USER MOD reduce.3.24.130724 H: found=0, std=0, add=1243, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1241 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 LYS NZ :NH3+ 138:sc= 0.522 (180deg=-0.437) USER MOD Set 1.2: A 142 SER OG : rot -13:sc= -0.783 USER MOD Set 2.1: A 36 THR OG1 : rot 18:sc= 1.1 USER MOD Set 2.2: A 46 LYS NZ :NH3+ 178:sc= 1.2 (180deg=-0.00924) USER MOD Set 3.1: A 17 THR OG1 : rot -101:sc= 0.0435 USER MOD Set 3.2: A 136 THR OG1 : rot 180:sc= 0.048 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 23:sc= 0.923 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 25:sc= 0.0487 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 171:sc= -0.161 (180deg=-0.329) USER MOD Single : A 19 ASN : amide:sc= 0.857 K(o=0.86,f=-4!) USER MOD Single : A 20 ASN : amide:sc= -0.786 X(o=-0.79,f=-0.77) USER MOD Single : A 22 SER OG : rot 180:sc= 0.0146 USER MOD Single : A 24 CYS SG : rot 29:sc= -1.82 USER MOD Single : A 28 MET CE :methyl -133:sc= -2.04 (180deg=-5.08!) USER MOD Single : A 33 LYS NZ :NH3+ -126:sc=-0.00105 (180deg=-1.21) USER MOD Single : A 34 SER OG : rot 160:sc= 0.0548 USER MOD Single : A 35 SER OG : rot 180:sc= 0.00184 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN :FLIP amide:sc= -0.058 F(o=-1.7,f=-0.058) USER MOD Single : A 44 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0194) USER MOD Single : A 48 CYS SG : rot -21:sc= -1.5 USER MOD Single : A 52 ASN : amide:sc= -2.81 K(o=-2.8,f=-5.8!) USER MOD Single : A 54 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.062) USER MOD Single : A 60 SER OG : rot -47:sc= 0.655 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.14 USER MOD Single : A 65 SER OG : rot 29:sc= -0.195 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 8:sc= 0.115 USER MOD Single : A 73 CYS SG : rot 102:sc= 0.643 USER MOD Single : A 75 LYS NZ :NH3+ -155:sc= -0.275 (180deg=-1.01) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot -22:sc= 0.561 USER MOD Single : A 88 ASN : amide:sc= -6.08! C(o=-6.1!,f=-11!) USER MOD Single : A 90 LYS NZ :NH3+ -155:sc= -0.111 (180deg=-0.487) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -169:sc= -7.09! (180deg=-7.56!) USER MOD Single : A 99 SER OG : rot 122:sc= 0.221 USER MOD Single : A 100 GLN : amide:sc=-0.00189 X(o=-0.0019,f=0) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.0412 K(o=-0.041,f=-1.6) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ -132:sc= 0 (180deg=-0.864) USER MOD Single : A 127 ASN : amide:sc= -8.72! C(o=-8.7!,f=-10!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 CYS SG : rot 99:sc= 1.5 USER MOD Single : A 145 GLN :FLIP amide:sc= -3.28 F(o=-5.4!,f=-3.3) USER MOD Single : A 147 SER OG : rot -58:sc= 0.263 USER MOD Single : A 149 ASN : amide:sc= 0.239 K(o=0.24,f=-3.5!) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 43:sc= 0.725 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.658 20.632 13.981 1.00 0.00 N ATOM 2 CA GLY A 1 16.391 21.185 14.422 1.00 0.00 C ATOM 3 C GLY A 1 16.379 21.492 15.907 1.00 0.00 C ATOM 4 O GLY A 1 16.544 20.595 16.734 1.00 0.00 O ATOM 0 H1 GLY A 1 17.616 20.439 12.960 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.420 21.313 14.174 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.847 19.747 14.493 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.182 22.097 13.864 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.591 20.481 14.193 1.00 0.00 H new ATOM 8 N SER A 2 16.184 22.762 16.246 1.00 0.00 N ATOM 9 CA SER A 2 16.156 23.186 17.641 1.00 0.00 C ATOM 10 C SER A 2 14.840 22.790 18.302 1.00 0.00 C ATOM 11 O SER A 2 13.771 22.913 17.705 1.00 0.00 O ATOM 12 CB SER A 2 16.356 24.699 17.741 1.00 0.00 C ATOM 13 OG SER A 2 15.260 25.396 17.175 1.00 0.00 O ATOM 0 H SER A 2 16.043 23.516 15.573 1.00 0.00 H new ATOM 0 HA SER A 2 16.970 22.685 18.164 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.473 24.985 18.786 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.275 24.982 17.228 1.00 0.00 H new ATOM 0 HG SER A 2 15.411 26.361 17.253 1.00 0.00 H new ATOM 19 N SER A 3 14.926 22.315 19.541 1.00 0.00 N ATOM 20 CA SER A 3 13.743 21.897 20.284 1.00 0.00 C ATOM 21 C SER A 3 12.768 23.059 20.450 1.00 0.00 C ATOM 22 O SER A 3 13.113 24.098 21.011 1.00 0.00 O ATOM 23 CB SER A 3 14.143 21.351 21.656 1.00 0.00 C ATOM 24 OG SER A 3 13.013 21.217 22.500 1.00 0.00 O ATOM 0 H SER A 3 15.803 22.210 20.051 1.00 0.00 H new ATOM 0 HA SER A 3 13.248 21.108 19.718 1.00 0.00 H new ATOM 0 HB2 SER A 3 14.630 20.383 21.538 1.00 0.00 H new ATOM 0 HB3 SER A 3 14.870 22.019 22.119 1.00 0.00 H new ATOM 0 HG SER A 3 13.295 20.865 23.370 1.00 0.00 H new ATOM 30 N GLY A 4 11.547 22.873 19.958 1.00 0.00 N ATOM 31 CA GLY A 4 10.540 23.913 20.061 1.00 0.00 C ATOM 32 C GLY A 4 9.483 23.806 18.979 1.00 0.00 C ATOM 33 O GLY A 4 9.088 24.810 18.387 1.00 0.00 O ATOM 0 H GLY A 4 11.237 22.021 19.490 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.062 23.856 21.039 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.022 24.889 19.999 1.00 0.00 H new ATOM 37 N SER A 5 9.025 22.586 18.720 1.00 0.00 N ATOM 38 CA SER A 5 8.011 22.351 17.699 1.00 0.00 C ATOM 39 C SER A 5 7.338 20.997 17.903 1.00 0.00 C ATOM 40 O SER A 5 7.931 19.951 17.641 1.00 0.00 O ATOM 41 CB SER A 5 8.638 22.416 16.304 1.00 0.00 C ATOM 42 OG SER A 5 8.722 23.754 15.845 1.00 0.00 O ATOM 0 H SER A 5 9.340 21.745 19.203 1.00 0.00 H new ATOM 0 HA SER A 5 7.254 23.130 17.787 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.634 21.973 16.328 1.00 0.00 H new ATOM 0 HB3 SER A 5 8.044 21.826 15.607 1.00 0.00 H new ATOM 0 HG SER A 5 8.713 24.364 16.612 1.00 0.00 H new ATOM 48 N SER A 6 6.095 21.027 18.372 1.00 0.00 N ATOM 49 CA SER A 6 5.340 19.803 18.616 1.00 0.00 C ATOM 50 C SER A 6 5.679 18.740 17.575 1.00 0.00 C ATOM 51 O SER A 6 5.864 19.044 16.398 1.00 0.00 O ATOM 52 CB SER A 6 3.838 20.092 18.595 1.00 0.00 C ATOM 53 OG SER A 6 3.504 21.121 19.510 1.00 0.00 O ATOM 0 H SER A 6 5.589 21.885 18.591 1.00 0.00 H new ATOM 0 HA SER A 6 5.616 19.425 19.600 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.534 20.383 17.589 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.287 19.186 18.845 1.00 0.00 H new ATOM 0 HG SER A 6 2.539 21.288 19.476 1.00 0.00 H new ATOM 59 N GLY A 7 5.758 17.489 18.021 1.00 0.00 N ATOM 60 CA GLY A 7 6.075 16.399 17.117 1.00 0.00 C ATOM 61 C GLY A 7 4.835 15.706 16.588 1.00 0.00 C ATOM 62 O GLY A 7 4.805 14.481 16.461 1.00 0.00 O ATOM 0 H GLY A 7 5.608 17.212 18.991 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.658 16.783 16.280 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.701 15.672 17.635 1.00 0.00 H new ATOM 66 N LYS A 8 3.807 16.489 16.279 1.00 0.00 N ATOM 67 CA LYS A 8 2.558 15.945 15.761 1.00 0.00 C ATOM 68 C LYS A 8 2.773 15.287 14.402 1.00 0.00 C ATOM 69 O LYS A 8 3.643 15.698 13.633 1.00 0.00 O ATOM 70 CB LYS A 8 1.506 17.050 15.645 1.00 0.00 C ATOM 71 CG LYS A 8 0.086 16.526 15.509 1.00 0.00 C ATOM 72 CD LYS A 8 -0.295 16.319 14.052 1.00 0.00 C ATOM 73 CE LYS A 8 -1.794 16.460 13.843 1.00 0.00 C ATOM 74 NZ LYS A 8 -2.537 15.263 14.326 1.00 0.00 N ATOM 0 H LYS A 8 3.815 17.504 16.379 1.00 0.00 H new ATOM 0 HA LYS A 8 2.204 15.187 16.459 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.565 17.690 16.525 1.00 0.00 H new ATOM 0 HB3 LYS A 8 1.739 17.673 14.781 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -0.008 15.583 16.048 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -0.608 17.228 15.971 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.230 17.045 13.431 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.027 15.330 13.728 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.152 17.346 14.368 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.000 16.612 12.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -3.556 15.399 14.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -2.214 14.421 13.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.361 15.132 15.343 1.00 0.00 H new ATOM 88 N VAL A 9 1.975 14.265 14.111 1.00 0.00 N ATOM 89 CA VAL A 9 2.076 13.552 12.843 1.00 0.00 C ATOM 90 C VAL A 9 0.700 13.322 12.230 1.00 0.00 C ATOM 91 O VAL A 9 -0.208 12.813 12.889 1.00 0.00 O ATOM 92 CB VAL A 9 2.782 12.194 13.017 1.00 0.00 C ATOM 93 CG1 VAL A 9 2.084 11.362 14.082 1.00 0.00 C ATOM 94 CG2 VAL A 9 2.834 11.447 11.693 1.00 0.00 C ATOM 0 H VAL A 9 1.251 13.912 14.737 1.00 0.00 H new ATOM 0 HA VAL A 9 2.668 14.178 12.175 1.00 0.00 H new ATOM 0 HB VAL A 9 3.805 12.375 13.345 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.597 10.406 14.191 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.105 11.896 15.032 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.049 11.187 13.787 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.336 10.490 11.835 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.820 11.275 11.332 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.383 12.040 10.962 1.00 0.00 H new ATOM 104 N VAL A 10 0.551 13.700 10.964 1.00 0.00 N ATOM 105 CA VAL A 10 -0.716 13.533 10.261 1.00 0.00 C ATOM 106 C VAL A 10 -0.769 12.193 9.536 1.00 0.00 C ATOM 107 O VAL A 10 -0.197 12.034 8.458 1.00 0.00 O ATOM 108 CB VAL A 10 -0.944 14.665 9.242 1.00 0.00 C ATOM 109 CG1 VAL A 10 -2.197 14.399 8.420 1.00 0.00 C ATOM 110 CG2 VAL A 10 -1.037 16.008 9.950 1.00 0.00 C ATOM 0 H VAL A 10 1.291 14.124 10.405 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.504 13.567 11.014 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.092 14.696 8.563 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.342 15.209 7.705 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.087 13.457 7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.061 14.340 9.082 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.198 16.796 9.215 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.870 15.992 10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.110 16.200 10.490 1.00 0.00 H new ATOM 120 N LYS A 11 -1.462 11.230 10.135 1.00 0.00 N ATOM 121 CA LYS A 11 -1.593 9.903 9.547 1.00 0.00 C ATOM 122 C LYS A 11 -3.047 9.604 9.196 1.00 0.00 C ATOM 123 O LYS A 11 -3.959 10.300 9.643 1.00 0.00 O ATOM 124 CB LYS A 11 -1.062 8.840 10.512 1.00 0.00 C ATOM 125 CG LYS A 11 -1.988 8.565 11.684 1.00 0.00 C ATOM 126 CD LYS A 11 -1.673 9.466 12.867 1.00 0.00 C ATOM 127 CE LYS A 11 -0.654 8.826 13.797 1.00 0.00 C ATOM 128 NZ LYS A 11 -1.295 7.897 14.768 1.00 0.00 N ATOM 0 H LYS A 11 -1.942 11.345 11.028 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.004 9.880 8.630 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.899 7.912 9.963 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -0.092 9.160 10.893 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.022 8.717 11.375 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -1.895 7.522 11.985 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -1.290 10.421 12.507 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.589 9.678 13.419 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.084 8.282 13.208 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.118 9.605 14.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.567 7.482 15.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -1.981 8.421 15.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.785 7.139 14.252 1.00 0.00 H new ATOM 142 N PHE A 12 -3.257 8.565 8.395 1.00 0.00 N ATOM 143 CA PHE A 12 -4.601 8.175 7.984 1.00 0.00 C ATOM 144 C PHE A 12 -4.658 6.686 7.657 1.00 0.00 C ATOM 145 O PHE A 12 -3.714 6.125 7.101 1.00 0.00 O ATOM 146 CB PHE A 12 -5.044 8.993 6.770 1.00 0.00 C ATOM 147 CG PHE A 12 -3.969 9.160 5.734 1.00 0.00 C ATOM 148 CD1 PHE A 12 -3.087 10.226 5.798 1.00 0.00 C ATOM 149 CD2 PHE A 12 -3.841 8.250 4.697 1.00 0.00 C ATOM 150 CE1 PHE A 12 -2.096 10.382 4.846 1.00 0.00 C ATOM 151 CE2 PHE A 12 -2.852 8.400 3.744 1.00 0.00 C ATOM 152 CZ PHE A 12 -1.980 9.469 3.818 1.00 0.00 C ATOM 0 H PHE A 12 -2.514 7.978 8.017 1.00 0.00 H new ATOM 0 HA PHE A 12 -5.280 8.373 8.813 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -5.907 8.510 6.312 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.371 9.978 7.105 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.174 10.944 6.600 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.522 7.414 4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.414 11.217 4.907 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.761 7.682 2.942 1.00 0.00 H new ATOM 0 HZ PHE A 12 -1.208 9.590 3.072 1.00 0.00 H new ATOM 162 N SER A 13 -5.773 6.052 8.006 1.00 0.00 N ATOM 163 CA SER A 13 -5.953 4.627 7.754 1.00 0.00 C ATOM 164 C SER A 13 -6.949 4.397 6.621 1.00 0.00 C ATOM 165 O SER A 13 -8.039 4.969 6.612 1.00 0.00 O ATOM 166 CB SER A 13 -6.435 3.919 9.022 1.00 0.00 C ATOM 167 OG SER A 13 -7.630 4.505 9.510 1.00 0.00 O ATOM 0 H SER A 13 -6.565 6.503 8.464 1.00 0.00 H new ATOM 0 HA SER A 13 -4.989 4.212 7.458 1.00 0.00 H new ATOM 0 HB2 SER A 13 -6.604 2.863 8.811 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.661 3.971 9.788 1.00 0.00 H new ATOM 0 HG SER A 13 -8.103 4.946 8.773 1.00 0.00 H new ATOM 173 N TYR A 14 -6.565 3.557 5.666 1.00 0.00 N ATOM 174 CA TYR A 14 -7.422 3.253 4.526 1.00 0.00 C ATOM 175 C TYR A 14 -7.622 1.747 4.382 1.00 0.00 C ATOM 176 O TYR A 14 -6.690 1.015 4.052 1.00 0.00 O ATOM 177 CB TYR A 14 -6.819 3.824 3.242 1.00 0.00 C ATOM 178 CG TYR A 14 -7.504 3.340 1.984 1.00 0.00 C ATOM 179 CD1 TYR A 14 -8.861 3.560 1.780 1.00 0.00 C ATOM 180 CD2 TYR A 14 -6.795 2.662 1.000 1.00 0.00 C ATOM 181 CE1 TYR A 14 -9.492 3.118 0.633 1.00 0.00 C ATOM 182 CE2 TYR A 14 -7.417 2.218 -0.151 1.00 0.00 C ATOM 183 CZ TYR A 14 -8.765 2.449 -0.330 1.00 0.00 C ATOM 184 OH TYR A 14 -9.389 2.007 -1.475 1.00 0.00 O ATOM 0 H TYR A 14 -5.666 3.075 5.659 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.394 3.715 4.700 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.871 4.912 3.279 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -5.763 3.557 3.196 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.432 4.086 2.531 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.740 2.479 1.137 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.548 3.295 0.491 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -6.851 1.693 -0.906 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.736 1.557 -2.050 1.00 0.00 H new ATOM 194 N MET A 15 -8.846 1.293 4.630 1.00 0.00 N ATOM 195 CA MET A 15 -9.171 -0.125 4.526 1.00 0.00 C ATOM 196 C MET A 15 -9.610 -0.479 3.109 1.00 0.00 C ATOM 197 O MET A 15 -10.614 0.033 2.614 1.00 0.00 O ATOM 198 CB MET A 15 -10.273 -0.492 5.521 1.00 0.00 C ATOM 199 CG MET A 15 -10.322 -1.974 5.854 1.00 0.00 C ATOM 200 SD MET A 15 -11.869 -2.458 6.646 1.00 0.00 S ATOM 201 CE MET A 15 -11.687 -1.678 8.248 1.00 0.00 C ATOM 0 H MET A 15 -9.629 1.886 4.904 1.00 0.00 H new ATOM 0 HA MET A 15 -8.274 -0.696 4.763 1.00 0.00 H new ATOM 0 HB2 MET A 15 -10.124 0.074 6.441 1.00 0.00 H new ATOM 0 HB3 MET A 15 -11.236 -0.188 5.112 1.00 0.00 H new ATOM 0 HG2 MET A 15 -10.190 -2.552 4.940 1.00 0.00 H new ATOM 0 HG3 MET A 15 -9.489 -2.222 6.511 1.00 0.00 H new ATOM 0 HE1 MET A 15 -12.627 -1.749 8.796 1.00 0.00 H new ATOM 0 HE2 MET A 15 -10.900 -2.181 8.810 1.00 0.00 H new ATOM 0 HE3 MET A 15 -11.423 -0.629 8.114 1.00 0.00 H new ATOM 211 N TRP A 16 -8.853 -1.358 2.462 1.00 0.00 N ATOM 212 CA TRP A 16 -9.165 -1.780 1.101 1.00 0.00 C ATOM 213 C TRP A 16 -9.437 -3.279 1.045 1.00 0.00 C ATOM 214 O TRP A 16 -8.510 -4.088 1.017 1.00 0.00 O ATOM 215 CB TRP A 16 -8.015 -1.422 0.158 1.00 0.00 C ATOM 216 CG TRP A 16 -8.100 -2.111 -1.170 1.00 0.00 C ATOM 217 CD1 TRP A 16 -9.236 -2.512 -1.814 1.00 0.00 C ATOM 218 CD2 TRP A 16 -7.006 -2.480 -2.016 1.00 0.00 C ATOM 219 NE1 TRP A 16 -8.913 -3.108 -3.009 1.00 0.00 N ATOM 220 CE2 TRP A 16 -7.552 -3.100 -3.157 1.00 0.00 C ATOM 221 CE3 TRP A 16 -5.618 -2.345 -1.922 1.00 0.00 C ATOM 222 CZ2 TRP A 16 -6.757 -3.584 -4.193 1.00 0.00 C ATOM 223 CZ3 TRP A 16 -4.831 -2.826 -2.951 1.00 0.00 C ATOM 224 CH2 TRP A 16 -5.401 -3.439 -4.074 1.00 0.00 C ATOM 0 H TRP A 16 -8.019 -1.792 2.858 1.00 0.00 H new ATOM 0 HA TRP A 16 -10.065 -1.254 0.781 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -8.006 -0.344 -0.000 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -7.070 -1.682 0.634 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -10.240 -2.380 -1.439 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -9.579 -3.494 -3.678 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -5.169 -1.873 -1.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -7.195 -4.057 -5.060 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -3.757 -2.728 -2.888 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.758 -3.804 -4.861 1.00 0.00 H new ATOM 235 N THR A 17 -10.715 -3.644 1.030 1.00 0.00 N ATOM 236 CA THR A 17 -11.109 -5.046 0.979 1.00 0.00 C ATOM 237 C THR A 17 -11.249 -5.525 -0.462 1.00 0.00 C ATOM 238 O THR A 17 -12.140 -5.085 -1.188 1.00 0.00 O ATOM 239 CB THR A 17 -12.440 -5.283 1.718 1.00 0.00 C ATOM 240 OG1 THR A 17 -12.346 -4.802 3.063 1.00 0.00 O ATOM 241 CG2 THR A 17 -12.798 -6.761 1.726 1.00 0.00 C ATOM 0 H THR A 17 -11.495 -2.987 1.052 1.00 0.00 H new ATOM 0 HA THR A 17 -10.321 -5.614 1.474 1.00 0.00 H new ATOM 0 HB THR A 17 -13.224 -4.738 1.192 1.00 0.00 H new ATOM 0 HG1 THR A 17 -12.201 -5.557 3.671 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.741 -6.904 2.253 1.00 0.00 H new ATOM 0 HG22 THR A 17 -12.898 -7.117 0.701 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.012 -7.323 2.230 1.00 0.00 H new ATOM 249 N ILE A 18 -10.363 -6.429 -0.868 1.00 0.00 N ATOM 250 CA ILE A 18 -10.390 -6.969 -2.222 1.00 0.00 C ATOM 251 C ILE A 18 -11.308 -8.183 -2.311 1.00 0.00 C ATOM 252 O ILE A 18 -10.918 -9.295 -1.958 1.00 0.00 O ATOM 253 CB ILE A 18 -8.980 -7.368 -2.696 1.00 0.00 C ATOM 254 CG1 ILE A 18 -8.055 -6.149 -2.701 1.00 0.00 C ATOM 255 CG2 ILE A 18 -9.045 -7.996 -4.080 1.00 0.00 C ATOM 256 CD1 ILE A 18 -6.586 -6.505 -2.635 1.00 0.00 C ATOM 0 H ILE A 18 -9.618 -6.802 -0.279 1.00 0.00 H new ATOM 0 HA ILE A 18 -10.772 -6.180 -2.870 1.00 0.00 H new ATOM 0 HB ILE A 18 -8.575 -8.105 -2.002 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.239 -5.567 -3.604 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.304 -5.510 -1.854 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -8.041 -8.273 -4.402 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -9.674 -8.886 -4.047 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -9.467 -7.280 -4.785 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -5.990 -5.593 -2.642 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.387 -7.061 -1.719 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.321 -7.118 -3.496 1.00 0.00 H new ATOM 268 N ASN A 19 -12.528 -7.962 -2.788 1.00 0.00 N ATOM 269 CA ASN A 19 -13.502 -9.039 -2.925 1.00 0.00 C ATOM 270 C ASN A 19 -13.084 -10.013 -4.022 1.00 0.00 C ATOM 271 O ASN A 19 -12.737 -9.605 -5.129 1.00 0.00 O ATOM 272 CB ASN A 19 -14.886 -8.466 -3.237 1.00 0.00 C ATOM 273 CG ASN A 19 -15.093 -7.091 -2.632 1.00 0.00 C ATOM 274 OD1 ASN A 19 -14.411 -6.132 -2.994 1.00 0.00 O ATOM 275 ND2 ASN A 19 -16.037 -6.989 -1.703 1.00 0.00 N ATOM 0 H ASN A 19 -12.866 -7.047 -3.086 1.00 0.00 H new ATOM 0 HA ASN A 19 -13.545 -9.580 -1.980 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -15.017 -8.408 -4.318 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -15.651 -9.145 -2.859 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -16.220 -6.089 -1.259 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -16.578 -7.810 -1.434 1.00 0.00 H new ATOM 282 N ASN A 20 -13.121 -11.303 -3.705 1.00 0.00 N ATOM 283 CA ASN A 20 -12.746 -12.337 -4.664 1.00 0.00 C ATOM 284 C ASN A 20 -11.234 -12.374 -4.859 1.00 0.00 C ATOM 285 O ASN A 20 -10.744 -12.439 -5.987 1.00 0.00 O ATOM 286 CB ASN A 20 -13.439 -12.092 -6.006 1.00 0.00 C ATOM 287 CG ASN A 20 -14.863 -11.599 -5.840 1.00 0.00 C ATOM 288 OD1 ASN A 20 -15.676 -12.229 -5.163 1.00 0.00 O ATOM 289 ND2 ASN A 20 -15.173 -10.466 -6.459 1.00 0.00 N ATOM 0 H ASN A 20 -13.407 -11.658 -2.792 1.00 0.00 H new ATOM 0 HA ASN A 20 -13.067 -13.300 -4.267 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -12.869 -11.360 -6.578 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.442 -13.016 -6.584 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.116 -10.085 -6.384 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.468 -9.976 -7.010 1.00 0.00 H new ATOM 296 N PHE A 21 -10.499 -12.335 -3.753 1.00 0.00 N ATOM 297 CA PHE A 21 -9.041 -12.364 -3.801 1.00 0.00 C ATOM 298 C PHE A 21 -8.548 -13.569 -4.597 1.00 0.00 C ATOM 299 O PHE A 21 -7.589 -13.471 -5.362 1.00 0.00 O ATOM 300 CB PHE A 21 -8.463 -12.402 -2.385 1.00 0.00 C ATOM 301 CG PHE A 21 -6.963 -12.455 -2.352 1.00 0.00 C ATOM 302 CD1 PHE A 21 -6.208 -11.486 -2.993 1.00 0.00 C ATOM 303 CD2 PHE A 21 -6.307 -13.473 -1.678 1.00 0.00 C ATOM 304 CE1 PHE A 21 -4.827 -11.532 -2.964 1.00 0.00 C ATOM 305 CE2 PHE A 21 -4.926 -13.524 -1.646 1.00 0.00 C ATOM 306 CZ PHE A 21 -4.185 -12.552 -2.289 1.00 0.00 C ATOM 0 H PHE A 21 -10.889 -12.283 -2.812 1.00 0.00 H new ATOM 0 HA PHE A 21 -8.700 -11.457 -4.300 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -8.800 -11.520 -1.840 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -8.861 -13.271 -1.862 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.704 -10.686 -3.521 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.881 -14.235 -1.172 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.250 -10.771 -3.469 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -4.427 -14.323 -1.119 1.00 0.00 H new ATOM 0 HZ PHE A 21 -3.106 -12.589 -2.264 1.00 0.00 H new ATOM 316 N SER A 22 -9.211 -14.706 -4.409 1.00 0.00 N ATOM 317 CA SER A 22 -8.838 -15.932 -5.105 1.00 0.00 C ATOM 318 C SER A 22 -9.087 -15.803 -6.605 1.00 0.00 C ATOM 319 O SER A 22 -8.583 -16.596 -7.400 1.00 0.00 O ATOM 320 CB SER A 22 -9.624 -17.120 -4.547 1.00 0.00 C ATOM 321 OG SER A 22 -10.994 -16.796 -4.388 1.00 0.00 O ATOM 0 H SER A 22 -10.009 -14.803 -3.781 1.00 0.00 H new ATOM 0 HA SER A 22 -7.773 -16.102 -4.944 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.524 -17.973 -5.218 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.204 -17.419 -3.587 1.00 0.00 H new ATOM 0 HG SER A 22 -11.475 -17.572 -4.032 1.00 0.00 H new ATOM 327 N PHE A 23 -9.870 -14.798 -6.984 1.00 0.00 N ATOM 328 CA PHE A 23 -10.188 -14.564 -8.387 1.00 0.00 C ATOM 329 C PHE A 23 -9.305 -13.464 -8.969 1.00 0.00 C ATOM 330 O PHE A 23 -9.657 -12.833 -9.967 1.00 0.00 O ATOM 331 CB PHE A 23 -11.662 -14.185 -8.542 1.00 0.00 C ATOM 332 CG PHE A 23 -12.596 -15.357 -8.442 1.00 0.00 C ATOM 333 CD1 PHE A 23 -12.421 -16.317 -7.458 1.00 0.00 C ATOM 334 CD2 PHE A 23 -13.649 -15.498 -9.332 1.00 0.00 C ATOM 335 CE1 PHE A 23 -13.279 -17.396 -7.363 1.00 0.00 C ATOM 336 CE2 PHE A 23 -14.510 -16.576 -9.241 1.00 0.00 C ATOM 337 CZ PHE A 23 -14.324 -17.526 -8.257 1.00 0.00 C ATOM 0 H PHE A 23 -10.296 -14.133 -6.339 1.00 0.00 H new ATOM 0 HA PHE A 23 -9.998 -15.487 -8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.924 -13.456 -7.776 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -11.804 -13.699 -9.507 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -11.605 -16.221 -6.757 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -13.799 -14.758 -10.105 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -13.133 -18.137 -6.591 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -15.328 -16.675 -9.940 1.00 0.00 H new ATOM 0 HZ PHE A 23 -14.995 -18.370 -8.186 1.00 0.00 H new ATOM 347 N CYS A 24 -8.157 -13.240 -8.339 1.00 0.00 N ATOM 348 CA CYS A 24 -7.223 -12.216 -8.793 1.00 0.00 C ATOM 349 C CYS A 24 -6.651 -12.569 -10.162 1.00 0.00 C ATOM 350 O CYS A 24 -6.204 -13.694 -10.387 1.00 0.00 O ATOM 351 CB CYS A 24 -6.089 -12.046 -7.781 1.00 0.00 C ATOM 352 SG CYS A 24 -5.106 -13.541 -7.517 1.00 0.00 S ATOM 0 H CYS A 24 -7.851 -13.754 -7.513 1.00 0.00 H new ATOM 0 HA CYS A 24 -7.767 -11.276 -8.879 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -5.431 -11.246 -8.120 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -6.512 -11.729 -6.828 1.00 0.00 H new ATOM 0 HG CYS A 24 -5.110 -14.260 -8.600 1.00 0.00 H new ATOM 358 N ARG A 25 -6.670 -11.601 -11.073 1.00 0.00 N ATOM 359 CA ARG A 25 -6.156 -11.811 -12.421 1.00 0.00 C ATOM 360 C ARG A 25 -4.895 -10.984 -12.657 1.00 0.00 C ATOM 361 O ARG A 25 -4.966 -9.850 -13.129 1.00 0.00 O ATOM 362 CB ARG A 25 -7.220 -11.446 -13.458 1.00 0.00 C ATOM 363 CG ARG A 25 -8.080 -12.623 -13.888 1.00 0.00 C ATOM 364 CD ARG A 25 -9.276 -12.805 -12.967 1.00 0.00 C ATOM 365 NE ARG A 25 -10.238 -13.766 -13.502 1.00 0.00 N ATOM 366 CZ ARG A 25 -10.134 -15.079 -13.334 1.00 0.00 C ATOM 367 NH1 ARG A 25 -9.118 -15.586 -12.650 1.00 0.00 N ATOM 368 NH2 ARG A 25 -11.049 -15.889 -13.851 1.00 0.00 N ATOM 0 H ARG A 25 -7.036 -10.664 -10.902 1.00 0.00 H new ATOM 0 HA ARG A 25 -5.903 -12.866 -12.526 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -7.863 -10.668 -13.048 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -6.730 -11.025 -14.336 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -8.427 -12.468 -14.910 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -7.479 -13.532 -13.890 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -8.932 -13.142 -11.989 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -9.768 -11.844 -12.818 1.00 0.00 H new ATOM 0 HE ARG A 25 -11.032 -13.409 -14.033 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -8.413 -14.967 -12.251 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -9.042 -16.595 -12.523 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -11.833 -15.503 -14.378 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -10.969 -16.898 -13.722 1.00 0.00 H new ATOM 382 N GLU A 26 -3.745 -11.560 -12.324 1.00 0.00 N ATOM 383 CA GLU A 26 -2.469 -10.875 -12.499 1.00 0.00 C ATOM 384 C GLU A 26 -1.355 -11.871 -12.807 1.00 0.00 C ATOM 385 O GLU A 26 -1.193 -12.871 -12.110 1.00 0.00 O ATOM 386 CB GLU A 26 -2.119 -10.074 -11.243 1.00 0.00 C ATOM 387 CG GLU A 26 -3.049 -8.898 -10.993 1.00 0.00 C ATOM 388 CD GLU A 26 -2.911 -7.812 -12.043 1.00 0.00 C ATOM 389 OE1 GLU A 26 -3.331 -8.044 -13.196 1.00 0.00 O ATOM 390 OE2 GLU A 26 -2.384 -6.730 -11.710 1.00 0.00 O ATOM 0 H GLU A 26 -3.670 -12.499 -11.932 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.565 -10.191 -13.342 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -2.146 -10.738 -10.379 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -1.097 -9.706 -11.330 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.080 -9.252 -10.975 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.840 -8.476 -10.010 1.00 0.00 H new ATOM 397 N GLU A 27 -0.590 -11.587 -13.857 1.00 0.00 N ATOM 398 CA GLU A 27 0.508 -12.458 -14.258 1.00 0.00 C ATOM 399 C GLU A 27 1.774 -12.139 -13.467 1.00 0.00 C ATOM 400 O GLU A 27 1.794 -11.213 -12.656 1.00 0.00 O ATOM 401 CB GLU A 27 0.781 -12.315 -15.757 1.00 0.00 C ATOM 402 CG GLU A 27 1.290 -10.939 -16.154 1.00 0.00 C ATOM 403 CD GLU A 27 1.706 -10.869 -17.611 1.00 0.00 C ATOM 404 OE1 GLU A 27 2.732 -11.485 -17.966 1.00 0.00 O ATOM 405 OE2 GLU A 27 1.003 -10.197 -18.395 1.00 0.00 O ATOM 0 H GLU A 27 -0.711 -10.762 -14.444 1.00 0.00 H new ATOM 0 HA GLU A 27 0.217 -13.487 -14.045 1.00 0.00 H new ATOM 0 HB2 GLU A 27 1.513 -13.065 -16.058 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.136 -12.527 -16.307 1.00 0.00 H new ATOM 0 HG2 GLU A 27 0.511 -10.200 -15.966 1.00 0.00 H new ATOM 0 HG3 GLU A 27 2.139 -10.674 -15.524 1.00 0.00 H new ATOM 412 N MET A 28 2.827 -12.912 -13.709 1.00 0.00 N ATOM 413 CA MET A 28 4.096 -12.712 -13.020 1.00 0.00 C ATOM 414 C MET A 28 4.565 -11.267 -13.154 1.00 0.00 C ATOM 415 O MET A 28 4.965 -10.832 -14.233 1.00 0.00 O ATOM 416 CB MET A 28 5.160 -13.659 -13.578 1.00 0.00 C ATOM 417 CG MET A 28 6.211 -14.063 -12.557 1.00 0.00 C ATOM 418 SD MET A 28 5.760 -15.553 -11.647 1.00 0.00 S ATOM 419 CE MET A 28 5.746 -14.932 -9.967 1.00 0.00 C ATOM 0 H MET A 28 2.827 -13.683 -14.377 1.00 0.00 H new ATOM 0 HA MET A 28 3.945 -12.930 -11.963 1.00 0.00 H new ATOM 0 HB2 MET A 28 4.672 -14.556 -13.959 1.00 0.00 H new ATOM 0 HB3 MET A 28 5.653 -13.180 -14.424 1.00 0.00 H new ATOM 0 HG2 MET A 28 7.161 -14.226 -13.065 1.00 0.00 H new ATOM 0 HG3 MET A 28 6.362 -13.244 -11.854 1.00 0.00 H new ATOM 0 HE1 MET A 28 6.293 -15.619 -9.321 1.00 0.00 H new ATOM 0 HE2 MET A 28 6.220 -13.951 -9.938 1.00 0.00 H new ATOM 0 HE3 MET A 28 4.717 -14.848 -9.619 1.00 0.00 H new ATOM 429 N GLY A 29 4.513 -10.527 -12.051 1.00 0.00 N ATOM 430 CA GLY A 29 4.935 -9.138 -12.068 1.00 0.00 C ATOM 431 C GLY A 29 3.775 -8.177 -11.900 1.00 0.00 C ATOM 432 O GLY A 29 3.867 -7.210 -11.145 1.00 0.00 O ATOM 0 H GLY A 29 4.186 -10.864 -11.146 1.00 0.00 H new ATOM 0 HA2 GLY A 29 5.659 -8.972 -11.270 1.00 0.00 H new ATOM 0 HA3 GLY A 29 5.444 -8.928 -13.009 1.00 0.00 H new ATOM 436 N GLU A 30 2.681 -8.443 -12.606 1.00 0.00 N ATOM 437 CA GLU A 30 1.499 -7.592 -12.532 1.00 0.00 C ATOM 438 C GLU A 30 1.244 -7.139 -11.098 1.00 0.00 C ATOM 439 O GLU A 30 1.695 -7.774 -10.144 1.00 0.00 O ATOM 440 CB GLU A 30 0.274 -8.335 -13.070 1.00 0.00 C ATOM 441 CG GLU A 30 0.061 -8.158 -14.564 1.00 0.00 C ATOM 442 CD GLU A 30 -0.271 -6.727 -14.939 1.00 0.00 C ATOM 443 OE1 GLU A 30 -1.246 -6.179 -14.382 1.00 0.00 O ATOM 444 OE2 GLU A 30 0.442 -6.155 -15.790 1.00 0.00 O ATOM 0 H GLU A 30 2.588 -9.240 -13.235 1.00 0.00 H new ATOM 0 HA GLU A 30 1.679 -6.710 -13.147 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.379 -9.397 -12.850 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.613 -7.986 -12.541 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.960 -8.470 -15.095 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.746 -8.813 -14.892 1.00 0.00 H new ATOM 451 N VAL A 31 0.517 -6.035 -10.953 1.00 0.00 N ATOM 452 CA VAL A 31 0.201 -5.496 -9.635 1.00 0.00 C ATOM 453 C VAL A 31 -1.145 -4.780 -9.644 1.00 0.00 C ATOM 454 O VAL A 31 -1.496 -4.108 -10.614 1.00 0.00 O ATOM 455 CB VAL A 31 1.288 -4.517 -9.154 1.00 0.00 C ATOM 456 CG1 VAL A 31 1.326 -3.283 -10.042 1.00 0.00 C ATOM 457 CG2 VAL A 31 1.051 -4.132 -7.701 1.00 0.00 C ATOM 0 H VAL A 31 0.136 -5.497 -11.731 1.00 0.00 H new ATOM 0 HA VAL A 31 0.155 -6.342 -8.949 1.00 0.00 H new ATOM 0 HB VAL A 31 2.256 -5.013 -9.222 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.100 -2.603 -9.687 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.546 -3.579 -11.068 1.00 0.00 H new ATOM 0 HG13 VAL A 31 0.359 -2.781 -10.009 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.828 -3.440 -7.377 1.00 0.00 H new ATOM 0 HG22 VAL A 31 0.076 -3.654 -7.606 1.00 0.00 H new ATOM 0 HG23 VAL A 31 1.079 -5.026 -7.078 1.00 0.00 H new ATOM 467 N ILE A 32 -1.894 -4.928 -8.556 1.00 0.00 N ATOM 468 CA ILE A 32 -3.201 -4.294 -8.438 1.00 0.00 C ATOM 469 C ILE A 32 -3.101 -2.960 -7.706 1.00 0.00 C ATOM 470 O ILE A 32 -2.976 -2.918 -6.482 1.00 0.00 O ATOM 471 CB ILE A 32 -4.201 -5.200 -7.695 1.00 0.00 C ATOM 472 CG1 ILE A 32 -4.333 -6.546 -8.411 1.00 0.00 C ATOM 473 CG2 ILE A 32 -5.556 -4.517 -7.588 1.00 0.00 C ATOM 474 CD1 ILE A 32 -4.683 -7.691 -7.487 1.00 0.00 C ATOM 0 H ILE A 32 -1.618 -5.481 -7.745 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.561 -4.123 -9.452 1.00 0.00 H new ATOM 0 HB ILE A 32 -3.826 -5.380 -6.688 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.100 -6.465 -9.182 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.395 -6.772 -8.917 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.252 -5.170 -7.061 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.449 -3.581 -7.039 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.939 -4.310 -8.587 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -4.760 -8.613 -8.063 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.905 -7.799 -6.731 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.636 -7.487 -7.000 1.00 0.00 H new ATOM 486 N LYS A 33 -3.159 -1.870 -8.464 1.00 0.00 N ATOM 487 CA LYS A 33 -3.077 -0.533 -7.889 1.00 0.00 C ATOM 488 C LYS A 33 -4.460 -0.028 -7.487 1.00 0.00 C ATOM 489 O LYS A 33 -5.319 0.199 -8.337 1.00 0.00 O ATOM 490 CB LYS A 33 -2.440 0.436 -8.887 1.00 0.00 C ATOM 491 CG LYS A 33 -0.921 0.395 -8.890 1.00 0.00 C ATOM 492 CD LYS A 33 -0.340 1.342 -9.927 1.00 0.00 C ATOM 493 CE LYS A 33 -0.328 0.713 -11.311 1.00 0.00 C ATOM 494 NZ LYS A 33 0.725 -0.333 -11.436 1.00 0.00 N ATOM 0 H LYS A 33 -3.263 -1.887 -9.479 1.00 0.00 H new ATOM 0 HA LYS A 33 -2.454 -0.587 -6.996 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.803 0.204 -9.888 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.767 1.450 -8.656 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.547 0.662 -7.902 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.584 -0.621 -9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.924 2.262 -9.949 1.00 0.00 H new ATOM 0 HD3 LYS A 33 0.676 1.617 -9.642 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.303 0.273 -11.518 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -0.162 1.487 -12.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 1.329 -0.122 -12.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.305 -0.346 -10.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 0.277 -1.263 -11.566 1.00 0.00 H new ATOM 508 N SER A 34 -4.666 0.145 -6.185 1.00 0.00 N ATOM 509 CA SER A 34 -5.945 0.621 -5.670 1.00 0.00 C ATOM 510 C SER A 34 -6.127 2.108 -5.959 1.00 0.00 C ATOM 511 O SER A 34 -5.177 2.803 -6.317 1.00 0.00 O ATOM 512 CB SER A 34 -6.039 0.366 -4.165 1.00 0.00 C ATOM 513 OG SER A 34 -5.124 1.181 -3.452 1.00 0.00 O ATOM 0 H SER A 34 -3.964 -0.037 -5.468 1.00 0.00 H new ATOM 0 HA SER A 34 -6.740 0.071 -6.174 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.054 0.567 -3.822 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.834 -0.684 -3.957 1.00 0.00 H new ATOM 0 HG SER A 34 -5.407 1.249 -2.516 1.00 0.00 H new ATOM 519 N SER A 35 -7.356 2.588 -5.800 1.00 0.00 N ATOM 520 CA SER A 35 -7.666 3.992 -6.046 1.00 0.00 C ATOM 521 C SER A 35 -6.825 4.899 -5.154 1.00 0.00 C ATOM 522 O SER A 35 -5.947 4.434 -4.426 1.00 0.00 O ATOM 523 CB SER A 35 -9.153 4.258 -5.806 1.00 0.00 C ATOM 524 OG SER A 35 -9.627 5.300 -6.640 1.00 0.00 O ATOM 0 H SER A 35 -8.153 2.026 -5.502 1.00 0.00 H new ATOM 0 HA SER A 35 -7.428 4.213 -7.086 1.00 0.00 H new ATOM 0 HB2 SER A 35 -9.723 3.349 -5.996 1.00 0.00 H new ATOM 0 HB3 SER A 35 -9.314 4.523 -4.761 1.00 0.00 H new ATOM 0 HG SER A 35 -10.580 5.449 -6.468 1.00 0.00 H new ATOM 530 N THR A 36 -7.099 6.198 -5.215 1.00 0.00 N ATOM 531 CA THR A 36 -6.368 7.172 -4.414 1.00 0.00 C ATOM 532 C THR A 36 -7.107 7.484 -3.118 1.00 0.00 C ATOM 533 O THR A 36 -8.326 7.651 -3.112 1.00 0.00 O ATOM 534 CB THR A 36 -6.143 8.483 -5.192 1.00 0.00 C ATOM 535 OG1 THR A 36 -7.396 9.135 -5.425 1.00 0.00 O ATOM 536 CG2 THR A 36 -5.450 8.213 -6.519 1.00 0.00 C ATOM 0 H THR A 36 -7.822 6.600 -5.811 1.00 0.00 H new ATOM 0 HA THR A 36 -5.401 6.727 -4.179 1.00 0.00 H new ATOM 0 HB THR A 36 -5.503 9.131 -4.592 1.00 0.00 H new ATOM 0 HG1 THR A 36 -8.072 8.773 -4.814 1.00 0.00 H new ATOM 0 HG21 THR A 36 -5.302 9.153 -7.050 1.00 0.00 H new ATOM 0 HG22 THR A 36 -4.483 7.744 -6.336 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.067 7.548 -7.123 1.00 0.00 H new ATOM 544 N PHE A 37 -6.360 7.562 -2.021 1.00 0.00 N ATOM 545 CA PHE A 37 -6.945 7.854 -0.718 1.00 0.00 C ATOM 546 C PHE A 37 -6.147 8.932 0.008 1.00 0.00 C ATOM 547 O PHE A 37 -4.924 9.004 -0.116 1.00 0.00 O ATOM 548 CB PHE A 37 -7.002 6.584 0.135 1.00 0.00 C ATOM 549 CG PHE A 37 -5.714 5.810 0.144 1.00 0.00 C ATOM 550 CD1 PHE A 37 -4.679 6.172 0.990 1.00 0.00 C ATOM 551 CD2 PHE A 37 -5.540 4.721 -0.694 1.00 0.00 C ATOM 552 CE1 PHE A 37 -3.493 5.462 0.999 1.00 0.00 C ATOM 553 CE2 PHE A 37 -4.357 4.006 -0.689 1.00 0.00 C ATOM 554 CZ PHE A 37 -3.332 4.377 0.160 1.00 0.00 C ATOM 0 H PHE A 37 -5.349 7.427 -2.009 1.00 0.00 H new ATOM 0 HA PHE A 37 -7.958 8.223 -0.877 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.261 6.855 1.159 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.800 5.942 -0.237 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.800 7.018 1.650 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -6.338 4.427 -1.359 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.693 5.756 1.662 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -4.234 3.159 -1.348 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.407 3.820 0.167 1.00 0.00 H new ATOM 564 N SER A 38 -6.847 9.770 0.765 1.00 0.00 N ATOM 565 CA SER A 38 -6.205 10.849 1.508 1.00 0.00 C ATOM 566 C SER A 38 -6.693 10.879 2.953 1.00 0.00 C ATOM 567 O SER A 38 -7.592 10.128 3.332 1.00 0.00 O ATOM 568 CB SER A 38 -6.483 12.195 0.836 1.00 0.00 C ATOM 569 OG SER A 38 -7.859 12.525 0.905 1.00 0.00 O ATOM 0 H SER A 38 -7.859 9.723 0.880 1.00 0.00 H new ATOM 0 HA SER A 38 -5.130 10.667 1.509 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.894 12.975 1.319 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.167 12.157 -0.206 1.00 0.00 H new ATOM 0 HG SER A 38 -8.010 13.390 0.470 1.00 0.00 H new ATOM 575 N SER A 39 -6.093 11.752 3.756 1.00 0.00 N ATOM 576 CA SER A 39 -6.462 11.878 5.160 1.00 0.00 C ATOM 577 C SER A 39 -7.929 12.271 5.303 1.00 0.00 C ATOM 578 O SER A 39 -8.672 11.672 6.079 1.00 0.00 O ATOM 579 CB SER A 39 -5.575 12.915 5.852 1.00 0.00 C ATOM 580 OG SER A 39 -5.840 12.968 7.243 1.00 0.00 O ATOM 0 H SER A 39 -5.349 12.383 3.457 1.00 0.00 H new ATOM 0 HA SER A 39 -6.315 10.909 5.637 1.00 0.00 H new ATOM 0 HB2 SER A 39 -4.526 12.668 5.688 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.744 13.896 5.409 1.00 0.00 H new ATOM 0 HG SER A 39 -5.259 13.637 7.661 1.00 0.00 H new ATOM 586 N GLY A 40 -8.340 13.285 4.547 1.00 0.00 N ATOM 587 CA GLY A 40 -9.716 13.742 4.603 1.00 0.00 C ATOM 588 C GLY A 40 -9.955 14.969 3.745 1.00 0.00 C ATOM 589 O GLY A 40 -10.353 14.856 2.586 1.00 0.00 O ATOM 0 H GLY A 40 -7.744 13.798 3.897 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.376 12.939 4.275 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.979 13.968 5.636 1.00 0.00 H new ATOM 593 N ALA A 41 -9.714 16.144 4.315 1.00 0.00 N ATOM 594 CA ALA A 41 -9.905 17.397 3.595 1.00 0.00 C ATOM 595 C ALA A 41 -9.372 17.297 2.170 1.00 0.00 C ATOM 596 O ALA A 41 -8.620 16.381 1.841 1.00 0.00 O ATOM 597 CB ALA A 41 -9.227 18.540 4.335 1.00 0.00 C ATOM 0 H ALA A 41 -9.386 16.255 5.274 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.975 17.598 3.542 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -9.378 19.469 3.786 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -9.657 18.634 5.332 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -8.159 18.337 4.418 1.00 0.00 H new ATOM 603 N ASN A 42 -9.768 18.245 1.327 1.00 0.00 N ATOM 604 CA ASN A 42 -9.331 18.263 -0.064 1.00 0.00 C ATOM 605 C ASN A 42 -7.835 18.542 -0.161 1.00 0.00 C ATOM 606 O ASN A 42 -7.416 19.688 -0.331 1.00 0.00 O ATOM 607 CB ASN A 42 -10.110 19.318 -0.852 1.00 0.00 C ATOM 608 CG ASN A 42 -10.202 20.640 -0.115 1.00 0.00 C ATOM 609 OD1 ASN A 42 -11.413 21.173 -0.005 1.00 0.00 O flip ATOM 610 ND2 ASN A 42 -9.195 21.174 0.351 1.00 0.00 N flip ATOM 0 H ASN A 42 -10.391 19.011 1.583 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.528 17.280 -0.493 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.628 19.476 -1.817 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -11.115 18.947 -1.055 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -8.284 20.728 0.242 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -9.272 22.063 0.846 1.00 0.00 H new ATOM 617 N ASP A 43 -7.033 17.488 -0.052 1.00 0.00 N ATOM 618 CA ASP A 43 -5.583 17.619 -0.128 1.00 0.00 C ATOM 619 C ASP A 43 -5.067 17.162 -1.489 1.00 0.00 C ATOM 620 O ASP A 43 -5.486 16.127 -2.008 1.00 0.00 O ATOM 621 CB ASP A 43 -4.917 16.807 0.983 1.00 0.00 C ATOM 622 CG ASP A 43 -5.677 16.884 2.292 1.00 0.00 C ATOM 623 OD1 ASP A 43 -6.376 17.895 2.513 1.00 0.00 O ATOM 624 OD2 ASP A 43 -5.572 15.935 3.097 1.00 0.00 O ATOM 0 H ASP A 43 -7.363 16.533 0.089 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.331 18.671 0.001 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -4.840 15.765 0.672 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -3.900 17.170 1.135 1.00 0.00 H new ATOM 629 N LYS A 44 -4.156 17.940 -2.063 1.00 0.00 N ATOM 630 CA LYS A 44 -3.582 17.616 -3.364 1.00 0.00 C ATOM 631 C LYS A 44 -2.773 16.325 -3.295 1.00 0.00 C ATOM 632 O LYS A 44 -2.632 15.615 -4.291 1.00 0.00 O ATOM 633 CB LYS A 44 -2.693 18.762 -3.852 1.00 0.00 C ATOM 634 CG LYS A 44 -3.458 20.039 -4.153 1.00 0.00 C ATOM 635 CD LYS A 44 -4.298 19.903 -5.411 1.00 0.00 C ATOM 636 CE LYS A 44 -3.475 20.172 -6.662 1.00 0.00 C ATOM 637 NZ LYS A 44 -3.233 21.627 -6.864 1.00 0.00 N ATOM 0 H LYS A 44 -3.799 18.800 -1.647 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.401 17.474 -4.069 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.936 18.971 -3.096 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -2.165 18.444 -4.751 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.102 20.285 -3.309 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.757 20.865 -4.270 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -4.721 18.900 -5.461 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.135 20.600 -5.368 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.520 19.652 -6.587 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.992 19.766 -7.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.804 21.781 -7.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -4.136 22.140 -6.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.590 21.978 -6.126 1.00 0.00 H new ATOM 651 N LEU A 45 -2.244 16.026 -2.113 1.00 0.00 N ATOM 652 CA LEU A 45 -1.450 14.818 -1.914 1.00 0.00 C ATOM 653 C LEU A 45 -2.337 13.577 -1.912 1.00 0.00 C ATOM 654 O LEU A 45 -3.321 13.505 -1.176 1.00 0.00 O ATOM 655 CB LEU A 45 -0.674 14.906 -0.599 1.00 0.00 C ATOM 656 CG LEU A 45 0.133 13.666 -0.212 1.00 0.00 C ATOM 657 CD1 LEU A 45 1.109 13.298 -1.318 1.00 0.00 C ATOM 658 CD2 LEU A 45 0.872 13.898 1.098 1.00 0.00 C ATOM 0 H LEU A 45 -2.350 16.603 -1.279 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.745 14.736 -2.741 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.008 15.755 -0.659 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.380 15.120 0.203 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.558 12.835 -0.074 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.674 12.413 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.558 13.089 -2.235 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.795 14.127 -1.488 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.441 13.005 1.358 1.00 0.00 H new ATOM 0 HD22 LEU A 45 1.552 14.742 0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 45 0.153 14.113 1.888 1.00 0.00 H new ATOM 670 N LYS A 46 -1.982 12.601 -2.741 1.00 0.00 N ATOM 671 CA LYS A 46 -2.742 11.361 -2.834 1.00 0.00 C ATOM 672 C LYS A 46 -1.837 10.151 -2.625 1.00 0.00 C ATOM 673 O LYS A 46 -0.620 10.240 -2.786 1.00 0.00 O ATOM 674 CB LYS A 46 -3.436 11.264 -4.195 1.00 0.00 C ATOM 675 CG LYS A 46 -4.465 12.355 -4.432 1.00 0.00 C ATOM 676 CD LYS A 46 -5.808 11.998 -3.818 1.00 0.00 C ATOM 677 CE LYS A 46 -6.960 12.608 -4.602 1.00 0.00 C ATOM 678 NZ LYS A 46 -7.229 11.862 -5.862 1.00 0.00 N ATOM 0 H LYS A 46 -1.172 12.645 -3.359 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.497 11.368 -2.048 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.683 11.310 -4.982 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.924 10.293 -4.276 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.107 13.293 -4.006 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.585 12.517 -5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -5.920 10.914 -3.790 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -5.842 12.349 -2.787 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -7.858 12.613 -3.984 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -6.729 13.647 -4.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -8.042 12.288 -6.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -6.392 11.908 -6.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.441 10.869 -5.639 1.00 0.00 H new ATOM 692 N TRP A 47 -2.439 9.022 -2.269 1.00 0.00 N ATOM 693 CA TRP A 47 -1.687 7.794 -2.040 1.00 0.00 C ATOM 694 C TRP A 47 -2.455 6.581 -2.553 1.00 0.00 C ATOM 695 O TRP A 47 -3.686 6.587 -2.594 1.00 0.00 O ATOM 696 CB TRP A 47 -1.382 7.628 -0.551 1.00 0.00 C ATOM 697 CG TRP A 47 -0.618 8.778 0.031 1.00 0.00 C ATOM 698 CD1 TRP A 47 -1.138 9.940 0.526 1.00 0.00 C ATOM 699 CD2 TRP A 47 0.803 8.878 0.177 1.00 0.00 C ATOM 700 NE1 TRP A 47 -0.126 10.756 0.971 1.00 0.00 N ATOM 701 CE2 TRP A 47 1.074 10.127 0.768 1.00 0.00 C ATOM 702 CE3 TRP A 47 1.871 8.033 -0.133 1.00 0.00 C ATOM 703 CZ2 TRP A 47 2.370 10.550 1.054 1.00 0.00 C ATOM 704 CZ3 TRP A 47 3.157 8.454 0.151 1.00 0.00 C ATOM 705 CH2 TRP A 47 3.397 9.702 0.740 1.00 0.00 C ATOM 0 H TRP A 47 -3.446 8.932 -2.133 1.00 0.00 H new ATOM 0 HA TRP A 47 -0.748 7.865 -2.590 1.00 0.00 H new ATOM 0 HB2 TRP A 47 -2.319 7.511 -0.006 1.00 0.00 H new ATOM 0 HB3 TRP A 47 -0.811 6.711 -0.404 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.190 10.182 0.562 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -0.248 11.680 1.385 1.00 0.00 H new ATOM 0 HE3 TRP A 47 1.696 7.069 -0.586 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 2.557 11.512 1.507 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 3.991 7.810 -0.085 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.413 10.001 0.951 1.00 0.00 H new ATOM 716 N CYS A 48 -1.723 5.543 -2.942 1.00 0.00 N ATOM 717 CA CYS A 48 -2.337 4.323 -3.453 1.00 0.00 C ATOM 718 C CYS A 48 -1.635 3.088 -2.899 1.00 0.00 C ATOM 719 O CYS A 48 -0.553 3.183 -2.318 1.00 0.00 O ATOM 720 CB CYS A 48 -2.293 4.306 -4.982 1.00 0.00 C ATOM 721 SG CYS A 48 -0.623 4.242 -5.671 1.00 0.00 S ATOM 0 H CYS A 48 -0.704 5.522 -2.913 1.00 0.00 H new ATOM 0 HA CYS A 48 -3.377 4.305 -3.127 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -2.856 3.445 -5.342 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -2.796 5.196 -5.359 1.00 0.00 H new ATOM 0 HG CYS A 48 0.230 4.656 -4.781 1.00 0.00 H new ATOM 727 N LEU A 49 -2.258 1.929 -3.079 1.00 0.00 N ATOM 728 CA LEU A 49 -1.695 0.673 -2.595 1.00 0.00 C ATOM 729 C LEU A 49 -1.485 -0.308 -3.744 1.00 0.00 C ATOM 730 O LEU A 49 -2.354 -0.470 -4.601 1.00 0.00 O ATOM 731 CB LEU A 49 -2.612 0.053 -1.540 1.00 0.00 C ATOM 732 CG LEU A 49 -2.548 0.676 -0.145 1.00 0.00 C ATOM 733 CD1 LEU A 49 -3.393 -0.123 0.835 1.00 0.00 C ATOM 734 CD2 LEU A 49 -1.107 0.762 0.336 1.00 0.00 C ATOM 0 H LEU A 49 -3.154 1.832 -3.557 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.726 0.887 -2.144 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.640 0.117 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.370 -1.006 -1.454 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.951 1.687 -0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.336 0.335 1.822 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.430 -0.131 0.499 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.020 -1.146 0.887 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.081 1.208 1.330 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.676 -0.239 0.376 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.530 1.378 -0.353 1.00 0.00 H new ATOM 746 N ARG A 50 -0.328 -0.962 -3.753 1.00 0.00 N ATOM 747 CA ARG A 50 -0.005 -1.929 -4.795 1.00 0.00 C ATOM 748 C ARG A 50 0.101 -3.337 -4.217 1.00 0.00 C ATOM 749 O ARG A 50 1.050 -3.655 -3.500 1.00 0.00 O ATOM 750 CB ARG A 50 1.306 -1.548 -5.485 1.00 0.00 C ATOM 751 CG ARG A 50 1.125 -0.601 -6.659 1.00 0.00 C ATOM 752 CD ARG A 50 2.463 -0.176 -7.245 1.00 0.00 C ATOM 753 NE ARG A 50 3.273 -1.323 -7.646 1.00 0.00 N ATOM 754 CZ ARG A 50 4.264 -1.250 -8.527 1.00 0.00 C ATOM 755 NH1 ARG A 50 4.566 -0.091 -9.096 1.00 0.00 N ATOM 756 NH2 ARG A 50 4.957 -2.337 -8.841 1.00 0.00 N ATOM 0 H ARG A 50 0.401 -0.840 -3.050 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.811 -1.917 -5.529 1.00 0.00 H new ATOM 0 HB2 ARG A 50 1.969 -1.085 -4.755 1.00 0.00 H new ATOM 0 HB3 ARG A 50 1.800 -2.455 -5.834 1.00 0.00 H new ATOM 0 HG2 ARG A 50 0.527 -1.086 -7.430 1.00 0.00 H new ATOM 0 HG3 ARG A 50 0.572 0.281 -6.335 1.00 0.00 H new ATOM 0 HD2 ARG A 50 2.293 0.467 -8.108 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.010 0.415 -6.510 1.00 0.00 H new ATOM 0 HE ARG A 50 3.066 -2.230 -7.227 1.00 0.00 H new ATOM 0 HH11 ARG A 50 4.037 0.748 -8.857 1.00 0.00 H new ATOM 0 HH12 ARG A 50 5.328 -0.038 -9.772 1.00 0.00 H new ATOM 0 HH21 ARG A 50 4.729 -3.231 -8.406 1.00 0.00 H new ATOM 0 HH22 ARG A 50 5.718 -2.279 -9.518 1.00 0.00 H new ATOM 770 N VAL A 51 -0.879 -4.177 -4.534 1.00 0.00 N ATOM 771 CA VAL A 51 -0.895 -5.551 -4.047 1.00 0.00 C ATOM 772 C VAL A 51 -0.598 -6.537 -5.172 1.00 0.00 C ATOM 773 O VAL A 51 -1.093 -6.387 -6.288 1.00 0.00 O ATOM 774 CB VAL A 51 -2.253 -5.906 -3.414 1.00 0.00 C ATOM 775 CG1 VAL A 51 -2.438 -7.415 -3.356 1.00 0.00 C ATOM 776 CG2 VAL A 51 -2.371 -5.293 -2.027 1.00 0.00 C ATOM 0 H VAL A 51 -1.672 -3.930 -5.126 1.00 0.00 H new ATOM 0 HA VAL A 51 -0.117 -5.626 -3.287 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.044 -5.491 -4.038 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -3.403 -7.646 -2.906 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -2.401 -7.825 -4.365 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.642 -7.856 -2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.337 -5.554 -1.595 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.573 -5.676 -1.391 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.288 -4.209 -2.100 1.00 0.00 H new ATOM 786 N ASN A 52 0.213 -7.545 -4.869 1.00 0.00 N ATOM 787 CA ASN A 52 0.576 -8.556 -5.856 1.00 0.00 C ATOM 788 C ASN A 52 0.267 -9.957 -5.337 1.00 0.00 C ATOM 789 O ASN A 52 1.005 -10.525 -4.531 1.00 0.00 O ATOM 790 CB ASN A 52 2.062 -8.446 -6.206 1.00 0.00 C ATOM 791 CG ASN A 52 2.518 -7.007 -6.343 1.00 0.00 C ATOM 792 OD1 ASN A 52 2.268 -6.178 -5.467 1.00 0.00 O ATOM 793 ND2 ASN A 52 3.191 -6.702 -7.447 1.00 0.00 N ATOM 0 H ASN A 52 0.631 -7.684 -3.949 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.016 -8.381 -6.754 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.652 -8.939 -5.434 1.00 0.00 H new ATOM 0 HB3 ASN A 52 2.253 -8.975 -7.140 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.523 -5.749 -7.595 1.00 0.00 H new ATOM 0 HD22 ASN A 52 3.376 -7.421 -8.147 1.00 0.00 H new ATOM 800 N PRO A 53 -0.849 -10.530 -5.810 1.00 0.00 N ATOM 801 CA PRO A 53 -1.281 -11.873 -5.410 1.00 0.00 C ATOM 802 C PRO A 53 -0.370 -12.964 -5.961 1.00 0.00 C ATOM 803 O PRO A 53 -0.530 -14.142 -5.641 1.00 0.00 O ATOM 804 CB PRO A 53 -2.683 -11.990 -6.014 1.00 0.00 C ATOM 805 CG PRO A 53 -2.676 -11.050 -7.170 1.00 0.00 C ATOM 806 CD PRO A 53 -1.776 -9.912 -6.774 1.00 0.00 C ATOM 0 HA PRO A 53 -1.256 -12.003 -4.328 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.892 -13.011 -6.335 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -3.451 -11.720 -5.289 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.309 -11.542 -8.071 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -3.682 -10.693 -7.389 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.247 -9.500 -7.633 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -2.338 -9.094 -6.324 1.00 0.00 H new ATOM 814 N LYS A 54 0.587 -12.565 -6.792 1.00 0.00 N ATOM 815 CA LYS A 54 1.526 -13.508 -7.388 1.00 0.00 C ATOM 816 C LYS A 54 2.964 -13.038 -7.196 1.00 0.00 C ATOM 817 O LYS A 54 3.896 -13.617 -7.753 1.00 0.00 O ATOM 818 CB LYS A 54 1.229 -13.682 -8.879 1.00 0.00 C ATOM 819 CG LYS A 54 0.127 -14.687 -9.167 1.00 0.00 C ATOM 820 CD LYS A 54 0.272 -15.291 -10.554 1.00 0.00 C ATOM 821 CE LYS A 54 -0.614 -16.516 -10.724 1.00 0.00 C ATOM 822 NZ LYS A 54 -2.048 -16.202 -10.477 1.00 0.00 N ATOM 0 H LYS A 54 0.733 -11.594 -7.068 1.00 0.00 H new ATOM 0 HA LYS A 54 1.406 -14.468 -6.886 1.00 0.00 H new ATOM 0 HB2 LYS A 54 0.948 -12.717 -9.300 1.00 0.00 H new ATOM 0 HB3 LYS A 54 2.140 -13.998 -9.388 1.00 0.00 H new ATOM 0 HG2 LYS A 54 0.152 -15.480 -8.419 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -0.844 -14.199 -9.081 1.00 0.00 H new ATOM 0 HD2 LYS A 54 0.012 -14.546 -11.306 1.00 0.00 H new ATOM 0 HD3 LYS A 54 1.313 -15.567 -10.725 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -0.497 -16.911 -11.733 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -0.290 -17.297 -10.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -2.634 -17.017 -10.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -2.189 -15.996 -9.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -2.324 -15.374 -11.042 1.00 0.00 H new ATOM 836 N GLY A 55 3.138 -11.985 -6.403 1.00 0.00 N ATOM 837 CA GLY A 55 4.465 -11.457 -6.151 1.00 0.00 C ATOM 838 C GLY A 55 5.109 -10.887 -7.400 1.00 0.00 C ATOM 839 O GLY A 55 4.474 -10.803 -8.452 1.00 0.00 O ATOM 0 H GLY A 55 2.383 -11.488 -5.931 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.405 -10.679 -5.390 1.00 0.00 H new ATOM 0 HA3 GLY A 55 5.097 -12.248 -5.749 1.00 0.00 H new ATOM 843 N LEU A 56 6.372 -10.491 -7.285 1.00 0.00 N ATOM 844 CA LEU A 56 7.101 -9.923 -8.413 1.00 0.00 C ATOM 845 C LEU A 56 7.775 -11.019 -9.233 1.00 0.00 C ATOM 846 O LEU A 56 7.860 -10.928 -10.458 1.00 0.00 O ATOM 847 CB LEU A 56 8.149 -8.924 -7.918 1.00 0.00 C ATOM 848 CG LEU A 56 7.613 -7.581 -7.420 1.00 0.00 C ATOM 849 CD1 LEU A 56 6.901 -6.842 -8.542 1.00 0.00 C ATOM 850 CD2 LEU A 56 6.679 -7.785 -6.237 1.00 0.00 C ATOM 0 H LEU A 56 6.912 -10.553 -6.422 1.00 0.00 H new ATOM 0 HA LEU A 56 6.386 -9.404 -9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 56 8.713 -9.390 -7.110 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.852 -8.734 -8.729 1.00 0.00 H new ATOM 0 HG LEU A 56 8.457 -6.974 -7.091 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.526 -5.889 -8.169 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.599 -6.663 -9.360 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.067 -7.444 -8.902 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.307 -6.819 -5.896 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.839 -8.410 -6.540 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.220 -8.272 -5.426 1.00 0.00 H new ATOM 862 N ASP A 57 8.250 -12.055 -8.549 1.00 0.00 N ATOM 863 CA ASP A 57 8.913 -13.170 -9.214 1.00 0.00 C ATOM 864 C ASP A 57 8.591 -14.488 -8.517 1.00 0.00 C ATOM 865 O ASP A 57 7.987 -14.501 -7.444 1.00 0.00 O ATOM 866 CB ASP A 57 10.426 -12.950 -9.241 1.00 0.00 C ATOM 867 CG ASP A 57 11.184 -14.186 -9.682 1.00 0.00 C ATOM 868 OD1 ASP A 57 11.161 -14.495 -10.891 1.00 0.00 O ATOM 869 OD2 ASP A 57 11.799 -14.845 -8.818 1.00 0.00 O ATOM 0 H ASP A 57 8.188 -12.145 -7.535 1.00 0.00 H new ATOM 0 HA ASP A 57 8.543 -13.221 -10.238 1.00 0.00 H new ATOM 0 HB2 ASP A 57 10.658 -12.126 -9.915 1.00 0.00 H new ATOM 0 HB3 ASP A 57 10.765 -12.655 -8.248 1.00 0.00 H new ATOM 874 N GLU A 58 8.997 -15.593 -9.134 1.00 0.00 N ATOM 875 CA GLU A 58 8.749 -16.916 -8.572 1.00 0.00 C ATOM 876 C GLU A 58 9.201 -16.982 -7.115 1.00 0.00 C ATOM 877 O GLU A 58 8.800 -17.876 -6.371 1.00 0.00 O ATOM 878 CB GLU A 58 9.473 -17.986 -9.391 1.00 0.00 C ATOM 879 CG GLU A 58 8.865 -18.217 -10.764 1.00 0.00 C ATOM 880 CD GLU A 58 9.840 -18.856 -11.734 1.00 0.00 C ATOM 881 OE1 GLU A 58 11.061 -18.780 -11.485 1.00 0.00 O ATOM 882 OE2 GLU A 58 9.380 -19.433 -12.742 1.00 0.00 O ATOM 0 H GLU A 58 9.499 -15.599 -10.022 1.00 0.00 H new ATOM 0 HA GLU A 58 7.676 -17.104 -8.610 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.517 -17.696 -9.509 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.464 -18.924 -8.836 1.00 0.00 H new ATOM 0 HG2 GLU A 58 7.986 -18.854 -10.665 1.00 0.00 H new ATOM 0 HG3 GLU A 58 8.524 -17.265 -11.171 1.00 0.00 H new ATOM 889 N GLU A 59 10.037 -16.028 -6.718 1.00 0.00 N ATOM 890 CA GLU A 59 10.544 -15.979 -5.352 1.00 0.00 C ATOM 891 C GLU A 59 9.409 -15.754 -4.357 1.00 0.00 C ATOM 892 O GLU A 59 9.137 -16.601 -3.507 1.00 0.00 O ATOM 893 CB GLU A 59 11.588 -14.868 -5.211 1.00 0.00 C ATOM 894 CG GLU A 59 12.079 -14.672 -3.787 1.00 0.00 C ATOM 895 CD GLU A 59 13.113 -15.704 -3.379 1.00 0.00 C ATOM 896 OE1 GLU A 59 12.721 -16.852 -3.084 1.00 0.00 O ATOM 897 OE2 GLU A 59 14.314 -15.362 -3.355 1.00 0.00 O ATOM 0 H GLU A 59 10.377 -15.280 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 59 11.012 -16.938 -5.132 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.439 -15.098 -5.852 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.161 -13.932 -5.571 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.508 -13.675 -3.689 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.231 -14.723 -3.104 1.00 0.00 H new ATOM 904 N SER A 60 8.749 -14.605 -4.471 1.00 0.00 N ATOM 905 CA SER A 60 7.646 -14.266 -3.580 1.00 0.00 C ATOM 906 C SER A 60 6.303 -14.505 -4.263 1.00 0.00 C ATOM 907 O SER A 60 5.368 -13.719 -4.113 1.00 0.00 O ATOM 908 CB SER A 60 7.752 -12.806 -3.136 1.00 0.00 C ATOM 909 OG SER A 60 6.729 -12.478 -2.212 1.00 0.00 O ATOM 0 H SER A 60 8.959 -13.894 -5.171 1.00 0.00 H new ATOM 0 HA SER A 60 7.708 -14.911 -2.703 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.727 -12.631 -2.681 1.00 0.00 H new ATOM 0 HB3 SER A 60 7.684 -12.152 -4.006 1.00 0.00 H new ATOM 0 HG SER A 60 5.867 -12.799 -2.551 1.00 0.00 H new ATOM 915 N LYS A 61 6.215 -15.597 -5.015 1.00 0.00 N ATOM 916 CA LYS A 61 4.987 -15.944 -5.721 1.00 0.00 C ATOM 917 C LYS A 61 3.972 -16.571 -4.771 1.00 0.00 C ATOM 918 O LYS A 61 2.765 -16.382 -4.925 1.00 0.00 O ATOM 919 CB LYS A 61 5.291 -16.908 -6.870 1.00 0.00 C ATOM 920 CG LYS A 61 5.570 -18.330 -6.413 1.00 0.00 C ATOM 921 CD LYS A 61 5.902 -19.237 -7.586 1.00 0.00 C ATOM 922 CE LYS A 61 4.646 -19.693 -8.311 1.00 0.00 C ATOM 923 NZ LYS A 61 4.072 -20.926 -7.705 1.00 0.00 N ATOM 0 H LYS A 61 6.980 -16.258 -5.151 1.00 0.00 H new ATOM 0 HA LYS A 61 4.559 -15.028 -6.127 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.447 -16.916 -7.560 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.153 -16.538 -7.425 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.399 -18.330 -5.706 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.700 -18.721 -5.884 1.00 0.00 H new ATOM 0 HD2 LYS A 61 6.554 -18.709 -8.282 1.00 0.00 H new ATOM 0 HD3 LYS A 61 6.454 -20.107 -7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 61 3.903 -18.896 -8.286 1.00 0.00 H new ATOM 0 HE3 LYS A 61 4.879 -19.878 -9.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.217 -21.204 -8.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.772 -21.694 -7.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.826 -20.742 -6.711 1.00 0.00 H new ATOM 937 N ASP A 62 4.468 -17.316 -3.790 1.00 0.00 N ATOM 938 CA ASP A 62 3.603 -17.968 -2.813 1.00 0.00 C ATOM 939 C ASP A 62 3.081 -16.963 -1.792 1.00 0.00 C ATOM 940 O ASP A 62 1.944 -17.064 -1.331 1.00 0.00 O ATOM 941 CB ASP A 62 4.359 -19.092 -2.102 1.00 0.00 C ATOM 942 CG ASP A 62 5.838 -18.793 -1.956 1.00 0.00 C ATOM 943 OD1 ASP A 62 6.215 -17.605 -2.038 1.00 0.00 O ATOM 944 OD2 ASP A 62 6.620 -19.747 -1.761 1.00 0.00 O ATOM 0 H ASP A 62 5.464 -17.484 -3.650 1.00 0.00 H new ATOM 0 HA ASP A 62 2.751 -18.393 -3.344 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.924 -19.251 -1.115 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.232 -20.020 -2.659 1.00 0.00 H new ATOM 949 N TYR A 63 3.920 -15.994 -1.442 1.00 0.00 N ATOM 950 CA TYR A 63 3.544 -14.972 -0.472 1.00 0.00 C ATOM 951 C TYR A 63 2.917 -13.767 -1.166 1.00 0.00 C ATOM 952 O TYR A 63 3.064 -13.586 -2.375 1.00 0.00 O ATOM 953 CB TYR A 63 4.766 -14.531 0.335 1.00 0.00 C ATOM 954 CG TYR A 63 5.664 -15.676 0.749 1.00 0.00 C ATOM 955 CD1 TYR A 63 5.404 -16.406 1.903 1.00 0.00 C ATOM 956 CD2 TYR A 63 6.770 -16.028 -0.014 1.00 0.00 C ATOM 957 CE1 TYR A 63 6.222 -17.451 2.285 1.00 0.00 C ATOM 958 CE2 TYR A 63 7.592 -17.073 0.360 1.00 0.00 C ATOM 959 CZ TYR A 63 7.314 -17.782 1.510 1.00 0.00 C ATOM 960 OH TYR A 63 8.130 -18.824 1.887 1.00 0.00 O ATOM 0 H TYR A 63 4.864 -15.895 -1.815 1.00 0.00 H new ATOM 0 HA TYR A 63 2.806 -15.403 0.205 1.00 0.00 H new ATOM 0 HB2 TYR A 63 5.345 -13.822 -0.257 1.00 0.00 H new ATOM 0 HB3 TYR A 63 4.430 -14.003 1.227 1.00 0.00 H new ATOM 0 HD1 TYR A 63 4.548 -16.152 2.511 1.00 0.00 H new ATOM 0 HD2 TYR A 63 6.991 -15.475 -0.915 1.00 0.00 H new ATOM 0 HE1 TYR A 63 6.008 -18.006 3.186 1.00 0.00 H new ATOM 0 HE2 TYR A 63 8.448 -17.334 -0.245 1.00 0.00 H new ATOM 0 HH TYR A 63 8.852 -18.927 1.233 1.00 0.00 H new ATOM 970 N LEU A 64 2.218 -12.944 -0.391 1.00 0.00 N ATOM 971 CA LEU A 64 1.569 -11.754 -0.929 1.00 0.00 C ATOM 972 C LEU A 64 2.454 -10.524 -0.756 1.00 0.00 C ATOM 973 O LEU A 64 2.929 -10.238 0.343 1.00 0.00 O ATOM 974 CB LEU A 64 0.222 -11.528 -0.240 1.00 0.00 C ATOM 975 CG LEU A 64 -0.675 -10.453 -0.855 1.00 0.00 C ATOM 976 CD1 LEU A 64 -0.111 -9.067 -0.583 1.00 0.00 C ATOM 977 CD2 LEU A 64 -0.834 -10.683 -2.351 1.00 0.00 C ATOM 0 H LEU A 64 2.087 -13.079 0.611 1.00 0.00 H new ATOM 0 HA LEU A 64 1.404 -11.912 -1.995 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.325 -12.471 -0.237 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.409 -11.265 0.801 1.00 0.00 H new ATOM 0 HG LEU A 64 -1.659 -10.519 -0.391 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.763 -8.315 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.051 -8.904 0.493 1.00 0.00 H new ATOM 0 HD13 LEU A 64 0.885 -8.988 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.475 -9.909 -2.772 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.144 -10.645 -2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.285 -11.660 -2.523 1.00 0.00 H new ATOM 989 N SER A 65 2.672 -9.799 -1.848 1.00 0.00 N ATOM 990 CA SER A 65 3.502 -8.600 -1.818 1.00 0.00 C ATOM 991 C SER A 65 2.640 -7.342 -1.860 1.00 0.00 C ATOM 992 O SER A 65 1.844 -7.151 -2.780 1.00 0.00 O ATOM 993 CB SER A 65 4.480 -8.602 -2.994 1.00 0.00 C ATOM 994 OG SER A 65 5.439 -7.567 -2.860 1.00 0.00 O ATOM 0 H SER A 65 2.285 -10.021 -2.765 1.00 0.00 H new ATOM 0 HA SER A 65 4.067 -8.601 -0.886 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.986 -9.566 -3.049 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.932 -8.476 -3.928 1.00 0.00 H new ATOM 0 HG SER A 65 5.580 -7.372 -1.910 1.00 0.00 H new ATOM 1000 N LEU A 66 2.805 -6.486 -0.857 1.00 0.00 N ATOM 1001 CA LEU A 66 2.044 -5.244 -0.778 1.00 0.00 C ATOM 1002 C LEU A 66 2.966 -4.054 -0.536 1.00 0.00 C ATOM 1003 O LEU A 66 3.585 -3.940 0.522 1.00 0.00 O ATOM 1004 CB LEU A 66 1.002 -5.332 0.339 1.00 0.00 C ATOM 1005 CG LEU A 66 0.603 -4.008 0.990 1.00 0.00 C ATOM 1006 CD1 LEU A 66 0.067 -3.040 -0.054 1.00 0.00 C ATOM 1007 CD2 LEU A 66 -0.430 -4.241 2.083 1.00 0.00 C ATOM 0 H LEU A 66 3.459 -6.629 -0.087 1.00 0.00 H new ATOM 0 HA LEU A 66 1.535 -5.097 -1.731 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.104 -5.800 -0.065 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.386 -5.994 1.115 1.00 0.00 H new ATOM 0 HG LEU A 66 1.490 -3.567 1.444 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.212 -2.103 0.428 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.837 -2.848 -0.802 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.808 -3.474 -0.537 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.702 -3.287 2.535 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.317 -4.705 1.652 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -0.011 -4.898 2.845 1.00 0.00 H new ATOM 1019 N TYR A 67 3.052 -3.169 -1.523 1.00 0.00 N ATOM 1020 CA TYR A 67 3.899 -1.987 -1.418 1.00 0.00 C ATOM 1021 C TYR A 67 3.056 -0.716 -1.359 1.00 0.00 C ATOM 1022 O TYR A 67 1.862 -0.734 -1.660 1.00 0.00 O ATOM 1023 CB TYR A 67 4.864 -1.918 -2.602 1.00 0.00 C ATOM 1024 CG TYR A 67 6.061 -2.831 -2.462 1.00 0.00 C ATOM 1025 CD1 TYR A 67 6.007 -4.150 -2.894 1.00 0.00 C ATOM 1026 CD2 TYR A 67 7.245 -2.375 -1.897 1.00 0.00 C ATOM 1027 CE1 TYR A 67 7.098 -4.989 -2.768 1.00 0.00 C ATOM 1028 CE2 TYR A 67 8.342 -3.205 -1.768 1.00 0.00 C ATOM 1029 CZ TYR A 67 8.263 -4.511 -2.204 1.00 0.00 C ATOM 1030 OH TYR A 67 9.352 -5.342 -2.076 1.00 0.00 O ATOM 0 H TYR A 67 2.545 -3.248 -2.405 1.00 0.00 H new ATOM 0 HA TYR A 67 4.473 -2.064 -0.495 1.00 0.00 H new ATOM 0 HB2 TYR A 67 4.326 -2.176 -3.514 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.212 -0.891 -2.717 1.00 0.00 H new ATOM 0 HD1 TYR A 67 5.096 -4.527 -3.336 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.309 -1.353 -1.552 1.00 0.00 H new ATOM 0 HE1 TYR A 67 7.039 -6.012 -3.109 1.00 0.00 H new ATOM 0 HE2 TYR A 67 9.256 -2.833 -1.328 1.00 0.00 H new ATOM 0 HH TYR A 67 10.091 -4.851 -1.661 1.00 0.00 H new ATOM 1040 N LEU A 68 3.687 0.386 -0.970 1.00 0.00 N ATOM 1041 CA LEU A 68 2.997 1.668 -0.872 1.00 0.00 C ATOM 1042 C LEU A 68 3.557 2.666 -1.881 1.00 0.00 C ATOM 1043 O LEU A 68 4.605 3.272 -1.655 1.00 0.00 O ATOM 1044 CB LEU A 68 3.125 2.231 0.544 1.00 0.00 C ATOM 1045 CG LEU A 68 2.729 3.698 0.722 1.00 0.00 C ATOM 1046 CD1 LEU A 68 1.251 3.892 0.419 1.00 0.00 C ATOM 1047 CD2 LEU A 68 3.053 4.171 2.131 1.00 0.00 C ATOM 0 H LEU A 68 4.675 0.418 -0.717 1.00 0.00 H new ATOM 0 HA LEU A 68 1.943 1.504 -1.097 1.00 0.00 H new ATOM 0 HB2 LEU A 68 2.510 1.626 1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.159 2.113 0.868 1.00 0.00 H new ATOM 0 HG LEU A 68 3.305 4.298 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.987 4.941 0.551 1.00 0.00 H new ATOM 0 HD12 LEU A 68 1.048 3.593 -0.609 1.00 0.00 H new ATOM 0 HD13 LEU A 68 0.657 3.281 1.098 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.765 5.217 2.239 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.504 3.567 2.853 1.00 0.00 H new ATOM 0 HD23 LEU A 68 4.123 4.069 2.312 1.00 0.00 H new ATOM 1059 N LEU A 69 2.850 2.835 -2.993 1.00 0.00 N ATOM 1060 CA LEU A 69 3.274 3.762 -4.037 1.00 0.00 C ATOM 1061 C LEU A 69 2.647 5.137 -3.831 1.00 0.00 C ATOM 1062 O LEU A 69 1.524 5.252 -3.339 1.00 0.00 O ATOM 1063 CB LEU A 69 2.896 3.217 -5.415 1.00 0.00 C ATOM 1064 CG LEU A 69 3.325 4.065 -6.613 1.00 0.00 C ATOM 1065 CD1 LEU A 69 4.710 3.654 -7.089 1.00 0.00 C ATOM 1066 CD2 LEU A 69 2.313 3.943 -7.742 1.00 0.00 C ATOM 0 H LEU A 69 1.980 2.342 -3.195 1.00 0.00 H new ATOM 0 HA LEU A 69 4.358 3.865 -3.979 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.333 2.224 -5.523 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.813 3.095 -5.451 1.00 0.00 H new ATOM 0 HG LEU A 69 3.366 5.108 -6.300 1.00 0.00 H new ATOM 0 HD11 LEU A 69 4.999 4.268 -7.942 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.429 3.794 -6.281 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.697 2.605 -7.385 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.634 4.553 -8.586 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.240 2.901 -8.054 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.338 4.287 -7.396 1.00 0.00 H new ATOM 1078 N LEU A 70 3.379 6.178 -4.213 1.00 0.00 N ATOM 1079 CA LEU A 70 2.894 7.546 -4.073 1.00 0.00 C ATOM 1080 C LEU A 70 2.250 8.031 -5.368 1.00 0.00 C ATOM 1081 O LEU A 70 2.886 8.709 -6.174 1.00 0.00 O ATOM 1082 CB LEU A 70 4.043 8.478 -3.682 1.00 0.00 C ATOM 1083 CG LEU A 70 3.718 9.972 -3.661 1.00 0.00 C ATOM 1084 CD1 LEU A 70 2.563 10.254 -2.713 1.00 0.00 C ATOM 1085 CD2 LEU A 70 4.946 10.779 -3.265 1.00 0.00 C ATOM 0 H LEU A 70 4.310 6.100 -4.622 1.00 0.00 H new ATOM 0 HA LEU A 70 2.140 7.559 -3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.397 8.190 -2.692 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.868 8.316 -4.376 1.00 0.00 H new ATOM 0 HG LEU A 70 3.418 10.274 -4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.346 11.322 -2.711 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.680 9.705 -3.041 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.833 9.937 -1.706 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.696 11.840 -3.255 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.277 10.475 -2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.746 10.601 -3.984 1.00 0.00 H new ATOM 1097 N VAL A 71 0.982 7.679 -5.559 1.00 0.00 N ATOM 1098 CA VAL A 71 0.250 8.081 -6.755 1.00 0.00 C ATOM 1099 C VAL A 71 0.662 9.477 -7.209 1.00 0.00 C ATOM 1100 O VAL A 71 1.226 9.648 -8.289 1.00 0.00 O ATOM 1101 CB VAL A 71 -1.271 8.060 -6.514 1.00 0.00 C ATOM 1102 CG1 VAL A 71 -1.596 8.526 -5.104 1.00 0.00 C ATOM 1103 CG2 VAL A 71 -1.985 8.919 -7.547 1.00 0.00 C ATOM 0 H VAL A 71 0.441 7.117 -4.902 1.00 0.00 H new ATOM 0 HA VAL A 71 0.498 7.361 -7.535 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.624 7.034 -6.621 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.675 8.504 -4.953 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.115 7.865 -4.383 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -1.231 9.543 -4.964 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.059 8.893 -7.362 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.629 9.947 -7.474 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -1.779 8.534 -8.546 1.00 0.00 H new ATOM 1113 N SER A 72 0.377 10.472 -6.375 1.00 0.00 N ATOM 1114 CA SER A 72 0.716 11.855 -6.692 1.00 0.00 C ATOM 1115 C SER A 72 1.095 12.624 -5.431 1.00 0.00 C ATOM 1116 O SER A 72 0.590 12.342 -4.343 1.00 0.00 O ATOM 1117 CB SER A 72 -0.460 12.543 -7.389 1.00 0.00 C ATOM 1118 OG SER A 72 -0.570 12.123 -8.738 1.00 0.00 O ATOM 0 H SER A 72 -0.087 10.347 -5.476 1.00 0.00 H new ATOM 0 HA SER A 72 1.574 11.848 -7.364 1.00 0.00 H new ATOM 0 HB2 SER A 72 -1.385 12.317 -6.858 1.00 0.00 H new ATOM 0 HB3 SER A 72 -0.327 13.624 -7.351 1.00 0.00 H new ATOM 0 HG SER A 72 0.057 11.388 -8.904 1.00 0.00 H new ATOM 1124 N CYS A 73 1.986 13.597 -5.584 1.00 0.00 N ATOM 1125 CA CYS A 73 2.435 14.408 -4.457 1.00 0.00 C ATOM 1126 C CYS A 73 2.586 15.870 -4.866 1.00 0.00 C ATOM 1127 O CYS A 73 3.001 16.189 -5.980 1.00 0.00 O ATOM 1128 CB CYS A 73 3.763 13.877 -3.917 1.00 0.00 C ATOM 1129 SG CYS A 73 5.116 13.917 -5.115 1.00 0.00 S ATOM 0 H CYS A 73 2.412 13.844 -6.477 1.00 0.00 H new ATOM 0 HA CYS A 73 1.681 14.345 -3.672 1.00 0.00 H new ATOM 0 HB2 CYS A 73 4.048 14.463 -3.043 1.00 0.00 H new ATOM 0 HB3 CYS A 73 3.621 12.850 -3.579 1.00 0.00 H new ATOM 0 HG CYS A 73 5.886 14.935 -4.866 1.00 0.00 H new ATOM 1135 N PRO A 74 2.239 16.781 -3.944 1.00 0.00 N ATOM 1136 CA PRO A 74 2.327 18.224 -4.186 1.00 0.00 C ATOM 1137 C PRO A 74 3.769 18.712 -4.268 1.00 0.00 C ATOM 1138 O PRO A 74 4.149 19.402 -5.214 1.00 0.00 O ATOM 1139 CB PRO A 74 1.626 18.830 -2.968 1.00 0.00 C ATOM 1140 CG PRO A 74 1.769 17.804 -1.898 1.00 0.00 C ATOM 1141 CD PRO A 74 1.736 16.472 -2.595 1.00 0.00 C ATOM 0 HA PRO A 74 1.878 18.506 -5.138 1.00 0.00 H new ATOM 0 HB2 PRO A 74 2.086 19.774 -2.675 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.577 19.039 -3.178 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.704 17.936 -1.353 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.961 17.884 -1.170 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.364 15.738 -2.090 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.727 16.060 -2.627 1.00 0.00 H new ATOM 1149 N LYS A 75 4.569 18.348 -3.271 1.00 0.00 N ATOM 1150 CA LYS A 75 5.971 18.747 -3.231 1.00 0.00 C ATOM 1151 C LYS A 75 6.860 17.676 -3.856 1.00 0.00 C ATOM 1152 O LYS A 75 6.481 16.507 -3.929 1.00 0.00 O ATOM 1153 CB LYS A 75 6.407 19.007 -1.787 1.00 0.00 C ATOM 1154 CG LYS A 75 6.031 17.891 -0.828 1.00 0.00 C ATOM 1155 CD LYS A 75 6.641 18.108 0.547 1.00 0.00 C ATOM 1156 CE LYS A 75 5.981 17.226 1.595 1.00 0.00 C ATOM 1157 NZ LYS A 75 4.497 17.344 1.565 1.00 0.00 N ATOM 0 H LYS A 75 4.270 17.777 -2.480 1.00 0.00 H new ATOM 0 HA LYS A 75 6.078 19.665 -3.808 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.488 19.147 -1.762 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.957 19.938 -1.442 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.946 17.835 -0.741 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.368 16.936 -1.230 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.709 17.894 0.510 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.535 19.155 0.832 1.00 0.00 H new ATOM 0 HE2 LYS A 75 6.266 16.187 1.427 1.00 0.00 H new ATOM 0 HE3 LYS A 75 6.347 17.501 2.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 4.110 17.099 2.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.231 18.321 1.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 4.112 16.695 0.849 1.00 0.00 H new ATOM 1171 N SER A 76 8.043 18.084 -4.305 1.00 0.00 N ATOM 1172 CA SER A 76 8.984 17.159 -4.926 1.00 0.00 C ATOM 1173 C SER A 76 8.950 15.801 -4.232 1.00 0.00 C ATOM 1174 O SER A 76 8.423 14.830 -4.772 1.00 0.00 O ATOM 1175 CB SER A 76 10.401 17.734 -4.880 1.00 0.00 C ATOM 1176 OG SER A 76 10.535 18.834 -5.763 1.00 0.00 O ATOM 0 H SER A 76 8.372 19.048 -4.250 1.00 0.00 H new ATOM 0 HA SER A 76 8.689 17.022 -5.966 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.636 18.049 -3.863 1.00 0.00 H new ATOM 0 HB3 SER A 76 11.120 16.959 -5.148 1.00 0.00 H new ATOM 0 HG SER A 76 11.449 19.184 -5.713 1.00 0.00 H new ATOM 1182 N GLU A 77 9.518 15.743 -3.031 1.00 0.00 N ATOM 1183 CA GLU A 77 9.554 14.505 -2.263 1.00 0.00 C ATOM 1184 C GLU A 77 8.826 14.669 -0.932 1.00 0.00 C ATOM 1185 O GLU A 77 8.745 15.770 -0.387 1.00 0.00 O ATOM 1186 CB GLU A 77 11.001 14.074 -2.015 1.00 0.00 C ATOM 1187 CG GLU A 77 11.705 14.891 -0.944 1.00 0.00 C ATOM 1188 CD GLU A 77 13.213 14.743 -0.994 1.00 0.00 C ATOM 1189 OE1 GLU A 77 13.706 13.614 -0.788 1.00 0.00 O ATOM 1190 OE2 GLU A 77 13.901 15.756 -1.239 1.00 0.00 O ATOM 0 H GLU A 77 9.959 16.539 -2.570 1.00 0.00 H new ATOM 0 HA GLU A 77 9.047 13.734 -2.843 1.00 0.00 H new ATOM 0 HB2 GLU A 77 11.014 13.023 -1.725 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.560 14.154 -2.947 1.00 0.00 H new ATOM 0 HG2 GLU A 77 11.443 15.942 -1.063 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.346 14.582 0.038 1.00 0.00 H new ATOM 1197 N VAL A 78 8.297 13.565 -0.414 1.00 0.00 N ATOM 1198 CA VAL A 78 7.575 13.585 0.853 1.00 0.00 C ATOM 1199 C VAL A 78 7.889 12.345 1.684 1.00 0.00 C ATOM 1200 O VAL A 78 7.917 11.229 1.165 1.00 0.00 O ATOM 1201 CB VAL A 78 6.054 13.669 0.631 1.00 0.00 C ATOM 1202 CG1 VAL A 78 5.600 12.613 -0.365 1.00 0.00 C ATOM 1203 CG2 VAL A 78 5.314 13.521 1.952 1.00 0.00 C ATOM 0 H VAL A 78 8.355 12.646 -0.852 1.00 0.00 H new ATOM 0 HA VAL A 78 7.905 14.473 1.392 1.00 0.00 H new ATOM 0 HB VAL A 78 5.819 14.649 0.217 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.522 12.688 -0.509 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.105 12.771 -1.318 1.00 0.00 H new ATOM 0 HG13 VAL A 78 5.847 11.622 0.017 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.240 13.583 1.776 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.554 12.555 2.397 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.617 14.319 2.630 1.00 0.00 H new ATOM 1213 N ARG A 79 8.124 12.549 2.976 1.00 0.00 N ATOM 1214 CA ARG A 79 8.436 11.448 3.879 1.00 0.00 C ATOM 1215 C ARG A 79 7.198 11.018 4.661 1.00 0.00 C ATOM 1216 O ARG A 79 6.445 11.855 5.158 1.00 0.00 O ATOM 1217 CB ARG A 79 9.549 11.854 4.847 1.00 0.00 C ATOM 1218 CG ARG A 79 10.946 11.546 4.332 1.00 0.00 C ATOM 1219 CD ARG A 79 11.967 12.538 4.867 1.00 0.00 C ATOM 1220 NE ARG A 79 13.322 11.994 4.842 1.00 0.00 N ATOM 1221 CZ ARG A 79 14.391 12.666 5.255 1.00 0.00 C ATOM 1222 NH1 ARG A 79 14.263 13.900 5.724 1.00 0.00 N ATOM 1223 NH2 ARG A 79 15.592 12.104 5.201 1.00 0.00 N ATOM 0 H ARG A 79 8.104 13.467 3.421 1.00 0.00 H new ATOM 0 HA ARG A 79 8.776 10.604 3.279 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.472 12.923 5.048 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.399 11.340 5.796 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.229 10.536 4.627 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.948 11.572 3.242 1.00 0.00 H new ATOM 0 HD2 ARG A 79 11.932 13.451 4.273 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.705 12.813 5.889 1.00 0.00 H new ATOM 0 HE ARG A 79 13.455 11.047 4.488 1.00 0.00 H new ATOM 0 HH11 ARG A 79 13.342 14.336 5.768 1.00 0.00 H new ATOM 0 HH12 ARG A 79 15.086 14.413 6.040 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.695 11.155 4.842 1.00 0.00 H new ATOM 0 HH22 ARG A 79 16.412 12.621 5.518 1.00 0.00 H new ATOM 1237 N ALA A 80 6.995 9.709 4.765 1.00 0.00 N ATOM 1238 CA ALA A 80 5.850 9.169 5.487 1.00 0.00 C ATOM 1239 C ALA A 80 6.074 7.706 5.855 1.00 0.00 C ATOM 1240 O ALA A 80 6.927 7.033 5.277 1.00 0.00 O ATOM 1241 CB ALA A 80 4.584 9.318 4.657 1.00 0.00 C ATOM 0 H ALA A 80 7.609 9.003 4.358 1.00 0.00 H new ATOM 0 HA ALA A 80 5.734 9.736 6.411 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.737 8.910 5.209 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.407 10.373 4.449 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.699 8.777 3.718 1.00 0.00 H new ATOM 1247 N LYS A 81 5.303 7.219 6.821 1.00 0.00 N ATOM 1248 CA LYS A 81 5.415 5.835 7.267 1.00 0.00 C ATOM 1249 C LYS A 81 4.296 4.981 6.680 1.00 0.00 C ATOM 1250 O LYS A 81 3.367 5.499 6.059 1.00 0.00 O ATOM 1251 CB LYS A 81 5.376 5.766 8.795 1.00 0.00 C ATOM 1252 CG LYS A 81 6.542 6.472 9.467 1.00 0.00 C ATOM 1253 CD LYS A 81 6.255 6.752 10.932 1.00 0.00 C ATOM 1254 CE LYS A 81 7.020 7.969 11.427 1.00 0.00 C ATOM 1255 NZ LYS A 81 6.543 9.224 10.784 1.00 0.00 N ATOM 0 H LYS A 81 4.593 7.763 7.311 1.00 0.00 H new ATOM 0 HA LYS A 81 6.369 5.442 6.916 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.444 6.208 9.146 1.00 0.00 H new ATOM 0 HB3 LYS A 81 5.369 4.720 9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.438 5.858 9.382 1.00 0.00 H new ATOM 0 HG3 LYS A 81 6.748 7.409 8.950 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.186 6.912 11.070 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.527 5.882 11.530 1.00 0.00 H new ATOM 0 HE2 LYS A 81 6.911 8.051 12.508 1.00 0.00 H new ATOM 0 HE3 LYS A 81 8.083 7.838 11.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.482 9.978 11.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 7.210 9.507 10.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.603 9.065 10.367 1.00 0.00 H new ATOM 1269 N PHE A 82 4.390 3.671 6.881 1.00 0.00 N ATOM 1270 CA PHE A 82 3.384 2.746 6.372 1.00 0.00 C ATOM 1271 C PHE A 82 3.302 1.497 7.246 1.00 0.00 C ATOM 1272 O PHE A 82 4.317 0.995 7.729 1.00 0.00 O ATOM 1273 CB PHE A 82 3.708 2.352 4.929 1.00 0.00 C ATOM 1274 CG PHE A 82 5.111 1.848 4.745 1.00 0.00 C ATOM 1275 CD1 PHE A 82 5.442 0.545 5.079 1.00 0.00 C ATOM 1276 CD2 PHE A 82 6.098 2.678 4.239 1.00 0.00 C ATOM 1277 CE1 PHE A 82 6.732 0.078 4.910 1.00 0.00 C ATOM 1278 CE2 PHE A 82 7.389 2.217 4.068 1.00 0.00 C ATOM 1279 CZ PHE A 82 7.707 0.916 4.405 1.00 0.00 C ATOM 0 H PHE A 82 5.152 3.226 7.392 1.00 0.00 H new ATOM 0 HA PHE A 82 2.417 3.249 6.396 1.00 0.00 H new ATOM 0 HB2 PHE A 82 3.008 1.581 4.606 1.00 0.00 H new ATOM 0 HB3 PHE A 82 3.553 3.215 4.282 1.00 0.00 H new ATOM 0 HD1 PHE A 82 4.684 -0.113 5.476 1.00 0.00 H new ATOM 0 HD2 PHE A 82 5.855 3.697 3.975 1.00 0.00 H new ATOM 0 HE1 PHE A 82 6.977 -0.941 5.172 1.00 0.00 H new ATOM 0 HE2 PHE A 82 8.149 2.874 3.671 1.00 0.00 H new ATOM 0 HZ PHE A 82 8.716 0.554 4.274 1.00 0.00 H new ATOM 1289 N LYS A 83 2.086 1.001 7.445 1.00 0.00 N ATOM 1290 CA LYS A 83 1.868 -0.188 8.260 1.00 0.00 C ATOM 1291 C LYS A 83 0.768 -1.061 7.665 1.00 0.00 C ATOM 1292 O LYS A 83 -0.390 -0.650 7.586 1.00 0.00 O ATOM 1293 CB LYS A 83 1.501 0.209 9.691 1.00 0.00 C ATOM 1294 CG LYS A 83 1.643 -0.925 10.692 1.00 0.00 C ATOM 1295 CD LYS A 83 0.391 -1.785 10.742 1.00 0.00 C ATOM 1296 CE LYS A 83 -0.724 -1.102 11.520 1.00 0.00 C ATOM 1297 NZ LYS A 83 -0.662 -1.420 12.973 1.00 0.00 N ATOM 0 H LYS A 83 1.235 1.404 7.053 1.00 0.00 H new ATOM 0 HA LYS A 83 2.795 -0.762 8.276 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.135 1.039 10.003 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.473 0.570 9.707 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.500 -1.543 10.424 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.844 -0.515 11.682 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.052 -1.995 9.728 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.625 -2.744 11.205 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.655 -0.023 11.381 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -1.689 -1.414 11.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.438 -0.936 13.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -0.753 -2.447 13.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.249 -1.099 13.360 1.00 0.00 H new ATOM 1311 N PHE A 84 1.137 -2.268 7.248 1.00 0.00 N ATOM 1312 CA PHE A 84 0.181 -3.199 6.661 1.00 0.00 C ATOM 1313 C PHE A 84 -0.305 -4.207 7.698 1.00 0.00 C ATOM 1314 O PHE A 84 0.442 -4.600 8.595 1.00 0.00 O ATOM 1315 CB PHE A 84 0.813 -3.934 5.477 1.00 0.00 C ATOM 1316 CG PHE A 84 1.371 -3.013 4.429 1.00 0.00 C ATOM 1317 CD1 PHE A 84 0.558 -2.084 3.801 1.00 0.00 C ATOM 1318 CD2 PHE A 84 2.708 -3.078 4.072 1.00 0.00 C ATOM 1319 CE1 PHE A 84 1.068 -1.235 2.836 1.00 0.00 C ATOM 1320 CE2 PHE A 84 3.224 -2.231 3.109 1.00 0.00 C ATOM 1321 CZ PHE A 84 2.403 -1.310 2.490 1.00 0.00 C ATOM 0 H PHE A 84 2.091 -2.624 7.306 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.676 -2.625 6.308 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.611 -4.580 5.844 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.064 -4.581 5.020 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.487 -2.022 4.068 1.00 0.00 H new ATOM 0 HD2 PHE A 84 3.354 -3.798 4.551 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.424 -0.515 2.354 1.00 0.00 H new ATOM 0 HE2 PHE A 84 4.269 -2.290 2.841 1.00 0.00 H new ATOM 0 HZ PHE A 84 2.804 -0.649 1.736 1.00 0.00 H new ATOM 1331 N SER A 85 -1.561 -4.621 7.570 1.00 0.00 N ATOM 1332 CA SER A 85 -2.149 -5.580 8.498 1.00 0.00 C ATOM 1333 C SER A 85 -3.350 -6.279 7.869 1.00 0.00 C ATOM 1334 O SER A 85 -3.975 -5.753 6.948 1.00 0.00 O ATOM 1335 CB SER A 85 -2.571 -4.878 9.790 1.00 0.00 C ATOM 1336 OG SER A 85 -3.393 -3.757 9.516 1.00 0.00 O ATOM 0 H SER A 85 -2.192 -4.307 6.832 1.00 0.00 H new ATOM 0 HA SER A 85 -1.395 -6.332 8.731 1.00 0.00 H new ATOM 0 HB2 SER A 85 -3.108 -5.579 10.430 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.686 -4.558 10.340 1.00 0.00 H new ATOM 0 HG SER A 85 -3.243 -3.459 8.595 1.00 0.00 H new ATOM 1342 N ILE A 86 -3.667 -7.466 8.374 1.00 0.00 N ATOM 1343 CA ILE A 86 -4.794 -8.237 7.864 1.00 0.00 C ATOM 1344 C ILE A 86 -5.864 -8.421 8.934 1.00 0.00 C ATOM 1345 O ILE A 86 -5.559 -8.733 10.086 1.00 0.00 O ATOM 1346 CB ILE A 86 -4.346 -9.621 7.358 1.00 0.00 C ATOM 1347 CG1 ILE A 86 -3.303 -9.470 6.249 1.00 0.00 C ATOM 1348 CG2 ILE A 86 -5.544 -10.416 6.860 1.00 0.00 C ATOM 1349 CD1 ILE A 86 -2.361 -10.649 6.140 1.00 0.00 C ATOM 0 H ILE A 86 -3.159 -7.915 9.136 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.211 -7.672 7.031 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.892 -10.165 8.187 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -3.815 -9.335 5.296 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.721 -8.566 6.429 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.211 -11.392 6.506 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -6.256 -10.549 7.674 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.024 -9.877 6.043 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.649 -10.473 5.333 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.822 -10.772 7.079 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.932 -11.553 5.929 1.00 0.00 H new ATOM 1361 N LEU A 87 -7.120 -8.229 8.546 1.00 0.00 N ATOM 1362 CA LEU A 87 -8.238 -8.376 9.472 1.00 0.00 C ATOM 1363 C LEU A 87 -8.923 -9.726 9.289 1.00 0.00 C ATOM 1364 O LEU A 87 -9.633 -9.945 8.308 1.00 0.00 O ATOM 1365 CB LEU A 87 -9.248 -7.246 9.266 1.00 0.00 C ATOM 1366 CG LEU A 87 -8.784 -5.848 9.674 1.00 0.00 C ATOM 1367 CD1 LEU A 87 -9.970 -4.994 10.097 1.00 0.00 C ATOM 1368 CD2 LEU A 87 -7.759 -5.932 10.796 1.00 0.00 C ATOM 0 H LEU A 87 -7.390 -7.971 7.597 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.846 -8.324 10.488 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.526 -7.222 8.212 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.151 -7.486 9.828 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.312 -5.377 8.812 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.620 -4.002 10.384 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.670 -4.906 9.266 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.471 -5.461 10.945 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.440 -4.927 11.073 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.206 -6.423 11.661 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.896 -6.506 10.458 1.00 0.00 H new ATOM 1380 N ASN A 88 -8.707 -10.628 10.241 1.00 0.00 N ATOM 1381 CA ASN A 88 -9.305 -11.957 10.186 1.00 0.00 C ATOM 1382 C ASN A 88 -10.826 -11.866 10.107 1.00 0.00 C ATOM 1383 O ASN A 88 -11.387 -10.777 9.989 1.00 0.00 O ATOM 1384 CB ASN A 88 -8.894 -12.775 11.412 1.00 0.00 C ATOM 1385 CG ASN A 88 -9.777 -12.498 12.613 1.00 0.00 C ATOM 1386 OD1 ASN A 88 -10.547 -13.357 13.043 1.00 0.00 O ATOM 1387 ND2 ASN A 88 -9.669 -11.293 13.162 1.00 0.00 N ATOM 0 H ASN A 88 -8.122 -10.463 11.060 1.00 0.00 H new ATOM 0 HA ASN A 88 -8.942 -12.455 9.287 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.938 -13.837 11.169 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.858 -12.549 11.666 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -10.238 -11.049 13.973 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -9.017 -10.612 12.773 1.00 0.00 H new ATOM 1394 N ALA A 89 -11.486 -13.017 10.173 1.00 0.00 N ATOM 1395 CA ALA A 89 -12.941 -13.068 10.112 1.00 0.00 C ATOM 1396 C ALA A 89 -13.567 -12.194 11.193 1.00 0.00 C ATOM 1397 O ALA A 89 -14.634 -11.611 10.996 1.00 0.00 O ATOM 1398 CB ALA A 89 -13.426 -14.504 10.246 1.00 0.00 C ATOM 0 H ALA A 89 -11.036 -13.927 10.269 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.252 -12.680 9.142 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.515 -14.526 10.199 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.015 -15.104 9.434 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.096 -14.912 11.201 1.00 0.00 H new ATOM 1404 N LYS A 90 -12.897 -12.106 12.337 1.00 0.00 N ATOM 1405 CA LYS A 90 -13.387 -11.302 13.451 1.00 0.00 C ATOM 1406 C LYS A 90 -13.065 -9.826 13.240 1.00 0.00 C ATOM 1407 O LYS A 90 -13.359 -8.988 14.091 1.00 0.00 O ATOM 1408 CB LYS A 90 -12.770 -11.786 14.766 1.00 0.00 C ATOM 1409 CG LYS A 90 -13.513 -12.954 15.392 1.00 0.00 C ATOM 1410 CD LYS A 90 -13.129 -14.272 14.740 1.00 0.00 C ATOM 1411 CE LYS A 90 -14.103 -14.653 13.636 1.00 0.00 C ATOM 1412 NZ LYS A 90 -15.461 -14.948 14.172 1.00 0.00 N ATOM 0 H LYS A 90 -12.013 -12.582 12.517 1.00 0.00 H new ATOM 0 HA LYS A 90 -14.470 -11.416 13.500 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.735 -12.078 14.586 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.749 -10.958 15.474 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.293 -12.997 16.459 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -14.587 -12.798 15.294 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -12.123 -14.196 14.328 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -13.106 -15.059 15.494 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -14.167 -13.841 12.912 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -13.725 -15.526 13.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -15.961 -15.584 13.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -15.375 -15.404 15.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -15.996 -14.061 14.269 1.00 0.00 H new ATOM 1426 N GLY A 91 -12.460 -9.514 12.097 1.00 0.00 N ATOM 1427 CA GLY A 91 -12.110 -8.139 11.794 1.00 0.00 C ATOM 1428 C GLY A 91 -10.971 -7.628 12.654 1.00 0.00 C ATOM 1429 O GLY A 91 -10.764 -6.420 12.765 1.00 0.00 O ATOM 0 H GLY A 91 -12.206 -10.189 11.376 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.831 -8.061 10.743 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -12.984 -7.504 11.939 1.00 0.00 H new ATOM 1433 N GLU A 92 -10.233 -8.549 13.265 1.00 0.00 N ATOM 1434 CA GLU A 92 -9.111 -8.184 14.121 1.00 0.00 C ATOM 1435 C GLU A 92 -7.793 -8.268 13.357 1.00 0.00 C ATOM 1436 O GLU A 92 -7.613 -9.137 12.505 1.00 0.00 O ATOM 1437 CB GLU A 92 -9.060 -9.095 15.350 1.00 0.00 C ATOM 1438 CG GLU A 92 -10.341 -9.087 16.167 1.00 0.00 C ATOM 1439 CD GLU A 92 -10.340 -8.017 17.241 1.00 0.00 C ATOM 1440 OE1 GLU A 92 -9.255 -7.721 17.783 1.00 0.00 O ATOM 1441 OE2 GLU A 92 -11.425 -7.476 17.541 1.00 0.00 O ATOM 0 H GLU A 92 -10.392 -9.553 13.183 1.00 0.00 H new ATOM 0 HA GLU A 92 -9.257 -7.154 14.447 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -8.851 -10.115 15.027 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -8.231 -8.786 15.987 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -11.190 -8.929 15.503 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -10.477 -10.063 16.632 1.00 0.00 H new ATOM 1448 N GLU A 93 -6.876 -7.357 13.668 1.00 0.00 N ATOM 1449 CA GLU A 93 -5.575 -7.328 13.010 1.00 0.00 C ATOM 1450 C GLU A 93 -4.817 -8.632 13.243 1.00 0.00 C ATOM 1451 O GLU A 93 -4.795 -9.160 14.355 1.00 0.00 O ATOM 1452 CB GLU A 93 -4.747 -6.146 13.519 1.00 0.00 C ATOM 1453 CG GLU A 93 -4.964 -4.866 12.730 1.00 0.00 C ATOM 1454 CD GLU A 93 -4.563 -3.627 13.506 1.00 0.00 C ATOM 1455 OE1 GLU A 93 -4.684 -3.641 14.749 1.00 0.00 O ATOM 1456 OE2 GLU A 93 -4.127 -2.643 12.872 1.00 0.00 O ATOM 0 H GLU A 93 -7.010 -6.630 14.371 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.741 -7.211 11.939 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -4.994 -5.964 14.565 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.690 -6.411 13.482 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.390 -4.912 11.805 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.015 -4.790 12.450 1.00 0.00 H new ATOM 1463 N THR A 94 -4.198 -9.147 12.185 1.00 0.00 N ATOM 1464 CA THR A 94 -3.441 -10.389 12.273 1.00 0.00 C ATOM 1465 C THR A 94 -2.377 -10.463 11.184 1.00 0.00 C ATOM 1466 O THR A 94 -2.610 -10.055 10.045 1.00 0.00 O ATOM 1467 CB THR A 94 -4.362 -11.618 12.158 1.00 0.00 C ATOM 1468 OG1 THR A 94 -3.689 -12.783 12.648 1.00 0.00 O ATOM 1469 CG2 THR A 94 -4.789 -11.841 10.716 1.00 0.00 C ATOM 0 H THR A 94 -4.206 -8.723 11.257 1.00 0.00 H new ATOM 0 HA THR A 94 -2.958 -10.396 13.250 1.00 0.00 H new ATOM 0 HB THR A 94 -5.252 -11.434 12.759 1.00 0.00 H new ATOM 0 HG1 THR A 94 -4.282 -13.559 12.573 1.00 0.00 H new ATOM 0 HG21 THR A 94 -5.439 -12.714 10.660 1.00 0.00 H new ATOM 0 HG22 THR A 94 -5.328 -10.964 10.356 1.00 0.00 H new ATOM 0 HG23 THR A 94 -3.907 -12.004 10.097 1.00 0.00 H new ATOM 1477 N LYS A 95 -1.208 -10.985 11.539 1.00 0.00 N ATOM 1478 CA LYS A 95 -0.107 -11.114 10.592 1.00 0.00 C ATOM 1479 C LYS A 95 0.224 -9.768 9.956 1.00 0.00 C ATOM 1480 O LYS A 95 0.322 -9.655 8.734 1.00 0.00 O ATOM 1481 CB LYS A 95 -0.461 -12.131 9.504 1.00 0.00 C ATOM 1482 CG LYS A 95 -0.925 -13.470 10.050 1.00 0.00 C ATOM 1483 CD LYS A 95 0.197 -14.197 10.772 1.00 0.00 C ATOM 1484 CE LYS A 95 0.016 -15.706 10.706 1.00 0.00 C ATOM 1485 NZ LYS A 95 1.321 -16.423 10.736 1.00 0.00 N ATOM 0 H LYS A 95 -0.998 -11.326 12.477 1.00 0.00 H new ATOM 0 HA LYS A 95 0.770 -11.464 11.137 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.245 -11.715 8.871 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.411 -12.289 8.869 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.759 -13.315 10.734 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -1.294 -14.089 9.232 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.154 -13.924 10.327 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.227 -13.878 11.814 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -0.598 -16.035 11.544 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -0.521 -15.968 9.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 1.155 -17.449 10.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.898 -16.128 9.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 1.823 -16.194 11.617 1.00 0.00 H new ATOM 1499 N ALA A 96 0.399 -8.751 10.793 1.00 0.00 N ATOM 1500 CA ALA A 96 0.723 -7.413 10.312 1.00 0.00 C ATOM 1501 C ALA A 96 2.222 -7.147 10.400 1.00 0.00 C ATOM 1502 O ALA A 96 2.955 -7.883 11.060 1.00 0.00 O ATOM 1503 CB ALA A 96 -0.048 -6.367 11.103 1.00 0.00 C ATOM 0 H ALA A 96 0.322 -8.828 11.807 1.00 0.00 H new ATOM 0 HA ALA A 96 0.430 -7.349 9.264 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.204 -5.373 10.733 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.118 -6.538 10.986 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.217 -6.440 12.158 1.00 0.00 H new ATOM 1509 N MET A 97 2.671 -6.091 9.730 1.00 0.00 N ATOM 1510 CA MET A 97 4.083 -5.728 9.733 1.00 0.00 C ATOM 1511 C MET A 97 4.256 -4.215 9.825 1.00 0.00 C ATOM 1512 O MET A 97 3.652 -3.466 9.059 1.00 0.00 O ATOM 1513 CB MET A 97 4.770 -6.256 8.472 1.00 0.00 C ATOM 1514 CG MET A 97 4.725 -7.770 8.344 1.00 0.00 C ATOM 1515 SD MET A 97 6.101 -8.426 7.381 1.00 0.00 S ATOM 1516 CE MET A 97 6.225 -7.197 6.085 1.00 0.00 C ATOM 0 H MET A 97 2.077 -5.472 9.178 1.00 0.00 H new ATOM 0 HA MET A 97 4.547 -6.182 10.608 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.296 -5.811 7.597 1.00 0.00 H new ATOM 0 HB3 MET A 97 5.810 -5.930 8.471 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.738 -8.215 9.339 1.00 0.00 H new ATOM 0 HG3 MET A 97 3.786 -8.063 7.875 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.895 -7.558 5.304 1.00 0.00 H new ATOM 0 HE2 MET A 97 5.238 -7.015 5.660 1.00 0.00 H new ATOM 0 HE3 MET A 97 6.618 -6.269 6.500 1.00 0.00 H new ATOM 1526 N GLU A 98 5.083 -3.775 10.767 1.00 0.00 N ATOM 1527 CA GLU A 98 5.333 -2.351 10.959 1.00 0.00 C ATOM 1528 C GLU A 98 6.620 -1.925 10.257 1.00 0.00 C ATOM 1529 O GLU A 98 7.496 -2.748 9.992 1.00 0.00 O ATOM 1530 CB GLU A 98 5.420 -2.022 12.450 1.00 0.00 C ATOM 1531 CG GLU A 98 4.135 -2.305 13.212 1.00 0.00 C ATOM 1532 CD GLU A 98 4.316 -2.212 14.714 1.00 0.00 C ATOM 1533 OE1 GLU A 98 4.603 -1.103 15.210 1.00 0.00 O ATOM 1534 OE2 GLU A 98 4.169 -3.249 15.395 1.00 0.00 O ATOM 0 H GLU A 98 5.591 -4.383 11.409 1.00 0.00 H new ATOM 0 HA GLU A 98 4.501 -1.800 10.521 1.00 0.00 H new ATOM 0 HB2 GLU A 98 6.231 -2.600 12.894 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.677 -0.969 12.567 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.367 -1.598 12.898 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.776 -3.301 12.954 1.00 0.00 H new ATOM 1541 N SER A 99 6.725 -0.634 9.960 1.00 0.00 N ATOM 1542 CA SER A 99 7.902 -0.099 9.285 1.00 0.00 C ATOM 1543 C SER A 99 8.911 0.437 10.297 1.00 0.00 C ATOM 1544 O SER A 99 8.542 0.864 11.390 1.00 0.00 O ATOM 1545 CB SER A 99 7.498 1.012 8.314 1.00 0.00 C ATOM 1546 OG SER A 99 8.634 1.567 7.673 1.00 0.00 O ATOM 0 H SER A 99 6.010 0.061 10.176 1.00 0.00 H new ATOM 0 HA SER A 99 8.369 -0.909 8.725 1.00 0.00 H new ATOM 0 HB2 SER A 99 6.813 0.614 7.566 1.00 0.00 H new ATOM 0 HB3 SER A 99 6.963 1.794 8.853 1.00 0.00 H new ATOM 0 HG SER A 99 8.543 1.467 6.702 1.00 0.00 H new ATOM 1552 N GLN A 100 10.186 0.410 9.922 1.00 0.00 N ATOM 1553 CA GLN A 100 11.249 0.892 10.796 1.00 0.00 C ATOM 1554 C GLN A 100 11.222 2.413 10.899 1.00 0.00 C ATOM 1555 O GLN A 100 10.991 2.968 11.974 1.00 0.00 O ATOM 1556 CB GLN A 100 12.612 0.428 10.280 1.00 0.00 C ATOM 1557 CG GLN A 100 13.773 0.844 11.169 1.00 0.00 C ATOM 1558 CD GLN A 100 15.098 0.272 10.705 1.00 0.00 C ATOM 1559 OE1 GLN A 100 15.252 -0.943 10.575 1.00 0.00 O ATOM 1560 NE2 GLN A 100 16.064 1.146 10.451 1.00 0.00 N ATOM 0 H GLN A 100 10.508 0.060 9.020 1.00 0.00 H new ATOM 0 HA GLN A 100 11.084 0.476 11.790 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.606 -0.658 10.189 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.769 0.831 9.279 1.00 0.00 H new ATOM 0 HG2 GLN A 100 13.838 1.932 11.189 1.00 0.00 H new ATOM 0 HG3 GLN A 100 13.578 0.517 12.191 1.00 0.00 H new ATOM 0 HE21 GLN A 100 15.893 2.144 10.572 1.00 0.00 H new ATOM 0 HE22 GLN A 100 16.977 0.819 10.135 1.00 0.00 H new ATOM 1569 N ARG A 101 11.458 3.082 9.775 1.00 0.00 N ATOM 1570 CA ARG A 101 11.462 4.539 9.740 1.00 0.00 C ATOM 1571 C ARG A 101 10.962 5.052 8.392 1.00 0.00 C ATOM 1572 O ARG A 101 11.280 4.488 7.346 1.00 0.00 O ATOM 1573 CB ARG A 101 12.870 5.074 10.010 1.00 0.00 C ATOM 1574 CG ARG A 101 12.891 6.508 10.512 1.00 0.00 C ATOM 1575 CD ARG A 101 12.727 6.572 12.022 1.00 0.00 C ATOM 1576 NE ARG A 101 12.519 7.939 12.493 1.00 0.00 N ATOM 1577 CZ ARG A 101 12.742 8.328 13.743 1.00 0.00 C ATOM 1578 NH1 ARG A 101 13.177 7.457 14.644 1.00 0.00 N ATOM 1579 NH2 ARG A 101 12.530 9.589 14.095 1.00 0.00 N ATOM 0 H ARG A 101 11.649 2.638 8.877 1.00 0.00 H new ATOM 0 HA ARG A 101 10.789 4.897 10.519 1.00 0.00 H new ATOM 0 HB2 ARG A 101 13.358 4.434 10.745 1.00 0.00 H new ATOM 0 HB3 ARG A 101 13.456 5.011 9.093 1.00 0.00 H new ATOM 0 HG2 ARG A 101 13.831 6.981 10.227 1.00 0.00 H new ATOM 0 HG3 ARG A 101 12.091 7.074 10.034 1.00 0.00 H new ATOM 0 HD2 ARG A 101 11.881 5.953 12.321 1.00 0.00 H new ATOM 0 HD3 ARG A 101 13.613 6.155 12.501 1.00 0.00 H new ATOM 0 HE ARG A 101 12.184 8.633 11.825 1.00 0.00 H new ATOM 0 HH11 ARG A 101 13.341 6.486 14.377 1.00 0.00 H new ATOM 0 HH12 ARG A 101 13.348 7.758 15.604 1.00 0.00 H new ATOM 0 HH21 ARG A 101 12.195 10.262 13.405 1.00 0.00 H new ATOM 0 HH22 ARG A 101 12.702 9.886 15.056 1.00 0.00 H new ATOM 1593 N ALA A 102 10.177 6.124 8.427 1.00 0.00 N ATOM 1594 CA ALA A 102 9.635 6.713 7.209 1.00 0.00 C ATOM 1595 C ALA A 102 10.679 6.736 6.098 1.00 0.00 C ATOM 1596 O ALA A 102 11.881 6.780 6.363 1.00 0.00 O ATOM 1597 CB ALA A 102 9.123 8.119 7.485 1.00 0.00 C ATOM 0 H ALA A 102 9.902 6.602 9.285 1.00 0.00 H new ATOM 0 HA ALA A 102 8.802 6.094 6.875 1.00 0.00 H new ATOM 0 HB1 ALA A 102 8.721 8.547 6.566 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.338 8.079 8.240 1.00 0.00 H new ATOM 0 HB3 ALA A 102 9.943 8.740 7.846 1.00 0.00 H new ATOM 1603 N TYR A 103 10.214 6.706 4.854 1.00 0.00 N ATOM 1604 CA TYR A 103 11.108 6.720 3.703 1.00 0.00 C ATOM 1605 C TYR A 103 10.762 7.868 2.758 1.00 0.00 C ATOM 1606 O TYR A 103 9.753 8.550 2.937 1.00 0.00 O ATOM 1607 CB TYR A 103 11.032 5.388 2.954 1.00 0.00 C ATOM 1608 CG TYR A 103 11.608 4.225 3.729 1.00 0.00 C ATOM 1609 CD1 TYR A 103 10.905 3.650 4.781 1.00 0.00 C ATOM 1610 CD2 TYR A 103 12.854 3.701 3.411 1.00 0.00 C ATOM 1611 CE1 TYR A 103 11.427 2.587 5.493 1.00 0.00 C ATOM 1612 CE2 TYR A 103 13.384 2.637 4.116 1.00 0.00 C ATOM 1613 CZ TYR A 103 12.666 2.084 5.156 1.00 0.00 C ATOM 1614 OH TYR A 103 13.190 1.025 5.862 1.00 0.00 O ATOM 0 H TYR A 103 9.222 6.672 4.617 1.00 0.00 H new ATOM 0 HA TYR A 103 12.125 6.867 4.067 1.00 0.00 H new ATOM 0 HB2 TYR A 103 9.990 5.174 2.715 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.564 5.482 2.007 1.00 0.00 H new ATOM 0 HD1 TYR A 103 9.934 4.041 5.047 1.00 0.00 H new ATOM 0 HD2 TYR A 103 13.419 4.133 2.598 1.00 0.00 H new ATOM 0 HE1 TYR A 103 10.868 2.153 6.309 1.00 0.00 H new ATOM 0 HE2 TYR A 103 14.354 2.241 3.854 1.00 0.00 H new ATOM 0 HH TYR A 103 14.069 0.792 5.497 1.00 0.00 H new ATOM 1624 N ARG A 104 11.607 8.073 1.753 1.00 0.00 N ATOM 1625 CA ARG A 104 11.392 9.137 0.780 1.00 0.00 C ATOM 1626 C ARG A 104 10.368 8.715 -0.270 1.00 0.00 C ATOM 1627 O ARG A 104 10.619 7.815 -1.071 1.00 0.00 O ATOM 1628 CB ARG A 104 12.710 9.510 0.100 1.00 0.00 C ATOM 1629 CG ARG A 104 12.535 10.372 -1.139 1.00 0.00 C ATOM 1630 CD ARG A 104 13.874 10.732 -1.762 1.00 0.00 C ATOM 1631 NE ARG A 104 14.302 9.746 -2.751 1.00 0.00 N ATOM 1632 CZ ARG A 104 15.565 9.583 -3.127 1.00 0.00 C ATOM 1633 NH1 ARG A 104 16.520 10.336 -2.600 1.00 0.00 N ATOM 1634 NH2 ARG A 104 15.875 8.663 -4.033 1.00 0.00 N ATOM 0 H ARG A 104 12.446 7.517 1.591 1.00 0.00 H new ATOM 0 HA ARG A 104 11.006 10.007 1.311 1.00 0.00 H new ATOM 0 HB2 ARG A 104 13.340 10.040 0.814 1.00 0.00 H new ATOM 0 HB3 ARG A 104 13.238 8.597 -0.175 1.00 0.00 H new ATOM 0 HG2 ARG A 104 11.924 9.841 -1.869 1.00 0.00 H new ATOM 0 HG3 ARG A 104 11.998 11.284 -0.876 1.00 0.00 H new ATOM 0 HD2 ARG A 104 13.802 11.711 -2.235 1.00 0.00 H new ATOM 0 HD3 ARG A 104 14.628 10.811 -0.979 1.00 0.00 H new ATOM 0 HE ARG A 104 13.592 9.150 -3.176 1.00 0.00 H new ATOM 0 HH11 ARG A 104 16.286 11.043 -1.903 1.00 0.00 H new ATOM 0 HH12 ARG A 104 17.489 10.208 -2.891 1.00 0.00 H new ATOM 0 HH21 ARG A 104 15.143 8.081 -4.440 1.00 0.00 H new ATOM 0 HH22 ARG A 104 16.845 8.538 -4.322 1.00 0.00 H new ATOM 1648 N PHE A 105 9.212 9.372 -0.259 1.00 0.00 N ATOM 1649 CA PHE A 105 8.149 9.064 -1.209 1.00 0.00 C ATOM 1650 C PHE A 105 8.000 10.181 -2.238 1.00 0.00 C ATOM 1651 O PHE A 105 7.554 11.282 -1.916 1.00 0.00 O ATOM 1652 CB PHE A 105 6.824 8.853 -0.473 1.00 0.00 C ATOM 1653 CG PHE A 105 6.690 7.487 0.138 1.00 0.00 C ATOM 1654 CD1 PHE A 105 6.767 6.350 -0.650 1.00 0.00 C ATOM 1655 CD2 PHE A 105 6.485 7.341 1.501 1.00 0.00 C ATOM 1656 CE1 PHE A 105 6.644 5.092 -0.090 1.00 0.00 C ATOM 1657 CE2 PHE A 105 6.362 6.086 2.066 1.00 0.00 C ATOM 1658 CZ PHE A 105 6.440 4.960 1.270 1.00 0.00 C ATOM 0 H PHE A 105 8.988 10.120 0.397 1.00 0.00 H new ATOM 0 HA PHE A 105 8.417 8.146 -1.731 1.00 0.00 H new ATOM 0 HB2 PHE A 105 6.729 9.604 0.311 1.00 0.00 H new ATOM 0 HB3 PHE A 105 6.001 9.013 -1.169 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.925 6.448 -1.714 1.00 0.00 H new ATOM 0 HD2 PHE A 105 6.421 8.218 2.128 1.00 0.00 H new ATOM 0 HE1 PHE A 105 6.707 4.213 -0.715 1.00 0.00 H new ATOM 0 HE2 PHE A 105 6.205 5.986 3.130 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.342 3.978 1.710 1.00 0.00 H new ATOM 1668 N VAL A 106 8.377 9.888 -3.479 1.00 0.00 N ATOM 1669 CA VAL A 106 8.284 10.865 -4.557 1.00 0.00 C ATOM 1670 C VAL A 106 7.382 10.364 -5.678 1.00 0.00 C ATOM 1671 O VAL A 106 7.131 9.165 -5.796 1.00 0.00 O ATOM 1672 CB VAL A 106 9.673 11.193 -5.138 1.00 0.00 C ATOM 1673 CG1 VAL A 106 10.711 11.272 -4.029 1.00 0.00 C ATOM 1674 CG2 VAL A 106 10.072 10.159 -6.180 1.00 0.00 C ATOM 0 H VAL A 106 8.750 8.982 -3.762 1.00 0.00 H new ATOM 0 HA VAL A 106 7.854 11.770 -4.127 1.00 0.00 H new ATOM 0 HB VAL A 106 9.623 12.166 -5.626 1.00 0.00 H new ATOM 0 HG11 VAL A 106 11.685 11.504 -4.459 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.430 12.053 -3.323 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.762 10.315 -3.510 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.055 10.406 -6.580 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.105 9.172 -5.719 1.00 0.00 H new ATOM 0 HG23 VAL A 106 9.341 10.157 -6.989 1.00 0.00 H new ATOM 1684 N GLN A 107 6.898 11.290 -6.500 1.00 0.00 N ATOM 1685 CA GLN A 107 6.022 10.940 -7.613 1.00 0.00 C ATOM 1686 C GLN A 107 6.592 9.769 -8.406 1.00 0.00 C ATOM 1687 O GLN A 107 7.480 9.944 -9.240 1.00 0.00 O ATOM 1688 CB GLN A 107 5.825 12.147 -8.532 1.00 0.00 C ATOM 1689 CG GLN A 107 4.474 12.167 -9.228 1.00 0.00 C ATOM 1690 CD GLN A 107 4.430 13.139 -10.390 1.00 0.00 C ATOM 1691 OE1 GLN A 107 5.447 13.725 -10.763 1.00 0.00 O ATOM 1692 NE2 GLN A 107 3.249 13.316 -10.971 1.00 0.00 N ATOM 0 H GLN A 107 7.097 12.287 -6.417 1.00 0.00 H new ATOM 0 HA GLN A 107 5.056 10.642 -7.204 1.00 0.00 H new ATOM 0 HB2 GLN A 107 5.937 13.060 -7.948 1.00 0.00 H new ATOM 0 HB3 GLN A 107 6.613 12.152 -9.285 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.241 11.165 -9.588 1.00 0.00 H new ATOM 0 HG3 GLN A 107 3.702 12.434 -8.506 1.00 0.00 H new ATOM 0 HE21 GLN A 107 2.432 12.810 -10.630 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.159 13.958 -11.759 1.00 0.00 H new ATOM 1701 N GLY A 108 6.074 8.573 -8.141 1.00 0.00 N ATOM 1702 CA GLY A 108 6.544 7.390 -8.839 1.00 0.00 C ATOM 1703 C GLY A 108 7.448 6.531 -7.978 1.00 0.00 C ATOM 1704 O GLY A 108 8.304 5.809 -8.491 1.00 0.00 O ATOM 0 H GLY A 108 5.338 8.402 -7.456 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.688 6.799 -9.164 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.082 7.692 -9.738 1.00 0.00 H new ATOM 1708 N LYS A 109 7.261 6.608 -6.665 1.00 0.00 N ATOM 1709 CA LYS A 109 8.067 5.832 -5.730 1.00 0.00 C ATOM 1710 C LYS A 109 7.231 4.742 -5.066 1.00 0.00 C ATOM 1711 O LYS A 109 6.002 4.814 -5.047 1.00 0.00 O ATOM 1712 CB LYS A 109 8.670 6.747 -4.662 1.00 0.00 C ATOM 1713 CG LYS A 109 10.011 6.266 -4.135 1.00 0.00 C ATOM 1714 CD LYS A 109 11.035 6.137 -5.251 1.00 0.00 C ATOM 1715 CE LYS A 109 12.456 6.184 -4.711 1.00 0.00 C ATOM 1716 NZ LYS A 109 13.465 5.980 -5.787 1.00 0.00 N ATOM 0 H LYS A 109 6.558 7.201 -6.224 1.00 0.00 H new ATOM 0 HA LYS A 109 8.873 5.358 -6.291 1.00 0.00 H new ATOM 0 HB2 LYS A 109 8.790 7.747 -5.078 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.971 6.830 -3.830 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.378 6.963 -3.382 1.00 0.00 H new ATOM 0 HG3 LYS A 109 9.885 5.302 -3.642 1.00 0.00 H new ATOM 0 HD2 LYS A 109 10.878 5.199 -5.784 1.00 0.00 H new ATOM 0 HD3 LYS A 109 10.892 6.941 -5.972 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.629 7.146 -4.228 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.580 5.417 -3.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.421 6.019 -5.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.316 5.052 -6.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.364 6.727 -6.504 1.00 0.00 H new ATOM 1730 N ASP A 110 7.905 3.734 -4.523 1.00 0.00 N ATOM 1731 CA ASP A 110 7.224 2.630 -3.856 1.00 0.00 C ATOM 1732 C ASP A 110 8.078 2.070 -2.723 1.00 0.00 C ATOM 1733 O ASP A 110 9.278 1.848 -2.889 1.00 0.00 O ATOM 1734 CB ASP A 110 6.896 1.524 -4.860 1.00 0.00 C ATOM 1735 CG ASP A 110 5.603 0.806 -4.529 1.00 0.00 C ATOM 1736 OD1 ASP A 110 4.891 1.262 -3.610 1.00 0.00 O ATOM 1737 OD2 ASP A 110 5.302 -0.211 -5.189 1.00 0.00 O ATOM 0 H ASP A 110 8.922 3.659 -4.532 1.00 0.00 H new ATOM 0 HA ASP A 110 6.295 3.011 -3.432 1.00 0.00 H new ATOM 0 HB2 ASP A 110 6.824 1.954 -5.859 1.00 0.00 H new ATOM 0 HB3 ASP A 110 7.713 0.803 -4.882 1.00 0.00 H new ATOM 1742 N TRP A 111 7.453 1.844 -1.574 1.00 0.00 N ATOM 1743 CA TRP A 111 8.157 1.310 -0.413 1.00 0.00 C ATOM 1744 C TRP A 111 7.250 0.392 0.399 1.00 0.00 C ATOM 1745 O TRP A 111 6.129 0.762 0.747 1.00 0.00 O ATOM 1746 CB TRP A 111 8.669 2.451 0.468 1.00 0.00 C ATOM 1747 CG TRP A 111 9.775 3.239 -0.165 1.00 0.00 C ATOM 1748 CD1 TRP A 111 9.647 4.363 -0.930 1.00 0.00 C ATOM 1749 CD2 TRP A 111 11.178 2.961 -0.089 1.00 0.00 C ATOM 1750 NE1 TRP A 111 10.886 4.801 -1.334 1.00 0.00 N ATOM 1751 CE2 TRP A 111 11.841 3.958 -0.830 1.00 0.00 C ATOM 1752 CE3 TRP A 111 11.938 1.968 0.535 1.00 0.00 C ATOM 1753 CZ2 TRP A 111 13.227 3.988 -0.964 1.00 0.00 C ATOM 1754 CZ3 TRP A 111 13.313 1.999 0.401 1.00 0.00 C ATOM 1755 CH2 TRP A 111 13.946 3.003 -0.343 1.00 0.00 C ATOM 0 H TRP A 111 6.460 2.022 -1.420 1.00 0.00 H new ATOM 0 HA TRP A 111 9.006 0.727 -0.770 1.00 0.00 H new ATOM 0 HB2 TRP A 111 7.841 3.121 0.699 1.00 0.00 H new ATOM 0 HB3 TRP A 111 9.021 2.040 1.414 1.00 0.00 H new ATOM 0 HD1 TRP A 111 8.710 4.838 -1.181 1.00 0.00 H new ATOM 0 HE1 TRP A 111 11.065 5.620 -1.915 1.00 0.00 H new ATOM 0 HE3 TRP A 111 11.459 1.190 1.112 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 13.717 4.761 -1.538 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 13.910 1.236 0.878 1.00 0.00 H new ATOM 0 HH2 TRP A 111 15.023 3.000 -0.428 1.00 0.00 H new ATOM 1766 N GLY A 112 7.742 -0.806 0.698 1.00 0.00 N ATOM 1767 CA GLY A 112 6.961 -1.758 1.467 1.00 0.00 C ATOM 1768 C GLY A 112 7.722 -3.038 1.749 1.00 0.00 C ATOM 1769 O GLY A 112 8.883 -3.002 2.159 1.00 0.00 O ATOM 0 H GLY A 112 8.667 -1.135 0.422 1.00 0.00 H new ATOM 0 HA2 GLY A 112 6.663 -1.301 2.410 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.046 -1.995 0.924 1.00 0.00 H new ATOM 1773 N PHE A 113 7.068 -4.174 1.531 1.00 0.00 N ATOM 1774 CA PHE A 113 7.689 -5.472 1.767 1.00 0.00 C ATOM 1775 C PHE A 113 7.445 -6.414 0.591 1.00 0.00 C ATOM 1776 O PHE A 113 6.424 -6.322 -0.091 1.00 0.00 O ATOM 1777 CB PHE A 113 7.146 -6.094 3.055 1.00 0.00 C ATOM 1778 CG PHE A 113 7.349 -5.233 4.269 1.00 0.00 C ATOM 1779 CD1 PHE A 113 6.428 -4.253 4.600 1.00 0.00 C ATOM 1780 CD2 PHE A 113 8.460 -5.404 5.078 1.00 0.00 C ATOM 1781 CE1 PHE A 113 6.612 -3.458 5.716 1.00 0.00 C ATOM 1782 CE2 PHE A 113 8.650 -4.613 6.195 1.00 0.00 C ATOM 1783 CZ PHE A 113 7.724 -3.639 6.515 1.00 0.00 C ATOM 0 H PHE A 113 6.108 -4.222 1.191 1.00 0.00 H new ATOM 0 HA PHE A 113 8.763 -5.320 1.870 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.081 -6.291 2.933 1.00 0.00 H new ATOM 0 HB3 PHE A 113 7.631 -7.056 3.217 1.00 0.00 H new ATOM 0 HD1 PHE A 113 5.556 -4.108 3.979 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.187 -6.165 4.833 1.00 0.00 H new ATOM 0 HE1 PHE A 113 5.887 -2.696 5.963 1.00 0.00 H new ATOM 0 HE2 PHE A 113 9.521 -4.756 6.817 1.00 0.00 H new ATOM 0 HZ PHE A 113 7.869 -3.020 7.388 1.00 0.00 H new ATOM 1793 N LYS A 114 8.390 -7.318 0.360 1.00 0.00 N ATOM 1794 CA LYS A 114 8.280 -8.279 -0.732 1.00 0.00 C ATOM 1795 C LYS A 114 7.352 -9.428 -0.354 1.00 0.00 C ATOM 1796 O LYS A 114 6.412 -9.747 -1.082 1.00 0.00 O ATOM 1797 CB LYS A 114 9.662 -8.824 -1.100 1.00 0.00 C ATOM 1798 CG LYS A 114 9.688 -9.571 -2.422 1.00 0.00 C ATOM 1799 CD LYS A 114 11.054 -9.488 -3.082 1.00 0.00 C ATOM 1800 CE LYS A 114 11.256 -10.611 -4.088 1.00 0.00 C ATOM 1801 NZ LYS A 114 12.630 -10.602 -4.661 1.00 0.00 N ATOM 0 H LYS A 114 9.242 -7.406 0.914 1.00 0.00 H new ATOM 0 HA LYS A 114 7.858 -7.764 -1.595 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.370 -7.996 -1.146 1.00 0.00 H new ATOM 0 HB3 LYS A 114 10.003 -9.491 -0.308 1.00 0.00 H new ATOM 0 HG2 LYS A 114 9.426 -10.616 -2.256 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.934 -9.156 -3.091 1.00 0.00 H new ATOM 0 HD2 LYS A 114 11.159 -8.526 -3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.831 -9.537 -2.319 1.00 0.00 H new ATOM 0 HE2 LYS A 114 11.071 -11.570 -3.604 1.00 0.00 H new ATOM 0 HE3 LYS A 114 10.527 -10.514 -4.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 12.727 -11.382 -5.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 12.798 -9.697 -5.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.326 -10.720 -3.897 1.00 0.00 H new ATOM 1815 N LYS A 115 7.620 -10.047 0.791 1.00 0.00 N ATOM 1816 CA LYS A 115 6.808 -11.160 1.269 1.00 0.00 C ATOM 1817 C LYS A 115 6.032 -10.768 2.522 1.00 0.00 C ATOM 1818 O LYS A 115 6.583 -10.740 3.622 1.00 0.00 O ATOM 1819 CB LYS A 115 7.692 -12.374 1.563 1.00 0.00 C ATOM 1820 CG LYS A 115 8.314 -12.988 0.320 1.00 0.00 C ATOM 1821 CD LYS A 115 9.656 -13.632 0.629 1.00 0.00 C ATOM 1822 CE LYS A 115 10.319 -14.168 -0.631 1.00 0.00 C ATOM 1823 NZ LYS A 115 11.744 -14.532 -0.395 1.00 0.00 N ATOM 0 H LYS A 115 8.394 -9.796 1.406 1.00 0.00 H new ATOM 0 HA LYS A 115 6.094 -11.419 0.487 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.486 -12.077 2.248 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.097 -13.131 2.074 1.00 0.00 H new ATOM 0 HG2 LYS A 115 7.638 -13.735 -0.095 1.00 0.00 H new ATOM 0 HG3 LYS A 115 8.445 -12.218 -0.441 1.00 0.00 H new ATOM 0 HD2 LYS A 115 10.311 -12.901 1.104 1.00 0.00 H new ATOM 0 HD3 LYS A 115 9.516 -14.445 1.342 1.00 0.00 H new ATOM 0 HE2 LYS A 115 9.774 -15.043 -0.984 1.00 0.00 H new ATOM 0 HE3 LYS A 115 10.261 -13.417 -1.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.335 -14.126 -1.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.050 -14.158 0.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 11.843 -15.567 -0.398 1.00 0.00 H new ATOM 1837 N PHE A 116 4.749 -10.469 2.348 1.00 0.00 N ATOM 1838 CA PHE A 116 3.896 -10.079 3.465 1.00 0.00 C ATOM 1839 C PHE A 116 3.405 -11.306 4.227 1.00 0.00 C ATOM 1840 O PHE A 116 3.536 -11.385 5.449 1.00 0.00 O ATOM 1841 CB PHE A 116 2.702 -9.265 2.963 1.00 0.00 C ATOM 1842 CG PHE A 116 1.842 -8.720 4.067 1.00 0.00 C ATOM 1843 CD1 PHE A 116 2.415 -8.140 5.188 1.00 0.00 C ATOM 1844 CD2 PHE A 116 0.461 -8.786 3.984 1.00 0.00 C ATOM 1845 CE1 PHE A 116 1.625 -7.639 6.206 1.00 0.00 C ATOM 1846 CE2 PHE A 116 -0.334 -8.286 4.999 1.00 0.00 C ATOM 1847 CZ PHE A 116 0.249 -7.711 6.110 1.00 0.00 C ATOM 0 H PHE A 116 4.277 -10.489 1.444 1.00 0.00 H new ATOM 0 HA PHE A 116 4.487 -9.463 4.143 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.067 -8.437 2.355 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.092 -9.893 2.314 1.00 0.00 H new ATOM 0 HD1 PHE A 116 3.490 -8.079 5.267 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -0.001 -9.233 3.116 1.00 0.00 H new ATOM 0 HE1 PHE A 116 2.083 -7.192 7.076 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.410 -8.345 4.922 1.00 0.00 H new ATOM 0 HZ PHE A 116 -0.370 -7.318 6.903 1.00 0.00 H new ATOM 1857 N ILE A 117 2.838 -12.261 3.497 1.00 0.00 N ATOM 1858 CA ILE A 117 2.327 -13.484 4.104 1.00 0.00 C ATOM 1859 C ILE A 117 1.958 -14.513 3.040 1.00 0.00 C ATOM 1860 O ILE A 117 1.553 -14.158 1.933 1.00 0.00 O ATOM 1861 CB ILE A 117 1.092 -13.204 4.981 1.00 0.00 C ATOM 1862 CG1 ILE A 117 0.512 -14.515 5.517 1.00 0.00 C ATOM 1863 CG2 ILE A 117 0.043 -12.439 4.190 1.00 0.00 C ATOM 1864 CD1 ILE A 117 -0.142 -14.377 6.873 1.00 0.00 C ATOM 0 H ILE A 117 2.721 -12.211 2.485 1.00 0.00 H new ATOM 0 HA ILE A 117 3.125 -13.882 4.731 1.00 0.00 H new ATOM 0 HB ILE A 117 1.398 -12.591 5.828 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -0.221 -14.896 4.806 1.00 0.00 H new ATOM 0 HG13 ILE A 117 1.309 -15.256 5.581 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -0.823 -12.249 4.824 1.00 0.00 H new ATOM 0 HG22 ILE A 117 0.461 -11.491 3.853 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -0.262 -13.028 3.325 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -0.530 -15.345 7.190 1.00 0.00 H new ATOM 0 HD12 ILE A 117 0.593 -14.026 7.597 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -0.961 -13.660 6.811 1.00 0.00 H new ATOM 1876 N ARG A 118 2.100 -15.788 3.385 1.00 0.00 N ATOM 1877 CA ARG A 118 1.781 -16.869 2.460 1.00 0.00 C ATOM 1878 C ARG A 118 0.331 -16.777 1.995 1.00 0.00 C ATOM 1879 O ARG A 118 -0.597 -16.976 2.779 1.00 0.00 O ATOM 1880 CB ARG A 118 2.030 -18.226 3.122 1.00 0.00 C ATOM 1881 CG ARG A 118 3.462 -18.716 2.987 1.00 0.00 C ATOM 1882 CD ARG A 118 3.564 -20.214 3.226 1.00 0.00 C ATOM 1883 NE ARG A 118 4.911 -20.616 3.620 1.00 0.00 N ATOM 1884 CZ ARG A 118 5.915 -20.762 2.762 1.00 0.00 C ATOM 1885 NH1 ARG A 118 5.724 -20.540 1.469 1.00 0.00 N ATOM 1886 NH2 ARG A 118 7.113 -21.130 3.197 1.00 0.00 N ATOM 0 H ARG A 118 2.434 -16.098 4.298 1.00 0.00 H new ATOM 0 HA ARG A 118 2.430 -16.772 1.590 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.777 -18.156 4.180 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.359 -18.964 2.682 1.00 0.00 H new ATOM 0 HG2 ARG A 118 3.836 -18.479 1.991 1.00 0.00 H new ATOM 0 HG3 ARG A 118 4.097 -18.189 3.699 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.857 -20.506 4.003 1.00 0.00 H new ATOM 0 HD3 ARG A 118 3.278 -20.746 2.319 1.00 0.00 H new ATOM 0 HE ARG A 118 5.091 -20.795 4.608 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.805 -20.256 1.131 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.497 -20.653 0.813 1.00 0.00 H new ATOM 0 HH21 ARG A 118 7.264 -21.301 4.191 1.00 0.00 H new ATOM 0 HH22 ARG A 118 7.883 -21.242 2.537 1.00 0.00 H new ATOM 1900 N ARG A 119 0.144 -16.473 0.715 1.00 0.00 N ATOM 1901 CA ARG A 119 -1.193 -16.352 0.146 1.00 0.00 C ATOM 1902 C ARG A 119 -2.058 -17.549 0.531 1.00 0.00 C ATOM 1903 O ARG A 119 -3.246 -17.401 0.819 1.00 0.00 O ATOM 1904 CB ARG A 119 -1.114 -16.237 -1.378 1.00 0.00 C ATOM 1905 CG ARG A 119 -2.271 -15.465 -1.991 1.00 0.00 C ATOM 1906 CD ARG A 119 -2.120 -15.341 -3.499 1.00 0.00 C ATOM 1907 NE ARG A 119 -3.413 -15.269 -4.175 1.00 0.00 N ATOM 1908 CZ ARG A 119 -4.237 -16.304 -4.297 1.00 0.00 C ATOM 1909 NH1 ARG A 119 -3.904 -17.484 -3.792 1.00 0.00 N ATOM 1910 NH2 ARG A 119 -5.397 -16.160 -4.925 1.00 0.00 N ATOM 0 H ARG A 119 0.901 -16.306 0.052 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.651 -15.449 0.549 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.178 -15.748 -1.649 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -1.087 -17.238 -1.809 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -3.210 -15.968 -1.758 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.323 -14.471 -1.546 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -1.539 -14.449 -3.733 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -1.560 -16.195 -3.879 1.00 0.00 H new ATOM 0 HE ARG A 119 -3.699 -14.375 -4.575 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -3.013 -17.599 -3.308 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -4.539 -18.277 -3.887 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -5.657 -15.254 -5.315 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -6.029 -16.955 -5.018 1.00 0.00 H new ATOM 1924 N ASP A 120 -1.455 -18.732 0.534 1.00 0.00 N ATOM 1925 CA ASP A 120 -2.169 -19.954 0.884 1.00 0.00 C ATOM 1926 C ASP A 120 -2.759 -19.855 2.288 1.00 0.00 C ATOM 1927 O ASP A 120 -3.804 -20.438 2.576 1.00 0.00 O ATOM 1928 CB ASP A 120 -1.234 -21.161 0.794 1.00 0.00 C ATOM 1929 CG ASP A 120 -1.915 -22.452 1.202 1.00 0.00 C ATOM 1930 OD1 ASP A 120 -2.943 -22.802 0.585 1.00 0.00 O ATOM 1931 OD2 ASP A 120 -1.418 -23.114 2.137 1.00 0.00 O ATOM 0 H ASP A 120 -0.473 -18.871 0.298 1.00 0.00 H new ATOM 0 HA ASP A 120 -2.986 -20.084 0.174 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.865 -21.255 -0.227 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -0.367 -20.994 1.433 1.00 0.00 H new ATOM 1936 N PHE A 121 -2.080 -19.115 3.158 1.00 0.00 N ATOM 1937 CA PHE A 121 -2.535 -18.942 4.533 1.00 0.00 C ATOM 1938 C PHE A 121 -3.789 -18.074 4.585 1.00 0.00 C ATOM 1939 O PHE A 121 -4.650 -18.259 5.446 1.00 0.00 O ATOM 1940 CB PHE A 121 -1.429 -18.312 5.383 1.00 0.00 C ATOM 1941 CG PHE A 121 -1.809 -18.135 6.825 1.00 0.00 C ATOM 1942 CD1 PHE A 121 -2.439 -16.977 7.252 1.00 0.00 C ATOM 1943 CD2 PHE A 121 -1.538 -19.127 7.754 1.00 0.00 C ATOM 1944 CE1 PHE A 121 -2.789 -16.811 8.579 1.00 0.00 C ATOM 1945 CE2 PHE A 121 -1.886 -18.967 9.082 1.00 0.00 C ATOM 1946 CZ PHE A 121 -2.513 -17.807 9.494 1.00 0.00 C ATOM 0 H PHE A 121 -1.213 -18.626 2.936 1.00 0.00 H new ATOM 0 HA PHE A 121 -2.778 -19.925 4.936 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -0.537 -18.936 5.325 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -1.167 -17.341 4.963 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -2.659 -16.195 6.540 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -1.049 -20.036 7.436 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -3.278 -15.903 8.900 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -1.668 -19.747 9.796 1.00 0.00 H new ATOM 0 HZ PHE A 121 -2.787 -17.680 10.531 1.00 0.00 H new ATOM 1956 N LEU A 122 -3.884 -17.126 3.660 1.00 0.00 N ATOM 1957 CA LEU A 122 -5.032 -16.227 3.599 1.00 0.00 C ATOM 1958 C LEU A 122 -6.296 -16.985 3.206 1.00 0.00 C ATOM 1959 O LEU A 122 -7.284 -16.990 3.942 1.00 0.00 O ATOM 1960 CB LEU A 122 -4.769 -15.098 2.601 1.00 0.00 C ATOM 1961 CG LEU A 122 -3.358 -14.509 2.611 1.00 0.00 C ATOM 1962 CD1 LEU A 122 -3.228 -13.420 1.557 1.00 0.00 C ATOM 1963 CD2 LEU A 122 -3.018 -13.963 3.990 1.00 0.00 C ATOM 0 H LEU A 122 -3.180 -16.959 2.941 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.180 -15.799 4.590 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.979 -15.470 1.598 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.478 -14.294 2.797 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.651 -15.303 2.373 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.217 -13.012 1.578 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.429 -13.841 0.572 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.945 -12.625 1.765 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.010 -13.548 3.979 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.729 -13.182 4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.070 -14.768 4.723 1.00 0.00 H new ATOM 1975 N LEU A 123 -6.258 -17.626 2.044 1.00 0.00 N ATOM 1976 CA LEU A 123 -7.400 -18.390 1.553 1.00 0.00 C ATOM 1977 C LEU A 123 -7.760 -19.513 2.521 1.00 0.00 C ATOM 1978 O LEU A 123 -8.933 -19.729 2.827 1.00 0.00 O ATOM 1979 CB LEU A 123 -7.094 -18.971 0.171 1.00 0.00 C ATOM 1980 CG LEU A 123 -7.086 -17.975 -0.989 1.00 0.00 C ATOM 1981 CD1 LEU A 123 -6.153 -16.813 -0.687 1.00 0.00 C ATOM 1982 CD2 LEU A 123 -6.680 -18.666 -2.282 1.00 0.00 C ATOM 0 H LEU A 123 -5.449 -17.632 1.423 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.252 -17.714 1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -6.120 -19.459 0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.830 -19.745 -0.046 1.00 0.00 H new ATOM 0 HG LEU A 123 -8.095 -17.581 -1.113 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.160 -16.114 -1.523 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -6.488 -16.302 0.216 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.141 -17.189 -0.536 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.680 -17.942 -3.097 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.681 -19.088 -2.171 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.388 -19.464 -2.506 1.00 0.00 H new ATOM 1994 N ASP A 124 -6.744 -20.222 3.001 1.00 0.00 N ATOM 1995 CA ASP A 124 -6.953 -21.320 3.937 1.00 0.00 C ATOM 1996 C ASP A 124 -8.101 -21.008 4.893 1.00 0.00 C ATOM 1997 O ASP A 124 -8.374 -19.846 5.191 1.00 0.00 O ATOM 1998 CB ASP A 124 -5.674 -21.594 4.729 1.00 0.00 C ATOM 1999 CG ASP A 124 -4.779 -22.611 4.049 1.00 0.00 C ATOM 2000 OD1 ASP A 124 -4.835 -22.713 2.805 1.00 0.00 O ATOM 2001 OD2 ASP A 124 -4.023 -23.306 4.760 1.00 0.00 O ATOM 0 H ASP A 124 -5.768 -20.056 2.757 1.00 0.00 H new ATOM 0 HA ASP A 124 -7.213 -22.209 3.363 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.125 -20.662 4.861 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.936 -21.953 5.724 1.00 0.00 H new ATOM 2006 N GLU A 125 -8.769 -22.055 5.369 1.00 0.00 N ATOM 2007 CA GLU A 125 -9.888 -21.891 6.289 1.00 0.00 C ATOM 2008 C GLU A 125 -9.411 -21.933 7.738 1.00 0.00 C ATOM 2009 O GLU A 125 -9.949 -21.237 8.599 1.00 0.00 O ATOM 2010 CB GLU A 125 -10.934 -22.983 6.053 1.00 0.00 C ATOM 2011 CG GLU A 125 -10.424 -24.386 6.333 1.00 0.00 C ATOM 2012 CD GLU A 125 -11.172 -25.447 5.549 1.00 0.00 C ATOM 2013 OE1 GLU A 125 -12.392 -25.278 5.340 1.00 0.00 O ATOM 2014 OE2 GLU A 125 -10.539 -26.444 5.146 1.00 0.00 O ATOM 0 H GLU A 125 -8.555 -23.024 5.133 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.341 -20.917 6.102 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -11.800 -22.787 6.686 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.276 -22.929 5.019 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -9.363 -24.439 6.087 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.515 -24.596 7.399 1.00 0.00 H new ATOM 2021 N ALA A 126 -8.399 -22.754 7.998 1.00 0.00 N ATOM 2022 CA ALA A 126 -7.849 -22.885 9.342 1.00 0.00 C ATOM 2023 C ALA A 126 -7.798 -21.535 10.049 1.00 0.00 C ATOM 2024 O ALA A 126 -8.172 -21.421 11.216 1.00 0.00 O ATOM 2025 CB ALA A 126 -6.460 -23.506 9.285 1.00 0.00 C ATOM 0 H ALA A 126 -7.944 -23.338 7.297 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.506 -23.540 9.914 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.061 -23.598 10.295 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.521 -24.494 8.828 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -5.802 -22.872 8.691 1.00 0.00 H new ATOM 2031 N ASN A 127 -7.333 -20.515 9.335 1.00 0.00 N ATOM 2032 CA ASN A 127 -7.233 -19.173 9.896 1.00 0.00 C ATOM 2033 C ASN A 127 -8.548 -18.417 9.736 1.00 0.00 C ATOM 2034 O ASN A 127 -8.998 -17.731 10.653 1.00 0.00 O ATOM 2035 CB ASN A 127 -6.101 -18.398 9.218 1.00 0.00 C ATOM 2036 CG ASN A 127 -4.858 -19.244 9.021 1.00 0.00 C ATOM 2037 OD1 ASN A 127 -4.256 -19.718 9.986 1.00 0.00 O ATOM 2038 ND2 ASN A 127 -4.467 -19.438 7.767 1.00 0.00 N ATOM 0 H ASN A 127 -7.020 -20.592 8.367 1.00 0.00 H new ATOM 0 HA ASN A 127 -7.015 -19.266 10.960 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -6.444 -18.031 8.251 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.851 -17.524 9.820 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.638 -19.999 7.572 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -4.996 -19.026 6.998 1.00 0.00 H new ATOM 2045 N GLY A 128 -9.161 -18.548 8.563 1.00 0.00 N ATOM 2046 CA GLY A 128 -10.419 -17.872 8.304 1.00 0.00 C ATOM 2047 C GLY A 128 -10.239 -16.389 8.051 1.00 0.00 C ATOM 2048 O GLY A 128 -11.097 -15.581 8.411 1.00 0.00 O ATOM 0 H GLY A 128 -8.809 -19.110 7.788 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.902 -18.329 7.440 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.086 -18.014 9.154 1.00 0.00 H new ATOM 2052 N LEU A 129 -9.121 -16.027 7.432 1.00 0.00 N ATOM 2053 CA LEU A 129 -8.829 -14.630 7.132 1.00 0.00 C ATOM 2054 C LEU A 129 -9.765 -14.099 6.050 1.00 0.00 C ATOM 2055 O LEU A 129 -9.970 -12.890 5.931 1.00 0.00 O ATOM 2056 CB LEU A 129 -7.375 -14.476 6.684 1.00 0.00 C ATOM 2057 CG LEU A 129 -6.315 -14.992 7.659 1.00 0.00 C ATOM 2058 CD1 LEU A 129 -4.945 -15.009 6.998 1.00 0.00 C ATOM 2059 CD2 LEU A 129 -6.290 -14.139 8.919 1.00 0.00 C ATOM 0 H LEU A 129 -8.401 -16.682 7.128 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.986 -14.049 8.041 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.251 -14.997 5.734 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.183 -13.420 6.496 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.573 -16.013 7.940 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.204 -15.379 7.706 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.970 -15.662 6.125 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.678 -13.999 6.688 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.530 -14.520 9.601 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.056 -13.107 8.655 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.265 -14.177 9.404 1.00 0.00 H new ATOM 2071 N LEU A 130 -10.331 -15.009 5.266 1.00 0.00 N ATOM 2072 CA LEU A 130 -11.247 -14.633 4.195 1.00 0.00 C ATOM 2073 C LEU A 130 -12.527 -15.460 4.258 1.00 0.00 C ATOM 2074 O LEU A 130 -12.706 -16.429 3.521 1.00 0.00 O ATOM 2075 CB LEU A 130 -10.574 -14.816 2.833 1.00 0.00 C ATOM 2076 CG LEU A 130 -9.079 -14.503 2.776 1.00 0.00 C ATOM 2077 CD1 LEU A 130 -8.466 -15.059 1.500 1.00 0.00 C ATOM 2078 CD2 LEU A 130 -8.844 -13.003 2.873 1.00 0.00 C ATOM 0 H LEU A 130 -10.172 -16.013 5.352 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.508 -13.583 4.326 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.721 -15.848 2.513 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -11.086 -14.182 2.109 1.00 0.00 H new ATOM 0 HG LEU A 130 -8.594 -14.982 3.627 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -7.401 -14.827 1.477 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -8.602 -16.140 1.472 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -8.955 -14.609 0.636 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -7.774 -12.799 2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -9.342 -12.502 2.043 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.247 -12.632 3.815 1.00 0.00 H new ATOM 2090 N PRO A 131 -13.441 -15.068 5.158 1.00 0.00 N ATOM 2091 CA PRO A 131 -14.722 -15.757 5.337 1.00 0.00 C ATOM 2092 C PRO A 131 -15.660 -15.556 4.151 1.00 0.00 C ATOM 2093 O PRO A 131 -16.533 -16.383 3.891 1.00 0.00 O ATOM 2094 CB PRO A 131 -15.303 -15.107 6.595 1.00 0.00 C ATOM 2095 CG PRO A 131 -14.673 -13.758 6.648 1.00 0.00 C ATOM 2096 CD PRO A 131 -13.295 -13.921 6.070 1.00 0.00 C ATOM 0 HA PRO A 131 -14.595 -16.837 5.419 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -16.389 -15.035 6.538 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -15.068 -15.689 7.486 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -15.253 -13.034 6.076 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -14.625 -13.390 7.673 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -12.973 -13.025 5.540 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -12.554 -14.116 6.846 1.00 0.00 H new ATOM 2104 N ASP A 132 -15.473 -14.452 3.436 1.00 0.00 N ATOM 2105 CA ASP A 132 -16.301 -14.143 2.277 1.00 0.00 C ATOM 2106 C ASP A 132 -15.449 -14.016 1.018 1.00 0.00 C ATOM 2107 O ASP A 132 -15.816 -13.315 0.075 1.00 0.00 O ATOM 2108 CB ASP A 132 -17.081 -12.848 2.511 1.00 0.00 C ATOM 2109 CG ASP A 132 -18.435 -13.095 3.148 1.00 0.00 C ATOM 2110 OD1 ASP A 132 -18.500 -13.172 4.393 1.00 0.00 O ATOM 2111 OD2 ASP A 132 -19.429 -13.209 2.401 1.00 0.00 O ATOM 0 H ASP A 132 -14.755 -13.756 3.639 1.00 0.00 H new ATOM 0 HA ASP A 132 -17.005 -14.963 2.137 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -16.497 -12.186 3.151 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -17.218 -12.333 1.560 1.00 0.00 H new ATOM 2116 N ASP A 133 -14.309 -14.699 1.011 1.00 0.00 N ATOM 2117 CA ASP A 133 -13.404 -14.663 -0.132 1.00 0.00 C ATOM 2118 C ASP A 133 -12.921 -13.241 -0.399 1.00 0.00 C ATOM 2119 O ASP A 133 -12.659 -12.867 -1.542 1.00 0.00 O ATOM 2120 CB ASP A 133 -14.096 -15.222 -1.376 1.00 0.00 C ATOM 2121 CG ASP A 133 -14.783 -16.547 -1.110 1.00 0.00 C ATOM 2122 OD1 ASP A 133 -14.074 -17.535 -0.826 1.00 0.00 O ATOM 2123 OD2 ASP A 133 -16.028 -16.597 -1.188 1.00 0.00 O ATOM 0 H ASP A 133 -13.990 -15.284 1.783 1.00 0.00 H new ATOM 0 HA ASP A 133 -12.539 -15.283 0.102 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.830 -14.501 -1.735 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -13.361 -15.350 -2.170 1.00 0.00 H new ATOM 2128 N LYS A 134 -12.807 -12.451 0.664 1.00 0.00 N ATOM 2129 CA LYS A 134 -12.356 -11.070 0.546 1.00 0.00 C ATOM 2130 C LYS A 134 -11.212 -10.786 1.514 1.00 0.00 C ATOM 2131 O LYS A 134 -11.305 -11.084 2.706 1.00 0.00 O ATOM 2132 CB LYS A 134 -13.515 -10.108 0.814 1.00 0.00 C ATOM 2133 CG LYS A 134 -14.478 -10.599 1.882 1.00 0.00 C ATOM 2134 CD LYS A 134 -15.241 -9.449 2.516 1.00 0.00 C ATOM 2135 CE LYS A 134 -16.424 -9.025 1.660 1.00 0.00 C ATOM 2136 NZ LYS A 134 -17.066 -7.784 2.175 1.00 0.00 N ATOM 0 H LYS A 134 -13.021 -12.744 1.617 1.00 0.00 H new ATOM 0 HA LYS A 134 -11.994 -10.919 -0.471 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.112 -9.142 1.117 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -14.065 -9.947 -0.113 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -15.182 -11.305 1.441 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -13.925 -11.138 2.651 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -15.593 -9.746 3.504 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -14.571 -8.601 2.658 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -16.091 -8.863 0.635 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -17.159 -9.829 1.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -17.868 -7.529 1.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -17.407 -7.946 3.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -16.372 -7.009 2.177 1.00 0.00 H new ATOM 2150 N LEU A 135 -10.134 -10.208 0.996 1.00 0.00 N ATOM 2151 CA LEU A 135 -8.972 -9.883 1.816 1.00 0.00 C ATOM 2152 C LEU A 135 -9.020 -8.430 2.277 1.00 0.00 C ATOM 2153 O LEU A 135 -8.769 -7.510 1.497 1.00 0.00 O ATOM 2154 CB LEU A 135 -7.683 -10.139 1.033 1.00 0.00 C ATOM 2155 CG LEU A 135 -6.404 -9.556 1.636 1.00 0.00 C ATOM 2156 CD1 LEU A 135 -6.120 -10.181 2.993 1.00 0.00 C ATOM 2157 CD2 LEU A 135 -5.227 -9.764 0.694 1.00 0.00 C ATOM 0 H LEU A 135 -10.040 -9.955 0.012 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.989 -10.525 2.697 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -7.553 -11.216 0.928 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -7.805 -9.733 0.029 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.547 -8.484 1.776 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.206 -9.754 3.406 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -6.952 -9.980 3.668 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.998 -11.258 2.879 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.326 -9.343 1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.083 -10.831 0.522 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.429 -9.268 -0.255 1.00 0.00 H new ATOM 2169 N THR A 136 -9.342 -8.229 3.551 1.00 0.00 N ATOM 2170 CA THR A 136 -9.423 -6.888 4.117 1.00 0.00 C ATOM 2171 C THR A 136 -8.043 -6.375 4.513 1.00 0.00 C ATOM 2172 O THR A 136 -7.523 -6.718 5.575 1.00 0.00 O ATOM 2173 CB THR A 136 -10.344 -6.853 5.351 1.00 0.00 C ATOM 2174 OG1 THR A 136 -11.649 -7.327 5.001 1.00 0.00 O ATOM 2175 CG2 THR A 136 -10.445 -5.443 5.911 1.00 0.00 C ATOM 0 H THR A 136 -9.551 -8.978 4.211 1.00 0.00 H new ATOM 0 HA THR A 136 -9.840 -6.243 3.343 1.00 0.00 H new ATOM 0 HB THR A 136 -9.915 -7.501 6.116 1.00 0.00 H new ATOM 0 HG1 THR A 136 -12.228 -7.303 5.791 1.00 0.00 H new ATOM 0 HG21 THR A 136 -11.101 -5.443 6.782 1.00 0.00 H new ATOM 0 HG22 THR A 136 -9.454 -5.096 6.203 1.00 0.00 H new ATOM 0 HG23 THR A 136 -10.853 -4.778 5.150 1.00 0.00 H new ATOM 2183 N LEU A 137 -7.454 -5.551 3.653 1.00 0.00 N ATOM 2184 CA LEU A 137 -6.134 -4.989 3.913 1.00 0.00 C ATOM 2185 C LEU A 137 -6.245 -3.638 4.612 1.00 0.00 C ATOM 2186 O LEU A 137 -6.777 -2.679 4.052 1.00 0.00 O ATOM 2187 CB LEU A 137 -5.355 -4.837 2.605 1.00 0.00 C ATOM 2188 CG LEU A 137 -4.505 -6.037 2.187 1.00 0.00 C ATOM 2189 CD1 LEU A 137 -4.053 -5.892 0.742 1.00 0.00 C ATOM 2190 CD2 LEU A 137 -3.306 -6.189 3.111 1.00 0.00 C ATOM 0 H LEU A 137 -7.870 -5.257 2.769 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.598 -5.674 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -6.065 -4.624 1.806 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.703 -3.968 2.693 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.115 -6.937 2.267 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.449 -6.755 0.461 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -4.926 -5.833 0.092 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.460 -4.984 0.636 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -2.712 -7.048 2.798 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -2.694 -5.288 3.064 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -3.652 -6.340 4.134 1.00 0.00 H new ATOM 2202 N PHE A 138 -5.738 -3.568 5.839 1.00 0.00 N ATOM 2203 CA PHE A 138 -5.780 -2.334 6.614 1.00 0.00 C ATOM 2204 C PHE A 138 -4.401 -1.683 6.675 1.00 0.00 C ATOM 2205 O PHE A 138 -3.528 -2.123 7.425 1.00 0.00 O ATOM 2206 CB PHE A 138 -6.287 -2.613 8.030 1.00 0.00 C ATOM 2207 CG PHE A 138 -6.777 -1.385 8.744 1.00 0.00 C ATOM 2208 CD1 PHE A 138 -5.893 -0.385 9.116 1.00 0.00 C ATOM 2209 CD2 PHE A 138 -8.121 -1.232 9.044 1.00 0.00 C ATOM 2210 CE1 PHE A 138 -6.340 0.746 9.773 1.00 0.00 C ATOM 2211 CE2 PHE A 138 -8.574 -0.103 9.700 1.00 0.00 C ATOM 2212 CZ PHE A 138 -7.682 0.886 10.066 1.00 0.00 C ATOM 0 H PHE A 138 -5.293 -4.352 6.317 1.00 0.00 H new ATOM 0 HA PHE A 138 -6.466 -1.647 6.119 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -7.096 -3.342 7.981 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -5.485 -3.066 8.612 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -4.842 -0.490 8.890 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -8.822 -2.003 8.762 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -5.641 1.519 10.057 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -9.624 0.006 9.926 1.00 0.00 H new ATOM 0 HZ PHE A 138 -8.034 1.768 10.581 1.00 0.00 H new ATOM 2222 N CYS A 139 -4.212 -0.635 5.881 1.00 0.00 N ATOM 2223 CA CYS A 139 -2.939 0.076 5.843 1.00 0.00 C ATOM 2224 C CYS A 139 -3.041 1.413 6.569 1.00 0.00 C ATOM 2225 O CYS A 139 -4.124 1.986 6.685 1.00 0.00 O ATOM 2226 CB CYS A 139 -2.500 0.301 4.395 1.00 0.00 C ATOM 2227 SG CYS A 139 -0.828 0.967 4.226 1.00 0.00 S ATOM 0 H CYS A 139 -4.924 -0.259 5.255 1.00 0.00 H new ATOM 0 HA CYS A 139 -2.194 -0.537 6.350 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -2.559 -0.645 3.858 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.202 0.984 3.916 1.00 0.00 H new ATOM 0 HG CYS A 139 -0.002 0.002 3.950 1.00 0.00 H new ATOM 2233 N GLU A 140 -1.906 1.904 7.058 1.00 0.00 N ATOM 2234 CA GLU A 140 -1.870 3.173 7.775 1.00 0.00 C ATOM 2235 C GLU A 140 -0.626 3.973 7.402 1.00 0.00 C ATOM 2236 O GLU A 140 0.502 3.525 7.612 1.00 0.00 O ATOM 2237 CB GLU A 140 -1.899 2.931 9.286 1.00 0.00 C ATOM 2238 CG GLU A 140 -3.179 2.272 9.772 1.00 0.00 C ATOM 2239 CD GLU A 140 -3.539 2.673 11.190 1.00 0.00 C ATOM 2240 OE1 GLU A 140 -3.432 3.874 11.513 1.00 0.00 O ATOM 2241 OE2 GLU A 140 -3.928 1.784 11.976 1.00 0.00 O ATOM 0 H GLU A 140 -1.001 1.443 6.971 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.751 3.748 7.489 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -1.051 2.305 9.562 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.773 3.884 9.801 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.997 2.540 9.104 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.067 1.189 9.722 1.00 0.00 H new ATOM 2248 N VAL A 141 -0.839 5.161 6.844 1.00 0.00 N ATOM 2249 CA VAL A 141 0.264 6.025 6.441 1.00 0.00 C ATOM 2250 C VAL A 141 0.368 7.244 7.350 1.00 0.00 C ATOM 2251 O VAL A 141 -0.643 7.838 7.728 1.00 0.00 O ATOM 2252 CB VAL A 141 0.102 6.498 4.984 1.00 0.00 C ATOM 2253 CG1 VAL A 141 1.294 7.345 4.562 1.00 0.00 C ATOM 2254 CG2 VAL A 141 -0.072 5.307 4.054 1.00 0.00 C ATOM 0 H VAL A 141 -1.765 5.547 6.661 1.00 0.00 H new ATOM 0 HA VAL A 141 1.176 5.434 6.525 1.00 0.00 H new ATOM 0 HB VAL A 141 -0.794 7.116 4.918 1.00 0.00 H new ATOM 0 HG11 VAL A 141 1.162 7.670 3.530 1.00 0.00 H new ATOM 0 HG12 VAL A 141 1.368 8.218 5.211 1.00 0.00 H new ATOM 0 HG13 VAL A 141 2.207 6.755 4.643 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -0.185 5.659 3.029 1.00 0.00 H new ATOM 0 HG22 VAL A 141 0.804 4.662 4.121 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -0.960 4.745 4.345 1.00 0.00 H new ATOM 2264 N SER A 142 1.596 7.613 7.699 1.00 0.00 N ATOM 2265 CA SER A 142 1.833 8.760 8.568 1.00 0.00 C ATOM 2266 C SER A 142 2.728 9.787 7.880 1.00 0.00 C ATOM 2267 O SER A 142 3.891 9.513 7.583 1.00 0.00 O ATOM 2268 CB SER A 142 2.471 8.308 9.882 1.00 0.00 C ATOM 2269 OG SER A 142 3.885 8.292 9.783 1.00 0.00 O ATOM 0 H SER A 142 2.443 7.134 7.393 1.00 0.00 H new ATOM 0 HA SER A 142 0.872 9.227 8.782 1.00 0.00 H new ATOM 0 HB2 SER A 142 2.167 8.977 10.687 1.00 0.00 H new ATOM 0 HB3 SER A 142 2.110 7.313 10.142 1.00 0.00 H new ATOM 0 HG SER A 142 4.148 8.369 8.842 1.00 0.00 H new ATOM 2275 N VAL A 143 2.178 10.970 7.631 1.00 0.00 N ATOM 2276 CA VAL A 143 2.926 12.039 6.980 1.00 0.00 C ATOM 2277 C VAL A 143 3.587 12.952 8.006 1.00 0.00 C ATOM 2278 O VAL A 143 2.910 13.580 8.821 1.00 0.00 O ATOM 2279 CB VAL A 143 2.017 12.885 6.067 1.00 0.00 C ATOM 2280 CG1 VAL A 143 2.812 14.003 5.410 1.00 0.00 C ATOM 2281 CG2 VAL A 143 1.350 12.007 5.019 1.00 0.00 C ATOM 0 H VAL A 143 1.217 11.213 7.870 1.00 0.00 H new ATOM 0 HA VAL A 143 3.696 11.562 6.373 1.00 0.00 H new ATOM 0 HB VAL A 143 1.237 13.338 6.679 1.00 0.00 H new ATOM 0 HG11 VAL A 143 2.154 14.590 4.769 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.238 14.647 6.179 1.00 0.00 H new ATOM 0 HG13 VAL A 143 3.615 13.575 4.810 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.712 12.621 4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 143 2.114 11.524 4.409 1.00 0.00 H new ATOM 0 HG23 VAL A 143 0.746 11.246 5.513 1.00 0.00 H new ATOM 2291 N VAL A 144 4.913 13.021 7.962 1.00 0.00 N ATOM 2292 CA VAL A 144 5.667 13.858 8.887 1.00 0.00 C ATOM 2293 C VAL A 144 5.371 15.336 8.658 1.00 0.00 C ATOM 2294 O VAL A 144 5.642 15.873 7.584 1.00 0.00 O ATOM 2295 CB VAL A 144 7.183 13.623 8.750 1.00 0.00 C ATOM 2296 CG1 VAL A 144 7.542 12.203 9.162 1.00 0.00 C ATOM 2297 CG2 VAL A 144 7.639 13.905 7.326 1.00 0.00 C ATOM 0 H VAL A 144 5.488 12.507 7.295 1.00 0.00 H new ATOM 0 HA VAL A 144 5.353 13.579 9.893 1.00 0.00 H new ATOM 0 HB VAL A 144 7.702 14.312 9.417 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.617 12.055 9.059 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.251 12.041 10.200 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.015 11.494 8.523 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.713 13.734 7.247 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.114 13.242 6.638 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.417 14.941 7.071 1.00 0.00 H new ATOM 2307 N GLN A 145 4.812 15.986 9.673 1.00 0.00 N ATOM 2308 CA GLN A 145 4.478 17.403 9.581 1.00 0.00 C ATOM 2309 C GLN A 145 5.021 18.169 10.783 1.00 0.00 C ATOM 2310 O GLN A 145 4.362 18.269 11.817 1.00 0.00 O ATOM 2311 CB GLN A 145 2.963 17.586 9.487 1.00 0.00 C ATOM 2312 CG GLN A 145 2.424 17.479 8.069 1.00 0.00 C ATOM 2313 CD GLN A 145 0.914 17.599 8.008 1.00 0.00 C ATOM 2314 OE1 GLN A 145 0.263 16.595 7.431 1.00 0.00 O flip ATOM 2315 NE2 GLN A 145 0.338 18.583 8.474 1.00 0.00 N flip ATOM 0 H GLN A 145 4.581 15.555 10.568 1.00 0.00 H new ATOM 0 HA GLN A 145 4.942 17.802 8.679 1.00 0.00 H new ATOM 0 HB2 GLN A 145 2.475 16.836 10.110 1.00 0.00 H new ATOM 0 HB3 GLN A 145 2.697 18.561 9.895 1.00 0.00 H new ATOM 0 HG2 GLN A 145 2.872 18.260 7.454 1.00 0.00 H new ATOM 0 HG3 GLN A 145 2.726 16.523 7.641 1.00 0.00 H new ATOM 0 HE21 GLN A 145 0.878 19.331 8.909 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -0.679 18.649 8.425 1.00 0.00 H new ATOM 2324 N ASP A 146 6.227 18.708 10.639 1.00 0.00 N ATOM 2325 CA ASP A 146 6.859 19.466 11.713 1.00 0.00 C ATOM 2326 C ASP A 146 6.448 20.934 11.656 1.00 0.00 C ATOM 2327 O ASP A 146 5.748 21.428 12.540 1.00 0.00 O ATOM 2328 CB ASP A 146 8.381 19.346 11.623 1.00 0.00 C ATOM 2329 CG ASP A 146 8.902 18.085 12.285 1.00 0.00 C ATOM 2330 OD1 ASP A 146 8.512 17.817 13.440 1.00 0.00 O ATOM 2331 OD2 ASP A 146 9.700 17.367 11.647 1.00 0.00 O ATOM 0 H ASP A 146 6.786 18.634 9.789 1.00 0.00 H new ATOM 0 HA ASP A 146 6.525 19.050 12.664 1.00 0.00 H new ATOM 0 HB2 ASP A 146 8.682 19.354 10.575 1.00 0.00 H new ATOM 0 HB3 ASP A 146 8.840 20.216 12.093 1.00 0.00 H new ATOM 2336 N SER A 147 6.888 21.627 10.610 1.00 0.00 N ATOM 2337 CA SER A 147 6.571 23.040 10.441 1.00 0.00 C ATOM 2338 C SER A 147 5.931 23.293 9.079 1.00 0.00 C ATOM 2339 O SER A 147 6.297 24.234 8.374 1.00 0.00 O ATOM 2340 CB SER A 147 7.834 23.890 10.590 1.00 0.00 C ATOM 2341 OG SER A 147 7.514 25.268 10.672 1.00 0.00 O ATOM 0 H SER A 147 7.465 21.233 9.867 1.00 0.00 H new ATOM 0 HA SER A 147 5.859 23.323 11.216 1.00 0.00 H new ATOM 0 HB2 SER A 147 8.378 23.586 11.484 1.00 0.00 H new ATOM 0 HB3 SER A 147 8.495 23.717 9.741 1.00 0.00 H new ATOM 0 HG SER A 147 7.019 25.537 9.870 1.00 0.00 H new ATOM 2347 N VAL A 148 4.973 22.446 8.715 1.00 0.00 N ATOM 2348 CA VAL A 148 4.281 22.578 7.439 1.00 0.00 C ATOM 2349 C VAL A 148 2.812 22.192 7.568 1.00 0.00 C ATOM 2350 O VAL A 148 2.471 21.226 8.250 1.00 0.00 O ATOM 2351 CB VAL A 148 4.937 21.704 6.352 1.00 0.00 C ATOM 2352 CG1 VAL A 148 6.275 22.290 5.931 1.00 0.00 C ATOM 2353 CG2 VAL A 148 5.103 20.275 6.847 1.00 0.00 C ATOM 0 H VAL A 148 4.659 21.661 9.286 1.00 0.00 H new ATOM 0 HA VAL A 148 4.354 23.625 7.146 1.00 0.00 H new ATOM 0 HB VAL A 148 4.284 21.689 5.479 1.00 0.00 H new ATOM 0 HG11 VAL A 148 6.723 21.659 5.163 1.00 0.00 H new ATOM 0 HG12 VAL A 148 6.124 23.294 5.534 1.00 0.00 H new ATOM 0 HG13 VAL A 148 6.939 22.338 6.794 1.00 0.00 H new ATOM 0 HG21 VAL A 148 5.568 19.671 6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 148 5.735 20.269 7.735 1.00 0.00 H new ATOM 0 HG23 VAL A 148 4.126 19.860 7.094 1.00 0.00 H new ATOM 2363 N ASN A 149 1.946 22.953 6.907 1.00 0.00 N ATOM 2364 CA ASN A 149 0.512 22.691 6.948 1.00 0.00 C ATOM 2365 C ASN A 149 -0.141 23.028 5.611 1.00 0.00 C ATOM 2366 O ASN A 149 0.355 23.870 4.861 1.00 0.00 O ATOM 2367 CB ASN A 149 -0.144 23.501 8.067 1.00 0.00 C ATOM 2368 CG ASN A 149 -1.500 22.948 8.464 1.00 0.00 C ATOM 2369 OD1 ASN A 149 -2.513 23.247 7.832 1.00 0.00 O ATOM 2370 ND2 ASN A 149 -1.523 22.136 9.515 1.00 0.00 N ATOM 0 H ASN A 149 2.212 23.756 6.337 1.00 0.00 H new ATOM 0 HA ASN A 149 0.368 21.629 7.145 1.00 0.00 H new ATOM 0 HB2 ASN A 149 0.511 23.509 8.938 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.257 24.536 7.744 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -2.406 21.732 9.828 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -0.658 21.916 10.009 1.00 0.00 H new ATOM 2377 N ILE A 150 -1.256 22.366 5.319 1.00 0.00 N ATOM 2378 CA ILE A 150 -1.977 22.597 4.074 1.00 0.00 C ATOM 2379 C ILE A 150 -2.521 24.021 4.010 1.00 0.00 C ATOM 2380 O ILE A 150 -2.400 24.697 2.988 1.00 0.00 O ATOM 2381 CB ILE A 150 -3.144 21.606 3.907 1.00 0.00 C ATOM 2382 CG1 ILE A 150 -2.627 20.166 3.934 1.00 0.00 C ATOM 2383 CG2 ILE A 150 -3.892 21.882 2.611 1.00 0.00 C ATOM 2384 CD1 ILE A 150 -1.655 19.853 2.819 1.00 0.00 C ATOM 0 H ILE A 150 -1.679 21.666 5.928 1.00 0.00 H new ATOM 0 HA ILE A 150 -1.264 22.446 3.264 1.00 0.00 H new ATOM 0 HB ILE A 150 -3.836 21.739 4.738 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -2.141 19.981 4.892 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -3.474 19.483 3.869 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -4.714 21.173 2.507 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -4.288 22.897 2.629 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -3.210 21.773 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -1.330 18.816 2.900 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -2.144 20.006 1.857 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -0.790 20.511 2.895 1.00 0.00 H new ATOM 2396 N SER A 151 -3.119 24.470 5.108 1.00 0.00 N ATOM 2397 CA SER A 151 -3.684 25.813 5.177 1.00 0.00 C ATOM 2398 C SER A 151 -2.789 26.737 5.996 1.00 0.00 C ATOM 2399 O SER A 151 -2.228 26.335 7.015 1.00 0.00 O ATOM 2400 CB SER A 151 -5.086 25.769 5.787 1.00 0.00 C ATOM 2401 OG SER A 151 -6.069 25.545 4.791 1.00 0.00 O ATOM 0 H SER A 151 -3.225 23.924 5.963 1.00 0.00 H new ATOM 0 HA SER A 151 -3.750 26.205 4.162 1.00 0.00 H new ATOM 0 HB2 SER A 151 -5.136 24.978 6.536 1.00 0.00 H new ATOM 0 HB3 SER A 151 -5.292 26.708 6.301 1.00 0.00 H new ATOM 0 HG SER A 151 -6.956 25.519 5.207 1.00 0.00 H new ATOM 2407 N GLY A 152 -2.659 27.981 5.543 1.00 0.00 N ATOM 2408 CA GLY A 152 -1.831 28.944 6.245 1.00 0.00 C ATOM 2409 C GLY A 152 -2.370 30.357 6.139 1.00 0.00 C ATOM 2410 O GLY A 152 -3.534 30.560 5.797 1.00 0.00 O ATOM 0 H GLY A 152 -3.113 28.339 4.702 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -1.762 28.662 7.296 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.820 28.913 5.840 1.00 0.00 H new ATOM 2414 N GLN A 153 -1.521 31.336 6.436 1.00 0.00 N ATOM 2415 CA GLN A 153 -1.920 32.737 6.375 1.00 0.00 C ATOM 2416 C GLN A 153 -3.223 32.965 7.133 1.00 0.00 C ATOM 2417 O GLN A 153 -4.103 33.691 6.670 1.00 0.00 O ATOM 2418 CB GLN A 153 -2.077 33.181 4.919 1.00 0.00 C ATOM 2419 CG GLN A 153 -2.158 34.689 4.749 1.00 0.00 C ATOM 2420 CD GLN A 153 -2.715 35.095 3.399 1.00 0.00 C ATOM 2421 OE1 GLN A 153 -2.521 34.400 2.400 1.00 0.00 O ATOM 2422 NE2 GLN A 153 -3.410 36.226 3.360 1.00 0.00 N ATOM 0 H GLN A 153 -0.553 31.185 6.721 1.00 0.00 H new ATOM 0 HA GLN A 153 -1.139 33.333 6.847 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -1.235 32.803 4.340 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -2.978 32.728 4.505 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -2.785 35.106 5.537 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -1.164 35.119 4.872 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -3.546 36.770 4.212 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -3.808 36.550 2.478 1.00 0.00 H new ATOM 2431 N SER A 154 -3.340 32.341 8.300 1.00 0.00 N ATOM 2432 CA SER A 154 -4.539 32.473 9.121 1.00 0.00 C ATOM 2433 C SER A 154 -4.902 33.941 9.319 1.00 0.00 C ATOM 2434 O SER A 154 -6.061 34.330 9.175 1.00 0.00 O ATOM 2435 CB SER A 154 -4.329 31.800 10.478 1.00 0.00 C ATOM 2436 OG SER A 154 -3.178 32.310 11.128 1.00 0.00 O ATOM 0 H SER A 154 -2.620 31.739 8.699 1.00 0.00 H new ATOM 0 HA SER A 154 -5.361 31.980 8.603 1.00 0.00 H new ATOM 0 HB2 SER A 154 -5.206 31.959 11.106 1.00 0.00 H new ATOM 0 HB3 SER A 154 -4.226 30.723 10.341 1.00 0.00 H new ATOM 0 HG SER A 154 -3.067 31.865 11.994 1.00 0.00 H new ATOM 2442 N GLY A 155 -3.903 34.753 9.650 1.00 0.00 N ATOM 2443 CA GLY A 155 -4.136 36.169 9.863 1.00 0.00 C ATOM 2444 C GLY A 155 -3.283 36.736 10.980 1.00 0.00 C ATOM 2445 O GLY A 155 -2.492 36.029 11.606 1.00 0.00 O ATOM 0 H GLY A 155 -2.936 34.455 9.775 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -3.928 36.711 8.940 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -5.188 36.330 10.097 1.00 0.00 H new ATOM 2449 N PRO A 156 -3.437 38.042 11.243 1.00 0.00 N ATOM 2450 CA PRO A 156 -2.682 38.733 12.293 1.00 0.00 C ATOM 2451 C PRO A 156 -3.106 38.300 13.692 1.00 0.00 C ATOM 2452 O PRO A 156 -2.267 38.091 14.568 1.00 0.00 O ATOM 2453 CB PRO A 156 -3.022 40.207 12.062 1.00 0.00 C ATOM 2454 CG PRO A 156 -4.347 40.189 11.382 1.00 0.00 C ATOM 2455 CD PRO A 156 -4.361 38.945 10.537 1.00 0.00 C ATOM 0 HA PRO A 156 -1.615 38.514 12.240 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -3.068 40.755 13.003 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -2.267 40.695 11.445 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -5.159 40.176 12.109 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -4.483 41.079 10.768 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -5.362 38.519 10.465 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -4.026 39.147 9.519 1.00 0.00 H new ATOM 2463 N SER A 157 -4.413 38.168 13.895 1.00 0.00 N ATOM 2464 CA SER A 157 -4.948 37.763 15.190 1.00 0.00 C ATOM 2465 C SER A 157 -4.246 36.508 15.700 1.00 0.00 C ATOM 2466 O SER A 157 -4.381 35.430 15.121 1.00 0.00 O ATOM 2467 CB SER A 157 -6.454 37.513 15.087 1.00 0.00 C ATOM 2468 OG SER A 157 -7.158 38.723 14.866 1.00 0.00 O ATOM 0 H SER A 157 -5.121 38.335 13.180 1.00 0.00 H new ATOM 0 HA SER A 157 -4.768 38.571 15.899 1.00 0.00 H new ATOM 0 HB2 SER A 157 -6.655 36.817 14.272 1.00 0.00 H new ATOM 0 HB3 SER A 157 -6.811 37.043 16.003 1.00 0.00 H new ATOM 0 HG SER A 157 -8.118 38.536 14.802 1.00 0.00 H new ATOM 2474 N SER A 158 -3.497 36.658 16.787 1.00 0.00 N ATOM 2475 CA SER A 158 -2.770 35.538 17.375 1.00 0.00 C ATOM 2476 C SER A 158 -3.255 35.260 18.794 1.00 0.00 C ATOM 2477 O SER A 158 -2.842 35.923 19.744 1.00 0.00 O ATOM 2478 CB SER A 158 -1.268 35.827 17.384 1.00 0.00 C ATOM 2479 OG SER A 158 -0.982 37.018 18.096 1.00 0.00 O ATOM 0 H SER A 158 -3.377 37.544 17.279 1.00 0.00 H new ATOM 0 HA SER A 158 -2.959 34.654 16.766 1.00 0.00 H new ATOM 0 HB2 SER A 158 -0.736 34.991 17.839 1.00 0.00 H new ATOM 0 HB3 SER A 158 -0.905 35.916 16.360 1.00 0.00 H new ATOM 0 HG SER A 158 -1.515 37.044 18.918 1.00 0.00 H new ATOM 2485 N GLY A 159 -4.136 34.273 18.930 1.00 0.00 N ATOM 2486 CA GLY A 159 -4.664 33.924 20.235 1.00 0.00 C ATOM 2487 C GLY A 159 -5.669 34.938 20.745 1.00 0.00 C ATOM 2488 O GLY A 159 -6.789 34.582 21.110 1.00 0.00 O ATOM 0 H GLY A 159 -4.493 33.709 18.159 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -5.137 32.944 20.182 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -3.842 33.843 20.946 1.00 0.00 H new TER 2492 GLY A 159