USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 822 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: F 23 ASN : amide:sc= -3.13! C(o=-3.3!,f=-3.5!) USER MOD Set 1.2: F 55 GLN : amide:sc= -0.216 X(o=-3.3,f=-3.5) USER MOD Set 2.1: E 39 SER OG : rot 180:sc= -0.0981 USER MOD Set 2.2: E 40 GLN : amide:sc= -0.681 X(o=-0.78,f=-1.2) USER MOD Set 3.1: E 23 ASN : amide:sc= -2.19! C(o=-6.8!,f=-6.2!) USER MOD Set 3.2: E 55 GLN : amide:sc= -4.61! C(o=-6.8!,f=-5.5!) USER MOD Set 4.1: C 26 SER OG : rot -79:sc= 1.49 USER MOD Set 4.2: C 28 LYS NZ :NH3+ -129:sc= 0.907 (180deg=-0.615) USER MOD Single : C 16 LYS NZ :NH3+ -152:sc= -0.0151 (180deg=-0.799) USER MOD Single : C 27 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : C 35 MET CE :methyl -138:sc= -0.0941 (180deg=-1.73) USER MOD Single : E 18 TYR OH : rot 143:sc= 1.06 USER MOD Single : E 21 ASN : amide:sc= -1.91! X(o=-1.9!,f=-1.8) USER MOD Single : E 26 GLN : amide:sc= -4.81 K(o=-4.8,f=-2.1) USER MOD Single : E 32 HIS : no HD1:sc= -0.39 X(o=-0.39,f=-0.029) USER MOD Single : E 33 SER OG : rot 180:sc= 0 USER MOD Single : E 35 HIS : no HE2:sc= 0.0165 K(o=0.016,f=-3.5!) USER MOD Single : E 41 SER OG : rot -75:sc= -5.09! USER MOD Single : E 43 ASN : amide:sc= -0.0184 X(o=-0.018,f=0) USER MOD Single : E 49 LYS NZ :NH3+ -115:sc= 0.408 (180deg=-0.497) USER MOD Single : E 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 52 ASN : amide:sc= -0.0939 K(o=-0.094,f=-1.1) USER MOD Single : F 18 TYR OH : rot -91:sc= 1.17 USER MOD Single : F 21 ASN : amide:sc= -0.0167 K(o=-0.017,f=-0.58) USER MOD Single : F 26 GLN : amide:sc= -2.38 K(o=-2.4,f=-0.99) USER MOD Single : F 32 HIS : no HD1:sc= -0.0848 X(o=-0.085,f=-0.45) USER MOD Single : F 33 SER OG : rot 81:sc= 0.697 USER MOD Single : F 35 HIS : no HD1:sc= 0 X(o=0,f=-0.038) USER MOD Single : F 39 SER OG : rot 180:sc= 0 USER MOD Single : F 40 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : F 41 SER OG : rot -86:sc= 0.814 USER MOD Single : F 43 ASN : amide:sc= -0.0238 X(o=-0.024,f=0) USER MOD Single : F 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 52 ASN : amide:sc= 0.873 K(o=0.87,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS C 16 126.531 -9.525 -3.637 1.00 0.00 N ATOM 2 CA LYS C 16 125.345 -9.419 -2.798 1.00 0.00 C ATOM 3 C LYS C 16 124.826 -7.987 -2.805 1.00 0.00 C ATOM 4 O LYS C 16 125.600 -7.033 -2.680 1.00 0.00 O ATOM 5 CB LYS C 16 125.662 -9.906 -1.370 1.00 0.00 C ATOM 6 CG LYS C 16 126.481 -8.863 -0.598 1.00 0.00 C ATOM 7 CD LYS C 16 125.532 -7.929 0.172 1.00 0.00 C ATOM 8 CE LYS C 16 125.302 -8.447 1.603 1.00 0.00 C ATOM 9 NZ LYS C 16 124.069 -9.288 1.638 1.00 0.00 N ATOM 0 HA LYS C 16 124.558 -10.058 -3.199 1.00 0.00 H new ATOM 0 HB2 LYS C 16 124.733 -10.110 -0.838 1.00 0.00 H new ATOM 0 HB3 LYS C 16 126.215 -10.844 -1.417 1.00 0.00 H new ATOM 0 HG2 LYS C 16 127.160 -9.359 0.095 1.00 0.00 H new ATOM 0 HG3 LYS C 16 127.096 -8.285 -1.288 1.00 0.00 H new ATOM 0 HD2 LYS C 16 125.952 -6.924 0.207 1.00 0.00 H new ATOM 0 HD3 LYS C 16 124.579 -7.858 -0.352 1.00 0.00 H new ATOM 0 HE2 LYS C 16 126.162 -9.030 1.932 1.00 0.00 H new ATOM 0 HE3 LYS C 16 125.203 -7.609 2.293 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 123.647 -9.246 2.588 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 123.386 -8.932 0.939 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 124.314 -10.273 1.411 1.00 0.00 H new ATOM 23 N LEU C 17 123.512 -7.854 -2.946 1.00 0.00 N ATOM 24 CA LEU C 17 122.869 -6.543 -2.957 1.00 0.00 C ATOM 25 C LEU C 17 121.881 -6.441 -1.813 1.00 0.00 C ATOM 26 O LEU C 17 121.288 -7.443 -1.400 1.00 0.00 O ATOM 27 CB LEU C 17 122.167 -6.282 -4.296 1.00 0.00 C ATOM 28 CG LEU C 17 123.059 -5.386 -5.181 1.00 0.00 C ATOM 29 CD1 LEU C 17 123.963 -6.251 -6.075 1.00 0.00 C ATOM 30 CD2 LEU C 17 122.169 -4.462 -6.027 1.00 0.00 C ATOM 0 H LEU C 17 122.869 -8.639 -3.055 1.00 0.00 H new ATOM 0 HA LEU C 17 123.640 -5.783 -2.830 1.00 0.00 H new ATOM 0 HB2 LEU C 17 121.965 -7.226 -4.803 1.00 0.00 H new ATOM 0 HB3 LEU C 17 121.204 -5.800 -4.126 1.00 0.00 H new ATOM 0 HG LEU C 17 123.703 -4.773 -4.550 1.00 0.00 H new ATOM 0 HD11 LEU C 17 124.587 -5.606 -6.694 1.00 0.00 H new ATOM 0 HD12 LEU C 17 124.598 -6.879 -5.451 1.00 0.00 H new ATOM 0 HD13 LEU C 17 123.346 -6.881 -6.715 1.00 0.00 H new ATOM 0 HD21 LEU C 17 122.795 -3.827 -6.654 1.00 0.00 H new ATOM 0 HD22 LEU C 17 121.516 -5.064 -6.659 1.00 0.00 H new ATOM 0 HD23 LEU C 17 121.563 -3.838 -5.370 1.00 0.00 H new ATOM 42 N VAL C 18 121.729 -5.225 -1.291 1.00 0.00 N ATOM 43 CA VAL C 18 120.825 -4.995 -0.166 1.00 0.00 C ATOM 44 C VAL C 18 120.106 -3.658 -0.325 1.00 0.00 C ATOM 45 O VAL C 18 120.739 -2.657 -0.637 1.00 0.00 O ATOM 46 CB VAL C 18 121.627 -5.009 1.155 1.00 0.00 C ATOM 47 CG1 VAL C 18 120.655 -5.168 2.332 1.00 0.00 C ATOM 48 CG2 VAL C 18 122.641 -6.175 1.160 1.00 0.00 C ATOM 0 H VAL C 18 122.214 -4.392 -1.625 1.00 0.00 H new ATOM 0 HA VAL C 18 120.079 -5.789 -0.144 1.00 0.00 H new ATOM 0 HB VAL C 18 122.175 -4.071 1.248 1.00 0.00 H new ATOM 0 HG11 VAL C 18 121.215 -5.179 3.267 1.00 0.00 H new ATOM 0 HG12 VAL C 18 119.953 -4.335 2.339 1.00 0.00 H new ATOM 0 HG13 VAL C 18 120.106 -6.104 2.227 1.00 0.00 H new ATOM 0 HG21 VAL C 18 123.197 -6.170 2.098 1.00 0.00 H new ATOM 0 HG22 VAL C 18 122.108 -7.121 1.059 1.00 0.00 H new ATOM 0 HG23 VAL C 18 123.334 -6.058 0.327 1.00 0.00 H new ATOM 58 N PHE C 19 118.789 -3.646 -0.090 1.00 0.00 N ATOM 59 CA PHE C 19 117.997 -2.423 -0.191 1.00 0.00 C ATOM 60 C PHE C 19 117.811 -1.832 1.189 1.00 0.00 C ATOM 61 O PHE C 19 117.421 -2.532 2.118 1.00 0.00 O ATOM 62 CB PHE C 19 116.611 -2.708 -0.811 1.00 0.00 C ATOM 63 CG PHE C 19 116.547 -2.116 -2.201 1.00 0.00 C ATOM 64 CD1 PHE C 19 117.377 -2.637 -3.202 1.00 0.00 C ATOM 65 CD2 PHE C 19 115.679 -1.042 -2.491 1.00 0.00 C ATOM 66 CE1 PHE C 19 117.346 -2.099 -4.488 1.00 0.00 C ATOM 67 CE2 PHE C 19 115.657 -0.506 -3.786 1.00 0.00 C ATOM 68 CZ PHE C 19 116.490 -1.036 -4.782 1.00 0.00 C ATOM 0 H PHE C 19 118.252 -4.473 0.172 1.00 0.00 H new ATOM 0 HA PHE C 19 118.528 -1.722 -0.835 1.00 0.00 H new ATOM 0 HB2 PHE C 19 116.434 -3.783 -0.854 1.00 0.00 H new ATOM 0 HB3 PHE C 19 115.827 -2.281 -0.186 1.00 0.00 H new ATOM 0 HD1 PHE C 19 118.042 -3.457 -2.977 1.00 0.00 H new ATOM 0 HD2 PHE C 19 115.038 -0.637 -1.722 1.00 0.00 H new ATOM 0 HE1 PHE C 19 117.985 -2.505 -5.258 1.00 0.00 H new ATOM 0 HE2 PHE C 19 114.997 0.317 -4.017 1.00 0.00 H new ATOM 0 HZ PHE C 19 116.469 -0.621 -5.779 1.00 0.00 H new ATOM 78 N PHE C 20 118.093 -0.546 1.312 1.00 0.00 N ATOM 79 CA PHE C 20 117.947 0.145 2.599 1.00 0.00 C ATOM 80 C PHE C 20 117.405 1.560 2.414 1.00 0.00 C ATOM 81 O PHE C 20 117.575 2.167 1.352 1.00 0.00 O ATOM 82 CB PHE C 20 119.295 0.200 3.315 1.00 0.00 C ATOM 83 CG PHE C 20 120.256 1.025 2.516 1.00 0.00 C ATOM 84 CD1 PHE C 20 120.285 2.413 2.676 1.00 0.00 C ATOM 85 CD2 PHE C 20 121.108 0.401 1.614 1.00 0.00 C ATOM 86 CE1 PHE C 20 121.173 3.175 1.928 1.00 0.00 C ATOM 87 CE2 PHE C 20 121.997 1.160 0.869 1.00 0.00 C ATOM 88 CZ PHE C 20 122.033 2.553 1.023 1.00 0.00 C ATOM 0 H PHE C 20 118.422 0.044 0.548 1.00 0.00 H new ATOM 0 HA PHE C 20 117.233 -0.416 3.202 1.00 0.00 H new ATOM 0 HB2 PHE C 20 119.172 0.628 4.310 1.00 0.00 H new ATOM 0 HB3 PHE C 20 119.689 -0.808 3.448 1.00 0.00 H new ATOM 0 HD1 PHE C 20 119.619 2.891 3.379 1.00 0.00 H new ATOM 0 HD2 PHE C 20 121.078 -0.672 1.493 1.00 0.00 H new ATOM 0 HE1 PHE C 20 121.198 4.248 2.047 1.00 0.00 H new ATOM 0 HE2 PHE C 20 122.663 0.678 0.169 1.00 0.00 H new ATOM 0 HZ PHE C 20 122.726 3.144 0.442 1.00 0.00 H new ATOM 98 N ALA C 21 116.771 2.080 3.466 1.00 0.00 N ATOM 99 CA ALA C 21 116.224 3.427 3.442 1.00 0.00 C ATOM 100 C ALA C 21 116.940 4.292 4.478 1.00 0.00 C ATOM 101 O ALA C 21 117.077 3.892 5.638 1.00 0.00 O ATOM 102 CB ALA C 21 114.730 3.373 3.736 1.00 0.00 C ATOM 0 H ALA C 21 116.626 1.583 4.345 1.00 0.00 H new ATOM 0 HA ALA C 21 116.375 3.867 2.456 1.00 0.00 H new ATOM 0 HB1 ALA C 21 114.319 4.382 3.718 1.00 0.00 H new ATOM 0 HB2 ALA C 21 114.232 2.765 2.980 1.00 0.00 H new ATOM 0 HB3 ALA C 21 114.568 2.933 4.720 1.00 0.00 H new ATOM 108 N GLU C 22 117.400 5.471 4.046 1.00 0.00 N ATOM 109 CA GLU C 22 118.107 6.396 4.914 1.00 0.00 C ATOM 110 C GLU C 22 117.182 7.539 5.317 1.00 0.00 C ATOM 111 O GLU C 22 116.590 8.179 4.456 1.00 0.00 O ATOM 112 CB GLU C 22 119.326 6.935 4.148 1.00 0.00 C ATOM 113 CG GLU C 22 120.023 8.028 4.956 1.00 0.00 C ATOM 114 CD GLU C 22 121.230 8.573 4.187 1.00 0.00 C ATOM 115 OE1 GLU C 22 122.177 7.825 4.002 1.00 0.00 O ATOM 116 OE2 GLU C 22 121.190 9.729 3.794 1.00 0.00 O ATOM 0 H GLU C 22 117.289 5.802 3.088 1.00 0.00 H new ATOM 0 HA GLU C 22 118.435 5.890 5.822 1.00 0.00 H new ATOM 0 HB2 GLU C 22 120.024 6.123 3.945 1.00 0.00 H new ATOM 0 HB3 GLU C 22 119.011 7.332 3.183 1.00 0.00 H new ATOM 0 HG2 GLU C 22 119.323 8.836 5.166 1.00 0.00 H new ATOM 0 HG3 GLU C 22 120.346 7.628 5.917 1.00 0.00 H new ATOM 123 N ASP C 23 117.084 7.801 6.623 1.00 0.00 N ATOM 124 CA ASP C 23 116.246 8.884 7.125 1.00 0.00 C ATOM 125 C ASP C 23 116.940 10.208 6.841 1.00 0.00 C ATOM 126 O ASP C 23 118.058 10.447 7.302 1.00 0.00 O ATOM 127 CB ASP C 23 116.010 8.722 8.632 1.00 0.00 C ATOM 128 CG ASP C 23 115.046 9.800 9.130 1.00 0.00 C ATOM 129 OD1 ASP C 23 113.848 9.599 9.011 1.00 0.00 O ATOM 130 OD2 ASP C 23 115.519 10.813 9.622 1.00 0.00 O ATOM 0 H ASP C 23 117.575 7.277 7.348 1.00 0.00 H new ATOM 0 HA ASP C 23 115.277 8.860 6.626 1.00 0.00 H new ATOM 0 HB2 ASP C 23 115.601 7.733 8.840 1.00 0.00 H new ATOM 0 HB3 ASP C 23 116.957 8.795 9.167 1.00 0.00 H new ATOM 135 N VAL C 24 116.290 11.034 6.032 1.00 0.00 N ATOM 136 CA VAL C 24 116.859 12.326 5.627 1.00 0.00 C ATOM 137 C VAL C 24 115.953 13.499 5.989 1.00 0.00 C ATOM 138 O VAL C 24 116.334 14.653 5.782 1.00 0.00 O ATOM 139 CB VAL C 24 117.106 12.297 4.110 1.00 0.00 C ATOM 140 CG1 VAL C 24 117.936 11.047 3.775 1.00 0.00 C ATOM 141 CG2 VAL C 24 115.757 12.264 3.355 1.00 0.00 C ATOM 0 H VAL C 24 115.369 10.839 5.640 1.00 0.00 H new ATOM 0 HA VAL C 24 117.794 12.474 6.167 1.00 0.00 H new ATOM 0 HB VAL C 24 117.647 13.192 3.802 1.00 0.00 H new ATOM 0 HG11 VAL C 24 118.121 11.010 2.701 1.00 0.00 H new ATOM 0 HG12 VAL C 24 118.887 11.089 4.306 1.00 0.00 H new ATOM 0 HG13 VAL C 24 117.389 10.155 4.080 1.00 0.00 H new ATOM 0 HG21 VAL C 24 115.942 12.244 2.281 1.00 0.00 H new ATOM 0 HG22 VAL C 24 115.200 11.373 3.644 1.00 0.00 H new ATOM 0 HG23 VAL C 24 115.177 13.152 3.607 1.00 0.00 H new ATOM 151 N GLY C 25 114.750 13.203 6.500 1.00 0.00 N ATOM 152 CA GLY C 25 113.795 14.251 6.858 1.00 0.00 C ATOM 153 C GLY C 25 113.540 15.143 5.648 1.00 0.00 C ATOM 154 O GLY C 25 113.112 14.658 4.602 1.00 0.00 O ATOM 0 H GLY C 25 114.420 12.253 6.672 1.00 0.00 H new ATOM 0 HA2 GLY C 25 112.860 13.805 7.198 1.00 0.00 H new ATOM 0 HA3 GLY C 25 114.184 14.845 7.685 1.00 0.00 H new ATOM 158 N SER C 26 113.848 16.439 5.800 1.00 0.00 N ATOM 159 CA SER C 26 113.698 17.438 4.726 1.00 0.00 C ATOM 160 C SER C 26 112.414 17.249 3.899 1.00 0.00 C ATOM 161 O SER C 26 112.396 17.491 2.689 1.00 0.00 O ATOM 162 CB SER C 26 114.929 17.410 3.809 1.00 0.00 C ATOM 163 OG SER C 26 115.251 16.066 3.463 1.00 0.00 O ATOM 0 H SER C 26 114.209 16.827 6.672 1.00 0.00 H new ATOM 0 HA SER C 26 113.616 18.412 5.209 1.00 0.00 H new ATOM 0 HB2 SER C 26 114.733 17.989 2.907 1.00 0.00 H new ATOM 0 HB3 SER C 26 115.776 17.878 4.310 1.00 0.00 H new ATOM 0 HG SER C 26 115.730 15.643 4.206 1.00 0.00 H new ATOM 169 N ASN C 27 111.350 16.813 4.573 1.00 0.00 N ATOM 170 CA ASN C 27 110.049 16.578 3.933 1.00 0.00 C ATOM 171 C ASN C 27 110.115 15.456 2.886 1.00 0.00 C ATOM 172 O ASN C 27 109.106 15.134 2.250 1.00 0.00 O ATOM 173 CB ASN C 27 109.508 17.872 3.294 1.00 0.00 C ATOM 174 CG ASN C 27 109.421 18.992 4.334 1.00 0.00 C ATOM 175 OD1 ASN C 27 108.934 18.779 5.446 1.00 0.00 O ATOM 176 ND2 ASN C 27 109.864 20.182 4.036 1.00 0.00 N ATOM 0 H ASN C 27 111.362 16.613 5.573 1.00 0.00 H new ATOM 0 HA ASN C 27 109.363 16.258 4.717 1.00 0.00 H new ATOM 0 HB2 ASN C 27 110.158 18.179 2.475 1.00 0.00 H new ATOM 0 HB3 ASN C 27 108.522 17.688 2.866 1.00 0.00 H new ATOM 0 HD21 ASN C 27 109.807 20.934 4.723 1.00 0.00 H new ATOM 0 HD22 ASN C 27 110.267 20.360 3.116 1.00 0.00 H new ATOM 183 N LYS C 28 111.295 14.850 2.740 1.00 0.00 N ATOM 184 CA LYS C 28 111.500 13.744 1.805 1.00 0.00 C ATOM 185 C LYS C 28 111.368 12.404 2.529 1.00 0.00 C ATOM 186 O LYS C 28 111.417 11.344 1.899 1.00 0.00 O ATOM 187 CB LYS C 28 112.897 13.841 1.183 1.00 0.00 C ATOM 188 CG LYS C 28 113.003 15.097 0.305 1.00 0.00 C ATOM 189 CD LYS C 28 114.191 14.966 -0.662 1.00 0.00 C ATOM 190 CE LYS C 28 115.520 14.996 0.107 1.00 0.00 C ATOM 191 NZ LYS C 28 115.692 16.326 0.759 1.00 0.00 N ATOM 0 H LYS C 28 112.131 15.111 3.264 1.00 0.00 H new ATOM 0 HA LYS C 28 110.743 13.807 1.024 1.00 0.00 H new ATOM 0 HB2 LYS C 28 113.651 13.874 1.969 1.00 0.00 H new ATOM 0 HB3 LYS C 28 113.099 12.953 0.585 1.00 0.00 H new ATOM 0 HG2 LYS C 28 112.080 15.236 -0.257 1.00 0.00 H new ATOM 0 HG3 LYS C 28 113.130 15.979 0.932 1.00 0.00 H new ATOM 0 HD2 LYS C 28 114.110 14.035 -1.222 1.00 0.00 H new ATOM 0 HD3 LYS C 28 114.167 15.778 -1.389 1.00 0.00 H new ATOM 0 HE2 LYS C 28 115.534 14.207 0.859 1.00 0.00 H new ATOM 0 HE3 LYS C 28 116.350 14.803 -0.573 1.00 0.00 H new ATOM 0 HZ1 LYS C 28 116.628 16.711 0.520 1.00 0.00 H new ATOM 0 HZ2 LYS C 28 114.953 16.976 0.422 1.00 0.00 H new ATOM 0 HZ3 LYS C 28 115.615 16.219 1.791 1.00 0.00 H new ATOM 205 N GLY C 29 111.221 12.464 3.857 1.00 0.00 N ATOM 206 CA GLY C 29 111.111 11.255 4.665 1.00 0.00 C ATOM 207 C GLY C 29 112.448 10.527 4.664 1.00 0.00 C ATOM 208 O GLY C 29 113.385 10.941 5.354 1.00 0.00 O ATOM 0 H GLY C 29 111.176 13.334 4.388 1.00 0.00 H new ATOM 0 HA2 GLY C 29 110.823 11.510 5.685 1.00 0.00 H new ATOM 0 HA3 GLY C 29 110.330 10.607 4.266 1.00 0.00 H new ATOM 212 N ALA C 30 112.534 9.460 3.864 1.00 0.00 N ATOM 213 CA ALA C 30 113.766 8.684 3.740 1.00 0.00 C ATOM 214 C ALA C 30 114.142 8.518 2.265 1.00 0.00 C ATOM 215 O ALA C 30 113.336 8.805 1.374 1.00 0.00 O ATOM 216 CB ALA C 30 113.608 7.313 4.405 1.00 0.00 C ATOM 0 H ALA C 30 111.762 9.116 3.293 1.00 0.00 H new ATOM 0 HA ALA C 30 114.566 9.223 4.247 1.00 0.00 H new ATOM 0 HB1 ALA C 30 114.536 6.750 4.302 1.00 0.00 H new ATOM 0 HB2 ALA C 30 113.379 7.446 5.462 1.00 0.00 H new ATOM 0 HB3 ALA C 30 112.797 6.767 3.924 1.00 0.00 H new ATOM 222 N ILE C 31 115.375 8.056 2.022 1.00 0.00 N ATOM 223 CA ILE C 31 115.876 7.853 0.658 1.00 0.00 C ATOM 224 C ILE C 31 116.193 6.384 0.421 1.00 0.00 C ATOM 225 O ILE C 31 116.846 5.746 1.247 1.00 0.00 O ATOM 226 CB ILE C 31 117.156 8.675 0.411 1.00 0.00 C ATOM 227 CG1 ILE C 31 116.880 10.167 0.657 1.00 0.00 C ATOM 228 CG2 ILE C 31 117.623 8.468 -1.036 1.00 0.00 C ATOM 229 CD1 ILE C 31 118.137 11.006 0.367 1.00 0.00 C ATOM 0 H ILE C 31 116.044 7.816 2.753 1.00 0.00 H new ATOM 0 HA ILE C 31 115.096 8.182 -0.028 1.00 0.00 H new ATOM 0 HB ILE C 31 117.934 8.342 1.098 1.00 0.00 H new ATOM 0 HG12 ILE C 31 116.059 10.500 0.021 1.00 0.00 H new ATOM 0 HG13 ILE C 31 116.565 10.319 1.690 1.00 0.00 H new ATOM 0 HG21 ILE C 31 118.528 9.049 -1.213 1.00 0.00 H new ATOM 0 HG22 ILE C 31 117.831 7.411 -1.203 1.00 0.00 H new ATOM 0 HG23 ILE C 31 116.842 8.797 -1.721 1.00 0.00 H new ATOM 0 HD11 ILE C 31 117.921 12.059 0.547 1.00 0.00 H new ATOM 0 HD12 ILE C 31 118.948 10.685 1.021 1.00 0.00 H new ATOM 0 HD13 ILE C 31 118.434 10.869 -0.673 1.00 0.00 H new ATOM 241 N ILE C 32 115.757 5.874 -0.731 1.00 0.00 N ATOM 242 CA ILE C 32 116.020 4.492 -1.098 1.00 0.00 C ATOM 243 C ILE C 32 117.401 4.384 -1.731 1.00 0.00 C ATOM 244 O ILE C 32 117.669 4.966 -2.788 1.00 0.00 O ATOM 245 CB ILE C 32 114.923 3.968 -2.063 1.00 0.00 C ATOM 246 CG1 ILE C 32 113.809 3.296 -1.246 1.00 0.00 C ATOM 247 CG2 ILE C 32 115.483 2.946 -3.076 1.00 0.00 C ATOM 248 CD1 ILE C 32 114.341 2.030 -0.542 1.00 0.00 C ATOM 0 H ILE C 32 115.222 6.400 -1.422 1.00 0.00 H new ATOM 0 HA ILE C 32 115.998 3.873 -0.201 1.00 0.00 H new ATOM 0 HB ILE C 32 114.537 4.822 -2.620 1.00 0.00 H new ATOM 0 HG12 ILE C 32 113.422 3.995 -0.505 1.00 0.00 H new ATOM 0 HG13 ILE C 32 112.978 3.033 -1.901 1.00 0.00 H new ATOM 0 HG21 ILE C 32 114.681 2.606 -3.731 1.00 0.00 H new ATOM 0 HG22 ILE C 32 116.264 3.416 -3.673 1.00 0.00 H new ATOM 0 HG23 ILE C 32 115.900 2.093 -2.540 1.00 0.00 H new ATOM 0 HD11 ILE C 32 113.538 1.568 0.032 1.00 0.00 H new ATOM 0 HD12 ILE C 32 114.706 1.325 -1.289 1.00 0.00 H new ATOM 0 HD13 ILE C 32 115.156 2.302 0.129 1.00 0.00 H new ATOM 260 N GLY C 33 118.248 3.605 -1.075 1.00 0.00 N ATOM 261 CA GLY C 33 119.599 3.346 -1.541 1.00 0.00 C ATOM 262 C GLY C 33 119.893 1.869 -1.361 1.00 0.00 C ATOM 263 O GLY C 33 119.326 1.227 -0.475 1.00 0.00 O ATOM 0 H GLY C 33 118.015 3.134 -0.201 1.00 0.00 H new ATOM 0 HA2 GLY C 33 119.699 3.628 -2.589 1.00 0.00 H new ATOM 0 HA3 GLY C 33 120.315 3.946 -0.980 1.00 0.00 H new ATOM 267 N LEU C 34 120.761 1.330 -2.204 1.00 0.00 N ATOM 268 CA LEU C 34 121.110 -0.090 -2.124 1.00 0.00 C ATOM 269 C LEU C 34 122.609 -0.279 -2.044 1.00 0.00 C ATOM 270 O LEU C 34 123.389 0.532 -2.537 1.00 0.00 O ATOM 271 CB LEU C 34 120.568 -0.866 -3.327 1.00 0.00 C ATOM 272 CG LEU C 34 120.824 -0.071 -4.604 1.00 0.00 C ATOM 273 CD1 LEU C 34 121.329 -1.034 -5.677 1.00 0.00 C ATOM 274 CD2 LEU C 34 119.526 0.626 -5.045 1.00 0.00 C ATOM 0 H LEU C 34 121.235 1.844 -2.946 1.00 0.00 H new ATOM 0 HA LEU C 34 120.651 -0.480 -1.216 1.00 0.00 H new ATOM 0 HB2 LEU C 34 121.050 -1.842 -3.391 1.00 0.00 H new ATOM 0 HB3 LEU C 34 119.500 -1.045 -3.206 1.00 0.00 H new ATOM 0 HG LEU C 34 121.576 0.700 -4.436 1.00 0.00 H new ATOM 0 HD11 LEU C 34 121.518 -0.484 -6.599 1.00 0.00 H new ATOM 0 HD12 LEU C 34 122.252 -1.504 -5.339 1.00 0.00 H new ATOM 0 HD13 LEU C 34 120.577 -1.802 -5.860 1.00 0.00 H new ATOM 0 HD21 LEU C 34 119.710 1.194 -5.957 1.00 0.00 H new ATOM 0 HD22 LEU C 34 118.756 -0.123 -5.232 1.00 0.00 H new ATOM 0 HD23 LEU C 34 119.191 1.302 -4.258 1.00 0.00 H new ATOM 286 N MET C 35 122.977 -1.374 -1.413 1.00 0.00 N ATOM 287 CA MET C 35 124.375 -1.748 -1.228 1.00 0.00 C ATOM 288 C MET C 35 124.767 -2.761 -2.302 1.00 0.00 C ATOM 289 O MET C 35 123.943 -3.579 -2.696 1.00 0.00 O ATOM 290 CB MET C 35 124.559 -2.315 0.212 1.00 0.00 C ATOM 291 CG MET C 35 125.232 -3.702 0.207 1.00 0.00 C ATOM 292 SD MET C 35 125.160 -4.437 1.857 1.00 0.00 S ATOM 293 CE MET C 35 126.334 -3.324 2.651 1.00 0.00 C ATOM 0 H MET C 35 122.316 -2.038 -1.009 1.00 0.00 H new ATOM 0 HA MET C 35 125.030 -0.883 -1.334 1.00 0.00 H new ATOM 0 HB2 MET C 35 125.161 -1.622 0.800 1.00 0.00 H new ATOM 0 HB3 MET C 35 123.587 -2.386 0.700 1.00 0.00 H new ATOM 0 HG2 MET C 35 124.734 -4.353 -0.511 1.00 0.00 H new ATOM 0 HG3 MET C 35 126.270 -3.610 -0.113 1.00 0.00 H new ATOM 0 HE1 MET C 35 126.993 -3.896 3.305 1.00 0.00 H new ATOM 0 HE2 MET C 35 126.928 -2.819 1.890 1.00 0.00 H new ATOM 0 HE3 MET C 35 125.792 -2.583 3.239 1.00 0.00 H new ATOM 303 N VAL C 36 126.020 -2.693 -2.764 1.00 0.00 N ATOM 304 CA VAL C 36 126.525 -3.611 -3.796 1.00 0.00 C ATOM 305 C VAL C 36 127.837 -4.244 -3.321 1.00 0.00 C ATOM 306 O VAL C 36 128.785 -3.523 -2.990 1.00 0.00 O ATOM 307 CB VAL C 36 126.791 -2.842 -5.107 1.00 0.00 C ATOM 308 CG1 VAL C 36 127.047 -3.833 -6.252 1.00 0.00 C ATOM 309 CG2 VAL C 36 125.596 -1.939 -5.464 1.00 0.00 C ATOM 0 H VAL C 36 126.706 -2.011 -2.440 1.00 0.00 H new ATOM 0 HA VAL C 36 125.778 -4.385 -3.973 1.00 0.00 H new ATOM 0 HB VAL C 36 127.671 -2.215 -4.963 1.00 0.00 H new ATOM 0 HG11 VAL C 36 127.234 -3.283 -7.174 1.00 0.00 H new ATOM 0 HG12 VAL C 36 127.915 -4.448 -6.014 1.00 0.00 H new ATOM 0 HG13 VAL C 36 126.174 -4.473 -6.382 1.00 0.00 H new ATOM 0 HG21 VAL C 36 125.806 -1.407 -6.392 1.00 0.00 H new ATOM 0 HG22 VAL C 36 124.703 -2.551 -5.591 1.00 0.00 H new ATOM 0 HG23 VAL C 36 125.432 -1.219 -4.662 1.00 0.00 H new ATOM 319 N GLY C 37 127.895 -5.588 -3.293 1.00 0.00 N ATOM 320 CA GLY C 37 129.104 -6.292 -2.858 1.00 0.00 C ATOM 321 C GLY C 37 129.566 -5.796 -1.491 1.00 0.00 C ATOM 322 O GLY C 37 130.692 -5.309 -1.348 1.00 0.00 O ATOM 0 H GLY C 37 127.124 -6.199 -3.564 1.00 0.00 H new ATOM 0 HA2 GLY C 37 128.908 -7.363 -2.813 1.00 0.00 H new ATOM 0 HA3 GLY C 37 129.898 -6.144 -3.590 1.00 0.00 H new ATOM 326 N GLY C 38 128.680 -5.914 -0.500 1.00 0.00 N ATOM 327 CA GLY C 38 128.976 -5.469 0.860 1.00 0.00 C ATOM 328 C GLY C 38 128.513 -6.496 1.885 1.00 0.00 C ATOM 329 O GLY C 38 128.178 -7.630 1.534 1.00 0.00 O ATOM 0 H GLY C 38 127.750 -6.315 -0.616 1.00 0.00 H new ATOM 0 HA2 GLY C 38 130.048 -5.302 0.966 1.00 0.00 H new ATOM 0 HA3 GLY C 38 128.484 -4.515 1.049 1.00 0.00 H new ATOM 333 N VAL C 39 128.516 -6.086 3.153 1.00 0.00 N ATOM 334 CA VAL C 39 128.115 -6.962 4.254 1.00 0.00 C ATOM 335 C VAL C 39 127.220 -6.207 5.249 1.00 0.00 C ATOM 336 O VAL C 39 127.432 -5.020 5.508 1.00 0.00 O ATOM 337 CB VAL C 39 129.384 -7.495 4.953 1.00 0.00 C ATOM 338 CG1 VAL C 39 130.203 -6.328 5.534 1.00 0.00 C ATOM 339 CG2 VAL C 39 129.001 -8.475 6.076 1.00 0.00 C ATOM 0 H VAL C 39 128.793 -5.149 3.444 1.00 0.00 H new ATOM 0 HA VAL C 39 127.537 -7.800 3.863 1.00 0.00 H new ATOM 0 HB VAL C 39 129.991 -8.020 4.216 1.00 0.00 H new ATOM 0 HG11 VAL C 39 131.095 -6.718 6.024 1.00 0.00 H new ATOM 0 HG12 VAL C 39 130.496 -5.653 4.730 1.00 0.00 H new ATOM 0 HG13 VAL C 39 129.598 -5.785 6.260 1.00 0.00 H new ATOM 0 HG21 VAL C 39 129.905 -8.844 6.561 1.00 0.00 H new ATOM 0 HG22 VAL C 39 128.379 -7.962 6.810 1.00 0.00 H new ATOM 0 HG23 VAL C 39 128.448 -9.314 5.654 1.00 0.00 H new ATOM 349 N VAL C 40 126.231 -6.912 5.806 1.00 0.00 N ATOM 350 CA VAL C 40 125.311 -6.311 6.779 1.00 0.00 C ATOM 351 C VAL C 40 124.545 -7.401 7.543 1.00 0.00 C ATOM 352 O VAL C 40 124.134 -8.367 6.918 1.00 0.00 O ATOM 353 CB VAL C 40 124.331 -5.357 6.057 1.00 0.00 C ATOM 354 CG1 VAL C 40 123.465 -6.131 5.048 1.00 0.00 C ATOM 355 CG2 VAL C 40 123.422 -4.657 7.083 1.00 0.00 C ATOM 356 OXT VAL C 40 124.383 -7.252 8.745 1.00 0.00 O ATOM 0 H VAL C 40 126.046 -7.894 5.602 1.00 0.00 H new ATOM 0 HA VAL C 40 125.889 -5.736 7.502 1.00 0.00 H new ATOM 0 HB VAL C 40 124.915 -4.610 5.520 1.00 0.00 H new ATOM 0 HG11 VAL C 40 122.782 -5.442 4.551 1.00 0.00 H new ATOM 0 HG12 VAL C 40 124.107 -6.605 4.306 1.00 0.00 H new ATOM 0 HG13 VAL C 40 122.891 -6.895 5.572 1.00 0.00 H new ATOM 0 HG21 VAL C 40 122.736 -3.988 6.564 1.00 0.00 H new ATOM 0 HG22 VAL C 40 122.852 -5.405 7.634 1.00 0.00 H new ATOM 0 HG23 VAL C 40 124.034 -4.082 7.778 1.00 0.00 H new TER 366 VAL C 40 ATOM 367 N GLY E 14 131.522 -1.816 0.637 1.00 0.00 N ATOM 368 CA GLY E 14 130.943 -2.122 -0.673 1.00 0.00 C ATOM 369 C GLY E 14 130.465 -0.850 -1.371 1.00 0.00 C ATOM 370 O GLY E 14 130.312 0.195 -0.732 1.00 0.00 O ATOM 0 HA2 GLY E 14 131.684 -2.625 -1.294 1.00 0.00 H new ATOM 0 HA3 GLY E 14 130.107 -2.811 -0.553 1.00 0.00 H new ATOM 374 N GLU E 15 130.202 -0.956 -2.679 1.00 0.00 N ATOM 375 CA GLU E 15 129.705 0.183 -3.451 1.00 0.00 C ATOM 376 C GLU E 15 128.236 0.393 -3.103 1.00 0.00 C ATOM 377 O GLU E 15 127.424 -0.507 -3.298 1.00 0.00 O ATOM 378 CB GLU E 15 129.872 -0.095 -4.964 1.00 0.00 C ATOM 379 CG GLU E 15 129.339 1.089 -5.803 1.00 0.00 C ATOM 380 CD GLU E 15 129.413 0.782 -7.305 1.00 0.00 C ATOM 381 OE1 GLU E 15 130.465 0.360 -7.764 1.00 0.00 O ATOM 382 OE2 GLU E 15 128.414 0.989 -7.981 1.00 0.00 O ATOM 0 H GLU E 15 130.325 -1.813 -3.219 1.00 0.00 H new ATOM 0 HA GLU E 15 130.271 1.082 -3.208 1.00 0.00 H new ATOM 0 HB2 GLU E 15 130.924 -0.264 -5.193 1.00 0.00 H new ATOM 0 HB3 GLU E 15 129.337 -1.006 -5.232 1.00 0.00 H new ATOM 0 HG2 GLU E 15 128.307 1.301 -5.523 1.00 0.00 H new ATOM 0 HG3 GLU E 15 129.920 1.985 -5.583 1.00 0.00 H new ATOM 389 N ILE E 16 127.906 1.577 -2.583 1.00 0.00 N ATOM 390 CA ILE E 16 126.526 1.876 -2.201 1.00 0.00 C ATOM 391 C ILE E 16 125.908 2.896 -3.159 1.00 0.00 C ATOM 392 O ILE E 16 126.476 3.959 -3.423 1.00 0.00 O ATOM 393 CB ILE E 16 126.476 2.364 -0.742 1.00 0.00 C ATOM 394 CG1 ILE E 16 127.191 1.313 0.156 1.00 0.00 C ATOM 395 CG2 ILE E 16 125.010 2.529 -0.317 1.00 0.00 C ATOM 396 CD1 ILE E 16 126.732 1.399 1.622 1.00 0.00 C ATOM 0 H ILE E 16 128.567 2.336 -2.418 1.00 0.00 H new ATOM 0 HA ILE E 16 125.933 0.964 -2.272 1.00 0.00 H new ATOM 0 HB ILE E 16 126.979 3.326 -0.640 1.00 0.00 H new ATOM 0 HG12 ILE E 16 126.992 0.313 -0.228 1.00 0.00 H new ATOM 0 HG13 ILE E 16 128.269 1.465 0.104 1.00 0.00 H new ATOM 0 HG21 ILE E 16 124.967 2.875 0.716 1.00 0.00 H new ATOM 0 HG22 ILE E 16 124.523 3.259 -0.964 1.00 0.00 H new ATOM 0 HG23 ILE E 16 124.497 1.571 -0.401 1.00 0.00 H new ATOM 0 HD11 ILE E 16 127.257 0.648 2.212 1.00 0.00 H new ATOM 0 HD12 ILE E 16 126.955 2.391 2.016 1.00 0.00 H new ATOM 0 HD13 ILE E 16 125.658 1.220 1.678 1.00 0.00 H new ATOM 408 N VAL E 17 124.744 2.515 -3.695 1.00 0.00 N ATOM 409 CA VAL E 17 123.995 3.315 -4.668 1.00 0.00 C ATOM 410 C VAL E 17 122.742 3.949 -4.050 1.00 0.00 C ATOM 411 O VAL E 17 122.091 3.354 -3.195 1.00 0.00 O ATOM 412 CB VAL E 17 123.580 2.393 -5.834 1.00 0.00 C ATOM 413 CG1 VAL E 17 122.599 3.115 -6.777 1.00 0.00 C ATOM 414 CG2 VAL E 17 124.829 1.968 -6.617 1.00 0.00 C ATOM 0 H VAL E 17 124.290 1.632 -3.462 1.00 0.00 H new ATOM 0 HA VAL E 17 124.634 4.127 -5.014 1.00 0.00 H new ATOM 0 HB VAL E 17 123.083 1.514 -5.425 1.00 0.00 H new ATOM 0 HG11 VAL E 17 122.319 2.447 -7.592 1.00 0.00 H new ATOM 0 HG12 VAL E 17 121.706 3.404 -6.222 1.00 0.00 H new ATOM 0 HG13 VAL E 17 123.076 4.006 -7.186 1.00 0.00 H new ATOM 0 HG21 VAL E 17 124.538 1.317 -7.441 1.00 0.00 H new ATOM 0 HG22 VAL E 17 125.329 2.852 -7.013 1.00 0.00 H new ATOM 0 HG23 VAL E 17 125.509 1.433 -5.954 1.00 0.00 H new ATOM 424 N TYR E 18 122.409 5.153 -4.529 1.00 0.00 N ATOM 425 CA TYR E 18 121.218 5.884 -4.079 1.00 0.00 C ATOM 426 C TYR E 18 120.358 6.251 -5.291 1.00 0.00 C ATOM 427 O TYR E 18 120.869 6.814 -6.263 1.00 0.00 O ATOM 428 CB TYR E 18 121.629 7.157 -3.323 1.00 0.00 C ATOM 429 CG TYR E 18 121.952 6.817 -1.893 1.00 0.00 C ATOM 430 CD1 TYR E 18 123.127 6.133 -1.586 1.00 0.00 C ATOM 431 CD2 TYR E 18 121.074 7.197 -0.875 1.00 0.00 C ATOM 432 CE1 TYR E 18 123.427 5.832 -0.259 1.00 0.00 C ATOM 433 CE2 TYR E 18 121.368 6.897 0.451 1.00 0.00 C ATOM 434 CZ TYR E 18 122.551 6.214 0.765 1.00 0.00 C ATOM 435 OH TYR E 18 122.856 5.920 2.080 1.00 0.00 O ATOM 0 H TYR E 18 122.954 5.646 -5.236 1.00 0.00 H new ATOM 0 HA TYR E 18 120.643 5.250 -3.405 1.00 0.00 H new ATOM 0 HB2 TYR E 18 122.495 7.613 -3.803 1.00 0.00 H new ATOM 0 HB3 TYR E 18 120.822 7.889 -3.359 1.00 0.00 H new ATOM 0 HD1 TYR E 18 123.803 5.837 -2.375 1.00 0.00 H new ATOM 0 HD2 TYR E 18 120.164 7.725 -1.118 1.00 0.00 H new ATOM 0 HE1 TYR E 18 124.337 5.303 -0.019 1.00 0.00 H new ATOM 0 HE2 TYR E 18 120.687 7.189 1.236 1.00 0.00 H new ATOM 0 HH TYR E 18 122.571 6.661 2.655 1.00 0.00 H new ATOM 445 N LEU E 19 119.054 5.929 -5.227 1.00 0.00 N ATOM 446 CA LEU E 19 118.129 6.231 -6.332 1.00 0.00 C ATOM 447 C LEU E 19 116.931 7.071 -5.837 1.00 0.00 C ATOM 448 O LEU E 19 115.771 6.674 -6.001 1.00 0.00 O ATOM 449 CB LEU E 19 117.620 4.920 -6.974 1.00 0.00 C ATOM 450 CG LEU E 19 118.787 4.103 -7.573 1.00 0.00 C ATOM 451 CD1 LEU E 19 118.300 2.701 -7.980 1.00 0.00 C ATOM 452 CD2 LEU E 19 119.373 4.821 -8.803 1.00 0.00 C ATOM 0 H LEU E 19 118.620 5.464 -4.429 1.00 0.00 H new ATOM 0 HA LEU E 19 118.672 6.811 -7.079 1.00 0.00 H new ATOM 0 HB2 LEU E 19 117.101 4.322 -6.225 1.00 0.00 H new ATOM 0 HB3 LEU E 19 116.896 5.151 -7.755 1.00 0.00 H new ATOM 0 HG LEU E 19 119.564 4.009 -6.814 1.00 0.00 H new ATOM 0 HD11 LEU E 19 119.131 2.135 -8.401 1.00 0.00 H new ATOM 0 HD12 LEU E 19 117.914 2.181 -7.103 1.00 0.00 H new ATOM 0 HD13 LEU E 19 117.509 2.792 -8.725 1.00 0.00 H new ATOM 0 HD21 LEU E 19 120.194 4.231 -9.212 1.00 0.00 H new ATOM 0 HD22 LEU E 19 118.598 4.937 -9.560 1.00 0.00 H new ATOM 0 HD23 LEU E 19 119.743 5.803 -8.509 1.00 0.00 H new ATOM 464 N PRO E 20 117.184 8.234 -5.255 1.00 0.00 N ATOM 465 CA PRO E 20 116.098 9.143 -4.757 1.00 0.00 C ATOM 466 C PRO E 20 115.274 9.718 -5.904 1.00 0.00 C ATOM 467 O PRO E 20 114.159 10.205 -5.699 1.00 0.00 O ATOM 468 CB PRO E 20 116.854 10.272 -4.038 1.00 0.00 C ATOM 469 CG PRO E 20 118.231 10.257 -4.610 1.00 0.00 C ATOM 470 CD PRO E 20 118.520 8.812 -5.007 1.00 0.00 C ATOM 0 HA PRO E 20 115.394 8.615 -4.114 1.00 0.00 H new ATOM 0 HB2 PRO E 20 116.371 11.235 -4.203 1.00 0.00 H new ATOM 0 HB3 PRO E 20 116.875 10.106 -2.961 1.00 0.00 H new ATOM 0 HG2 PRO E 20 118.299 10.918 -5.474 1.00 0.00 H new ATOM 0 HG3 PRO E 20 118.958 10.611 -3.880 1.00 0.00 H new ATOM 0 HD2 PRO E 20 119.148 8.761 -5.896 1.00 0.00 H new ATOM 0 HD3 PRO E 20 119.045 8.278 -4.215 1.00 0.00 H new ATOM 478 N ASN E 21 115.860 9.689 -7.101 1.00 0.00 N ATOM 479 CA ASN E 21 115.224 10.240 -8.292 1.00 0.00 C ATOM 480 C ASN E 21 114.347 9.218 -9.019 1.00 0.00 C ATOM 481 O ASN E 21 113.731 9.559 -10.033 1.00 0.00 O ATOM 482 CB ASN E 21 116.316 10.746 -9.245 1.00 0.00 C ATOM 483 CG ASN E 21 117.162 11.831 -8.571 1.00 0.00 C ATOM 484 OD1 ASN E 21 116.660 12.599 -7.748 1.00 0.00 O ATOM 485 ND2 ASN E 21 118.425 11.946 -8.880 1.00 0.00 N ATOM 0 H ASN E 21 116.782 9.286 -7.269 1.00 0.00 H new ATOM 0 HA ASN E 21 114.571 11.053 -7.975 1.00 0.00 H new ATOM 0 HB2 ASN E 21 116.954 9.916 -9.548 1.00 0.00 H new ATOM 0 HB3 ASN E 21 115.859 11.144 -10.151 1.00 0.00 H new ATOM 0 HD21 ASN E 21 118.994 12.670 -8.441 1.00 0.00 H new ATOM 0 HD22 ASN E 21 118.843 11.312 -9.561 1.00 0.00 H new ATOM 492 N LEU E 22 114.284 7.975 -8.517 1.00 0.00 N ATOM 493 CA LEU E 22 113.471 6.947 -9.165 1.00 0.00 C ATOM 494 C LEU E 22 112.097 6.846 -8.521 1.00 0.00 C ATOM 495 O LEU E 22 111.974 6.689 -7.303 1.00 0.00 O ATOM 496 CB LEU E 22 114.196 5.596 -9.115 1.00 0.00 C ATOM 497 CG LEU E 22 115.061 5.425 -10.380 1.00 0.00 C ATOM 498 CD1 LEU E 22 116.068 6.586 -10.508 1.00 0.00 C ATOM 499 CD2 LEU E 22 115.809 4.084 -10.311 1.00 0.00 C ATOM 0 H LEU E 22 114.778 7.666 -7.680 1.00 0.00 H new ATOM 0 HA LEU E 22 113.326 7.230 -10.208 1.00 0.00 H new ATOM 0 HB2 LEU E 22 114.822 5.541 -8.224 1.00 0.00 H new ATOM 0 HB3 LEU E 22 113.471 4.785 -9.046 1.00 0.00 H new ATOM 0 HG LEU E 22 114.413 5.435 -11.256 1.00 0.00 H new ATOM 0 HD11 LEU E 22 116.670 6.448 -11.406 1.00 0.00 H new ATOM 0 HD12 LEU E 22 115.528 7.530 -10.574 1.00 0.00 H new ATOM 0 HD13 LEU E 22 116.719 6.601 -9.634 1.00 0.00 H new ATOM 0 HD21 LEU E 22 116.421 3.962 -11.205 1.00 0.00 H new ATOM 0 HD22 LEU E 22 116.449 4.069 -9.429 1.00 0.00 H new ATOM 0 HD23 LEU E 22 115.089 3.268 -10.250 1.00 0.00 H new ATOM 511 N ASN E 23 111.070 6.930 -9.367 1.00 0.00 N ATOM 512 CA ASN E 23 109.681 6.843 -8.910 1.00 0.00 C ATOM 513 C ASN E 23 109.388 5.421 -8.410 1.00 0.00 C ATOM 514 O ASN E 23 110.134 4.491 -8.731 1.00 0.00 O ATOM 515 CB ASN E 23 108.717 7.227 -10.050 1.00 0.00 C ATOM 516 CG ASN E 23 109.119 6.544 -11.356 1.00 0.00 C ATOM 517 OD1 ASN E 23 108.818 5.372 -11.561 1.00 0.00 O ATOM 518 ND2 ASN E 23 109.784 7.214 -12.257 1.00 0.00 N ATOM 0 H ASN E 23 111.173 7.058 -10.374 1.00 0.00 H new ATOM 0 HA ASN E 23 109.531 7.543 -8.088 1.00 0.00 H new ATOM 0 HB2 ASN E 23 107.700 6.941 -9.783 1.00 0.00 H new ATOM 0 HB3 ASN E 23 108.719 8.309 -10.185 1.00 0.00 H new ATOM 0 HD21 ASN E 23 110.054 6.764 -13.132 1.00 0.00 H new ATOM 0 HD22 ASN E 23 110.034 8.188 -12.087 1.00 0.00 H new ATOM 525 N PRO E 24 108.338 5.230 -7.624 1.00 0.00 N ATOM 526 CA PRO E 24 107.987 3.879 -7.077 1.00 0.00 C ATOM 527 C PRO E 24 107.893 2.819 -8.171 1.00 0.00 C ATOM 528 O PRO E 24 108.303 1.675 -7.960 1.00 0.00 O ATOM 529 CB PRO E 24 106.628 4.092 -6.398 1.00 0.00 C ATOM 530 CG PRO E 24 106.564 5.551 -6.088 1.00 0.00 C ATOM 531 CD PRO E 24 107.380 6.262 -7.168 1.00 0.00 C ATOM 0 HA PRO E 24 108.751 3.509 -6.393 1.00 0.00 H new ATOM 0 HB2 PRO E 24 105.810 3.793 -7.054 1.00 0.00 H new ATOM 0 HB3 PRO E 24 106.544 3.494 -5.491 1.00 0.00 H new ATOM 0 HG2 PRO E 24 105.532 5.902 -6.088 1.00 0.00 H new ATOM 0 HG3 PRO E 24 106.971 5.755 -5.098 1.00 0.00 H new ATOM 0 HD2 PRO E 24 106.747 6.609 -7.985 1.00 0.00 H new ATOM 0 HD3 PRO E 24 107.894 7.137 -6.770 1.00 0.00 H new ATOM 539 N ASP E 25 107.372 3.207 -9.338 1.00 0.00 N ATOM 540 CA ASP E 25 107.254 2.277 -10.461 1.00 0.00 C ATOM 541 C ASP E 25 108.646 1.829 -10.911 1.00 0.00 C ATOM 542 O ASP E 25 108.866 0.645 -11.182 1.00 0.00 O ATOM 543 CB ASP E 25 106.510 2.938 -11.634 1.00 0.00 C ATOM 544 CG ASP E 25 105.087 3.321 -11.214 1.00 0.00 C ATOM 545 OD1 ASP E 25 104.306 2.421 -10.942 1.00 0.00 O ATOM 546 OD2 ASP E 25 104.798 4.507 -11.168 1.00 0.00 O ATOM 0 H ASP E 25 107.029 4.149 -9.528 1.00 0.00 H new ATOM 0 HA ASP E 25 106.683 1.407 -10.136 1.00 0.00 H new ATOM 0 HB2 ASP E 25 107.051 3.826 -11.962 1.00 0.00 H new ATOM 0 HB3 ASP E 25 106.474 2.254 -12.482 1.00 0.00 H new ATOM 551 N GLN E 26 109.584 2.785 -10.976 1.00 0.00 N ATOM 552 CA GLN E 26 110.953 2.490 -11.379 1.00 0.00 C ATOM 553 C GLN E 26 111.650 1.620 -10.335 1.00 0.00 C ATOM 554 O GLN E 26 112.276 0.616 -10.683 1.00 0.00 O ATOM 555 CB GLN E 26 111.730 3.803 -11.572 1.00 0.00 C ATOM 556 CG GLN E 26 112.028 4.017 -13.061 1.00 0.00 C ATOM 557 CD GLN E 26 113.091 3.024 -13.520 1.00 0.00 C ATOM 558 OE1 GLN E 26 112.890 2.293 -14.489 1.00 0.00 O ATOM 559 NE2 GLN E 26 114.219 2.956 -12.870 1.00 0.00 N ATOM 0 H GLN E 26 109.413 3.766 -10.754 1.00 0.00 H new ATOM 0 HA GLN E 26 110.928 1.941 -12.320 1.00 0.00 H new ATOM 0 HB2 GLN E 26 111.149 4.640 -11.184 1.00 0.00 H new ATOM 0 HB3 GLN E 26 112.661 3.772 -11.006 1.00 0.00 H new ATOM 0 HG2 GLN E 26 111.118 3.887 -13.646 1.00 0.00 H new ATOM 0 HG3 GLN E 26 112.372 5.037 -13.230 1.00 0.00 H new ATOM 0 HE21 GLN E 26 114.382 3.564 -12.067 1.00 0.00 H new ATOM 0 HE22 GLN E 26 114.938 2.295 -13.164 1.00 0.00 H new ATOM 568 N LEU E 27 111.541 2.007 -9.055 1.00 0.00 N ATOM 569 CA LEU E 27 112.173 1.234 -7.980 1.00 0.00 C ATOM 570 C LEU E 27 111.594 -0.180 -7.936 1.00 0.00 C ATOM 571 O LEU E 27 112.331 -1.141 -7.739 1.00 0.00 O ATOM 572 CB LEU E 27 111.999 1.923 -6.612 1.00 0.00 C ATOM 573 CG LEU E 27 112.712 3.293 -6.598 1.00 0.00 C ATOM 574 CD1 LEU E 27 112.509 3.979 -5.241 1.00 0.00 C ATOM 575 CD2 LEU E 27 114.225 3.125 -6.846 1.00 0.00 C ATOM 0 H LEU E 27 111.031 2.834 -8.745 1.00 0.00 H new ATOM 0 HA LEU E 27 113.241 1.178 -8.192 1.00 0.00 H new ATOM 0 HB2 LEU E 27 110.939 2.057 -6.399 1.00 0.00 H new ATOM 0 HB3 LEU E 27 112.405 1.288 -5.825 1.00 0.00 H new ATOM 0 HG LEU E 27 112.282 3.903 -7.392 1.00 0.00 H new ATOM 0 HD11 LEU E 27 113.016 4.944 -5.242 1.00 0.00 H new ATOM 0 HD12 LEU E 27 111.444 4.129 -5.065 1.00 0.00 H new ATOM 0 HD13 LEU E 27 112.923 3.352 -4.451 1.00 0.00 H new ATOM 0 HD21 LEU E 27 114.707 4.103 -6.832 1.00 0.00 H new ATOM 0 HD22 LEU E 27 114.654 2.498 -6.065 1.00 0.00 H new ATOM 0 HD23 LEU E 27 114.385 2.656 -7.817 1.00 0.00 H new ATOM 587 N CYS E 28 110.277 -0.303 -8.151 1.00 0.00 N ATOM 588 CA CYS E 28 109.632 -1.623 -8.156 1.00 0.00 C ATOM 589 C CYS E 28 110.102 -2.427 -9.367 1.00 0.00 C ATOM 590 O CYS E 28 110.399 -3.617 -9.250 1.00 0.00 O ATOM 591 CB CYS E 28 108.103 -1.487 -8.185 1.00 0.00 C ATOM 592 SG CYS E 28 107.470 -1.439 -6.488 1.00 0.00 S ATOM 0 H CYS E 28 109.647 0.481 -8.321 1.00 0.00 H new ATOM 0 HA CYS E 28 109.914 -2.144 -7.241 1.00 0.00 H new ATOM 0 HB2 CYS E 28 107.818 -0.579 -8.717 1.00 0.00 H new ATOM 0 HB3 CYS E 28 107.663 -2.325 -8.725 1.00 0.00 H new ATOM 597 N ALA E 29 110.177 -1.759 -10.524 1.00 0.00 N ATOM 598 CA ALA E 29 110.625 -2.404 -11.761 1.00 0.00 C ATOM 599 C ALA E 29 112.053 -2.911 -11.594 1.00 0.00 C ATOM 600 O ALA E 29 112.378 -4.042 -11.969 1.00 0.00 O ATOM 601 CB ALA E 29 110.579 -1.390 -12.912 1.00 0.00 C ATOM 0 H ALA E 29 109.933 -0.774 -10.628 1.00 0.00 H new ATOM 0 HA ALA E 29 109.968 -3.244 -11.984 1.00 0.00 H new ATOM 0 HB1 ALA E 29 110.912 -1.869 -13.833 1.00 0.00 H new ATOM 0 HB2 ALA E 29 109.558 -1.030 -13.039 1.00 0.00 H new ATOM 0 HB3 ALA E 29 111.234 -0.549 -12.683 1.00 0.00 H new ATOM 607 N PHE E 30 112.888 -2.051 -11.022 1.00 0.00 N ATOM 608 CA PHE E 30 114.290 -2.362 -10.777 1.00 0.00 C ATOM 609 C PHE E 30 114.425 -3.477 -9.733 1.00 0.00 C ATOM 610 O PHE E 30 115.086 -4.480 -9.978 1.00 0.00 O ATOM 611 CB PHE E 30 114.982 -1.076 -10.298 1.00 0.00 C ATOM 612 CG PHE E 30 116.444 -1.319 -9.984 1.00 0.00 C ATOM 613 CD1 PHE E 30 117.348 -1.621 -11.010 1.00 0.00 C ATOM 614 CD2 PHE E 30 116.893 -1.223 -8.662 1.00 0.00 C ATOM 615 CE1 PHE E 30 118.699 -1.827 -10.707 1.00 0.00 C ATOM 616 CE2 PHE E 30 118.243 -1.426 -8.365 1.00 0.00 C ATOM 617 CZ PHE E 30 119.143 -1.727 -9.386 1.00 0.00 C ATOM 0 H PHE E 30 112.611 -1.118 -10.715 1.00 0.00 H new ATOM 0 HA PHE E 30 114.761 -2.721 -11.692 1.00 0.00 H new ATOM 0 HB2 PHE E 30 114.896 -0.307 -11.066 1.00 0.00 H new ATOM 0 HB3 PHE E 30 114.476 -0.698 -9.410 1.00 0.00 H new ATOM 0 HD1 PHE E 30 117.004 -1.695 -12.031 1.00 0.00 H new ATOM 0 HD2 PHE E 30 116.195 -0.992 -7.871 1.00 0.00 H new ATOM 0 HE1 PHE E 30 119.399 -2.063 -11.495 1.00 0.00 H new ATOM 0 HE2 PHE E 30 118.589 -1.350 -7.345 1.00 0.00 H new ATOM 0 HZ PHE E 30 120.186 -1.883 -9.155 1.00 0.00 H new ATOM 627 N ILE E 31 113.789 -3.280 -8.579 1.00 0.00 N ATOM 628 CA ILE E 31 113.830 -4.253 -7.478 1.00 0.00 C ATOM 629 C ILE E 31 113.273 -5.624 -7.894 1.00 0.00 C ATOM 630 O ILE E 31 113.718 -6.652 -7.375 1.00 0.00 O ATOM 631 CB ILE E 31 113.047 -3.668 -6.277 1.00 0.00 C ATOM 632 CG1 ILE E 31 113.881 -2.547 -5.639 1.00 0.00 C ATOM 633 CG2 ILE E 31 112.750 -4.728 -5.205 1.00 0.00 C ATOM 634 CD1 ILE E 31 113.047 -1.799 -4.594 1.00 0.00 C ATOM 0 H ILE E 31 113.233 -2.449 -8.377 1.00 0.00 H new ATOM 0 HA ILE E 31 114.869 -4.424 -7.195 1.00 0.00 H new ATOM 0 HB ILE E 31 112.095 -3.292 -6.652 1.00 0.00 H new ATOM 0 HG12 ILE E 31 114.772 -2.967 -5.172 1.00 0.00 H new ATOM 0 HG13 ILE E 31 114.221 -1.854 -6.408 1.00 0.00 H new ATOM 0 HG21 ILE E 31 112.200 -4.270 -4.383 1.00 0.00 H new ATOM 0 HG22 ILE E 31 112.152 -5.528 -5.641 1.00 0.00 H new ATOM 0 HG23 ILE E 31 113.687 -5.138 -4.830 1.00 0.00 H new ATOM 0 HD11 ILE E 31 113.648 -1.007 -4.148 1.00 0.00 H new ATOM 0 HD12 ILE E 31 112.170 -1.364 -5.072 1.00 0.00 H new ATOM 0 HD13 ILE E 31 112.729 -2.494 -3.817 1.00 0.00 H new ATOM 646 N HIS E 32 112.304 -5.637 -8.813 1.00 0.00 N ATOM 647 CA HIS E 32 111.704 -6.895 -9.264 1.00 0.00 C ATOM 648 C HIS E 32 112.713 -7.724 -10.057 1.00 0.00 C ATOM 649 O HIS E 32 112.892 -8.919 -9.805 1.00 0.00 O ATOM 650 CB HIS E 32 110.478 -6.597 -10.142 1.00 0.00 C ATOM 651 CG HIS E 32 109.744 -7.874 -10.462 1.00 0.00 C ATOM 652 ND1 HIS E 32 108.535 -8.196 -9.870 1.00 0.00 N ATOM 653 CD2 HIS E 32 110.040 -8.918 -11.304 1.00 0.00 C ATOM 654 CE1 HIS E 32 108.148 -9.389 -10.358 1.00 0.00 C ATOM 655 NE2 HIS E 32 109.030 -9.873 -11.237 1.00 0.00 N ATOM 0 H HIS E 32 111.922 -4.801 -9.255 1.00 0.00 H new ATOM 0 HA HIS E 32 111.399 -7.466 -8.387 1.00 0.00 H new ATOM 0 HB2 HIS E 32 109.812 -5.906 -9.626 1.00 0.00 H new ATOM 0 HB3 HIS E 32 110.792 -6.109 -11.064 1.00 0.00 H new ATOM 0 HD2 HIS E 32 110.922 -8.987 -11.924 1.00 0.00 H new ATOM 0 HE1 HIS E 32 107.236 -9.893 -10.074 1.00 0.00 H new ATOM 0 HE2 HIS E 32 108.975 -10.753 -11.749 1.00 0.00 H new ATOM 664 N SER E 33 113.351 -7.072 -11.027 1.00 0.00 N ATOM 665 CA SER E 33 114.333 -7.724 -11.894 1.00 0.00 C ATOM 666 C SER E 33 115.680 -7.928 -11.193 1.00 0.00 C ATOM 667 O SER E 33 116.351 -8.941 -11.409 1.00 0.00 O ATOM 668 CB SER E 33 114.526 -6.864 -13.144 1.00 0.00 C ATOM 669 OG SER E 33 115.315 -7.569 -14.097 1.00 0.00 O ATOM 0 H SER E 33 113.204 -6.084 -11.234 1.00 0.00 H new ATOM 0 HA SER E 33 113.955 -8.712 -12.157 1.00 0.00 H new ATOM 0 HB2 SER E 33 113.558 -6.611 -13.576 1.00 0.00 H new ATOM 0 HB3 SER E 33 115.012 -5.925 -12.879 1.00 0.00 H new ATOM 0 HG SER E 33 115.435 -7.015 -14.896 1.00 0.00 H new ATOM 675 N LEU E 34 116.070 -6.946 -10.375 1.00 0.00 N ATOM 676 CA LEU E 34 117.345 -6.986 -9.647 1.00 0.00 C ATOM 677 C LEU E 34 117.456 -8.250 -8.797 1.00 0.00 C ATOM 678 O LEU E 34 118.509 -8.895 -8.756 1.00 0.00 O ATOM 679 CB LEU E 34 117.439 -5.744 -8.745 1.00 0.00 C ATOM 680 CG LEU E 34 118.802 -5.679 -8.043 1.00 0.00 C ATOM 681 CD1 LEU E 34 119.909 -5.470 -9.088 1.00 0.00 C ATOM 682 CD2 LEU E 34 118.806 -4.508 -7.036 1.00 0.00 C ATOM 0 H LEU E 34 115.517 -6.107 -10.199 1.00 0.00 H new ATOM 0 HA LEU E 34 118.163 -6.994 -10.368 1.00 0.00 H new ATOM 0 HB2 LEU E 34 117.289 -4.844 -9.342 1.00 0.00 H new ATOM 0 HB3 LEU E 34 116.643 -5.769 -8.001 1.00 0.00 H new ATOM 0 HG LEU E 34 118.983 -6.613 -7.511 1.00 0.00 H new ATOM 0 HD11 LEU E 34 120.877 -5.424 -8.589 1.00 0.00 H new ATOM 0 HD12 LEU E 34 119.904 -6.300 -9.794 1.00 0.00 H new ATOM 0 HD13 LEU E 34 119.732 -4.537 -9.624 1.00 0.00 H new ATOM 0 HD21 LEU E 34 119.774 -4.461 -6.537 1.00 0.00 H new ATOM 0 HD22 LEU E 34 118.625 -3.572 -7.565 1.00 0.00 H new ATOM 0 HD23 LEU E 34 118.022 -4.663 -6.294 1.00 0.00 H new ATOM 694 N HIS E 35 116.359 -8.591 -8.126 1.00 0.00 N ATOM 695 CA HIS E 35 116.316 -9.773 -7.272 1.00 0.00 C ATOM 696 C HIS E 35 116.222 -11.055 -8.109 1.00 0.00 C ATOM 697 O HIS E 35 116.835 -12.071 -7.767 1.00 0.00 O ATOM 698 CB HIS E 35 115.111 -9.677 -6.326 1.00 0.00 C ATOM 699 CG HIS E 35 115.322 -10.581 -5.135 1.00 0.00 C ATOM 700 ND1 HIS E 35 115.779 -11.884 -5.267 1.00 0.00 N ATOM 701 CD2 HIS E 35 115.147 -10.383 -3.787 1.00 0.00 C ATOM 702 CE1 HIS E 35 115.861 -12.413 -4.033 1.00 0.00 C ATOM 703 NE2 HIS E 35 115.487 -11.541 -3.094 1.00 0.00 N ATOM 0 H HIS E 35 115.486 -8.064 -8.158 1.00 0.00 H new ATOM 0 HA HIS E 35 117.237 -9.815 -6.691 1.00 0.00 H new ATOM 0 HB2 HIS E 35 114.979 -8.647 -5.994 1.00 0.00 H new ATOM 0 HB3 HIS E 35 114.200 -9.961 -6.853 1.00 0.00 H new ATOM 0 HD1 HIS E 35 116.011 -12.356 -6.141 1.00 0.00 H new ATOM 0 HD2 HIS E 35 114.798 -9.467 -3.333 1.00 0.00 H new ATOM 0 HE1 HIS E 35 116.190 -13.421 -3.827 1.00 0.00 H new ATOM 712 N ASP E 36 115.436 -11.001 -9.192 1.00 0.00 N ATOM 713 CA ASP E 36 115.241 -12.162 -10.069 1.00 0.00 C ATOM 714 C ASP E 36 116.561 -12.634 -10.690 1.00 0.00 C ATOM 715 O ASP E 36 116.796 -13.840 -10.806 1.00 0.00 O ATOM 716 CB ASP E 36 114.245 -11.813 -11.180 1.00 0.00 C ATOM 717 CG ASP E 36 113.841 -13.079 -11.940 1.00 0.00 C ATOM 718 OD1 ASP E 36 112.937 -13.760 -11.479 1.00 0.00 O ATOM 719 OD2 ASP E 36 114.439 -13.351 -12.968 1.00 0.00 O ATOM 0 H ASP E 36 114.926 -10.167 -9.481 1.00 0.00 H new ATOM 0 HA ASP E 36 114.848 -12.975 -9.459 1.00 0.00 H new ATOM 0 HB2 ASP E 36 113.362 -11.339 -10.752 1.00 0.00 H new ATOM 0 HB3 ASP E 36 114.691 -11.094 -11.867 1.00 0.00 H new ATOM 724 N ASP E 37 117.409 -11.677 -11.093 1.00 0.00 N ATOM 725 CA ASP E 37 118.705 -11.993 -11.713 1.00 0.00 C ATOM 726 C ASP E 37 119.848 -11.287 -10.961 1.00 0.00 C ATOM 727 O ASP E 37 120.298 -10.211 -11.372 1.00 0.00 O ATOM 728 CB ASP E 37 118.694 -11.558 -13.190 1.00 0.00 C ATOM 729 CG ASP E 37 117.772 -12.469 -14.001 1.00 0.00 C ATOM 730 OD1 ASP E 37 118.172 -13.590 -14.277 1.00 0.00 O ATOM 731 OD2 ASP E 37 116.681 -12.035 -14.338 1.00 0.00 O ATOM 0 H ASP E 37 117.222 -10.679 -11.001 1.00 0.00 H new ATOM 0 HA ASP E 37 118.869 -13.069 -11.657 1.00 0.00 H new ATOM 0 HB2 ASP E 37 118.358 -10.524 -13.270 1.00 0.00 H new ATOM 0 HB3 ASP E 37 119.705 -11.597 -13.596 1.00 0.00 H new ATOM 736 N PRO E 38 120.321 -11.862 -9.867 1.00 0.00 N ATOM 737 CA PRO E 38 121.424 -11.259 -9.054 1.00 0.00 C ATOM 738 C PRO E 38 122.776 -11.316 -9.774 1.00 0.00 C ATOM 739 O PRO E 38 123.633 -10.453 -9.567 1.00 0.00 O ATOM 740 CB PRO E 38 121.436 -12.091 -7.768 1.00 0.00 C ATOM 741 CG PRO E 38 120.838 -13.409 -8.139 1.00 0.00 C ATOM 742 CD PRO E 38 119.862 -13.144 -9.289 1.00 0.00 C ATOM 0 HA PRO E 38 121.259 -10.198 -8.867 1.00 0.00 H new ATOM 0 HB2 PRO E 38 122.451 -12.213 -7.389 1.00 0.00 H new ATOM 0 HB3 PRO E 38 120.858 -11.606 -6.981 1.00 0.00 H new ATOM 0 HG2 PRO E 38 121.612 -14.113 -8.444 1.00 0.00 H new ATOM 0 HG3 PRO E 38 120.321 -13.852 -7.288 1.00 0.00 H new ATOM 0 HD2 PRO E 38 119.889 -13.946 -10.027 1.00 0.00 H new ATOM 0 HD3 PRO E 38 118.835 -13.074 -8.931 1.00 0.00 H new ATOM 750 N SER E 39 122.955 -12.331 -10.623 1.00 0.00 N ATOM 751 CA SER E 39 124.202 -12.488 -11.379 1.00 0.00 C ATOM 752 C SER E 39 124.424 -11.295 -12.312 1.00 0.00 C ATOM 753 O SER E 39 125.560 -10.856 -12.513 1.00 0.00 O ATOM 754 CB SER E 39 124.160 -13.786 -12.192 1.00 0.00 C ATOM 755 OG SER E 39 122.925 -13.872 -12.892 1.00 0.00 O ATOM 0 H SER E 39 122.258 -13.053 -10.804 1.00 0.00 H new ATOM 0 HA SER E 39 125.031 -12.532 -10.672 1.00 0.00 H new ATOM 0 HB2 SER E 39 124.991 -13.812 -12.897 1.00 0.00 H new ATOM 0 HB3 SER E 39 124.275 -14.645 -11.531 1.00 0.00 H new ATOM 0 HG SER E 39 122.901 -14.702 -13.413 1.00 0.00 H new ATOM 761 N GLN E 40 123.323 -10.778 -12.865 1.00 0.00 N ATOM 762 CA GLN E 40 123.360 -9.629 -13.773 1.00 0.00 C ATOM 763 C GLN E 40 123.112 -8.322 -13.009 1.00 0.00 C ATOM 764 O GLN E 40 122.967 -7.259 -13.621 1.00 0.00 O ATOM 765 CB GLN E 40 122.272 -9.799 -14.848 1.00 0.00 C ATOM 766 CG GLN E 40 122.750 -10.745 -15.953 1.00 0.00 C ATOM 767 CD GLN E 40 122.765 -12.182 -15.447 1.00 0.00 C ATOM 768 OE1 GLN E 40 121.719 -12.727 -15.100 1.00 0.00 O ATOM 769 NE2 GLN E 40 123.894 -12.832 -15.378 1.00 0.00 N ATOM 0 H GLN E 40 122.385 -11.142 -12.697 1.00 0.00 H new ATOM 0 HA GLN E 40 124.346 -9.582 -14.235 1.00 0.00 H new ATOM 0 HB2 GLN E 40 121.362 -10.192 -14.394 1.00 0.00 H new ATOM 0 HB3 GLN E 40 122.021 -8.828 -15.276 1.00 0.00 H new ATOM 0 HG2 GLN E 40 122.094 -10.664 -16.820 1.00 0.00 H new ATOM 0 HG3 GLN E 40 123.749 -10.457 -16.281 1.00 0.00 H new ATOM 0 HE21 GLN E 40 124.761 -12.379 -15.666 1.00 0.00 H new ATOM 0 HE22 GLN E 40 123.909 -13.793 -15.036 1.00 0.00 H new ATOM 778 N SER E 41 123.047 -8.412 -11.672 1.00 0.00 N ATOM 779 CA SER E 41 122.781 -7.242 -10.826 1.00 0.00 C ATOM 780 C SER E 41 123.664 -6.047 -11.180 1.00 0.00 C ATOM 781 O SER E 41 123.173 -4.923 -11.209 1.00 0.00 O ATOM 782 CB SER E 41 122.988 -7.594 -9.353 1.00 0.00 C ATOM 783 OG SER E 41 122.598 -6.488 -8.552 1.00 0.00 O ATOM 0 H SER E 41 123.175 -9.282 -11.155 1.00 0.00 H new ATOM 0 HA SER E 41 121.744 -6.958 -11.006 1.00 0.00 H new ATOM 0 HB2 SER E 41 122.401 -8.474 -9.091 1.00 0.00 H new ATOM 0 HB3 SER E 41 124.033 -7.842 -9.169 1.00 0.00 H new ATOM 0 HG SER E 41 123.283 -5.789 -8.603 1.00 0.00 H new ATOM 789 N ALA E 42 124.953 -6.285 -11.437 1.00 0.00 N ATOM 790 CA ALA E 42 125.868 -5.187 -11.769 1.00 0.00 C ATOM 791 C ALA E 42 125.434 -4.479 -13.052 1.00 0.00 C ATOM 792 O ALA E 42 125.358 -3.246 -13.088 1.00 0.00 O ATOM 793 CB ALA E 42 127.295 -5.716 -11.927 1.00 0.00 C ATOM 0 H ALA E 42 125.382 -7.210 -11.423 1.00 0.00 H new ATOM 0 HA ALA E 42 125.839 -4.467 -10.951 1.00 0.00 H new ATOM 0 HB1 ALA E 42 127.964 -4.891 -12.173 1.00 0.00 H new ATOM 0 HB2 ALA E 42 127.617 -6.178 -10.994 1.00 0.00 H new ATOM 0 HB3 ALA E 42 127.322 -6.456 -12.727 1.00 0.00 H new ATOM 799 N ASN E 43 125.139 -5.261 -14.097 1.00 0.00 N ATOM 800 CA ASN E 43 124.703 -4.688 -15.370 1.00 0.00 C ATOM 801 C ASN E 43 123.374 -3.968 -15.196 1.00 0.00 C ATOM 802 O ASN E 43 123.215 -2.827 -15.644 1.00 0.00 O ATOM 803 CB ASN E 43 124.555 -5.795 -16.418 1.00 0.00 C ATOM 804 CG ASN E 43 125.929 -6.223 -16.911 1.00 0.00 C ATOM 805 OD1 ASN E 43 126.364 -7.348 -16.665 1.00 0.00 O ATOM 806 ND2 ASN E 43 126.643 -5.380 -17.605 1.00 0.00 N ATOM 0 H ASN E 43 125.194 -6.279 -14.085 1.00 0.00 H new ATOM 0 HA ASN E 43 125.453 -3.972 -15.705 1.00 0.00 H new ATOM 0 HB2 ASN E 43 124.031 -6.648 -15.988 1.00 0.00 H new ATOM 0 HB3 ASN E 43 123.953 -5.439 -17.254 1.00 0.00 H new ATOM 0 HD21 ASN E 43 127.565 -5.652 -17.946 1.00 0.00 H new ATOM 0 HD22 ASN E 43 126.279 -4.449 -17.807 1.00 0.00 H new ATOM 813 N LEU E 44 122.434 -4.647 -14.530 1.00 0.00 N ATOM 814 CA LEU E 44 121.105 -4.092 -14.275 1.00 0.00 C ATOM 815 C LEU E 44 121.209 -2.793 -13.485 1.00 0.00 C ATOM 816 O LEU E 44 120.481 -1.834 -13.759 1.00 0.00 O ATOM 817 CB LEU E 44 120.255 -5.103 -13.488 1.00 0.00 C ATOM 818 CG LEU E 44 120.011 -6.369 -14.331 1.00 0.00 C ATOM 819 CD1 LEU E 44 119.503 -7.499 -13.427 1.00 0.00 C ATOM 820 CD2 LEU E 44 118.964 -6.075 -15.417 1.00 0.00 C ATOM 0 H LEU E 44 122.572 -5.586 -14.157 1.00 0.00 H new ATOM 0 HA LEU E 44 120.630 -3.885 -15.234 1.00 0.00 H new ATOM 0 HB2 LEU E 44 120.761 -5.368 -12.559 1.00 0.00 H new ATOM 0 HB3 LEU E 44 119.302 -4.651 -13.214 1.00 0.00 H new ATOM 0 HG LEU E 44 120.946 -6.672 -14.802 1.00 0.00 H new ATOM 0 HD11 LEU E 44 119.331 -8.394 -14.025 1.00 0.00 H new ATOM 0 HD12 LEU E 44 120.247 -7.713 -12.659 1.00 0.00 H new ATOM 0 HD13 LEU E 44 118.570 -7.194 -12.953 1.00 0.00 H new ATOM 0 HD21 LEU E 44 118.794 -6.973 -16.011 1.00 0.00 H new ATOM 0 HD22 LEU E 44 118.029 -5.768 -14.948 1.00 0.00 H new ATOM 0 HD23 LEU E 44 119.325 -5.275 -16.063 1.00 0.00 H new ATOM 832 N LEU E 45 122.123 -2.766 -12.509 1.00 0.00 N ATOM 833 CA LEU E 45 122.317 -1.570 -11.694 1.00 0.00 C ATOM 834 C LEU E 45 122.820 -0.435 -12.565 1.00 0.00 C ATOM 835 O LEU E 45 122.429 0.716 -12.380 1.00 0.00 O ATOM 836 CB LEU E 45 123.327 -1.823 -10.559 1.00 0.00 C ATOM 837 CG LEU E 45 122.844 -1.214 -9.228 1.00 0.00 C ATOM 838 CD1 LEU E 45 124.018 -1.183 -8.245 1.00 0.00 C ATOM 839 CD2 LEU E 45 122.282 0.216 -9.435 1.00 0.00 C ATOM 0 H LEU E 45 122.731 -3.549 -12.269 1.00 0.00 H new ATOM 0 HA LEU E 45 121.357 -1.306 -11.250 1.00 0.00 H new ATOM 0 HB2 LEU E 45 123.477 -2.896 -10.436 1.00 0.00 H new ATOM 0 HB3 LEU E 45 124.293 -1.395 -10.827 1.00 0.00 H new ATOM 0 HG LEU E 45 122.038 -1.829 -8.829 1.00 0.00 H new ATOM 0 HD11 LEU E 45 123.689 -0.754 -7.299 1.00 0.00 H new ATOM 0 HD12 LEU E 45 124.379 -2.198 -8.077 1.00 0.00 H new ATOM 0 HD13 LEU E 45 124.823 -0.575 -8.659 1.00 0.00 H new ATOM 0 HD21 LEU E 45 121.950 0.618 -8.478 1.00 0.00 H new ATOM 0 HD22 LEU E 45 123.061 0.857 -9.847 1.00 0.00 H new ATOM 0 HD23 LEU E 45 121.439 0.179 -10.126 1.00 0.00 H new ATOM 851 N ALA E 46 123.680 -0.777 -13.530 1.00 0.00 N ATOM 852 CA ALA E 46 124.226 0.216 -14.449 1.00 0.00 C ATOM 853 C ALA E 46 123.081 0.984 -15.100 1.00 0.00 C ATOM 854 O ALA E 46 123.159 2.196 -15.286 1.00 0.00 O ATOM 855 CB ALA E 46 125.066 -0.480 -15.529 1.00 0.00 C ATOM 0 H ALA E 46 124.009 -1.729 -13.691 1.00 0.00 H new ATOM 0 HA ALA E 46 124.862 0.909 -13.898 1.00 0.00 H new ATOM 0 HB1 ALA E 46 125.471 0.267 -16.212 1.00 0.00 H new ATOM 0 HB2 ALA E 46 125.885 -1.024 -15.059 1.00 0.00 H new ATOM 0 HB3 ALA E 46 124.439 -1.178 -16.084 1.00 0.00 H new ATOM 861 N GLU E 47 122.011 0.252 -15.412 1.00 0.00 N ATOM 862 CA GLU E 47 120.821 0.837 -16.028 1.00 0.00 C ATOM 863 C GLU E 47 120.096 1.731 -15.045 1.00 0.00 C ATOM 864 O GLU E 47 119.596 2.794 -15.413 1.00 0.00 O ATOM 865 CB GLU E 47 119.851 -0.263 -16.460 1.00 0.00 C ATOM 866 CG GLU E 47 120.633 -1.410 -17.076 1.00 0.00 C ATOM 867 CD GLU E 47 119.696 -2.356 -17.830 1.00 0.00 C ATOM 868 OE1 GLU E 47 118.888 -3.001 -17.181 1.00 0.00 O ATOM 869 OE2 GLU E 47 119.796 -2.419 -19.045 1.00 0.00 O ATOM 0 H GLU E 47 121.945 -0.752 -15.247 1.00 0.00 H new ATOM 0 HA GLU E 47 121.149 1.416 -16.891 1.00 0.00 H new ATOM 0 HB2 GLU E 47 119.280 -0.617 -15.602 1.00 0.00 H new ATOM 0 HB3 GLU E 47 119.134 0.131 -17.180 1.00 0.00 H new ATOM 0 HG2 GLU E 47 121.388 -1.018 -17.757 1.00 0.00 H new ATOM 0 HG3 GLU E 47 121.161 -1.958 -16.296 1.00 0.00 H new ATOM 876 N ALA E 48 120.031 1.286 -13.790 1.00 0.00 N ATOM 877 CA ALA E 48 119.353 2.056 -12.778 1.00 0.00 C ATOM 878 C ALA E 48 120.157 3.305 -12.482 1.00 0.00 C ATOM 879 O ALA E 48 119.599 4.353 -12.159 1.00 0.00 O ATOM 880 CB ALA E 48 119.129 1.239 -11.511 1.00 0.00 C ATOM 0 H ALA E 48 120.437 0.408 -13.465 1.00 0.00 H new ATOM 0 HA ALA E 48 118.369 2.339 -13.152 1.00 0.00 H new ATOM 0 HB1 ALA E 48 118.615 1.851 -10.769 1.00 0.00 H new ATOM 0 HB2 ALA E 48 118.521 0.365 -11.744 1.00 0.00 H new ATOM 0 HB3 ALA E 48 120.090 0.916 -11.112 1.00 0.00 H new ATOM 886 N LYS E 49 121.483 3.191 -12.632 1.00 0.00 N ATOM 887 CA LYS E 49 122.363 4.328 -12.423 1.00 0.00 C ATOM 888 C LYS E 49 122.091 5.343 -13.532 1.00 0.00 C ATOM 889 O LYS E 49 122.015 6.548 -13.285 1.00 0.00 O ATOM 890 CB LYS E 49 123.839 3.889 -12.422 1.00 0.00 C ATOM 891 CG LYS E 49 124.507 4.239 -11.074 1.00 0.00 C ATOM 892 CD LYS E 49 124.236 3.131 -10.050 1.00 0.00 C ATOM 893 CE LYS E 49 125.195 1.952 -10.271 1.00 0.00 C ATOM 894 NZ LYS E 49 126.588 2.358 -9.912 1.00 0.00 N ATOM 0 H LYS E 49 121.958 2.328 -12.895 1.00 0.00 H new ATOM 0 HA LYS E 49 122.167 4.779 -11.450 1.00 0.00 H new ATOM 0 HB2 LYS E 49 123.905 2.816 -12.599 1.00 0.00 H new ATOM 0 HB3 LYS E 49 124.371 4.380 -13.237 1.00 0.00 H new ATOM 0 HG2 LYS E 49 125.581 4.362 -11.212 1.00 0.00 H new ATOM 0 HG3 LYS E 49 124.122 5.189 -10.704 1.00 0.00 H new ATOM 0 HD2 LYS E 49 124.358 3.523 -9.040 1.00 0.00 H new ATOM 0 HD3 LYS E 49 123.204 2.790 -10.138 1.00 0.00 H new ATOM 0 HE2 LYS E 49 124.886 1.101 -9.663 1.00 0.00 H new ATOM 0 HE3 LYS E 49 125.157 1.631 -11.312 1.00 0.00 H new ATOM 0 HZ1 LYS E 49 127.185 2.342 -10.764 1.00 0.00 H new ATOM 0 HZ2 LYS E 49 126.578 3.319 -9.514 1.00 0.00 H new ATOM 0 HZ3 LYS E 49 126.972 1.696 -9.208 1.00 0.00 H new ATOM 908 N LYS E 50 121.868 4.824 -14.753 1.00 0.00 N ATOM 909 CA LYS E 50 121.514 5.678 -15.886 1.00 0.00 C ATOM 910 C LYS E 50 120.172 6.336 -15.572 1.00 0.00 C ATOM 911 O LYS E 50 119.974 7.517 -15.842 1.00 0.00 O ATOM 912 CB LYS E 50 121.403 4.864 -17.188 1.00 0.00 C ATOM 913 CG LYS E 50 122.788 4.390 -17.645 1.00 0.00 C ATOM 914 CD LYS E 50 122.654 3.600 -18.958 1.00 0.00 C ATOM 915 CE LYS E 50 123.926 2.782 -19.212 1.00 0.00 C ATOM 916 NZ LYS E 50 124.015 2.436 -20.660 1.00 0.00 N ATOM 0 H LYS E 50 121.927 3.830 -14.972 1.00 0.00 H new ATOM 0 HA LYS E 50 122.292 6.427 -16.034 1.00 0.00 H new ATOM 0 HB2 LYS E 50 120.751 4.004 -17.032 1.00 0.00 H new ATOM 0 HB3 LYS E 50 120.945 5.474 -17.967 1.00 0.00 H new ATOM 0 HG2 LYS E 50 123.447 5.246 -17.789 1.00 0.00 H new ATOM 0 HG3 LYS E 50 123.241 3.764 -16.876 1.00 0.00 H new ATOM 0 HD2 LYS E 50 121.790 2.937 -18.906 1.00 0.00 H new ATOM 0 HD3 LYS E 50 122.481 4.285 -19.788 1.00 0.00 H new ATOM 0 HE2 LYS E 50 124.804 3.352 -18.909 1.00 0.00 H new ATOM 0 HE3 LYS E 50 123.913 1.873 -18.610 1.00 0.00 H new ATOM 0 HZ1 LYS E 50 124.878 1.881 -20.832 1.00 0.00 H new ATOM 0 HZ2 LYS E 50 123.183 1.876 -20.935 1.00 0.00 H new ATOM 0 HZ3 LYS E 50 124.047 3.309 -21.224 1.00 0.00 H new ATOM 930 N LEU E 51 119.274 5.554 -14.950 1.00 0.00 N ATOM 931 CA LEU E 51 117.962 6.060 -14.544 1.00 0.00 C ATOM 932 C LEU E 51 118.148 7.153 -13.502 1.00 0.00 C ATOM 933 O LEU E 51 117.429 8.154 -13.510 1.00 0.00 O ATOM 934 CB LEU E 51 117.112 4.926 -13.943 1.00 0.00 C ATOM 935 CG LEU E 51 116.087 4.352 -14.945 1.00 0.00 C ATOM 936 CD1 LEU E 51 114.798 5.194 -14.921 1.00 0.00 C ATOM 937 CD2 LEU E 51 116.651 4.297 -16.380 1.00 0.00 C ATOM 0 H LEU E 51 119.436 4.574 -14.720 1.00 0.00 H new ATOM 0 HA LEU E 51 117.450 6.459 -15.420 1.00 0.00 H new ATOM 0 HB2 LEU E 51 117.770 4.126 -13.604 1.00 0.00 H new ATOM 0 HB3 LEU E 51 116.585 5.299 -13.065 1.00 0.00 H new ATOM 0 HG LEU E 51 115.864 3.330 -14.638 1.00 0.00 H new ATOM 0 HD11 LEU E 51 114.081 4.782 -15.631 1.00 0.00 H new ATOM 0 HD12 LEU E 51 114.369 5.174 -13.919 1.00 0.00 H new ATOM 0 HD13 LEU E 51 115.030 6.223 -15.196 1.00 0.00 H new ATOM 0 HD21 LEU E 51 115.897 3.887 -17.052 1.00 0.00 H new ATOM 0 HD22 LEU E 51 116.918 5.303 -16.705 1.00 0.00 H new ATOM 0 HD23 LEU E 51 117.537 3.663 -16.399 1.00 0.00 H new ATOM 949 N ASN E 52 119.132 6.950 -12.608 1.00 0.00 N ATOM 950 CA ASN E 52 119.430 7.926 -11.560 1.00 0.00 C ATOM 951 C ASN E 52 119.692 9.283 -12.216 1.00 0.00 C ATOM 952 O ASN E 52 119.227 10.322 -11.739 1.00 0.00 O ATOM 953 CB ASN E 52 120.655 7.469 -10.737 1.00 0.00 C ATOM 954 CG ASN E 52 120.779 8.313 -9.467 1.00 0.00 C ATOM 955 OD1 ASN E 52 119.876 8.321 -8.632 1.00 0.00 O ATOM 956 ND2 ASN E 52 121.852 9.029 -9.271 1.00 0.00 N ATOM 0 H ASN E 52 119.728 6.122 -12.595 1.00 0.00 H new ATOM 0 HA ASN E 52 118.584 8.011 -10.878 1.00 0.00 H new ATOM 0 HB2 ASN E 52 120.554 6.416 -10.475 1.00 0.00 H new ATOM 0 HB3 ASN E 52 121.561 7.563 -11.336 1.00 0.00 H new ATOM 0 HD21 ASN E 52 121.941 9.594 -8.426 1.00 0.00 H new ATOM 0 HD22 ASN E 52 122.602 9.024 -9.962 1.00 0.00 H new ATOM 963 N ASP E 53 120.410 9.237 -13.344 1.00 0.00 N ATOM 964 CA ASP E 53 120.717 10.432 -14.130 1.00 0.00 C ATOM 965 C ASP E 53 119.524 10.818 -15.028 1.00 0.00 C ATOM 966 O ASP E 53 119.311 11.996 -15.326 1.00 0.00 O ATOM 967 CB ASP E 53 121.955 10.174 -15.000 1.00 0.00 C ATOM 968 CG ASP E 53 122.373 11.460 -15.717 1.00 0.00 C ATOM 969 OD1 ASP E 53 123.074 12.254 -15.111 1.00 0.00 O ATOM 970 OD2 ASP E 53 121.982 11.634 -16.862 1.00 0.00 O ATOM 0 H ASP E 53 120.791 8.375 -13.734 1.00 0.00 H new ATOM 0 HA ASP E 53 120.915 11.256 -13.444 1.00 0.00 H new ATOM 0 HB2 ASP E 53 122.775 9.811 -14.380 1.00 0.00 H new ATOM 0 HB3 ASP E 53 121.739 9.395 -15.731 1.00 0.00 H new ATOM 975 N ALA E 54 118.778 9.801 -15.481 1.00 0.00 N ATOM 976 CA ALA E 54 117.626 9.994 -16.374 1.00 0.00 C ATOM 977 C ALA E 54 116.477 10.739 -15.692 1.00 0.00 C ATOM 978 O ALA E 54 115.751 11.492 -16.346 1.00 0.00 O ATOM 979 CB ALA E 54 117.111 8.630 -16.866 1.00 0.00 C ATOM 0 H ALA E 54 118.954 8.826 -15.240 1.00 0.00 H new ATOM 0 HA ALA E 54 117.971 10.600 -17.212 1.00 0.00 H new ATOM 0 HB1 ALA E 54 116.258 8.780 -17.527 1.00 0.00 H new ATOM 0 HB2 ALA E 54 117.904 8.116 -17.409 1.00 0.00 H new ATOM 0 HB3 ALA E 54 116.806 8.026 -16.011 1.00 0.00 H new ATOM 985 N GLN E 55 116.308 10.510 -14.385 1.00 0.00 N ATOM 986 CA GLN E 55 115.228 11.149 -13.619 1.00 0.00 C ATOM 987 C GLN E 55 115.792 12.154 -12.619 1.00 0.00 C ATOM 988 O GLN E 55 115.068 12.693 -11.776 1.00 0.00 O ATOM 989 CB GLN E 55 114.394 10.080 -12.901 1.00 0.00 C ATOM 990 CG GLN E 55 113.802 9.126 -13.954 1.00 0.00 C ATOM 991 CD GLN E 55 112.729 8.209 -13.354 1.00 0.00 C ATOM 992 OE1 GLN E 55 112.141 7.399 -14.071 1.00 0.00 O ATOM 993 NE2 GLN E 55 112.427 8.286 -12.087 1.00 0.00 N ATOM 0 H GLN E 55 116.902 9.889 -13.835 1.00 0.00 H new ATOM 0 HA GLN E 55 114.584 11.692 -14.311 1.00 0.00 H new ATOM 0 HB2 GLN E 55 115.015 9.527 -12.196 1.00 0.00 H new ATOM 0 HB3 GLN E 55 113.596 10.548 -12.324 1.00 0.00 H new ATOM 0 HG2 GLN E 55 113.369 9.707 -14.768 1.00 0.00 H new ATOM 0 HG3 GLN E 55 114.599 8.520 -14.384 1.00 0.00 H new ATOM 0 HE21 GLN E 55 112.910 8.955 -11.487 1.00 0.00 H new ATOM 0 HE22 GLN E 55 111.708 7.677 -11.696 1.00 0.00 H new ATOM 1002 N ALA E 56 117.096 12.382 -12.732 1.00 0.00 N ATOM 1003 CA ALA E 56 117.819 13.291 -11.872 1.00 0.00 C ATOM 1004 C ALA E 56 117.216 14.696 -11.882 1.00 0.00 C ATOM 1005 O ALA E 56 116.464 15.062 -12.790 1.00 0.00 O ATOM 1006 CB ALA E 56 119.281 13.335 -12.320 1.00 0.00 C ATOM 0 H ALA E 56 117.682 11.931 -13.435 1.00 0.00 H new ATOM 0 HA ALA E 56 117.749 12.926 -10.847 1.00 0.00 H new ATOM 0 HB1 ALA E 56 119.838 14.018 -11.678 1.00 0.00 H new ATOM 0 HB2 ALA E 56 119.713 12.337 -12.249 1.00 0.00 H new ATOM 0 HB3 ALA E 56 119.335 13.681 -13.352 1.00 0.00 H new TER 1012 ALA E 56 ATOM 1013 N GLY F 14 120.529 10.739 8.840 1.00 0.00 N ATOM 1014 CA GLY F 14 119.603 10.221 9.852 1.00 0.00 C ATOM 1015 C GLY F 14 119.762 8.720 10.032 1.00 0.00 C ATOM 1016 O GLY F 14 120.751 8.127 9.589 1.00 0.00 O ATOM 0 HA2 GLY F 14 119.782 10.724 10.802 1.00 0.00 H new ATOM 0 HA3 GLY F 14 118.578 10.447 9.559 1.00 0.00 H new ATOM 1020 N GLU F 15 118.773 8.113 10.687 1.00 0.00 N ATOM 1021 CA GLU F 15 118.788 6.683 10.932 1.00 0.00 C ATOM 1022 C GLU F 15 118.674 5.937 9.619 1.00 0.00 C ATOM 1023 O GLU F 15 117.964 6.370 8.709 1.00 0.00 O ATOM 1024 CB GLU F 15 117.613 6.282 11.821 1.00 0.00 C ATOM 1025 CG GLU F 15 117.859 4.884 12.390 1.00 0.00 C ATOM 1026 CD GLU F 15 116.683 4.450 13.272 1.00 0.00 C ATOM 1027 OE1 GLU F 15 115.599 4.272 12.737 1.00 0.00 O ATOM 1028 OE2 GLU F 15 116.886 4.292 14.466 1.00 0.00 O ATOM 0 H GLU F 15 117.953 8.595 11.055 1.00 0.00 H new ATOM 0 HA GLU F 15 119.725 6.431 11.429 1.00 0.00 H new ATOM 0 HB2 GLU F 15 117.495 7.001 12.632 1.00 0.00 H new ATOM 0 HB3 GLU F 15 116.687 6.295 11.246 1.00 0.00 H new ATOM 0 HG2 GLU F 15 117.993 4.172 11.576 1.00 0.00 H new ATOM 0 HG3 GLU F 15 118.780 4.879 12.973 1.00 0.00 H new ATOM 1035 N ILE F 16 119.366 4.812 9.538 1.00 0.00 N ATOM 1036 CA ILE F 16 119.340 3.985 8.343 1.00 0.00 C ATOM 1037 C ILE F 16 118.750 2.614 8.664 1.00 0.00 C ATOM 1038 O ILE F 16 118.976 2.065 9.746 1.00 0.00 O ATOM 1039 CB ILE F 16 120.752 3.833 7.790 1.00 0.00 C ATOM 1040 CG1 ILE F 16 121.314 5.210 7.378 1.00 0.00 C ATOM 1041 CG2 ILE F 16 120.716 2.898 6.572 1.00 0.00 C ATOM 1042 CD1 ILE F 16 122.781 5.074 6.947 1.00 0.00 C ATOM 0 H ILE F 16 119.954 4.450 10.288 1.00 0.00 H new ATOM 0 HA ILE F 16 118.714 4.466 7.592 1.00 0.00 H new ATOM 0 HB ILE F 16 121.398 3.410 8.559 1.00 0.00 H new ATOM 0 HG12 ILE F 16 120.723 5.622 6.560 1.00 0.00 H new ATOM 0 HG13 ILE F 16 121.235 5.908 8.212 1.00 0.00 H new ATOM 0 HG21 ILE F 16 121.723 2.784 6.171 1.00 0.00 H new ATOM 0 HG22 ILE F 16 120.333 1.923 6.873 1.00 0.00 H new ATOM 0 HG23 ILE F 16 120.066 3.322 5.807 1.00 0.00 H new ATOM 0 HD11 ILE F 16 123.168 6.051 6.658 1.00 0.00 H new ATOM 0 HD12 ILE F 16 123.369 4.682 7.777 1.00 0.00 H new ATOM 0 HD13 ILE F 16 122.849 4.392 6.099 1.00 0.00 H new ATOM 1054 N VAL F 17 117.984 2.089 7.709 1.00 0.00 N ATOM 1055 CA VAL F 17 117.324 0.794 7.854 1.00 0.00 C ATOM 1056 C VAL F 17 117.603 -0.089 6.636 1.00 0.00 C ATOM 1057 O VAL F 17 117.280 0.292 5.510 1.00 0.00 O ATOM 1058 CB VAL F 17 115.819 1.064 7.994 1.00 0.00 C ATOM 1059 CG1 VAL F 17 114.992 -0.198 7.699 1.00 0.00 C ATOM 1060 CG2 VAL F 17 115.522 1.556 9.420 1.00 0.00 C ATOM 0 H VAL F 17 117.804 2.548 6.816 1.00 0.00 H new ATOM 0 HA VAL F 17 117.701 0.266 8.730 1.00 0.00 H new ATOM 0 HB VAL F 17 115.538 1.827 7.268 1.00 0.00 H new ATOM 0 HG11 VAL F 17 113.931 0.029 7.807 1.00 0.00 H new ATOM 0 HG12 VAL F 17 115.190 -0.533 6.681 1.00 0.00 H new ATOM 0 HG13 VAL F 17 115.268 -0.986 8.400 1.00 0.00 H new ATOM 0 HG21 VAL F 17 114.454 1.749 9.523 1.00 0.00 H new ATOM 0 HG22 VAL F 17 115.824 0.794 10.138 1.00 0.00 H new ATOM 0 HG23 VAL F 17 116.077 2.475 9.611 1.00 0.00 H new ATOM 1070 N TYR F 18 118.183 -1.274 6.878 1.00 0.00 N ATOM 1071 CA TYR F 18 118.495 -2.221 5.799 1.00 0.00 C ATOM 1072 C TYR F 18 117.439 -3.315 5.712 1.00 0.00 C ATOM 1073 O TYR F 18 116.917 -3.776 6.732 1.00 0.00 O ATOM 1074 CB TYR F 18 119.887 -2.852 6.017 1.00 0.00 C ATOM 1075 CG TYR F 18 120.941 -2.012 5.317 1.00 0.00 C ATOM 1076 CD1 TYR F 18 121.043 -0.648 5.605 1.00 0.00 C ATOM 1077 CD2 TYR F 18 121.797 -2.586 4.360 1.00 0.00 C ATOM 1078 CE1 TYR F 18 121.991 0.138 4.947 1.00 0.00 C ATOM 1079 CE2 TYR F 18 122.743 -1.793 3.702 1.00 0.00 C ATOM 1080 CZ TYR F 18 122.840 -0.433 3.995 1.00 0.00 C ATOM 1081 OH TYR F 18 123.772 0.349 3.345 1.00 0.00 O ATOM 0 H TYR F 18 118.445 -1.598 7.809 1.00 0.00 H new ATOM 0 HA TYR F 18 118.500 -1.668 4.860 1.00 0.00 H new ATOM 0 HB2 TYR F 18 120.106 -2.915 7.083 1.00 0.00 H new ATOM 0 HB3 TYR F 18 119.901 -3.870 5.628 1.00 0.00 H new ATOM 0 HD1 TYR F 18 120.387 -0.201 6.338 1.00 0.00 H new ATOM 0 HD2 TYR F 18 121.724 -3.639 4.133 1.00 0.00 H new ATOM 0 HE1 TYR F 18 122.068 1.191 5.175 1.00 0.00 H new ATOM 0 HE2 TYR F 18 123.399 -2.234 2.966 1.00 0.00 H new ATOM 0 HH TYR F 18 123.383 0.702 2.518 1.00 0.00 H new ATOM 1091 N LEU F 19 117.134 -3.717 4.471 1.00 0.00 N ATOM 1092 CA LEU F 19 116.130 -4.763 4.207 1.00 0.00 C ATOM 1093 C LEU F 19 116.801 -5.972 3.512 1.00 0.00 C ATOM 1094 O LEU F 19 116.691 -6.132 2.291 1.00 0.00 O ATOM 1095 CB LEU F 19 115.002 -4.210 3.294 1.00 0.00 C ATOM 1096 CG LEU F 19 114.030 -3.269 4.047 1.00 0.00 C ATOM 1097 CD1 LEU F 19 113.453 -3.956 5.293 1.00 0.00 C ATOM 1098 CD2 LEU F 19 114.737 -1.965 4.449 1.00 0.00 C ATOM 0 H LEU F 19 117.568 -3.334 3.631 1.00 0.00 H new ATOM 0 HA LEU F 19 115.700 -5.078 5.157 1.00 0.00 H new ATOM 0 HB2 LEU F 19 115.448 -3.671 2.458 1.00 0.00 H new ATOM 0 HB3 LEU F 19 114.440 -5.044 2.872 1.00 0.00 H new ATOM 0 HG LEU F 19 113.209 -3.031 3.371 1.00 0.00 H new ATOM 0 HD11 LEU F 19 112.774 -3.273 5.803 1.00 0.00 H new ATOM 0 HD12 LEU F 19 112.910 -4.853 4.995 1.00 0.00 H new ATOM 0 HD13 LEU F 19 114.265 -4.230 5.966 1.00 0.00 H new ATOM 0 HD21 LEU F 19 114.036 -1.319 4.977 1.00 0.00 H new ATOM 0 HD22 LEU F 19 115.580 -2.194 5.101 1.00 0.00 H new ATOM 0 HD23 LEU F 19 115.097 -1.456 3.555 1.00 0.00 H new ATOM 1110 N PRO F 20 117.504 -6.816 4.257 1.00 0.00 N ATOM 1111 CA PRO F 20 118.204 -8.011 3.690 1.00 0.00 C ATOM 1112 C PRO F 20 117.290 -9.231 3.518 1.00 0.00 C ATOM 1113 O PRO F 20 117.185 -9.782 2.418 1.00 0.00 O ATOM 1114 CB PRO F 20 119.303 -8.286 4.721 1.00 0.00 C ATOM 1115 CG PRO F 20 118.739 -7.829 6.028 1.00 0.00 C ATOM 1116 CD PRO F 20 117.717 -6.726 5.718 1.00 0.00 C ATOM 0 HA PRO F 20 118.575 -7.822 2.683 1.00 0.00 H new ATOM 0 HB2 PRO F 20 119.558 -9.345 4.751 1.00 0.00 H new ATOM 0 HB3 PRO F 20 120.217 -7.745 4.476 1.00 0.00 H new ATOM 0 HG2 PRO F 20 118.264 -8.658 6.553 1.00 0.00 H new ATOM 0 HG3 PRO F 20 119.529 -7.451 6.677 1.00 0.00 H new ATOM 0 HD2 PRO F 20 116.787 -6.882 6.265 1.00 0.00 H new ATOM 0 HD3 PRO F 20 118.094 -5.744 6.004 1.00 0.00 H new ATOM 1124 N ASN F 21 116.654 -9.661 4.614 1.00 0.00 N ATOM 1125 CA ASN F 21 115.772 -10.840 4.589 1.00 0.00 C ATOM 1126 C ASN F 21 114.380 -10.506 4.039 1.00 0.00 C ATOM 1127 O ASN F 21 113.520 -11.388 3.948 1.00 0.00 O ATOM 1128 CB ASN F 21 115.626 -11.412 6.007 1.00 0.00 C ATOM 1129 CG ASN F 21 116.984 -11.840 6.569 1.00 0.00 C ATOM 1130 OD1 ASN F 21 117.849 -12.319 5.833 1.00 0.00 O ATOM 1131 ND2 ASN F 21 117.216 -11.701 7.843 1.00 0.00 N ATOM 0 H ASN F 21 116.731 -9.214 5.528 1.00 0.00 H new ATOM 0 HA ASN F 21 116.231 -11.575 3.928 1.00 0.00 H new ATOM 0 HB2 ASN F 21 115.178 -10.664 6.660 1.00 0.00 H new ATOM 0 HB3 ASN F 21 114.950 -12.267 5.990 1.00 0.00 H new ATOM 0 HD21 ASN F 21 118.114 -11.989 8.232 1.00 0.00 H new ATOM 0 HD22 ASN F 21 116.500 -11.305 8.452 1.00 0.00 H new ATOM 1138 N LEU F 22 114.166 -9.243 3.672 1.00 0.00 N ATOM 1139 CA LEU F 22 112.877 -8.813 3.132 1.00 0.00 C ATOM 1140 C LEU F 22 112.719 -9.313 1.694 1.00 0.00 C ATOM 1141 O LEU F 22 113.717 -9.552 1.008 1.00 0.00 O ATOM 1142 CB LEU F 22 112.794 -7.281 3.161 1.00 0.00 C ATOM 1143 CG LEU F 22 111.350 -6.827 3.456 1.00 0.00 C ATOM 1144 CD1 LEU F 22 111.181 -6.523 4.966 1.00 0.00 C ATOM 1145 CD2 LEU F 22 111.035 -5.575 2.614 1.00 0.00 C ATOM 0 H LEU F 22 114.865 -8.503 3.738 1.00 0.00 H new ATOM 0 HA LEU F 22 112.076 -9.231 3.742 1.00 0.00 H new ATOM 0 HB2 LEU F 22 113.468 -6.888 3.922 1.00 0.00 H new ATOM 0 HB3 LEU F 22 113.122 -6.874 2.204 1.00 0.00 H new ATOM 0 HG LEU F 22 110.655 -7.624 3.192 1.00 0.00 H new ATOM 0 HD11 LEU F 22 110.157 -6.204 5.160 1.00 0.00 H new ATOM 0 HD12 LEU F 22 111.397 -7.421 5.544 1.00 0.00 H new ATOM 0 HD13 LEU F 22 111.870 -5.730 5.257 1.00 0.00 H new ATOM 0 HD21 LEU F 22 110.015 -5.247 2.817 1.00 0.00 H new ATOM 0 HD22 LEU F 22 111.731 -4.777 2.874 1.00 0.00 H new ATOM 0 HD23 LEU F 22 111.136 -5.814 1.555 1.00 0.00 H new ATOM 1157 N ASN F 23 111.466 -9.450 1.238 1.00 0.00 N ATOM 1158 CA ASN F 23 111.200 -9.906 -0.130 1.00 0.00 C ATOM 1159 C ASN F 23 110.773 -8.711 -0.989 1.00 0.00 C ATOM 1160 O ASN F 23 110.268 -7.717 -0.456 1.00 0.00 O ATOM 1161 CB ASN F 23 110.126 -11.014 -0.157 1.00 0.00 C ATOM 1162 CG ASN F 23 108.983 -10.716 0.813 1.00 0.00 C ATOM 1163 OD1 ASN F 23 107.854 -10.485 0.385 1.00 0.00 O ATOM 1164 ND2 ASN F 23 109.204 -10.728 2.098 1.00 0.00 N ATOM 0 H ASN F 23 110.631 -9.254 1.790 1.00 0.00 H new ATOM 0 HA ASN F 23 112.114 -10.336 -0.539 1.00 0.00 H new ATOM 0 HB2 ASN F 23 109.730 -11.112 -1.168 1.00 0.00 H new ATOM 0 HB3 ASN F 23 110.582 -11.970 0.101 1.00 0.00 H new ATOM 0 HD21 ASN F 23 108.440 -10.546 2.749 1.00 0.00 H new ATOM 0 HD22 ASN F 23 110.141 -10.920 2.453 1.00 0.00 H new ATOM 1171 N PRO F 24 110.992 -8.763 -2.291 1.00 0.00 N ATOM 1172 CA PRO F 24 110.642 -7.629 -3.201 1.00 0.00 C ATOM 1173 C PRO F 24 109.188 -7.191 -3.069 1.00 0.00 C ATOM 1174 O PRO F 24 108.882 -6.003 -3.211 1.00 0.00 O ATOM 1175 CB PRO F 24 110.934 -8.162 -4.611 1.00 0.00 C ATOM 1176 CG PRO F 24 111.867 -9.312 -4.426 1.00 0.00 C ATOM 1177 CD PRO F 24 111.588 -9.891 -3.038 1.00 0.00 C ATOM 0 HA PRO F 24 111.219 -6.737 -2.958 1.00 0.00 H new ATOM 0 HB2 PRO F 24 110.017 -8.479 -5.107 1.00 0.00 H new ATOM 0 HB3 PRO F 24 111.384 -7.390 -5.235 1.00 0.00 H new ATOM 0 HG2 PRO F 24 111.709 -10.065 -5.198 1.00 0.00 H new ATOM 0 HG3 PRO F 24 112.904 -8.985 -4.507 1.00 0.00 H new ATOM 0 HD2 PRO F 24 110.906 -10.740 -3.090 1.00 0.00 H new ATOM 0 HD3 PRO F 24 112.503 -10.245 -2.562 1.00 0.00 H new ATOM 1185 N ASP F 25 108.297 -8.147 -2.780 1.00 0.00 N ATOM 1186 CA ASP F 25 106.877 -7.832 -2.607 1.00 0.00 C ATOM 1187 C ASP F 25 106.727 -6.810 -1.486 1.00 0.00 C ATOM 1188 O ASP F 25 105.976 -5.837 -1.604 1.00 0.00 O ATOM 1189 CB ASP F 25 106.095 -9.100 -2.243 1.00 0.00 C ATOM 1190 CG ASP F 25 106.206 -10.139 -3.365 1.00 0.00 C ATOM 1191 OD1 ASP F 25 105.696 -9.875 -4.444 1.00 0.00 O ATOM 1192 OD2 ASP F 25 106.799 -11.179 -3.131 1.00 0.00 O ATOM 0 H ASP F 25 108.531 -9.133 -2.663 1.00 0.00 H new ATOM 0 HA ASP F 25 106.483 -7.427 -3.539 1.00 0.00 H new ATOM 0 HB2 ASP F 25 106.480 -9.518 -1.313 1.00 0.00 H new ATOM 0 HB3 ASP F 25 105.048 -8.852 -2.071 1.00 0.00 H new ATOM 1197 N GLN F 26 107.480 -7.042 -0.409 1.00 0.00 N ATOM 1198 CA GLN F 26 107.477 -6.151 0.741 1.00 0.00 C ATOM 1199 C GLN F 26 108.192 -4.835 0.410 1.00 0.00 C ATOM 1200 O GLN F 26 107.766 -3.770 0.865 1.00 0.00 O ATOM 1201 CB GLN F 26 108.129 -6.842 1.942 1.00 0.00 C ATOM 1202 CG GLN F 26 107.226 -7.977 2.458 1.00 0.00 C ATOM 1203 CD GLN F 26 105.865 -7.442 2.917 1.00 0.00 C ATOM 1204 OE1 GLN F 26 104.853 -8.130 2.784 1.00 0.00 O ATOM 1205 NE2 GLN F 26 105.776 -6.254 3.450 1.00 0.00 N ATOM 0 H GLN F 26 108.101 -7.845 -0.314 1.00 0.00 H new ATOM 0 HA GLN F 26 106.445 -5.913 0.997 1.00 0.00 H new ATOM 0 HB2 GLN F 26 109.102 -7.243 1.656 1.00 0.00 H new ATOM 0 HB3 GLN F 26 108.304 -6.117 2.737 1.00 0.00 H new ATOM 0 HG2 GLN F 26 107.081 -8.716 1.670 1.00 0.00 H new ATOM 0 HG3 GLN F 26 107.717 -8.487 3.287 1.00 0.00 H new ATOM 0 HE21 GLN F 26 106.613 -5.681 3.562 1.00 0.00 H new ATOM 0 HE22 GLN F 26 104.870 -5.898 3.755 1.00 0.00 H new ATOM 1214 N LEU F 27 109.272 -4.910 -0.388 1.00 0.00 N ATOM 1215 CA LEU F 27 110.014 -3.700 -0.774 1.00 0.00 C ATOM 1216 C LEU F 27 109.115 -2.759 -1.577 1.00 0.00 C ATOM 1217 O LEU F 27 109.184 -1.542 -1.412 1.00 0.00 O ATOM 1218 CB LEU F 27 111.254 -4.046 -1.622 1.00 0.00 C ATOM 1219 CG LEU F 27 112.388 -4.613 -0.747 1.00 0.00 C ATOM 1220 CD1 LEU F 27 113.550 -5.069 -1.643 1.00 0.00 C ATOM 1221 CD2 LEU F 27 112.896 -3.531 0.225 1.00 0.00 C ATOM 0 H LEU F 27 109.644 -5.779 -0.771 1.00 0.00 H new ATOM 0 HA LEU F 27 110.339 -3.212 0.145 1.00 0.00 H new ATOM 0 HB2 LEU F 27 110.983 -4.774 -2.387 1.00 0.00 H new ATOM 0 HB3 LEU F 27 111.603 -3.153 -2.141 1.00 0.00 H new ATOM 0 HG LEU F 27 112.005 -5.460 -0.178 1.00 0.00 H new ATOM 0 HD11 LEU F 27 114.352 -5.470 -1.023 1.00 0.00 H new ATOM 0 HD12 LEU F 27 113.200 -5.841 -2.328 1.00 0.00 H new ATOM 0 HD13 LEU F 27 113.924 -4.220 -2.215 1.00 0.00 H new ATOM 0 HD21 LEU F 27 113.697 -3.941 0.839 1.00 0.00 H new ATOM 0 HD22 LEU F 27 113.273 -2.680 -0.342 1.00 0.00 H new ATOM 0 HD23 LEU F 27 112.077 -3.205 0.867 1.00 0.00 H new ATOM 1233 N CYS F 28 108.272 -3.329 -2.445 1.00 0.00 N ATOM 1234 CA CYS F 28 107.365 -2.517 -3.264 1.00 0.00 C ATOM 1235 C CYS F 28 106.338 -1.821 -2.376 1.00 0.00 C ATOM 1236 O CYS F 28 106.128 -0.611 -2.490 1.00 0.00 O ATOM 1237 CB CYS F 28 106.656 -3.386 -4.313 1.00 0.00 C ATOM 1238 SG CYS F 28 107.603 -3.356 -5.857 1.00 0.00 S ATOM 0 H CYS F 28 108.199 -4.335 -2.598 1.00 0.00 H new ATOM 0 HA CYS F 28 107.954 -1.762 -3.785 1.00 0.00 H new ATOM 0 HB2 CYS F 28 106.563 -4.410 -3.950 1.00 0.00 H new ATOM 0 HB3 CYS F 28 105.646 -3.015 -4.486 1.00 0.00 H new ATOM 1243 N ALA F 29 105.718 -2.595 -1.481 1.00 0.00 N ATOM 1244 CA ALA F 29 104.727 -2.048 -0.553 1.00 0.00 C ATOM 1245 C ALA F 29 105.394 -1.017 0.356 1.00 0.00 C ATOM 1246 O ALA F 29 104.795 0.007 0.708 1.00 0.00 O ATOM 1247 CB ALA F 29 104.134 -3.177 0.298 1.00 0.00 C ATOM 0 H ALA F 29 105.884 -3.596 -1.380 1.00 0.00 H new ATOM 0 HA ALA F 29 103.928 -1.570 -1.120 1.00 0.00 H new ATOM 0 HB1 ALA F 29 103.397 -2.765 0.987 1.00 0.00 H new ATOM 0 HB2 ALA F 29 103.654 -3.909 -0.352 1.00 0.00 H new ATOM 0 HB3 ALA F 29 104.929 -3.662 0.865 1.00 0.00 H new ATOM 1253 N PHE F 30 106.645 -1.307 0.720 1.00 0.00 N ATOM 1254 CA PHE F 30 107.431 -0.433 1.580 1.00 0.00 C ATOM 1255 C PHE F 30 107.748 0.886 0.872 1.00 0.00 C ATOM 1256 O PHE F 30 107.466 1.962 1.401 1.00 0.00 O ATOM 1257 CB PHE F 30 108.739 -1.161 1.957 1.00 0.00 C ATOM 1258 CG PHE F 30 109.699 -0.214 2.654 1.00 0.00 C ATOM 1259 CD1 PHE F 30 109.293 0.455 3.815 1.00 0.00 C ATOM 1260 CD2 PHE F 30 110.991 0.004 2.132 1.00 0.00 C ATOM 1261 CE1 PHE F 30 110.166 1.334 4.457 1.00 0.00 C ATOM 1262 CE2 PHE F 30 111.860 0.886 2.779 1.00 0.00 C ATOM 1263 CZ PHE F 30 111.446 1.550 3.942 1.00 0.00 C ATOM 0 H PHE F 30 107.136 -2.151 0.426 1.00 0.00 H new ATOM 0 HA PHE F 30 106.859 -0.200 2.478 1.00 0.00 H new ATOM 0 HB2 PHE F 30 108.516 -2.005 2.609 1.00 0.00 H new ATOM 0 HB3 PHE F 30 109.207 -1.566 1.060 1.00 0.00 H new ATOM 0 HD1 PHE F 30 108.303 0.291 4.214 1.00 0.00 H new ATOM 0 HD2 PHE F 30 111.307 -0.509 1.236 1.00 0.00 H new ATOM 0 HE1 PHE F 30 109.851 1.848 5.353 1.00 0.00 H new ATOM 0 HE2 PHE F 30 112.850 1.056 2.383 1.00 0.00 H new ATOM 0 HZ PHE F 30 112.119 2.231 4.441 1.00 0.00 H new ATOM 1273 N ILE F 31 108.341 0.783 -0.321 1.00 0.00 N ATOM 1274 CA ILE F 31 108.713 1.965 -1.100 1.00 0.00 C ATOM 1275 C ILE F 31 107.484 2.758 -1.536 1.00 0.00 C ATOM 1276 O ILE F 31 107.557 3.982 -1.659 1.00 0.00 O ATOM 1277 CB ILE F 31 109.561 1.567 -2.318 1.00 0.00 C ATOM 1278 CG1 ILE F 31 110.896 0.978 -1.825 1.00 0.00 C ATOM 1279 CG2 ILE F 31 109.844 2.807 -3.188 1.00 0.00 C ATOM 1280 CD1 ILE F 31 111.687 0.394 -3.005 1.00 0.00 C ATOM 0 H ILE F 31 108.573 -0.105 -0.766 1.00 0.00 H new ATOM 0 HA ILE F 31 109.311 2.610 -0.456 1.00 0.00 H new ATOM 0 HB ILE F 31 109.021 0.829 -2.912 1.00 0.00 H new ATOM 0 HG12 ILE F 31 111.483 1.753 -1.332 1.00 0.00 H new ATOM 0 HG13 ILE F 31 110.707 0.201 -1.084 1.00 0.00 H new ATOM 0 HG21 ILE F 31 110.446 2.517 -4.050 1.00 0.00 H new ATOM 0 HG22 ILE F 31 108.901 3.234 -3.531 1.00 0.00 H new ATOM 0 HG23 ILE F 31 110.385 3.548 -2.600 1.00 0.00 H new ATOM 0 HD11 ILE F 31 112.629 -0.019 -2.643 1.00 0.00 H new ATOM 0 HD12 ILE F 31 111.103 -0.395 -3.480 1.00 0.00 H new ATOM 0 HD13 ILE F 31 111.891 1.181 -3.731 1.00 0.00 H new ATOM 1292 N HIS F 32 106.371 2.060 -1.776 1.00 0.00 N ATOM 1293 CA HIS F 32 105.138 2.726 -2.196 1.00 0.00 C ATOM 1294 C HIS F 32 104.651 3.666 -1.091 1.00 0.00 C ATOM 1295 O HIS F 32 104.329 4.826 -1.352 1.00 0.00 O ATOM 1296 CB HIS F 32 104.056 1.680 -2.522 1.00 0.00 C ATOM 1297 CG HIS F 32 102.767 2.357 -2.930 1.00 0.00 C ATOM 1298 ND1 HIS F 32 102.745 3.591 -3.567 1.00 0.00 N ATOM 1299 CD2 HIS F 32 101.452 1.981 -2.800 1.00 0.00 C ATOM 1300 CE1 HIS F 32 101.456 3.907 -3.795 1.00 0.00 C ATOM 1301 NE2 HIS F 32 100.627 2.960 -3.346 1.00 0.00 N ATOM 0 H HIS F 32 106.299 1.046 -1.688 1.00 0.00 H new ATOM 0 HA HIS F 32 105.338 3.311 -3.093 1.00 0.00 H new ATOM 0 HB2 HIS F 32 104.402 1.030 -3.326 1.00 0.00 H new ATOM 0 HB3 HIS F 32 103.881 1.047 -1.652 1.00 0.00 H new ATOM 0 HD2 HIS F 32 101.110 1.064 -2.343 1.00 0.00 H new ATOM 0 HE1 HIS F 32 101.132 4.815 -4.281 1.00 0.00 H new ATOM 0 HE2 HIS F 32 99.608 2.956 -3.393 1.00 0.00 H new ATOM 1310 N SER F 33 104.616 3.149 0.141 1.00 0.00 N ATOM 1311 CA SER F 33 104.181 3.935 1.299 1.00 0.00 C ATOM 1312 C SER F 33 105.233 4.994 1.646 1.00 0.00 C ATOM 1313 O SER F 33 104.907 6.150 1.924 1.00 0.00 O ATOM 1314 CB SER F 33 103.963 3.001 2.495 1.00 0.00 C ATOM 1315 OG SER F 33 103.108 1.931 2.106 1.00 0.00 O ATOM 0 H SER F 33 104.884 2.190 0.362 1.00 0.00 H new ATOM 0 HA SER F 33 103.246 4.440 1.058 1.00 0.00 H new ATOM 0 HB2 SER F 33 104.918 2.610 2.845 1.00 0.00 H new ATOM 0 HB3 SER F 33 103.521 3.552 3.325 1.00 0.00 H new ATOM 0 HG SER F 33 103.629 1.253 1.627 1.00 0.00 H new ATOM 1321 N LEU F 34 106.494 4.562 1.614 1.00 0.00 N ATOM 1322 CA LEU F 34 107.646 5.411 1.904 1.00 0.00 C ATOM 1323 C LEU F 34 107.654 6.655 1.006 1.00 0.00 C ATOM 1324 O LEU F 34 107.910 7.767 1.477 1.00 0.00 O ATOM 1325 CB LEU F 34 108.895 4.546 1.658 1.00 0.00 C ATOM 1326 CG LEU F 34 110.209 5.320 1.836 1.00 0.00 C ATOM 1327 CD1 LEU F 34 110.708 5.162 3.273 1.00 0.00 C ATOM 1328 CD2 LEU F 34 111.264 4.755 0.867 1.00 0.00 C ATOM 0 H LEU F 34 106.745 3.601 1.383 1.00 0.00 H new ATOM 0 HA LEU F 34 107.616 5.773 2.932 1.00 0.00 H new ATOM 0 HB2 LEU F 34 108.884 3.699 2.344 1.00 0.00 H new ATOM 0 HB3 LEU F 34 108.854 4.139 0.648 1.00 0.00 H new ATOM 0 HG LEU F 34 110.040 6.376 1.625 1.00 0.00 H new ATOM 0 HD11 LEU F 34 111.641 5.712 3.397 1.00 0.00 H new ATOM 0 HD12 LEU F 34 109.961 5.554 3.963 1.00 0.00 H new ATOM 0 HD13 LEU F 34 110.879 4.106 3.485 1.00 0.00 H new ATOM 0 HD21 LEU F 34 112.199 5.301 0.989 1.00 0.00 H new ATOM 0 HD22 LEU F 34 111.429 3.700 1.084 1.00 0.00 H new ATOM 0 HD23 LEU F 34 110.911 4.864 -0.159 1.00 0.00 H new ATOM 1340 N HIS F 35 107.384 6.450 -0.288 1.00 0.00 N ATOM 1341 CA HIS F 35 107.371 7.548 -1.261 1.00 0.00 C ATOM 1342 C HIS F 35 106.056 8.339 -1.219 1.00 0.00 C ATOM 1343 O HIS F 35 106.073 9.570 -1.133 1.00 0.00 O ATOM 1344 CB HIS F 35 107.587 6.980 -2.672 1.00 0.00 C ATOM 1345 CG HIS F 35 107.787 8.103 -3.657 1.00 0.00 C ATOM 1346 ND1 HIS F 35 106.753 8.596 -4.437 1.00 0.00 N ATOM 1347 CD2 HIS F 35 108.897 8.837 -4.000 1.00 0.00 C ATOM 1348 CE1 HIS F 35 107.257 9.581 -5.204 1.00 0.00 C ATOM 1349 NE2 HIS F 35 108.560 9.769 -4.976 1.00 0.00 N ATOM 0 H HIS F 35 107.172 5.535 -0.685 1.00 0.00 H new ATOM 0 HA HIS F 35 108.177 8.235 -1.001 1.00 0.00 H new ATOM 0 HB2 HIS F 35 108.455 6.321 -2.678 1.00 0.00 H new ATOM 0 HB3 HIS F 35 106.728 6.377 -2.965 1.00 0.00 H new ATOM 0 HD2 HIS F 35 109.882 8.709 -3.576 1.00 0.00 H new ATOM 0 HE1 HIS F 35 106.678 10.150 -5.917 1.00 0.00 H new ATOM 0 HE2 HIS F 35 109.175 10.450 -5.422 1.00 0.00 H new ATOM 1358 N ASP F 36 104.927 7.624 -1.307 1.00 0.00 N ATOM 1359 CA ASP F 36 103.601 8.260 -1.307 1.00 0.00 C ATOM 1360 C ASP F 36 103.367 9.095 -0.043 1.00 0.00 C ATOM 1361 O ASP F 36 102.700 10.131 -0.100 1.00 0.00 O ATOM 1362 CB ASP F 36 102.504 7.192 -1.425 1.00 0.00 C ATOM 1363 CG ASP F 36 101.139 7.856 -1.624 1.00 0.00 C ATOM 1364 OD1 ASP F 36 100.504 8.173 -0.630 1.00 0.00 O ATOM 1365 OD2 ASP F 36 100.750 8.041 -2.768 1.00 0.00 O ATOM 0 H ASP F 36 104.904 6.607 -1.379 1.00 0.00 H new ATOM 0 HA ASP F 36 103.561 8.930 -2.166 1.00 0.00 H new ATOM 0 HB2 ASP F 36 102.720 6.529 -2.263 1.00 0.00 H new ATOM 0 HB3 ASP F 36 102.489 6.575 -0.527 1.00 0.00 H new ATOM 1370 N ASP F 37 103.899 8.627 1.090 1.00 0.00 N ATOM 1371 CA ASP F 37 103.732 9.326 2.369 1.00 0.00 C ATOM 1372 C ASP F 37 105.094 9.521 3.059 1.00 0.00 C ATOM 1373 O ASP F 37 105.486 8.717 3.912 1.00 0.00 O ATOM 1374 CB ASP F 37 102.776 8.526 3.276 1.00 0.00 C ATOM 1375 CG ASP F 37 101.417 8.327 2.592 1.00 0.00 C ATOM 1376 OD1 ASP F 37 100.860 9.303 2.105 1.00 0.00 O ATOM 1377 OD2 ASP F 37 100.949 7.201 2.570 1.00 0.00 O ATOM 0 H ASP F 37 104.448 7.769 1.148 1.00 0.00 H new ATOM 0 HA ASP F 37 103.303 10.310 2.182 1.00 0.00 H new ATOM 0 HB2 ASP F 37 103.216 7.557 3.511 1.00 0.00 H new ATOM 0 HB3 ASP F 37 102.639 9.051 4.221 1.00 0.00 H new ATOM 1382 N PRO F 38 105.822 10.569 2.700 1.00 0.00 N ATOM 1383 CA PRO F 38 107.165 10.864 3.297 1.00 0.00 C ATOM 1384 C PRO F 38 107.117 10.949 4.825 1.00 0.00 C ATOM 1385 O PRO F 38 108.078 10.586 5.501 1.00 0.00 O ATOM 1386 CB PRO F 38 107.560 12.217 2.685 1.00 0.00 C ATOM 1387 CG PRO F 38 106.745 12.350 1.442 1.00 0.00 C ATOM 1388 CD PRO F 38 105.448 11.581 1.690 1.00 0.00 C ATOM 0 HA PRO F 38 107.883 10.072 3.081 1.00 0.00 H new ATOM 0 HB2 PRO F 38 107.356 13.034 3.377 1.00 0.00 H new ATOM 0 HB3 PRO F 38 108.626 12.249 2.460 1.00 0.00 H new ATOM 0 HG2 PRO F 38 106.539 13.398 1.223 1.00 0.00 H new ATOM 0 HG3 PRO F 38 107.279 11.944 0.583 1.00 0.00 H new ATOM 0 HD2 PRO F 38 104.658 12.237 2.056 1.00 0.00 H new ATOM 0 HD3 PRO F 38 105.078 11.116 0.776 1.00 0.00 H new ATOM 1396 N SER F 39 105.992 11.428 5.355 1.00 0.00 N ATOM 1397 CA SER F 39 105.823 11.555 6.803 1.00 0.00 C ATOM 1398 C SER F 39 105.810 10.181 7.479 1.00 0.00 C ATOM 1399 O SER F 39 106.255 10.041 8.623 1.00 0.00 O ATOM 1400 CB SER F 39 104.513 12.291 7.108 1.00 0.00 C ATOM 1401 OG SER F 39 103.413 11.505 6.660 1.00 0.00 O ATOM 0 H SER F 39 105.188 11.733 4.807 1.00 0.00 H new ATOM 0 HA SER F 39 106.666 12.123 7.197 1.00 0.00 H new ATOM 0 HB2 SER F 39 104.429 12.478 8.179 1.00 0.00 H new ATOM 0 HB3 SER F 39 104.505 13.262 6.614 1.00 0.00 H new ATOM 0 HG SER F 39 102.575 11.974 6.856 1.00 0.00 H new ATOM 1407 N GLN F 40 105.286 9.176 6.766 1.00 0.00 N ATOM 1408 CA GLN F 40 105.197 7.810 7.294 1.00 0.00 C ATOM 1409 C GLN F 40 106.487 7.022 7.095 1.00 0.00 C ATOM 1410 O GLN F 40 106.650 5.976 7.706 1.00 0.00 O ATOM 1411 CB GLN F 40 104.053 7.052 6.605 1.00 0.00 C ATOM 1412 CG GLN F 40 102.705 7.623 7.052 1.00 0.00 C ATOM 1413 CD GLN F 40 101.546 6.931 6.328 1.00 0.00 C ATOM 1414 OE1 GLN F 40 101.710 5.850 5.760 1.00 0.00 O ATOM 1415 NE2 GLN F 40 100.372 7.499 6.315 1.00 0.00 N ATOM 0 H GLN F 40 104.917 9.284 5.821 1.00 0.00 H new ATOM 0 HA GLN F 40 105.013 7.901 8.364 1.00 0.00 H new ATOM 0 HB2 GLN F 40 104.151 7.134 5.523 1.00 0.00 H new ATOM 0 HB3 GLN F 40 104.108 5.992 6.851 1.00 0.00 H new ATOM 0 HG2 GLN F 40 102.592 7.497 8.129 1.00 0.00 H new ATOM 0 HG3 GLN F 40 102.676 8.694 6.851 1.00 0.00 H new ATOM 0 HE21 GLN F 40 100.233 8.394 6.784 1.00 0.00 H new ATOM 0 HE22 GLN F 40 99.593 7.048 5.836 1.00 0.00 H new ATOM 1424 N SER F 41 107.380 7.502 6.223 1.00 0.00 N ATOM 1425 CA SER F 41 108.635 6.785 5.932 1.00 0.00 C ATOM 1426 C SER F 41 109.353 6.336 7.209 1.00 0.00 C ATOM 1427 O SER F 41 109.819 5.202 7.298 1.00 0.00 O ATOM 1428 CB SER F 41 109.564 7.684 5.118 1.00 0.00 C ATOM 1429 OG SER F 41 109.943 8.808 5.901 1.00 0.00 O ATOM 0 H SER F 41 107.263 8.375 5.709 1.00 0.00 H new ATOM 0 HA SER F 41 108.377 5.892 5.363 1.00 0.00 H new ATOM 0 HB2 SER F 41 110.449 7.127 4.810 1.00 0.00 H new ATOM 0 HB3 SER F 41 109.063 8.014 4.208 1.00 0.00 H new ATOM 0 HG SER F 41 109.270 9.514 5.807 1.00 0.00 H new ATOM 1435 N ALA F 42 109.420 7.233 8.181 1.00 0.00 N ATOM 1436 CA ALA F 42 110.071 6.945 9.462 1.00 0.00 C ATOM 1437 C ALA F 42 109.373 5.782 10.177 1.00 0.00 C ATOM 1438 O ALA F 42 110.028 4.819 10.586 1.00 0.00 O ATOM 1439 CB ALA F 42 110.044 8.191 10.353 1.00 0.00 C ATOM 0 H ALA F 42 109.031 8.173 8.112 1.00 0.00 H new ATOM 0 HA ALA F 42 111.105 6.662 9.266 1.00 0.00 H new ATOM 0 HB1 ALA F 42 110.530 7.969 11.303 1.00 0.00 H new ATOM 0 HB2 ALA F 42 110.573 9.005 9.857 1.00 0.00 H new ATOM 0 HB3 ALA F 42 109.011 8.487 10.534 1.00 0.00 H new ATOM 1445 N ASN F 43 108.045 5.873 10.313 1.00 0.00 N ATOM 1446 CA ASN F 43 107.273 4.811 10.967 1.00 0.00 C ATOM 1447 C ASN F 43 107.371 3.521 10.154 1.00 0.00 C ATOM 1448 O ASN F 43 107.498 2.427 10.712 1.00 0.00 O ATOM 1449 CB ASN F 43 105.802 5.222 11.105 1.00 0.00 C ATOM 1450 CG ASN F 43 105.671 6.416 12.049 1.00 0.00 C ATOM 1451 OD1 ASN F 43 105.177 7.472 11.657 1.00 0.00 O ATOM 1452 ND2 ASN F 43 106.084 6.307 13.282 1.00 0.00 N ATOM 0 H ASN F 43 107.488 6.661 9.983 1.00 0.00 H new ATOM 0 HA ASN F 43 107.686 4.645 11.962 1.00 0.00 H new ATOM 0 HB2 ASN F 43 105.395 5.477 10.126 1.00 0.00 H new ATOM 0 HB3 ASN F 43 105.217 4.384 11.484 1.00 0.00 H new ATOM 0 HD21 ASN F 43 105.997 7.098 13.921 1.00 0.00 H new ATOM 0 HD22 ASN F 43 106.494 5.431 13.607 1.00 0.00 H new ATOM 1459 N LEU F 44 107.330 3.673 8.830 1.00 0.00 N ATOM 1460 CA LEU F 44 107.434 2.542 7.919 1.00 0.00 C ATOM 1461 C LEU F 44 108.791 1.883 8.072 1.00 0.00 C ATOM 1462 O LEU F 44 108.907 0.672 7.936 1.00 0.00 O ATOM 1463 CB LEU F 44 107.255 3.010 6.472 1.00 0.00 C ATOM 1464 CG LEU F 44 105.815 3.500 6.252 1.00 0.00 C ATOM 1465 CD1 LEU F 44 105.766 4.388 5.002 1.00 0.00 C ATOM 1466 CD2 LEU F 44 104.883 2.294 6.062 1.00 0.00 C ATOM 0 H LEU F 44 107.225 4.575 8.366 1.00 0.00 H new ATOM 0 HA LEU F 44 106.651 1.824 8.161 1.00 0.00 H new ATOM 0 HB2 LEU F 44 107.959 3.813 6.251 1.00 0.00 H new ATOM 0 HB3 LEU F 44 107.478 2.193 5.786 1.00 0.00 H new ATOM 0 HG LEU F 44 105.490 4.073 7.120 1.00 0.00 H new ATOM 0 HD11 LEU F 44 104.746 4.737 4.843 1.00 0.00 H new ATOM 0 HD12 LEU F 44 106.426 5.245 5.138 1.00 0.00 H new ATOM 0 HD13 LEU F 44 106.092 3.814 4.135 1.00 0.00 H new ATOM 0 HD21 LEU F 44 103.862 2.644 5.906 1.00 0.00 H new ATOM 0 HD22 LEU F 44 105.206 1.718 5.195 1.00 0.00 H new ATOM 0 HD23 LEU F 44 104.919 1.663 6.950 1.00 0.00 H new ATOM 1478 N LEU F 45 109.814 2.696 8.359 1.00 0.00 N ATOM 1479 CA LEU F 45 111.170 2.184 8.543 1.00 0.00 C ATOM 1480 C LEU F 45 111.203 1.227 9.731 1.00 0.00 C ATOM 1481 O LEU F 45 111.858 0.189 9.681 1.00 0.00 O ATOM 1482 CB LEU F 45 112.154 3.346 8.787 1.00 0.00 C ATOM 1483 CG LEU F 45 113.142 3.462 7.616 1.00 0.00 C ATOM 1484 CD1 LEU F 45 112.436 4.086 6.400 1.00 0.00 C ATOM 1485 CD2 LEU F 45 114.339 4.350 8.009 1.00 0.00 C ATOM 0 H LEU F 45 109.726 3.706 8.468 1.00 0.00 H new ATOM 0 HA LEU F 45 111.469 1.653 7.639 1.00 0.00 H new ATOM 0 HB2 LEU F 45 111.604 4.280 8.901 1.00 0.00 H new ATOM 0 HB3 LEU F 45 112.699 3.181 9.717 1.00 0.00 H new ATOM 0 HG LEU F 45 113.501 2.463 7.366 1.00 0.00 H new ATOM 0 HD11 LEU F 45 113.140 4.166 5.572 1.00 0.00 H new ATOM 0 HD12 LEU F 45 111.597 3.456 6.103 1.00 0.00 H new ATOM 0 HD13 LEU F 45 112.069 5.078 6.662 1.00 0.00 H new ATOM 0 HD21 LEU F 45 115.030 4.422 7.169 1.00 0.00 H new ATOM 0 HD22 LEU F 45 113.982 5.346 8.272 1.00 0.00 H new ATOM 0 HD23 LEU F 45 114.853 3.911 8.864 1.00 0.00 H new ATOM 1497 N ALA F 46 110.478 1.589 10.791 1.00 0.00 N ATOM 1498 CA ALA F 46 110.417 0.762 11.993 1.00 0.00 C ATOM 1499 C ALA F 46 109.747 -0.576 11.692 1.00 0.00 C ATOM 1500 O ALA F 46 110.287 -1.631 12.032 1.00 0.00 O ATOM 1501 CB ALA F 46 109.633 1.499 13.087 1.00 0.00 C ATOM 0 H ALA F 46 109.928 2.446 10.840 1.00 0.00 H new ATOM 0 HA ALA F 46 111.434 0.572 12.337 1.00 0.00 H new ATOM 0 HB1 ALA F 46 109.589 0.880 13.983 1.00 0.00 H new ATOM 0 HB2 ALA F 46 110.131 2.440 13.320 1.00 0.00 H new ATOM 0 HB3 ALA F 46 108.621 1.702 12.736 1.00 0.00 H new ATOM 1507 N GLU F 47 108.571 -0.528 11.055 1.00 0.00 N ATOM 1508 CA GLU F 47 107.845 -1.756 10.722 1.00 0.00 C ATOM 1509 C GLU F 47 108.598 -2.562 9.672 1.00 0.00 C ATOM 1510 O GLU F 47 108.702 -3.776 9.788 1.00 0.00 O ATOM 1511 CB GLU F 47 106.452 -1.445 10.183 1.00 0.00 C ATOM 1512 CG GLU F 47 105.597 -0.764 11.266 1.00 0.00 C ATOM 1513 CD GLU F 47 104.152 -0.523 10.785 1.00 0.00 C ATOM 1514 OE1 GLU F 47 103.926 -0.467 9.582 1.00 0.00 O ATOM 1515 OE2 GLU F 47 103.290 -0.380 11.637 1.00 0.00 O ATOM 0 H GLU F 47 108.109 0.334 10.764 1.00 0.00 H new ATOM 0 HA GLU F 47 107.758 -2.334 11.642 1.00 0.00 H new ATOM 0 HB2 GLU F 47 106.529 -0.796 9.311 1.00 0.00 H new ATOM 0 HB3 GLU F 47 105.969 -2.365 9.854 1.00 0.00 H new ATOM 0 HG2 GLU F 47 105.583 -1.384 12.162 1.00 0.00 H new ATOM 0 HG3 GLU F 47 106.051 0.187 11.544 1.00 0.00 H new ATOM 1522 N ALA F 48 109.121 -1.874 8.650 1.00 0.00 N ATOM 1523 CA ALA F 48 109.872 -2.527 7.576 1.00 0.00 C ATOM 1524 C ALA F 48 111.074 -3.244 8.164 1.00 0.00 C ATOM 1525 O ALA F 48 111.323 -4.417 7.872 1.00 0.00 O ATOM 1526 CB ALA F 48 110.344 -1.475 6.563 1.00 0.00 C ATOM 0 H ALA F 48 109.036 -0.863 8.546 1.00 0.00 H new ATOM 0 HA ALA F 48 109.230 -3.249 7.071 1.00 0.00 H new ATOM 0 HB1 ALA F 48 110.903 -1.964 5.765 1.00 0.00 H new ATOM 0 HB2 ALA F 48 109.479 -0.963 6.140 1.00 0.00 H new ATOM 0 HB3 ALA F 48 110.986 -0.750 7.064 1.00 0.00 H new ATOM 1532 N LYS F 49 111.788 -2.530 9.029 1.00 0.00 N ATOM 1533 CA LYS F 49 112.939 -3.088 9.704 1.00 0.00 C ATOM 1534 C LYS F 49 112.487 -4.231 10.620 1.00 0.00 C ATOM 1535 O LYS F 49 113.177 -5.245 10.748 1.00 0.00 O ATOM 1536 CB LYS F 49 113.635 -1.995 10.522 1.00 0.00 C ATOM 1537 CG LYS F 49 114.992 -2.510 11.017 1.00 0.00 C ATOM 1538 CD LYS F 49 115.197 -2.112 12.483 1.00 0.00 C ATOM 1539 CE LYS F 49 115.509 -0.614 12.587 1.00 0.00 C ATOM 1540 NZ LYS F 49 115.682 -0.245 14.022 1.00 0.00 N ATOM 0 H LYS F 49 111.583 -1.561 9.275 1.00 0.00 H new ATOM 0 HA LYS F 49 113.643 -3.479 8.969 1.00 0.00 H new ATOM 0 HB2 LYS F 49 113.774 -1.102 9.912 1.00 0.00 H new ATOM 0 HB3 LYS F 49 113.012 -1.708 11.369 1.00 0.00 H new ATOM 0 HG2 LYS F 49 115.038 -3.594 10.915 1.00 0.00 H new ATOM 0 HG3 LYS F 49 115.793 -2.098 10.404 1.00 0.00 H new ATOM 0 HD2 LYS F 49 114.302 -2.345 13.059 1.00 0.00 H new ATOM 0 HD3 LYS F 49 116.013 -2.692 12.914 1.00 0.00 H new ATOM 0 HE2 LYS F 49 116.415 -0.380 12.028 1.00 0.00 H new ATOM 0 HE3 LYS F 49 114.701 -0.031 12.144 1.00 0.00 H new ATOM 0 HZ1 LYS F 49 115.894 0.771 14.096 1.00 0.00 H new ATOM 0 HZ2 LYS F 49 114.806 -0.455 14.542 1.00 0.00 H new ATOM 0 HZ3 LYS F 49 116.467 -0.793 14.429 1.00 0.00 H new ATOM 1554 N LYS F 50 111.304 -4.065 11.235 1.00 0.00 N ATOM 1555 CA LYS F 50 110.747 -5.091 12.114 1.00 0.00 C ATOM 1556 C LYS F 50 110.365 -6.297 11.274 1.00 0.00 C ATOM 1557 O LYS F 50 110.467 -7.442 11.714 1.00 0.00 O ATOM 1558 CB LYS F 50 109.523 -4.525 12.861 1.00 0.00 C ATOM 1559 CG LYS F 50 108.909 -5.580 13.796 1.00 0.00 C ATOM 1560 CD LYS F 50 107.839 -4.933 14.692 1.00 0.00 C ATOM 1561 CE LYS F 50 106.592 -4.586 13.866 1.00 0.00 C ATOM 1562 NZ LYS F 50 105.463 -4.267 14.786 1.00 0.00 N ATOM 0 H LYS F 50 110.722 -3.233 11.137 1.00 0.00 H new ATOM 0 HA LYS F 50 111.484 -5.396 12.857 1.00 0.00 H new ATOM 0 HB2 LYS F 50 109.819 -3.650 13.440 1.00 0.00 H new ATOM 0 HB3 LYS F 50 108.775 -4.193 12.141 1.00 0.00 H new ATOM 0 HG2 LYS F 50 108.465 -6.384 13.209 1.00 0.00 H new ATOM 0 HG3 LYS F 50 109.688 -6.029 14.412 1.00 0.00 H new ATOM 0 HD2 LYS F 50 107.571 -5.614 15.500 1.00 0.00 H new ATOM 0 HD3 LYS F 50 108.239 -4.031 15.155 1.00 0.00 H new ATOM 0 HE2 LYS F 50 106.798 -3.736 13.216 1.00 0.00 H new ATOM 0 HE3 LYS F 50 106.325 -5.423 13.221 1.00 0.00 H new ATOM 0 HZ1 LYS F 50 104.617 -4.032 14.229 1.00 0.00 H new ATOM 0 HZ2 LYS F 50 105.263 -5.091 15.388 1.00 0.00 H new ATOM 0 HZ3 LYS F 50 105.721 -3.456 15.384 1.00 0.00 H new ATOM 1576 N LEU F 51 109.926 -6.010 10.055 1.00 0.00 N ATOM 1577 CA LEU F 51 109.524 -7.036 9.120 1.00 0.00 C ATOM 1578 C LEU F 51 110.731 -7.879 8.750 1.00 0.00 C ATOM 1579 O LEU F 51 110.635 -9.100 8.646 1.00 0.00 O ATOM 1580 CB LEU F 51 108.918 -6.376 7.877 1.00 0.00 C ATOM 1581 CG LEU F 51 107.924 -7.325 7.203 1.00 0.00 C ATOM 1582 CD1 LEU F 51 106.742 -7.600 8.151 1.00 0.00 C ATOM 1583 CD2 LEU F 51 107.415 -6.669 5.918 1.00 0.00 C ATOM 0 H LEU F 51 109.841 -5.060 9.694 1.00 0.00 H new ATOM 0 HA LEU F 51 108.773 -7.684 9.572 1.00 0.00 H new ATOM 0 HB2 LEU F 51 108.415 -5.450 8.157 1.00 0.00 H new ATOM 0 HB3 LEU F 51 109.709 -6.109 7.176 1.00 0.00 H new ATOM 0 HG LEU F 51 108.414 -8.270 6.968 1.00 0.00 H new ATOM 0 HD11 LEU F 51 106.037 -8.276 7.667 1.00 0.00 H new ATOM 0 HD12 LEU F 51 107.111 -8.057 9.069 1.00 0.00 H new ATOM 0 HD13 LEU F 51 106.240 -6.662 8.389 1.00 0.00 H new ATOM 0 HD21 LEU F 51 106.705 -7.334 5.426 1.00 0.00 H new ATOM 0 HD22 LEU F 51 106.922 -5.728 6.161 1.00 0.00 H new ATOM 0 HD23 LEU F 51 108.255 -6.477 5.250 1.00 0.00 H new ATOM 1595 N ASN F 52 111.878 -7.211 8.596 1.00 0.00 N ATOM 1596 CA ASN F 52 113.131 -7.899 8.289 1.00 0.00 C ATOM 1597 C ASN F 52 113.420 -8.898 9.421 1.00 0.00 C ATOM 1598 O ASN F 52 113.865 -10.021 9.176 1.00 0.00 O ATOM 1599 CB ASN F 52 114.272 -6.856 8.121 1.00 0.00 C ATOM 1600 CG ASN F 52 115.462 -7.153 9.032 1.00 0.00 C ATOM 1601 OD1 ASN F 52 116.411 -7.828 8.634 1.00 0.00 O ATOM 1602 ND2 ASN F 52 115.450 -6.686 10.243 1.00 0.00 N ATOM 0 H ASN F 52 111.963 -6.198 8.679 1.00 0.00 H new ATOM 0 HA ASN F 52 113.059 -8.449 7.351 1.00 0.00 H new ATOM 0 HB2 ASN F 52 114.604 -6.847 7.083 1.00 0.00 H new ATOM 0 HB3 ASN F 52 113.887 -5.860 8.341 1.00 0.00 H new ATOM 0 HD21 ASN F 52 116.230 -6.878 10.871 1.00 0.00 H new ATOM 0 HD22 ASN F 52 114.660 -6.127 10.566 1.00 0.00 H new ATOM 1609 N ASP F 53 113.124 -8.466 10.655 1.00 0.00 N ATOM 1610 CA ASP F 53 113.307 -9.304 11.839 1.00 0.00 C ATOM 1611 C ASP F 53 112.225 -10.389 11.903 1.00 0.00 C ATOM 1612 O ASP F 53 112.465 -11.487 12.409 1.00 0.00 O ATOM 1613 CB ASP F 53 113.252 -8.444 13.114 1.00 0.00 C ATOM 1614 CG ASP F 53 114.408 -7.432 13.142 1.00 0.00 C ATOM 1615 OD1 ASP F 53 115.548 -7.847 12.993 1.00 0.00 O ATOM 1616 OD2 ASP F 53 114.135 -6.254 13.315 1.00 0.00 O ATOM 0 H ASP F 53 112.755 -7.536 10.855 1.00 0.00 H new ATOM 0 HA ASP F 53 114.284 -9.783 11.771 1.00 0.00 H new ATOM 0 HB2 ASP F 53 112.300 -7.916 13.161 1.00 0.00 H new ATOM 0 HB3 ASP F 53 113.304 -9.086 13.993 1.00 0.00 H new ATOM 1621 N ALA F 54 111.030 -10.056 11.399 1.00 0.00 N ATOM 1622 CA ALA F 54 109.889 -10.980 11.398 1.00 0.00 C ATOM 1623 C ALA F 54 110.033 -12.057 10.317 1.00 0.00 C ATOM 1624 O ALA F 54 109.606 -13.198 10.509 1.00 0.00 O ATOM 1625 CB ALA F 54 108.591 -10.199 11.166 1.00 0.00 C ATOM 0 H ALA F 54 110.828 -9.147 10.984 1.00 0.00 H new ATOM 0 HA ALA F 54 109.862 -11.475 12.369 1.00 0.00 H new ATOM 0 HB1 ALA F 54 107.747 -10.888 11.166 1.00 0.00 H new ATOM 0 HB2 ALA F 54 108.461 -9.465 11.962 1.00 0.00 H new ATOM 0 HB3 ALA F 54 108.641 -9.687 10.205 1.00 0.00 H new ATOM 1631 N GLN F 55 110.626 -11.674 9.180 1.00 0.00 N ATOM 1632 CA GLN F 55 110.823 -12.592 8.049 1.00 0.00 C ATOM 1633 C GLN F 55 112.226 -13.197 8.081 1.00 0.00 C ATOM 1634 O GLN F 55 112.582 -14.025 7.238 1.00 0.00 O ATOM 1635 CB GLN F 55 110.608 -11.842 6.726 1.00 0.00 C ATOM 1636 CG GLN F 55 109.170 -11.308 6.671 1.00 0.00 C ATOM 1637 CD GLN F 55 108.878 -10.696 5.302 1.00 0.00 C ATOM 1638 OE1 GLN F 55 107.966 -11.137 4.604 1.00 0.00 O ATOM 1639 NE2 GLN F 55 109.604 -9.703 4.872 1.00 0.00 N ATOM 0 H GLN F 55 110.979 -10.731 9.017 1.00 0.00 H new ATOM 0 HA GLN F 55 110.097 -13.401 8.129 1.00 0.00 H new ATOM 0 HB2 GLN F 55 111.317 -11.018 6.643 1.00 0.00 H new ATOM 0 HB3 GLN F 55 110.793 -12.508 5.883 1.00 0.00 H new ATOM 0 HG2 GLN F 55 108.468 -12.117 6.871 1.00 0.00 H new ATOM 0 HG3 GLN F 55 109.024 -10.559 7.449 1.00 0.00 H new ATOM 0 HE21 GLN F 55 110.360 -9.337 5.450 1.00 0.00 H new ATOM 0 HE22 GLN F 55 109.416 -9.292 3.958 1.00 0.00 H new ATOM 1648 N ALA F 56 113.010 -12.762 9.064 1.00 0.00 N ATOM 1649 CA ALA F 56 114.376 -13.222 9.239 1.00 0.00 C ATOM 1650 C ALA F 56 114.436 -14.735 9.473 1.00 0.00 C ATOM 1651 O ALA F 56 113.413 -15.381 9.725 1.00 0.00 O ATOM 1652 CB ALA F 56 115.003 -12.486 10.430 1.00 0.00 C ATOM 0 H ALA F 56 112.711 -12.079 9.761 1.00 0.00 H new ATOM 0 HA ALA F 56 114.932 -13.007 8.327 1.00 0.00 H new ATOM 0 HB1 ALA F 56 116.029 -12.826 10.568 1.00 0.00 H new ATOM 0 HB2 ALA F 56 114.999 -11.413 10.238 1.00 0.00 H new ATOM 0 HB3 ALA F 56 114.427 -12.695 11.331 1.00 0.00 H new TER 1658 ALA F 56