777 8.737 7.588 1.00 54.31 H new ATOM 0 HB2 GLN A 139 -3.580 6.640 7.300 1.00 72.21 H new ATOM 0 HB3 GLN A 139 -4.579 6.880 8.720 1.00 72.21 H new ATOM 0 HG2 GLN A 139 -5.511 5.947 5.980 1.00 62.21 H new ATOM 0 HG3 GLN A 139 -5.403 4.978 7.436 1.00 62.21 H new ATOM 0 HE21 GLN A 139 -6.966 5.255 9.128 1.00 14.10 H new ATOM 0 HE22 GLN A 139 -8.489 6.099 8.826 1.00 14.10 H new ATOM 2275 N VAL A 140 -2.537 9.339 7.299 1.00 30.11 N ATOM 2276 CA VAL A 140 -1.433 10.161 7.823 1.00 11.31 C ATOM 2277 C VAL A 140 -1.809 11.652 7.911 1.00 24.52 C ATOM 2278 O VAL A 140 -1.648 12.284 8.955 1.00 61.10 O ATOM 2279 CB VAL A 140 -0.153 10.003 6.953 1.00 13.42 C ATOM 2280 CG1 VAL A 140 0.953 10.962 7.402 1.00 33.45 C ATOM 2281 CG2 VAL A 140 0.346 8.556 6.988 1.00 22.54 C ATOM 0 H VAL A 140 -2.293 8.790 6.475 1.00 30.11 H new ATOM 0 HA VAL A 140 -1.232 9.799 8.831 1.00 11.31 H new ATOM 0 HB VAL A 140 -0.417 10.258 5.927 1.00 13.42 H new ATOM 0 HG11 VAL A 140 1.832 10.824 6.772 1.00 33.45 H new ATOM 0 HG12 VAL A 140 0.601 11.990 7.314 1.00 33.45 H new ATOM 0 HG13 VAL A 140 1.214 10.756 8.440 1.00 33.45 H new ATOM 0 HG21 VAL A 140 1.242 8.465 6.374 1.00 22.54 H new ATOM 0 HG22 VAL A 140 0.580 8.277 8.015 1.00 22.54 H new ATOM 0 HG23 VAL A 140 -0.429 7.895 6.600 1.00 22.54 H new ATOM 2291 N SER A 141 -2.318 12.205 6.815 1.00 34.42 N ATOM 2292 CA SER A 141 -2.673 13.631 6.765 1.00 32.32 C ATOM 2293 C SER A 141 -3.928 13.935 7.599 1.00 2.21 C ATOM 2294 O SER A 141 -4.040 15.002 8.204 1.00 33.54 O ATOM 2295 CB SER A 141 -2.900 14.076 5.313 1.00 65.24 C ATOM 2296 OG SER A 141 -3.993 13.386 4.726 1.00 62.54 O ATOM 0 H SER A 141 -2.496 11.695 5.949 1.00 34.42 H new ATOM 0 HA SER A 141 -1.838 14.188 7.191 1.00 32.32 H new ATOM 0 HB2 SER A 141 -3.088 15.149 5.285 1.00 65.24 H new ATOM 0 HB3 SER A 141 -1.997 13.895 4.730 1.00 65.24 H new ATOM 0 HG SER A 141 -3.686 12.523 4.377 1.00 62.54 H new ATOM 2302 N ALA A 142 -4.862 12.989 7.643 1.00 54.31 N ATOM 2303 CA ALA A 142 -6.133 13.185 8.351 1.00 63.42 C ATOM 2304 C ALA A 142 -6.005 12.988 9.876 1.00 33.51 C ATOM 2305 O ALA A 142 -6.988 13.124 10.605 1.00 5.15 O ATOM 2306 CB ALA A 142 -7.192 12.252 7.780 1.00 11.10 C ATOM 0 H ALA A 142 -4.767 12.076 7.198 1.00 54.31 H new ATOM 0 HA ALA A 142 -6.433 14.221 8.196 1.00 63.42 H new ATOM 0 HB1 ALA A 142 -8.133 12.402 8.309 1.00 11.10 H new ATOM 0 HB2 ALA A 142 -7.333 12.467 6.721 1.00 11.10 H new ATOM 0 HB3 ALA A 142 -6.869 11.218 7.900 1.00 11.10 H new ATOM 2312 N PHE A 143 -4.796 12.690 10.365 1.00 74.45 N ATOM 2313 CA PHE A 143 -4.567 12.517 11.813 1.00 53.43 C ATOM 2314 C PHE A 143 -4.653 13.843 12.590 1.00 64.44 C ATOM 2315 O PHE A 143 -4.395 13.886 13.794 1.00 24.22 O ATOM 2316 CB PHE A 143 -3.215 11.832 12.080 1.00 10.45 C ATOM 2317 CG PHE A 143 -3.312 10.330 12.164 1.00 13.25 C ATOM 2318 CD1 PHE A 143 -4.188 9.742 13.064 1.00 35.23 C ATOM 2319 CD2 PHE A 143 -2.533 9.509 11.361 1.00 73.22 C ATOM 2320 CE1 PHE A 143 -4.290 8.367 13.159 1.00 12.33 C ATOM 2321 CE2 PHE A 143 -2.631 8.133 11.453 1.00 40.21 C ATOM 2322 CZ PHE A 143 -3.509 7.561 12.353 1.00 71.13 C ATOM 0 H PHE A 143 -3.964 12.563 9.789 1.00 74.45 H new ATOM 0 HA PHE A 143 -5.370 11.875 12.177 1.00 53.43 H new ATOM 0 HB2 PHE A 143 -2.517 12.100 11.287 1.00 10.45 H new ATOM 0 HB3 PHE A 143 -2.800 12.215 13.012 1.00 10.45 H new ATOM 0 HD1 PHE A 143 -4.799 10.367 13.699 1.00 35.23 H new ATOM 0 HD2 PHE A 143 -1.843 9.950 10.657 1.00 73.22 H new ATOM 0 HE1 PHE A 143 -4.979 7.923 13.862 1.00 12.33 H new ATOM 0 HE2 PHE A 143 -2.021 7.505 10.821 1.00 40.21 H new ATOM 0 HZ PHE A 143 -3.585 6.486 12.427 1.00 71.13 H new ATOM 2332 N THR A 144 -5.023 14.918 11.903 1.00 13.31 N ATOM 2333 CA THR A 144 -5.220 16.221 12.551 1.00 44.33 C ATOM 2334 C THR A 144 -6.644 16.362 13.127 1.00 63.51 C ATOM 2335 O THR A 144 -6.954 17.341 13.810 1.00 14.41 O ATOM 2336 CB THR A 144 -4.948 17.387 11.561 1.00 2.42 C ATOM 2337 OG1 THR A 144 -5.093 18.654 12.225 1.00 22.24 O ATOM 2338 CG2 THR A 144 -5.891 17.330 10.361 1.00 11.04 C ATOM 0 H THR A 144 -5.194 14.919 10.897 1.00 13.31 H new ATOM 0 HA THR A 144 -4.505 16.274 13.372 1.00 44.33 H new ATOM 0 HB THR A 144 -3.924 17.280 11.202 1.00 2.42 H new ATOM 0 HG1 THR A 144 -5.631 18.539 13.036 1.00 22.24 H new ATOM 0 HG21 THR A 144 -5.674 18.160 9.688 1.00 11.04 H new ATOM 0 HG22 THR A 144 -5.750 16.387 9.832 1.00 11.04 H new ATOM 0 HG23 THR A 144 -6.923 17.402 10.705 1.00 11.04 H new ATOM 2346 N SER A 145 -7.502 15.374 12.860 1.00 62.12 N ATOM 2347 CA SER A 145 -8.905 15.416 13.307 1.00 2.21 C ATOM 2348 C SER A 145 -9.407 14.033 13.763 1.00 11.51 C ATOM 2349 O SER A 145 -8.646 13.063 13.804 1.00 62.04 O ATOM 2350 CB SER A 145 -9.806 15.940 12.175 1.00 30.45 C ATOM 2351 OG SER A 145 -9.501 17.289 11.846 1.00 53.42 O ATOM 0 H SER A 145 -7.254 14.534 12.337 1.00 62.12 H new ATOM 0 HA SER A 145 -8.952 16.090 14.162 1.00 2.21 H new ATOM 0 HB2 SER A 145 -9.684 15.313 11.292 1.00 30.45 H new ATOM 0 HB3 SER A 145 -10.851 15.866 12.477 1.00 30.45 H new ATOM 0 HG SER A 145 -10.090 17.591 11.123 1.00 53.42 H new ATOM 2357 N ALA A 146 -10.697 13.965 14.122 1.00 55.23 N ATOM 2358 CA ALA A 146 -11.362 12.701 14.490 1.00 32.24 C ATOM 2359 C ALA A 146 -10.794 12.074 15.776 1.00 42.35 C ATOM 2360 O ALA A 146 -10.904 10.863 15.991 1.00 32.53 O ATOM 2361 CB ALA A 146 -11.283 11.710 13.331 1.00 22.42 C ATOM 0 H ALA A 146 -11.309 14.780 14.166 1.00 55.23 H new ATOM 0 HA ALA A 146 -12.405 12.940 14.697 1.00 32.24 H new ATOM 0 HB1 ALA A 146 -11.777 10.780 13.613 1.00 22.42 H new ATOM 0 HB2 ALA A 146 -11.778 12.133 12.456 1.00 22.42 H new ATOM 0 HB3 ALA A 146 -10.238 11.509 13.095 1.00 22.42 H new ATOM 2367 N GLY A 147 -10.201 12.894 16.637 1.00 21.44 N ATOM 2368 CA GLY A 147 -9.661 12.398 17.900 1.00 73.33 C ATOM 2369 C GLY A 147 -10.739 12.062 18.935 1.00 12.12 C ATOM 2370 O GLY A 147 -10.573 11.142 19.737 1.00 40.54 O ATOM 0 H GLY A 147 -10.082 13.896 16.487 1.00 21.44 H new ATOM 0 HA2 GLY A 147 -9.064 11.507 17.706 1.00 73.33 H new ATOM 0 HA3 GLY A 147 -8.988 13.147 18.318 1.00 73.33 H new ATOM 2374 N LEU A 148 -11.852 12.799 18.907 1.00 52.15 N ATOM 2375 CA LEU A 148 -12.928 12.640 19.904 1.00 1.25 C ATOM 2376 C LEU A 148 -13.991 11.608 19.471 1.00 42.02 C ATOM 2377 O LEU A 148 -15.148 11.689 19.888 1.00 73.23 O ATOM 2378 CB LEU A 148 -13.613 13.996 20.171 1.00 24.25 C ATOM 2379 CG LEU A 148 -12.759 15.063 20.888 1.00 63.32 C ATOM 2380 CD1 LEU A 148 -11.622 15.558 19.997 1.00 63.41 C ATOM 2381 CD2 LEU A 148 -13.635 16.230 21.341 1.00 44.22 C ATOM 0 H LEU A 148 -12.037 13.515 18.205 1.00 52.15 H new ATOM 0 HA LEU A 148 -12.458 12.270 20.815 1.00 1.25 H new ATOM 0 HB2 LEU A 148 -13.943 14.406 19.217 1.00 24.25 H new ATOM 0 HB3 LEU A 148 -14.508 13.816 20.767 1.00 24.25 H new ATOM 0 HG LEU A 148 -12.312 14.599 21.767 1.00 63.32 H new ATOM 0 HD11 LEU A 148 -11.040 16.308 20.533 1.00 63.41 H new ATOM 0 HD12 LEU A 148 -10.977 14.720 19.731 1.00 63.41 H new ATOM 0 HD13 LEU A 148 -12.036 15.999 19.090 1.00 63.41 H new ATOM 0 HD21 LEU A 148 -13.018 16.974 21.845 1.00 44.22 H new ATOM 0 HD22 LEU A 148 -14.114 16.683 20.473 1.00 44.22 H new ATOM 0 HD23 LEU A 148 -14.399 15.866 22.028 1.00 44.22 H new ATOM 2393 N GLU A 149 -13.594 10.618 18.676 1.00 41.20 N ATOM 2394 CA GLU A 149 -14.538 9.609 18.158 1.00 54.45 C ATOM 2395 C GLU A 149 -14.926 8.540 19.199 1.00 43.33 C ATOM 2396 O GLU A 149 -15.572 7.546 18.865 1.00 54.42 O ATOM 2397 CB GLU A 149 -13.959 8.945 16.902 1.00 43.04 C ATOM 2398 CG GLU A 149 -14.012 9.835 15.663 1.00 61.40 C ATOM 2399 CD GLU A 149 -15.438 10.130 15.219 1.00 60.32 C ATOM 2400 OE1 GLU A 149 -16.044 11.098 15.727 1.00 32.42 O ATOM 2401 OE2 GLU A 149 -15.964 9.387 14.364 1.00 72.33 O ATOM 0 H GLU A 149 -12.629 10.486 18.372 1.00 41.20 H new ATOM 0 HA GLU A 149 -15.457 10.140 17.909 1.00 54.45 H new ATOM 0 HB2 GLU A 149 -12.923 8.664 17.094 1.00 43.04 H new ATOM 0 HB3 GLU A 149 -14.507 8.024 16.702 1.00 43.04 H new ATOM 0 HG2 GLU A 149 -13.498 10.773 15.871 1.00 61.40 H new ATOM 0 HG3 GLU A 149 -13.474 9.351 14.848 1.00 61.40 H new ATOM 2408 N HIS A 150 -14.554 8.750 20.459 1.00 43.43 N ATOM 2409 CA HIS A 150 -14.946 7.842 21.548 1.00 75.14 C ATOM 2410 C HIS A 150 -16.185 8.382 22.294 1.00 61.53 C ATOM 2411 O HIS A 150 -16.292 8.269 23.518 1.00 22.35 O ATOM 2412 CB HIS A 150 -13.772 7.658 22.521 1.00 65.12 C ATOM 2413 CG HIS A 150 -12.539 7.092 21.877 1.00 44.11 C ATOM 2414 ND1 HIS A 150 -11.484 7.871 21.453 1.00 15.44 N ATOM 2415 CD2 HIS A 150 -12.189 5.812 21.596 1.00 73.11 C ATOM 2416 CE1 HIS A 150 -10.547 7.099 20.936 1.00 4.13 C ATOM 2417 NE2 HIS A 150 -10.948 5.847 21.010 1.00 31.52 N ATOM 0 H HIS A 150 -13.981 9.540 20.757 1.00 43.43 H new ATOM 0 HA HIS A 150 -15.207 6.875 21.118 1.00 75.14 H new ATOM 0 HB2 HIS A 150 -13.528 8.621 22.969 1.00 65.12 H new ATOM 0 HB3 HIS A 150 -14.083 6.999 23.332 1.00 65.12 H new ATOM 0 HD2 HIS A 150 -12.778 4.929 21.796 1.00 73.11 H new ATOM 0 HE1 HIS A 150 -9.609 7.437 20.522 1.00 4.13 H new ATOM 0 HE2 HIS A 150 -10.422 5.036 20.685 1.00 31.52 H new ATOM 2426 N HIS A 151 -17.131 8.936 21.533 1.00 23.14 N ATOM 2427 CA HIS A 151 -18.313 9.606 22.097 1.00 74.43 C ATOM 2428 C HIS A 151 -19.093 8.726 23.095 1.00 40.24 C ATOM 2429 O HIS A 151 -19.111 7.496 22.994 1.00 61.45 O ATOM 2430 CB HIS A 151 -19.242 10.061 20.966 1.00 24.14 C ATOM 2431 CG HIS A 151 -18.662 11.148 20.107 1.00 44.30 C ATOM 2432 ND1 HIS A 151 -18.224 10.943 18.818 1.00 31.30 N ATOM 2433 CD2 HIS A 151 -18.462 12.462 20.360 1.00 4.33 C ATOM 2434 CE1 HIS A 151 -17.783 12.077 18.317 1.00 14.34 C ATOM 2435 NE2 HIS A 151 -17.915 13.018 19.230 1.00 3.40 N ATOM 0 H HIS A 151 -17.103 8.935 20.513 1.00 23.14 H new ATOM 0 HA HIS A 151 -17.949 10.467 22.657 1.00 74.43 H new ATOM 0 HB2 HIS A 151 -19.482 9.203 20.338 1.00 24.14 H new ATOM 0 HB3 HIS A 151 -20.179 10.412 21.397 1.00 24.14 H new ATOM 0 HD2 HIS A 151 -18.690 12.978 21.281 1.00 4.33 H new ATOM 0 HE1 HIS A 151 -17.380 12.214 17.324 1.00 14.34 H new ATOM 0 HE2 HIS A 151 -17.654 13.997 19.116 1.00 3.40 H new ATOM 2444 N HIS A 152 -19.736 9.379 24.060 1.00 63.12 N ATOM 2445 CA HIS A 152 -20.534 8.692 25.081 1.00 64.43 C ATOM 2446 C HIS A 152 -21.519 9.663 25.753 1.00 62.45 C ATOM 2447 O HIS A 152 -21.143 10.774 26.128 1.00 42.21 O ATOM 2448 CB HIS A 152 -19.610 8.056 26.133 1.00 74.23 C ATOM 2449 CG HIS A 152 -18.620 9.011 26.739 1.00 33.11 C ATOM 2450 ND1 HIS A 152 -17.354 9.215 26.222 1.00 72.20 N ATOM 2451 CD2 HIS A 152 -18.705 9.811 27.832 1.00 53.23 C ATOM 2452 CE1 HIS A 152 -16.712 10.090 26.969 1.00 43.55 C ATOM 2453 NE2 HIS A 152 -17.505 10.466 27.949 1.00 42.33 N ATOM 0 H HIS A 152 -19.721 10.394 24.159 1.00 63.12 H new ATOM 0 HA HIS A 152 -21.112 7.906 24.594 1.00 64.43 H new ATOM 0 HB2 HIS A 152 -20.222 7.631 26.929 1.00 74.23 H new ATOM 0 HB3 HIS A 152 -19.067 7.231 25.672 1.00 74.23 H new ATOM 0 HD1 HIS A 152 -16.976 8.759 25.392 1.00 72.20 H new ATOM 0 HD2 HIS A 152 -19.558 9.913 28.487 1.00 53.23 H new ATOM 0 HE1 HIS A 152 -15.704 10.440 26.804 1.00 43.55 H new ATOM 2462 N HIS A 153 -22.780 9.248 25.889 1.00 31.42 N ATOM 2463 CA HIS A 153 -23.793 10.060 26.577 1.00 2.32 C ATOM 2464 C HIS A 153 -24.630 9.209 27.547 1.00 31.51 C ATOM 2465 O HIS A 153 -25.031 8.092 27.217 1.00 30.21 O ATOM 2466 CB HIS A 153 -24.703 10.774 25.560 1.00 14.32 C ATOM 2467 CG HIS A 153 -25.517 9.861 24.688 1.00 65.54 C ATOM 2468 ND1 HIS A 153 -25.184 9.568 23.383 1.00 1.43 N ATOM 2469 CD2 HIS A 153 -26.676 9.203 24.929 1.00 51.54 C ATOM 2470 CE1 HIS A 153 -26.100 8.776 22.863 1.00 73.50 C ATOM 2471 NE2 HIS A 153 -27.014 8.539 23.778 1.00 70.54 N ATOM 0 H HIS A 153 -23.126 8.357 25.534 1.00 31.42 H new ATOM 0 HA HIS A 153 -23.269 10.815 27.163 1.00 2.32 H new ATOM 0 HB2 HIS A 153 -25.380 11.434 26.102 1.00 14.32 H new ATOM 0 HB3 HIS A 153 -24.085 11.406 24.922 1.00 14.32 H new ATOM 0 HD2 HIS A 153 -27.231 9.202 25.856 1.00 51.54 H new ATOM 0 HE1 HIS A 153 -26.100 8.387 21.855 1.00 73.50 H new ATOM 0 HE2 HIS A 153 -27.841 7.955 23.652 1.00 70.54 H new ATOM 2480 N HIS A 154 -24.886 9.751 28.739 1.00 32.02 N ATOM 2481 CA HIS A 154 -25.676 9.069 29.775 1.00 72.33 C ATOM 2482 C HIS A 154 -25.023 7.755 30.240 1.00 3.14 C ATOM 2483 O HIS A 154 -25.207 6.699 29.630 1.00 4.01 O ATOM 2484 CB HIS A 154 -27.111 8.811 29.289 1.00 5.45 C ATOM 2485 CG HIS A 154 -27.969 10.040 29.268 1.00 40.14 C ATOM 2486 ND1 HIS A 154 -28.833 10.365 30.292 1.00 72.24 N ATOM 2487 CD2 HIS A 154 -28.096 11.026 28.346 1.00 72.11 C ATOM 2488 CE1 HIS A 154 -29.451 11.493 30.004 1.00 54.25 C ATOM 2489 NE2 HIS A 154 -29.024 11.913 28.832 1.00 63.33 N ATOM 0 H HIS A 154 -24.553 10.674 29.017 1.00 32.02 H new ATOM 0 HA HIS A 154 -25.709 9.737 30.636 1.00 72.33 H new ATOM 0 HB2 HIS A 154 -27.075 8.386 28.286 1.00 5.45 H new ATOM 0 HB3 HIS A 154 -27.575 8.065 29.934 1.00 5.45 H new ATOM 0 HD2 HIS A 154 -27.567 11.100 27.407 1.00 72.11 H new ATOM 0 HE1 HIS A 154 -30.183 11.988 30.624 1.00 54.25 H new ATOM 0 HE2 HIS A 154 -29.333 12.763 28.360 1.00 63.33 H new ATOM 2498 N HIS A 155 -24.247 7.831 31.321 1.00 44.34 N ATOM 2499 CA HIS A 155 -23.597 6.647 31.898 1.00 32.01 C ATOM 2500 C HIS A 155 -23.463 6.776 33.432 1.00 63.41 C ATOM 2501 O HIS A 155 -24.294 6.186 34.157 1.00 37.50 O ATOM 2502 CB HIS A 155 -22.219 6.436 31.249 1.00 4.14 C ATOM 2503 CG HIS A 155 -21.554 5.153 31.645 1.00 63.23 C ATOM 2504 ND1 HIS A 155 -21.705 3.977 30.941 1.00 31.05 N ATOM 2505 CD2 HIS A 155 -20.722 4.863 32.674 1.00 63.21 C ATOM 2506 CE1 HIS A 155 -21.001 3.025 31.520 1.00 51.33 C ATOM 2507 NE2 HIS A 155 -20.396 3.535 32.569 1.00 44.40 N ATOM 2508 OXT HIS A 155 -22.536 7.478 33.899 1.00 37.50 O ATOM 0 H HIS A 155 -24.051 8.700 31.818 1.00 44.34 H new ATOM 0 HA HIS A 155 -24.221 5.778 31.692 1.00 32.01 H new ATOM 0 HB2 HIS A 155 -22.331 6.457 30.165 1.00 4.14 H new ATOM 0 HB3 HIS A 155 -21.570 7.269 31.518 1.00 4.14 H new ATOM 0 HD2 HIS A 155 -20.380 5.549 33.435 1.00 63.21 H new ATOM 0 HE1 HIS A 155 -20.933 1.999 31.188 1.00 51.33 H new ATOM 0 HE2 HIS A 155 -19.782 3.025 33.204 1.00 44.40 H new TER 2517 HIS A 155