USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1160 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 7 HIS : no HD1:sc= 0.15 K(o=1.3,f=-8.8!) USER MOD Set 1.2: A 9 SER OG : rot -18:sc= 1.16 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -115:sc= 0.0676 (180deg=-0.0321) USER MOD Single : A 3 HIS : no HD1:sc= -0.0463 X(o=-0.046,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc=-0.000454 X(o=-0.00045,f=-0.00045) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 HIS : no HD1:sc= -0.0956 X(o=-0.096,f=-0.0036) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 50:sc= 0.0552 USER MOD Single : A 18 LYS NZ :NH3+ -136:sc= 0.749 (180deg=-1.6!) USER MOD Single : A 22 THR OG1 : rot 54:sc= 0.156 USER MOD Single : A 24 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 29 TYR OH : rot 165:sc= -0.139 USER MOD Single : A 33 HIS : no HE2:sc= -0.84 K(o=-0.84,f=-2.9) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : +bothHN:sc= 1.68 K(o=1.7,f=-8.5!) USER MOD Single : A 37 GLN : amide:sc= 1.18 K(o=1.2,f=-0.076) USER MOD Single : A 40 TYR OH : rot -156:sc= 0.1 USER MOD Single : A 49 LYS NZ :NH3+ -110:sc= 1.08 (180deg=0.605) USER MOD Single : A 50 SER OG : rot -96:sc= 1.16 USER MOD Single : A 51 HIS : no HD1:sc= -0.0172 X(o=-0.017,f=0) USER MOD Single : A 54 GLN :FLIP amide:sc= -0.0053 F(o=-1.3!,f=-0.0053) USER MOD Single : A 59 GLN : amide:sc= -1.48! C(o=-1.5!,f=-4.6!) USER MOD Single : A 65 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.09) USER MOD Single : A 66 ASN : amide:sc= -2.51! C(o=-2.5!,f=-2.2!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 173:sc= -1.62 (180deg=-1.63!) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -1.33! C(o=-1.3!,f=-3.5!) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= 0.0191 K(o=0.019,f=-1.2) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 ASN :FLIP amide:sc= -0.107 F(o=-0.75,f=-0.11) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -165:sc= 1.1 (180deg=0.905) USER MOD Single : A 122 SER OG : rot 100:sc= -0.45 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 GLN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : A 128 GLN : amide:sc= -0.185 X(o=-0.18,f=-0.44) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 142 CYS SG : rot -78:sc= 0.898 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 152:sc= 0.00579 (180deg=-0.118) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -48.341 -4.588 12.743 1.00 0.00 N ATOM 2 CA MET A 1 -47.815 -4.697 14.122 1.00 0.00 C ATOM 3 C MET A 1 -46.418 -5.299 14.104 1.00 0.00 C ATOM 4 O MET A 1 -46.041 -5.974 13.146 1.00 0.00 O ATOM 5 CB MET A 1 -48.740 -5.560 14.985 1.00 0.00 C ATOM 6 CG MET A 1 -50.085 -4.911 15.278 1.00 0.00 C ATOM 7 SD MET A 1 -51.145 -5.935 16.319 1.00 0.00 S ATOM 8 CE MET A 1 -52.600 -4.895 16.445 1.00 0.00 C ATOM 0 H1 MET A 1 -48.466 -3.585 12.497 1.00 0.00 H new ATOM 0 H2 MET A 1 -47.670 -5.026 12.080 1.00 0.00 H new ATOM 0 H3 MET A 1 -49.257 -5.076 12.681 1.00 0.00 H new ATOM 0 HA MET A 1 -47.769 -3.696 14.552 1.00 0.00 H new ATOM 0 HB2 MET A 1 -48.908 -6.512 14.482 1.00 0.00 H new ATOM 0 HB3 MET A 1 -48.240 -5.782 15.928 1.00 0.00 H new ATOM 0 HG2 MET A 1 -49.921 -3.951 15.768 1.00 0.00 H new ATOM 0 HG3 MET A 1 -50.596 -4.706 14.338 1.00 0.00 H new ATOM 0 HE1 MET A 1 -53.350 -5.392 17.060 1.00 0.00 H new ATOM 0 HE2 MET A 1 -52.328 -3.943 16.902 1.00 0.00 H new ATOM 0 HE3 MET A 1 -53.007 -4.717 15.450 1.00 0.00 H new ATOM 20 N GLY A 2 -45.652 -5.045 15.154 1.00 0.00 N ATOM 21 CA GLY A 2 -44.312 -5.588 15.241 1.00 0.00 C ATOM 22 C GLY A 2 -43.281 -4.677 14.608 1.00 0.00 C ATOM 23 O GLY A 2 -43.361 -3.455 14.755 1.00 0.00 O ATOM 0 H GLY A 2 -45.935 -4.472 15.949 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -44.056 -5.751 16.288 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -44.284 -6.561 14.751 1.00 0.00 H new ATOM 27 N HIS A 3 -42.327 -5.277 13.891 1.00 0.00 N ATOM 28 CA HIS A 3 -41.250 -4.541 13.222 1.00 0.00 C ATOM 29 C HIS A 3 -40.324 -3.873 14.232 1.00 0.00 C ATOM 30 O HIS A 3 -40.638 -2.822 14.788 1.00 0.00 O ATOM 31 CB HIS A 3 -41.799 -3.496 12.242 1.00 0.00 C ATOM 32 CG HIS A 3 -42.435 -4.087 11.023 1.00 0.00 C ATOM 33 ND1 HIS A 3 -42.098 -3.710 9.741 1.00 0.00 N ATOM 34 CD2 HIS A 3 -43.394 -5.032 10.896 1.00 0.00 C ATOM 35 CE1 HIS A 3 -42.823 -4.398 8.880 1.00 0.00 C ATOM 36 NE2 HIS A 3 -43.617 -5.209 9.556 1.00 0.00 N ATOM 0 H HIS A 3 -42.279 -6.287 13.758 1.00 0.00 H new ATOM 0 HA HIS A 3 -40.675 -5.272 12.653 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -42.532 -2.877 12.759 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -40.986 -2.838 11.934 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -43.892 -5.551 11.702 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -42.775 -4.313 7.804 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -44.287 -5.861 9.147 1.00 0.00 H new ATOM 45 N HIS A 4 -39.182 -4.495 14.469 1.00 0.00 N ATOM 46 CA HIS A 4 -38.198 -3.953 15.393 1.00 0.00 C ATOM 47 C HIS A 4 -37.007 -3.406 14.629 1.00 0.00 C ATOM 48 O HIS A 4 -36.394 -4.105 13.820 1.00 0.00 O ATOM 49 CB HIS A 4 -37.754 -5.011 16.401 1.00 0.00 C ATOM 50 CG HIS A 4 -38.813 -5.338 17.404 1.00 0.00 C ATOM 51 ND1 HIS A 4 -39.783 -6.294 17.192 1.00 0.00 N ATOM 52 CD2 HIS A 4 -39.063 -4.815 18.626 1.00 0.00 C ATOM 53 CE1 HIS A 4 -40.586 -6.341 18.240 1.00 0.00 C ATOM 54 NE2 HIS A 4 -40.170 -5.455 19.123 1.00 0.00 N ATOM 0 H HIS A 4 -38.912 -5.377 14.034 1.00 0.00 H new ATOM 0 HA HIS A 4 -38.661 -3.137 15.948 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -37.473 -5.919 15.867 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -36.864 -4.659 16.922 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -38.497 -4.038 19.119 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -41.438 -6.994 18.354 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -40.602 -5.274 20.029 1.00 0.00 H new ATOM 63 N HIS A 5 -36.688 -2.155 14.890 1.00 0.00 N ATOM 64 CA HIS A 5 -35.654 -1.463 14.152 1.00 0.00 C ATOM 65 C HIS A 5 -34.432 -1.221 15.029 1.00 0.00 C ATOM 66 O HIS A 5 -34.412 -0.305 15.848 1.00 0.00 O ATOM 67 CB HIS A 5 -36.196 -0.135 13.612 1.00 0.00 C ATOM 68 CG HIS A 5 -35.221 0.621 12.759 1.00 0.00 C ATOM 69 ND1 HIS A 5 -35.083 0.407 11.405 1.00 0.00 N ATOM 70 CD2 HIS A 5 -34.335 1.594 13.076 1.00 0.00 C ATOM 71 CE1 HIS A 5 -34.154 1.213 10.927 1.00 0.00 C ATOM 72 NE2 HIS A 5 -33.686 1.947 11.920 1.00 0.00 N ATOM 0 H HIS A 5 -37.135 -1.593 15.615 1.00 0.00 H new ATOM 0 HA HIS A 5 -35.349 -2.089 13.313 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -37.096 -0.332 13.029 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -36.491 0.493 14.452 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -34.170 2.014 14.057 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -33.831 1.264 9.898 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -32.961 2.660 11.841 1.00 0.00 H new ATOM 81 N HIS A 6 -33.423 -2.057 14.857 1.00 0.00 N ATOM 82 CA HIS A 6 -32.148 -1.867 15.532 1.00 0.00 C ATOM 83 C HIS A 6 -31.051 -1.651 14.501 1.00 0.00 C ATOM 84 O HIS A 6 -30.810 -2.502 13.643 1.00 0.00 O ATOM 85 CB HIS A 6 -31.813 -3.041 16.469 1.00 0.00 C ATOM 86 CG HIS A 6 -32.031 -4.402 15.879 1.00 0.00 C ATOM 87 ND1 HIS A 6 -31.024 -5.160 15.322 1.00 0.00 N ATOM 88 CD2 HIS A 6 -33.156 -5.150 15.786 1.00 0.00 C ATOM 89 CE1 HIS A 6 -31.520 -6.313 14.912 1.00 0.00 C ATOM 90 NE2 HIS A 6 -32.810 -6.330 15.183 1.00 0.00 N ATOM 0 H HIS A 6 -33.461 -2.878 14.253 1.00 0.00 H new ATOM 0 HA HIS A 6 -32.222 -0.980 16.161 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -30.770 -2.956 16.775 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -32.418 -2.951 17.371 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -34.142 -4.869 16.124 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -30.964 -7.107 14.436 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -33.448 -7.099 14.977 1.00 0.00 H new ATOM 99 N HIS A 7 -30.417 -0.494 14.580 1.00 0.00 N ATOM 100 CA HIS A 7 -29.430 -0.079 13.598 1.00 0.00 C ATOM 101 C HIS A 7 -28.033 -0.488 14.048 1.00 0.00 C ATOM 102 O HIS A 7 -27.700 -0.375 15.228 1.00 0.00 O ATOM 103 CB HIS A 7 -29.513 1.436 13.418 1.00 0.00 C ATOM 104 CG HIS A 7 -28.802 1.958 12.209 1.00 0.00 C ATOM 105 ND1 HIS A 7 -27.645 2.696 12.276 1.00 0.00 N ATOM 106 CD2 HIS A 7 -29.116 1.874 10.897 1.00 0.00 C ATOM 107 CE1 HIS A 7 -27.277 3.044 11.058 1.00 0.00 C ATOM 108 NE2 HIS A 7 -28.151 2.556 10.201 1.00 0.00 N ATOM 0 H HIS A 7 -30.572 0.184 15.326 1.00 0.00 H new ATOM 0 HA HIS A 7 -29.635 -0.567 12.645 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -30.562 1.725 13.360 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -29.098 1.918 14.304 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -29.969 1.364 10.475 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -26.406 3.630 10.806 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -28.116 2.667 9.188 1.00 0.00 H new ATOM 117 N HIS A 8 -27.228 -0.977 13.112 1.00 0.00 N ATOM 118 CA HIS A 8 -25.872 -1.414 13.432 1.00 0.00 C ATOM 119 C HIS A 8 -24.963 -0.200 13.598 1.00 0.00 C ATOM 120 O HIS A 8 -24.149 -0.148 14.522 1.00 0.00 O ATOM 121 CB HIS A 8 -25.331 -2.342 12.338 1.00 0.00 C ATOM 122 CG HIS A 8 -24.383 -3.387 12.845 1.00 0.00 C ATOM 123 ND1 HIS A 8 -24.362 -4.677 12.363 1.00 0.00 N ATOM 124 CD2 HIS A 8 -23.432 -3.335 13.807 1.00 0.00 C ATOM 125 CE1 HIS A 8 -23.447 -5.373 13.009 1.00 0.00 C ATOM 126 NE2 HIS A 8 -22.865 -4.583 13.892 1.00 0.00 N ATOM 0 H HIS A 8 -27.487 -1.081 12.131 1.00 0.00 H new ATOM 0 HA HIS A 8 -25.895 -1.971 14.369 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -26.169 -2.834 11.845 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -24.825 -1.741 11.583 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -23.168 -2.471 14.399 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -23.213 -6.414 12.843 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -22.118 -4.854 14.531 1.00 0.00 H new ATOM 135 N SER A 9 -25.116 0.756 12.679 1.00 0.00 N ATOM 136 CA SER A 9 -24.441 2.056 12.751 1.00 0.00 C ATOM 137 C SER A 9 -22.957 1.967 12.397 1.00 0.00 C ATOM 138 O SER A 9 -22.321 0.920 12.525 1.00 0.00 O ATOM 139 CB SER A 9 -24.632 2.693 14.134 1.00 0.00 C ATOM 140 OG SER A 9 -26.009 2.920 14.403 1.00 0.00 O ATOM 0 H SER A 9 -25.714 0.651 11.860 1.00 0.00 H new ATOM 0 HA SER A 9 -24.908 2.696 12.002 1.00 0.00 H new ATOM 0 HB2 SER A 9 -24.210 2.042 14.900 1.00 0.00 H new ATOM 0 HB3 SER A 9 -24.088 3.636 14.183 1.00 0.00 H new ATOM 0 HG SER A 9 -26.514 2.898 13.564 1.00 0.00 H new ATOM 146 N HIS A 10 -22.421 3.083 11.927 1.00 0.00 N ATOM 147 CA HIS A 10 -21.019 3.176 11.555 1.00 0.00 C ATOM 148 C HIS A 10 -20.428 4.458 12.137 1.00 0.00 C ATOM 149 O HIS A 10 -20.222 5.442 11.427 1.00 0.00 O ATOM 150 CB HIS A 10 -20.882 3.142 10.021 1.00 0.00 C ATOM 151 CG HIS A 10 -19.471 3.183 9.502 1.00 0.00 C ATOM 152 ND1 HIS A 10 -18.716 2.054 9.272 1.00 0.00 N ATOM 153 CD2 HIS A 10 -18.695 4.230 9.132 1.00 0.00 C ATOM 154 CE1 HIS A 10 -17.540 2.406 8.788 1.00 0.00 C ATOM 155 NE2 HIS A 10 -17.499 3.722 8.692 1.00 0.00 N ATOM 0 H HIS A 10 -22.945 3.948 11.793 1.00 0.00 H new ATOM 0 HA HIS A 10 -20.468 2.327 11.959 1.00 0.00 H new ATOM 0 HB2 HIS A 10 -21.362 2.237 9.650 1.00 0.00 H new ATOM 0 HB3 HIS A 10 -21.430 3.987 9.605 1.00 0.00 H new ATOM 0 HD2 HIS A 10 -18.968 5.274 9.175 1.00 0.00 H new ATOM 0 HE1 HIS A 10 -16.743 1.730 8.516 1.00 0.00 H new ATOM 0 HE2 HIS A 10 -16.710 4.270 8.348 1.00 0.00 H new ATOM 164 N MET A 11 -20.196 4.455 13.443 1.00 0.00 N ATOM 165 CA MET A 11 -19.681 5.638 14.123 1.00 0.00 C ATOM 166 C MET A 11 -18.158 5.649 14.136 1.00 0.00 C ATOM 167 O MET A 11 -17.526 5.275 15.123 1.00 0.00 O ATOM 168 CB MET A 11 -20.220 5.732 15.554 1.00 0.00 C ATOM 169 CG MET A 11 -21.676 6.162 15.637 1.00 0.00 C ATOM 170 SD MET A 11 -22.233 6.372 17.341 1.00 0.00 S ATOM 171 CE MET A 11 -23.915 6.927 17.078 1.00 0.00 C ATOM 0 H MET A 11 -20.355 3.651 14.051 1.00 0.00 H new ATOM 0 HA MET A 11 -20.027 6.508 13.565 1.00 0.00 H new ATOM 0 HB2 MET A 11 -20.110 4.761 16.038 1.00 0.00 H new ATOM 0 HB3 MET A 11 -19.610 6.439 16.116 1.00 0.00 H new ATOM 0 HG2 MET A 11 -21.807 7.099 15.096 1.00 0.00 H new ATOM 0 HG3 MET A 11 -22.301 5.419 15.142 1.00 0.00 H new ATOM 0 HE1 MET A 11 -24.396 7.101 18.041 1.00 0.00 H new ATOM 0 HE2 MET A 11 -23.907 7.854 16.504 1.00 0.00 H new ATOM 0 HE3 MET A 11 -24.468 6.165 16.529 1.00 0.00 H new ATOM 181 N ASP A 12 -17.584 6.053 13.015 1.00 0.00 N ATOM 182 CA ASP A 12 -16.140 6.221 12.894 1.00 0.00 C ATOM 183 C ASP A 12 -15.849 6.991 11.616 1.00 0.00 C ATOM 184 O ASP A 12 -16.135 6.511 10.519 1.00 0.00 O ATOM 185 CB ASP A 12 -15.423 4.867 12.875 1.00 0.00 C ATOM 186 CG ASP A 12 -13.922 5.001 13.047 1.00 0.00 C ATOM 187 OD1 ASP A 12 -13.466 5.211 14.195 1.00 0.00 O ATOM 188 OD2 ASP A 12 -13.185 4.893 12.047 1.00 0.00 O ATOM 0 H ASP A 12 -18.101 6.274 12.164 1.00 0.00 H new ATOM 0 HA ASP A 12 -15.769 6.773 13.758 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -15.822 4.237 13.671 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -15.634 4.361 11.933 1.00 0.00 H new ATOM 193 N TYR A 13 -15.312 8.191 11.762 1.00 0.00 N ATOM 194 CA TYR A 13 -15.131 9.081 10.627 1.00 0.00 C ATOM 195 C TYR A 13 -13.887 9.946 10.788 1.00 0.00 C ATOM 196 O TYR A 13 -13.650 10.526 11.849 1.00 0.00 O ATOM 197 CB TYR A 13 -16.383 9.953 10.420 1.00 0.00 C ATOM 198 CG TYR A 13 -16.976 10.527 11.695 1.00 0.00 C ATOM 199 CD1 TYR A 13 -17.867 9.784 12.462 1.00 0.00 C ATOM 200 CD2 TYR A 13 -16.652 11.809 12.127 1.00 0.00 C ATOM 201 CE1 TYR A 13 -18.417 10.300 13.620 1.00 0.00 C ATOM 202 CE2 TYR A 13 -17.198 12.331 13.286 1.00 0.00 C ATOM 203 CZ TYR A 13 -18.081 11.572 14.028 1.00 0.00 C ATOM 204 OH TYR A 13 -18.629 12.087 15.183 1.00 0.00 O ATOM 0 H TYR A 13 -14.994 8.571 12.654 1.00 0.00 H new ATOM 0 HA TYR A 13 -14.988 8.465 9.739 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -16.129 10.776 9.751 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -17.145 9.357 9.918 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -18.134 8.786 12.147 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -15.963 12.406 11.548 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -19.107 9.708 14.203 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -16.935 13.327 13.609 1.00 0.00 H new ATOM 0 HH TYR A 13 -18.289 12.994 15.330 1.00 0.00 H new ATOM 214 N PRO A 14 -13.066 10.020 9.733 1.00 0.00 N ATOM 215 CA PRO A 14 -11.844 10.804 9.724 1.00 0.00 C ATOM 216 C PRO A 14 -12.086 12.245 9.290 1.00 0.00 C ATOM 217 O PRO A 14 -12.133 12.551 8.097 1.00 0.00 O ATOM 218 CB PRO A 14 -10.955 10.078 8.704 1.00 0.00 C ATOM 219 CG PRO A 14 -11.835 9.080 8.005 1.00 0.00 C ATOM 220 CD PRO A 14 -13.250 9.332 8.456 1.00 0.00 C ATOM 0 HA PRO A 14 -11.400 10.875 10.717 1.00 0.00 H new ATOM 0 HB2 PRO A 14 -10.526 10.783 7.992 1.00 0.00 H new ATOM 0 HB3 PRO A 14 -10.122 9.580 9.200 1.00 0.00 H new ATOM 0 HG2 PRO A 14 -11.752 9.187 6.923 1.00 0.00 H new ATOM 0 HG3 PRO A 14 -11.530 8.062 8.249 1.00 0.00 H new ATOM 0 HD2 PRO A 14 -13.799 9.946 7.742 1.00 0.00 H new ATOM 0 HD3 PRO A 14 -13.808 8.403 8.574 1.00 0.00 H new ATOM 228 N SER A 15 -12.277 13.116 10.262 1.00 0.00 N ATOM 229 CA SER A 15 -12.480 14.531 9.997 1.00 0.00 C ATOM 230 C SER A 15 -11.502 15.365 10.818 1.00 0.00 C ATOM 231 O SER A 15 -11.747 15.652 11.992 1.00 0.00 O ATOM 232 CB SER A 15 -13.930 14.913 10.314 1.00 0.00 C ATOM 233 OG SER A 15 -14.357 14.323 11.535 1.00 0.00 O ATOM 0 H SER A 15 -12.296 12.868 11.251 1.00 0.00 H new ATOM 0 HA SER A 15 -12.292 14.733 8.942 1.00 0.00 H new ATOM 0 HB2 SER A 15 -14.018 15.997 10.380 1.00 0.00 H new ATOM 0 HB3 SER A 15 -14.581 14.589 9.502 1.00 0.00 H new ATOM 0 HG SER A 15 -13.697 14.508 12.236 1.00 0.00 H new ATOM 239 N PHE A 16 -10.385 15.741 10.208 1.00 0.00 N ATOM 240 CA PHE A 16 -9.333 16.442 10.930 1.00 0.00 C ATOM 241 C PHE A 16 -8.676 17.531 10.083 1.00 0.00 C ATOM 242 O PHE A 16 -7.977 17.235 9.112 1.00 0.00 O ATOM 243 CB PHE A 16 -8.276 15.443 11.411 1.00 0.00 C ATOM 244 CG PHE A 16 -7.130 16.075 12.148 1.00 0.00 C ATOM 245 CD1 PHE A 16 -7.305 16.576 13.426 1.00 0.00 C ATOM 246 CD2 PHE A 16 -5.878 16.162 11.565 1.00 0.00 C ATOM 247 CE1 PHE A 16 -6.251 17.154 14.107 1.00 0.00 C ATOM 248 CE2 PHE A 16 -4.821 16.738 12.240 1.00 0.00 C ATOM 249 CZ PHE A 16 -5.006 17.235 13.514 1.00 0.00 C ATOM 0 H PHE A 16 -10.186 15.573 9.222 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.795 16.932 11.787 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -8.753 14.710 12.061 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -7.886 14.900 10.550 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.275 16.515 13.896 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -5.726 15.774 10.569 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.401 17.543 15.103 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -3.850 16.800 11.772 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.181 17.686 14.045 1.00 0.00 H new ATOM 259 N ASP A 17 -8.952 18.786 10.452 1.00 0.00 N ATOM 260 CA ASP A 17 -8.217 19.964 9.962 1.00 0.00 C ATOM 261 C ASP A 17 -8.544 20.303 8.506 1.00 0.00 C ATOM 262 O ASP A 17 -9.157 21.336 8.229 1.00 0.00 O ATOM 263 CB ASP A 17 -6.707 19.764 10.130 1.00 0.00 C ATOM 264 CG ASP A 17 -5.914 21.022 9.847 1.00 0.00 C ATOM 265 OD1 ASP A 17 -5.777 21.859 10.768 1.00 0.00 O ATOM 266 OD2 ASP A 17 -5.413 21.181 8.715 1.00 0.00 O ATOM 0 H ASP A 17 -9.699 19.018 11.106 1.00 0.00 H new ATOM 0 HA ASP A 17 -8.542 20.809 10.569 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -6.500 19.431 11.147 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.373 18.971 9.460 1.00 0.00 H new ATOM 271 N LYS A 18 -8.131 19.432 7.593 1.00 0.00 N ATOM 272 CA LYS A 18 -8.311 19.642 6.160 1.00 0.00 C ATOM 273 C LYS A 18 -9.796 19.762 5.812 1.00 0.00 C ATOM 274 O LYS A 18 -10.649 19.234 6.530 1.00 0.00 O ATOM 275 CB LYS A 18 -7.667 18.471 5.403 1.00 0.00 C ATOM 276 CG LYS A 18 -7.700 18.585 3.886 1.00 0.00 C ATOM 277 CD LYS A 18 -7.031 17.382 3.233 1.00 0.00 C ATOM 278 CE LYS A 18 -7.104 17.437 1.714 1.00 0.00 C ATOM 279 NZ LYS A 18 -6.344 18.587 1.155 1.00 0.00 N ATOM 0 H LYS A 18 -7.660 18.557 7.825 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.829 20.574 5.865 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.629 18.380 5.722 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.172 17.550 5.693 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.733 18.660 3.546 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.195 19.500 3.575 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -5.987 17.336 3.543 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.509 16.468 3.585 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.711 16.509 1.299 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -8.147 17.508 1.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -6.908 19.049 0.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -6.142 19.271 1.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -5.449 18.247 0.748 1.00 0.00 H new ATOM 293 N PHE A 19 -10.108 20.447 4.715 1.00 0.00 N ATOM 294 CA PHE A 19 -11.478 20.637 4.313 1.00 0.00 C ATOM 295 C PHE A 19 -11.573 20.311 2.820 1.00 0.00 C ATOM 296 O PHE A 19 -12.231 19.338 2.460 1.00 0.00 O ATOM 297 CB PHE A 19 -11.958 22.051 4.672 1.00 0.00 C ATOM 298 CG PHE A 19 -13.420 22.141 4.993 1.00 0.00 C ATOM 299 CD1 PHE A 19 -14.027 21.191 5.797 1.00 0.00 C ATOM 300 CD2 PHE A 19 -14.184 23.188 4.509 1.00 0.00 C ATOM 301 CE1 PHE A 19 -15.368 21.283 6.107 1.00 0.00 C ATOM 302 CE2 PHE A 19 -15.525 23.282 4.813 1.00 0.00 C ATOM 303 CZ PHE A 19 -16.118 22.330 5.613 1.00 0.00 C ATOM 0 H PHE A 19 -9.421 20.876 4.095 1.00 0.00 H new ATOM 0 HA PHE A 19 -12.149 19.967 4.851 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -11.387 22.410 5.528 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -11.738 22.719 3.839 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.444 20.369 6.186 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -13.724 23.941 3.886 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -15.830 20.536 6.736 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.111 24.102 4.424 1.00 0.00 H new ATOM 0 HZ PHE A 19 -17.168 22.403 5.853 1.00 0.00 H new ATOM 313 N LEU A 20 -10.933 21.086 1.922 1.00 0.00 N ATOM 314 CA LEU A 20 -10.472 22.454 2.146 1.00 0.00 C ATOM 315 C LEU A 20 -11.402 23.408 1.397 1.00 0.00 C ATOM 316 O LEU A 20 -11.358 23.481 0.168 1.00 0.00 O ATOM 317 CB LEU A 20 -9.045 22.640 1.618 1.00 0.00 C ATOM 318 CG LEU A 20 -7.944 21.900 2.372 1.00 0.00 C ATOM 319 CD1 LEU A 20 -6.645 21.956 1.585 1.00 0.00 C ATOM 320 CD2 LEU A 20 -7.738 22.508 3.750 1.00 0.00 C ATOM 0 H LEU A 20 -10.718 20.753 0.982 1.00 0.00 H new ATOM 0 HA LEU A 20 -10.479 22.661 3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.021 22.320 0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -8.812 23.705 1.630 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.247 20.860 2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -5.865 21.425 2.131 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -6.789 21.488 0.611 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -6.348 22.996 1.447 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.949 21.967 4.272 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.453 23.555 3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -8.664 22.439 4.320 1.00 0.00 H new ATOM 332 N GLY A 21 -12.250 24.120 2.127 1.00 0.00 N ATOM 333 CA GLY A 21 -13.249 24.958 1.487 1.00 0.00 C ATOM 334 C GLY A 21 -14.239 24.124 0.695 1.00 0.00 C ATOM 335 O GLY A 21 -14.820 23.175 1.226 1.00 0.00 O ATOM 0 H GLY A 21 -12.266 24.134 3.147 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -13.780 25.537 2.243 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -12.759 25.672 0.825 1.00 0.00 H new ATOM 339 N THR A 22 -14.432 24.461 -0.571 1.00 0.00 N ATOM 340 CA THR A 22 -15.251 23.648 -1.456 1.00 0.00 C ATOM 341 C THR A 22 -14.536 23.401 -2.778 1.00 0.00 C ATOM 342 O THR A 22 -14.818 24.048 -3.787 1.00 0.00 O ATOM 343 CB THR A 22 -16.634 24.275 -1.725 1.00 0.00 C ATOM 344 OG1 THR A 22 -16.497 25.651 -2.109 1.00 0.00 O ATOM 345 CG2 THR A 22 -17.537 24.168 -0.503 1.00 0.00 C ATOM 0 H THR A 22 -14.033 25.292 -1.008 1.00 0.00 H new ATOM 0 HA THR A 22 -15.411 22.699 -0.944 1.00 0.00 H new ATOM 0 HB THR A 22 -17.094 23.720 -2.542 1.00 0.00 H new ATOM 0 HG1 THR A 22 -15.874 25.720 -2.862 1.00 0.00 H new ATOM 0 HG21 THR A 22 -18.504 24.619 -0.725 1.00 0.00 H new ATOM 0 HG22 THR A 22 -17.677 23.118 -0.245 1.00 0.00 H new ATOM 0 HG23 THR A 22 -17.077 24.690 0.336 1.00 0.00 H new ATOM 353 N GLU A 23 -13.582 22.487 -2.754 1.00 0.00 N ATOM 354 CA GLU A 23 -12.851 22.105 -3.949 1.00 0.00 C ATOM 355 C GLU A 23 -12.705 20.586 -3.979 1.00 0.00 C ATOM 356 O GLU A 23 -11.855 20.016 -3.295 1.00 0.00 O ATOM 357 CB GLU A 23 -11.481 22.792 -3.992 1.00 0.00 C ATOM 358 CG GLU A 23 -10.783 22.684 -5.340 1.00 0.00 C ATOM 359 CD GLU A 23 -9.571 23.590 -5.442 1.00 0.00 C ATOM 360 OE1 GLU A 23 -9.739 24.822 -5.337 1.00 0.00 O ATOM 361 OE2 GLU A 23 -8.451 23.081 -5.647 1.00 0.00 O ATOM 0 H GLU A 23 -13.293 21.991 -1.911 1.00 0.00 H new ATOM 0 HA GLU A 23 -13.404 22.428 -4.831 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.605 23.845 -3.741 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.841 22.355 -3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -10.475 21.651 -5.504 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -11.488 22.936 -6.132 1.00 0.00 H new ATOM 368 N ASN A 24 -13.547 19.942 -4.772 1.00 0.00 N ATOM 369 CA ASN A 24 -13.674 18.486 -4.763 1.00 0.00 C ATOM 370 C ASN A 24 -12.644 17.819 -5.665 1.00 0.00 C ATOM 371 O ASN A 24 -12.712 16.616 -5.902 1.00 0.00 O ATOM 372 CB ASN A 24 -15.085 18.080 -5.205 1.00 0.00 C ATOM 373 CG ASN A 24 -16.165 18.589 -4.265 1.00 0.00 C ATOM 374 OD1 ASN A 24 -16.530 17.920 -3.297 1.00 0.00 O ATOM 375 ND2 ASN A 24 -16.690 19.777 -4.541 1.00 0.00 N ATOM 0 H ASN A 24 -14.161 20.408 -5.439 1.00 0.00 H new ATOM 0 HA ASN A 24 -13.493 18.148 -3.743 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -15.272 18.464 -6.208 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -15.144 16.993 -5.264 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -17.420 20.163 -3.943 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -16.363 20.303 -5.351 1.00 0.00 H new ATOM 382 N ALA A 25 -11.676 18.593 -6.141 1.00 0.00 N ATOM 383 CA ALA A 25 -10.656 18.069 -7.045 1.00 0.00 C ATOM 384 C ALA A 25 -9.890 16.914 -6.411 1.00 0.00 C ATOM 385 O ALA A 25 -9.608 15.912 -7.071 1.00 0.00 O ATOM 386 CB ALA A 25 -9.702 19.174 -7.467 1.00 0.00 C ATOM 0 H ALA A 25 -11.575 19.583 -5.918 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.161 17.685 -7.931 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -8.948 18.766 -8.141 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.258 19.960 -7.978 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.214 19.590 -6.585 1.00 0.00 H new ATOM 392 N GLU A 26 -9.573 17.049 -5.128 1.00 0.00 N ATOM 393 CA GLU A 26 -8.872 15.997 -4.401 1.00 0.00 C ATOM 394 C GLU A 26 -9.799 14.815 -4.142 1.00 0.00 C ATOM 395 O GLU A 26 -9.362 13.667 -4.091 1.00 0.00 O ATOM 396 CB GLU A 26 -8.336 16.527 -3.071 1.00 0.00 C ATOM 397 CG GLU A 26 -7.333 17.658 -3.221 1.00 0.00 C ATOM 398 CD GLU A 26 -6.775 18.117 -1.889 1.00 0.00 C ATOM 399 OE1 GLU A 26 -5.754 17.560 -1.436 1.00 0.00 O ATOM 400 OE2 GLU A 26 -7.364 19.031 -1.276 1.00 0.00 O ATOM 0 H GLU A 26 -9.790 17.875 -4.571 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.035 15.665 -5.015 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.173 16.874 -2.465 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -7.867 15.708 -2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -6.514 17.331 -3.861 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -7.812 18.500 -3.721 1.00 0.00 H new ATOM 407 N LEU A 27 -11.084 15.110 -4.000 1.00 0.00 N ATOM 408 CA LEU A 27 -12.071 14.102 -3.671 1.00 0.00 C ATOM 409 C LEU A 27 -12.396 13.223 -4.876 1.00 0.00 C ATOM 410 O LEU A 27 -12.520 12.009 -4.744 1.00 0.00 O ATOM 411 CB LEU A 27 -13.339 14.769 -3.140 1.00 0.00 C ATOM 412 CG LEU A 27 -14.492 13.816 -2.864 1.00 0.00 C ATOM 413 CD1 LEU A 27 -14.134 12.833 -1.756 1.00 0.00 C ATOM 414 CD2 LEU A 27 -15.751 14.589 -2.512 1.00 0.00 C ATOM 0 H LEU A 27 -11.465 16.050 -4.110 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.653 13.458 -2.897 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.096 15.299 -2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.669 15.517 -3.861 1.00 0.00 H new ATOM 0 HG LEU A 27 -14.683 13.243 -3.772 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -14.975 12.163 -1.578 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -13.263 12.250 -2.054 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.908 13.382 -0.842 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -16.565 13.890 -2.318 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.571 15.192 -1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -16.022 15.240 -3.343 1.00 0.00 H new ATOM 426 N VAL A 28 -12.529 13.834 -6.048 1.00 0.00 N ATOM 427 CA VAL A 28 -12.814 13.081 -7.267 1.00 0.00 C ATOM 428 C VAL A 28 -11.672 12.109 -7.569 1.00 0.00 C ATOM 429 O VAL A 28 -11.891 11.011 -8.084 1.00 0.00 O ATOM 430 CB VAL A 28 -13.046 14.018 -8.474 1.00 0.00 C ATOM 431 CG1 VAL A 28 -13.361 13.214 -9.727 1.00 0.00 C ATOM 432 CG2 VAL A 28 -14.167 15.003 -8.180 1.00 0.00 C ATOM 0 H VAL A 28 -12.445 14.842 -6.181 1.00 0.00 H new ATOM 0 HA VAL A 28 -13.732 12.517 -7.100 1.00 0.00 H new ATOM 0 HB VAL A 28 -12.129 14.581 -8.648 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -13.521 13.893 -10.564 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -12.527 12.550 -9.952 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -14.262 12.622 -9.563 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -14.315 15.654 -9.042 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -15.088 14.456 -7.976 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -13.903 15.606 -7.311 1.00 0.00 H new ATOM 442 N TYR A 29 -10.457 12.518 -7.214 1.00 0.00 N ATOM 443 CA TYR A 29 -9.275 11.663 -7.346 1.00 0.00 C ATOM 444 C TYR A 29 -9.419 10.383 -6.515 1.00 0.00 C ATOM 445 O TYR A 29 -8.800 9.361 -6.814 1.00 0.00 O ATOM 446 CB TYR A 29 -8.026 12.443 -6.910 1.00 0.00 C ATOM 447 CG TYR A 29 -6.760 11.612 -6.834 1.00 0.00 C ATOM 448 CD1 TYR A 29 -6.134 11.142 -7.983 1.00 0.00 C ATOM 449 CD2 TYR A 29 -6.194 11.297 -5.604 1.00 0.00 C ATOM 450 CE1 TYR A 29 -4.980 10.384 -7.905 1.00 0.00 C ATOM 451 CE2 TYR A 29 -5.042 10.542 -5.519 1.00 0.00 C ATOM 452 CZ TYR A 29 -4.439 10.087 -6.670 1.00 0.00 C ATOM 453 OH TYR A 29 -3.292 9.334 -6.584 1.00 0.00 O ATOM 0 H TYR A 29 -10.262 13.443 -6.830 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.175 11.370 -8.391 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -7.865 13.265 -7.608 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -8.213 12.887 -5.932 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.555 11.372 -8.951 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.665 11.650 -4.698 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -4.504 10.026 -8.806 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -4.616 10.309 -4.554 1.00 0.00 H new ATOM 0 HH TYR A 29 -2.914 9.416 -5.684 1.00 0.00 H new ATOM 463 N VAL A 30 -10.244 10.447 -5.481 1.00 0.00 N ATOM 464 CA VAL A 30 -10.451 9.318 -4.582 1.00 0.00 C ATOM 465 C VAL A 30 -11.300 8.223 -5.235 1.00 0.00 C ATOM 466 O VAL A 30 -11.078 7.034 -5.007 1.00 0.00 O ATOM 467 CB VAL A 30 -11.126 9.781 -3.267 1.00 0.00 C ATOM 468 CG1 VAL A 30 -11.470 8.604 -2.370 1.00 0.00 C ATOM 469 CG2 VAL A 30 -10.231 10.765 -2.530 1.00 0.00 C ATOM 0 H VAL A 30 -10.787 11.277 -5.241 1.00 0.00 H new ATOM 0 HA VAL A 30 -9.469 8.903 -4.357 1.00 0.00 H new ATOM 0 HB VAL A 30 -12.059 10.280 -3.531 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -11.942 8.968 -1.457 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -12.156 7.937 -2.892 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -10.559 8.062 -2.116 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -10.719 11.081 -1.608 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -9.282 10.285 -2.292 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -10.050 11.635 -3.161 1.00 0.00 H new ATOM 479 N LEU A 31 -12.256 8.628 -6.059 1.00 0.00 N ATOM 480 CA LEU A 31 -13.217 7.694 -6.639 1.00 0.00 C ATOM 481 C LEU A 31 -12.574 6.783 -7.684 1.00 0.00 C ATOM 482 O LEU A 31 -11.611 7.169 -8.349 1.00 0.00 O ATOM 483 CB LEU A 31 -14.398 8.450 -7.264 1.00 0.00 C ATOM 484 CG LEU A 31 -15.473 8.948 -6.286 1.00 0.00 C ATOM 485 CD1 LEU A 31 -14.926 10.022 -5.357 1.00 0.00 C ATOM 486 CD2 LEU A 31 -16.677 9.473 -7.053 1.00 0.00 C ATOM 0 H LEU A 31 -12.389 9.599 -6.343 1.00 0.00 H new ATOM 0 HA LEU A 31 -13.580 7.066 -5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -14.006 9.308 -7.810 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -14.875 7.798 -7.996 1.00 0.00 H new ATOM 0 HG LEU A 31 -15.784 8.104 -5.670 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -15.713 10.352 -4.679 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -14.096 9.615 -4.779 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -14.577 10.870 -5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -17.432 9.823 -6.349 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -16.368 10.298 -7.694 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -17.095 8.674 -7.666 1.00 0.00 H new ATOM 498 N ARG A 32 -13.144 5.577 -7.821 1.00 0.00 N ATOM 499 CA ARG A 32 -12.676 4.554 -8.767 1.00 0.00 C ATOM 500 C ARG A 32 -11.366 3.919 -8.303 1.00 0.00 C ATOM 501 O ARG A 32 -10.368 4.601 -8.080 1.00 0.00 O ATOM 502 CB ARG A 32 -12.531 5.104 -10.194 1.00 0.00 C ATOM 503 CG ARG A 32 -13.857 5.335 -10.912 1.00 0.00 C ATOM 504 CD ARG A 32 -14.528 6.633 -10.490 1.00 0.00 C ATOM 505 NE ARG A 32 -13.787 7.811 -10.944 1.00 0.00 N ATOM 506 CZ ARG A 32 -14.331 9.014 -11.127 1.00 0.00 C ATOM 507 NH1 ARG A 32 -15.614 9.223 -10.842 1.00 0.00 N ATOM 508 NH2 ARG A 32 -13.589 10.016 -11.583 1.00 0.00 N ATOM 0 H ARG A 32 -13.951 5.282 -7.272 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.444 3.780 -8.789 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.983 6.045 -10.155 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -11.929 4.409 -10.780 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.686 5.351 -11.988 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -14.527 4.500 -10.708 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -15.540 6.665 -10.893 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -14.617 6.658 -9.404 1.00 0.00 H new ATOM 0 HE ARG A 32 -12.790 7.704 -11.132 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.187 8.460 -10.481 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.024 10.146 -10.984 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -12.602 9.865 -11.793 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -14.006 10.936 -11.723 1.00 0.00 H new ATOM 522 N HIS A 33 -11.372 2.599 -8.165 1.00 0.00 N ATOM 523 CA HIS A 33 -10.225 1.880 -7.623 1.00 0.00 C ATOM 524 C HIS A 33 -10.210 0.429 -8.097 1.00 0.00 C ATOM 525 O HIS A 33 -11.229 -0.260 -8.040 1.00 0.00 O ATOM 526 CB HIS A 33 -10.240 1.935 -6.084 1.00 0.00 C ATOM 527 CG HIS A 33 -11.443 1.293 -5.437 1.00 0.00 C ATOM 528 ND1 HIS A 33 -11.347 0.426 -4.369 1.00 0.00 N ATOM 529 CD2 HIS A 33 -12.772 1.416 -5.693 1.00 0.00 C ATOM 530 CE1 HIS A 33 -12.557 0.048 -3.998 1.00 0.00 C ATOM 531 NE2 HIS A 33 -13.437 0.634 -4.784 1.00 0.00 N ATOM 0 H HIS A 33 -12.159 2.004 -8.421 1.00 0.00 H new ATOM 0 HA HIS A 33 -9.320 2.365 -7.988 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -9.340 1.447 -5.709 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -10.191 2.978 -5.772 1.00 0.00 H new ATOM 0 HD1 HIS A 33 -10.476 0.123 -3.933 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -13.221 2.018 -6.469 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -12.786 -0.627 -3.187 1.00 0.00 H new ATOM 540 N LYS A 34 -9.056 -0.027 -8.570 1.00 0.00 N ATOM 541 CA LYS A 34 -8.907 -1.408 -9.015 1.00 0.00 C ATOM 542 C LYS A 34 -7.440 -1.832 -9.025 1.00 0.00 C ATOM 543 O LYS A 34 -6.554 -1.019 -9.293 1.00 0.00 O ATOM 544 CB LYS A 34 -9.500 -1.602 -10.412 1.00 0.00 C ATOM 545 CG LYS A 34 -8.910 -0.676 -11.468 1.00 0.00 C ATOM 546 CD LYS A 34 -8.950 -1.317 -12.844 1.00 0.00 C ATOM 547 CE LYS A 34 -10.353 -1.756 -13.218 1.00 0.00 C ATOM 548 NZ LYS A 34 -10.348 -2.650 -14.402 1.00 0.00 N ATOM 0 H LYS A 34 -8.211 0.538 -8.655 1.00 0.00 H new ATOM 0 HA LYS A 34 -9.450 -2.033 -8.306 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -9.344 -2.635 -10.722 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.577 -1.442 -10.364 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -9.465 0.262 -11.484 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -7.880 -0.432 -11.207 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.580 -0.609 -13.586 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.282 -2.178 -12.864 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -10.811 -2.272 -12.374 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -10.966 -0.879 -13.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -11.323 -2.930 -14.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -9.934 -2.149 -15.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -9.783 -3.498 -14.194 1.00 0.00 H new ATOM 562 N HIS A 35 -7.208 -3.106 -8.708 1.00 0.00 N ATOM 563 CA HIS A 35 -5.875 -3.718 -8.747 1.00 0.00 C ATOM 564 C HIS A 35 -5.938 -5.141 -8.202 1.00 0.00 C ATOM 565 O HIS A 35 -6.940 -5.534 -7.610 1.00 0.00 O ATOM 566 CB HIS A 35 -4.837 -2.909 -7.947 1.00 0.00 C ATOM 567 CG HIS A 35 -5.206 -2.648 -6.513 1.00 0.00 C ATOM 568 ND1 HIS A 35 -5.030 -3.570 -5.503 1.00 0.00 N ATOM 569 CD2 HIS A 35 -5.723 -1.546 -5.920 1.00 0.00 C ATOM 570 CE1 HIS A 35 -5.417 -3.050 -4.356 1.00 0.00 C ATOM 571 NE2 HIS A 35 -5.843 -1.821 -4.580 1.00 0.00 N ATOM 0 H HIS A 35 -7.944 -3.749 -8.415 1.00 0.00 H new ATOM 0 HA HIS A 35 -5.557 -3.729 -9.789 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -3.886 -3.441 -7.971 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -4.680 -1.953 -8.446 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -4.657 -4.511 -5.625 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -5.991 -0.622 -6.410 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.390 -3.545 -3.396 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -6.203 -1.180 -3.873 1.00 0.00 H new ATOM 580 N GLY A 36 -4.862 -5.905 -8.397 1.00 0.00 N ATOM 581 CA GLY A 36 -4.782 -7.244 -7.828 1.00 0.00 C ATOM 582 C GLY A 36 -4.674 -7.208 -6.315 1.00 0.00 C ATOM 583 O GLY A 36 -4.702 -6.130 -5.726 1.00 0.00 O ATOM 0 H GLY A 36 -4.045 -5.621 -8.938 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -5.665 -7.815 -8.116 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.918 -7.764 -8.242 1.00 0.00 H new ATOM 587 N GLN A 37 -4.542 -8.371 -5.682 1.00 0.00 N ATOM 588 CA GLN A 37 -4.493 -8.442 -4.222 1.00 0.00 C ATOM 589 C GLN A 37 -3.335 -7.623 -3.648 1.00 0.00 C ATOM 590 O GLN A 37 -3.510 -6.458 -3.292 1.00 0.00 O ATOM 591 CB GLN A 37 -4.390 -9.894 -3.744 1.00 0.00 C ATOM 592 CG GLN A 37 -5.655 -10.710 -3.966 1.00 0.00 C ATOM 593 CD GLN A 37 -5.553 -12.110 -3.389 1.00 0.00 C ATOM 594 OE1 GLN A 37 -5.127 -13.043 -4.068 1.00 0.00 O ATOM 595 NE2 GLN A 37 -5.947 -12.272 -2.135 1.00 0.00 N ATOM 0 H GLN A 37 -4.467 -9.273 -6.153 1.00 0.00 H new ATOM 0 HA GLN A 37 -5.425 -8.013 -3.855 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -3.562 -10.378 -4.262 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -4.148 -9.900 -2.681 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.501 -10.194 -3.511 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -5.858 -10.775 -5.035 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.295 -11.474 -1.603 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -5.903 -13.194 -1.702 1.00 0.00 H new ATOM 604 N PHE A 38 -2.155 -8.227 -3.585 1.00 0.00 N ATOM 605 CA PHE A 38 -1.003 -7.586 -2.963 1.00 0.00 C ATOM 606 C PHE A 38 -0.258 -6.718 -3.971 1.00 0.00 C ATOM 607 O PHE A 38 0.310 -7.228 -4.937 1.00 0.00 O ATOM 608 CB PHE A 38 -0.053 -8.642 -2.390 1.00 0.00 C ATOM 609 CG PHE A 38 -0.686 -9.574 -1.388 1.00 0.00 C ATOM 610 CD1 PHE A 38 -0.741 -9.239 -0.046 1.00 0.00 C ATOM 611 CD2 PHE A 38 -1.214 -10.790 -1.794 1.00 0.00 C ATOM 612 CE1 PHE A 38 -1.312 -10.097 0.874 1.00 0.00 C ATOM 613 CE2 PHE A 38 -1.786 -11.651 -0.877 1.00 0.00 C ATOM 614 CZ PHE A 38 -1.836 -11.304 0.458 1.00 0.00 C ATOM 0 H PHE A 38 -1.970 -9.159 -3.957 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.364 -6.951 -2.154 1.00 0.00 H new ATOM 0 HB2 PHE A 38 0.352 -9.233 -3.212 1.00 0.00 H new ATOM 0 HB3 PHE A 38 0.789 -8.137 -1.916 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -0.333 -8.296 0.286 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.178 -11.067 -2.837 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -1.348 -9.823 1.918 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.194 -12.596 -1.205 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.284 -11.976 1.175 1.00 0.00 H new ATOM 624 N ILE A 39 -0.258 -5.409 -3.744 1.00 0.00 N ATOM 625 CA ILE A 39 0.381 -4.474 -4.666 1.00 0.00 C ATOM 626 C ILE A 39 1.361 -3.559 -3.933 1.00 0.00 C ATOM 627 O ILE A 39 1.022 -2.968 -2.905 1.00 0.00 O ATOM 628 CB ILE A 39 -0.671 -3.604 -5.395 1.00 0.00 C ATOM 629 CG1 ILE A 39 -1.675 -4.479 -6.158 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.003 -2.621 -6.341 1.00 0.00 C ATOM 631 CD1 ILE A 39 -1.050 -5.335 -7.243 1.00 0.00 C ATOM 0 H ILE A 39 -0.692 -4.971 -2.932 1.00 0.00 H new ATOM 0 HA ILE A 39 0.926 -5.070 -5.398 1.00 0.00 H new ATOM 0 HB ILE A 39 -1.217 -3.038 -4.640 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.188 -5.128 -5.448 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -2.432 -3.837 -6.608 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.756 -2.020 -6.842 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.667 -1.968 -5.775 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.581 -3.170 -7.085 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -1.825 -5.923 -7.734 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.561 -4.693 -7.976 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.313 -6.005 -6.799 1.00 0.00 H new ATOM 643 N TYR A 40 2.576 -3.452 -4.461 1.00 0.00 N ATOM 644 CA TYR A 40 3.582 -2.546 -3.919 1.00 0.00 C ATOM 645 C TYR A 40 3.983 -1.525 -4.985 1.00 0.00 C ATOM 646 O TYR A 40 4.341 -1.897 -6.107 1.00 0.00 O ATOM 647 CB TYR A 40 4.816 -3.335 -3.461 1.00 0.00 C ATOM 648 CG TYR A 40 5.699 -2.590 -2.478 1.00 0.00 C ATOM 649 CD1 TYR A 40 6.491 -1.522 -2.879 1.00 0.00 C ATOM 650 CD2 TYR A 40 5.736 -2.964 -1.143 1.00 0.00 C ATOM 651 CE1 TYR A 40 7.290 -0.848 -1.973 1.00 0.00 C ATOM 652 CE2 TYR A 40 6.533 -2.297 -0.233 1.00 0.00 C ATOM 653 CZ TYR A 40 7.307 -1.240 -0.651 1.00 0.00 C ATOM 654 OH TYR A 40 8.090 -0.565 0.254 1.00 0.00 O ATOM 0 H TYR A 40 2.889 -3.987 -5.271 1.00 0.00 H new ATOM 0 HA TYR A 40 3.162 -2.024 -3.059 1.00 0.00 H new ATOM 0 HB2 TYR A 40 4.488 -4.268 -3.003 1.00 0.00 H new ATOM 0 HB3 TYR A 40 5.409 -3.601 -4.336 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.483 -1.213 -3.914 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.130 -3.793 -0.808 1.00 0.00 H new ATOM 0 HE1 TYR A 40 7.898 -0.018 -2.300 1.00 0.00 H new ATOM 0 HE2 TYR A 40 6.548 -2.604 0.802 1.00 0.00 H new ATOM 0 HH TYR A 40 8.296 -1.153 1.011 1.00 0.00 H new ATOM 664 N VAL A 41 3.911 -0.246 -4.641 1.00 0.00 N ATOM 665 CA VAL A 41 4.272 0.818 -5.574 1.00 0.00 C ATOM 666 C VAL A 41 5.279 1.789 -4.951 1.00 0.00 C ATOM 667 O VAL A 41 4.961 2.526 -4.022 1.00 0.00 O ATOM 668 CB VAL A 41 3.028 1.599 -6.066 1.00 0.00 C ATOM 669 CG1 VAL A 41 2.195 0.741 -7.004 1.00 0.00 C ATOM 670 CG2 VAL A 41 2.174 2.069 -4.897 1.00 0.00 C ATOM 0 H VAL A 41 3.607 0.082 -3.724 1.00 0.00 H new ATOM 0 HA VAL A 41 4.736 0.334 -6.434 1.00 0.00 H new ATOM 0 HB VAL A 41 3.382 2.477 -6.607 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.326 1.307 -7.339 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.797 0.456 -7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.864 -0.156 -6.480 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.309 2.614 -5.274 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.837 1.206 -4.322 1.00 0.00 H new ATOM 0 HG23 VAL A 41 2.764 2.724 -4.256 1.00 0.00 H new ATOM 680 N TRP A 42 6.497 1.791 -5.478 1.00 0.00 N ATOM 681 CA TRP A 42 7.573 2.613 -4.921 1.00 0.00 C ATOM 682 C TRP A 42 8.107 3.613 -5.946 1.00 0.00 C ATOM 683 O TRP A 42 9.115 4.275 -5.714 1.00 0.00 O ATOM 684 CB TRP A 42 8.712 1.712 -4.433 1.00 0.00 C ATOM 685 CG TRP A 42 9.311 0.855 -5.515 1.00 0.00 C ATOM 686 CD1 TRP A 42 8.823 -0.330 -5.986 1.00 0.00 C ATOM 687 CD2 TRP A 42 10.518 1.111 -6.250 1.00 0.00 C ATOM 688 NE1 TRP A 42 9.642 -0.817 -6.977 1.00 0.00 N ATOM 689 CE2 TRP A 42 10.690 0.048 -7.155 1.00 0.00 C ATOM 690 CE3 TRP A 42 11.467 2.140 -6.232 1.00 0.00 C ATOM 691 CZ2 TRP A 42 11.771 -0.015 -8.036 1.00 0.00 C ATOM 692 CZ3 TRP A 42 12.537 2.076 -7.105 1.00 0.00 C ATOM 693 CH2 TRP A 42 12.681 1.005 -7.994 1.00 0.00 C ATOM 0 H TRP A 42 6.768 1.235 -6.289 1.00 0.00 H new ATOM 0 HA TRP A 42 7.164 3.179 -4.084 1.00 0.00 H new ATOM 0 HB2 TRP A 42 9.495 2.334 -3.999 1.00 0.00 H new ATOM 0 HB3 TRP A 42 8.338 1.068 -3.637 1.00 0.00 H new ATOM 0 HD1 TRP A 42 7.925 -0.814 -5.632 1.00 0.00 H new ATOM 0 HE1 TRP A 42 9.494 -1.682 -7.496 1.00 0.00 H new ATOM 0 HE3 TRP A 42 11.365 2.969 -5.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 11.884 -0.839 -8.725 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 13.274 2.866 -7.101 1.00 0.00 H new ATOM 0 HH2 TRP A 42 13.530 0.983 -8.662 1.00 0.00 H new ATOM 704 N GLY A 43 7.410 3.739 -7.068 1.00 0.00 N ATOM 705 CA GLY A 43 7.895 4.572 -8.159 1.00 0.00 C ATOM 706 C GLY A 43 7.936 6.053 -7.819 1.00 0.00 C ATOM 707 O GLY A 43 8.712 6.805 -8.411 1.00 0.00 O ATOM 0 H GLY A 43 6.516 3.280 -7.245 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.896 4.244 -8.439 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.256 4.425 -9.030 1.00 0.00 H new ATOM 711 N GLU A 44 7.115 6.456 -6.849 1.00 0.00 N ATOM 712 CA GLU A 44 6.970 7.862 -6.465 1.00 0.00 C ATOM 713 C GLU A 44 6.400 8.697 -7.609 1.00 0.00 C ATOM 714 O GLU A 44 7.145 9.283 -8.391 1.00 0.00 O ATOM 715 CB GLU A 44 8.303 8.477 -6.011 1.00 0.00 C ATOM 716 CG GLU A 44 8.893 7.859 -4.755 1.00 0.00 C ATOM 717 CD GLU A 44 10.134 8.595 -4.288 1.00 0.00 C ATOM 718 OE1 GLU A 44 9.991 9.602 -3.562 1.00 0.00 O ATOM 719 OE2 GLU A 44 11.255 8.188 -4.653 1.00 0.00 O ATOM 0 H GLU A 44 6.532 5.818 -6.307 1.00 0.00 H new ATOM 0 HA GLU A 44 6.275 7.877 -5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.026 8.381 -6.821 1.00 0.00 H new ATOM 0 HB3 GLU A 44 8.156 9.543 -5.840 1.00 0.00 H new ATOM 0 HG2 GLU A 44 8.146 7.868 -3.961 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.141 6.815 -4.947 1.00 0.00 H new ATOM 726 N GLU A 45 5.081 8.741 -7.710 1.00 0.00 N ATOM 727 CA GLU A 45 4.432 9.591 -8.696 1.00 0.00 C ATOM 728 C GLU A 45 4.148 10.952 -8.079 1.00 0.00 C ATOM 729 O GLU A 45 3.817 11.040 -6.895 1.00 0.00 O ATOM 730 CB GLU A 45 3.143 8.940 -9.213 1.00 0.00 C ATOM 731 CG GLU A 45 2.473 9.720 -10.335 1.00 0.00 C ATOM 732 CD GLU A 45 1.429 8.910 -11.079 1.00 0.00 C ATOM 733 OE1 GLU A 45 0.264 8.862 -10.628 1.00 0.00 O ATOM 734 OE2 GLU A 45 1.768 8.324 -12.127 1.00 0.00 O ATOM 0 H GLU A 45 4.442 8.202 -7.126 1.00 0.00 H new ATOM 0 HA GLU A 45 5.097 9.721 -9.550 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.371 7.934 -9.567 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.441 8.836 -8.385 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.005 10.612 -9.920 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.233 10.057 -11.040 1.00 0.00 H new ATOM 741 N GLY A 46 4.293 12.003 -8.880 1.00 0.00 N ATOM 742 CA GLY A 46 4.149 13.363 -8.381 1.00 0.00 C ATOM 743 C GLY A 46 2.834 13.604 -7.665 1.00 0.00 C ATOM 744 O GLY A 46 2.820 14.079 -6.530 1.00 0.00 O ATOM 0 H GLY A 46 4.510 11.938 -9.875 1.00 0.00 H new ATOM 0 HA2 GLY A 46 4.971 13.581 -7.699 1.00 0.00 H new ATOM 0 HA3 GLY A 46 4.233 14.059 -9.215 1.00 0.00 H new ATOM 748 N ALA A 47 1.730 13.273 -8.316 1.00 0.00 N ATOM 749 CA ALA A 47 0.410 13.482 -7.731 1.00 0.00 C ATOM 750 C ALA A 47 -0.067 12.248 -6.971 1.00 0.00 C ATOM 751 O ALA A 47 -1.224 12.179 -6.550 1.00 0.00 O ATOM 752 CB ALA A 47 -0.589 13.846 -8.818 1.00 0.00 C ATOM 0 H ALA A 47 1.719 12.859 -9.248 1.00 0.00 H new ATOM 0 HA ALA A 47 0.485 14.304 -7.019 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.572 14.000 -8.372 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -0.268 14.762 -9.315 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.644 13.038 -9.547 1.00 0.00 H new ATOM 758 N GLY A 48 0.827 11.290 -6.771 1.00 0.00 N ATOM 759 CA GLY A 48 0.439 10.043 -6.146 1.00 0.00 C ATOM 760 C GLY A 48 1.420 9.576 -5.091 1.00 0.00 C ATOM 761 O GLY A 48 1.737 8.387 -5.012 1.00 0.00 O ATOM 0 H GLY A 48 1.812 11.354 -7.030 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -0.545 10.162 -5.692 1.00 0.00 H new ATOM 0 HA3 GLY A 48 0.345 9.273 -6.912 1.00 0.00 H new ATOM 765 N LYS A 49 1.896 10.496 -4.266 1.00 0.00 N ATOM 766 CA LYS A 49 2.805 10.141 -3.184 1.00 0.00 C ATOM 767 C LYS A 49 2.027 9.671 -1.961 1.00 0.00 C ATOM 768 O LYS A 49 1.683 10.470 -1.087 1.00 0.00 O ATOM 769 CB LYS A 49 3.723 11.314 -2.817 1.00 0.00 C ATOM 770 CG LYS A 49 5.113 11.204 -3.419 1.00 0.00 C ATOM 771 CD LYS A 49 5.996 12.370 -3.008 1.00 0.00 C ATOM 772 CE LYS A 49 7.448 12.116 -3.376 1.00 0.00 C ATOM 773 NZ LYS A 49 8.054 11.034 -2.549 1.00 0.00 N ATOM 0 H LYS A 49 1.670 11.489 -4.323 1.00 0.00 H new ATOM 0 HA LYS A 49 3.433 9.322 -3.534 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.263 12.244 -3.151 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.809 11.373 -1.732 1.00 0.00 H new ATOM 0 HG2 LYS A 49 5.574 10.269 -3.102 1.00 0.00 H new ATOM 0 HG3 LYS A 49 5.037 11.170 -4.506 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.649 13.282 -3.495 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.913 12.531 -1.933 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.513 11.846 -4.430 1.00 0.00 H new ATOM 0 HE3 LYS A 49 8.021 13.035 -3.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.753 11.445 -1.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.309 10.557 -2.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 8.524 10.344 -3.170 1.00 0.00 H new ATOM 787 N SER A 50 1.695 8.377 -1.961 1.00 0.00 N ATOM 788 CA SER A 50 1.020 7.718 -0.838 1.00 0.00 C ATOM 789 C SER A 50 -0.429 8.203 -0.666 1.00 0.00 C ATOM 790 O SER A 50 -1.165 7.701 0.184 1.00 0.00 O ATOM 791 CB SER A 50 1.822 7.920 0.454 1.00 0.00 C ATOM 792 OG SER A 50 3.150 7.438 0.304 1.00 0.00 O ATOM 0 H SER A 50 1.888 7.753 -2.744 1.00 0.00 H new ATOM 0 HA SER A 50 0.972 6.652 -1.062 1.00 0.00 H new ATOM 0 HB2 SER A 50 1.842 8.978 0.713 1.00 0.00 H new ATOM 0 HB3 SER A 50 1.332 7.399 1.277 1.00 0.00 H new ATOM 0 HG SER A 50 3.210 6.527 0.661 1.00 0.00 H new ATOM 798 N HIS A 51 -0.843 9.155 -1.495 1.00 0.00 N ATOM 799 CA HIS A 51 -2.191 9.709 -1.421 1.00 0.00 C ATOM 800 C HIS A 51 -3.216 8.710 -1.954 1.00 0.00 C ATOM 801 O HIS A 51 -4.346 8.652 -1.471 1.00 0.00 O ATOM 802 CB HIS A 51 -2.270 11.028 -2.205 1.00 0.00 C ATOM 803 CG HIS A 51 -3.487 11.857 -1.901 1.00 0.00 C ATOM 804 ND1 HIS A 51 -3.933 12.864 -2.727 1.00 0.00 N ATOM 805 CD2 HIS A 51 -4.337 11.841 -0.845 1.00 0.00 C ATOM 806 CE1 HIS A 51 -5.001 13.430 -2.195 1.00 0.00 C ATOM 807 NE2 HIS A 51 -5.271 12.830 -1.050 1.00 0.00 N ATOM 0 H HIS A 51 -0.262 9.561 -2.229 1.00 0.00 H new ATOM 0 HA HIS A 51 -2.422 9.910 -0.375 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -1.380 11.619 -1.990 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -2.254 10.804 -3.272 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -4.290 11.173 0.003 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -5.561 14.248 -2.625 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -6.042 13.061 -0.423 1.00 0.00 H new ATOM 816 N LEU A 52 -2.810 7.923 -2.947 1.00 0.00 N ATOM 817 CA LEU A 52 -3.706 6.962 -3.589 1.00 0.00 C ATOM 818 C LEU A 52 -4.163 5.864 -2.621 1.00 0.00 C ATOM 819 O LEU A 52 -5.240 5.295 -2.791 1.00 0.00 O ATOM 820 CB LEU A 52 -3.038 6.355 -4.834 1.00 0.00 C ATOM 821 CG LEU A 52 -1.716 5.618 -4.598 1.00 0.00 C ATOM 822 CD1 LEU A 52 -1.955 4.137 -4.330 1.00 0.00 C ATOM 823 CD2 LEU A 52 -0.788 5.803 -5.787 1.00 0.00 C ATOM 0 H LEU A 52 -1.863 7.931 -3.326 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.600 7.503 -3.900 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -3.740 5.661 -5.296 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -2.861 7.155 -5.553 1.00 0.00 H new ATOM 0 HG LEU A 52 -1.241 6.046 -3.715 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.000 3.638 -4.166 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -2.580 4.024 -3.444 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -2.456 3.688 -5.188 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.147 5.274 -5.604 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.262 5.404 -6.684 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.583 6.864 -5.927 1.00 0.00 H new ATOM 835 N LEU A 53 -3.350 5.570 -1.605 1.00 0.00 N ATOM 836 CA LEU A 53 -3.720 4.566 -0.607 1.00 0.00 C ATOM 837 C LEU A 53 -4.936 5.035 0.186 1.00 0.00 C ATOM 838 O LEU A 53 -5.829 4.251 0.505 1.00 0.00 O ATOM 839 CB LEU A 53 -2.560 4.275 0.355 1.00 0.00 C ATOM 840 CG LEU A 53 -1.379 3.487 -0.228 1.00 0.00 C ATOM 841 CD1 LEU A 53 -0.489 4.377 -1.083 1.00 0.00 C ATOM 842 CD2 LEU A 53 -0.575 2.842 0.890 1.00 0.00 C ATOM 0 H LEU A 53 -2.441 6.007 -1.452 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.962 3.646 -1.139 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.184 5.225 0.736 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -2.953 3.722 1.209 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.779 2.703 -0.871 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.338 3.789 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.071 4.789 -1.907 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -0.096 5.191 -0.474 1.00 0.00 H new ATOM 0 HD21 LEU A 53 0.260 2.286 0.464 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -0.193 3.615 1.557 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -1.215 2.162 1.452 1.00 0.00 H new ATOM 854 N GLN A 54 -4.960 6.327 0.480 1.00 0.00 N ATOM 855 CA GLN A 54 -6.060 6.944 1.206 1.00 0.00 C ATOM 856 C GLN A 54 -7.344 6.850 0.389 1.00 0.00 C ATOM 857 O GLN A 54 -8.409 6.520 0.914 1.00 0.00 O ATOM 858 CB GLN A 54 -5.714 8.407 1.491 1.00 0.00 C ATOM 859 CG GLN A 54 -6.764 9.168 2.282 1.00 0.00 C ATOM 860 CD GLN A 54 -6.342 10.596 2.565 1.00 0.00 C ATOM 861 OE1 GLN A 54 -5.042 10.821 2.701 1.00 0.00 O flip ATOM 862 NE2 GLN A 54 -7.176 11.494 2.659 1.00 0.00 N flip ATOM 0 H GLN A 54 -4.217 6.977 0.222 1.00 0.00 H new ATOM 0 HA GLN A 54 -6.216 6.421 2.149 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -4.771 8.443 2.037 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -5.552 8.919 0.542 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -7.703 9.171 1.728 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -6.952 8.653 3.224 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -8.168 11.283 2.548 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -6.876 12.451 2.848 1.00 0.00 H new ATOM 871 N ALA A 55 -7.217 7.125 -0.904 1.00 0.00 N ATOM 872 CA ALA A 55 -8.343 7.067 -1.825 1.00 0.00 C ATOM 873 C ALA A 55 -8.919 5.658 -1.897 1.00 0.00 C ATOM 874 O ALA A 55 -10.136 5.466 -1.852 1.00 0.00 O ATOM 875 CB ALA A 55 -7.904 7.529 -3.205 1.00 0.00 C ATOM 0 H ALA A 55 -6.335 7.393 -1.341 1.00 0.00 H new ATOM 0 HA ALA A 55 -9.125 7.731 -1.456 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -8.750 7.484 -3.890 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.539 8.554 -3.146 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -7.107 6.881 -3.569 1.00 0.00 H new ATOM 881 N TRP A 56 -8.029 4.675 -1.997 1.00 0.00 N ATOM 882 CA TRP A 56 -8.425 3.278 -2.102 1.00 0.00 C ATOM 883 C TRP A 56 -9.245 2.848 -0.886 1.00 0.00 C ATOM 884 O TRP A 56 -10.276 2.183 -1.022 1.00 0.00 O ATOM 885 CB TRP A 56 -7.180 2.398 -2.241 1.00 0.00 C ATOM 886 CG TRP A 56 -7.488 0.936 -2.319 1.00 0.00 C ATOM 887 CD1 TRP A 56 -8.161 0.296 -3.314 1.00 0.00 C ATOM 888 CD2 TRP A 56 -7.125 -0.069 -1.365 1.00 0.00 C ATOM 889 NE1 TRP A 56 -8.251 -1.044 -3.037 1.00 0.00 N ATOM 890 CE2 TRP A 56 -7.622 -1.295 -1.846 1.00 0.00 C ATOM 891 CE3 TRP A 56 -6.436 -0.053 -0.149 1.00 0.00 C ATOM 892 CZ2 TRP A 56 -7.444 -2.490 -1.160 1.00 0.00 C ATOM 893 CZ3 TRP A 56 -6.261 -1.242 0.531 1.00 0.00 C ATOM 894 CH2 TRP A 56 -6.765 -2.447 0.025 1.00 0.00 C ATOM 0 H TRP A 56 -7.020 4.825 -2.007 1.00 0.00 H new ATOM 0 HA TRP A 56 -9.050 3.160 -2.987 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -6.634 2.694 -3.136 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -6.521 2.578 -1.391 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -8.565 0.774 -4.194 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -8.711 -1.741 -3.623 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -6.048 0.872 0.251 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -7.829 -3.421 -1.550 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -5.726 -1.243 1.469 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -6.614 -3.360 0.582 1.00 0.00 H new ATOM 905 N VAL A 57 -8.783 3.241 0.292 1.00 0.00 N ATOM 906 CA VAL A 57 -9.449 2.883 1.538 1.00 0.00 C ATOM 907 C VAL A 57 -10.838 3.510 1.631 1.00 0.00 C ATOM 908 O VAL A 57 -11.808 2.832 1.959 1.00 0.00 O ATOM 909 CB VAL A 57 -8.598 3.296 2.759 1.00 0.00 C ATOM 910 CG1 VAL A 57 -9.367 3.130 4.063 1.00 0.00 C ATOM 911 CG2 VAL A 57 -7.317 2.478 2.804 1.00 0.00 C ATOM 0 H VAL A 57 -7.946 3.811 0.412 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.564 1.799 1.542 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.351 4.352 2.649 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.735 3.431 4.899 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -10.260 3.754 4.041 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.657 2.086 4.184 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -6.724 2.777 3.669 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.564 1.419 2.882 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.743 2.650 1.894 1.00 0.00 H new ATOM 921 N ALA A 58 -10.934 4.794 1.318 1.00 0.00 N ATOM 922 CA ALA A 58 -12.206 5.502 1.384 1.00 0.00 C ATOM 923 C ALA A 58 -13.235 4.875 0.449 1.00 0.00 C ATOM 924 O ALA A 58 -14.415 4.777 0.786 1.00 0.00 O ATOM 925 CB ALA A 58 -12.007 6.968 1.047 1.00 0.00 C ATOM 0 H ALA A 58 -10.147 5.368 1.016 1.00 0.00 H new ATOM 0 HA ALA A 58 -12.587 5.422 2.402 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -12.964 7.487 1.100 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -11.313 7.414 1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -11.601 7.058 0.040 1.00 0.00 H new ATOM 931 N GLN A 59 -12.778 4.440 -0.719 1.00 0.00 N ATOM 932 CA GLN A 59 -13.647 3.780 -1.682 1.00 0.00 C ATOM 933 C GLN A 59 -14.119 2.424 -1.166 1.00 0.00 C ATOM 934 O GLN A 59 -15.255 2.025 -1.409 1.00 0.00 O ATOM 935 CB GLN A 59 -12.932 3.612 -3.017 1.00 0.00 C ATOM 936 CG GLN A 59 -12.918 4.872 -3.863 1.00 0.00 C ATOM 937 CD GLN A 59 -14.285 5.210 -4.426 1.00 0.00 C ATOM 938 OE1 GLN A 59 -14.642 4.766 -5.516 1.00 0.00 O ATOM 939 NE2 GLN A 59 -15.066 5.982 -3.690 1.00 0.00 N ATOM 0 H GLN A 59 -11.808 4.533 -1.021 1.00 0.00 H new ATOM 0 HA GLN A 59 -14.524 4.412 -1.825 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -11.905 3.297 -2.832 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -13.414 2.812 -3.579 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -12.561 5.707 -3.260 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -12.212 4.747 -4.684 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -14.736 6.332 -2.791 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -15.999 6.228 -4.022 1.00 0.00 H new ATOM 948 N ALA A 60 -13.246 1.719 -0.459 1.00 0.00 N ATOM 949 CA ALA A 60 -13.608 0.439 0.133 1.00 0.00 C ATOM 950 C ALA A 60 -14.607 0.647 1.265 1.00 0.00 C ATOM 951 O ALA A 60 -15.518 -0.158 1.467 1.00 0.00 O ATOM 952 CB ALA A 60 -12.367 -0.279 0.634 1.00 0.00 C ATOM 0 H ALA A 60 -12.285 2.011 -0.282 1.00 0.00 H new ATOM 0 HA ALA A 60 -14.078 -0.182 -0.629 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -12.652 -1.234 1.074 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -11.686 -0.452 -0.199 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.871 0.334 1.387 1.00 0.00 H new ATOM 958 N LEU A 61 -14.435 1.746 1.987 1.00 0.00 N ATOM 959 CA LEU A 61 -15.363 2.140 3.036 1.00 0.00 C ATOM 960 C LEU A 61 -16.745 2.416 2.451 1.00 0.00 C ATOM 961 O LEU A 61 -17.765 2.022 3.022 1.00 0.00 O ATOM 962 CB LEU A 61 -14.833 3.384 3.761 1.00 0.00 C ATOM 963 CG LEU A 61 -13.568 3.162 4.593 1.00 0.00 C ATOM 964 CD1 LEU A 61 -13.089 4.474 5.193 1.00 0.00 C ATOM 965 CD2 LEU A 61 -13.824 2.138 5.691 1.00 0.00 C ATOM 0 H LEU A 61 -13.651 2.387 1.862 1.00 0.00 H new ATOM 0 HA LEU A 61 -15.451 1.323 3.752 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.631 4.158 3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.617 3.766 4.415 1.00 0.00 H new ATOM 0 HG LEU A 61 -12.788 2.777 3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -12.189 4.298 5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -12.867 5.180 4.393 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -13.867 4.886 5.835 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -12.914 1.993 6.273 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -14.619 2.497 6.345 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.123 1.191 5.242 1.00 0.00 H new ATOM 977 N GLU A 62 -16.772 3.078 1.300 1.00 0.00 N ATOM 978 CA GLU A 62 -18.023 3.376 0.613 1.00 0.00 C ATOM 979 C GLU A 62 -18.644 2.111 0.030 1.00 0.00 C ATOM 980 O GLU A 62 -19.848 2.054 -0.223 1.00 0.00 O ATOM 981 CB GLU A 62 -17.793 4.400 -0.494 1.00 0.00 C ATOM 982 CG GLU A 62 -17.375 5.758 0.028 1.00 0.00 C ATOM 983 CD GLU A 62 -17.077 6.745 -1.081 1.00 0.00 C ATOM 984 OE1 GLU A 62 -18.032 7.232 -1.724 1.00 0.00 O ATOM 985 OE2 GLU A 62 -15.888 7.048 -1.304 1.00 0.00 O ATOM 0 H GLU A 62 -15.938 3.420 0.822 1.00 0.00 H new ATOM 0 HA GLU A 62 -18.715 3.793 1.345 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -17.026 4.026 -1.172 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -18.708 4.508 -1.077 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -18.166 6.158 0.662 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -16.491 5.645 0.655 1.00 0.00 H new ATOM 992 N ALA A 63 -17.819 1.094 -0.174 1.00 0.00 N ATOM 993 CA ALA A 63 -18.294 -0.192 -0.668 1.00 0.00 C ATOM 994 C ALA A 63 -18.934 -1.003 0.453 1.00 0.00 C ATOM 995 O ALA A 63 -19.357 -2.144 0.248 1.00 0.00 O ATOM 996 CB ALA A 63 -17.154 -0.977 -1.296 1.00 0.00 C ATOM 0 H ALA A 63 -16.814 1.134 -0.005 1.00 0.00 H new ATOM 0 HA ALA A 63 -19.050 -0.001 -1.430 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -17.528 -1.934 -1.659 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -16.738 -0.411 -2.129 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -16.377 -1.150 -0.551 1.00 0.00 H new ATOM 1002 N GLY A 64 -18.988 -0.417 1.642 1.00 0.00 N ATOM 1003 CA GLY A 64 -19.588 -1.090 2.775 1.00 0.00 C ATOM 1004 C GLY A 64 -18.705 -2.200 3.292 1.00 0.00 C ATOM 1005 O GLY A 64 -19.188 -3.223 3.769 1.00 0.00 O ATOM 0 H GLY A 64 -18.625 0.515 1.841 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -19.772 -0.369 3.572 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -20.556 -1.499 2.485 1.00 0.00 H new ATOM 1009 N LYS A 65 -17.405 -2.000 3.169 1.00 0.00 N ATOM 1010 CA LYS A 65 -16.429 -2.961 3.626 1.00 0.00 C ATOM 1011 C LYS A 65 -15.516 -2.291 4.635 1.00 0.00 C ATOM 1012 O LYS A 65 -15.442 -1.064 4.688 1.00 0.00 O ATOM 1013 CB LYS A 65 -15.613 -3.476 2.441 1.00 0.00 C ATOM 1014 CG LYS A 65 -16.467 -4.001 1.297 1.00 0.00 C ATOM 1015 CD LYS A 65 -17.169 -5.291 1.676 1.00 0.00 C ATOM 1016 CE LYS A 65 -18.176 -5.705 0.618 1.00 0.00 C ATOM 1017 NZ LYS A 65 -19.401 -4.860 0.647 1.00 0.00 N ATOM 0 H LYS A 65 -17.000 -1.164 2.748 1.00 0.00 H new ATOM 0 HA LYS A 65 -16.934 -3.806 4.094 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -14.978 -2.671 2.070 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.951 -4.271 2.784 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -17.207 -3.250 1.020 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -15.840 -4.170 0.421 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -16.432 -6.083 1.808 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -17.676 -5.164 2.633 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -17.714 -5.638 -0.367 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -18.453 -6.748 0.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -20.108 -5.250 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.792 -4.848 1.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -19.160 -3.890 0.359 1.00 0.00 H new ATOM 1031 N ASN A 66 -14.828 -3.085 5.431 1.00 0.00 N ATOM 1032 CA ASN A 66 -13.916 -2.534 6.419 1.00 0.00 C ATOM 1033 C ASN A 66 -12.557 -2.312 5.786 1.00 0.00 C ATOM 1034 O ASN A 66 -12.020 -3.198 5.114 1.00 0.00 O ATOM 1035 CB ASN A 66 -13.782 -3.456 7.626 1.00 0.00 C ATOM 1036 CG ASN A 66 -13.310 -2.710 8.861 1.00 0.00 C ATOM 1037 OD1 ASN A 66 -13.509 -1.501 8.979 1.00 0.00 O ATOM 1038 ND2 ASN A 66 -12.698 -3.419 9.793 1.00 0.00 N ATOM 0 H ASN A 66 -14.880 -4.104 5.416 1.00 0.00 H new ATOM 0 HA ASN A 66 -14.321 -1.584 6.766 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -14.744 -3.926 7.832 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -13.079 -4.256 7.395 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.372 -2.966 10.647 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.551 -4.419 9.659 1.00 0.00 H new ATOM 1045 N ALA A 67 -12.000 -1.141 6.024 1.00 0.00 N ATOM 1046 CA ALA A 67 -10.749 -0.747 5.403 1.00 0.00 C ATOM 1047 C ALA A 67 -10.021 0.267 6.265 1.00 0.00 C ATOM 1048 O ALA A 67 -10.653 1.066 6.962 1.00 0.00 O ATOM 1049 CB ALA A 67 -11.007 -0.169 4.017 1.00 0.00 C ATOM 0 H ALA A 67 -12.398 -0.440 6.649 1.00 0.00 H new ATOM 0 HA ALA A 67 -10.120 -1.632 5.304 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -10.060 0.123 3.562 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -11.493 -0.920 3.394 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -11.653 0.705 4.102 1.00 0.00 H new ATOM 1055 N ALA A 68 -8.699 0.225 6.222 1.00 0.00 N ATOM 1056 CA ALA A 68 -7.884 1.155 6.984 1.00 0.00 C ATOM 1057 C ALA A 68 -6.484 1.280 6.396 1.00 0.00 C ATOM 1058 O ALA A 68 -5.858 0.281 6.037 1.00 0.00 O ATOM 1059 CB ALA A 68 -7.803 0.708 8.434 1.00 0.00 C ATOM 0 H ALA A 68 -8.167 -0.445 5.666 1.00 0.00 H new ATOM 0 HA ALA A 68 -8.357 2.136 6.934 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -7.190 1.411 8.998 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.805 0.676 8.862 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.356 -0.285 8.484 1.00 0.00 H new ATOM 1065 N TYR A 69 -5.999 2.510 6.291 1.00 0.00 N ATOM 1066 CA TYR A 69 -4.627 2.748 5.896 1.00 0.00 C ATOM 1067 C TYR A 69 -3.839 3.212 7.108 1.00 0.00 C ATOM 1068 O TYR A 69 -4.289 4.078 7.860 1.00 0.00 O ATOM 1069 CB TYR A 69 -4.524 3.766 4.746 1.00 0.00 C ATOM 1070 CG TYR A 69 -5.043 5.153 5.063 1.00 0.00 C ATOM 1071 CD1 TYR A 69 -6.398 5.445 4.990 1.00 0.00 C ATOM 1072 CD2 TYR A 69 -4.171 6.174 5.426 1.00 0.00 C ATOM 1073 CE1 TYR A 69 -6.870 6.711 5.270 1.00 0.00 C ATOM 1074 CE2 TYR A 69 -4.637 7.444 5.709 1.00 0.00 C ATOM 1075 CZ TYR A 69 -5.985 7.707 5.629 1.00 0.00 C ATOM 1076 OH TYR A 69 -6.454 8.969 5.907 1.00 0.00 O ATOM 0 H TYR A 69 -6.540 3.355 6.475 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.206 1.816 5.519 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -3.479 3.846 4.446 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.073 3.378 3.888 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.094 4.669 4.709 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -3.112 5.971 5.488 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -7.928 6.921 5.208 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -3.947 8.225 5.991 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.703 9.552 6.144 1.00 0.00 H new ATOM 1086 N ILE A 70 -2.694 2.599 7.320 1.00 0.00 N ATOM 1087 CA ILE A 70 -1.879 2.900 8.476 1.00 0.00 C ATOM 1088 C ILE A 70 -0.490 3.363 8.053 1.00 0.00 C ATOM 1089 O ILE A 70 0.206 2.679 7.294 1.00 0.00 O ATOM 1090 CB ILE A 70 -1.759 1.674 9.412 1.00 0.00 C ATOM 1091 CG1 ILE A 70 -3.151 1.220 9.873 1.00 0.00 C ATOM 1092 CG2 ILE A 70 -0.869 1.994 10.608 1.00 0.00 C ATOM 1093 CD1 ILE A 70 -3.130 -0.021 10.740 1.00 0.00 C ATOM 0 H ILE A 70 -2.306 1.886 6.703 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.371 3.705 9.022 1.00 0.00 H new ATOM 0 HB ILE A 70 -1.296 0.858 8.858 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.623 2.031 10.427 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.770 1.030 8.996 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.798 1.118 11.253 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.126 2.268 10.258 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -1.298 2.824 11.169 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.149 -0.282 11.027 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.688 -0.847 10.183 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.538 0.171 11.635 1.00 0.00 H new ATOM 1105 N ASP A 71 -0.108 4.537 8.525 1.00 0.00 N ATOM 1106 CA ASP A 71 1.230 5.056 8.307 1.00 0.00 C ATOM 1107 C ASP A 71 2.155 4.448 9.342 1.00 0.00 C ATOM 1108 O ASP A 71 2.105 4.814 10.512 1.00 0.00 O ATOM 1109 CB ASP A 71 1.259 6.583 8.432 1.00 0.00 C ATOM 1110 CG ASP A 71 0.631 7.301 7.256 1.00 0.00 C ATOM 1111 OD1 ASP A 71 -0.614 7.365 7.185 1.00 0.00 O ATOM 1112 OD2 ASP A 71 1.383 7.829 6.413 1.00 0.00 O ATOM 0 H ASP A 71 -0.713 5.154 9.067 1.00 0.00 H new ATOM 0 HA ASP A 71 1.552 4.794 7.299 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.739 6.874 9.344 1.00 0.00 H new ATOM 0 HB3 ASP A 71 2.293 6.911 8.537 1.00 0.00 H new ATOM 1117 N ALA A 72 2.989 3.512 8.917 1.00 0.00 N ATOM 1118 CA ALA A 72 3.880 2.797 9.833 1.00 0.00 C ATOM 1119 C ALA A 72 4.837 3.749 10.549 1.00 0.00 C ATOM 1120 O ALA A 72 5.427 3.402 11.572 1.00 0.00 O ATOM 1121 CB ALA A 72 4.654 1.728 9.082 1.00 0.00 C ATOM 0 H ALA A 72 3.072 3.225 7.942 1.00 0.00 H new ATOM 0 HA ALA A 72 3.263 2.321 10.595 1.00 0.00 H new ATOM 0 HB1 ALA A 72 5.313 1.203 9.773 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.956 1.019 8.637 1.00 0.00 H new ATOM 0 HB3 ALA A 72 5.249 2.194 8.296 1.00 0.00 H new ATOM 1127 N ALA A 73 4.989 4.949 10.007 1.00 0.00 N ATOM 1128 CA ALA A 73 5.830 5.960 10.624 1.00 0.00 C ATOM 1129 C ALA A 73 4.994 7.148 11.097 1.00 0.00 C ATOM 1130 O ALA A 73 5.409 8.304 10.968 1.00 0.00 O ATOM 1131 CB ALA A 73 6.907 6.413 9.649 1.00 0.00 C ATOM 0 H ALA A 73 4.540 5.245 9.140 1.00 0.00 H new ATOM 0 HA ALA A 73 6.313 5.522 11.497 1.00 0.00 H new ATOM 0 HB1 ALA A 73 7.531 7.171 10.123 1.00 0.00 H new ATOM 0 HB2 ALA A 73 7.524 5.560 9.366 1.00 0.00 H new ATOM 0 HB3 ALA A 73 6.439 6.833 8.759 1.00 0.00 H new ATOM 1137 N SER A 74 3.820 6.860 11.650 1.00 0.00 N ATOM 1138 CA SER A 74 2.936 7.902 12.166 1.00 0.00 C ATOM 1139 C SER A 74 1.840 7.301 13.051 1.00 0.00 C ATOM 1140 O SER A 74 1.384 7.932 14.004 1.00 0.00 O ATOM 1141 CB SER A 74 2.303 8.695 11.014 1.00 0.00 C ATOM 1142 OG SER A 74 1.571 9.811 11.492 1.00 0.00 O ATOM 0 H SER A 74 3.457 5.912 11.753 1.00 0.00 H new ATOM 0 HA SER A 74 3.538 8.580 12.771 1.00 0.00 H new ATOM 0 HB2 SER A 74 3.083 9.035 10.333 1.00 0.00 H new ATOM 0 HB3 SER A 74 1.643 8.043 10.442 1.00 0.00 H new ATOM 0 HG SER A 74 1.182 10.296 10.734 1.00 0.00 H new ATOM 1148 N MET A 75 1.411 6.091 12.723 1.00 0.00 N ATOM 1149 CA MET A 75 0.383 5.399 13.488 1.00 0.00 C ATOM 1150 C MET A 75 0.829 3.978 13.805 1.00 0.00 C ATOM 1151 O MET A 75 1.515 3.347 13.003 1.00 0.00 O ATOM 1152 CB MET A 75 -0.938 5.376 12.714 1.00 0.00 C ATOM 1153 CG MET A 75 -1.610 6.735 12.623 1.00 0.00 C ATOM 1154 SD MET A 75 -3.287 6.649 11.957 1.00 0.00 S ATOM 1155 CE MET A 75 -2.976 6.054 10.296 1.00 0.00 C ATOM 0 H MET A 75 1.763 5.563 11.924 1.00 0.00 H new ATOM 0 HA MET A 75 0.228 5.937 14.423 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.753 5.003 11.707 1.00 0.00 H new ATOM 0 HB3 MET A 75 -1.619 4.674 13.194 1.00 0.00 H new ATOM 0 HG2 MET A 75 -1.641 7.186 13.615 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.008 7.391 11.994 1.00 0.00 H new ATOM 0 HE1 MET A 75 -3.924 5.833 9.805 1.00 0.00 H new ATOM 0 HE2 MET A 75 -2.443 6.818 9.730 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.371 5.148 10.341 1.00 0.00 H new ATOM 1165 N PRO A 76 0.466 3.469 14.990 1.00 0.00 N ATOM 1166 CA PRO A 76 0.824 2.114 15.407 1.00 0.00 C ATOM 1167 C PRO A 76 -0.059 1.052 14.763 1.00 0.00 C ATOM 1168 O PRO A 76 -1.178 1.333 14.326 1.00 0.00 O ATOM 1169 CB PRO A 76 0.598 2.150 16.917 1.00 0.00 C ATOM 1170 CG PRO A 76 -0.494 3.144 17.106 1.00 0.00 C ATOM 1171 CD PRO A 76 -0.311 4.179 16.026 1.00 0.00 C ATOM 0 HA PRO A 76 1.840 1.849 15.113 1.00 0.00 H new ATOM 0 HB2 PRO A 76 0.313 1.170 17.299 1.00 0.00 H new ATOM 0 HB3 PRO A 76 1.503 2.448 17.447 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -1.472 2.668 17.028 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -0.439 3.599 18.095 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -1.268 4.528 15.640 1.00 0.00 H new ATOM 0 HD3 PRO A 76 0.222 5.055 16.397 1.00 0.00 H new ATOM 1179 N LEU A 77 0.445 -0.170 14.708 1.00 0.00 N ATOM 1180 CA LEU A 77 -0.315 -1.279 14.153 1.00 0.00 C ATOM 1181 C LEU A 77 -1.049 -2.003 15.276 1.00 0.00 C ATOM 1182 O LEU A 77 -0.528 -2.129 16.383 1.00 0.00 O ATOM 1183 CB LEU A 77 0.621 -2.235 13.405 1.00 0.00 C ATOM 1184 CG LEU A 77 -0.059 -3.384 12.655 1.00 0.00 C ATOM 1185 CD1 LEU A 77 -1.090 -2.851 11.670 1.00 0.00 C ATOM 1186 CD2 LEU A 77 0.982 -4.218 11.924 1.00 0.00 C ATOM 0 H LEU A 77 1.376 -0.419 15.041 1.00 0.00 H new ATOM 0 HA LEU A 77 -1.050 -0.900 13.443 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.206 -1.656 12.690 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.324 -2.660 14.122 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.573 -4.013 13.382 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.560 -3.685 11.149 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.850 -2.285 12.209 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -0.599 -2.201 10.946 1.00 0.00 H new ATOM 0 HD21 LEU A 77 0.489 -5.033 11.394 1.00 0.00 H new ATOM 0 HD22 LEU A 77 1.515 -3.590 11.210 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.689 -4.630 12.644 1.00 0.00 H new ATOM 1198 N THR A 78 -2.251 -2.478 14.989 1.00 0.00 N ATOM 1199 CA THR A 78 -3.088 -3.094 16.002 1.00 0.00 C ATOM 1200 C THR A 78 -3.809 -4.318 15.446 1.00 0.00 C ATOM 1201 O THR A 78 -3.979 -4.450 14.231 1.00 0.00 O ATOM 1202 CB THR A 78 -4.116 -2.082 16.553 1.00 0.00 C ATOM 1203 OG1 THR A 78 -4.564 -1.219 15.496 1.00 0.00 O ATOM 1204 CG2 THR A 78 -3.522 -1.243 17.676 1.00 0.00 C ATOM 0 H THR A 78 -2.668 -2.448 14.059 1.00 0.00 H new ATOM 0 HA THR A 78 -2.439 -3.415 16.817 1.00 0.00 H new ATOM 0 HB THR A 78 -4.959 -2.644 16.955 1.00 0.00 H new ATOM 0 HG1 THR A 78 -5.217 -0.580 15.850 1.00 0.00 H new ATOM 0 HG21 THR A 78 -4.272 -0.541 18.041 1.00 0.00 H new ATOM 0 HG22 THR A 78 -3.208 -1.896 18.491 1.00 0.00 H new ATOM 0 HG23 THR A 78 -2.660 -0.691 17.301 1.00 0.00 H new ATOM 1212 N ASP A 79 -4.223 -5.207 16.342 1.00 0.00 N ATOM 1213 CA ASP A 79 -4.910 -6.441 15.966 1.00 0.00 C ATOM 1214 C ASP A 79 -6.300 -6.151 15.406 1.00 0.00 C ATOM 1215 O ASP A 79 -6.926 -7.021 14.803 1.00 0.00 O ATOM 1216 CB ASP A 79 -5.017 -7.392 17.166 1.00 0.00 C ATOM 1217 CG ASP A 79 -5.953 -6.886 18.249 1.00 0.00 C ATOM 1218 OD1 ASP A 79 -5.516 -6.068 19.086 1.00 0.00 O ATOM 1219 OD2 ASP A 79 -7.132 -7.302 18.271 1.00 0.00 O ATOM 0 H ASP A 79 -4.093 -5.095 17.347 1.00 0.00 H new ATOM 0 HA ASP A 79 -4.318 -6.922 15.187 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -5.365 -8.365 16.820 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.025 -7.541 17.593 1.00 0.00 H new ATOM 1224 N ALA A 80 -6.777 -4.929 15.609 1.00 0.00 N ATOM 1225 CA ALA A 80 -8.043 -4.487 15.030 1.00 0.00 C ATOM 1226 C ALA A 80 -8.009 -4.603 13.506 1.00 0.00 C ATOM 1227 O ALA A 80 -9.045 -4.761 12.864 1.00 0.00 O ATOM 1228 CB ALA A 80 -8.347 -3.055 15.449 1.00 0.00 C ATOM 0 H ALA A 80 -6.305 -4.222 16.173 1.00 0.00 H new ATOM 0 HA ALA A 80 -8.836 -5.134 15.404 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -9.294 -2.740 15.009 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -8.416 -3.001 16.535 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -7.550 -2.397 15.102 1.00 0.00 H new ATOM 1234 N ALA A 81 -6.803 -4.541 12.941 1.00 0.00 N ATOM 1235 CA ALA A 81 -6.610 -4.646 11.496 1.00 0.00 C ATOM 1236 C ALA A 81 -7.123 -5.978 10.949 1.00 0.00 C ATOM 1237 O ALA A 81 -7.420 -6.090 9.764 1.00 0.00 O ATOM 1238 CB ALA A 81 -5.137 -4.467 11.153 1.00 0.00 C ATOM 0 H ALA A 81 -5.939 -4.417 13.468 1.00 0.00 H new ATOM 0 HA ALA A 81 -7.191 -3.853 11.025 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -5.002 -4.547 10.074 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -4.802 -3.486 11.489 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -4.551 -5.240 11.650 1.00 0.00 H new ATOM 1244 N PHE A 82 -7.235 -6.983 11.818 1.00 0.00 N ATOM 1245 CA PHE A 82 -7.735 -8.293 11.409 1.00 0.00 C ATOM 1246 C PHE A 82 -9.226 -8.238 11.098 1.00 0.00 C ATOM 1247 O PHE A 82 -9.764 -9.129 10.443 1.00 0.00 O ATOM 1248 CB PHE A 82 -7.468 -9.342 12.493 1.00 0.00 C ATOM 1249 CG PHE A 82 -6.025 -9.746 12.598 1.00 0.00 C ATOM 1250 CD1 PHE A 82 -5.498 -10.691 11.731 1.00 0.00 C ATOM 1251 CD2 PHE A 82 -5.199 -9.190 13.561 1.00 0.00 C ATOM 1252 CE1 PHE A 82 -4.175 -11.070 11.823 1.00 0.00 C ATOM 1253 CE2 PHE A 82 -3.875 -9.569 13.658 1.00 0.00 C ATOM 1254 CZ PHE A 82 -3.364 -10.510 12.787 1.00 0.00 C ATOM 0 H PHE A 82 -6.987 -6.914 12.805 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.201 -8.580 10.503 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -7.798 -8.950 13.455 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -8.070 -10.227 12.286 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.130 -11.135 10.976 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.595 -8.452 14.243 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.775 -11.805 11.140 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.240 -9.130 14.414 1.00 0.00 H new ATOM 0 HZ PHE A 82 -2.328 -10.808 12.861 1.00 0.00 H new ATOM 1264 N GLU A 83 -9.890 -7.194 11.574 1.00 0.00 N ATOM 1265 CA GLU A 83 -11.303 -7.004 11.301 1.00 0.00 C ATOM 1266 C GLU A 83 -11.499 -6.336 9.949 1.00 0.00 C ATOM 1267 O GLU A 83 -12.584 -6.382 9.360 1.00 0.00 O ATOM 1268 CB GLU A 83 -11.939 -6.145 12.379 1.00 0.00 C ATOM 1269 CG GLU A 83 -11.851 -6.751 13.764 1.00 0.00 C ATOM 1270 CD GLU A 83 -12.661 -5.982 14.781 1.00 0.00 C ATOM 1271 OE1 GLU A 83 -12.207 -4.911 15.229 1.00 0.00 O ATOM 1272 OE2 GLU A 83 -13.766 -6.448 15.134 1.00 0.00 O ATOM 0 H GLU A 83 -9.470 -6.466 12.152 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.780 -7.984 11.291 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.455 -5.168 12.387 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -12.987 -5.979 12.129 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.201 -7.783 13.729 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.808 -6.779 14.080 1.00 0.00 H new ATOM 1279 N ALA A 84 -10.450 -5.693 9.480 1.00 0.00 N ATOM 1280 CA ALA A 84 -10.485 -4.994 8.216 1.00 0.00 C ATOM 1281 C ALA A 84 -10.174 -5.948 7.082 1.00 0.00 C ATOM 1282 O ALA A 84 -9.290 -6.794 7.190 1.00 0.00 O ATOM 1283 CB ALA A 84 -9.510 -3.828 8.225 1.00 0.00 C ATOM 0 H ALA A 84 -9.553 -5.641 9.963 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.488 -4.595 8.064 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.550 -3.313 7.265 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.780 -3.134 9.021 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -8.500 -4.200 8.396 1.00 0.00 H new ATOM 1289 N GLU A 85 -10.923 -5.830 6.006 1.00 0.00 N ATOM 1290 CA GLU A 85 -10.681 -6.655 4.832 1.00 0.00 C ATOM 1291 C GLU A 85 -9.712 -5.952 3.886 1.00 0.00 C ATOM 1292 O GLU A 85 -8.949 -6.589 3.156 1.00 0.00 O ATOM 1293 CB GLU A 85 -11.999 -6.956 4.122 1.00 0.00 C ATOM 1294 CG GLU A 85 -11.938 -8.183 3.228 1.00 0.00 C ATOM 1295 CD GLU A 85 -11.470 -9.414 3.979 1.00 0.00 C ATOM 1296 OE1 GLU A 85 -12.252 -9.961 4.791 1.00 0.00 O ATOM 1297 OE2 GLU A 85 -10.319 -9.841 3.767 1.00 0.00 O ATOM 0 H GLU A 85 -11.701 -5.176 5.916 1.00 0.00 H new ATOM 0 HA GLU A 85 -10.234 -7.597 5.148 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -12.781 -7.098 4.868 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -12.285 -6.092 3.522 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -12.924 -8.371 2.804 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.264 -7.990 2.394 1.00 0.00 H new ATOM 1304 N TYR A 86 -9.741 -4.630 3.912 1.00 0.00 N ATOM 1305 CA TYR A 86 -8.874 -3.834 3.058 1.00 0.00 C ATOM 1306 C TYR A 86 -7.849 -3.074 3.892 1.00 0.00 C ATOM 1307 O TYR A 86 -8.160 -2.051 4.500 1.00 0.00 O ATOM 1308 CB TYR A 86 -9.704 -2.857 2.218 1.00 0.00 C ATOM 1309 CG TYR A 86 -10.679 -3.526 1.269 1.00 0.00 C ATOM 1310 CD1 TYR A 86 -11.903 -4.004 1.721 1.00 0.00 C ATOM 1311 CD2 TYR A 86 -10.378 -3.673 -0.079 1.00 0.00 C ATOM 1312 CE1 TYR A 86 -12.796 -4.610 0.857 1.00 0.00 C ATOM 1313 CE2 TYR A 86 -11.267 -4.276 -0.948 1.00 0.00 C ATOM 1314 CZ TYR A 86 -12.474 -4.742 -0.475 1.00 0.00 C ATOM 1315 OH TYR A 86 -13.360 -5.346 -1.339 1.00 0.00 O ATOM 0 H TYR A 86 -10.356 -4.084 4.516 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.341 -4.508 2.387 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.259 -2.200 2.888 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -9.028 -2.226 1.641 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -12.161 -3.900 2.765 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.433 -3.310 -0.454 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.742 -4.978 1.225 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.017 -4.382 -1.993 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.980 -5.358 -2.242 1.00 0.00 H new ATOM 1325 N LEU A 87 -6.631 -3.595 3.942 1.00 0.00 N ATOM 1326 CA LEU A 87 -5.557 -2.943 4.678 1.00 0.00 C ATOM 1327 C LEU A 87 -4.589 -2.261 3.722 1.00 0.00 C ATOM 1328 O LEU A 87 -4.177 -2.845 2.718 1.00 0.00 O ATOM 1329 CB LEU A 87 -4.784 -3.944 5.551 1.00 0.00 C ATOM 1330 CG LEU A 87 -5.512 -4.469 6.792 1.00 0.00 C ATOM 1331 CD1 LEU A 87 -6.092 -3.318 7.598 1.00 0.00 C ATOM 1332 CD2 LEU A 87 -6.590 -5.471 6.411 1.00 0.00 C ATOM 0 H LEU A 87 -6.362 -4.465 3.483 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.017 -2.197 5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.508 -4.797 4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.856 -3.471 5.874 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.787 -4.989 7.418 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -6.605 -3.711 8.476 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.288 -2.654 7.915 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.799 -2.763 6.982 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.090 -5.827 7.311 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -7.318 -4.991 5.757 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -6.136 -6.314 5.891 1.00 0.00 H new ATOM 1344 N ALA A 88 -4.243 -1.026 4.031 1.00 0.00 N ATOM 1345 CA ALA A 88 -3.250 -0.291 3.264 1.00 0.00 C ATOM 1346 C ALA A 88 -2.164 0.224 4.195 1.00 0.00 C ATOM 1347 O ALA A 88 -2.449 0.933 5.156 1.00 0.00 O ATOM 1348 CB ALA A 88 -3.903 0.860 2.513 1.00 0.00 C ATOM 0 H ALA A 88 -4.638 -0.505 4.814 1.00 0.00 H new ATOM 0 HA ALA A 88 -2.799 -0.960 2.531 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.146 1.400 1.944 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.658 0.468 1.831 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.374 1.538 3.225 1.00 0.00 H new ATOM 1354 N VAL A 89 -0.925 -0.142 3.925 1.00 0.00 N ATOM 1355 CA VAL A 89 0.178 0.245 4.784 1.00 0.00 C ATOM 1356 C VAL A 89 1.203 1.048 3.998 1.00 0.00 C ATOM 1357 O VAL A 89 1.701 0.599 2.965 1.00 0.00 O ATOM 1358 CB VAL A 89 0.867 -0.981 5.425 1.00 0.00 C ATOM 1359 CG1 VAL A 89 1.968 -0.545 6.381 1.00 0.00 C ATOM 1360 CG2 VAL A 89 -0.147 -1.864 6.141 1.00 0.00 C ATOM 0 H VAL A 89 -0.657 -0.706 3.118 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.236 0.858 5.584 1.00 0.00 H new ATOM 0 HB VAL A 89 1.321 -1.566 4.625 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.438 -1.425 6.820 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.715 0.032 5.836 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.540 0.070 7.172 1.00 0.00 H new ATOM 0 HG21 VAL A 89 0.364 -2.719 6.583 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -0.639 -1.290 6.926 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -0.892 -2.215 5.427 1.00 0.00 H new ATOM 1370 N ASP A 90 1.501 2.239 4.482 1.00 0.00 N ATOM 1371 CA ASP A 90 2.514 3.079 3.864 1.00 0.00 C ATOM 1372 C ASP A 90 3.699 3.221 4.805 1.00 0.00 C ATOM 1373 O ASP A 90 3.528 3.171 6.027 1.00 0.00 O ATOM 1374 CB ASP A 90 1.941 4.455 3.517 1.00 0.00 C ATOM 1375 CG ASP A 90 2.966 5.359 2.865 1.00 0.00 C ATOM 1376 OD1 ASP A 90 3.367 5.080 1.714 1.00 0.00 O ATOM 1377 OD2 ASP A 90 3.383 6.344 3.504 1.00 0.00 O ATOM 0 H ASP A 90 1.056 2.649 5.303 1.00 0.00 H new ATOM 0 HA ASP A 90 2.844 2.609 2.938 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.090 4.333 2.847 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.567 4.929 4.424 1.00 0.00 H new ATOM 1382 N GLN A 91 4.892 3.371 4.231 1.00 0.00 N ATOM 1383 CA GLN A 91 6.131 3.441 5.001 1.00 0.00 C ATOM 1384 C GLN A 91 6.365 2.124 5.738 1.00 0.00 C ATOM 1385 O GLN A 91 6.918 2.095 6.836 1.00 0.00 O ATOM 1386 CB GLN A 91 6.086 4.623 5.975 1.00 0.00 C ATOM 1387 CG GLN A 91 6.125 5.975 5.279 1.00 0.00 C ATOM 1388 CD GLN A 91 5.561 7.090 6.136 1.00 0.00 C ATOM 1389 OE1 GLN A 91 6.276 7.732 6.904 1.00 0.00 O ATOM 1390 NE2 GLN A 91 4.273 7.340 5.986 1.00 0.00 N ATOM 0 H GLN A 91 5.026 3.447 3.223 1.00 0.00 H new ATOM 0 HA GLN A 91 6.966 3.601 4.319 1.00 0.00 H new ATOM 0 HB2 GLN A 91 5.178 4.557 6.575 1.00 0.00 H new ATOM 0 HB3 GLN A 91 6.929 4.551 6.663 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.155 6.212 5.013 1.00 0.00 H new ATOM 0 HG3 GLN A 91 5.561 5.916 4.348 1.00 0.00 H new ATOM 0 HE21 GLN A 91 3.717 6.782 5.338 1.00 0.00 H new ATOM 0 HE22 GLN A 91 3.834 8.091 6.519 1.00 0.00 H new ATOM 1399 N VAL A 92 5.975 1.027 5.090 1.00 0.00 N ATOM 1400 CA VAL A 92 6.081 -0.306 5.677 1.00 0.00 C ATOM 1401 C VAL A 92 7.544 -0.694 5.892 1.00 0.00 C ATOM 1402 O VAL A 92 7.863 -1.559 6.703 1.00 0.00 O ATOM 1403 CB VAL A 92 5.378 -1.361 4.793 1.00 0.00 C ATOM 1404 CG1 VAL A 92 6.090 -1.529 3.459 1.00 0.00 C ATOM 1405 CG2 VAL A 92 5.262 -2.697 5.520 1.00 0.00 C ATOM 0 H VAL A 92 5.579 1.038 4.150 1.00 0.00 H new ATOM 0 HA VAL A 92 5.582 -0.279 6.646 1.00 0.00 H new ATOM 0 HB VAL A 92 4.370 -1.000 4.589 1.00 0.00 H new ATOM 0 HG11 VAL A 92 5.571 -2.278 2.861 1.00 0.00 H new ATOM 0 HG12 VAL A 92 6.094 -0.578 2.926 1.00 0.00 H new ATOM 0 HG13 VAL A 92 7.117 -1.852 3.633 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.764 -3.420 4.875 1.00 0.00 H new ATOM 0 HG22 VAL A 92 6.258 -3.062 5.772 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.682 -2.565 6.433 1.00 0.00 H new ATOM 1415 N GLU A 93 8.430 -0.018 5.178 1.00 0.00 N ATOM 1416 CA GLU A 93 9.860 -0.252 5.295 1.00 0.00 C ATOM 1417 C GLU A 93 10.375 0.150 6.679 1.00 0.00 C ATOM 1418 O GLU A 93 11.499 -0.182 7.059 1.00 0.00 O ATOM 1419 CB GLU A 93 10.603 0.551 4.224 1.00 0.00 C ATOM 1420 CG GLU A 93 10.120 0.293 2.805 1.00 0.00 C ATOM 1421 CD GLU A 93 10.450 -1.101 2.314 1.00 0.00 C ATOM 1422 OE1 GLU A 93 11.650 -1.396 2.136 1.00 0.00 O ATOM 1423 OE2 GLU A 93 9.511 -1.898 2.098 1.00 0.00 O ATOM 0 H GLU A 93 8.179 0.705 4.504 1.00 0.00 H new ATOM 0 HA GLU A 93 10.042 -1.318 5.155 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.498 1.613 4.444 1.00 0.00 H new ATOM 0 HB3 GLU A 93 11.666 0.317 4.282 1.00 0.00 H new ATOM 0 HG2 GLU A 93 9.041 0.442 2.761 1.00 0.00 H new ATOM 0 HG3 GLU A 93 10.571 1.025 2.135 1.00 0.00 H new ATOM 1430 N LYS A 94 9.543 0.862 7.435 1.00 0.00 N ATOM 1431 CA LYS A 94 9.959 1.430 8.704 1.00 0.00 C ATOM 1432 C LYS A 94 9.470 0.599 9.894 1.00 0.00 C ATOM 1433 O LYS A 94 9.503 1.068 11.033 1.00 0.00 O ATOM 1434 CB LYS A 94 9.430 2.857 8.827 1.00 0.00 C ATOM 1435 CG LYS A 94 9.651 3.694 7.578 1.00 0.00 C ATOM 1436 CD LYS A 94 11.109 3.692 7.140 1.00 0.00 C ATOM 1437 CE LYS A 94 11.981 4.542 8.046 1.00 0.00 C ATOM 1438 NZ LYS A 94 13.341 4.725 7.472 1.00 0.00 N ATOM 0 H LYS A 94 8.574 1.057 7.185 1.00 0.00 H new ATOM 0 HA LYS A 94 11.049 1.429 8.723 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.363 2.823 9.048 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.915 3.345 9.672 1.00 0.00 H new ATOM 0 HG2 LYS A 94 9.029 3.310 6.769 1.00 0.00 H new ATOM 0 HG3 LYS A 94 9.331 4.719 7.767 1.00 0.00 H new ATOM 0 HD2 LYS A 94 11.483 2.668 7.134 1.00 0.00 H new ATOM 0 HD3 LYS A 94 11.180 4.063 6.118 1.00 0.00 H new ATOM 0 HE2 LYS A 94 11.513 5.515 8.196 1.00 0.00 H new ATOM 0 HE3 LYS A 94 12.058 4.071 9.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.913 5.310 8.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.795 3.797 7.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 13.267 5.196 6.548 1.00 0.00 H new ATOM 1452 N LEU A 95 9.021 -0.631 9.634 1.00 0.00 N ATOM 1453 CA LEU A 95 8.517 -1.507 10.696 1.00 0.00 C ATOM 1454 C LEU A 95 9.561 -1.702 11.797 1.00 0.00 C ATOM 1455 O LEU A 95 10.734 -1.945 11.515 1.00 0.00 O ATOM 1456 CB LEU A 95 8.115 -2.871 10.131 1.00 0.00 C ATOM 1457 CG LEU A 95 6.936 -2.868 9.153 1.00 0.00 C ATOM 1458 CD1 LEU A 95 6.609 -4.285 8.710 1.00 0.00 C ATOM 1459 CD2 LEU A 95 5.713 -2.212 9.778 1.00 0.00 C ATOM 0 H LEU A 95 8.996 -1.043 8.701 1.00 0.00 H new ATOM 0 HA LEU A 95 7.640 -1.023 11.126 1.00 0.00 H new ATOM 0 HB2 LEU A 95 8.979 -3.303 9.627 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.870 -3.530 10.964 1.00 0.00 H new ATOM 0 HG LEU A 95 7.224 -2.286 8.277 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.769 -4.264 8.016 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.477 -4.721 8.216 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.346 -4.887 9.580 1.00 0.00 H new ATOM 0 HD21 LEU A 95 4.890 -2.222 9.064 1.00 0.00 H new ATOM 0 HD22 LEU A 95 5.423 -2.761 10.674 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.949 -1.182 10.045 1.00 0.00 H new ATOM 1471 N GLY A 96 9.125 -1.602 13.046 1.00 0.00 N ATOM 1472 CA GLY A 96 10.043 -1.697 14.165 1.00 0.00 C ATOM 1473 C GLY A 96 10.129 -3.095 14.742 1.00 0.00 C ATOM 1474 O GLY A 96 10.948 -3.900 14.309 1.00 0.00 O ATOM 0 H GLY A 96 8.149 -1.456 13.305 1.00 0.00 H new ATOM 0 HA2 GLY A 96 11.035 -1.381 13.842 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.727 -1.006 14.947 1.00 0.00 H new ATOM 1478 N ASN A 97 9.276 -3.393 15.713 1.00 0.00 N ATOM 1479 CA ASN A 97 9.332 -4.681 16.402 1.00 0.00 C ATOM 1480 C ASN A 97 7.957 -5.336 16.427 1.00 0.00 C ATOM 1481 O ASN A 97 7.716 -6.321 15.726 1.00 0.00 O ATOM 1482 CB ASN A 97 9.845 -4.515 17.839 1.00 0.00 C ATOM 1483 CG ASN A 97 11.162 -3.769 17.921 1.00 0.00 C ATOM 1484 OD1 ASN A 97 12.239 -4.364 17.851 1.00 0.00 O ATOM 1485 ND2 ASN A 97 11.079 -2.460 18.083 1.00 0.00 N ATOM 0 H ASN A 97 8.541 -2.767 16.042 1.00 0.00 H new ATOM 0 HA ASN A 97 10.024 -5.319 15.853 1.00 0.00 H new ATOM 0 HB2 ASN A 97 9.096 -3.983 18.426 1.00 0.00 H new ATOM 0 HB3 ASN A 97 9.964 -5.500 18.291 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.929 -1.900 18.155 1.00 0.00 H new ATOM 0 HD22 ASN A 97 10.165 -2.010 18.136 1.00 0.00 H new ATOM 1492 N GLU A 98 7.050 -4.764 17.219 1.00 0.00 N ATOM 1493 CA GLU A 98 5.697 -5.298 17.360 1.00 0.00 C ATOM 1494 C GLU A 98 4.969 -5.264 16.023 1.00 0.00 C ATOM 1495 O GLU A 98 4.140 -6.125 15.725 1.00 0.00 O ATOM 1496 CB GLU A 98 4.910 -4.490 18.400 1.00 0.00 C ATOM 1497 CG GLU A 98 5.449 -4.609 19.817 1.00 0.00 C ATOM 1498 CD GLU A 98 5.338 -6.017 20.366 1.00 0.00 C ATOM 1499 OE1 GLU A 98 4.294 -6.343 20.972 1.00 0.00 O ATOM 1500 OE2 GLU A 98 6.293 -6.803 20.197 1.00 0.00 O ATOM 0 H GLU A 98 7.230 -3.928 17.774 1.00 0.00 H new ATOM 0 HA GLU A 98 5.771 -6.332 17.696 1.00 0.00 H new ATOM 0 HB2 GLU A 98 4.915 -3.440 18.108 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.871 -4.819 18.389 1.00 0.00 H new ATOM 0 HG2 GLU A 98 6.494 -4.299 19.832 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.904 -3.925 20.468 1.00 0.00 H new ATOM 1507 N GLU A 99 5.307 -4.271 15.215 1.00 0.00 N ATOM 1508 CA GLU A 99 4.672 -4.084 13.922 1.00 0.00 C ATOM 1509 C GLU A 99 4.968 -5.262 12.998 1.00 0.00 C ATOM 1510 O GLU A 99 4.086 -5.724 12.281 1.00 0.00 O ATOM 1511 CB GLU A 99 5.137 -2.776 13.269 1.00 0.00 C ATOM 1512 CG GLU A 99 4.907 -1.524 14.112 1.00 0.00 C ATOM 1513 CD GLU A 99 5.847 -1.426 15.297 1.00 0.00 C ATOM 1514 OE1 GLU A 99 7.059 -1.660 15.116 1.00 0.00 O ATOM 1515 OE2 GLU A 99 5.382 -1.139 16.417 1.00 0.00 O ATOM 0 H GLU A 99 6.023 -3.578 15.435 1.00 0.00 H new ATOM 0 HA GLU A 99 3.596 -4.029 14.084 1.00 0.00 H new ATOM 0 HB2 GLU A 99 6.201 -2.856 13.045 1.00 0.00 H new ATOM 0 HB3 GLU A 99 4.619 -2.657 12.317 1.00 0.00 H new ATOM 0 HG2 GLU A 99 5.031 -0.642 13.484 1.00 0.00 H new ATOM 0 HG3 GLU A 99 3.878 -1.518 14.471 1.00 0.00 H new ATOM 1522 N GLN A 100 6.204 -5.757 13.033 1.00 0.00 N ATOM 1523 CA GLN A 100 6.594 -6.887 12.194 1.00 0.00 C ATOM 1524 C GLN A 100 5.826 -8.137 12.601 1.00 0.00 C ATOM 1525 O GLN A 100 5.308 -8.865 11.753 1.00 0.00 O ATOM 1526 CB GLN A 100 8.097 -7.163 12.298 1.00 0.00 C ATOM 1527 CG GLN A 100 8.980 -6.018 11.829 1.00 0.00 C ATOM 1528 CD GLN A 100 10.441 -6.414 11.734 1.00 0.00 C ATOM 1529 OE1 GLN A 100 10.770 -7.570 11.453 1.00 0.00 O ATOM 1530 NE2 GLN A 100 11.329 -5.467 11.982 1.00 0.00 N ATOM 0 H GLN A 100 6.948 -5.396 13.630 1.00 0.00 H new ATOM 0 HA GLN A 100 6.356 -6.629 11.162 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.341 -7.392 13.335 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.332 -8.051 11.711 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.636 -5.674 10.854 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.878 -5.179 12.517 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.018 -4.523 12.211 1.00 0.00 H new ATOM 0 HE22 GLN A 100 12.326 -5.680 11.945 1.00 0.00 H new ATOM 1539 N ALA A 101 5.755 -8.370 13.905 1.00 0.00 N ATOM 1540 CA ALA A 101 5.070 -9.536 14.442 1.00 0.00 C ATOM 1541 C ALA A 101 3.585 -9.510 14.092 1.00 0.00 C ATOM 1542 O ALA A 101 3.017 -10.524 13.687 1.00 0.00 O ATOM 1543 CB ALA A 101 5.259 -9.606 15.950 1.00 0.00 C ATOM 0 H ALA A 101 6.166 -7.762 14.613 1.00 0.00 H new ATOM 0 HA ALA A 101 5.506 -10.426 13.989 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.742 -10.482 16.341 1.00 0.00 H new ATOM 0 HB2 ALA A 101 6.322 -9.679 16.180 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.849 -8.707 16.410 1.00 0.00 H new ATOM 1549 N LEU A 102 2.968 -8.344 14.239 1.00 0.00 N ATOM 1550 CA LEU A 102 1.548 -8.186 13.947 1.00 0.00 C ATOM 1551 C LEU A 102 1.308 -8.356 12.446 1.00 0.00 C ATOM 1552 O LEU A 102 0.429 -9.108 12.023 1.00 0.00 O ATOM 1553 CB LEU A 102 1.086 -6.799 14.420 1.00 0.00 C ATOM 1554 CG LEU A 102 -0.386 -6.670 14.828 1.00 0.00 C ATOM 1555 CD1 LEU A 102 -1.318 -6.932 13.658 1.00 0.00 C ATOM 1556 CD2 LEU A 102 -0.702 -7.604 15.984 1.00 0.00 C ATOM 0 H LEU A 102 3.429 -7.492 14.559 1.00 0.00 H new ATOM 0 HA LEU A 102 0.973 -8.947 14.474 1.00 0.00 H new ATOM 0 HB2 LEU A 102 1.702 -6.506 15.270 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.283 -6.083 13.622 1.00 0.00 H new ATOM 0 HG LEU A 102 -0.549 -5.643 15.153 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -2.352 -6.831 13.987 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.118 -6.212 12.865 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -1.154 -7.942 13.281 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.751 -7.499 16.260 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.507 -8.634 15.684 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.075 -7.350 16.839 1.00 0.00 H new ATOM 1568 N LEU A 103 2.119 -7.664 11.658 1.00 0.00 N ATOM 1569 CA LEU A 103 2.035 -7.714 10.198 1.00 0.00 C ATOM 1570 C LEU A 103 2.130 -9.159 9.699 1.00 0.00 C ATOM 1571 O LEU A 103 1.367 -9.578 8.826 1.00 0.00 O ATOM 1572 CB LEU A 103 3.170 -6.871 9.598 1.00 0.00 C ATOM 1573 CG LEU A 103 2.951 -6.316 8.184 1.00 0.00 C ATOM 1574 CD1 LEU A 103 2.918 -7.424 7.144 1.00 0.00 C ATOM 1575 CD2 LEU A 103 1.675 -5.488 8.126 1.00 0.00 C ATOM 0 H LEU A 103 2.855 -7.051 12.009 1.00 0.00 H new ATOM 0 HA LEU A 103 1.073 -7.310 9.883 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.358 -6.031 10.267 1.00 0.00 H new ATOM 0 HB3 LEU A 103 4.075 -7.479 9.587 1.00 0.00 H new ATOM 0 HG LEU A 103 3.798 -5.671 7.949 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.761 -6.991 6.156 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.865 -7.964 7.157 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.104 -8.113 7.372 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.537 -5.103 7.116 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.823 -6.113 8.396 1.00 0.00 H new ATOM 0 HD23 LEU A 103 1.750 -4.655 8.825 1.00 0.00 H new ATOM 1587 N PHE A 104 3.073 -9.910 10.261 1.00 0.00 N ATOM 1588 CA PHE A 104 3.268 -11.314 9.902 1.00 0.00 C ATOM 1589 C PHE A 104 1.965 -12.101 10.015 1.00 0.00 C ATOM 1590 O PHE A 104 1.583 -12.828 9.093 1.00 0.00 O ATOM 1591 CB PHE A 104 4.337 -11.942 10.799 1.00 0.00 C ATOM 1592 CG PHE A 104 4.593 -13.391 10.502 1.00 0.00 C ATOM 1593 CD1 PHE A 104 5.267 -13.764 9.352 1.00 0.00 C ATOM 1594 CD2 PHE A 104 4.159 -14.379 11.371 1.00 0.00 C ATOM 1595 CE1 PHE A 104 5.502 -15.094 9.073 1.00 0.00 C ATOM 1596 CE2 PHE A 104 4.392 -15.712 11.098 1.00 0.00 C ATOM 1597 CZ PHE A 104 5.065 -16.071 9.947 1.00 0.00 C ATOM 0 H PHE A 104 3.719 -9.568 10.972 1.00 0.00 H new ATOM 0 HA PHE A 104 3.599 -11.353 8.864 1.00 0.00 H new ATOM 0 HB2 PHE A 104 5.268 -11.386 10.685 1.00 0.00 H new ATOM 0 HB3 PHE A 104 4.031 -11.841 11.840 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.613 -13.005 8.666 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.632 -14.103 12.273 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.028 -15.372 8.171 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.049 -16.473 11.783 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.249 -17.113 9.730 1.00 0.00 H new ATOM 1607 N SER A 105 1.287 -11.945 11.142 1.00 0.00 N ATOM 1608 CA SER A 105 0.030 -12.622 11.381 1.00 0.00 C ATOM 1609 C SER A 105 -1.040 -12.178 10.379 1.00 0.00 C ATOM 1610 O SER A 105 -1.879 -12.978 9.962 1.00 0.00 O ATOM 1611 CB SER A 105 -0.416 -12.348 12.811 1.00 0.00 C ATOM 1612 OG SER A 105 0.534 -12.847 13.737 1.00 0.00 O ATOM 0 H SER A 105 1.594 -11.348 11.910 1.00 0.00 H new ATOM 0 HA SER A 105 0.171 -13.694 11.244 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.545 -11.276 12.958 1.00 0.00 H new ATOM 0 HB3 SER A 105 -1.385 -12.813 12.990 1.00 0.00 H new ATOM 0 HG SER A 105 0.231 -12.660 14.650 1.00 0.00 H new ATOM 1618 N ILE A 106 -0.994 -10.911 9.986 1.00 0.00 N ATOM 1619 CA ILE A 106 -1.931 -10.378 8.999 1.00 0.00 C ATOM 1620 C ILE A 106 -1.770 -11.099 7.662 1.00 0.00 C ATOM 1621 O ILE A 106 -2.756 -11.523 7.055 1.00 0.00 O ATOM 1622 CB ILE A 106 -1.741 -8.855 8.796 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -1.929 -8.113 10.120 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -2.718 -8.324 7.755 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -1.721 -6.616 10.016 1.00 0.00 C ATOM 0 H ILE A 106 -0.318 -10.231 10.335 1.00 0.00 H new ATOM 0 HA ILE A 106 -2.937 -10.548 9.382 1.00 0.00 H new ATOM 0 HB ILE A 106 -0.726 -8.683 8.437 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -2.934 -8.306 10.494 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -1.232 -8.517 10.855 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -2.567 -7.252 7.628 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -2.547 -8.830 6.805 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -3.740 -8.510 8.087 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -1.871 -6.159 10.994 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -0.707 -6.413 9.672 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -2.435 -6.198 9.307 1.00 0.00 H new ATOM 1637 N PHE A 107 -0.525 -11.253 7.217 1.00 0.00 N ATOM 1638 CA PHE A 107 -0.244 -11.975 5.983 1.00 0.00 C ATOM 1639 C PHE A 107 -0.629 -13.442 6.109 1.00 0.00 C ATOM 1640 O PHE A 107 -1.054 -14.069 5.135 1.00 0.00 O ATOM 1641 CB PHE A 107 1.232 -11.852 5.599 1.00 0.00 C ATOM 1642 CG PHE A 107 1.569 -10.589 4.854 1.00 0.00 C ATOM 1643 CD1 PHE A 107 0.583 -9.860 4.208 1.00 0.00 C ATOM 1644 CD2 PHE A 107 2.878 -10.143 4.787 1.00 0.00 C ATOM 1645 CE1 PHE A 107 0.897 -8.709 3.511 1.00 0.00 C ATOM 1646 CE2 PHE A 107 3.198 -8.992 4.092 1.00 0.00 C ATOM 1647 CZ PHE A 107 2.206 -8.274 3.453 1.00 0.00 C ATOM 0 H PHE A 107 0.301 -10.888 7.692 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.847 -11.524 5.195 1.00 0.00 H new ATOM 0 HB2 PHE A 107 1.837 -11.900 6.504 1.00 0.00 H new ATOM 0 HB3 PHE A 107 1.509 -12.709 4.985 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -0.443 -10.196 4.250 1.00 0.00 H new ATOM 0 HD2 PHE A 107 3.658 -10.701 5.284 1.00 0.00 H new ATOM 0 HE1 PHE A 107 0.119 -8.150 3.012 1.00 0.00 H new ATOM 0 HE2 PHE A 107 4.223 -8.654 4.049 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.454 -7.374 2.909 1.00 0.00 H new ATOM 1657 N ASN A 108 -0.490 -13.990 7.310 1.00 0.00 N ATOM 1658 CA ASN A 108 -0.877 -15.371 7.559 1.00 0.00 C ATOM 1659 C ASN A 108 -2.390 -15.517 7.447 1.00 0.00 C ATOM 1660 O ASN A 108 -2.888 -16.495 6.896 1.00 0.00 O ATOM 1661 CB ASN A 108 -0.388 -15.834 8.936 1.00 0.00 C ATOM 1662 CG ASN A 108 -0.695 -17.295 9.201 1.00 0.00 C ATOM 1663 OD1 ASN A 108 0.048 -18.184 8.779 1.00 0.00 O ATOM 1664 ND2 ASN A 108 -1.767 -17.557 9.931 1.00 0.00 N ATOM 0 H ASN A 108 -0.114 -13.501 8.122 1.00 0.00 H new ATOM 0 HA ASN A 108 -0.408 -16.005 6.807 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.688 -15.673 9.009 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -0.855 -15.222 9.708 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -2.003 -18.522 10.163 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -2.358 -16.794 10.262 1.00 0.00 H new ATOM 1671 N ARG A 109 -3.112 -14.521 7.953 1.00 0.00 N ATOM 1672 CA ARG A 109 -4.566 -14.488 7.852 1.00 0.00 C ATOM 1673 C ARG A 109 -4.990 -14.456 6.385 1.00 0.00 C ATOM 1674 O ARG A 109 -5.903 -15.177 5.979 1.00 0.00 O ATOM 1675 CB ARG A 109 -5.120 -13.269 8.615 1.00 0.00 C ATOM 1676 CG ARG A 109 -6.639 -13.125 8.586 1.00 0.00 C ATOM 1677 CD ARG A 109 -7.110 -12.279 7.409 1.00 0.00 C ATOM 1678 NE ARG A 109 -8.566 -12.122 7.387 1.00 0.00 N ATOM 1679 CZ ARG A 109 -9.228 -11.453 6.439 1.00 0.00 C ATOM 1680 NH1 ARG A 109 -8.573 -10.858 5.454 1.00 0.00 N ATOM 1681 NH2 ARG A 109 -10.551 -11.373 6.478 1.00 0.00 N ATOM 0 H ARG A 109 -2.709 -13.721 8.440 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.978 -15.390 8.305 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -4.796 -13.332 9.654 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -4.677 -12.365 8.197 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -7.096 -14.113 8.528 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -6.978 -12.671 9.517 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -6.641 -11.296 7.460 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -6.782 -12.741 6.478 1.00 0.00 H new ATOM 0 HE ARG A 109 -9.106 -12.549 8.140 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -7.555 -10.908 5.415 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -9.086 -10.349 4.734 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -11.067 -11.823 7.234 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -11.053 -10.861 5.752 1.00 0.00 H new ATOM 1695 N PHE A 110 -4.315 -13.625 5.595 1.00 0.00 N ATOM 1696 CA PHE A 110 -4.588 -13.546 4.168 1.00 0.00 C ATOM 1697 C PHE A 110 -4.319 -14.888 3.495 1.00 0.00 C ATOM 1698 O PHE A 110 -5.165 -15.407 2.775 1.00 0.00 O ATOM 1699 CB PHE A 110 -3.739 -12.462 3.501 1.00 0.00 C ATOM 1700 CG PHE A 110 -4.117 -11.057 3.883 1.00 0.00 C ATOM 1701 CD1 PHE A 110 -5.447 -10.690 4.019 1.00 0.00 C ATOM 1702 CD2 PHE A 110 -3.140 -10.100 4.088 1.00 0.00 C ATOM 1703 CE1 PHE A 110 -5.793 -9.394 4.353 1.00 0.00 C ATOM 1704 CE2 PHE A 110 -3.479 -8.804 4.424 1.00 0.00 C ATOM 1705 CZ PHE A 110 -4.806 -8.450 4.556 1.00 0.00 C ATOM 0 H PHE A 110 -3.578 -13.000 5.920 1.00 0.00 H new ATOM 0 HA PHE A 110 -5.640 -13.288 4.049 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -2.693 -12.627 3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -3.822 -12.567 2.419 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -6.222 -11.426 3.862 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -2.099 -10.369 3.984 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -6.833 -9.120 4.455 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -2.705 -8.068 4.583 1.00 0.00 H new ATOM 0 HZ PHE A 110 -5.072 -7.437 4.818 1.00 0.00 H new ATOM 1715 N ARG A 111 -3.142 -15.448 3.753 1.00 0.00 N ATOM 1716 CA ARG A 111 -2.739 -16.712 3.146 1.00 0.00 C ATOM 1717 C ARG A 111 -3.680 -17.847 3.547 1.00 0.00 C ATOM 1718 O ARG A 111 -4.061 -18.667 2.714 1.00 0.00 O ATOM 1719 CB ARG A 111 -1.307 -17.065 3.555 1.00 0.00 C ATOM 1720 CG ARG A 111 -0.805 -18.373 2.967 1.00 0.00 C ATOM 1721 CD ARG A 111 -0.242 -18.198 1.564 1.00 0.00 C ATOM 1722 NE ARG A 111 -1.189 -17.590 0.626 1.00 0.00 N ATOM 1723 CZ ARG A 111 -1.709 -18.229 -0.425 1.00 0.00 C ATOM 1724 NH1 ARG A 111 -1.528 -19.534 -0.577 1.00 0.00 N ATOM 1725 NH2 ARG A 111 -2.439 -17.560 -1.309 1.00 0.00 N ATOM 0 H ARG A 111 -2.447 -15.044 4.381 1.00 0.00 H new ATOM 0 HA ARG A 111 -2.789 -16.589 2.064 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -0.642 -16.259 3.245 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -1.253 -17.122 4.642 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -0.034 -18.788 3.616 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -1.622 -19.094 2.941 1.00 0.00 H new ATOM 0 HD2 ARG A 111 0.654 -17.580 1.615 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.064 -19.171 1.180 1.00 0.00 H new ATOM 0 HE ARG A 111 -1.468 -16.622 0.785 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -0.988 -20.058 0.112 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -1.929 -20.014 -1.383 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -2.601 -16.561 -1.184 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -2.838 -18.045 -2.113 1.00 0.00 H new ATOM 1739 N ASN A 112 -4.049 -17.877 4.824 1.00 0.00 N ATOM 1740 CA ASN A 112 -4.889 -18.944 5.373 1.00 0.00 C ATOM 1741 C ASN A 112 -6.224 -19.051 4.648 1.00 0.00 C ATOM 1742 O ASN A 112 -6.702 -20.153 4.372 1.00 0.00 O ATOM 1743 CB ASN A 112 -5.140 -18.712 6.866 1.00 0.00 C ATOM 1744 CG ASN A 112 -4.392 -19.694 7.747 1.00 0.00 C ATOM 1745 OD1 ASN A 112 -3.220 -20.121 7.306 1.00 0.00 O flip ATOM 1746 ND2 ASN A 112 -4.861 -20.062 8.823 1.00 0.00 N flip ATOM 0 H ASN A 112 -3.778 -17.169 5.506 1.00 0.00 H new ATOM 0 HA ASN A 112 -4.349 -19.880 5.230 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -4.841 -17.697 7.127 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -6.208 -18.791 7.067 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -5.768 -19.711 9.131 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -4.343 -20.718 9.408 1.00 0.00 H new ATOM 1753 N SER A 113 -6.818 -17.912 4.338 1.00 0.00 N ATOM 1754 CA SER A 113 -8.139 -17.892 3.733 1.00 0.00 C ATOM 1755 C SER A 113 -8.055 -17.712 2.218 1.00 0.00 C ATOM 1756 O SER A 113 -8.940 -18.146 1.479 1.00 0.00 O ATOM 1757 CB SER A 113 -8.963 -16.763 4.357 1.00 0.00 C ATOM 1758 OG SER A 113 -10.325 -16.845 3.981 1.00 0.00 O ATOM 0 H SER A 113 -6.408 -16.991 4.494 1.00 0.00 H new ATOM 0 HA SER A 113 -8.623 -18.850 3.924 1.00 0.00 H new ATOM 0 HB2 SER A 113 -8.881 -16.809 5.443 1.00 0.00 H new ATOM 0 HB3 SER A 113 -8.556 -15.800 4.047 1.00 0.00 H new ATOM 0 HG SER A 113 -10.824 -16.111 4.397 1.00 0.00 H new ATOM 1764 N GLY A 114 -6.982 -17.085 1.757 1.00 0.00 N ATOM 1765 CA GLY A 114 -6.866 -16.746 0.352 1.00 0.00 C ATOM 1766 C GLY A 114 -7.651 -15.490 0.034 1.00 0.00 C ATOM 1767 O GLY A 114 -7.984 -15.216 -1.120 1.00 0.00 O ATOM 0 H GLY A 114 -6.188 -16.804 2.332 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -5.817 -16.599 0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.232 -17.573 -0.257 1.00 0.00 H new ATOM 1771 N LYS A 115 -7.924 -14.720 1.076 1.00 0.00 N ATOM 1772 CA LYS A 115 -8.763 -13.546 0.980 1.00 0.00 C ATOM 1773 C LYS A 115 -7.929 -12.301 1.252 1.00 0.00 C ATOM 1774 O LYS A 115 -6.756 -12.401 1.613 1.00 0.00 O ATOM 1775 CB LYS A 115 -9.887 -13.672 2.011 1.00 0.00 C ATOM 1776 CG LYS A 115 -11.081 -12.766 1.784 1.00 0.00 C ATOM 1777 CD LYS A 115 -12.072 -12.888 2.924 1.00 0.00 C ATOM 1778 CE LYS A 115 -13.322 -12.069 2.676 1.00 0.00 C ATOM 1779 NZ LYS A 115 -14.086 -11.863 3.931 1.00 0.00 N ATOM 0 H LYS A 115 -7.566 -14.897 2.015 1.00 0.00 H new ATOM 0 HA LYS A 115 -9.191 -13.463 -0.019 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -10.233 -14.705 2.022 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -9.476 -13.463 2.999 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -10.747 -11.732 1.695 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -11.567 -13.026 0.844 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -12.345 -13.935 3.058 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -11.601 -12.560 3.851 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -13.049 -11.103 2.251 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -13.951 -12.574 1.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -15.044 -11.530 3.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -14.146 -12.761 4.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -13.603 -11.154 4.519 1.00 0.00 H new ATOM 1793 N GLY A 116 -8.538 -11.145 1.081 1.00 0.00 N ATOM 1794 CA GLY A 116 -7.866 -9.897 1.366 1.00 0.00 C ATOM 1795 C GLY A 116 -7.092 -9.383 0.176 1.00 0.00 C ATOM 1796 O GLY A 116 -6.890 -10.102 -0.803 1.00 0.00 O ATOM 0 H GLY A 116 -9.496 -11.046 0.746 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.601 -9.151 1.669 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.187 -10.036 2.207 1.00 0.00 H new ATOM 1800 N PHE A 117 -6.676 -8.135 0.251 1.00 0.00 N ATOM 1801 CA PHE A 117 -5.890 -7.527 -0.811 1.00 0.00 C ATOM 1802 C PHE A 117 -4.535 -7.086 -0.286 1.00 0.00 C ATOM 1803 O PHE A 117 -3.519 -7.692 -0.610 1.00 0.00 O ATOM 1804 CB PHE A 117 -6.638 -6.342 -1.430 1.00 0.00 C ATOM 1805 CG PHE A 117 -7.834 -6.747 -2.243 1.00 0.00 C ATOM 1806 CD1 PHE A 117 -9.068 -6.935 -1.642 1.00 0.00 C ATOM 1807 CD2 PHE A 117 -7.721 -6.944 -3.609 1.00 0.00 C ATOM 1808 CE1 PHE A 117 -10.167 -7.312 -2.390 1.00 0.00 C ATOM 1809 CE2 PHE A 117 -8.815 -7.320 -4.363 1.00 0.00 C ATOM 1810 CZ PHE A 117 -10.040 -7.505 -3.752 1.00 0.00 C ATOM 0 H PHE A 117 -6.869 -7.517 1.039 1.00 0.00 H new ATOM 0 HA PHE A 117 -5.732 -8.274 -1.588 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -6.960 -5.670 -0.634 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -5.952 -5.780 -2.063 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -9.172 -6.785 -0.578 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -6.765 -6.802 -4.091 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.124 -7.456 -1.910 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -8.713 -7.469 -5.428 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.898 -7.800 -4.338 1.00 0.00 H new ATOM 1820 N LEU A 118 -4.560 -6.056 0.555 1.00 0.00 N ATOM 1821 CA LEU A 118 -3.355 -5.444 1.126 1.00 0.00 C ATOM 1822 C LEU A 118 -2.658 -4.580 0.075 1.00 0.00 C ATOM 1823 O LEU A 118 -2.351 -5.023 -1.030 1.00 0.00 O ATOM 1824 CB LEU A 118 -2.391 -6.506 1.681 1.00 0.00 C ATOM 1825 CG LEU A 118 -1.388 -6.046 2.754 1.00 0.00 C ATOM 1826 CD1 LEU A 118 -0.292 -5.183 2.156 1.00 0.00 C ATOM 1827 CD2 LEU A 118 -2.098 -5.298 3.867 1.00 0.00 C ATOM 0 H LEU A 118 -5.426 -5.615 0.865 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.660 -4.812 1.960 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.986 -7.318 2.099 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.827 -6.921 0.846 1.00 0.00 H new ATOM 0 HG LEU A 118 -0.923 -6.939 3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.399 -4.876 2.941 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.248 -5.753 1.400 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -0.735 -4.299 1.696 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.371 -4.982 4.615 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.599 -4.422 3.455 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.835 -5.952 4.332 1.00 0.00 H new ATOM 1839 N LEU A 119 -2.414 -3.343 0.440 1.00 0.00 N ATOM 1840 CA LEU A 119 -1.787 -2.381 -0.452 1.00 0.00 C ATOM 1841 C LEU A 119 -0.611 -1.717 0.248 1.00 0.00 C ATOM 1842 O LEU A 119 -0.739 -1.251 1.379 1.00 0.00 O ATOM 1843 CB LEU A 119 -2.808 -1.326 -0.895 1.00 0.00 C ATOM 1844 CG LEU A 119 -2.286 -0.277 -1.880 1.00 0.00 C ATOM 1845 CD1 LEU A 119 -1.867 -0.929 -3.189 1.00 0.00 C ATOM 1846 CD2 LEU A 119 -3.340 0.793 -2.128 1.00 0.00 C ATOM 0 H LEU A 119 -2.642 -2.970 1.362 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.422 -2.903 -1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -3.657 -1.836 -1.350 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -3.182 -0.813 -0.009 1.00 0.00 H new ATOM 0 HG LEU A 119 -1.409 0.198 -1.440 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -1.499 -0.165 -3.874 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -1.077 -1.655 -2.997 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -2.724 -1.434 -3.635 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -2.952 1.530 -2.831 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -4.236 0.332 -2.544 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -3.588 1.284 -1.187 1.00 0.00 H new ATOM 1858 N LEU A 120 0.533 -1.687 -0.417 1.00 0.00 N ATOM 1859 CA LEU A 120 1.730 -1.098 0.159 1.00 0.00 C ATOM 1860 C LEU A 120 2.262 0.027 -0.718 1.00 0.00 C ATOM 1861 O LEU A 120 2.541 -0.170 -1.902 1.00 0.00 O ATOM 1862 CB LEU A 120 2.813 -2.166 0.348 1.00 0.00 C ATOM 1863 CG LEU A 120 2.474 -3.282 1.336 1.00 0.00 C ATOM 1864 CD1 LEU A 120 3.551 -4.357 1.318 1.00 0.00 C ATOM 1865 CD2 LEU A 120 2.320 -2.718 2.739 1.00 0.00 C ATOM 0 H LEU A 120 0.657 -2.064 -1.357 1.00 0.00 H new ATOM 0 HA LEU A 120 1.464 -0.682 1.131 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.027 -2.616 -0.621 1.00 0.00 H new ATOM 0 HB3 LEU A 120 3.728 -1.676 0.681 1.00 0.00 H new ATOM 0 HG LEU A 120 1.529 -3.733 1.034 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.292 -5.143 2.028 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.624 -4.782 0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.509 -3.917 1.597 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.079 -3.525 3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.253 -2.244 3.045 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.518 -1.980 2.748 1.00 0.00 H new ATOM 1877 N GLY A 121 2.376 1.210 -0.136 1.00 0.00 N ATOM 1878 CA GLY A 121 2.996 2.319 -0.829 1.00 0.00 C ATOM 1879 C GLY A 121 4.483 2.348 -0.563 1.00 0.00 C ATOM 1880 O GLY A 121 5.222 1.529 -1.108 1.00 0.00 O ATOM 0 H GLY A 121 2.049 1.423 0.807 1.00 0.00 H new ATOM 0 HA2 GLY A 121 2.814 2.233 -1.900 1.00 0.00 H new ATOM 0 HA3 GLY A 121 2.545 3.256 -0.504 1.00 0.00 H new ATOM 1884 N SER A 122 4.914 3.264 0.300 1.00 0.00 N ATOM 1885 CA SER A 122 6.297 3.302 0.772 1.00 0.00 C ATOM 1886 C SER A 122 7.284 3.615 -0.360 1.00 0.00 C ATOM 1887 O SER A 122 6.942 4.269 -1.348 1.00 0.00 O ATOM 1888 CB SER A 122 6.653 1.957 1.427 1.00 0.00 C ATOM 1889 OG SER A 122 5.617 1.520 2.295 1.00 0.00 O ATOM 0 H SER A 122 4.320 3.996 0.690 1.00 0.00 H new ATOM 0 HA SER A 122 6.379 4.105 1.504 1.00 0.00 H new ATOM 0 HB2 SER A 122 6.825 1.207 0.655 1.00 0.00 H new ATOM 0 HB3 SER A 122 7.583 2.057 1.987 1.00 0.00 H new ATOM 0 HG SER A 122 5.069 0.848 1.838 1.00 0.00 H new ATOM 1895 N GLU A 123 8.517 3.168 -0.169 1.00 0.00 N ATOM 1896 CA GLU A 123 9.589 3.346 -1.134 1.00 0.00 C ATOM 1897 C GLU A 123 10.526 2.151 -0.976 1.00 0.00 C ATOM 1898 O GLU A 123 10.418 1.444 0.021 1.00 0.00 O ATOM 1899 CB GLU A 123 10.311 4.677 -0.866 1.00 0.00 C ATOM 1900 CG GLU A 123 10.931 5.325 -2.100 1.00 0.00 C ATOM 1901 CD GLU A 123 12.331 4.833 -2.407 1.00 0.00 C ATOM 1902 OE1 GLU A 123 13.288 5.327 -1.772 1.00 0.00 O ATOM 1903 OE2 GLU A 123 12.485 3.962 -3.288 1.00 0.00 O ATOM 0 H GLU A 123 8.803 2.666 0.671 1.00 0.00 H new ATOM 0 HA GLU A 123 9.214 3.389 -2.156 1.00 0.00 H new ATOM 0 HB2 GLU A 123 9.602 5.376 -0.422 1.00 0.00 H new ATOM 0 HB3 GLU A 123 11.095 4.507 -0.128 1.00 0.00 H new ATOM 0 HG2 GLU A 123 10.291 5.133 -2.961 1.00 0.00 H new ATOM 0 HG3 GLU A 123 10.958 6.405 -1.958 1.00 0.00 H new ATOM 1910 N TYR A 124 11.436 1.933 -1.924 1.00 0.00 N ATOM 1911 CA TYR A 124 12.287 0.736 -1.925 1.00 0.00 C ATOM 1912 C TYR A 124 11.434 -0.507 -2.174 1.00 0.00 C ATOM 1913 O TYR A 124 10.314 -0.412 -2.668 1.00 0.00 O ATOM 1914 CB TYR A 124 13.067 0.589 -0.606 1.00 0.00 C ATOM 1915 CG TYR A 124 13.947 1.771 -0.270 1.00 0.00 C ATOM 1916 CD1 TYR A 124 15.141 1.988 -0.941 1.00 0.00 C ATOM 1917 CD2 TYR A 124 13.581 2.671 0.724 1.00 0.00 C ATOM 1918 CE1 TYR A 124 15.945 3.066 -0.633 1.00 0.00 C ATOM 1919 CE2 TYR A 124 14.379 3.752 1.038 1.00 0.00 C ATOM 1920 CZ TYR A 124 15.559 3.945 0.357 1.00 0.00 C ATOM 1921 OH TYR A 124 16.361 5.019 0.664 1.00 0.00 O ATOM 0 H TYR A 124 11.606 2.568 -2.704 1.00 0.00 H new ATOM 0 HA TYR A 124 13.016 0.845 -2.728 1.00 0.00 H new ATOM 0 HB2 TYR A 124 12.357 0.436 0.207 1.00 0.00 H new ATOM 0 HB3 TYR A 124 13.686 -0.306 -0.661 1.00 0.00 H new ATOM 0 HD1 TYR A 124 15.446 1.302 -1.717 1.00 0.00 H new ATOM 0 HD2 TYR A 124 12.655 2.522 1.260 1.00 0.00 H new ATOM 0 HE1 TYR A 124 16.872 3.221 -1.165 1.00 0.00 H new ATOM 0 HE2 TYR A 124 14.079 4.442 1.813 1.00 0.00 H new ATOM 0 HH TYR A 124 15.947 5.542 1.382 1.00 0.00 H new ATOM 1931 N THR A 125 11.969 -1.678 -1.873 1.00 0.00 N ATOM 1932 CA THR A 125 11.215 -2.904 -2.052 1.00 0.00 C ATOM 1933 C THR A 125 11.257 -3.753 -0.784 1.00 0.00 C ATOM 1934 O THR A 125 12.234 -3.703 -0.036 1.00 0.00 O ATOM 1935 CB THR A 125 11.762 -3.715 -3.244 1.00 0.00 C ATOM 1936 OG1 THR A 125 13.196 -3.765 -3.187 1.00 0.00 O ATOM 1937 CG2 THR A 125 11.319 -3.114 -4.570 1.00 0.00 C ATOM 0 H THR A 125 12.913 -1.804 -1.507 1.00 0.00 H new ATOM 0 HA THR A 125 10.180 -2.632 -2.260 1.00 0.00 H new ATOM 0 HB THR A 125 11.360 -4.726 -3.177 1.00 0.00 H new ATOM 0 HG1 THR A 125 13.536 -4.283 -3.946 1.00 0.00 H new ATOM 0 HG21 THR A 125 11.721 -3.708 -5.391 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.230 -3.111 -4.623 1.00 0.00 H new ATOM 0 HG23 THR A 125 11.688 -2.091 -4.648 1.00 0.00 H new ATOM 1945 N PRO A 126 10.225 -4.585 -0.555 1.00 0.00 N ATOM 1946 CA PRO A 126 10.122 -5.401 0.662 1.00 0.00 C ATOM 1947 C PRO A 126 11.181 -6.496 0.702 1.00 0.00 C ATOM 1948 O PRO A 126 11.494 -7.053 1.754 1.00 0.00 O ATOM 1949 CB PRO A 126 8.724 -6.013 0.571 1.00 0.00 C ATOM 1950 CG PRO A 126 8.379 -5.991 -0.879 1.00 0.00 C ATOM 1951 CD PRO A 126 9.074 -4.789 -1.458 1.00 0.00 C ATOM 0 HA PRO A 126 10.278 -4.811 1.565 1.00 0.00 H new ATOM 0 HB2 PRO A 126 8.714 -7.030 0.962 1.00 0.00 H new ATOM 0 HB3 PRO A 126 8.005 -5.439 1.155 1.00 0.00 H new ATOM 0 HG2 PRO A 126 8.709 -6.906 -1.371 1.00 0.00 H new ATOM 0 HG3 PRO A 126 7.300 -5.923 -1.021 1.00 0.00 H new ATOM 0 HD2 PRO A 126 9.396 -4.968 -2.484 1.00 0.00 H new ATOM 0 HD3 PRO A 126 8.419 -3.918 -1.476 1.00 0.00 H new ATOM 1959 N GLN A 127 11.738 -6.783 -0.462 1.00 0.00 N ATOM 1960 CA GLN A 127 12.786 -7.784 -0.599 1.00 0.00 C ATOM 1961 C GLN A 127 14.106 -7.243 -0.063 1.00 0.00 C ATOM 1962 O GLN A 127 15.020 -8.001 0.256 1.00 0.00 O ATOM 1963 CB GLN A 127 12.945 -8.182 -2.069 1.00 0.00 C ATOM 1964 CG GLN A 127 11.688 -8.780 -2.679 1.00 0.00 C ATOM 1965 CD GLN A 127 11.809 -9.011 -4.174 1.00 0.00 C ATOM 1966 OE1 GLN A 127 13.016 -9.292 -4.644 1.00 0.00 O flip ATOM 1967 NE2 GLN A 127 10.819 -8.944 -4.902 1.00 0.00 N flip ATOM 0 H GLN A 127 11.478 -6.330 -1.338 1.00 0.00 H new ATOM 0 HA GLN A 127 12.505 -8.664 -0.021 1.00 0.00 H new ATOM 0 HB2 GLN A 127 13.235 -7.303 -2.645 1.00 0.00 H new ATOM 0 HB3 GLN A 127 13.758 -8.902 -2.155 1.00 0.00 H new ATOM 0 HG2 GLN A 127 11.467 -9.727 -2.187 1.00 0.00 H new ATOM 0 HG3 GLN A 127 10.845 -8.116 -2.486 1.00 0.00 H new ATOM 0 HE21 GLN A 127 9.906 -8.725 -4.503 1.00 0.00 H new ATOM 0 HE22 GLN A 127 10.911 -9.107 -5.905 1.00 0.00 H new ATOM 1976 N GLN A 128 14.191 -5.922 0.040 1.00 0.00 N ATOM 1977 CA GLN A 128 15.407 -5.267 0.496 1.00 0.00 C ATOM 1978 C GLN A 128 15.372 -5.085 2.010 1.00 0.00 C ATOM 1979 O GLN A 128 16.364 -4.697 2.627 1.00 0.00 O ATOM 1980 CB GLN A 128 15.555 -3.910 -0.196 1.00 0.00 C ATOM 1981 CG GLN A 128 16.983 -3.390 -0.229 1.00 0.00 C ATOM 1982 CD GLN A 128 17.890 -4.248 -1.086 1.00 0.00 C ATOM 1983 OE1 GLN A 128 18.525 -5.190 -0.605 1.00 0.00 O ATOM 1984 NE2 GLN A 128 17.947 -3.932 -2.368 1.00 0.00 N ATOM 0 H GLN A 128 13.429 -5.283 -0.187 1.00 0.00 H new ATOM 0 HA GLN A 128 16.263 -5.891 0.241 1.00 0.00 H new ATOM 0 HB2 GLN A 128 15.184 -3.991 -1.218 1.00 0.00 H new ATOM 0 HB3 GLN A 128 14.925 -3.182 0.315 1.00 0.00 H new ATOM 0 HG2 GLN A 128 16.986 -2.369 -0.611 1.00 0.00 H new ATOM 0 HG3 GLN A 128 17.377 -3.352 0.787 1.00 0.00 H new ATOM 0 HE21 GLN A 128 17.405 -3.145 -2.724 1.00 0.00 H new ATOM 0 HE22 GLN A 128 18.533 -4.476 -3.002 1.00 0.00 H new ATOM 1993 N LEU A 129 14.221 -5.376 2.601 1.00 0.00 N ATOM 1994 CA LEU A 129 14.029 -5.208 4.034 1.00 0.00 C ATOM 1995 C LEU A 129 14.847 -6.200 4.844 1.00 0.00 C ATOM 1996 O LEU A 129 14.881 -7.399 4.549 1.00 0.00 O ATOM 1997 CB LEU A 129 12.552 -5.354 4.399 1.00 0.00 C ATOM 1998 CG LEU A 129 11.689 -4.131 4.117 1.00 0.00 C ATOM 1999 CD1 LEU A 129 10.227 -4.431 4.415 1.00 0.00 C ATOM 2000 CD2 LEU A 129 12.170 -2.955 4.949 1.00 0.00 C ATOM 0 H LEU A 129 13.403 -5.731 2.107 1.00 0.00 H new ATOM 0 HA LEU A 129 14.373 -4.204 4.281 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.141 -6.202 3.851 1.00 0.00 H new ATOM 0 HB3 LEU A 129 12.479 -5.594 5.460 1.00 0.00 H new ATOM 0 HG LEU A 129 11.777 -3.874 3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.625 -3.546 4.208 1.00 0.00 H new ATOM 0 HD12 LEU A 129 9.889 -5.255 3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 129 10.119 -4.707 5.464 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.548 -2.084 4.742 1.00 0.00 H new ATOM 0 HD22 LEU A 129 12.102 -3.206 6.007 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.206 -2.730 4.696 1.00 0.00 H new ATOM 2012 N VAL A 130 15.501 -5.680 5.871 1.00 0.00 N ATOM 2013 CA VAL A 130 16.208 -6.504 6.834 1.00 0.00 C ATOM 2014 C VAL A 130 15.256 -6.861 7.968 1.00 0.00 C ATOM 2015 O VAL A 130 15.209 -6.188 9.001 1.00 0.00 O ATOM 2016 CB VAL A 130 17.460 -5.793 7.396 1.00 0.00 C ATOM 2017 CG1 VAL A 130 18.238 -6.718 8.318 1.00 0.00 C ATOM 2018 CG2 VAL A 130 18.348 -5.301 6.261 1.00 0.00 C ATOM 0 H VAL A 130 15.556 -4.679 6.058 1.00 0.00 H new ATOM 0 HA VAL A 130 16.552 -7.406 6.328 1.00 0.00 H new ATOM 0 HB VAL A 130 17.131 -4.931 7.977 1.00 0.00 H new ATOM 0 HG11 VAL A 130 19.115 -6.196 8.702 1.00 0.00 H new ATOM 0 HG12 VAL A 130 17.603 -7.020 9.150 1.00 0.00 H new ATOM 0 HG13 VAL A 130 18.555 -7.601 7.764 1.00 0.00 H new ATOM 0 HG21 VAL A 130 19.225 -4.803 6.675 1.00 0.00 H new ATOM 0 HG22 VAL A 130 18.665 -6.149 5.654 1.00 0.00 H new ATOM 0 HG23 VAL A 130 17.791 -4.599 5.641 1.00 0.00 H new ATOM 2028 N ILE A 131 14.462 -7.891 7.734 1.00 0.00 N ATOM 2029 CA ILE A 131 13.423 -8.302 8.663 1.00 0.00 C ATOM 2030 C ILE A 131 13.435 -9.814 8.821 1.00 0.00 C ATOM 2031 O ILE A 131 14.321 -10.486 8.288 1.00 0.00 O ATOM 2032 CB ILE A 131 12.021 -7.861 8.175 1.00 0.00 C ATOM 2033 CG1 ILE A 131 11.768 -8.377 6.752 1.00 0.00 C ATOM 2034 CG2 ILE A 131 11.881 -6.345 8.236 1.00 0.00 C ATOM 2035 CD1 ILE A 131 10.398 -8.032 6.206 1.00 0.00 C ATOM 0 H ILE A 131 14.519 -8.467 6.894 1.00 0.00 H new ATOM 0 HA ILE A 131 13.628 -7.822 9.620 1.00 0.00 H new ATOM 0 HB ILE A 131 11.271 -8.294 8.837 1.00 0.00 H new ATOM 0 HG12 ILE A 131 12.527 -7.965 6.087 1.00 0.00 H new ATOM 0 HG13 ILE A 131 11.889 -9.460 6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 131 10.889 -6.057 7.889 1.00 0.00 H new ATOM 0 HG22 ILE A 131 12.018 -6.008 9.264 1.00 0.00 H new ATOM 0 HG23 ILE A 131 12.636 -5.884 7.599 1.00 0.00 H new ATOM 0 HD11 ILE A 131 10.297 -8.431 5.197 1.00 0.00 H new ATOM 0 HD12 ILE A 131 9.631 -8.467 6.847 1.00 0.00 H new ATOM 0 HD13 ILE A 131 10.278 -6.949 6.181 1.00 0.00 H new ATOM 2047 N ARG A 132 12.462 -10.341 9.553 1.00 0.00 N ATOM 2048 CA ARG A 132 12.319 -11.786 9.714 1.00 0.00 C ATOM 2049 C ARG A 132 12.257 -12.456 8.346 1.00 0.00 C ATOM 2050 O ARG A 132 11.503 -12.015 7.476 1.00 0.00 O ATOM 2051 CB ARG A 132 11.032 -12.126 10.472 1.00 0.00 C ATOM 2052 CG ARG A 132 10.750 -11.255 11.684 1.00 0.00 C ATOM 2053 CD ARG A 132 11.803 -11.410 12.768 1.00 0.00 C ATOM 2054 NE ARG A 132 11.379 -10.762 14.005 1.00 0.00 N ATOM 2055 CZ ARG A 132 12.014 -9.737 14.568 1.00 0.00 C ATOM 2056 NH1 ARG A 132 13.112 -9.241 14.016 1.00 0.00 N ATOM 2057 NH2 ARG A 132 11.548 -9.200 15.687 1.00 0.00 N ATOM 0 H ARG A 132 11.759 -9.791 10.046 1.00 0.00 H new ATOM 0 HA ARG A 132 13.180 -12.146 10.278 1.00 0.00 H new ATOM 0 HB2 ARG A 132 10.191 -12.047 9.783 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.083 -13.166 10.795 1.00 0.00 H new ATOM 0 HG2 ARG A 132 10.703 -10.211 11.374 1.00 0.00 H new ATOM 0 HG3 ARG A 132 9.772 -11.511 12.092 1.00 0.00 H new ATOM 0 HD2 ARG A 132 11.987 -12.468 12.952 1.00 0.00 H new ATOM 0 HD3 ARG A 132 12.744 -10.977 12.430 1.00 0.00 H new ATOM 0 HE ARG A 132 10.542 -11.118 14.468 1.00 0.00 H new ATOM 0 HH11 ARG A 132 13.476 -9.645 13.153 1.00 0.00 H new ATOM 0 HH12 ARG A 132 13.593 -8.455 14.454 1.00 0.00 H new ATOM 0 HH21 ARG A 132 10.702 -9.573 16.118 1.00 0.00 H new ATOM 0 HH22 ARG A 132 12.036 -8.414 16.117 1.00 0.00 H new ATOM 2071 N GLU A 133 13.036 -13.516 8.156 1.00 0.00 N ATOM 2072 CA GLU A 133 12.991 -14.272 6.906 1.00 0.00 C ATOM 2073 C GLU A 133 11.579 -14.806 6.690 1.00 0.00 C ATOM 2074 O GLU A 133 11.060 -14.800 5.572 1.00 0.00 O ATOM 2075 CB GLU A 133 14.000 -15.427 6.929 1.00 0.00 C ATOM 2076 CG GLU A 133 14.079 -16.191 5.615 1.00 0.00 C ATOM 2077 CD GLU A 133 15.057 -17.345 5.663 1.00 0.00 C ATOM 2078 OE1 GLU A 133 16.272 -17.108 5.513 1.00 0.00 O ATOM 2079 OE2 GLU A 133 14.615 -18.498 5.835 1.00 0.00 O ATOM 0 H GLU A 133 13.701 -13.870 8.844 1.00 0.00 H new ATOM 0 HA GLU A 133 13.259 -13.610 6.083 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.987 -15.032 7.170 1.00 0.00 H new ATOM 0 HB3 GLU A 133 13.730 -16.119 7.727 1.00 0.00 H new ATOM 0 HG2 GLU A 133 13.089 -16.570 5.361 1.00 0.00 H new ATOM 0 HG3 GLU A 133 14.372 -15.506 4.819 1.00 0.00 H new ATOM 2086 N ASP A 134 10.961 -15.221 7.791 1.00 0.00 N ATOM 2087 CA ASP A 134 9.585 -15.711 7.800 1.00 0.00 C ATOM 2088 C ASP A 134 8.637 -14.655 7.244 1.00 0.00 C ATOM 2089 O ASP A 134 7.677 -14.961 6.538 1.00 0.00 O ATOM 2090 CB ASP A 134 9.154 -16.046 9.236 1.00 0.00 C ATOM 2091 CG ASP A 134 10.184 -16.854 10.002 1.00 0.00 C ATOM 2092 OD1 ASP A 134 11.272 -16.310 10.301 1.00 0.00 O ATOM 2093 OD2 ASP A 134 9.907 -18.022 10.338 1.00 0.00 O ATOM 0 H ASP A 134 11.404 -15.227 8.710 1.00 0.00 H new ATOM 0 HA ASP A 134 9.541 -16.605 7.178 1.00 0.00 H new ATOM 0 HB2 ASP A 134 8.958 -15.119 9.774 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.217 -16.602 9.206 1.00 0.00 H new ATOM 2098 N LEU A 135 8.917 -13.405 7.580 1.00 0.00 N ATOM 2099 CA LEU A 135 8.064 -12.292 7.195 1.00 0.00 C ATOM 2100 C LEU A 135 8.349 -11.851 5.766 1.00 0.00 C ATOM 2101 O LEU A 135 7.436 -11.493 5.024 1.00 0.00 O ATOM 2102 CB LEU A 135 8.268 -11.120 8.161 1.00 0.00 C ATOM 2103 CG LEU A 135 7.453 -9.859 7.855 1.00 0.00 C ATOM 2104 CD1 LEU A 135 5.963 -10.144 7.941 1.00 0.00 C ATOM 2105 CD2 LEU A 135 7.837 -8.736 8.807 1.00 0.00 C ATOM 0 H LEU A 135 9.737 -13.135 8.124 1.00 0.00 H new ATOM 0 HA LEU A 135 7.027 -12.623 7.245 1.00 0.00 H new ATOM 0 HB2 LEU A 135 8.020 -11.455 9.168 1.00 0.00 H new ATOM 0 HB3 LEU A 135 9.325 -10.855 8.164 1.00 0.00 H new ATOM 0 HG LEU A 135 7.680 -9.544 6.836 1.00 0.00 H new ATOM 0 HD11 LEU A 135 5.405 -9.234 7.720 1.00 0.00 H new ATOM 0 HD12 LEU A 135 5.698 -10.917 7.219 1.00 0.00 H new ATOM 0 HD13 LEU A 135 5.715 -10.486 8.946 1.00 0.00 H new ATOM 0 HD21 LEU A 135 7.250 -7.847 8.577 1.00 0.00 H new ATOM 0 HD22 LEU A 135 7.640 -9.046 9.833 1.00 0.00 H new ATOM 0 HD23 LEU A 135 8.897 -8.510 8.694 1.00 0.00 H new ATOM 2117 N ARG A 136 9.618 -11.890 5.373 1.00 0.00 N ATOM 2118 CA ARG A 136 10.015 -11.378 4.070 1.00 0.00 C ATOM 2119 C ARG A 136 9.549 -12.297 2.944 1.00 0.00 C ATOM 2120 O ARG A 136 9.309 -11.838 1.829 1.00 0.00 O ATOM 2121 CB ARG A 136 11.528 -11.168 3.996 1.00 0.00 C ATOM 2122 CG ARG A 136 11.943 -10.260 2.848 1.00 0.00 C ATOM 2123 CD ARG A 136 13.444 -10.029 2.820 1.00 0.00 C ATOM 2124 NE ARG A 136 14.177 -11.230 2.433 1.00 0.00 N ATOM 2125 CZ ARG A 136 15.497 -11.264 2.264 1.00 0.00 C ATOM 2126 NH1 ARG A 136 16.226 -10.177 2.498 1.00 0.00 N ATOM 2127 NH2 ARG A 136 16.089 -12.375 1.857 1.00 0.00 N ATOM 0 H ARG A 136 10.382 -12.268 5.934 1.00 0.00 H new ATOM 0 HA ARG A 136 9.528 -10.411 3.941 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.877 -10.740 4.936 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.019 -12.135 3.884 1.00 0.00 H new ATOM 0 HG2 ARG A 136 11.626 -10.702 1.903 1.00 0.00 H new ATOM 0 HG3 ARG A 136 11.430 -9.302 2.939 1.00 0.00 H new ATOM 0 HD2 ARG A 136 13.674 -9.224 2.122 1.00 0.00 H new ATOM 0 HD3 ARG A 136 13.779 -9.702 3.805 1.00 0.00 H new ATOM 0 HE ARG A 136 13.649 -12.090 2.284 1.00 0.00 H new ATOM 0 HH11 ARG A 136 15.774 -9.317 2.807 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.237 -10.204 2.368 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.534 -13.210 1.671 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.101 -12.396 1.729 1.00 0.00 H new ATOM 2141 N THR A 137 9.402 -13.589 3.229 1.00 0.00 N ATOM 2142 CA THR A 137 8.864 -14.512 2.240 1.00 0.00 C ATOM 2143 C THR A 137 7.395 -14.197 1.979 1.00 0.00 C ATOM 2144 O THR A 137 6.908 -14.321 0.854 1.00 0.00 O ATOM 2145 CB THR A 137 9.016 -15.982 2.679 1.00 0.00 C ATOM 2146 OG1 THR A 137 8.546 -16.144 4.023 1.00 0.00 O ATOM 2147 CG2 THR A 137 10.469 -16.427 2.583 1.00 0.00 C ATOM 0 H THR A 137 9.645 -14.013 4.124 1.00 0.00 H new ATOM 0 HA THR A 137 9.437 -14.381 1.322 1.00 0.00 H new ATOM 0 HB THR A 137 8.419 -16.603 2.011 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.645 -17.081 4.293 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.552 -17.467 2.898 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.812 -16.331 1.553 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.084 -15.802 3.230 1.00 0.00 H new ATOM 2155 N ARG A 138 6.698 -13.768 3.029 1.00 0.00 N ATOM 2156 CA ARG A 138 5.324 -13.310 2.915 1.00 0.00 C ATOM 2157 C ARG A 138 5.260 -11.997 2.141 1.00 0.00 C ATOM 2158 O ARG A 138 4.292 -11.728 1.431 1.00 0.00 O ATOM 2159 CB ARG A 138 4.722 -13.128 4.305 1.00 0.00 C ATOM 2160 CG ARG A 138 4.714 -14.400 5.131 1.00 0.00 C ATOM 2161 CD ARG A 138 3.768 -15.432 4.547 1.00 0.00 C ATOM 2162 NE ARG A 138 3.565 -16.571 5.440 1.00 0.00 N ATOM 2163 CZ ARG A 138 3.153 -17.773 5.031 1.00 0.00 C ATOM 2164 NH1 ARG A 138 3.001 -18.024 3.733 1.00 0.00 N ATOM 2165 NH2 ARG A 138 2.918 -18.733 5.920 1.00 0.00 N ATOM 0 H ARG A 138 7.072 -13.730 3.977 1.00 0.00 H new ATOM 0 HA ARG A 138 4.750 -14.060 2.371 1.00 0.00 H new ATOM 0 HB2 ARG A 138 5.284 -12.361 4.838 1.00 0.00 H new ATOM 0 HB3 ARG A 138 3.700 -12.763 4.205 1.00 0.00 H new ATOM 0 HG2 ARG A 138 5.722 -14.812 5.177 1.00 0.00 H new ATOM 0 HG3 ARG A 138 4.417 -14.170 6.154 1.00 0.00 H new ATOM 0 HD2 ARG A 138 2.807 -14.962 4.338 1.00 0.00 H new ATOM 0 HD3 ARG A 138 4.164 -15.786 3.595 1.00 0.00 H new ATOM 0 HE ARG A 138 3.749 -16.440 6.435 1.00 0.00 H new ATOM 0 HH11 ARG A 138 3.200 -17.296 3.046 1.00 0.00 H new ATOM 0 HH12 ARG A 138 2.686 -18.944 3.425 1.00 0.00 H new ATOM 0 HH21 ARG A 138 3.052 -18.551 6.915 1.00 0.00 H new ATOM 0 HH22 ARG A 138 2.603 -19.651 5.608 1.00 0.00 H new ATOM 2179 N MET A 139 6.306 -11.189 2.274 1.00 0.00 N ATOM 2180 CA MET A 139 6.406 -9.926 1.549 1.00 0.00 C ATOM 2181 C MET A 139 6.559 -10.169 0.052 1.00 0.00 C ATOM 2182 O MET A 139 6.278 -9.296 -0.761 1.00 0.00 O ATOM 2183 CB MET A 139 7.599 -9.112 2.055 1.00 0.00 C ATOM 2184 CG MET A 139 7.444 -8.598 3.475 1.00 0.00 C ATOM 2185 SD MET A 139 6.159 -7.341 3.630 1.00 0.00 S ATOM 2186 CE MET A 139 6.326 -6.895 5.358 1.00 0.00 C ATOM 0 H MET A 139 7.102 -11.387 2.881 1.00 0.00 H new ATOM 0 HA MET A 139 5.486 -9.368 1.724 1.00 0.00 H new ATOM 0 HB2 MET A 139 8.495 -9.730 2.000 1.00 0.00 H new ATOM 0 HB3 MET A 139 7.755 -8.264 1.388 1.00 0.00 H new ATOM 0 HG2 MET A 139 7.210 -9.433 4.135 1.00 0.00 H new ATOM 0 HG3 MET A 139 8.394 -8.183 3.812 1.00 0.00 H new ATOM 0 HE1 MET A 139 5.596 -6.125 5.607 1.00 0.00 H new ATOM 0 HE2 MET A 139 6.153 -7.774 5.979 1.00 0.00 H new ATOM 0 HE3 MET A 139 7.331 -6.515 5.540 1.00 0.00 H new ATOM 2196 N ALA A 140 6.993 -11.371 -0.305 1.00 0.00 N ATOM 2197 CA ALA A 140 7.242 -11.711 -1.700 1.00 0.00 C ATOM 2198 C ALA A 140 5.953 -12.096 -2.428 1.00 0.00 C ATOM 2199 O ALA A 140 5.990 -12.560 -3.567 1.00 0.00 O ATOM 2200 CB ALA A 140 8.260 -12.838 -1.792 1.00 0.00 C ATOM 0 H ALA A 140 7.180 -12.128 0.353 1.00 0.00 H new ATOM 0 HA ALA A 140 7.644 -10.825 -2.191 1.00 0.00 H new ATOM 0 HB1 ALA A 140 8.438 -13.083 -2.839 1.00 0.00 H new ATOM 0 HB2 ALA A 140 9.195 -12.522 -1.329 1.00 0.00 H new ATOM 0 HB3 ALA A 140 7.877 -13.717 -1.273 1.00 0.00 H new ATOM 2206 N TYR A 141 4.815 -11.904 -1.772 1.00 0.00 N ATOM 2207 CA TYR A 141 3.526 -12.197 -2.385 1.00 0.00 C ATOM 2208 C TYR A 141 2.976 -10.985 -3.128 1.00 0.00 C ATOM 2209 O TYR A 141 2.016 -11.102 -3.893 1.00 0.00 O ATOM 2210 CB TYR A 141 2.510 -12.645 -1.331 1.00 0.00 C ATOM 2211 CG TYR A 141 2.680 -14.074 -0.865 1.00 0.00 C ATOM 2212 CD1 TYR A 141 3.619 -14.403 0.099 1.00 0.00 C ATOM 2213 CD2 TYR A 141 1.887 -15.089 -1.384 1.00 0.00 C ATOM 2214 CE1 TYR A 141 3.768 -15.703 0.536 1.00 0.00 C ATOM 2215 CE2 TYR A 141 2.027 -16.393 -0.951 1.00 0.00 C ATOM 2216 CZ TYR A 141 2.971 -16.695 0.010 1.00 0.00 C ATOM 2217 OH TYR A 141 3.116 -17.992 0.448 1.00 0.00 O ATOM 0 H TYR A 141 4.759 -11.548 -0.818 1.00 0.00 H new ATOM 0 HA TYR A 141 3.687 -13.005 -3.099 1.00 0.00 H new ATOM 0 HB2 TYR A 141 2.585 -11.983 -0.468 1.00 0.00 H new ATOM 0 HB3 TYR A 141 1.506 -12.526 -1.738 1.00 0.00 H new ATOM 0 HD1 TYR A 141 4.245 -13.628 0.516 1.00 0.00 H new ATOM 0 HD2 TYR A 141 1.150 -14.855 -2.138 1.00 0.00 H new ATOM 0 HE1 TYR A 141 4.506 -15.942 1.287 1.00 0.00 H new ATOM 0 HE2 TYR A 141 1.402 -17.172 -1.362 1.00 0.00 H new ATOM 0 HH TYR A 141 2.478 -18.569 -0.022 1.00 0.00 H new ATOM 2227 N CYS A 142 3.580 -9.825 -2.909 1.00 0.00 N ATOM 2228 CA CYS A 142 3.094 -8.593 -3.492 1.00 0.00 C ATOM 2229 C CYS A 142 3.698 -8.376 -4.866 1.00 0.00 C ATOM 2230 O CYS A 142 4.866 -8.690 -5.105 1.00 0.00 O ATOM 2231 CB CYS A 142 3.415 -7.397 -2.587 1.00 0.00 C ATOM 2232 SG CYS A 142 5.179 -7.038 -2.431 1.00 0.00 S ATOM 0 H CYS A 142 4.411 -9.717 -2.328 1.00 0.00 H new ATOM 0 HA CYS A 142 2.012 -8.675 -3.592 1.00 0.00 H new ATOM 0 HB2 CYS A 142 2.909 -6.514 -2.978 1.00 0.00 H new ATOM 0 HB3 CYS A 142 3.005 -7.586 -1.595 1.00 0.00 H new ATOM 0 HG CYS A 142 5.721 -7.877 -1.599 1.00 0.00 H new ATOM 2238 N LEU A 143 2.888 -7.862 -5.765 1.00 0.00 N ATOM 2239 CA LEU A 143 3.354 -7.473 -7.085 1.00 0.00 C ATOM 2240 C LEU A 143 4.038 -6.118 -6.995 1.00 0.00 C ATOM 2241 O LEU A 143 3.727 -5.320 -6.112 1.00 0.00 O ATOM 2242 CB LEU A 143 2.196 -7.398 -8.089 1.00 0.00 C ATOM 2243 CG LEU A 143 1.573 -8.731 -8.504 1.00 0.00 C ATOM 2244 CD1 LEU A 143 0.727 -9.324 -7.386 1.00 0.00 C ATOM 2245 CD2 LEU A 143 0.744 -8.553 -9.764 1.00 0.00 C ATOM 0 H LEU A 143 1.893 -7.701 -5.607 1.00 0.00 H new ATOM 0 HA LEU A 143 4.057 -8.228 -7.437 1.00 0.00 H new ATOM 0 HB2 LEU A 143 1.412 -6.772 -7.662 1.00 0.00 H new ATOM 0 HB3 LEU A 143 2.553 -6.893 -8.986 1.00 0.00 H new ATOM 0 HG LEU A 143 2.383 -9.431 -8.710 1.00 0.00 H new ATOM 0 HD11 LEU A 143 0.300 -10.271 -7.716 1.00 0.00 H new ATOM 0 HD12 LEU A 143 1.351 -9.494 -6.508 1.00 0.00 H new ATOM 0 HD13 LEU A 143 -0.076 -8.633 -7.132 1.00 0.00 H new ATOM 0 HD21 LEU A 143 0.306 -9.509 -10.049 1.00 0.00 H new ATOM 0 HD22 LEU A 143 -0.051 -7.831 -9.578 1.00 0.00 H new ATOM 0 HD23 LEU A 143 1.381 -8.191 -10.571 1.00 0.00 H new ATOM 2257 N VAL A 144 4.947 -5.849 -7.913 1.00 0.00 N ATOM 2258 CA VAL A 144 5.714 -4.619 -7.877 1.00 0.00 C ATOM 2259 C VAL A 144 5.435 -3.786 -9.118 1.00 0.00 C ATOM 2260 O VAL A 144 5.725 -4.205 -10.239 1.00 0.00 O ATOM 2261 CB VAL A 144 7.230 -4.902 -7.785 1.00 0.00 C ATOM 2262 CG1 VAL A 144 8.016 -3.603 -7.715 1.00 0.00 C ATOM 2263 CG2 VAL A 144 7.545 -5.783 -6.582 1.00 0.00 C ATOM 0 H VAL A 144 5.172 -6.466 -8.693 1.00 0.00 H new ATOM 0 HA VAL A 144 5.408 -4.068 -6.987 1.00 0.00 H new ATOM 0 HB VAL A 144 7.529 -5.436 -8.687 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.081 -3.825 -7.651 1.00 0.00 H new ATOM 0 HG12 VAL A 144 7.822 -3.012 -8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.709 -3.039 -6.834 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.618 -5.969 -6.538 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.226 -5.280 -5.669 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.016 -6.731 -6.677 1.00 0.00 H new ATOM 2273 N TYR A 145 4.857 -2.617 -8.911 1.00 0.00 N ATOM 2274 CA TYR A 145 4.594 -1.693 -10.004 1.00 0.00 C ATOM 2275 C TYR A 145 5.540 -0.505 -9.950 1.00 0.00 C ATOM 2276 O TYR A 145 5.581 0.232 -8.960 1.00 0.00 O ATOM 2277 CB TYR A 145 3.147 -1.194 -9.972 1.00 0.00 C ATOM 2278 CG TYR A 145 2.139 -2.161 -10.547 1.00 0.00 C ATOM 2279 CD1 TYR A 145 2.125 -2.447 -11.905 1.00 0.00 C ATOM 2280 CD2 TYR A 145 1.190 -2.770 -9.740 1.00 0.00 C ATOM 2281 CE1 TYR A 145 1.194 -3.313 -12.441 1.00 0.00 C ATOM 2282 CE2 TYR A 145 0.255 -3.642 -10.269 1.00 0.00 C ATOM 2283 CZ TYR A 145 0.263 -3.909 -11.621 1.00 0.00 C ATOM 2284 OH TYR A 145 -0.665 -4.770 -12.158 1.00 0.00 O ATOM 0 H TYR A 145 4.559 -2.282 -7.995 1.00 0.00 H new ATOM 0 HA TYR A 145 4.757 -2.237 -10.934 1.00 0.00 H new ATOM 0 HB2 TYR A 145 2.874 -0.975 -8.940 1.00 0.00 H new ATOM 0 HB3 TYR A 145 3.087 -0.256 -10.523 1.00 0.00 H new ATOM 0 HD1 TYR A 145 2.855 -1.984 -12.553 1.00 0.00 H new ATOM 0 HD2 TYR A 145 1.181 -2.560 -8.681 1.00 0.00 H new ATOM 0 HE1 TYR A 145 1.196 -3.522 -13.500 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -0.476 -4.110 -9.627 1.00 0.00 H new ATOM 0 HH TYR A 145 -1.249 -5.107 -11.447 1.00 0.00 H new ATOM 2294 N GLU A 146 6.304 -0.328 -11.014 1.00 0.00 N ATOM 2295 CA GLU A 146 7.161 0.834 -11.146 1.00 0.00 C ATOM 2296 C GLU A 146 6.355 2.006 -11.699 1.00 0.00 C ATOM 2297 O GLU A 146 5.890 1.978 -12.839 1.00 0.00 O ATOM 2298 CB GLU A 146 8.366 0.519 -12.040 1.00 0.00 C ATOM 2299 CG GLU A 146 7.999 -0.128 -13.365 1.00 0.00 C ATOM 2300 CD GLU A 146 9.195 -0.320 -14.276 1.00 0.00 C ATOM 2301 OE1 GLU A 146 9.541 0.626 -15.011 1.00 0.00 O ATOM 2302 OE2 GLU A 146 9.786 -1.423 -14.274 1.00 0.00 O ATOM 0 H GLU A 146 6.347 -0.977 -11.800 1.00 0.00 H new ATOM 0 HA GLU A 146 7.544 1.109 -10.163 1.00 0.00 H new ATOM 0 HB2 GLU A 146 8.911 1.442 -12.237 1.00 0.00 H new ATOM 0 HB3 GLU A 146 9.044 -0.142 -11.500 1.00 0.00 H new ATOM 0 HG2 GLU A 146 7.534 -1.095 -13.175 1.00 0.00 H new ATOM 0 HG3 GLU A 146 7.257 0.489 -13.872 1.00 0.00 H new ATOM 2309 N VAL A 147 6.178 3.028 -10.881 1.00 0.00 N ATOM 2310 CA VAL A 147 5.335 4.154 -11.247 1.00 0.00 C ATOM 2311 C VAL A 147 6.178 5.348 -11.680 1.00 0.00 C ATOM 2312 O VAL A 147 6.724 6.060 -10.839 1.00 0.00 O ATOM 2313 CB VAL A 147 4.413 4.575 -10.082 1.00 0.00 C ATOM 2314 CG1 VAL A 147 3.433 5.647 -10.528 1.00 0.00 C ATOM 2315 CG2 VAL A 147 3.673 3.370 -9.522 1.00 0.00 C ATOM 0 H VAL A 147 6.607 3.102 -9.958 1.00 0.00 H new ATOM 0 HA VAL A 147 4.715 3.829 -12.082 1.00 0.00 H new ATOM 0 HB VAL A 147 5.035 4.993 -9.291 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.794 5.927 -9.690 1.00 0.00 H new ATOM 0 HG12 VAL A 147 3.983 6.522 -10.873 1.00 0.00 H new ATOM 0 HG13 VAL A 147 2.817 5.262 -11.341 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.029 3.687 -8.702 1.00 0.00 H new ATOM 0 HG22 VAL A 147 3.066 2.919 -10.307 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.393 2.639 -9.155 1.00 0.00 H new ATOM 2325 N LYS A 148 6.289 5.534 -12.994 1.00 0.00 N ATOM 2326 CA LYS A 148 7.039 6.642 -13.584 1.00 0.00 C ATOM 2327 C LYS A 148 8.519 6.614 -13.180 1.00 0.00 C ATOM 2328 O LYS A 148 8.919 7.205 -12.172 1.00 0.00 O ATOM 2329 CB LYS A 148 6.406 7.991 -13.218 1.00 0.00 C ATOM 2330 CG LYS A 148 7.134 9.191 -13.808 1.00 0.00 C ATOM 2331 CD LYS A 148 7.150 9.155 -15.327 1.00 0.00 C ATOM 2332 CE LYS A 148 7.951 10.316 -15.897 1.00 0.00 C ATOM 2333 NZ LYS A 148 9.406 10.191 -15.605 1.00 0.00 N ATOM 0 H LYS A 148 5.859 4.917 -13.683 1.00 0.00 H new ATOM 0 HA LYS A 148 6.992 6.519 -14.666 1.00 0.00 H new ATOM 0 HB2 LYS A 148 5.371 8.001 -13.560 1.00 0.00 H new ATOM 0 HB3 LYS A 148 6.384 8.089 -12.133 1.00 0.00 H new ATOM 0 HG2 LYS A 148 6.652 10.109 -13.472 1.00 0.00 H new ATOM 0 HG3 LYS A 148 8.158 9.214 -13.435 1.00 0.00 H new ATOM 0 HD2 LYS A 148 7.579 8.212 -15.666 1.00 0.00 H new ATOM 0 HD3 LYS A 148 6.128 9.194 -15.705 1.00 0.00 H new ATOM 0 HE2 LYS A 148 7.801 10.364 -16.976 1.00 0.00 H new ATOM 0 HE3 LYS A 148 7.578 11.252 -15.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 9.952 10.671 -16.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 9.614 10.629 -14.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 9.669 9.185 -15.577 1.00 0.00 H new ATOM 2347 N PRO A 149 9.346 5.913 -13.971 1.00 0.00 N ATOM 2348 CA PRO A 149 10.794 5.864 -13.768 1.00 0.00 C ATOM 2349 C PRO A 149 11.454 7.202 -14.094 1.00 0.00 C ATOM 2350 O PRO A 149 11.399 7.621 -15.269 1.00 0.00 O ATOM 2351 CB PRO A 149 11.272 4.774 -14.737 1.00 0.00 C ATOM 2352 CG PRO A 149 10.033 4.081 -15.201 1.00 0.00 C ATOM 2353 CD PRO A 149 8.938 5.101 -15.123 1.00 0.00 C ATOM 2354 OXT PRO A 149 12.022 7.830 -13.178 1.00 0.00 O ATOM 0 HA PRO A 149 11.054 5.654 -12.730 1.00 0.00 H new ATOM 0 HB2 PRO A 149 11.817 5.206 -15.576 1.00 0.00 H new ATOM 0 HB3 PRO A 149 11.949 4.078 -14.242 1.00 0.00 H new ATOM 0 HG2 PRO A 149 10.150 3.711 -16.220 1.00 0.00 H new ATOM 0 HG3 PRO A 149 9.809 3.219 -14.573 1.00 0.00 H new ATOM 0 HD2 PRO A 149 8.870 5.694 -16.035 1.00 0.00 H new ATOM 0 HD3 PRO A 149 7.963 4.639 -14.970 1.00 0.00 H new TER 2362 PRO A 149