USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1128 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 117 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 139 ASN : amide:sc= -0.318 K(o=-0.32,f=-1.4) USER MOD Set 2.1: A 71 ASN : amide:sc= 0.277 K(o=3.1,f=2.6) USER MOD Set 2.2: A 73 SER OG : rot 145:sc= 1.03 USER MOD Set 2.3: A 79 SER OG : rot -47:sc= 1.79 USER MOD Set 3.1: A 47 LYS NZ :NH3+ -168:sc= 1.23 (180deg=0) USER MOD Set 3.2: A 114 SER OG : rot 160:sc= 1.04 USER MOD Set 4.1: A 42 SER OG : rot -7:sc= 0.829 USER MOD Set 4.2: A 77 LYS NZ :NH3+ -165:sc= 2.15 (180deg=-0.265) USER MOD Set 5.1: A 38 CYS SG : rot 180:sc= -0.154 USER MOD Set 5.2: A 81 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 16 ASN : amide:sc= 0.127 K(o=0.3,f=-1.2) USER MOD Set 6.2: A 145 THR OG1 : rot 78:sc= 0.169 USER MOD Set 7.1: A 2 LYS NZ :NH3+ -116:sc= -0.185 (180deg=-1.53) USER MOD Set 7.2: A 3 ASN : amide:sc= 0.622 K(o=0.46,f=-0.76) USER MOD Set 7.3: A -2 SER OG : rot 169:sc= 0.0203 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0107 USER MOD Single : A 7 LYS NZ :NH3+ -178:sc= 1.13 (180deg=1.07) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.281 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0.0208 X(o=0.021,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -80:sc= 0.819 USER MOD Single : A 39 MET CE :methyl 172:sc= -0.639 (180deg=-0.653) USER MOD Single : A 43 TYR OH : rot 180:sc= 0.11 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 152:sc= 0.422 (180deg=-2.2!) USER MOD Single : A 56 ASN : amide:sc= -0.753 K(o=-0.75,f=-1.4) USER MOD Single : A 57 THR OG1 : rot -23:sc= 0.275 USER MOD Single : A 61 LYS NZ :NH3+ 168:sc= 1.51 (180deg=1.25) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0413 USER MOD Single : A 65 ASN : amide:sc= 1.11 K(o=1.1,f=-0.033) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 116:sc= 0.878 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0294 USER MOD Single : A 83 THR OG1 : rot 45:sc= 1.05 USER MOD Single : A 86 THR OG1 : rot 78:sc= 0.902 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 1.19 K(o=1.2,f=-8.1!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -0.0217 X(o=-0.022,f=-0.074) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.00132 USER MOD Single : A 122 THR OG1 : rot -66:sc= 0.977 USER MOD Single : A 129 ASN :FLIP amide:sc= -0.0821 F(o=-0.63,f=-0.082) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ -172:sc= 1.76 (180deg=1.62) USER MOD Single : A 138 SER OG : rot -150:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -169:sc= 1.21 (180deg=1.09) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 180:sc= -1.87 USER MOD Single : A 150 THR OG1 : rot 180:sc= -0.01 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -1.232 31.496 3.744 1.00 0.00 N ATOM 2 CA GLY A -3 -0.533 30.409 3.065 1.00 0.00 C ATOM 3 C GLY A -3 -0.686 29.133 3.831 1.00 0.00 C ATOM 4 O GLY A -3 -1.798 28.596 3.932 1.00 0.00 O ATOM 0 H1 GLY A -3 -1.117 32.375 3.201 1.00 0.00 H new ATOM 0 H2 GLY A -3 -2.243 31.265 3.819 1.00 0.00 H new ATOM 0 H3 GLY A -3 -0.834 31.623 4.697 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -0.930 30.286 2.057 1.00 0.00 H new ATOM 0 HA3 GLY A -3 0.524 30.655 2.963 1.00 0.00 H new ATOM 10 N SER A -2 0.398 28.647 4.381 1.00 0.00 N ATOM 11 CA SER A -2 0.374 27.471 5.196 1.00 0.00 C ATOM 12 C SER A -2 1.604 27.476 6.066 1.00 0.00 C ATOM 13 O SER A -2 2.724 27.298 5.574 1.00 0.00 O ATOM 14 CB SER A -2 0.343 26.197 4.333 1.00 0.00 C ATOM 15 OG SER A -2 0.093 25.031 5.117 1.00 0.00 O ATOM 0 H SER A -2 1.323 29.062 4.272 1.00 0.00 H new ATOM 0 HA SER A -2 -0.527 27.474 5.809 1.00 0.00 H new ATOM 0 HB2 SER A -2 -0.429 26.294 3.570 1.00 0.00 H new ATOM 0 HB3 SER A -2 1.294 26.088 3.812 1.00 0.00 H new ATOM 0 HG SER A -2 -0.089 24.272 4.525 1.00 0.00 H new ATOM 21 N ALA A -1 1.419 27.765 7.327 1.00 0.00 N ATOM 22 CA ALA A -1 2.504 27.697 8.277 1.00 0.00 C ATOM 23 C ALA A -1 2.733 26.234 8.596 1.00 0.00 C ATOM 24 O ALA A -1 1.760 25.455 8.631 1.00 0.00 O ATOM 25 CB ALA A -1 2.170 28.485 9.536 1.00 0.00 C ATOM 0 H ALA A -1 0.524 28.051 7.724 1.00 0.00 H new ATOM 0 HA ALA A -1 3.408 28.139 7.858 1.00 0.00 H new ATOM 0 HB1 ALA A -1 3.002 28.420 10.238 1.00 0.00 H new ATOM 0 HB2 ALA A -1 1.996 29.529 9.276 1.00 0.00 H new ATOM 0 HB3 ALA A -1 1.273 28.071 9.997 1.00 0.00 H new ATOM 31 N SER A 0 3.974 25.848 8.841 1.00 0.00 N ATOM 32 CA SER A 0 4.337 24.453 9.055 1.00 0.00 C ATOM 33 C SER A 0 3.938 23.922 10.460 1.00 0.00 C ATOM 34 O SER A 0 4.766 23.452 11.245 1.00 0.00 O ATOM 35 CB SER A 0 5.824 24.249 8.752 1.00 0.00 C ATOM 36 OG SER A 0 6.125 24.721 7.438 1.00 0.00 O ATOM 0 H SER A 0 4.762 26.493 8.898 1.00 0.00 H new ATOM 0 HA SER A 0 3.756 23.851 8.357 1.00 0.00 H new ATOM 0 HB2 SER A 0 6.429 24.781 9.486 1.00 0.00 H new ATOM 0 HB3 SER A 0 6.079 23.192 8.835 1.00 0.00 H new ATOM 0 HG SER A 0 7.078 24.588 7.253 1.00 0.00 H new ATOM 42 N VAL A 1 2.678 24.080 10.757 1.00 0.00 N ATOM 43 CA VAL A 1 2.030 23.499 11.901 1.00 0.00 C ATOM 44 C VAL A 1 1.210 22.365 11.319 1.00 0.00 C ATOM 45 O VAL A 1 1.191 21.245 11.823 1.00 0.00 O ATOM 46 CB VAL A 1 1.091 24.519 12.617 1.00 0.00 C ATOM 47 CG1 VAL A 1 0.452 23.900 13.856 1.00 0.00 C ATOM 48 CG2 VAL A 1 1.851 25.791 12.988 1.00 0.00 C ATOM 0 H VAL A 1 2.047 24.641 10.184 1.00 0.00 H new ATOM 0 HA VAL A 1 2.751 23.176 12.652 1.00 0.00 H new ATOM 0 HB VAL A 1 0.296 24.784 11.920 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -0.197 24.633 14.335 1.00 0.00 H new ATOM 0 HG12 VAL A 1 -0.136 23.029 13.566 1.00 0.00 H new ATOM 0 HG13 VAL A 1 1.232 23.595 14.554 1.00 0.00 H new ATOM 0 HG21 VAL A 1 1.175 26.486 13.486 1.00 0.00 H new ATOM 0 HG22 VAL A 1 2.673 25.541 13.659 1.00 0.00 H new ATOM 0 HG23 VAL A 1 2.248 26.254 12.085 1.00 0.00 H new ATOM 58 N LYS A 2 0.574 22.681 10.194 1.00 0.00 N ATOM 59 CA LYS A 2 -0.119 21.713 9.390 1.00 0.00 C ATOM 60 C LYS A 2 0.867 21.260 8.340 1.00 0.00 C ATOM 61 O LYS A 2 1.974 21.833 8.247 1.00 0.00 O ATOM 62 CB LYS A 2 -1.315 22.331 8.654 1.00 0.00 C ATOM 63 CG LYS A 2 -2.289 23.103 9.513 1.00 0.00 C ATOM 64 CD LYS A 2 -3.572 23.521 8.754 1.00 0.00 C ATOM 65 CE LYS A 2 -3.347 24.435 7.517 1.00 0.00 C ATOM 66 NZ LYS A 2 -2.878 23.716 6.289 1.00 0.00 N ATOM 0 H LYS A 2 0.533 23.630 9.822 1.00 0.00 H new ATOM 0 HA LYS A 2 -0.487 20.909 10.027 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -0.936 22.997 7.879 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -1.859 21.533 8.149 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -2.566 22.495 10.374 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -1.796 23.995 9.899 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -4.091 22.620 8.429 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -4.234 24.037 9.450 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -4.280 24.950 7.287 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -2.616 25.201 7.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.926 24.048 6.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.850 22.693 6.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -3.532 23.907 5.504 1.00 0.00 H new ATOM 80 N ASN A 3 0.471 20.277 7.554 1.00 0.00 N ATOM 81 CA ASN A 3 1.251 19.756 6.446 1.00 0.00 C ATOM 82 C ASN A 3 2.573 19.241 6.935 1.00 0.00 C ATOM 83 O ASN A 3 3.628 19.873 6.769 1.00 0.00 O ATOM 84 CB ASN A 3 1.416 20.789 5.325 1.00 0.00 C ATOM 85 CG ASN A 3 0.101 21.170 4.678 1.00 0.00 C ATOM 86 OD1 ASN A 3 -0.598 22.091 5.134 1.00 0.00 O ATOM 87 ND2 ASN A 3 -0.238 20.497 3.614 1.00 0.00 N ATOM 0 H ASN A 3 -0.426 19.806 7.671 1.00 0.00 H new ATOM 0 HA ASN A 3 0.703 18.920 6.012 1.00 0.00 H new ATOM 0 HB2 ASN A 3 1.889 21.684 5.729 1.00 0.00 H new ATOM 0 HB3 ASN A 3 2.087 20.389 4.565 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -1.105 20.720 3.124 1.00 0.00 H new ATOM 0 HD22 ASN A 3 0.363 19.748 3.271 1.00 0.00 H new ATOM 94 N GLU A 4 2.505 18.127 7.569 1.00 0.00 N ATOM 95 CA GLU A 4 3.646 17.557 8.209 1.00 0.00 C ATOM 96 C GLU A 4 4.120 16.381 7.436 1.00 0.00 C ATOM 97 O GLU A 4 3.420 15.906 6.547 1.00 0.00 O ATOM 98 CB GLU A 4 3.399 17.190 9.691 1.00 0.00 C ATOM 99 CG GLU A 4 2.302 16.157 9.969 1.00 0.00 C ATOM 100 CD GLU A 4 0.899 16.683 9.825 1.00 0.00 C ATOM 101 OE1 GLU A 4 0.512 17.566 10.599 1.00 0.00 O ATOM 102 OE2 GLU A 4 0.139 16.194 8.972 1.00 0.00 O ATOM 0 H GLU A 4 1.651 17.577 7.662 1.00 0.00 H new ATOM 0 HA GLU A 4 4.423 18.321 8.222 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.333 16.816 10.109 1.00 0.00 H new ATOM 0 HB3 GLU A 4 3.151 18.104 10.231 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.433 15.315 9.289 1.00 0.00 H new ATOM 0 HG3 GLU A 4 2.430 15.773 10.981 1.00 0.00 H new ATOM 109 N THR A 5 5.284 15.908 7.763 1.00 0.00 N ATOM 110 CA THR A 5 5.860 14.842 7.046 1.00 0.00 C ATOM 111 C THR A 5 5.245 13.502 7.503 1.00 0.00 C ATOM 112 O THR A 5 5.519 12.996 8.601 1.00 0.00 O ATOM 113 CB THR A 5 7.367 14.860 7.241 1.00 0.00 C ATOM 114 OG1 THR A 5 7.764 16.228 7.504 1.00 0.00 O ATOM 115 CG2 THR A 5 8.042 14.421 5.963 1.00 0.00 C ATOM 0 H THR A 5 5.851 16.258 8.535 1.00 0.00 H new ATOM 0 HA THR A 5 5.650 14.955 5.982 1.00 0.00 H new ATOM 0 HB THR A 5 7.647 14.197 8.060 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.734 16.267 7.636 1.00 0.00 H new ATOM 0 HG21 THR A 5 9.123 14.433 6.100 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.719 13.411 5.710 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.771 15.102 5.156 1.00 0.00 H new ATOM 123 N VAL A 6 4.401 12.980 6.662 1.00 0.00 N ATOM 124 CA VAL A 6 3.671 11.758 6.896 1.00 0.00 C ATOM 125 C VAL A 6 4.536 10.572 6.533 1.00 0.00 C ATOM 126 O VAL A 6 4.923 10.423 5.397 1.00 0.00 O ATOM 127 CB VAL A 6 2.375 11.737 6.032 1.00 0.00 C ATOM 128 CG1 VAL A 6 1.591 10.450 6.225 1.00 0.00 C ATOM 129 CG2 VAL A 6 1.504 12.948 6.337 1.00 0.00 C ATOM 0 H VAL A 6 4.191 13.406 5.759 1.00 0.00 H new ATOM 0 HA VAL A 6 3.400 11.704 7.950 1.00 0.00 H new ATOM 0 HB VAL A 6 2.679 11.782 4.986 1.00 0.00 H new ATOM 0 HG11 VAL A 6 0.694 10.474 5.606 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.209 9.600 5.936 1.00 0.00 H new ATOM 0 HG13 VAL A 6 1.306 10.351 7.272 1.00 0.00 H new ATOM 0 HG21 VAL A 6 0.604 12.913 5.723 1.00 0.00 H new ATOM 0 HG22 VAL A 6 1.224 12.939 7.391 1.00 0.00 H new ATOM 0 HG23 VAL A 6 2.059 13.860 6.117 1.00 0.00 H new ATOM 139 N LYS A 7 4.835 9.744 7.481 1.00 0.00 N ATOM 140 CA LYS A 7 5.655 8.592 7.222 1.00 0.00 C ATOM 141 C LYS A 7 4.850 7.466 6.632 1.00 0.00 C ATOM 142 O LYS A 7 3.909 6.961 7.258 1.00 0.00 O ATOM 143 CB LYS A 7 6.402 8.104 8.465 1.00 0.00 C ATOM 144 CG LYS A 7 7.573 8.948 8.870 1.00 0.00 C ATOM 145 CD LYS A 7 8.250 8.348 10.082 1.00 0.00 C ATOM 146 CE LYS A 7 9.442 9.165 10.514 1.00 0.00 C ATOM 147 NZ LYS A 7 10.569 9.097 9.552 1.00 0.00 N ATOM 0 H LYS A 7 4.525 9.840 8.448 1.00 0.00 H new ATOM 0 HA LYS A 7 6.402 8.914 6.496 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.700 8.058 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.751 7.087 8.286 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.282 9.020 8.045 1.00 0.00 H new ATOM 0 HG3 LYS A 7 7.241 9.962 9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 7 7.536 8.283 10.903 1.00 0.00 H new ATOM 0 HD3 LYS A 7 8.569 7.331 9.855 1.00 0.00 H new ATOM 0 HE2 LYS A 7 9.138 10.205 10.637 1.00 0.00 H new ATOM 0 HE3 LYS A 7 9.782 8.815 11.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 11.371 9.649 9.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 10.859 8.106 9.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 10.268 9.488 8.636 1.00 0.00 H new ATOM 161 N LEU A 8 5.180 7.114 5.425 1.00 0.00 N ATOM 162 CA LEU A 8 4.606 5.964 4.804 1.00 0.00 C ATOM 163 C LEU A 8 5.554 4.816 5.084 1.00 0.00 C ATOM 164 O LEU A 8 6.722 4.843 4.658 1.00 0.00 O ATOM 165 CB LEU A 8 4.448 6.181 3.301 1.00 0.00 C ATOM 166 CG LEU A 8 3.750 5.056 2.533 1.00 0.00 C ATOM 167 CD1 LEU A 8 2.293 4.925 2.961 1.00 0.00 C ATOM 168 CD2 LEU A 8 3.850 5.295 1.047 1.00 0.00 C ATOM 0 H LEU A 8 5.853 7.616 4.847 1.00 0.00 H new ATOM 0 HA LEU A 8 3.610 5.759 5.197 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.889 7.103 3.143 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.438 6.330 2.869 1.00 0.00 H new ATOM 0 HG LEU A 8 4.253 4.118 2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.820 4.119 2.400 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.246 4.702 4.027 1.00 0.00 H new ATOM 0 HD13 LEU A 8 1.770 5.860 2.762 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.349 4.487 0.514 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.374 6.243 0.798 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.899 5.328 0.754 1.00 0.00 H new ATOM 180 N SER A 9 5.085 3.850 5.818 1.00 0.00 N ATOM 181 CA SER A 9 5.918 2.794 6.291 1.00 0.00 C ATOM 182 C SER A 9 5.442 1.430 5.765 1.00 0.00 C ATOM 183 O SER A 9 4.305 1.275 5.292 1.00 0.00 O ATOM 184 CB SER A 9 5.963 2.837 7.838 1.00 0.00 C ATOM 185 OG SER A 9 6.926 1.936 8.366 1.00 0.00 O ATOM 0 H SER A 9 4.109 3.776 6.104 1.00 0.00 H new ATOM 0 HA SER A 9 6.930 2.933 5.910 1.00 0.00 H new ATOM 0 HB2 SER A 9 6.196 3.850 8.166 1.00 0.00 H new ATOM 0 HB3 SER A 9 4.979 2.591 8.237 1.00 0.00 H new ATOM 0 HG SER A 9 6.926 1.993 9.344 1.00 0.00 H new ATOM 191 N VAL A 10 6.316 0.463 5.872 1.00 0.00 N ATOM 192 CA VAL A 10 6.140 -0.892 5.383 1.00 0.00 C ATOM 193 C VAL A 10 6.616 -1.858 6.457 1.00 0.00 C ATOM 194 O VAL A 10 7.314 -1.442 7.387 1.00 0.00 O ATOM 195 CB VAL A 10 6.941 -1.159 4.072 1.00 0.00 C ATOM 196 CG1 VAL A 10 6.377 -0.358 2.902 1.00 0.00 C ATOM 197 CG2 VAL A 10 8.417 -0.830 4.274 1.00 0.00 C ATOM 0 H VAL A 10 7.219 0.600 6.325 1.00 0.00 H new ATOM 0 HA VAL A 10 5.083 -1.034 5.157 1.00 0.00 H new ATOM 0 HB VAL A 10 6.843 -2.218 3.832 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.958 -0.567 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 10 5.337 -0.640 2.735 1.00 0.00 H new ATOM 0 HG13 VAL A 10 6.432 0.707 3.130 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.962 -1.022 3.350 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.522 0.220 4.546 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.823 -1.453 5.071 1.00 0.00 H new ATOM 207 N GLY A 11 6.230 -3.107 6.364 1.00 0.00 N ATOM 208 CA GLY A 11 6.658 -4.067 7.350 1.00 0.00 C ATOM 209 C GLY A 11 7.106 -5.360 6.713 1.00 0.00 C ATOM 210 O GLY A 11 6.975 -5.541 5.492 1.00 0.00 O ATOM 0 H GLY A 11 5.630 -3.478 5.628 1.00 0.00 H new ATOM 0 HA2 GLY A 11 7.476 -3.647 7.935 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.840 -4.267 8.042 1.00 0.00 H new ATOM 214 N THR A 12 7.628 -6.248 7.515 1.00 0.00 N ATOM 215 CA THR A 12 8.125 -7.508 7.040 1.00 0.00 C ATOM 216 C THR A 12 7.204 -8.619 7.532 1.00 0.00 C ATOM 217 O THR A 12 6.862 -8.686 8.724 1.00 0.00 O ATOM 218 CB THR A 12 9.562 -7.754 7.571 1.00 0.00 C ATOM 219 OG1 THR A 12 10.374 -6.596 7.313 1.00 0.00 O ATOM 220 CG2 THR A 12 10.203 -8.972 6.909 1.00 0.00 C ATOM 0 H THR A 12 7.720 -6.116 8.522 1.00 0.00 H new ATOM 0 HA THR A 12 8.151 -7.498 5.950 1.00 0.00 H new ATOM 0 HB THR A 12 9.497 -7.941 8.643 1.00 0.00 H new ATOM 0 HG1 THR A 12 11.281 -6.751 7.650 1.00 0.00 H new ATOM 0 HG21 THR A 12 11.209 -9.114 7.305 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.602 -9.857 7.117 1.00 0.00 H new ATOM 0 HG23 THR A 12 10.256 -8.815 5.832 1.00 0.00 H new ATOM 228 N VAL A 13 6.777 -9.441 6.621 1.00 0.00 N ATOM 229 CA VAL A 13 5.895 -10.547 6.906 1.00 0.00 C ATOM 230 C VAL A 13 6.530 -11.827 6.399 1.00 0.00 C ATOM 231 O VAL A 13 7.499 -11.777 5.633 1.00 0.00 O ATOM 232 CB VAL A 13 4.485 -10.354 6.271 1.00 0.00 C ATOM 233 CG1 VAL A 13 3.739 -9.209 6.949 1.00 0.00 C ATOM 234 CG2 VAL A 13 4.594 -10.086 4.773 1.00 0.00 C ATOM 0 H VAL A 13 7.034 -9.365 5.637 1.00 0.00 H new ATOM 0 HA VAL A 13 5.751 -10.600 7.985 1.00 0.00 H new ATOM 0 HB VAL A 13 3.925 -11.277 6.420 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.757 -9.092 6.490 1.00 0.00 H new ATOM 0 HG12 VAL A 13 3.620 -9.430 8.010 1.00 0.00 H new ATOM 0 HG13 VAL A 13 4.306 -8.286 6.832 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.597 -9.955 4.353 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.179 -9.182 4.607 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.084 -10.930 4.287 1.00 0.00 H new ATOM 244 N SER A 14 6.037 -12.948 6.834 1.00 0.00 N ATOM 245 CA SER A 14 6.560 -14.217 6.410 1.00 0.00 C ATOM 246 C SER A 14 5.423 -15.101 5.917 1.00 0.00 C ATOM 247 O SER A 14 4.284 -14.979 6.393 1.00 0.00 O ATOM 248 CB SER A 14 7.323 -14.882 7.556 1.00 0.00 C ATOM 249 OG SER A 14 8.355 -14.018 8.034 1.00 0.00 O ATOM 0 H SER A 14 5.261 -13.011 7.493 1.00 0.00 H new ATOM 0 HA SER A 14 7.259 -14.066 5.587 1.00 0.00 H new ATOM 0 HB2 SER A 14 6.636 -15.122 8.368 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.756 -15.823 7.216 1.00 0.00 H new ATOM 0 HG SER A 14 8.834 -14.456 8.768 1.00 0.00 H new ATOM 255 N GLY A 15 5.721 -15.954 4.971 1.00 0.00 N ATOM 256 CA GLY A 15 4.729 -16.817 4.403 1.00 0.00 C ATOM 257 C GLY A 15 5.359 -18.057 3.838 1.00 0.00 C ATOM 258 O GLY A 15 6.587 -18.212 3.884 1.00 0.00 O ATOM 0 H GLY A 15 6.655 -16.067 4.577 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.999 -17.090 5.165 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.188 -16.289 3.618 1.00 0.00 H new ATOM 262 N ASN A 16 4.549 -18.912 3.275 1.00 0.00 N ATOM 263 CA ASN A 16 5.009 -20.183 2.742 1.00 0.00 C ATOM 264 C ASN A 16 4.556 -20.337 1.290 1.00 0.00 C ATOM 265 O ASN A 16 3.611 -19.676 0.882 1.00 0.00 O ATOM 266 CB ASN A 16 4.459 -21.353 3.593 1.00 0.00 C ATOM 267 CG ASN A 16 5.023 -21.397 5.003 1.00 0.00 C ATOM 268 OD1 ASN A 16 6.059 -22.000 5.245 1.00 0.00 O ATOM 269 ND2 ASN A 16 4.343 -20.793 5.943 1.00 0.00 N ATOM 0 H ASN A 16 3.547 -18.754 3.169 1.00 0.00 H new ATOM 0 HA ASN A 16 6.098 -20.203 2.779 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.373 -21.273 3.647 1.00 0.00 H new ATOM 0 HB3 ASN A 16 4.684 -22.294 3.091 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.674 -20.817 6.908 1.00 0.00 H new ATOM 0 HD22 ASN A 16 3.482 -20.298 5.711 1.00 0.00 H new ATOM 276 N PRO A 17 5.239 -21.173 0.465 1.00 0.00 N ATOM 277 CA PRO A 17 4.818 -21.428 -0.925 1.00 0.00 C ATOM 278 C PRO A 17 3.437 -22.117 -0.969 1.00 0.00 C ATOM 279 O PRO A 17 3.235 -23.179 -0.362 1.00 0.00 O ATOM 280 CB PRO A 17 5.914 -22.366 -1.473 1.00 0.00 C ATOM 281 CG PRO A 17 7.066 -22.194 -0.546 1.00 0.00 C ATOM 282 CD PRO A 17 6.472 -21.909 0.796 1.00 0.00 C ATOM 0 HA PRO A 17 4.713 -20.512 -1.506 1.00 0.00 H new ATOM 0 HB2 PRO A 17 5.574 -23.401 -1.492 1.00 0.00 H new ATOM 0 HB3 PRO A 17 6.186 -22.101 -2.495 1.00 0.00 H new ATOM 0 HG2 PRO A 17 7.682 -23.093 -0.518 1.00 0.00 H new ATOM 0 HG3 PRO A 17 7.710 -21.376 -0.870 1.00 0.00 H new ATOM 0 HD2 PRO A 17 6.259 -22.826 1.346 1.00 0.00 H new ATOM 0 HD3 PRO A 17 7.143 -21.314 1.416 1.00 0.00 H new ATOM 290 N GLY A 18 2.489 -21.479 -1.636 1.00 0.00 N ATOM 291 CA GLY A 18 1.122 -21.977 -1.719 1.00 0.00 C ATOM 292 C GLY A 18 0.219 -21.225 -0.763 1.00 0.00 C ATOM 293 O GLY A 18 -1.018 -21.234 -0.887 1.00 0.00 O ATOM 0 H GLY A 18 2.643 -20.603 -2.135 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.751 -21.869 -2.738 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.103 -23.041 -1.484 1.00 0.00 H new ATOM 297 N ASP A 19 0.845 -20.586 0.186 1.00 0.00 N ATOM 298 CA ASP A 19 0.184 -19.820 1.205 1.00 0.00 C ATOM 299 C ASP A 19 0.022 -18.372 0.751 1.00 0.00 C ATOM 300 O ASP A 19 0.861 -17.833 0.003 1.00 0.00 O ATOM 301 CB ASP A 19 0.974 -19.940 2.519 1.00 0.00 C ATOM 302 CG ASP A 19 0.457 -19.106 3.659 1.00 0.00 C ATOM 303 OD1 ASP A 19 1.261 -18.394 4.276 1.00 0.00 O ATOM 304 OD2 ASP A 19 -0.756 -19.161 3.977 1.00 0.00 O ATOM 0 H ASP A 19 1.861 -20.584 0.274 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.819 -20.210 1.381 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.977 -20.985 2.828 1.00 0.00 H new ATOM 0 HB3 ASP A 19 2.010 -19.661 2.327 1.00 0.00 H new ATOM 309 N THR A 20 -1.053 -17.775 1.160 1.00 0.00 N ATOM 310 CA THR A 20 -1.376 -16.433 0.801 1.00 0.00 C ATOM 311 C THR A 20 -0.791 -15.492 1.863 1.00 0.00 C ATOM 312 O THR A 20 -1.008 -15.680 3.066 1.00 0.00 O ATOM 313 CB THR A 20 -2.904 -16.273 0.746 1.00 0.00 C ATOM 314 OG1 THR A 20 -3.488 -17.504 0.239 1.00 0.00 O ATOM 315 CG2 THR A 20 -3.277 -15.138 -0.192 1.00 0.00 C ATOM 0 H THR A 20 -1.744 -18.218 1.766 1.00 0.00 H new ATOM 0 HA THR A 20 -0.960 -16.192 -0.177 1.00 0.00 H new ATOM 0 HB THR A 20 -3.277 -16.054 1.747 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.463 -17.412 0.202 1.00 0.00 H new ATOM 0 HG21 THR A 20 -4.362 -15.033 -0.223 1.00 0.00 H new ATOM 0 HG22 THR A 20 -2.833 -14.209 0.166 1.00 0.00 H new ATOM 0 HG23 THR A 20 -2.904 -15.356 -1.193 1.00 0.00 H new ATOM 323 N VAL A 21 -0.046 -14.525 1.436 1.00 0.00 N ATOM 324 CA VAL A 21 0.608 -13.622 2.333 1.00 0.00 C ATOM 325 C VAL A 21 -0.015 -12.224 2.207 1.00 0.00 C ATOM 326 O VAL A 21 -0.574 -11.869 1.150 1.00 0.00 O ATOM 327 CB VAL A 21 2.150 -13.616 2.078 1.00 0.00 C ATOM 328 CG1 VAL A 21 2.508 -13.049 0.718 1.00 0.00 C ATOM 329 CG2 VAL A 21 2.919 -12.922 3.190 1.00 0.00 C ATOM 0 H VAL A 21 0.129 -14.336 0.449 1.00 0.00 H new ATOM 0 HA VAL A 21 0.462 -13.956 3.360 1.00 0.00 H new ATOM 0 HB VAL A 21 2.459 -14.661 2.081 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.590 -13.067 0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 21 2.040 -13.650 -0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.151 -12.022 0.647 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.985 -12.945 2.964 1.00 0.00 H new ATOM 0 HG22 VAL A 21 2.588 -11.887 3.270 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.737 -13.436 4.134 1.00 0.00 H new ATOM 339 N LYS A 22 0.029 -11.471 3.280 1.00 0.00 N ATOM 340 CA LYS A 22 -0.544 -10.155 3.323 1.00 0.00 C ATOM 341 C LYS A 22 0.477 -9.152 3.836 1.00 0.00 C ATOM 342 O LYS A 22 1.072 -9.348 4.894 1.00 0.00 O ATOM 343 CB LYS A 22 -1.779 -10.183 4.214 1.00 0.00 C ATOM 344 CG LYS A 22 -2.473 -8.845 4.427 1.00 0.00 C ATOM 345 CD LYS A 22 -3.774 -9.023 5.196 1.00 0.00 C ATOM 346 CE LYS A 22 -3.570 -9.729 6.532 1.00 0.00 C ATOM 347 NZ LYS A 22 -4.842 -9.958 7.237 1.00 0.00 N ATOM 0 H LYS A 22 0.468 -11.761 4.154 1.00 0.00 H new ATOM 0 HA LYS A 22 -0.836 -9.846 2.319 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.498 -10.880 3.784 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.493 -10.581 5.187 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -1.813 -8.171 4.973 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -2.677 -8.379 3.463 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -4.226 -8.047 5.370 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.476 -9.596 4.589 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.072 -10.684 6.365 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.910 -9.131 7.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -4.657 -10.440 8.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -5.306 -9.046 7.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -5.463 -10.550 6.649 1.00 0.00 H new ATOM 361 N VAL A 23 0.682 -8.100 3.080 1.00 0.00 N ATOM 362 CA VAL A 23 1.624 -7.056 3.446 1.00 0.00 C ATOM 363 C VAL A 23 0.850 -5.774 3.779 1.00 0.00 C ATOM 364 O VAL A 23 0.073 -5.289 2.947 1.00 0.00 O ATOM 365 CB VAL A 23 2.633 -6.767 2.295 1.00 0.00 C ATOM 366 CG1 VAL A 23 3.691 -5.747 2.719 1.00 0.00 C ATOM 367 CG2 VAL A 23 3.292 -8.051 1.824 1.00 0.00 C ATOM 0 H VAL A 23 0.204 -7.939 2.194 1.00 0.00 H new ATOM 0 HA VAL A 23 2.190 -7.395 4.313 1.00 0.00 H new ATOM 0 HB VAL A 23 2.071 -6.339 1.465 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.378 -5.570 1.891 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.205 -4.811 2.994 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.246 -6.132 3.575 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.993 -7.827 1.020 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.828 -8.511 2.654 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.529 -8.739 1.459 1.00 0.00 H new ATOM 377 N PRO A 24 1.001 -5.236 4.995 1.00 0.00 N ATOM 378 CA PRO A 24 0.325 -4.023 5.391 1.00 0.00 C ATOM 379 C PRO A 24 1.111 -2.738 5.050 1.00 0.00 C ATOM 380 O PRO A 24 2.296 -2.583 5.404 1.00 0.00 O ATOM 381 CB PRO A 24 0.181 -4.180 6.907 1.00 0.00 C ATOM 382 CG PRO A 24 1.302 -5.085 7.335 1.00 0.00 C ATOM 383 CD PRO A 24 1.823 -5.785 6.097 1.00 0.00 C ATOM 0 HA PRO A 24 -0.620 -3.905 4.861 1.00 0.00 H new ATOM 0 HB2 PRO A 24 0.246 -3.214 7.408 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -0.787 -4.609 7.165 1.00 0.00 H new ATOM 0 HG2 PRO A 24 2.096 -4.511 7.813 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.949 -5.812 8.066 1.00 0.00 H new ATOM 0 HD2 PRO A 24 2.883 -5.583 5.942 1.00 0.00 H new ATOM 0 HD3 PRO A 24 1.713 -6.867 6.175 1.00 0.00 H new ATOM 391 N VAL A 25 0.455 -1.836 4.360 1.00 0.00 N ATOM 392 CA VAL A 25 1.018 -0.539 4.051 1.00 0.00 C ATOM 393 C VAL A 25 0.612 0.384 5.187 1.00 0.00 C ATOM 394 O VAL A 25 -0.570 0.614 5.397 1.00 0.00 O ATOM 395 CB VAL A 25 0.468 0.015 2.701 1.00 0.00 C ATOM 396 CG1 VAL A 25 1.104 1.355 2.353 1.00 0.00 C ATOM 397 CG2 VAL A 25 0.688 -0.985 1.570 1.00 0.00 C ATOM 0 H VAL A 25 -0.487 -1.979 3.995 1.00 0.00 H new ATOM 0 HA VAL A 25 2.101 -0.611 3.948 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.604 0.169 2.823 1.00 0.00 H new ATOM 0 HG11 VAL A 25 0.700 1.715 1.407 1.00 0.00 H new ATOM 0 HG12 VAL A 25 0.884 2.077 3.139 1.00 0.00 H new ATOM 0 HG13 VAL A 25 2.183 1.233 2.264 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.296 -0.574 0.640 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.755 -1.180 1.459 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.171 -1.916 1.802 1.00 0.00 H new ATOM 407 N THR A 26 1.563 0.879 5.916 1.00 0.00 N ATOM 408 CA THR A 26 1.282 1.628 7.116 1.00 0.00 C ATOM 409 C THR A 26 1.445 3.135 6.868 1.00 0.00 C ATOM 410 O THR A 26 2.349 3.557 6.156 1.00 0.00 O ATOM 411 CB THR A 26 2.242 1.152 8.225 1.00 0.00 C ATOM 412 OG1 THR A 26 2.237 -0.291 8.230 1.00 0.00 O ATOM 413 CG2 THR A 26 1.802 1.653 9.600 1.00 0.00 C ATOM 0 H THR A 26 2.556 0.780 5.703 1.00 0.00 H new ATOM 0 HA THR A 26 0.250 1.457 7.423 1.00 0.00 H new ATOM 0 HB THR A 26 3.238 1.548 8.024 1.00 0.00 H new ATOM 0 HG1 THR A 26 2.843 -0.618 8.927 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.501 1.299 10.357 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.786 2.743 9.602 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.804 1.275 9.823 1.00 0.00 H new ATOM 421 N ILE A 27 0.559 3.920 7.421 1.00 0.00 N ATOM 422 CA ILE A 27 0.623 5.357 7.307 1.00 0.00 C ATOM 423 C ILE A 27 0.663 5.944 8.720 1.00 0.00 C ATOM 424 O ILE A 27 -0.124 5.553 9.580 1.00 0.00 O ATOM 425 CB ILE A 27 -0.578 5.929 6.458 1.00 0.00 C ATOM 426 CG1 ILE A 27 -0.522 7.466 6.370 1.00 0.00 C ATOM 427 CG2 ILE A 27 -1.936 5.448 6.989 1.00 0.00 C ATOM 428 CD1 ILE A 27 -1.605 8.088 5.498 1.00 0.00 C ATOM 0 H ILE A 27 -0.233 3.581 7.967 1.00 0.00 H new ATOM 0 HA ILE A 27 1.526 5.647 6.769 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.472 5.535 5.447 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.602 7.878 7.376 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.453 7.760 5.982 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.735 5.865 6.376 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.978 4.360 6.948 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.061 5.777 8.021 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.490 9.172 5.493 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.515 7.709 4.480 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.586 7.829 5.896 1.00 0.00 H new ATOM 440 N SER A 28 1.630 6.790 8.992 1.00 0.00 N ATOM 441 CA SER A 28 1.789 7.369 10.313 1.00 0.00 C ATOM 442 C SER A 28 2.237 8.840 10.242 1.00 0.00 C ATOM 443 O SER A 28 2.641 9.318 9.188 1.00 0.00 O ATOM 444 CB SER A 28 2.791 6.527 11.114 1.00 0.00 C ATOM 445 OG SER A 28 2.338 5.172 11.238 1.00 0.00 O ATOM 0 H SER A 28 2.326 7.097 8.312 1.00 0.00 H new ATOM 0 HA SER A 28 0.822 7.360 10.816 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.763 6.546 10.622 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.927 6.961 12.105 1.00 0.00 H new ATOM 0 HG SER A 28 2.993 4.654 11.751 1.00 0.00 H new ATOM 451 N GLN A 29 2.123 9.541 11.383 1.00 0.00 N ATOM 452 CA GLN A 29 2.497 10.972 11.577 1.00 0.00 C ATOM 453 C GLN A 29 1.582 11.922 10.813 1.00 0.00 C ATOM 454 O GLN A 29 1.872 13.103 10.694 1.00 0.00 O ATOM 455 CB GLN A 29 3.968 11.282 11.229 1.00 0.00 C ATOM 456 CG GLN A 29 4.992 10.424 11.948 1.00 0.00 C ATOM 457 CD GLN A 29 6.405 10.979 11.881 1.00 0.00 C ATOM 458 OE1 GLN A 29 7.212 10.735 12.777 1.00 0.00 O ATOM 459 NE2 GLN A 29 6.711 11.742 10.862 1.00 0.00 N ATOM 0 H GLN A 29 1.754 9.119 12.235 1.00 0.00 H new ATOM 0 HA GLN A 29 2.369 11.141 12.646 1.00 0.00 H new ATOM 0 HB2 GLN A 29 4.105 11.160 10.154 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.167 12.329 11.459 1.00 0.00 H new ATOM 0 HG2 GLN A 29 4.699 10.323 12.993 1.00 0.00 H new ATOM 0 HG3 GLN A 29 4.983 9.423 11.516 1.00 0.00 H new ATOM 0 HE21 GLN A 29 6.019 11.925 10.136 1.00 0.00 H new ATOM 0 HE22 GLN A 29 7.642 12.154 10.795 1.00 0.00 H new ATOM 468 N VAL A 30 0.465 11.426 10.373 1.00 0.00 N ATOM 469 CA VAL A 30 -0.470 12.208 9.608 1.00 0.00 C ATOM 470 C VAL A 30 -1.463 12.906 10.538 1.00 0.00 C ATOM 471 O VAL A 30 -2.084 12.271 11.387 1.00 0.00 O ATOM 472 CB VAL A 30 -1.194 11.327 8.525 1.00 0.00 C ATOM 473 CG1 VAL A 30 -1.892 10.117 9.127 1.00 0.00 C ATOM 474 CG2 VAL A 30 -2.162 12.143 7.681 1.00 0.00 C ATOM 0 H VAL A 30 0.171 10.462 10.533 1.00 0.00 H new ATOM 0 HA VAL A 30 0.079 12.980 9.070 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.408 10.954 7.869 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.375 9.544 8.335 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.159 9.489 9.634 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.643 10.449 9.844 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.640 11.495 6.946 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.923 12.584 8.325 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.618 12.935 7.167 1.00 0.00 H new ATOM 484 N SER A 31 -1.506 14.212 10.469 1.00 0.00 N ATOM 485 CA SER A 31 -2.452 14.982 11.206 1.00 0.00 C ATOM 486 C SER A 31 -3.252 15.890 10.265 1.00 0.00 C ATOM 487 O SER A 31 -4.385 16.277 10.555 1.00 0.00 O ATOM 488 CB SER A 31 -1.713 15.774 12.225 1.00 0.00 C ATOM 489 OG SER A 31 -0.954 14.908 13.063 1.00 0.00 O ATOM 0 H SER A 31 -0.875 14.768 9.892 1.00 0.00 H new ATOM 0 HA SER A 31 -3.167 14.328 11.705 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.052 16.488 11.733 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.415 16.352 12.827 1.00 0.00 H new ATOM 0 HG SER A 31 -0.470 15.439 13.729 1.00 0.00 H new ATOM 495 N THR A 32 -2.653 16.212 9.146 1.00 0.00 N ATOM 496 CA THR A 32 -3.268 17.001 8.122 1.00 0.00 C ATOM 497 C THR A 32 -3.880 16.020 7.088 1.00 0.00 C ATOM 498 O THR A 32 -3.230 15.038 6.739 1.00 0.00 O ATOM 499 CB THR A 32 -2.168 17.874 7.488 1.00 0.00 C ATOM 500 OG1 THR A 32 -1.423 18.500 8.555 1.00 0.00 O ATOM 501 CG2 THR A 32 -2.744 18.964 6.626 1.00 0.00 C ATOM 0 H THR A 32 -1.701 15.923 8.922 1.00 0.00 H new ATOM 0 HA THR A 32 -4.056 17.650 8.504 1.00 0.00 H new ATOM 0 HB THR A 32 -1.541 17.236 6.865 1.00 0.00 H new ATOM 0 HG1 THR A 32 -1.918 19.278 8.887 1.00 0.00 H new ATOM 0 HG21 THR A 32 -1.935 19.556 6.199 1.00 0.00 H new ATOM 0 HG22 THR A 32 -3.332 18.520 5.823 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.383 19.607 7.231 1.00 0.00 H new ATOM 509 N PRO A 33 -5.147 16.230 6.649 1.00 0.00 N ATOM 510 CA PRO A 33 -5.845 15.282 5.766 1.00 0.00 C ATOM 511 C PRO A 33 -5.202 15.065 4.387 1.00 0.00 C ATOM 512 O PRO A 33 -5.044 15.982 3.590 1.00 0.00 O ATOM 513 CB PRO A 33 -7.251 15.877 5.616 1.00 0.00 C ATOM 514 CG PRO A 33 -7.103 17.314 5.968 1.00 0.00 C ATOM 515 CD PRO A 33 -5.994 17.388 6.979 1.00 0.00 C ATOM 0 HA PRO A 33 -5.818 14.286 6.208 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.624 15.757 4.599 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.962 15.380 6.277 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.865 17.908 5.086 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -8.031 17.711 6.379 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.441 18.324 6.900 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.376 17.328 7.998 1.00 0.00 H new ATOM 523 N VAL A 34 -4.922 13.819 4.106 1.00 0.00 N ATOM 524 CA VAL A 34 -4.357 13.412 2.851 1.00 0.00 C ATOM 525 C VAL A 34 -5.493 13.153 1.854 1.00 0.00 C ATOM 526 O VAL A 34 -6.533 12.591 2.218 1.00 0.00 O ATOM 527 CB VAL A 34 -3.416 12.160 3.024 1.00 0.00 C ATOM 528 CG1 VAL A 34 -4.141 10.956 3.609 1.00 0.00 C ATOM 529 CG2 VAL A 34 -2.736 11.786 1.724 1.00 0.00 C ATOM 0 H VAL A 34 -5.084 13.048 4.754 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.726 14.210 2.459 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.650 12.458 3.740 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.444 10.123 3.706 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -4.539 11.212 4.591 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.960 10.669 2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.096 10.918 1.885 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.490 11.547 0.975 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.131 12.623 1.376 1.00 0.00 H new ATOM 539 N GLY A 35 -5.325 13.608 0.630 1.00 0.00 N ATOM 540 CA GLY A 35 -6.366 13.443 -0.349 1.00 0.00 C ATOM 541 C GLY A 35 -5.908 12.738 -1.601 1.00 0.00 C ATOM 542 O GLY A 35 -6.734 12.246 -2.371 1.00 0.00 O ATOM 0 H GLY A 35 -4.489 14.088 0.297 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -7.186 12.880 0.096 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -6.760 14.423 -0.617 1.00 0.00 H new ATOM 546 N LEU A 36 -4.607 12.664 -1.802 1.00 0.00 N ATOM 547 CA LEU A 36 -4.052 12.073 -3.001 1.00 0.00 C ATOM 548 C LEU A 36 -2.876 11.158 -2.641 1.00 0.00 C ATOM 549 O LEU A 36 -1.880 11.601 -2.093 1.00 0.00 O ATOM 550 CB LEU A 36 -3.667 13.224 -3.998 1.00 0.00 C ATOM 551 CG LEU A 36 -3.037 12.884 -5.382 1.00 0.00 C ATOM 552 CD1 LEU A 36 -1.555 12.554 -5.286 1.00 0.00 C ATOM 553 CD2 LEU A 36 -3.804 11.766 -6.082 1.00 0.00 C ATOM 0 H LEU A 36 -3.910 13.010 -1.143 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.785 11.439 -3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -4.571 13.803 -4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.970 13.882 -3.479 1.00 0.00 H new ATOM 0 HG LEU A 36 -3.120 13.785 -5.989 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.168 12.325 -6.279 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -1.018 13.409 -4.875 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.416 11.691 -4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.339 11.553 -7.045 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.785 10.869 -5.463 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.837 12.076 -6.239 1.00 0.00 H new ATOM 565 N ILE A 37 -3.035 9.885 -2.911 1.00 0.00 N ATOM 566 CA ILE A 37 -2.018 8.887 -2.646 1.00 0.00 C ATOM 567 C ILE A 37 -1.732 8.107 -3.933 1.00 0.00 C ATOM 568 O ILE A 37 -2.614 7.496 -4.491 1.00 0.00 O ATOM 569 CB ILE A 37 -2.493 7.899 -1.543 1.00 0.00 C ATOM 570 CG1 ILE A 37 -2.856 8.669 -0.259 1.00 0.00 C ATOM 571 CG2 ILE A 37 -1.415 6.854 -1.259 1.00 0.00 C ATOM 572 CD1 ILE A 37 -3.473 7.827 0.831 1.00 0.00 C ATOM 0 H ILE A 37 -3.885 9.504 -3.327 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.114 9.389 -2.300 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.383 7.381 -1.899 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.955 9.141 0.132 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.549 9.470 -0.516 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.765 6.171 -0.485 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -1.204 6.293 -2.169 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.506 7.352 -0.920 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.694 8.455 1.694 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -4.395 7.376 0.464 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.776 7.042 1.123 1.00 0.00 H new ATOM 584 N CYS A 38 -0.522 8.161 -4.373 1.00 0.00 N ATOM 585 CA CYS A 38 -0.046 7.519 -5.583 1.00 0.00 C ATOM 586 C CYS A 38 1.185 6.667 -5.253 1.00 0.00 C ATOM 587 O CYS A 38 2.087 7.139 -4.561 1.00 0.00 O ATOM 588 CB CYS A 38 0.327 8.631 -6.572 1.00 0.00 C ATOM 589 SG CYS A 38 -1.075 9.514 -7.291 1.00 0.00 S ATOM 0 H CYS A 38 0.211 8.676 -3.885 1.00 0.00 H new ATOM 0 HA CYS A 38 -0.808 6.869 -6.013 1.00 0.00 H new ATOM 0 HB2 CYS A 38 0.967 9.351 -6.062 1.00 0.00 H new ATOM 0 HB3 CYS A 38 0.916 8.196 -7.379 1.00 0.00 H new ATOM 0 HG CYS A 38 -0.640 10.428 -8.106 1.00 0.00 H new ATOM 595 N MET A 39 1.202 5.413 -5.689 1.00 0.00 N ATOM 596 CA MET A 39 2.338 4.514 -5.449 1.00 0.00 C ATOM 597 C MET A 39 2.356 3.378 -6.473 1.00 0.00 C ATOM 598 O MET A 39 1.313 3.015 -7.021 1.00 0.00 O ATOM 599 CB MET A 39 2.294 3.932 -4.020 1.00 0.00 C ATOM 600 CG MET A 39 1.033 3.126 -3.706 1.00 0.00 C ATOM 601 SD MET A 39 1.008 2.440 -2.033 1.00 0.00 S ATOM 602 CE MET A 39 1.071 3.927 -1.038 1.00 0.00 C ATOM 0 H MET A 39 0.439 4.988 -6.215 1.00 0.00 H new ATOM 0 HA MET A 39 3.251 5.100 -5.556 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.165 3.293 -3.874 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.375 4.750 -3.305 1.00 0.00 H new ATOM 0 HG2 MET A 39 0.161 3.766 -3.840 1.00 0.00 H new ATOM 0 HG3 MET A 39 0.945 2.311 -4.425 1.00 0.00 H new ATOM 0 HE1 MET A 39 0.919 3.670 0.010 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.044 4.404 -1.158 1.00 0.00 H new ATOM 0 HE3 MET A 39 0.288 4.614 -1.360 1.00 0.00 H new ATOM 612 N ASP A 40 3.520 2.827 -6.724 1.00 0.00 N ATOM 613 CA ASP A 40 3.654 1.692 -7.633 1.00 0.00 C ATOM 614 C ASP A 40 4.417 0.594 -6.927 1.00 0.00 C ATOM 615 O ASP A 40 5.559 0.791 -6.507 1.00 0.00 O ATOM 616 CB ASP A 40 4.378 2.091 -8.921 1.00 0.00 C ATOM 617 CG ASP A 40 4.451 0.956 -9.928 1.00 0.00 C ATOM 618 OD1 ASP A 40 3.496 0.817 -10.743 1.00 0.00 O ATOM 619 OD2 ASP A 40 5.468 0.216 -9.945 1.00 0.00 O ATOM 0 H ASP A 40 4.399 3.142 -6.313 1.00 0.00 H new ATOM 0 HA ASP A 40 2.660 1.342 -7.911 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.865 2.940 -9.373 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.388 2.421 -8.678 1.00 0.00 H new ATOM 624 N ILE A 41 3.792 -0.537 -6.767 1.00 0.00 N ATOM 625 CA ILE A 41 4.381 -1.637 -6.035 1.00 0.00 C ATOM 626 C ILE A 41 4.942 -2.647 -7.014 1.00 0.00 C ATOM 627 O ILE A 41 4.203 -3.258 -7.779 1.00 0.00 O ATOM 628 CB ILE A 41 3.357 -2.370 -5.064 1.00 0.00 C ATOM 629 CG1 ILE A 41 2.772 -1.434 -3.971 1.00 0.00 C ATOM 630 CG2 ILE A 41 4.001 -3.587 -4.393 1.00 0.00 C ATOM 631 CD1 ILE A 41 1.765 -0.412 -4.451 1.00 0.00 C ATOM 0 H ILE A 41 2.861 -0.729 -7.137 1.00 0.00 H new ATOM 0 HA ILE A 41 5.167 -1.213 -5.410 1.00 0.00 H new ATOM 0 HB ILE A 41 2.533 -2.692 -5.700 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.300 -2.050 -3.206 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.597 -0.907 -3.491 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.276 -4.066 -3.736 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.323 -4.296 -5.156 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.864 -3.266 -3.809 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.423 0.186 -3.607 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.231 0.238 -5.191 1.00 0.00 H new ATOM 0 HD13 ILE A 41 0.914 -0.923 -4.901 1.00 0.00 H new ATOM 643 N SER A 42 6.231 -2.790 -7.016 1.00 0.00 N ATOM 644 CA SER A 42 6.874 -3.755 -7.843 1.00 0.00 C ATOM 645 C SER A 42 7.148 -5.011 -7.012 1.00 0.00 C ATOM 646 O SER A 42 7.415 -4.922 -5.804 1.00 0.00 O ATOM 647 CB SER A 42 8.152 -3.159 -8.403 1.00 0.00 C ATOM 648 OG SER A 42 7.860 -1.908 -9.022 1.00 0.00 O ATOM 0 H SER A 42 6.866 -2.237 -6.441 1.00 0.00 H new ATOM 0 HA SER A 42 6.239 -4.033 -8.684 1.00 0.00 H new ATOM 0 HB2 SER A 42 8.882 -3.021 -7.605 1.00 0.00 H new ATOM 0 HB3 SER A 42 8.597 -3.841 -9.128 1.00 0.00 H new ATOM 0 HG SER A 42 6.890 -1.773 -9.045 1.00 0.00 H new ATOM 654 N TYR A 43 7.045 -6.151 -7.638 1.00 0.00 N ATOM 655 CA TYR A 43 7.205 -7.429 -6.980 1.00 0.00 C ATOM 656 C TYR A 43 7.714 -8.421 -8.002 1.00 0.00 C ATOM 657 O TYR A 43 7.685 -8.128 -9.205 1.00 0.00 O ATOM 658 CB TYR A 43 5.837 -7.907 -6.395 1.00 0.00 C ATOM 659 CG TYR A 43 4.738 -8.126 -7.439 1.00 0.00 C ATOM 660 CD1 TYR A 43 4.479 -9.391 -7.963 1.00 0.00 C ATOM 661 CD2 TYR A 43 3.989 -7.063 -7.919 1.00 0.00 C ATOM 662 CE1 TYR A 43 3.518 -9.577 -8.935 1.00 0.00 C ATOM 663 CE2 TYR A 43 3.023 -7.251 -8.878 1.00 0.00 C ATOM 664 CZ TYR A 43 2.797 -8.502 -9.385 1.00 0.00 C ATOM 665 OH TYR A 43 1.866 -8.663 -10.380 1.00 0.00 O ATOM 0 H TYR A 43 6.844 -6.225 -8.635 1.00 0.00 H new ATOM 0 HA TYR A 43 7.913 -7.344 -6.156 1.00 0.00 H new ATOM 0 HB2 TYR A 43 5.995 -8.839 -5.852 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.490 -7.171 -5.670 1.00 0.00 H new ATOM 0 HD1 TYR A 43 5.040 -10.240 -7.602 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.168 -6.070 -7.533 1.00 0.00 H new ATOM 0 HE1 TYR A 43 3.335 -10.562 -9.338 1.00 0.00 H new ATOM 0 HE2 TYR A 43 2.442 -6.412 -9.232 1.00 0.00 H new ATOM 0 HH TYR A 43 1.446 -7.800 -10.578 1.00 0.00 H new ATOM 675 N ASP A 44 8.166 -9.575 -7.555 1.00 0.00 N ATOM 676 CA ASP A 44 8.616 -10.596 -8.483 1.00 0.00 C ATOM 677 C ASP A 44 7.392 -11.312 -9.023 1.00 0.00 C ATOM 678 O ASP A 44 6.684 -11.988 -8.272 1.00 0.00 O ATOM 679 CB ASP A 44 9.560 -11.596 -7.817 1.00 0.00 C ATOM 680 CG ASP A 44 10.211 -12.525 -8.832 1.00 0.00 C ATOM 681 OD1 ASP A 44 9.536 -13.437 -9.368 1.00 0.00 O ATOM 682 OD2 ASP A 44 11.415 -12.361 -9.111 1.00 0.00 O ATOM 0 H ASP A 44 8.232 -9.829 -6.569 1.00 0.00 H new ATOM 0 HA ASP A 44 9.175 -10.122 -9.290 1.00 0.00 H new ATOM 0 HB2 ASP A 44 10.333 -11.056 -7.270 1.00 0.00 H new ATOM 0 HB3 ASP A 44 9.007 -12.187 -7.087 1.00 0.00 H new ATOM 687 N ALA A 45 7.160 -11.162 -10.311 1.00 0.00 N ATOM 688 CA ALA A 45 5.956 -11.649 -10.994 1.00 0.00 C ATOM 689 C ALA A 45 5.779 -13.165 -10.954 1.00 0.00 C ATOM 690 O ALA A 45 4.656 -13.662 -11.010 1.00 0.00 O ATOM 691 CB ALA A 45 5.965 -11.179 -12.433 1.00 0.00 C ATOM 0 H ALA A 45 7.812 -10.688 -10.936 1.00 0.00 H new ATOM 0 HA ALA A 45 5.110 -11.232 -10.448 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.070 -11.541 -12.940 1.00 0.00 H new ATOM 0 HB2 ALA A 45 5.981 -10.089 -12.460 1.00 0.00 H new ATOM 0 HB3 ALA A 45 6.850 -11.568 -12.937 1.00 0.00 H new ATOM 697 N SER A 46 6.860 -13.886 -10.881 1.00 0.00 N ATOM 698 CA SER A 46 6.789 -15.324 -10.894 1.00 0.00 C ATOM 699 C SER A 46 6.760 -15.873 -9.472 1.00 0.00 C ATOM 700 O SER A 46 6.280 -16.986 -9.228 1.00 0.00 O ATOM 701 CB SER A 46 7.979 -15.883 -11.687 1.00 0.00 C ATOM 702 OG SER A 46 7.990 -17.301 -11.732 1.00 0.00 O ATOM 0 H SER A 46 7.803 -13.504 -10.812 1.00 0.00 H new ATOM 0 HA SER A 46 5.866 -15.639 -11.381 1.00 0.00 H new ATOM 0 HB2 SER A 46 7.949 -15.492 -12.704 1.00 0.00 H new ATOM 0 HB3 SER A 46 8.907 -15.531 -11.238 1.00 0.00 H new ATOM 0 HG SER A 46 8.765 -17.606 -12.249 1.00 0.00 H new ATOM 708 N LYS A 47 7.258 -15.095 -8.542 1.00 0.00 N ATOM 709 CA LYS A 47 7.384 -15.528 -7.178 1.00 0.00 C ATOM 710 C LYS A 47 6.113 -15.223 -6.402 1.00 0.00 C ATOM 711 O LYS A 47 5.663 -16.027 -5.580 1.00 0.00 O ATOM 712 CB LYS A 47 8.571 -14.814 -6.562 1.00 0.00 C ATOM 713 CG LYS A 47 9.355 -15.616 -5.566 1.00 0.00 C ATOM 714 CD LYS A 47 10.583 -14.851 -5.132 1.00 0.00 C ATOM 715 CE LYS A 47 11.535 -15.714 -4.333 1.00 0.00 C ATOM 716 NZ LYS A 47 12.745 -14.958 -3.963 1.00 0.00 N ATOM 0 H LYS A 47 7.586 -14.145 -8.713 1.00 0.00 H new ATOM 0 HA LYS A 47 7.540 -16.606 -7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 47 9.242 -14.503 -7.362 1.00 0.00 H new ATOM 0 HB3 LYS A 47 8.215 -13.907 -6.074 1.00 0.00 H new ATOM 0 HG2 LYS A 47 8.733 -15.842 -4.700 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.648 -16.569 -6.006 1.00 0.00 H new ATOM 0 HD2 LYS A 47 11.097 -14.462 -6.011 1.00 0.00 H new ATOM 0 HD3 LYS A 47 10.282 -13.992 -4.532 1.00 0.00 H new ATOM 0 HE2 LYS A 47 11.037 -16.075 -3.433 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.814 -16.592 -4.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.466 -15.613 -3.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 13.116 -14.466 -4.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 12.508 -14.261 -3.229 1.00 0.00 H new ATOM 730 N PHE A 48 5.526 -14.078 -6.675 1.00 0.00 N ATOM 731 CA PHE A 48 4.329 -13.656 -5.990 1.00 0.00 C ATOM 732 C PHE A 48 3.248 -13.349 -6.990 1.00 0.00 C ATOM 733 O PHE A 48 3.502 -12.738 -8.017 1.00 0.00 O ATOM 734 CB PHE A 48 4.597 -12.418 -5.121 1.00 0.00 C ATOM 735 CG PHE A 48 5.665 -12.622 -4.091 1.00 0.00 C ATOM 736 CD1 PHE A 48 6.898 -12.010 -4.226 1.00 0.00 C ATOM 737 CD2 PHE A 48 5.444 -13.448 -3.004 1.00 0.00 C ATOM 738 CE1 PHE A 48 7.885 -12.212 -3.292 1.00 0.00 C ATOM 739 CE2 PHE A 48 6.431 -13.652 -2.066 1.00 0.00 C ATOM 740 CZ PHE A 48 7.650 -13.039 -2.210 1.00 0.00 C ATOM 0 H PHE A 48 5.865 -13.418 -7.375 1.00 0.00 H new ATOM 0 HA PHE A 48 4.005 -14.469 -5.340 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.882 -11.587 -5.767 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.673 -12.130 -4.620 1.00 0.00 H new ATOM 0 HD1 PHE A 48 7.087 -11.367 -5.073 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.488 -13.938 -2.890 1.00 0.00 H new ATOM 0 HE1 PHE A 48 8.843 -11.725 -3.403 1.00 0.00 H new ATOM 0 HE2 PHE A 48 6.246 -14.294 -1.218 1.00 0.00 H new ATOM 0 HZ PHE A 48 8.426 -13.203 -1.477 1.00 0.00 H new ATOM 750 N THR A 49 2.067 -13.808 -6.717 1.00 0.00 N ATOM 751 CA THR A 49 0.943 -13.551 -7.569 1.00 0.00 C ATOM 752 C THR A 49 -0.129 -12.800 -6.775 1.00 0.00 C ATOM 753 O THR A 49 -0.729 -13.355 -5.853 1.00 0.00 O ATOM 754 CB THR A 49 0.390 -14.883 -8.111 1.00 0.00 C ATOM 755 OG1 THR A 49 1.496 -15.636 -8.637 1.00 0.00 O ATOM 756 CG2 THR A 49 -0.618 -14.642 -9.232 1.00 0.00 C ATOM 0 H THR A 49 1.852 -14.373 -5.896 1.00 0.00 H new ATOM 0 HA THR A 49 1.249 -12.936 -8.415 1.00 0.00 H new ATOM 0 HB THR A 49 -0.113 -15.419 -7.306 1.00 0.00 H new ATOM 0 HG1 THR A 49 1.172 -16.492 -8.988 1.00 0.00 H new ATOM 0 HG21 THR A 49 -0.993 -15.599 -9.596 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.449 -14.048 -8.852 1.00 0.00 H new ATOM 0 HG23 THR A 49 -0.133 -14.107 -10.049 1.00 0.00 H new ATOM 764 N VAL A 50 -0.332 -11.545 -7.103 1.00 0.00 N ATOM 765 CA VAL A 50 -1.305 -10.721 -6.412 1.00 0.00 C ATOM 766 C VAL A 50 -2.707 -11.042 -6.906 1.00 0.00 C ATOM 767 O VAL A 50 -2.936 -11.197 -8.115 1.00 0.00 O ATOM 768 CB VAL A 50 -0.998 -9.174 -6.541 1.00 0.00 C ATOM 769 CG1 VAL A 50 -0.969 -8.699 -7.989 1.00 0.00 C ATOM 770 CG2 VAL A 50 -1.978 -8.331 -5.719 1.00 0.00 C ATOM 0 H VAL A 50 0.168 -11.066 -7.852 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.236 -10.959 -5.351 1.00 0.00 H new ATOM 0 HB VAL A 50 0.003 -9.032 -6.133 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.754 -7.631 -8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.195 -9.239 -8.534 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.937 -8.887 -8.453 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.734 -7.275 -5.834 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.994 -8.509 -6.070 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -1.904 -8.609 -4.668 1.00 0.00 H new ATOM 780 N LYS A 51 -3.614 -11.219 -5.985 1.00 0.00 N ATOM 781 CA LYS A 51 -4.986 -11.439 -6.351 1.00 0.00 C ATOM 782 C LYS A 51 -5.746 -10.153 -6.262 1.00 0.00 C ATOM 783 O LYS A 51 -6.321 -9.669 -7.249 1.00 0.00 O ATOM 784 CB LYS A 51 -5.674 -12.458 -5.453 1.00 0.00 C ATOM 785 CG LYS A 51 -5.145 -13.867 -5.535 1.00 0.00 C ATOM 786 CD LYS A 51 -6.099 -14.879 -4.874 1.00 0.00 C ATOM 787 CE LYS A 51 -6.135 -14.864 -3.327 1.00 0.00 C ATOM 788 NZ LYS A 51 -6.607 -13.595 -2.731 1.00 0.00 N ATOM 0 H LYS A 51 -3.430 -11.215 -4.982 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.980 -11.826 -7.370 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -5.592 -12.119 -4.420 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -6.736 -12.474 -5.700 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.996 -14.138 -6.580 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.170 -13.917 -5.050 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -7.107 -14.693 -5.243 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -5.819 -15.880 -5.202 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.781 -15.673 -2.985 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.134 -15.075 -2.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.045 -13.787 -1.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.801 -12.950 -2.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.307 -13.155 -3.362 1.00 0.00 H new ATOM 802 N ASP A 52 -5.707 -9.575 -5.097 1.00 0.00 N ATOM 803 CA ASP A 52 -6.493 -8.425 -4.790 1.00 0.00 C ATOM 804 C ASP A 52 -5.822 -7.620 -3.721 1.00 0.00 C ATOM 805 O ASP A 52 -4.828 -8.052 -3.151 1.00 0.00 O ATOM 806 CB ASP A 52 -7.929 -8.852 -4.356 1.00 0.00 C ATOM 807 CG ASP A 52 -7.999 -9.814 -3.153 1.00 0.00 C ATOM 808 OD1 ASP A 52 -8.335 -9.368 -2.028 1.00 0.00 O ATOM 809 OD2 ASP A 52 -7.791 -11.048 -3.331 1.00 0.00 O ATOM 0 H ASP A 52 -5.120 -9.896 -4.327 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.583 -7.803 -5.681 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.499 -7.955 -4.115 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -8.422 -9.324 -5.206 1.00 0.00 H new ATOM 814 N VAL A 53 -6.302 -6.431 -3.507 1.00 0.00 N ATOM 815 CA VAL A 53 -5.813 -5.595 -2.446 1.00 0.00 C ATOM 816 C VAL A 53 -6.997 -5.113 -1.640 1.00 0.00 C ATOM 817 O VAL A 53 -8.073 -4.840 -2.198 1.00 0.00 O ATOM 818 CB VAL A 53 -4.935 -4.375 -2.937 1.00 0.00 C ATOM 819 CG1 VAL A 53 -3.702 -4.846 -3.701 1.00 0.00 C ATOM 820 CG2 VAL A 53 -5.730 -3.386 -3.783 1.00 0.00 C ATOM 0 H VAL A 53 -7.046 -6.010 -4.064 1.00 0.00 H new ATOM 0 HA VAL A 53 -5.140 -6.197 -1.836 1.00 0.00 H new ATOM 0 HB VAL A 53 -4.611 -3.853 -2.037 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -3.122 -3.982 -4.024 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -3.090 -5.473 -3.053 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -4.012 -5.421 -4.574 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -5.080 -2.568 -4.094 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -6.121 -3.894 -4.665 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.558 -2.988 -3.196 1.00 0.00 H new ATOM 830 N LEU A 54 -6.841 -5.058 -0.363 1.00 0.00 N ATOM 831 CA LEU A 54 -7.901 -4.620 0.500 1.00 0.00 C ATOM 832 C LEU A 54 -7.574 -3.256 1.052 1.00 0.00 C ATOM 833 O LEU A 54 -6.603 -3.102 1.786 1.00 0.00 O ATOM 834 CB LEU A 54 -8.136 -5.625 1.632 1.00 0.00 C ATOM 835 CG LEU A 54 -8.628 -7.015 1.208 1.00 0.00 C ATOM 836 CD1 LEU A 54 -8.678 -7.937 2.402 1.00 0.00 C ATOM 837 CD2 LEU A 54 -10.003 -6.927 0.562 1.00 0.00 C ATOM 0 H LEU A 54 -5.979 -5.313 0.120 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.822 -4.555 -0.079 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.204 -5.744 2.184 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.863 -5.199 2.323 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.927 -7.417 0.476 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -9.029 -8.920 2.088 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.681 -8.028 2.833 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.360 -7.530 3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -10.332 -7.924 0.269 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -10.713 -6.505 1.273 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.950 -6.289 -0.320 1.00 0.00 H new ATOM 849 N PRO A 55 -8.326 -2.228 0.666 1.00 0.00 N ATOM 850 CA PRO A 55 -8.114 -0.896 1.175 1.00 0.00 C ATOM 851 C PRO A 55 -8.736 -0.746 2.556 1.00 0.00 C ATOM 852 O PRO A 55 -9.771 -1.367 2.861 1.00 0.00 O ATOM 853 CB PRO A 55 -8.835 -0.007 0.158 1.00 0.00 C ATOM 854 CG PRO A 55 -9.951 -0.856 -0.355 1.00 0.00 C ATOM 855 CD PRO A 55 -9.461 -2.283 -0.292 1.00 0.00 C ATOM 0 HA PRO A 55 -7.059 -0.645 1.288 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.211 0.904 0.623 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.166 0.299 -0.647 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -10.848 -0.726 0.250 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.212 -0.579 -1.376 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -10.243 -2.959 0.053 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.141 -2.639 -1.271 1.00 0.00 H new ATOM 863 N ASN A 56 -8.115 0.029 3.394 1.00 0.00 N ATOM 864 CA ASN A 56 -8.664 0.276 4.701 1.00 0.00 C ATOM 865 C ASN A 56 -9.746 1.331 4.551 1.00 0.00 C ATOM 866 O ASN A 56 -9.450 2.524 4.376 1.00 0.00 O ATOM 867 CB ASN A 56 -7.569 0.732 5.678 1.00 0.00 C ATOM 868 CG ASN A 56 -8.071 0.973 7.096 1.00 0.00 C ATOM 869 OD1 ASN A 56 -9.003 0.334 7.560 1.00 0.00 O ATOM 870 ND2 ASN A 56 -7.437 1.870 7.795 1.00 0.00 N ATOM 0 H ASN A 56 -7.232 0.501 3.201 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.090 -0.638 5.115 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -6.782 -0.022 5.704 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.118 1.650 5.301 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -7.715 2.056 8.759 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -6.662 2.387 7.379 1.00 0.00 H new ATOM 877 N THR A 57 -10.999 0.889 4.586 1.00 0.00 N ATOM 878 CA THR A 57 -12.143 1.754 4.356 1.00 0.00 C ATOM 879 C THR A 57 -12.391 2.685 5.554 1.00 0.00 C ATOM 880 O THR A 57 -13.207 3.612 5.497 1.00 0.00 O ATOM 881 CB THR A 57 -13.427 0.956 3.930 1.00 0.00 C ATOM 882 OG1 THR A 57 -14.495 1.851 3.603 1.00 0.00 O ATOM 883 CG2 THR A 57 -13.893 -0.010 5.015 1.00 0.00 C ATOM 0 H THR A 57 -11.247 -0.082 4.775 1.00 0.00 H new ATOM 0 HA THR A 57 -11.899 2.390 3.505 1.00 0.00 H new ATOM 0 HB THR A 57 -13.154 0.373 3.051 1.00 0.00 H new ATOM 0 HG1 THR A 57 -14.345 2.714 4.042 1.00 0.00 H new ATOM 0 HG21 THR A 57 -14.783 -0.538 4.674 1.00 0.00 H new ATOM 0 HG22 THR A 57 -13.102 -0.730 5.225 1.00 0.00 H new ATOM 0 HG23 THR A 57 -14.127 0.547 5.922 1.00 0.00 H new ATOM 891 N ASP A 58 -11.671 2.432 6.637 1.00 0.00 N ATOM 892 CA ASP A 58 -11.628 3.338 7.775 1.00 0.00 C ATOM 893 C ASP A 58 -11.093 4.682 7.283 1.00 0.00 C ATOM 894 O ASP A 58 -11.631 5.741 7.604 1.00 0.00 O ATOM 895 CB ASP A 58 -10.699 2.769 8.857 1.00 0.00 C ATOM 896 CG ASP A 58 -10.542 3.655 10.071 1.00 0.00 C ATOM 897 OD1 ASP A 58 -9.626 4.497 10.096 1.00 0.00 O ATOM 898 OD2 ASP A 58 -11.300 3.497 11.039 1.00 0.00 O ATOM 0 H ASP A 58 -11.101 1.594 6.752 1.00 0.00 H new ATOM 0 HA ASP A 58 -12.623 3.460 8.204 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.083 1.800 9.176 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.716 2.594 8.420 1.00 0.00 H new ATOM 903 N LEU A 59 -10.097 4.610 6.419 1.00 0.00 N ATOM 904 CA LEU A 59 -9.488 5.781 5.851 1.00 0.00 C ATOM 905 C LEU A 59 -10.150 6.148 4.521 1.00 0.00 C ATOM 906 O LEU A 59 -10.745 7.206 4.407 1.00 0.00 O ATOM 907 CB LEU A 59 -7.979 5.578 5.659 1.00 0.00 C ATOM 908 CG LEU A 59 -7.158 5.261 6.917 1.00 0.00 C ATOM 909 CD1 LEU A 59 -5.688 5.174 6.582 1.00 0.00 C ATOM 910 CD2 LEU A 59 -7.390 6.293 8.003 1.00 0.00 C ATOM 0 H LEU A 59 -9.692 3.731 6.096 1.00 0.00 H new ATOM 0 HA LEU A 59 -9.636 6.605 6.549 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.833 4.767 4.945 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.570 6.480 5.205 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.491 4.294 7.295 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -5.122 4.949 7.486 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.528 4.385 5.847 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.352 6.126 6.171 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.794 6.039 8.880 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -7.097 7.277 7.638 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -8.446 6.306 8.273 1.00 0.00 H new ATOM 922 N VAL A 60 -10.079 5.244 3.549 1.00 0.00 N ATOM 923 CA VAL A 60 -10.601 5.497 2.193 1.00 0.00 C ATOM 924 C VAL A 60 -12.120 5.309 2.185 1.00 0.00 C ATOM 925 O VAL A 60 -12.616 4.204 2.462 1.00 0.00 O ATOM 926 CB VAL A 60 -9.955 4.527 1.148 1.00 0.00 C ATOM 927 CG1 VAL A 60 -10.332 4.914 -0.278 1.00 0.00 C ATOM 928 CG2 VAL A 60 -8.433 4.459 1.309 1.00 0.00 C ATOM 0 H VAL A 60 -9.663 4.320 3.668 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.348 6.521 1.917 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.355 3.532 1.343 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.867 4.220 -0.978 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.415 4.873 -0.392 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.984 5.926 -0.485 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -8.019 3.776 0.567 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -8.007 5.452 1.166 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -8.189 4.100 2.309 1.00 0.00 H new ATOM 938 N LYS A 61 -12.852 6.362 1.890 1.00 0.00 N ATOM 939 CA LYS A 61 -14.268 6.316 1.943 1.00 0.00 C ATOM 940 C LYS A 61 -14.892 6.311 0.548 1.00 0.00 C ATOM 941 O LYS A 61 -14.293 6.790 -0.425 1.00 0.00 O ATOM 942 CB LYS A 61 -14.787 7.496 2.748 1.00 0.00 C ATOM 943 CG LYS A 61 -16.028 7.190 3.547 1.00 0.00 C ATOM 944 CD LYS A 61 -15.740 6.171 4.649 1.00 0.00 C ATOM 945 CE LYS A 61 -14.769 6.704 5.699 1.00 0.00 C ATOM 946 NZ LYS A 61 -14.502 5.707 6.752 1.00 0.00 N ATOM 0 H LYS A 61 -12.468 7.264 1.609 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.556 5.384 2.429 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -14.004 7.833 3.427 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -14.998 8.322 2.069 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -16.414 8.108 3.989 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -16.804 6.804 2.885 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -16.675 5.890 5.133 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -15.327 5.266 4.204 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -13.832 6.985 5.218 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -15.180 7.608 6.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -13.695 6.019 7.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -15.342 5.608 7.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -14.281 4.790 6.314 1.00 0.00 H new ATOM 960 N ASP A 62 -16.097 5.737 0.501 1.00 0.00 N ATOM 961 CA ASP A 62 -16.969 5.582 -0.678 1.00 0.00 C ATOM 962 C ASP A 62 -16.194 5.214 -1.931 1.00 0.00 C ATOM 963 O ASP A 62 -16.037 6.009 -2.856 1.00 0.00 O ATOM 964 CB ASP A 62 -17.864 6.801 -0.893 1.00 0.00 C ATOM 965 CG ASP A 62 -18.980 6.536 -1.878 1.00 0.00 C ATOM 966 OD1 ASP A 62 -18.886 6.934 -3.043 1.00 0.00 O ATOM 967 OD2 ASP A 62 -20.002 5.926 -1.479 1.00 0.00 O ATOM 0 H ASP A 62 -16.522 5.340 1.339 1.00 0.00 H new ATOM 0 HA ASP A 62 -17.627 4.739 -0.466 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -18.292 7.106 0.062 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -17.258 7.633 -1.251 1.00 0.00 H new ATOM 972 N THR A 63 -15.702 4.001 -1.950 1.00 0.00 N ATOM 973 CA THR A 63 -14.795 3.550 -2.980 1.00 0.00 C ATOM 974 C THR A 63 -15.419 3.417 -4.372 1.00 0.00 C ATOM 975 O THR A 63 -14.689 3.369 -5.381 1.00 0.00 O ATOM 976 CB THR A 63 -14.093 2.259 -2.547 1.00 0.00 C ATOM 977 OG1 THR A 63 -15.063 1.354 -1.984 1.00 0.00 O ATOM 978 CG2 THR A 63 -13.015 2.560 -1.513 1.00 0.00 C ATOM 0 H THR A 63 -15.919 3.293 -1.248 1.00 0.00 H new ATOM 0 HA THR A 63 -14.055 4.342 -3.091 1.00 0.00 H new ATOM 0 HB THR A 63 -13.624 1.802 -3.418 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.617 0.526 -1.708 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.526 1.632 -1.216 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.277 3.237 -1.943 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.469 3.026 -0.639 1.00 0.00 H new ATOM 986 N ASP A 64 -16.749 3.408 -4.437 1.00 0.00 N ATOM 987 CA ASP A 64 -17.453 3.274 -5.708 1.00 0.00 C ATOM 988 C ASP A 64 -17.282 4.514 -6.566 1.00 0.00 C ATOM 989 O ASP A 64 -17.178 4.419 -7.786 1.00 0.00 O ATOM 990 CB ASP A 64 -18.936 2.977 -5.511 1.00 0.00 C ATOM 991 CG ASP A 64 -19.625 2.648 -6.815 1.00 0.00 C ATOM 992 OD1 ASP A 64 -19.415 1.535 -7.334 1.00 0.00 O ATOM 993 OD2 ASP A 64 -20.397 3.470 -7.331 1.00 0.00 O ATOM 0 H ASP A 64 -17.359 3.492 -3.624 1.00 0.00 H new ATOM 0 HA ASP A 64 -17.005 2.425 -6.225 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -19.050 2.142 -4.820 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -19.421 3.839 -5.052 1.00 0.00 H new ATOM 998 N ASN A 65 -17.161 5.667 -5.920 1.00 0.00 N ATOM 999 CA ASN A 65 -17.004 6.949 -6.623 1.00 0.00 C ATOM 1000 C ASN A 65 -15.579 7.266 -7.028 1.00 0.00 C ATOM 1001 O ASN A 65 -15.196 8.437 -7.102 1.00 0.00 O ATOM 1002 CB ASN A 65 -17.664 8.120 -5.895 1.00 0.00 C ATOM 1003 CG ASN A 65 -19.134 8.223 -6.240 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -19.517 8.908 -7.197 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -19.963 7.577 -5.484 1.00 0.00 N ATOM 0 H ASN A 65 -17.168 5.748 -4.903 1.00 0.00 H new ATOM 0 HA ASN A 65 -17.550 6.809 -7.556 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -17.549 7.993 -4.819 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -17.159 9.048 -6.163 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -20.965 7.624 -5.669 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -19.614 7.021 -4.703 1.00 0.00 H new ATOM 1012 N TYR A 66 -14.797 6.202 -7.283 1.00 0.00 N ATOM 1013 CA TYR A 66 -13.448 6.285 -7.855 1.00 0.00 C ATOM 1014 C TYR A 66 -12.415 6.762 -6.814 1.00 0.00 C ATOM 1015 O TYR A 66 -11.440 7.421 -7.132 1.00 0.00 O ATOM 1016 CB TYR A 66 -13.496 7.153 -9.164 1.00 0.00 C ATOM 1017 CG TYR A 66 -12.246 7.209 -10.022 1.00 0.00 C ATOM 1018 CD1 TYR A 66 -11.557 8.405 -10.197 1.00 0.00 C ATOM 1019 CD2 TYR A 66 -11.769 6.078 -10.666 1.00 0.00 C ATOM 1020 CE1 TYR A 66 -10.432 8.470 -10.986 1.00 0.00 C ATOM 1021 CE2 TYR A 66 -10.640 6.137 -11.459 1.00 0.00 C ATOM 1022 CZ TYR A 66 -9.979 7.336 -11.616 1.00 0.00 C ATOM 1023 OH TYR A 66 -8.850 7.395 -12.398 1.00 0.00 O ATOM 0 H TYR A 66 -15.093 5.245 -7.093 1.00 0.00 H new ATOM 0 HA TYR A 66 -13.103 5.292 -8.141 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -14.311 6.780 -9.784 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -13.753 8.173 -8.880 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -11.912 9.298 -9.705 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -12.287 5.138 -10.546 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -9.908 9.406 -11.109 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -10.277 5.248 -11.954 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.663 6.508 -12.771 1.00 0.00 H new ATOM 1033 N SER A 67 -12.638 6.401 -5.560 1.00 0.00 N ATOM 1034 CA SER A 67 -11.650 6.660 -4.511 1.00 0.00 C ATOM 1035 C SER A 67 -10.567 5.576 -4.575 1.00 0.00 C ATOM 1036 O SER A 67 -9.407 5.782 -4.207 1.00 0.00 O ATOM 1037 CB SER A 67 -12.331 6.602 -3.156 1.00 0.00 C ATOM 1038 OG SER A 67 -13.563 7.279 -3.205 1.00 0.00 O ATOM 0 H SER A 67 -13.485 5.931 -5.240 1.00 0.00 H new ATOM 0 HA SER A 67 -11.204 7.644 -4.655 1.00 0.00 H new ATOM 0 HB2 SER A 67 -12.489 5.564 -2.864 1.00 0.00 H new ATOM 0 HB3 SER A 67 -11.690 7.052 -2.398 1.00 0.00 H new ATOM 0 HG SER A 67 -14.292 6.644 -3.043 1.00 0.00 H new ATOM 1044 N PHE A 68 -10.978 4.433 -5.088 1.00 0.00 N ATOM 1045 CA PHE A 68 -10.158 3.260 -5.213 1.00 0.00 C ATOM 1046 C PHE A 68 -9.677 3.152 -6.655 1.00 0.00 C ATOM 1047 O PHE A 68 -10.470 2.876 -7.554 1.00 0.00 O ATOM 1048 CB PHE A 68 -11.022 2.036 -4.822 1.00 0.00 C ATOM 1049 CG PHE A 68 -10.363 0.678 -4.895 1.00 0.00 C ATOM 1050 CD1 PHE A 68 -9.570 0.226 -3.863 1.00 0.00 C ATOM 1051 CD2 PHE A 68 -10.575 -0.156 -5.988 1.00 0.00 C ATOM 1052 CE1 PHE A 68 -8.994 -1.029 -3.911 1.00 0.00 C ATOM 1053 CE2 PHE A 68 -9.999 -1.408 -6.045 1.00 0.00 C ATOM 1054 CZ PHE A 68 -9.209 -1.847 -5.004 1.00 0.00 C ATOM 0 H PHE A 68 -11.926 4.298 -5.439 1.00 0.00 H new ATOM 0 HA PHE A 68 -9.285 3.308 -4.562 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -11.378 2.185 -3.803 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.900 2.021 -5.468 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -9.397 0.860 -3.006 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -11.199 0.181 -6.803 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -8.376 -1.371 -3.094 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -10.166 -2.043 -6.903 1.00 0.00 H new ATOM 0 HZ PHE A 68 -8.759 -2.828 -5.043 1.00 0.00 H new ATOM 1064 N ILE A 69 -8.416 3.438 -6.887 1.00 0.00 N ATOM 1065 CA ILE A 69 -7.842 3.312 -8.213 1.00 0.00 C ATOM 1066 C ILE A 69 -6.727 2.288 -8.143 1.00 0.00 C ATOM 1067 O ILE A 69 -5.676 2.536 -7.550 1.00 0.00 O ATOM 1068 CB ILE A 69 -7.229 4.659 -8.786 1.00 0.00 C ATOM 1069 CG1 ILE A 69 -8.228 5.830 -8.829 1.00 0.00 C ATOM 1070 CG2 ILE A 69 -6.632 4.452 -10.174 1.00 0.00 C ATOM 1071 CD1 ILE A 69 -8.463 6.522 -7.510 1.00 0.00 C ATOM 0 H ILE A 69 -7.763 3.761 -6.173 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.652 3.022 -8.882 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.443 4.932 -8.082 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -7.870 6.566 -9.549 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -9.183 5.459 -9.202 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.221 5.394 -10.537 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -5.839 3.706 -10.121 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.409 4.108 -10.857 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.181 7.331 -7.646 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.856 5.806 -6.788 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.522 6.930 -7.141 1.00 0.00 H new ATOM 1083 N VAL A 70 -6.955 1.139 -8.694 1.00 0.00 N ATOM 1084 CA VAL A 70 -5.940 0.115 -8.728 1.00 0.00 C ATOM 1085 C VAL A 70 -5.838 -0.426 -10.126 1.00 0.00 C ATOM 1086 O VAL A 70 -6.781 -1.030 -10.641 1.00 0.00 O ATOM 1087 CB VAL A 70 -6.202 -1.052 -7.708 1.00 0.00 C ATOM 1088 CG1 VAL A 70 -5.156 -2.163 -7.855 1.00 0.00 C ATOM 1089 CG2 VAL A 70 -6.181 -0.533 -6.279 1.00 0.00 C ATOM 0 H VAL A 70 -7.839 0.878 -9.131 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.999 0.575 -8.426 1.00 0.00 H new ATOM 0 HB VAL A 70 -7.187 -1.462 -7.931 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.364 -2.956 -7.136 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.197 -2.570 -8.866 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -4.163 -1.755 -7.668 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -6.364 -1.357 -5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -5.207 -0.092 -6.066 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -6.956 0.223 -6.155 1.00 0.00 H new ATOM 1099 N ASN A 71 -4.739 -0.165 -10.757 1.00 0.00 N ATOM 1100 CA ASN A 71 -4.492 -0.693 -12.061 1.00 0.00 C ATOM 1101 C ASN A 71 -3.471 -1.769 -11.917 1.00 0.00 C ATOM 1102 O ASN A 71 -2.300 -1.484 -11.600 1.00 0.00 O ATOM 1103 CB ASN A 71 -3.976 0.383 -13.039 1.00 0.00 C ATOM 1104 CG ASN A 71 -3.871 -0.129 -14.483 1.00 0.00 C ATOM 1105 OD1 ASN A 71 -4.836 -0.059 -15.239 1.00 0.00 O ATOM 1106 ND2 ASN A 71 -2.716 -0.620 -14.883 1.00 0.00 N ATOM 0 H ASN A 71 -3.989 0.418 -10.385 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.426 -1.074 -12.475 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -4.644 1.244 -13.011 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -2.997 0.729 -12.708 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.608 -0.953 -15.841 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.930 -0.667 -14.235 1.00 0.00 H new ATOM 1113 N THR A 72 -3.895 -2.992 -12.051 1.00 0.00 N ATOM 1114 CA THR A 72 -2.979 -4.079 -12.011 1.00 0.00 C ATOM 1115 C THR A 72 -2.261 -4.117 -13.355 1.00 0.00 C ATOM 1116 O THR A 72 -2.786 -4.611 -14.359 1.00 0.00 O ATOM 1117 CB THR A 72 -3.684 -5.416 -11.713 1.00 0.00 C ATOM 1118 OG1 THR A 72 -4.583 -5.236 -10.589 1.00 0.00 O ATOM 1119 CG2 THR A 72 -2.656 -6.484 -11.350 1.00 0.00 C ATOM 0 H THR A 72 -4.871 -3.255 -12.189 1.00 0.00 H new ATOM 0 HA THR A 72 -2.265 -3.934 -11.200 1.00 0.00 H new ATOM 0 HB THR A 72 -4.236 -5.732 -12.598 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.037 -6.082 -10.394 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.166 -7.424 -11.142 1.00 0.00 H new ATOM 0 HG22 THR A 72 -1.966 -6.622 -12.182 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.101 -6.169 -10.467 1.00 0.00 H new ATOM 1127 N SER A 73 -1.118 -3.493 -13.370 1.00 0.00 N ATOM 1128 CA SER A 73 -0.296 -3.347 -14.520 1.00 0.00 C ATOM 1129 C SER A 73 0.340 -4.680 -14.912 1.00 0.00 C ATOM 1130 O SER A 73 0.103 -5.717 -14.253 1.00 0.00 O ATOM 1131 CB SER A 73 0.758 -2.261 -14.248 1.00 0.00 C ATOM 1132 OG SER A 73 0.122 -1.024 -13.876 1.00 0.00 O ATOM 0 H SER A 73 -0.722 -3.055 -12.538 1.00 0.00 H new ATOM 0 HA SER A 73 -0.905 -3.034 -15.369 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.427 -2.587 -13.452 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.370 -2.109 -15.137 1.00 0.00 H new ATOM 0 HG SER A 73 0.673 -0.560 -13.212 1.00 0.00 H new ATOM 1138 N THR A 74 1.059 -4.662 -16.028 1.00 0.00 N ATOM 1139 CA THR A 74 1.789 -5.797 -16.540 1.00 0.00 C ATOM 1140 C THR A 74 2.605 -6.434 -15.385 1.00 0.00 C ATOM 1141 O THR A 74 3.297 -5.697 -14.649 1.00 0.00 O ATOM 1142 CB THR A 74 2.716 -5.276 -17.662 1.00 0.00 C ATOM 1143 OG1 THR A 74 1.908 -4.543 -18.602 1.00 0.00 O ATOM 1144 CG2 THR A 74 3.405 -6.403 -18.394 1.00 0.00 C ATOM 0 H THR A 74 1.148 -3.830 -16.612 1.00 0.00 H new ATOM 0 HA THR A 74 1.124 -6.562 -16.941 1.00 0.00 H new ATOM 0 HB THR A 74 3.486 -4.649 -17.212 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.475 -4.200 -19.324 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.046 -5.992 -19.174 1.00 0.00 H new ATOM 0 HG22 THR A 74 4.010 -6.977 -17.692 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.657 -7.055 -18.846 1.00 0.00 H new ATOM 1152 N PRO A 75 2.479 -7.801 -15.208 1.00 0.00 N ATOM 1153 CA PRO A 75 3.002 -8.564 -14.059 1.00 0.00 C ATOM 1154 C PRO A 75 4.326 -8.059 -13.498 1.00 0.00 C ATOM 1155 O PRO A 75 5.312 -7.873 -14.228 1.00 0.00 O ATOM 1156 CB PRO A 75 3.158 -9.995 -14.606 1.00 0.00 C ATOM 1157 CG PRO A 75 2.597 -9.978 -15.998 1.00 0.00 C ATOM 1158 CD PRO A 75 1.803 -8.714 -16.136 1.00 0.00 C ATOM 0 HA PRO A 75 2.322 -8.475 -13.212 1.00 0.00 H new ATOM 0 HB2 PRO A 75 4.205 -10.297 -14.613 1.00 0.00 H new ATOM 0 HB3 PRO A 75 2.624 -10.711 -13.981 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.398 -10.013 -16.737 1.00 0.00 H new ATOM 0 HG3 PRO A 75 1.966 -10.850 -16.170 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.819 -8.336 -17.158 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.757 -8.862 -15.867 1.00 0.00 H new ATOM 1166 N GLY A 76 4.342 -7.859 -12.209 1.00 0.00 N ATOM 1167 CA GLY A 76 5.506 -7.336 -11.549 1.00 0.00 C ATOM 1168 C GLY A 76 5.332 -5.896 -11.095 1.00 0.00 C ATOM 1169 O GLY A 76 6.188 -5.374 -10.394 1.00 0.00 O ATOM 0 H GLY A 76 3.555 -8.052 -11.590 1.00 0.00 H new ATOM 0 HA2 GLY A 76 5.738 -7.959 -10.685 1.00 0.00 H new ATOM 0 HA3 GLY A 76 6.359 -7.398 -12.225 1.00 0.00 H new ATOM 1173 N LYS A 77 4.225 -5.258 -11.481 1.00 0.00 N ATOM 1174 CA LYS A 77 3.907 -3.888 -11.039 1.00 0.00 C ATOM 1175 C LYS A 77 2.420 -3.698 -10.781 1.00 0.00 C ATOM 1176 O LYS A 77 1.583 -4.101 -11.588 1.00 0.00 O ATOM 1177 CB LYS A 77 4.370 -2.812 -12.032 1.00 0.00 C ATOM 1178 CG LYS A 77 5.848 -2.476 -11.986 1.00 0.00 C ATOM 1179 CD LYS A 77 6.152 -1.295 -12.891 1.00 0.00 C ATOM 1180 CE LYS A 77 7.555 -0.755 -12.665 1.00 0.00 C ATOM 1181 NZ LYS A 77 7.752 -0.302 -11.266 1.00 0.00 N ATOM 0 H LYS A 77 3.527 -5.667 -12.102 1.00 0.00 H new ATOM 0 HA LYS A 77 4.459 -3.764 -10.107 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.121 -3.142 -13.041 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.802 -1.901 -11.845 1.00 0.00 H new ATOM 0 HG2 LYS A 77 6.143 -2.243 -10.963 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.434 -3.341 -12.297 1.00 0.00 H new ATOM 0 HD2 LYS A 77 6.043 -1.598 -13.932 1.00 0.00 H new ATOM 0 HD3 LYS A 77 5.425 -0.503 -12.711 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.285 -1.529 -12.903 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.739 0.076 -13.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.610 0.283 -11.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.930 0.258 -10.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.855 -1.129 -10.644 1.00 0.00 H new ATOM 1195 N ILE A 78 2.108 -3.104 -9.651 1.00 0.00 N ATOM 1196 CA ILE A 78 0.743 -2.751 -9.297 1.00 0.00 C ATOM 1197 C ILE A 78 0.715 -1.246 -9.100 1.00 0.00 C ATOM 1198 O ILE A 78 1.353 -0.735 -8.176 1.00 0.00 O ATOM 1199 CB ILE A 78 0.287 -3.381 -7.950 1.00 0.00 C ATOM 1200 CG1 ILE A 78 0.669 -4.853 -7.862 1.00 0.00 C ATOM 1201 CG2 ILE A 78 -1.233 -3.237 -7.810 1.00 0.00 C ATOM 1202 CD1 ILE A 78 0.403 -5.467 -6.504 1.00 0.00 C ATOM 0 H ILE A 78 2.797 -2.848 -8.943 1.00 0.00 H new ATOM 0 HA ILE A 78 0.084 -3.112 -10.087 1.00 0.00 H new ATOM 0 HB ILE A 78 0.792 -2.853 -7.141 1.00 0.00 H new ATOM 0 HG12 ILE A 78 0.115 -5.409 -8.618 1.00 0.00 H new ATOM 0 HG13 ILE A 78 1.728 -4.960 -8.099 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -1.555 -3.678 -6.867 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.502 -2.181 -7.827 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.725 -3.750 -8.637 1.00 0.00 H new ATOM 0 HD11 ILE A 78 0.699 -6.516 -6.515 1.00 0.00 H new ATOM 0 HD12 ILE A 78 0.978 -4.936 -5.746 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -0.660 -5.392 -6.273 1.00 0.00 H new ATOM 1214 N SER A 79 0.008 -0.548 -9.929 1.00 0.00 N ATOM 1215 CA SER A 79 -0.060 0.879 -9.825 1.00 0.00 C ATOM 1216 C SER A 79 -1.327 1.254 -9.037 1.00 0.00 C ATOM 1217 O SER A 79 -2.462 1.030 -9.501 1.00 0.00 O ATOM 1218 CB SER A 79 -0.059 1.470 -11.227 1.00 0.00 C ATOM 1219 OG SER A 79 1.012 0.895 -12.006 1.00 0.00 O ATOM 0 H SER A 79 -0.537 -0.945 -10.694 1.00 0.00 H new ATOM 0 HA SER A 79 0.800 1.283 -9.291 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.016 1.278 -11.712 1.00 0.00 H new ATOM 0 HB3 SER A 79 0.060 2.552 -11.174 1.00 0.00 H new ATOM 0 HG SER A 79 1.841 0.912 -11.484 1.00 0.00 H new ATOM 1225 N ILE A 80 -1.135 1.778 -7.844 1.00 0.00 N ATOM 1226 CA ILE A 80 -2.231 2.074 -6.941 1.00 0.00 C ATOM 1227 C ILE A 80 -2.337 3.579 -6.683 1.00 0.00 C ATOM 1228 O ILE A 80 -1.329 4.278 -6.548 1.00 0.00 O ATOM 1229 CB ILE A 80 -2.065 1.304 -5.580 1.00 0.00 C ATOM 1230 CG1 ILE A 80 -2.029 -0.218 -5.823 1.00 0.00 C ATOM 1231 CG2 ILE A 80 -3.178 1.662 -4.594 1.00 0.00 C ATOM 1232 CD1 ILE A 80 -1.902 -1.060 -4.563 1.00 0.00 C ATOM 0 H ILE A 80 -0.214 2.011 -7.472 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.151 1.738 -7.419 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.118 1.612 -5.137 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -2.938 -0.510 -6.349 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.192 -0.447 -6.483 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -3.032 1.112 -3.665 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.153 2.732 -4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -4.144 1.397 -5.024 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.885 -2.116 -4.831 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.978 -0.802 -4.045 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.752 -0.866 -3.908 1.00 0.00 H new ATOM 1244 N THR A 81 -3.540 4.070 -6.669 1.00 0.00 N ATOM 1245 CA THR A 81 -3.827 5.426 -6.362 1.00 0.00 C ATOM 1246 C THR A 81 -5.109 5.501 -5.517 1.00 0.00 C ATOM 1247 O THR A 81 -6.106 4.862 -5.822 1.00 0.00 O ATOM 1248 CB THR A 81 -3.945 6.276 -7.665 1.00 0.00 C ATOM 1249 OG1 THR A 81 -2.691 6.229 -8.367 1.00 0.00 O ATOM 1250 CG2 THR A 81 -4.302 7.733 -7.373 1.00 0.00 C ATOM 0 H THR A 81 -4.370 3.515 -6.878 1.00 0.00 H new ATOM 0 HA THR A 81 -3.006 5.845 -5.780 1.00 0.00 H new ATOM 0 HB THR A 81 -4.748 5.854 -8.270 1.00 0.00 H new ATOM 0 HG1 THR A 81 -2.756 6.759 -9.189 1.00 0.00 H new ATOM 0 HG21 THR A 81 -4.373 8.285 -8.310 1.00 0.00 H new ATOM 0 HG22 THR A 81 -5.259 7.776 -6.853 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.529 8.179 -6.747 1.00 0.00 H new ATOM 1258 N PHE A 82 -5.040 6.203 -4.431 1.00 0.00 N ATOM 1259 CA PHE A 82 -6.183 6.437 -3.602 1.00 0.00 C ATOM 1260 C PHE A 82 -6.394 7.918 -3.523 1.00 0.00 C ATOM 1261 O PHE A 82 -5.522 8.648 -3.062 1.00 0.00 O ATOM 1262 CB PHE A 82 -6.014 5.879 -2.173 1.00 0.00 C ATOM 1263 CG PHE A 82 -5.840 4.389 -2.062 1.00 0.00 C ATOM 1264 CD1 PHE A 82 -6.852 3.524 -2.449 1.00 0.00 C ATOM 1265 CD2 PHE A 82 -4.677 3.856 -1.531 1.00 0.00 C ATOM 1266 CE1 PHE A 82 -6.702 2.159 -2.318 1.00 0.00 C ATOM 1267 CE2 PHE A 82 -4.520 2.491 -1.401 1.00 0.00 C ATOM 1268 CZ PHE A 82 -5.538 1.640 -1.793 1.00 0.00 C ATOM 0 H PHE A 82 -4.181 6.635 -4.090 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.035 5.922 -4.046 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -5.149 6.361 -1.716 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -6.886 6.167 -1.586 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.768 3.923 -2.858 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.883 4.517 -1.215 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -7.497 1.497 -2.627 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.604 2.088 -0.994 1.00 0.00 H new ATOM 0 HZ PHE A 82 -5.421 0.572 -1.688 1.00 0.00 H new ATOM 1278 N THR A 83 -7.484 8.371 -4.015 1.00 0.00 N ATOM 1279 CA THR A 83 -7.810 9.742 -3.897 1.00 0.00 C ATOM 1280 C THR A 83 -9.272 9.839 -3.543 1.00 0.00 C ATOM 1281 O THR A 83 -10.142 9.346 -4.268 1.00 0.00 O ATOM 1282 CB THR A 83 -7.398 10.591 -5.161 1.00 0.00 C ATOM 1283 OG1 THR A 83 -7.703 11.975 -4.965 1.00 0.00 O ATOM 1284 CG2 THR A 83 -8.044 10.097 -6.447 1.00 0.00 C ATOM 0 H THR A 83 -8.174 7.806 -4.509 1.00 0.00 H new ATOM 0 HA THR A 83 -7.222 10.193 -3.098 1.00 0.00 H new ATOM 0 HB THR A 83 -6.321 10.466 -5.273 1.00 0.00 H new ATOM 0 HG1 THR A 83 -7.420 12.249 -4.068 1.00 0.00 H new ATOM 0 HG21 THR A 83 -7.721 10.722 -7.280 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.746 9.065 -6.631 1.00 0.00 H new ATOM 0 HG23 THR A 83 -9.129 10.150 -6.353 1.00 0.00 H new ATOM 1292 N ASP A 84 -9.536 10.424 -2.417 1.00 0.00 N ATOM 1293 CA ASP A 84 -10.869 10.433 -1.884 1.00 0.00 C ATOM 1294 C ASP A 84 -11.578 11.718 -2.299 1.00 0.00 C ATOM 1295 O ASP A 84 -11.090 12.818 -2.026 1.00 0.00 O ATOM 1296 CB ASP A 84 -10.816 10.317 -0.355 1.00 0.00 C ATOM 1297 CG ASP A 84 -12.124 9.855 0.250 1.00 0.00 C ATOM 1298 OD1 ASP A 84 -12.112 8.872 1.012 1.00 0.00 O ATOM 1299 OD2 ASP A 84 -13.167 10.441 -0.045 1.00 0.00 O ATOM 0 H ASP A 84 -8.844 10.905 -1.843 1.00 0.00 H new ATOM 0 HA ASP A 84 -11.426 9.583 -2.279 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -10.027 9.619 -0.077 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -10.549 11.285 0.068 1.00 0.00 H new ATOM 1304 N PRO A 85 -12.718 11.606 -3.003 1.00 0.00 N ATOM 1305 CA PRO A 85 -13.507 12.752 -3.428 1.00 0.00 C ATOM 1306 C PRO A 85 -14.426 13.260 -2.310 1.00 0.00 C ATOM 1307 O PRO A 85 -15.126 14.262 -2.472 1.00 0.00 O ATOM 1308 CB PRO A 85 -14.338 12.192 -4.586 1.00 0.00 C ATOM 1309 CG PRO A 85 -14.540 10.756 -4.244 1.00 0.00 C ATOM 1310 CD PRO A 85 -13.328 10.333 -3.454 1.00 0.00 C ATOM 0 HA PRO A 85 -12.886 13.604 -3.703 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -15.290 12.715 -4.680 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.818 12.304 -5.537 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -15.451 10.620 -3.661 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -14.646 10.153 -5.146 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.605 9.704 -2.608 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -12.636 9.756 -4.067 1.00 0.00 H new ATOM 1318 N THR A 86 -14.419 12.572 -1.192 1.00 0.00 N ATOM 1319 CA THR A 86 -15.268 12.885 -0.082 1.00 0.00 C ATOM 1320 C THR A 86 -14.444 13.542 1.031 1.00 0.00 C ATOM 1321 O THR A 86 -14.926 13.694 2.150 1.00 0.00 O ATOM 1322 CB THR A 86 -15.883 11.588 0.484 1.00 0.00 C ATOM 1323 OG1 THR A 86 -15.852 10.565 -0.526 1.00 0.00 O ATOM 1324 CG2 THR A 86 -17.318 11.825 0.901 1.00 0.00 C ATOM 0 H THR A 86 -13.812 11.768 -1.033 1.00 0.00 H new ATOM 0 HA THR A 86 -16.052 13.561 -0.423 1.00 0.00 H new ATOM 0 HB THR A 86 -15.304 11.275 1.353 1.00 0.00 H new ATOM 0 HG1 THR A 86 -14.945 10.200 -0.595 1.00 0.00 H new ATOM 0 HG21 THR A 86 -17.739 10.901 1.298 1.00 0.00 H new ATOM 0 HG22 THR A 86 -17.351 12.598 1.669 1.00 0.00 H new ATOM 0 HG23 THR A 86 -17.900 12.146 0.037 1.00 0.00 H new ATOM 1332 N LEU A 87 -13.222 13.979 0.694 1.00 0.00 N ATOM 1333 CA LEU A 87 -12.262 14.541 1.666 1.00 0.00 C ATOM 1334 C LEU A 87 -12.786 15.742 2.483 1.00 0.00 C ATOM 1335 O LEU A 87 -12.286 16.019 3.575 1.00 0.00 O ATOM 1336 CB LEU A 87 -10.867 14.813 1.013 1.00 0.00 C ATOM 1337 CG LEU A 87 -10.792 15.703 -0.265 1.00 0.00 C ATOM 1338 CD1 LEU A 87 -11.102 17.166 0.018 1.00 0.00 C ATOM 1339 CD2 LEU A 87 -9.426 15.576 -0.917 1.00 0.00 C ATOM 0 H LEU A 87 -12.867 13.954 -0.262 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.129 13.759 2.414 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.232 15.272 1.771 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.424 13.848 0.768 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.560 15.339 -0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -11.035 17.738 -0.908 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.109 17.252 0.426 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.384 17.557 0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -9.388 16.203 -1.808 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.656 15.897 -0.215 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.252 14.537 -1.197 1.00 0.00 H new ATOM 1351 N ALA A 88 -13.784 16.444 1.960 1.00 0.00 N ATOM 1352 CA ALA A 88 -14.366 17.573 2.669 1.00 0.00 C ATOM 1353 C ALA A 88 -15.282 17.095 3.800 1.00 0.00 C ATOM 1354 O ALA A 88 -15.367 17.724 4.857 1.00 0.00 O ATOM 1355 CB ALA A 88 -15.116 18.486 1.708 1.00 0.00 C ATOM 0 H ALA A 88 -14.205 16.251 1.051 1.00 0.00 H new ATOM 0 HA ALA A 88 -13.555 18.147 3.116 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -15.543 19.323 2.260 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -14.427 18.863 0.952 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -15.915 17.926 1.223 1.00 0.00 H new ATOM 1361 N ASN A 89 -15.933 15.961 3.587 1.00 0.00 N ATOM 1362 CA ASN A 89 -16.847 15.395 4.583 1.00 0.00 C ATOM 1363 C ASN A 89 -16.144 14.371 5.457 1.00 0.00 C ATOM 1364 O ASN A 89 -16.519 14.162 6.607 1.00 0.00 O ATOM 1365 CB ASN A 89 -18.103 14.777 3.936 1.00 0.00 C ATOM 1366 CG ASN A 89 -19.061 15.809 3.350 1.00 0.00 C ATOM 1367 OD1 ASN A 89 -19.956 16.305 4.032 1.00 0.00 O ATOM 1368 ND2 ASN A 89 -18.904 16.128 2.099 1.00 0.00 N ATOM 0 H ASN A 89 -15.849 15.409 2.733 1.00 0.00 H new ATOM 0 HA ASN A 89 -17.174 16.223 5.212 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -17.794 14.091 3.147 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -18.632 14.186 4.683 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -19.531 16.804 1.662 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -18.154 15.703 1.554 1.00 0.00 H new ATOM 1375 N TYR A 90 -15.140 13.723 4.911 1.00 0.00 N ATOM 1376 CA TYR A 90 -14.344 12.764 5.649 1.00 0.00 C ATOM 1377 C TYR A 90 -12.869 13.073 5.425 1.00 0.00 C ATOM 1378 O TYR A 90 -12.342 12.820 4.353 1.00 0.00 O ATOM 1379 CB TYR A 90 -14.634 11.318 5.204 1.00 0.00 C ATOM 1380 CG TYR A 90 -16.068 10.872 5.354 1.00 0.00 C ATOM 1381 CD1 TYR A 90 -16.626 10.653 6.605 1.00 0.00 C ATOM 1382 CD2 TYR A 90 -16.857 10.653 4.240 1.00 0.00 C ATOM 1383 CE1 TYR A 90 -17.935 10.233 6.733 1.00 0.00 C ATOM 1384 CE2 TYR A 90 -18.161 10.234 4.357 1.00 0.00 C ATOM 1385 CZ TYR A 90 -18.697 10.025 5.604 1.00 0.00 C ATOM 1386 OH TYR A 90 -20.006 9.607 5.726 1.00 0.00 O ATOM 0 H TYR A 90 -14.850 13.845 3.941 1.00 0.00 H new ATOM 0 HA TYR A 90 -14.601 12.846 6.705 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -14.346 11.213 4.158 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -13.999 10.644 5.779 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -16.029 10.813 7.490 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -16.440 10.815 3.257 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -18.359 10.068 7.712 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -18.760 10.070 3.474 1.00 0.00 H new ATOM 0 HH TYR A 90 -20.402 9.509 4.835 1.00 0.00 H new ATOM 1396 N PRO A 91 -12.198 13.680 6.400 1.00 0.00 N ATOM 1397 CA PRO A 91 -10.796 14.001 6.273 1.00 0.00 C ATOM 1398 C PRO A 91 -9.890 12.846 6.734 1.00 0.00 C ATOM 1399 O PRO A 91 -9.926 12.436 7.906 1.00 0.00 O ATOM 1400 CB PRO A 91 -10.631 15.222 7.186 1.00 0.00 C ATOM 1401 CG PRO A 91 -11.768 15.165 8.175 1.00 0.00 C ATOM 1402 CD PRO A 91 -12.746 14.116 7.696 1.00 0.00 C ATOM 0 HA PRO A 91 -10.507 14.187 5.239 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -9.669 15.198 7.697 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -10.663 16.146 6.609 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -11.397 14.916 9.169 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -12.257 16.136 8.251 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -12.816 13.286 8.399 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -13.750 14.527 7.587 1.00 0.00 H new ATOM 1410 N ILE A 92 -9.092 12.304 5.825 1.00 0.00 N ATOM 1411 CA ILE A 92 -8.172 11.241 6.194 1.00 0.00 C ATOM 1412 C ILE A 92 -6.958 11.876 6.875 1.00 0.00 C ATOM 1413 O ILE A 92 -6.008 12.277 6.222 1.00 0.00 O ATOM 1414 CB ILE A 92 -7.682 10.428 4.956 1.00 0.00 C ATOM 1415 CG1 ILE A 92 -8.868 9.978 4.088 1.00 0.00 C ATOM 1416 CG2 ILE A 92 -6.884 9.207 5.421 1.00 0.00 C ATOM 1417 CD1 ILE A 92 -8.466 9.268 2.802 1.00 0.00 C ATOM 0 H ILE A 92 -9.063 12.578 4.843 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.695 10.552 6.858 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.043 11.073 4.353 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.501 9.312 4.675 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -9.470 10.850 3.835 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.544 8.642 4.553 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -6.021 9.535 6.001 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.518 8.573 6.041 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.361 8.984 2.248 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -7.859 9.937 2.192 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.890 8.375 3.044 1.00 0.00 H new ATOM 1429 N SER A 93 -7.027 12.010 8.168 1.00 0.00 N ATOM 1430 CA SER A 93 -5.963 12.633 8.919 1.00 0.00 C ATOM 1431 C SER A 93 -5.574 11.778 10.115 1.00 0.00 C ATOM 1432 O SER A 93 -4.939 12.244 11.057 1.00 0.00 O ATOM 1433 CB SER A 93 -6.427 14.021 9.353 1.00 0.00 C ATOM 1434 OG SER A 93 -7.686 13.951 10.014 1.00 0.00 O ATOM 0 H SER A 93 -7.815 11.694 8.733 1.00 0.00 H new ATOM 0 HA SER A 93 -5.074 12.729 8.296 1.00 0.00 H new ATOM 0 HB2 SER A 93 -5.686 14.465 10.018 1.00 0.00 H new ATOM 0 HB3 SER A 93 -6.504 14.672 8.482 1.00 0.00 H new ATOM 0 HG SER A 93 -7.964 14.851 10.285 1.00 0.00 H new ATOM 1440 N VAL A 94 -5.944 10.524 10.060 1.00 0.00 N ATOM 1441 CA VAL A 94 -5.639 9.585 11.116 1.00 0.00 C ATOM 1442 C VAL A 94 -4.766 8.473 10.573 1.00 0.00 C ATOM 1443 O VAL A 94 -4.824 8.162 9.382 1.00 0.00 O ATOM 1444 CB VAL A 94 -6.907 9.010 11.824 1.00 0.00 C ATOM 1445 CG1 VAL A 94 -7.576 10.077 12.684 1.00 0.00 C ATOM 1446 CG2 VAL A 94 -7.908 8.478 10.813 1.00 0.00 C ATOM 0 H VAL A 94 -6.466 10.122 9.282 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.098 10.134 11.887 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.579 8.188 12.460 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.457 9.655 13.168 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -6.876 10.424 13.444 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -7.874 10.916 12.056 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.780 8.085 11.336 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.217 9.285 10.148 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.446 7.683 10.228 1.00 0.00 H new ATOM 1456 N ASP A 95 -3.950 7.908 11.425 1.00 0.00 N ATOM 1457 CA ASP A 95 -2.978 6.902 11.017 1.00 0.00 C ATOM 1458 C ASP A 95 -3.551 5.500 11.104 1.00 0.00 C ATOM 1459 O ASP A 95 -4.699 5.296 11.550 1.00 0.00 O ATOM 1460 CB ASP A 95 -1.682 6.993 11.861 1.00 0.00 C ATOM 1461 CG ASP A 95 -1.821 6.513 13.298 1.00 0.00 C ATOM 1462 OD1 ASP A 95 -1.329 5.404 13.618 1.00 0.00 O ATOM 1463 OD2 ASP A 95 -2.391 7.247 14.133 1.00 0.00 O ATOM 0 H ASP A 95 -3.933 8.125 12.421 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.732 7.109 9.975 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -0.904 6.407 11.371 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -1.343 8.029 11.870 1.00 0.00 H new ATOM 1468 N GLY A 96 -2.760 4.543 10.688 1.00 0.00 N ATOM 1469 CA GLY A 96 -3.148 3.174 10.711 1.00 0.00 C ATOM 1470 C GLY A 96 -2.629 2.477 9.496 1.00 0.00 C ATOM 1471 O GLY A 96 -1.531 2.790 9.010 1.00 0.00 O ATOM 0 H GLY A 96 -1.822 4.704 10.322 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.762 2.693 11.610 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.235 3.096 10.749 1.00 0.00 H new ATOM 1475 N ILE A 97 -3.391 1.563 8.991 1.00 0.00 N ATOM 1476 CA ILE A 97 -3.020 0.864 7.792 1.00 0.00 C ATOM 1477 C ILE A 97 -3.748 1.524 6.636 1.00 0.00 C ATOM 1478 O ILE A 97 -4.866 1.976 6.797 1.00 0.00 O ATOM 1479 CB ILE A 97 -3.395 -0.653 7.867 1.00 0.00 C ATOM 1480 CG1 ILE A 97 -2.775 -1.325 9.113 1.00 0.00 C ATOM 1481 CG2 ILE A 97 -2.962 -1.396 6.599 1.00 0.00 C ATOM 1482 CD1 ILE A 97 -1.258 -1.266 9.184 1.00 0.00 C ATOM 0 H ILE A 97 -4.285 1.277 9.391 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.939 0.917 7.659 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.480 -0.712 7.948 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -3.185 -0.851 10.005 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.085 -2.370 9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.237 -2.448 6.682 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.459 -0.958 5.733 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -1.882 -1.311 6.479 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.917 -1.763 10.092 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.833 -1.767 8.314 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.935 -0.225 9.197 1.00 0.00 H new ATOM 1494 N LEU A 98 -3.107 1.629 5.514 1.00 0.00 N ATOM 1495 CA LEU A 98 -3.719 2.209 4.350 1.00 0.00 C ATOM 1496 C LEU A 98 -4.362 1.122 3.490 1.00 0.00 C ATOM 1497 O LEU A 98 -5.528 1.231 3.093 1.00 0.00 O ATOM 1498 CB LEU A 98 -2.685 2.990 3.545 1.00 0.00 C ATOM 1499 CG LEU A 98 -3.200 3.668 2.279 1.00 0.00 C ATOM 1500 CD1 LEU A 98 -4.262 4.711 2.609 1.00 0.00 C ATOM 1501 CD2 LEU A 98 -2.055 4.287 1.514 1.00 0.00 C ATOM 0 H LEU A 98 -2.146 1.317 5.375 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.500 2.899 4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.250 3.753 4.191 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.879 2.310 3.268 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.666 2.910 1.649 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.611 5.178 1.688 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.100 4.230 3.113 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.834 5.471 3.262 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.437 4.767 0.613 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.559 5.030 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.341 3.511 1.237 1.00 0.00 H new ATOM 1513 N ALA A 99 -3.608 0.075 3.224 1.00 0.00 N ATOM 1514 CA ALA A 99 -4.079 -1.015 2.409 1.00 0.00 C ATOM 1515 C ALA A 99 -3.348 -2.285 2.772 1.00 0.00 C ATOM 1516 O ALA A 99 -2.229 -2.242 3.305 1.00 0.00 O ATOM 1517 CB ALA A 99 -3.899 -0.700 0.926 1.00 0.00 C ATOM 0 H ALA A 99 -2.655 -0.040 3.568 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.143 -1.155 2.598 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -4.262 -1.537 0.330 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -4.464 0.197 0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -2.843 -0.535 0.715 1.00 0.00 H new ATOM 1523 N TYR A 100 -3.988 -3.389 2.520 1.00 0.00 N ATOM 1524 CA TYR A 100 -3.450 -4.697 2.767 1.00 0.00 C ATOM 1525 C TYR A 100 -3.236 -5.358 1.414 1.00 0.00 C ATOM 1526 O TYR A 100 -4.191 -5.527 0.645 1.00 0.00 O ATOM 1527 CB TYR A 100 -4.448 -5.533 3.600 1.00 0.00 C ATOM 1528 CG TYR A 100 -4.917 -4.872 4.892 1.00 0.00 C ATOM 1529 CD1 TYR A 100 -4.206 -5.022 6.075 1.00 0.00 C ATOM 1530 CD2 TYR A 100 -6.076 -4.092 4.919 1.00 0.00 C ATOM 1531 CE1 TYR A 100 -4.634 -4.415 7.246 1.00 0.00 C ATOM 1532 CE2 TYR A 100 -6.507 -3.487 6.081 1.00 0.00 C ATOM 1533 CZ TYR A 100 -5.785 -3.650 7.242 1.00 0.00 C ATOM 1534 OH TYR A 100 -6.203 -3.032 8.403 1.00 0.00 O ATOM 0 H TYR A 100 -4.928 -3.406 2.125 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.515 -4.628 3.323 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.320 -5.752 2.983 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.984 -6.488 3.845 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.307 -5.620 6.083 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -6.646 -3.960 4.011 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -4.070 -4.540 8.158 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -7.406 -2.889 6.080 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.028 -2.532 8.229 1.00 0.00 H new ATOM 1544 N LEU A 101 -2.006 -5.679 1.106 1.00 0.00 N ATOM 1545 CA LEU A 101 -1.663 -6.287 -0.174 1.00 0.00 C ATOM 1546 C LEU A 101 -1.737 -7.805 -0.052 1.00 0.00 C ATOM 1547 O LEU A 101 -1.150 -8.376 0.867 1.00 0.00 O ATOM 1548 CB LEU A 101 -0.247 -5.870 -0.588 1.00 0.00 C ATOM 1549 CG LEU A 101 0.055 -4.360 -0.633 1.00 0.00 C ATOM 1550 CD1 LEU A 101 1.509 -4.120 -1.002 1.00 0.00 C ATOM 1551 CD2 LEU A 101 -0.861 -3.644 -1.614 1.00 0.00 C ATOM 0 H LEU A 101 -1.210 -5.531 1.726 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.369 -5.949 -0.933 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.458 -6.336 0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.048 -6.284 -1.576 1.00 0.00 H new ATOM 0 HG LEU A 101 -0.129 -3.953 0.361 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.705 -3.048 -1.029 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.155 -4.588 -0.259 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.711 -4.551 -1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.624 -2.580 -1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.718 -4.057 -2.613 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.899 -3.782 -1.310 1.00 0.00 H new ATOM 1563 N ASP A 102 -2.441 -8.437 -0.965 1.00 0.00 N ATOM 1564 CA ASP A 102 -2.657 -9.884 -0.932 1.00 0.00 C ATOM 1565 C ASP A 102 -1.892 -10.576 -2.072 1.00 0.00 C ATOM 1566 O ASP A 102 -2.193 -10.370 -3.255 1.00 0.00 O ATOM 1567 CB ASP A 102 -4.160 -10.157 -1.057 1.00 0.00 C ATOM 1568 CG ASP A 102 -4.537 -11.607 -1.028 1.00 0.00 C ATOM 1569 OD1 ASP A 102 -5.016 -12.076 0.030 1.00 0.00 O ATOM 1570 OD2 ASP A 102 -4.426 -12.286 -2.056 1.00 0.00 O ATOM 0 H ASP A 102 -2.884 -7.970 -1.756 1.00 0.00 H new ATOM 0 HA ASP A 102 -2.283 -10.286 0.010 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -4.677 -9.645 -0.246 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -4.518 -9.721 -1.989 1.00 0.00 H new ATOM 1575 N PHE A 103 -0.906 -11.371 -1.718 1.00 0.00 N ATOM 1576 CA PHE A 103 -0.096 -12.086 -2.693 1.00 0.00 C ATOM 1577 C PHE A 103 -0.082 -13.560 -2.373 1.00 0.00 C ATOM 1578 O PHE A 103 -0.015 -13.936 -1.220 1.00 0.00 O ATOM 1579 CB PHE A 103 1.370 -11.603 -2.683 1.00 0.00 C ATOM 1580 CG PHE A 103 1.617 -10.186 -3.105 1.00 0.00 C ATOM 1581 CD1 PHE A 103 1.845 -9.878 -4.435 1.00 0.00 C ATOM 1582 CD2 PHE A 103 1.653 -9.165 -2.172 1.00 0.00 C ATOM 1583 CE1 PHE A 103 2.104 -8.581 -4.825 1.00 0.00 C ATOM 1584 CE2 PHE A 103 1.907 -7.867 -2.559 1.00 0.00 C ATOM 1585 CZ PHE A 103 2.132 -7.574 -3.886 1.00 0.00 C ATOM 0 H PHE A 103 -0.640 -11.543 -0.749 1.00 0.00 H new ATOM 0 HA PHE A 103 -0.539 -11.896 -3.671 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.763 -11.731 -1.674 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.948 -12.258 -3.335 1.00 0.00 H new ATOM 0 HD1 PHE A 103 1.820 -10.663 -5.176 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.480 -9.388 -1.129 1.00 0.00 H new ATOM 0 HE1 PHE A 103 2.285 -8.355 -5.866 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.930 -7.079 -1.821 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.330 -6.557 -4.189 1.00 0.00 H new ATOM 1595 N ILE A 104 -0.171 -14.383 -3.369 1.00 0.00 N ATOM 1596 CA ILE A 104 0.028 -15.798 -3.184 1.00 0.00 C ATOM 1597 C ILE A 104 1.475 -16.083 -3.501 1.00 0.00 C ATOM 1598 O ILE A 104 1.980 -15.644 -4.547 1.00 0.00 O ATOM 1599 CB ILE A 104 -0.869 -16.672 -4.114 1.00 0.00 C ATOM 1600 CG1 ILE A 104 -2.347 -16.405 -3.847 1.00 0.00 C ATOM 1601 CG2 ILE A 104 -0.561 -18.171 -3.924 1.00 0.00 C ATOM 1602 CD1 ILE A 104 -3.271 -17.188 -4.750 1.00 0.00 C ATOM 0 H ILE A 104 -0.381 -14.104 -4.327 1.00 0.00 H new ATOM 0 HA ILE A 104 -0.242 -16.053 -2.159 1.00 0.00 H new ATOM 0 HB ILE A 104 -0.645 -16.399 -5.145 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.571 -16.651 -2.809 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.545 -15.340 -3.972 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.199 -18.760 -4.583 1.00 0.00 H new ATOM 0 HG22 ILE A 104 0.485 -18.361 -4.166 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.751 -18.453 -2.888 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.306 -16.950 -4.506 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.074 -16.925 -5.789 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -3.101 -18.255 -4.608 1.00 0.00 H new ATOM 1614 N ILE A 105 2.148 -16.738 -2.607 1.00 0.00 N ATOM 1615 CA ILE A 105 3.505 -17.123 -2.845 1.00 0.00 C ATOM 1616 C ILE A 105 3.462 -18.370 -3.697 1.00 0.00 C ATOM 1617 O ILE A 105 2.824 -19.350 -3.316 1.00 0.00 O ATOM 1618 CB ILE A 105 4.246 -17.411 -1.518 1.00 0.00 C ATOM 1619 CG1 ILE A 105 4.114 -16.197 -0.583 1.00 0.00 C ATOM 1620 CG2 ILE A 105 5.721 -17.735 -1.789 1.00 0.00 C ATOM 1621 CD1 ILE A 105 4.776 -16.361 0.763 1.00 0.00 C ATOM 0 H ILE A 105 1.777 -17.019 -1.699 1.00 0.00 H new ATOM 0 HA ILE A 105 4.045 -16.318 -3.344 1.00 0.00 H new ATOM 0 HB ILE A 105 3.796 -18.278 -1.034 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.542 -15.326 -1.079 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.055 -15.988 -0.429 1.00 0.00 H new ATOM 0 HG21 ILE A 105 6.229 -17.935 -0.846 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.789 -18.613 -2.431 1.00 0.00 H new ATOM 0 HG23 ILE A 105 6.195 -16.887 -2.283 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.631 -15.456 1.353 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.333 -17.209 1.285 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.843 -16.536 0.625 1.00 0.00 H new ATOM 1633 N ASN A 106 4.083 -18.317 -4.853 1.00 0.00 N ATOM 1634 CA ASN A 106 4.063 -19.430 -5.800 1.00 0.00 C ATOM 1635 C ASN A 106 4.727 -20.659 -5.161 1.00 0.00 C ATOM 1636 O ASN A 106 5.734 -20.538 -4.472 1.00 0.00 O ATOM 1637 CB ASN A 106 4.813 -19.030 -7.094 1.00 0.00 C ATOM 1638 CG ASN A 106 4.582 -19.965 -8.289 1.00 0.00 C ATOM 1639 OD1 ASN A 106 4.279 -21.145 -8.142 1.00 0.00 O ATOM 1640 ND2 ASN A 106 4.765 -19.451 -9.476 1.00 0.00 N ATOM 0 H ASN A 106 4.617 -17.508 -5.171 1.00 0.00 H new ATOM 0 HA ASN A 106 3.031 -19.674 -6.053 1.00 0.00 H new ATOM 0 HB2 ASN A 106 4.509 -18.022 -7.376 1.00 0.00 H new ATOM 0 HB3 ASN A 106 5.881 -18.993 -6.881 1.00 0.00 H new ATOM 0 HD21 ASN A 106 4.656 -20.033 -10.306 1.00 0.00 H new ATOM 0 HD22 ASN A 106 5.016 -18.467 -9.573 1.00 0.00 H new ATOM 1647 N SER A 107 4.164 -21.824 -5.383 1.00 0.00 N ATOM 1648 CA SER A 107 4.707 -23.060 -4.845 1.00 0.00 C ATOM 1649 C SER A 107 5.992 -23.459 -5.589 1.00 0.00 C ATOM 1650 O SER A 107 6.803 -24.237 -5.091 1.00 0.00 O ATOM 1651 CB SER A 107 3.656 -24.155 -4.936 1.00 0.00 C ATOM 1652 OG SER A 107 2.462 -23.742 -4.274 1.00 0.00 O ATOM 0 H SER A 107 3.318 -21.947 -5.940 1.00 0.00 H new ATOM 0 HA SER A 107 4.970 -22.912 -3.798 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.443 -24.380 -5.981 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.034 -25.072 -4.483 1.00 0.00 H new ATOM 0 HG SER A 107 1.790 -24.452 -4.339 1.00 0.00 H new ATOM 1658 N ASN A 108 6.170 -22.877 -6.766 1.00 0.00 N ATOM 1659 CA ASN A 108 7.338 -23.109 -7.600 1.00 0.00 C ATOM 1660 C ASN A 108 8.442 -22.081 -7.252 1.00 0.00 C ATOM 1661 O ASN A 108 9.541 -22.106 -7.800 1.00 0.00 O ATOM 1662 CB ASN A 108 6.918 -23.000 -9.089 1.00 0.00 C ATOM 1663 CG ASN A 108 8.001 -23.395 -10.084 1.00 0.00 C ATOM 1664 OD1 ASN A 108 8.796 -22.562 -10.541 1.00 0.00 O ATOM 1665 ND2 ASN A 108 8.024 -24.645 -10.449 1.00 0.00 N ATOM 0 H ASN A 108 5.500 -22.224 -7.172 1.00 0.00 H new ATOM 0 HA ASN A 108 7.741 -24.106 -7.420 1.00 0.00 H new ATOM 0 HB2 ASN A 108 6.044 -23.631 -9.254 1.00 0.00 H new ATOM 0 HB3 ASN A 108 6.613 -21.974 -9.293 1.00 0.00 H new ATOM 0 HD21 ASN A 108 8.712 -24.964 -11.131 1.00 0.00 H new ATOM 0 HD22 ASN A 108 7.354 -25.304 -10.052 1.00 0.00 H new ATOM 1672 N ALA A 109 8.150 -21.202 -6.306 1.00 0.00 N ATOM 1673 CA ALA A 109 9.084 -20.167 -5.903 1.00 0.00 C ATOM 1674 C ALA A 109 10.064 -20.703 -4.879 1.00 0.00 C ATOM 1675 O ALA A 109 9.768 -21.664 -4.161 1.00 0.00 O ATOM 1676 CB ALA A 109 8.346 -18.975 -5.330 1.00 0.00 C ATOM 0 H ALA A 109 7.264 -21.187 -5.800 1.00 0.00 H new ATOM 0 HA ALA A 109 9.636 -19.848 -6.787 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.064 -18.210 -5.034 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.672 -18.568 -6.084 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.770 -19.288 -4.459 1.00 0.00 H new ATOM 1682 N THR A 110 11.220 -20.100 -4.833 1.00 0.00 N ATOM 1683 CA THR A 110 12.253 -20.476 -3.912 1.00 0.00 C ATOM 1684 C THR A 110 12.031 -19.721 -2.585 1.00 0.00 C ATOM 1685 O THR A 110 11.444 -18.623 -2.579 1.00 0.00 O ATOM 1686 CB THR A 110 13.611 -20.079 -4.507 1.00 0.00 C ATOM 1687 OG1 THR A 110 13.565 -20.278 -5.935 1.00 0.00 O ATOM 1688 CG2 THR A 110 14.724 -20.944 -3.937 1.00 0.00 C ATOM 0 H THR A 110 11.473 -19.323 -5.443 1.00 0.00 H new ATOM 0 HA THR A 110 12.231 -21.551 -3.731 1.00 0.00 H new ATOM 0 HB THR A 110 13.810 -19.036 -4.261 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.427 -20.026 -6.328 1.00 0.00 H new ATOM 0 HG21 THR A 110 15.677 -20.645 -4.373 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.765 -20.818 -2.855 1.00 0.00 H new ATOM 0 HG23 THR A 110 14.529 -21.990 -4.174 1.00 0.00 H new ATOM 1696 N ALA A 111 12.485 -20.296 -1.490 1.00 0.00 N ATOM 1697 CA ALA A 111 12.323 -19.694 -0.188 1.00 0.00 C ATOM 1698 C ALA A 111 13.404 -18.646 0.050 1.00 0.00 C ATOM 1699 O ALA A 111 14.458 -18.663 -0.607 1.00 0.00 O ATOM 1700 CB ALA A 111 12.327 -20.755 0.902 1.00 0.00 C ATOM 0 H ALA A 111 12.975 -21.191 -1.480 1.00 0.00 H new ATOM 0 HA ALA A 111 11.356 -19.193 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 111 12.204 -20.278 1.874 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.507 -21.453 0.733 1.00 0.00 H new ATOM 0 HB3 ALA A 111 13.273 -21.295 0.880 1.00 0.00 H new ATOM 1706 N GLY A 112 13.149 -17.746 0.954 1.00 0.00 N ATOM 1707 CA GLY A 112 14.068 -16.687 1.235 1.00 0.00 C ATOM 1708 C GLY A 112 13.361 -15.363 1.353 1.00 0.00 C ATOM 1709 O GLY A 112 12.163 -15.253 1.027 1.00 0.00 O ATOM 0 H GLY A 112 12.298 -17.727 1.516 1.00 0.00 H new ATOM 0 HA2 GLY A 112 14.600 -16.901 2.162 1.00 0.00 H new ATOM 0 HA3 GLY A 112 14.816 -16.633 0.444 1.00 0.00 H new ATOM 1713 N ASP A 113 14.070 -14.364 1.813 1.00 0.00 N ATOM 1714 CA ASP A 113 13.531 -13.049 1.989 1.00 0.00 C ATOM 1715 C ASP A 113 13.469 -12.325 0.646 1.00 0.00 C ATOM 1716 O ASP A 113 14.473 -12.142 -0.033 1.00 0.00 O ATOM 1717 CB ASP A 113 14.341 -12.272 3.053 1.00 0.00 C ATOM 1718 CG ASP A 113 15.783 -11.949 2.669 1.00 0.00 C ATOM 1719 OD1 ASP A 113 16.599 -12.885 2.528 1.00 0.00 O ATOM 1720 OD2 ASP A 113 16.133 -10.758 2.545 1.00 0.00 O ATOM 0 H ASP A 113 15.051 -14.447 2.078 1.00 0.00 H new ATOM 0 HA ASP A 113 12.509 -13.118 2.363 1.00 0.00 H new ATOM 0 HB2 ASP A 113 13.822 -11.338 3.270 1.00 0.00 H new ATOM 0 HB3 ASP A 113 14.350 -12.853 3.975 1.00 0.00 H new ATOM 1725 N SER A 114 12.275 -11.988 0.240 1.00 0.00 N ATOM 1726 CA SER A 114 12.046 -11.358 -1.037 1.00 0.00 C ATOM 1727 C SER A 114 11.360 -10.017 -0.812 1.00 0.00 C ATOM 1728 O SER A 114 10.334 -9.945 -0.122 1.00 0.00 O ATOM 1729 CB SER A 114 11.167 -12.273 -1.862 1.00 0.00 C ATOM 1730 OG SER A 114 11.655 -13.612 -1.808 1.00 0.00 O ATOM 0 H SER A 114 11.428 -12.142 0.787 1.00 0.00 H new ATOM 0 HA SER A 114 12.985 -11.185 -1.562 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.143 -12.237 -1.490 1.00 0.00 H new ATOM 0 HB3 SER A 114 11.143 -11.929 -2.896 1.00 0.00 H new ATOM 0 HG SER A 114 10.938 -14.232 -2.057 1.00 0.00 H new ATOM 1736 N ALA A 115 11.919 -8.973 -1.361 1.00 0.00 N ATOM 1737 CA ALA A 115 11.419 -7.640 -1.136 1.00 0.00 C ATOM 1738 C ALA A 115 10.415 -7.199 -2.194 1.00 0.00 C ATOM 1739 O ALA A 115 10.425 -7.678 -3.341 1.00 0.00 O ATOM 1740 CB ALA A 115 12.573 -6.657 -1.065 1.00 0.00 C ATOM 0 H ALA A 115 12.732 -9.020 -1.976 1.00 0.00 H new ATOM 0 HA ALA A 115 10.888 -7.655 -0.184 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.185 -5.653 -0.895 1.00 0.00 H new ATOM 0 HB2 ALA A 115 13.237 -6.934 -0.246 1.00 0.00 H new ATOM 0 HB3 ALA A 115 13.127 -6.678 -2.003 1.00 0.00 H new ATOM 1746 N LEU A 116 9.547 -6.315 -1.790 1.00 0.00 N ATOM 1747 CA LEU A 116 8.591 -5.682 -2.651 1.00 0.00 C ATOM 1748 C LEU A 116 9.025 -4.247 -2.759 1.00 0.00 C ATOM 1749 O LEU A 116 9.000 -3.502 -1.766 1.00 0.00 O ATOM 1750 CB LEU A 116 7.183 -5.736 -2.048 1.00 0.00 C ATOM 1751 CG LEU A 116 6.630 -7.115 -1.681 1.00 0.00 C ATOM 1752 CD1 LEU A 116 5.237 -6.970 -1.122 1.00 0.00 C ATOM 1753 CD2 LEU A 116 6.622 -8.052 -2.880 1.00 0.00 C ATOM 0 H LEU A 116 9.484 -6.006 -0.820 1.00 0.00 H new ATOM 0 HA LEU A 116 8.552 -6.183 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU A 116 7.177 -5.120 -1.149 1.00 0.00 H new ATOM 0 HB3 LEU A 116 6.495 -5.274 -2.756 1.00 0.00 H new ATOM 0 HG LEU A 116 7.282 -7.553 -0.926 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.845 -7.953 -0.861 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.266 -6.343 -0.231 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.591 -6.509 -1.869 1.00 0.00 H new ATOM 0 HD21 LEU A 116 6.223 -9.021 -2.582 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.998 -7.630 -3.668 1.00 0.00 H new ATOM 0 HD23 LEU A 116 7.639 -8.177 -3.251 1.00 0.00 H new ATOM 1765 N THR A 117 9.426 -3.859 -3.910 1.00 0.00 N ATOM 1766 CA THR A 117 9.985 -2.564 -4.098 1.00 0.00 C ATOM 1767 C THR A 117 8.915 -1.588 -4.549 1.00 0.00 C ATOM 1768 O THR A 117 8.430 -1.666 -5.668 1.00 0.00 O ATOM 1769 CB THR A 117 11.131 -2.622 -5.135 1.00 0.00 C ATOM 1770 OG1 THR A 117 12.032 -3.692 -4.776 1.00 0.00 O ATOM 1771 CG2 THR A 117 11.911 -1.308 -5.161 1.00 0.00 C ATOM 0 H THR A 117 9.378 -4.428 -4.755 1.00 0.00 H new ATOM 0 HA THR A 117 10.391 -2.218 -3.148 1.00 0.00 H new ATOM 0 HB THR A 117 10.701 -2.793 -6.122 1.00 0.00 H new ATOM 0 HG1 THR A 117 12.762 -3.738 -5.429 1.00 0.00 H new ATOM 0 HG21 THR A 117 12.711 -1.374 -5.898 1.00 0.00 H new ATOM 0 HG22 THR A 117 11.240 -0.492 -5.427 1.00 0.00 H new ATOM 0 HG23 THR A 117 12.339 -1.120 -4.177 1.00 0.00 H new ATOM 1779 N VAL A 118 8.513 -0.714 -3.673 1.00 0.00 N ATOM 1780 CA VAL A 118 7.574 0.302 -4.043 1.00 0.00 C ATOM 1781 C VAL A 118 8.402 1.418 -4.635 1.00 0.00 C ATOM 1782 O VAL A 118 9.346 1.876 -4.001 1.00 0.00 O ATOM 1783 CB VAL A 118 6.751 0.814 -2.830 1.00 0.00 C ATOM 1784 CG1 VAL A 118 5.663 1.794 -3.268 1.00 0.00 C ATOM 1785 CG2 VAL A 118 6.146 -0.351 -2.051 1.00 0.00 C ATOM 0 H VAL A 118 8.820 -0.685 -2.701 1.00 0.00 H new ATOM 0 HA VAL A 118 6.840 -0.089 -4.748 1.00 0.00 H new ATOM 0 HB VAL A 118 7.435 1.348 -2.171 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.106 2.133 -2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 118 6.122 2.651 -3.761 1.00 0.00 H new ATOM 0 HG13 VAL A 118 4.984 1.298 -3.961 1.00 0.00 H new ATOM 0 HG21 VAL A 118 5.574 0.034 -1.206 1.00 0.00 H new ATOM 0 HG22 VAL A 118 5.487 -0.923 -2.705 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.944 -0.997 -1.685 1.00 0.00 H new ATOM 1795 N ASP A 119 8.094 1.789 -5.851 1.00 0.00 N ATOM 1796 CA ASP A 119 8.884 2.763 -6.586 1.00 0.00 C ATOM 1797 C ASP A 119 8.721 4.158 -5.992 1.00 0.00 C ATOM 1798 O ASP A 119 7.635 4.729 -6.055 1.00 0.00 O ATOM 1799 CB ASP A 119 8.490 2.773 -8.054 1.00 0.00 C ATOM 1800 CG ASP A 119 9.403 3.642 -8.876 1.00 0.00 C ATOM 1801 OD1 ASP A 119 10.443 3.130 -9.347 1.00 0.00 O ATOM 1802 OD2 ASP A 119 9.102 4.841 -9.080 1.00 0.00 O ATOM 0 H ASP A 119 7.290 1.429 -6.366 1.00 0.00 H new ATOM 0 HA ASP A 119 9.932 2.474 -6.505 1.00 0.00 H new ATOM 0 HB2 ASP A 119 8.512 1.755 -8.442 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.465 3.130 -8.152 1.00 0.00 H new ATOM 1807 N PRO A 120 9.805 4.729 -5.406 1.00 0.00 N ATOM 1808 CA PRO A 120 9.753 6.036 -4.744 1.00 0.00 C ATOM 1809 C PRO A 120 9.523 7.200 -5.706 1.00 0.00 C ATOM 1810 O PRO A 120 8.957 8.220 -5.320 1.00 0.00 O ATOM 1811 CB PRO A 120 11.132 6.178 -4.074 1.00 0.00 C ATOM 1812 CG PRO A 120 11.732 4.817 -4.109 1.00 0.00 C ATOM 1813 CD PRO A 120 11.155 4.141 -5.313 1.00 0.00 C ATOM 0 HA PRO A 120 8.914 6.076 -4.049 1.00 0.00 H new ATOM 0 HB2 PRO A 120 11.755 6.896 -4.607 1.00 0.00 H new ATOM 0 HB3 PRO A 120 11.036 6.538 -3.050 1.00 0.00 H new ATOM 0 HG2 PRO A 120 12.819 4.872 -4.176 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.496 4.263 -3.200 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.744 4.339 -6.208 1.00 0.00 H new ATOM 0 HD3 PRO A 120 11.117 3.059 -5.189 1.00 0.00 H new ATOM 1821 N ALA A 121 9.925 7.038 -6.960 1.00 0.00 N ATOM 1822 CA ALA A 121 9.809 8.113 -7.939 1.00 0.00 C ATOM 1823 C ALA A 121 8.358 8.326 -8.336 1.00 0.00 C ATOM 1824 O ALA A 121 7.899 9.461 -8.486 1.00 0.00 O ATOM 1825 CB ALA A 121 10.666 7.826 -9.163 1.00 0.00 C ATOM 0 H ALA A 121 10.333 6.176 -7.323 1.00 0.00 H new ATOM 0 HA ALA A 121 10.174 9.031 -7.478 1.00 0.00 H new ATOM 0 HB1 ALA A 121 10.563 8.642 -9.879 1.00 0.00 H new ATOM 0 HB2 ALA A 121 11.710 7.736 -8.863 1.00 0.00 H new ATOM 0 HB3 ALA A 121 10.340 6.894 -9.625 1.00 0.00 H new ATOM 1831 N THR A 122 7.628 7.247 -8.455 1.00 0.00 N ATOM 1832 CA THR A 122 6.226 7.312 -8.811 1.00 0.00 C ATOM 1833 C THR A 122 5.324 7.238 -7.566 1.00 0.00 C ATOM 1834 O THR A 122 4.109 7.016 -7.660 1.00 0.00 O ATOM 1835 CB THR A 122 5.862 6.221 -9.849 1.00 0.00 C ATOM 1836 OG1 THR A 122 6.408 4.952 -9.455 1.00 0.00 O ATOM 1837 CG2 THR A 122 6.387 6.592 -11.231 1.00 0.00 C ATOM 0 H THR A 122 7.982 6.302 -8.310 1.00 0.00 H new ATOM 0 HA THR A 122 6.047 8.280 -9.278 1.00 0.00 H new ATOM 0 HB THR A 122 4.775 6.148 -9.892 1.00 0.00 H new ATOM 0 HG1 THR A 122 7.387 4.992 -9.491 1.00 0.00 H new ATOM 0 HG21 THR A 122 6.120 5.812 -11.943 1.00 0.00 H new ATOM 0 HG22 THR A 122 5.946 7.538 -11.546 1.00 0.00 H new ATOM 0 HG23 THR A 122 7.472 6.693 -11.193 1.00 0.00 H new ATOM 1845 N LEU A 123 5.922 7.476 -6.414 1.00 0.00 N ATOM 1846 CA LEU A 123 5.221 7.476 -5.164 1.00 0.00 C ATOM 1847 C LEU A 123 5.014 8.941 -4.771 1.00 0.00 C ATOM 1848 O LEU A 123 5.976 9.681 -4.532 1.00 0.00 O ATOM 1849 CB LEU A 123 6.057 6.709 -4.117 1.00 0.00 C ATOM 1850 CG LEU A 123 5.353 6.126 -2.879 1.00 0.00 C ATOM 1851 CD1 LEU A 123 6.352 5.345 -2.053 1.00 0.00 C ATOM 1852 CD2 LEU A 123 4.708 7.188 -2.019 1.00 0.00 C ATOM 0 H LEU A 123 6.919 7.676 -6.329 1.00 0.00 H new ATOM 0 HA LEU A 123 4.253 6.979 -5.232 1.00 0.00 H new ATOM 0 HB2 LEU A 123 6.553 5.886 -4.631 1.00 0.00 H new ATOM 0 HB3 LEU A 123 6.839 7.381 -3.764 1.00 0.00 H new ATOM 0 HG LEU A 123 4.556 5.474 -3.237 1.00 0.00 H new ATOM 0 HD11 LEU A 123 5.855 4.932 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 123 6.764 4.533 -2.653 1.00 0.00 H new ATOM 0 HD13 LEU A 123 7.158 6.007 -1.735 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.227 6.719 -1.161 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.469 7.886 -1.671 1.00 0.00 H new ATOM 0 HD23 LEU A 123 3.962 7.726 -2.604 1.00 0.00 H new ATOM 1864 N ILE A 124 3.775 9.344 -4.727 1.00 0.00 N ATOM 1865 CA ILE A 124 3.375 10.712 -4.456 1.00 0.00 C ATOM 1866 C ILE A 124 2.245 10.677 -3.424 1.00 0.00 C ATOM 1867 O ILE A 124 1.278 9.979 -3.613 1.00 0.00 O ATOM 1868 CB ILE A 124 2.861 11.397 -5.774 1.00 0.00 C ATOM 1869 CG1 ILE A 124 3.979 11.428 -6.840 1.00 0.00 C ATOM 1870 CG2 ILE A 124 2.350 12.816 -5.495 1.00 0.00 C ATOM 1871 CD1 ILE A 124 3.536 11.939 -8.196 1.00 0.00 C ATOM 0 H ILE A 124 2.986 8.717 -4.882 1.00 0.00 H new ATOM 0 HA ILE A 124 4.224 11.282 -4.078 1.00 0.00 H new ATOM 0 HB ILE A 124 2.029 10.806 -6.157 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.793 12.055 -6.477 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.380 10.421 -6.958 1.00 0.00 H new ATOM 0 HG21 ILE A 124 2.001 13.266 -6.424 1.00 0.00 H new ATOM 0 HG22 ILE A 124 1.528 12.773 -4.781 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.158 13.419 -5.081 1.00 0.00 H new ATOM 0 HD11 ILE A 124 4.382 11.927 -8.883 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.744 11.299 -8.585 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.163 12.958 -8.097 1.00 0.00 H new ATOM 1883 N VAL A 125 2.387 11.387 -2.340 1.00 0.00 N ATOM 1884 CA VAL A 125 1.373 11.413 -1.291 1.00 0.00 C ATOM 1885 C VAL A 125 1.150 12.855 -0.878 1.00 0.00 C ATOM 1886 O VAL A 125 1.976 13.467 -0.173 1.00 0.00 O ATOM 1887 CB VAL A 125 1.738 10.524 -0.051 1.00 0.00 C ATOM 1888 CG1 VAL A 125 0.694 10.644 1.052 1.00 0.00 C ATOM 1889 CG2 VAL A 125 1.894 9.059 -0.441 1.00 0.00 C ATOM 0 H VAL A 125 3.203 11.968 -2.147 1.00 0.00 H new ATOM 0 HA VAL A 125 0.457 10.983 -1.695 1.00 0.00 H new ATOM 0 HB VAL A 125 2.692 10.893 0.326 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.981 10.014 1.894 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.629 11.681 1.380 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.276 10.322 0.672 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.147 8.472 0.442 1.00 0.00 H new ATOM 0 HG22 VAL A 125 0.958 8.693 -0.864 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.689 8.962 -1.181 1.00 0.00 H new ATOM 1899 N ALA A 126 0.053 13.388 -1.323 1.00 0.00 N ATOM 1900 CA ALA A 126 -0.253 14.766 -1.160 1.00 0.00 C ATOM 1901 C ALA A 126 -1.473 15.000 -0.299 1.00 0.00 C ATOM 1902 O ALA A 126 -2.459 14.234 -0.329 1.00 0.00 O ATOM 1903 CB ALA A 126 -0.435 15.417 -2.518 1.00 0.00 C ATOM 0 H ALA A 126 -0.666 12.861 -1.819 1.00 0.00 H new ATOM 0 HA ALA A 126 0.589 15.222 -0.639 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -0.669 16.473 -2.387 1.00 0.00 H new ATOM 0 HB2 ALA A 126 0.485 15.318 -3.095 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -1.251 14.928 -3.050 1.00 0.00 H new ATOM 1909 N ASP A 127 -1.382 16.069 0.458 1.00 0.00 N ATOM 1910 CA ASP A 127 -2.451 16.619 1.301 1.00 0.00 C ATOM 1911 C ASP A 127 -3.639 17.076 0.423 1.00 0.00 C ATOM 1912 O ASP A 127 -3.536 17.057 -0.802 1.00 0.00 O ATOM 1913 CB ASP A 127 -1.823 17.796 2.091 1.00 0.00 C ATOM 1914 CG ASP A 127 -2.773 18.743 2.763 1.00 0.00 C ATOM 1915 OD1 ASP A 127 -3.502 18.338 3.625 1.00 0.00 O ATOM 1916 OD2 ASP A 127 -2.759 19.931 2.419 1.00 0.00 O ATOM 0 H ASP A 127 -0.523 16.615 0.515 1.00 0.00 H new ATOM 0 HA ASP A 127 -2.850 15.876 1.992 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -1.163 17.380 2.852 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -1.199 18.370 1.406 1.00 0.00 H new ATOM 1921 N GLU A 128 -4.747 17.480 1.029 1.00 0.00 N ATOM 1922 CA GLU A 128 -5.915 17.956 0.268 1.00 0.00 C ATOM 1923 C GLU A 128 -5.599 19.233 -0.524 1.00 0.00 C ATOM 1924 O GLU A 128 -6.243 19.537 -1.527 1.00 0.00 O ATOM 1925 CB GLU A 128 -7.202 18.081 1.139 1.00 0.00 C ATOM 1926 CG GLU A 128 -7.142 18.994 2.376 1.00 0.00 C ATOM 1927 CD GLU A 128 -7.036 20.489 2.079 1.00 0.00 C ATOM 1928 OE1 GLU A 128 -7.918 21.037 1.407 1.00 0.00 O ATOM 1929 OE2 GLU A 128 -6.097 21.154 2.565 1.00 0.00 O ATOM 0 H GLU A 128 -4.871 17.491 2.041 1.00 0.00 H new ATOM 0 HA GLU A 128 -6.142 17.183 -0.466 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -8.008 18.438 0.498 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.479 17.081 1.473 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.034 18.822 2.978 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.286 18.699 2.984 1.00 0.00 H new ATOM 1936 N ASN A 129 -4.565 19.948 -0.082 1.00 0.00 N ATOM 1937 CA ASN A 129 -4.072 21.145 -0.759 1.00 0.00 C ATOM 1938 C ASN A 129 -3.129 20.739 -1.922 1.00 0.00 C ATOM 1939 O ASN A 129 -2.552 21.586 -2.603 1.00 0.00 O ATOM 1940 CB ASN A 129 -3.359 22.047 0.273 1.00 0.00 C ATOM 1941 CG ASN A 129 -2.903 23.403 -0.244 1.00 0.00 C ATOM 1942 OD1 ASN A 129 -1.644 23.509 -0.596 1.00 0.00 O flip ATOM 1943 ND2 ASN A 129 -3.665 24.361 -0.252 1.00 0.00 N flip ATOM 0 H ASN A 129 -4.043 19.711 0.762 1.00 0.00 H new ATOM 0 HA ASN A 129 -4.900 21.707 -1.191 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -4.032 22.207 1.116 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -2.489 21.513 0.656 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -4.638 24.241 0.028 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -3.327 25.279 -0.539 1.00 0.00 H new ATOM 1950 N ASP A 130 -2.984 19.418 -2.123 1.00 0.00 N ATOM 1951 CA ASP A 130 -2.213 18.807 -3.229 1.00 0.00 C ATOM 1952 C ASP A 130 -0.694 19.057 -3.072 1.00 0.00 C ATOM 1953 O ASP A 130 0.073 19.152 -4.023 1.00 0.00 O ATOM 1954 CB ASP A 130 -2.805 19.267 -4.587 1.00 0.00 C ATOM 1955 CG ASP A 130 -2.124 18.736 -5.827 1.00 0.00 C ATOM 1956 OD1 ASP A 130 -2.113 17.504 -6.057 1.00 0.00 O ATOM 1957 OD2 ASP A 130 -1.628 19.562 -6.623 1.00 0.00 O ATOM 0 H ASP A 130 -3.409 18.725 -1.507 1.00 0.00 H new ATOM 0 HA ASP A 130 -2.312 17.722 -3.196 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -3.854 18.973 -4.620 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -2.778 20.356 -4.621 1.00 0.00 H new ATOM 1962 N LYS A 131 -0.259 19.116 -1.841 1.00 0.00 N ATOM 1963 CA LYS A 131 1.155 19.234 -1.563 1.00 0.00 C ATOM 1964 C LYS A 131 1.685 17.963 -0.950 1.00 0.00 C ATOM 1965 O LYS A 131 1.155 17.485 0.064 1.00 0.00 O ATOM 1966 CB LYS A 131 1.489 20.464 -0.717 1.00 0.00 C ATOM 1967 CG LYS A 131 1.309 21.794 -1.448 1.00 0.00 C ATOM 1968 CD LYS A 131 2.190 21.875 -2.699 1.00 0.00 C ATOM 1969 CE LYS A 131 2.069 23.223 -3.370 1.00 0.00 C ATOM 1970 NZ LYS A 131 2.867 23.309 -4.619 1.00 0.00 N ATOM 0 H LYS A 131 -0.857 19.085 -1.016 1.00 0.00 H new ATOM 0 HA LYS A 131 1.662 19.384 -2.516 1.00 0.00 H new ATOM 0 HB2 LYS A 131 0.858 20.462 0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 131 2.521 20.387 -0.375 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.263 21.916 -1.730 1.00 0.00 H new ATOM 0 HG3 LYS A 131 1.555 22.616 -0.775 1.00 0.00 H new ATOM 0 HD2 LYS A 131 3.230 21.694 -2.426 1.00 0.00 H new ATOM 0 HD3 LYS A 131 1.903 21.091 -3.400 1.00 0.00 H new ATOM 0 HE2 LYS A 131 1.021 23.419 -3.598 1.00 0.00 H new ATOM 0 HE3 LYS A 131 2.396 24.000 -2.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 2.751 24.252 -5.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 3.871 23.149 -4.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 2.539 22.586 -5.291 1.00 0.00 H new ATOM 1984 N ASP A 132 2.679 17.396 -1.608 1.00 0.00 N ATOM 1985 CA ASP A 132 3.322 16.153 -1.190 1.00 0.00 C ATOM 1986 C ASP A 132 4.080 16.368 0.105 1.00 0.00 C ATOM 1987 O ASP A 132 4.954 17.243 0.199 1.00 0.00 O ATOM 1988 CB ASP A 132 4.257 15.647 -2.292 1.00 0.00 C ATOM 1989 CG ASP A 132 4.895 14.313 -1.978 1.00 0.00 C ATOM 1990 OD1 ASP A 132 5.980 14.281 -1.367 1.00 0.00 O ATOM 1991 OD2 ASP A 132 4.355 13.268 -2.378 1.00 0.00 O ATOM 0 H ASP A 132 3.073 17.789 -2.463 1.00 0.00 H new ATOM 0 HA ASP A 132 2.556 15.397 -1.017 1.00 0.00 H new ATOM 0 HB2 ASP A 132 3.696 15.562 -3.223 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.041 16.385 -2.459 1.00 0.00 H new ATOM 1996 N ILE A 133 3.733 15.601 1.102 1.00 0.00 N ATOM 1997 CA ILE A 133 4.286 15.768 2.440 1.00 0.00 C ATOM 1998 C ILE A 133 4.686 14.442 3.061 1.00 0.00 C ATOM 1999 O ILE A 133 4.714 14.326 4.267 1.00 0.00 O ATOM 2000 CB ILE A 133 3.261 16.462 3.405 1.00 0.00 C ATOM 2001 CG1 ILE A 133 1.860 15.796 3.324 1.00 0.00 C ATOM 2002 CG2 ILE A 133 3.189 17.970 3.202 1.00 0.00 C ATOM 2003 CD1 ILE A 133 0.813 16.411 4.244 1.00 0.00 C ATOM 0 H ILE A 133 3.060 14.839 1.021 1.00 0.00 H new ATOM 0 HA ILE A 133 5.169 16.395 2.318 1.00 0.00 H new ATOM 0 HB ILE A 133 3.636 16.311 4.417 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.502 15.856 2.296 1.00 0.00 H new ATOM 0 HG13 ILE A 133 1.960 14.738 3.565 1.00 0.00 H new ATOM 0 HG21 ILE A 133 2.465 18.396 3.896 1.00 0.00 H new ATOM 0 HG22 ILE A 133 4.170 18.409 3.386 1.00 0.00 H new ATOM 0 HG23 ILE A 133 2.881 18.185 2.179 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -0.133 15.884 4.122 1.00 0.00 H new ATOM 0 HD12 ILE A 133 1.144 16.327 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 133 0.678 17.463 3.990 1.00 0.00 H new ATOM 2015 N LYS A 134 5.058 13.459 2.279 1.00 0.00 N ATOM 2016 CA LYS A 134 5.322 12.174 2.903 1.00 0.00 C ATOM 2017 C LYS A 134 6.806 11.828 3.007 1.00 0.00 C ATOM 2018 O LYS A 134 7.599 12.062 2.092 1.00 0.00 O ATOM 2019 CB LYS A 134 4.513 11.005 2.268 1.00 0.00 C ATOM 2020 CG LYS A 134 5.128 10.302 1.040 1.00 0.00 C ATOM 2021 CD LYS A 134 5.439 11.248 -0.084 1.00 0.00 C ATOM 2022 CE LYS A 134 5.965 10.524 -1.305 1.00 0.00 C ATOM 2023 NZ LYS A 134 6.361 11.466 -2.370 1.00 0.00 N ATOM 0 H LYS A 134 5.181 13.507 1.268 1.00 0.00 H new ATOM 0 HA LYS A 134 4.963 12.297 3.925 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.347 10.253 3.039 1.00 0.00 H new ATOM 0 HB3 LYS A 134 3.534 11.389 1.981 1.00 0.00 H new ATOM 0 HG2 LYS A 134 6.043 9.791 1.341 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.438 9.537 0.683 1.00 0.00 H new ATOM 0 HD2 LYS A 134 4.539 11.802 -0.351 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.176 11.978 0.250 1.00 0.00 H new ATOM 0 HE2 LYS A 134 6.822 9.912 -1.024 1.00 0.00 H new ATOM 0 HE3 LYS A 134 5.200 9.847 -1.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 6.587 10.936 -3.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 5.578 12.123 -2.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 7.197 12.003 -2.065 1.00 0.00 H new ATOM 2037 N ASP A 135 7.155 11.311 4.132 1.00 0.00 N ATOM 2038 CA ASP A 135 8.448 10.750 4.378 1.00 0.00 C ATOM 2039 C ASP A 135 8.280 9.281 4.114 1.00 0.00 C ATOM 2040 O ASP A 135 7.646 8.581 4.896 1.00 0.00 O ATOM 2041 CB ASP A 135 8.863 10.994 5.832 1.00 0.00 C ATOM 2042 CG ASP A 135 10.189 10.394 6.186 1.00 0.00 C ATOM 2043 OD1 ASP A 135 10.227 9.413 6.932 1.00 0.00 O ATOM 2044 OD2 ASP A 135 11.224 10.918 5.746 1.00 0.00 O ATOM 0 H ASP A 135 6.531 11.263 4.937 1.00 0.00 H new ATOM 0 HA ASP A 135 9.222 11.194 3.752 1.00 0.00 H new ATOM 0 HB2 ASP A 135 8.899 12.068 6.015 1.00 0.00 H new ATOM 0 HB3 ASP A 135 8.100 10.583 6.493 1.00 0.00 H new ATOM 2049 N ALA A 136 8.757 8.821 3.006 1.00 0.00 N ATOM 2050 CA ALA A 136 8.463 7.477 2.623 1.00 0.00 C ATOM 2051 C ALA A 136 9.678 6.644 2.400 1.00 0.00 C ATOM 2052 O ALA A 136 10.614 7.033 1.695 1.00 0.00 O ATOM 2053 CB ALA A 136 7.584 7.450 1.381 1.00 0.00 C ATOM 0 H ALA A 136 9.344 9.345 2.357 1.00 0.00 H new ATOM 0 HA ALA A 136 7.928 7.038 3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 136 7.373 6.416 1.107 1.00 0.00 H new ATOM 0 HB2 ALA A 136 6.648 7.970 1.586 1.00 0.00 H new ATOM 0 HB3 ALA A 136 8.101 7.945 0.559 1.00 0.00 H new ATOM 2059 N ALA A 137 9.657 5.521 3.024 1.00 0.00 N ATOM 2060 CA ALA A 137 10.585 4.474 2.787 1.00 0.00 C ATOM 2061 C ALA A 137 9.711 3.306 2.472 1.00 0.00 C ATOM 2062 O ALA A 137 8.929 2.864 3.319 1.00 0.00 O ATOM 2063 CB ALA A 137 11.426 4.204 4.030 1.00 0.00 C ATOM 0 H ALA A 137 8.967 5.298 3.741 1.00 0.00 H new ATOM 0 HA ALA A 137 11.295 4.703 1.992 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.130 3.398 3.825 1.00 0.00 H new ATOM 0 HB2 ALA A 137 11.976 5.106 4.300 1.00 0.00 H new ATOM 0 HB3 ALA A 137 10.774 3.915 4.855 1.00 0.00 H new ATOM 2069 N SER A 138 9.752 2.839 1.268 1.00 0.00 N ATOM 2070 CA SER A 138 8.837 1.819 0.903 1.00 0.00 C ATOM 2071 C SER A 138 9.509 0.673 0.181 1.00 0.00 C ATOM 2072 O SER A 138 9.883 0.757 -0.989 1.00 0.00 O ATOM 2073 CB SER A 138 7.695 2.430 0.091 1.00 0.00 C ATOM 2074 OG SER A 138 7.051 3.464 0.834 1.00 0.00 O ATOM 0 H SER A 138 10.396 3.141 0.537 1.00 0.00 H new ATOM 0 HA SER A 138 8.423 1.382 1.812 1.00 0.00 H new ATOM 0 HB2 SER A 138 8.082 2.833 -0.845 1.00 0.00 H new ATOM 0 HB3 SER A 138 6.972 1.657 -0.170 1.00 0.00 H new ATOM 0 HG SER A 138 6.108 3.517 0.572 1.00 0.00 H new ATOM 2080 N ASN A 139 9.634 -0.390 0.909 1.00 0.00 N ATOM 2081 CA ASN A 139 10.195 -1.630 0.460 1.00 0.00 C ATOM 2082 C ASN A 139 9.856 -2.651 1.513 1.00 0.00 C ATOM 2083 O ASN A 139 10.515 -2.725 2.547 1.00 0.00 O ATOM 2084 CB ASN A 139 11.729 -1.524 0.278 1.00 0.00 C ATOM 2085 CG ASN A 139 12.360 -2.782 -0.291 1.00 0.00 C ATOM 2086 OD1 ASN A 139 12.755 -3.685 0.439 1.00 0.00 O ATOM 2087 ND2 ASN A 139 12.494 -2.832 -1.588 1.00 0.00 N ATOM 0 H ASN A 139 9.333 -0.421 1.883 1.00 0.00 H new ATOM 0 HA ASN A 139 9.789 -1.908 -0.513 1.00 0.00 H new ATOM 0 HB2 ASN A 139 11.951 -0.685 -0.382 1.00 0.00 H new ATOM 0 HB3 ASN A 139 12.187 -1.302 1.242 1.00 0.00 H new ATOM 0 HD21 ASN A 139 12.939 -3.640 -2.024 1.00 0.00 H new ATOM 0 HD22 ASN A 139 12.154 -2.063 -2.166 1.00 0.00 H new ATOM 2094 N GLY A 140 8.762 -3.336 1.312 1.00 0.00 N ATOM 2095 CA GLY A 140 8.328 -4.337 2.262 1.00 0.00 C ATOM 2096 C GLY A 140 9.002 -5.629 1.953 1.00 0.00 C ATOM 2097 O GLY A 140 9.571 -5.765 0.878 1.00 0.00 O ATOM 0 H GLY A 140 8.153 -3.223 0.502 1.00 0.00 H new ATOM 0 HA2 GLY A 140 8.569 -4.021 3.277 1.00 0.00 H new ATOM 0 HA3 GLY A 140 7.246 -4.457 2.214 1.00 0.00 H new ATOM 2101 N LYS A 141 8.962 -6.575 2.836 1.00 0.00 N ATOM 2102 CA LYS A 141 9.636 -7.805 2.554 1.00 0.00 C ATOM 2103 C LYS A 141 8.868 -8.996 3.062 1.00 0.00 C ATOM 2104 O LYS A 141 8.307 -8.979 4.164 1.00 0.00 O ATOM 2105 CB LYS A 141 11.108 -7.773 3.037 1.00 0.00 C ATOM 2106 CG LYS A 141 11.917 -8.990 2.617 1.00 0.00 C ATOM 2107 CD LYS A 141 13.420 -8.747 2.658 1.00 0.00 C ATOM 2108 CE LYS A 141 13.965 -8.528 4.061 1.00 0.00 C ATOM 2109 NZ LYS A 141 15.446 -8.473 4.046 1.00 0.00 N ATOM 0 H LYS A 141 8.484 -6.526 3.736 1.00 0.00 H new ATOM 0 HA LYS A 141 9.676 -7.919 1.471 1.00 0.00 H new ATOM 0 HB2 LYS A 141 11.589 -6.876 2.647 1.00 0.00 H new ATOM 0 HB3 LYS A 141 11.123 -7.696 4.124 1.00 0.00 H new ATOM 0 HG2 LYS A 141 11.672 -9.826 3.271 1.00 0.00 H new ATOM 0 HG3 LYS A 141 11.629 -9.280 1.607 1.00 0.00 H new ATOM 0 HD2 LYS A 141 13.929 -9.599 2.209 1.00 0.00 H new ATOM 0 HD3 LYS A 141 13.655 -7.876 2.046 1.00 0.00 H new ATOM 0 HE2 LYS A 141 13.566 -7.600 4.471 1.00 0.00 H new ATOM 0 HE3 LYS A 141 13.633 -9.334 4.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 15.805 -8.511 5.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 15.818 -9.282 3.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 15.756 -7.588 3.597 1.00 0.00 H new ATOM 2123 N ILE A 142 8.806 -9.993 2.232 1.00 0.00 N ATOM 2124 CA ILE A 142 8.145 -11.218 2.518 1.00 0.00 C ATOM 2125 C ILE A 142 9.201 -12.285 2.681 1.00 0.00 C ATOM 2126 O ILE A 142 10.003 -12.519 1.775 1.00 0.00 O ATOM 2127 CB ILE A 142 7.191 -11.616 1.361 1.00 0.00 C ATOM 2128 CG1 ILE A 142 6.151 -10.509 1.123 1.00 0.00 C ATOM 2129 CG2 ILE A 142 6.504 -12.950 1.673 1.00 0.00 C ATOM 2130 CD1 ILE A 142 5.294 -10.713 -0.105 1.00 0.00 C ATOM 0 H ILE A 142 9.232 -9.969 1.305 1.00 0.00 H new ATOM 0 HA ILE A 142 7.551 -11.109 3.425 1.00 0.00 H new ATOM 0 HB ILE A 142 7.776 -11.738 0.449 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.503 -10.442 1.997 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.668 -9.554 1.036 1.00 0.00 H new ATOM 0 HG21 ILE A 142 5.838 -13.217 0.853 1.00 0.00 H new ATOM 0 HG22 ILE A 142 7.258 -13.728 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 142 5.927 -12.856 2.593 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.588 -9.887 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 142 5.929 -10.748 -0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 142 4.746 -11.651 -0.014 1.00 0.00 H new ATOM 2142 N THR A 143 9.241 -12.878 3.819 1.00 0.00 N ATOM 2143 CA THR A 143 10.167 -13.921 4.070 1.00 0.00 C ATOM 2144 C THR A 143 9.486 -15.249 3.812 1.00 0.00 C ATOM 2145 O THR A 143 8.597 -15.663 4.555 1.00 0.00 O ATOM 2146 CB THR A 143 10.706 -13.844 5.511 1.00 0.00 C ATOM 2147 OG1 THR A 143 11.217 -12.511 5.738 1.00 0.00 O ATOM 2148 CG2 THR A 143 11.834 -14.851 5.726 1.00 0.00 C ATOM 0 H THR A 143 8.631 -12.653 4.605 1.00 0.00 H new ATOM 0 HA THR A 143 11.022 -13.818 3.402 1.00 0.00 H new ATOM 0 HB THR A 143 9.898 -14.076 6.205 1.00 0.00 H new ATOM 0 HG1 THR A 143 11.563 -12.445 6.653 1.00 0.00 H new ATOM 0 HG21 THR A 143 12.197 -14.777 6.751 1.00 0.00 H new ATOM 0 HG22 THR A 143 11.461 -15.859 5.545 1.00 0.00 H new ATOM 0 HG23 THR A 143 12.650 -14.637 5.035 1.00 0.00 H new ATOM 2156 N VAL A 144 9.837 -15.861 2.720 1.00 0.00 N ATOM 2157 CA VAL A 144 9.304 -17.143 2.384 1.00 0.00 C ATOM 2158 C VAL A 144 10.097 -18.162 3.172 1.00 0.00 C ATOM 2159 O VAL A 144 11.273 -18.365 2.905 1.00 0.00 O ATOM 2160 CB VAL A 144 9.423 -17.440 0.867 1.00 0.00 C ATOM 2161 CG1 VAL A 144 8.743 -18.756 0.517 1.00 0.00 C ATOM 2162 CG2 VAL A 144 8.857 -16.292 0.030 1.00 0.00 C ATOM 0 H VAL A 144 10.499 -15.485 2.041 1.00 0.00 H new ATOM 0 HA VAL A 144 8.242 -17.178 2.626 1.00 0.00 H new ATOM 0 HB VAL A 144 10.483 -17.532 0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.840 -18.942 -0.553 1.00 0.00 H new ATOM 0 HG12 VAL A 144 9.214 -19.568 1.071 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.687 -18.702 0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.955 -16.531 -1.029 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.804 -16.149 0.273 1.00 0.00 H new ATOM 0 HG23 VAL A 144 9.408 -15.377 0.248 1.00 0.00 H new ATOM 2172 N THR A 145 9.483 -18.740 4.160 1.00 0.00 N ATOM 2173 CA THR A 145 10.156 -19.660 5.032 1.00 0.00 C ATOM 2174 C THR A 145 10.321 -21.025 4.390 1.00 0.00 C ATOM 2175 O THR A 145 11.425 -21.569 4.345 1.00 0.00 O ATOM 2176 CB THR A 145 9.418 -19.760 6.375 1.00 0.00 C ATOM 2177 OG1 THR A 145 8.012 -19.894 6.125 1.00 0.00 O ATOM 2178 CG2 THR A 145 9.663 -18.524 7.230 1.00 0.00 C ATOM 0 H THR A 145 8.500 -18.588 4.386 1.00 0.00 H new ATOM 0 HA THR A 145 11.158 -19.274 5.218 1.00 0.00 H new ATOM 0 HB THR A 145 9.794 -20.629 6.915 1.00 0.00 H new ATOM 0 HG1 THR A 145 7.814 -20.815 5.855 1.00 0.00 H new ATOM 0 HG21 THR A 145 9.128 -18.623 8.175 1.00 0.00 H new ATOM 0 HG22 THR A 145 10.730 -18.423 7.426 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.306 -17.640 6.702 1.00 0.00 H new ATOM 2186 N GLY A 146 9.243 -21.548 3.879 1.00 0.00 N ATOM 2187 CA GLY A 146 9.287 -22.829 3.258 1.00 0.00 C ATOM 2188 C GLY A 146 8.413 -23.802 3.991 1.00 0.00 C ATOM 2189 O GLY A 146 8.587 -24.003 5.194 1.00 0.00 O ATOM 0 H GLY A 146 8.325 -21.102 3.883 1.00 0.00 H new ATOM 0 HA2 GLY A 146 8.960 -22.748 2.221 1.00 0.00 H new ATOM 0 HA3 GLY A 146 10.313 -23.196 3.241 1.00 0.00 H new ATOM 2193 N SER A 147 7.477 -24.391 3.282 1.00 0.00 N ATOM 2194 CA SER A 147 6.495 -25.280 3.861 1.00 0.00 C ATOM 2195 C SER A 147 7.130 -26.591 4.297 1.00 0.00 C ATOM 2196 O SER A 147 6.853 -27.096 5.389 1.00 0.00 O ATOM 2197 CB SER A 147 5.413 -25.560 2.830 1.00 0.00 C ATOM 2198 OG SER A 147 4.866 -24.356 2.318 1.00 0.00 O ATOM 0 H SER A 147 7.375 -24.265 2.275 1.00 0.00 H new ATOM 0 HA SER A 147 6.067 -24.800 4.741 1.00 0.00 H new ATOM 0 HB2 SER A 147 5.830 -26.149 2.013 1.00 0.00 H new ATOM 0 HB3 SER A 147 4.622 -26.158 3.283 1.00 0.00 H new ATOM 0 HG SER A 147 4.174 -24.566 1.656 1.00 0.00 H new ATOM 2204 N ALA A 148 7.982 -27.124 3.453 1.00 0.00 N ATOM 2205 CA ALA A 148 8.620 -28.376 3.710 1.00 0.00 C ATOM 2206 C ALA A 148 10.027 -28.330 3.168 1.00 0.00 C ATOM 2207 O ALA A 148 10.237 -27.871 2.025 1.00 0.00 O ATOM 2208 CB ALA A 148 7.839 -29.516 3.062 1.00 0.00 C ATOM 0 H ALA A 148 8.247 -26.693 2.568 1.00 0.00 H new ATOM 0 HA ALA A 148 8.649 -28.554 4.785 1.00 0.00 H new ATOM 0 HB1 ALA A 148 8.339 -30.463 3.268 1.00 0.00 H new ATOM 0 HB2 ALA A 148 6.829 -29.543 3.470 1.00 0.00 H new ATOM 0 HB3 ALA A 148 7.791 -29.358 1.985 1.00 0.00 H new ATOM 2214 N PRO A 149 11.025 -28.731 3.979 1.00 0.00 N ATOM 2215 CA PRO A 149 12.414 -28.797 3.546 1.00 0.00 C ATOM 2216 C PRO A 149 12.603 -29.836 2.433 1.00 0.00 C ATOM 2217 O PRO A 149 12.704 -31.049 2.673 1.00 0.00 O ATOM 2218 CB PRO A 149 13.187 -29.182 4.815 1.00 0.00 C ATOM 2219 CG PRO A 149 12.170 -29.798 5.713 1.00 0.00 C ATOM 2220 CD PRO A 149 10.873 -29.119 5.397 1.00 0.00 C ATOM 0 HA PRO A 149 12.763 -27.856 3.121 1.00 0.00 H new ATOM 0 HB2 PRO A 149 13.991 -29.883 4.590 1.00 0.00 H new ATOM 0 HB3 PRO A 149 13.645 -28.308 5.278 1.00 0.00 H new ATOM 0 HG2 PRO A 149 12.099 -30.872 5.543 1.00 0.00 H new ATOM 0 HG3 PRO A 149 12.438 -29.658 6.760 1.00 0.00 H new ATOM 0 HD2 PRO A 149 10.024 -29.787 5.542 1.00 0.00 H new ATOM 0 HD3 PRO A 149 10.708 -28.251 6.035 1.00 0.00 H new ATOM 2228 N THR A 150 12.525 -29.363 1.226 1.00 0.00 N ATOM 2229 CA THR A 150 12.654 -30.158 0.046 1.00 0.00 C ATOM 2230 C THR A 150 13.233 -29.274 -1.052 1.00 0.00 C ATOM 2231 O THR A 150 12.542 -28.404 -1.587 1.00 0.00 O ATOM 2232 CB THR A 150 11.259 -30.707 -0.388 1.00 0.00 C ATOM 2233 OG1 THR A 150 10.687 -31.479 0.687 1.00 0.00 O ATOM 2234 CG2 THR A 150 11.366 -31.581 -1.626 1.00 0.00 C ATOM 0 H THR A 150 12.364 -28.375 1.031 1.00 0.00 H new ATOM 0 HA THR A 150 13.309 -31.009 0.233 1.00 0.00 H new ATOM 0 HB THR A 150 10.622 -29.855 -0.622 1.00 0.00 H new ATOM 0 HG1 THR A 150 9.811 -31.822 0.413 1.00 0.00 H new ATOM 0 HG21 THR A 150 10.376 -31.946 -1.900 1.00 0.00 H new ATOM 0 HG22 THR A 150 11.778 -30.997 -2.449 1.00 0.00 H new ATOM 0 HG23 THR A 150 12.020 -32.428 -1.418 1.00 0.00 H new ATOM 2242 N SER A 151 14.495 -29.436 -1.314 1.00 0.00 N ATOM 2243 CA SER A 151 15.164 -28.665 -2.307 1.00 0.00 C ATOM 2244 C SER A 151 16.317 -29.500 -2.838 1.00 0.00 C ATOM 2245 O SER A 151 16.134 -30.184 -3.864 1.00 0.00 O ATOM 2246 CB SER A 151 15.634 -27.325 -1.694 1.00 0.00 C ATOM 2247 OG SER A 151 16.217 -26.451 -2.658 1.00 0.00 O ATOM 2248 OXT SER A 151 17.382 -29.553 -2.202 1.00 0.00 O ATOM 0 H SER A 151 15.090 -30.114 -0.838 1.00 0.00 H new ATOM 0 HA SER A 151 14.503 -28.415 -3.137 1.00 0.00 H new ATOM 0 HB2 SER A 151 14.785 -26.827 -1.226 1.00 0.00 H new ATOM 0 HB3 SER A 151 16.360 -27.526 -0.906 1.00 0.00 H new ATOM 0 HG SER A 151 16.495 -25.620 -2.220 1.00 0.00 H new TER 2254 SER A 151