USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=18 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= 0.884 K(o=1.1,f=-14!) USER MOD Set 1.2: F 26 GLN : amide:sc= 0.245 K(o=1.1,f=0.24) USER MOD Set 1.3: F 55 GLN : amide:sc=-0.00785 K(o=1.1,f=-6.8!) USER MOD Set 2.1: F 21 ASN : amide:sc= -1.21 K(o=-0.25,f=-7.4!) USER MOD Set 2.2: F 52 ASN : amide:sc= 0.967 K(o=-0.25,f=-4.5!) USER MOD Set 3.1: C 35 MET CE :methyl -168:sc= -2.55! (180deg=-3.14) USER MOD Set 3.2: F 18 TYR OH : rot -86:sc= 1.07 USER MOD Set 4.1: E 23 ASN :FLIP amide:sc= 0.0646 F(o=-1.4,f=-0.36) USER MOD Set 4.2: E 55 GLN : amide:sc= -0.425 K(o=-0.36,f=-1.4!) USER MOD Single : C 16 LYS NZ :NH3+ -156:sc= -0.112 (180deg=-0.626) USER MOD Single : C 26 SER OG : rot 76:sc= 0.606 USER MOD Single : C 27 ASN : amide:sc= -0.0923 X(o=-0.092,f=-0.092) USER MOD Single : C 28 LYS NZ :NH3+ 143:sc= -0.0321 (180deg=-0.256) USER MOD Single : E 18 TYR OH : rot 144:sc= 1.26 USER MOD Single : E 21 ASN : amide:sc= -1.96! X(o=-2!,f=-1.9) USER MOD Single : E 26 GLN :FLIP amide:sc= -0.329 F(o=-1.8,f=-0.33) USER MOD Single : E 32 HIS : no HD1:sc= -0.137 X(o=-0.14,f=-0.33) USER MOD Single : E 33 SER OG : rot 33:sc= 0.72 USER MOD Single : E 35 HIS : no HD1:sc= -1.51 X(o=-1.5,f=-1.2) USER MOD Single : E 39 SER OG : rot 180:sc= 0 USER MOD Single : E 40 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.15) USER MOD Single : E 41 SER OG : rot 180:sc= -0.443 USER MOD Single : E 43 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : E 49 LYS NZ :NH3+ 134:sc= 0.786 (180deg=-0.883) USER MOD Single : E 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 52 ASN : amide:sc= -0.0155 K(o=-0.015,f=-0.9) USER MOD Single : F 32 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : F 33 SER OG : rot 81:sc= 1.26 USER MOD Single : F 35 HIS : no HE2:sc= 1.1 K(o=1.1,f=-4!) USER MOD Single : F 39 SER OG : rot 180:sc= -0.0314 USER MOD Single : F 40 GLN : amide:sc= 1.08 K(o=1.1,f=-0.12) USER MOD Single : F 41 SER OG : rot -82:sc= -0.647 USER MOD Single : F 43 ASN : amide:sc=-0.00525 X(o=-0.0053,f=-0.49) USER MOD Single : F 49 LYS NZ :NH3+ -179:sc= 0.981 (180deg=0.98) USER MOD Single : F 50 LYS NZ :NH3+ 174:sc= 1.12 (180deg=1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS C 16 125.857 -9.832 -3.520 1.00 0.00 N ATOM 2 CA LYS C 16 124.575 -9.771 -2.847 1.00 0.00 C ATOM 3 C LYS C 16 124.105 -8.311 -2.731 1.00 0.00 C ATOM 4 O LYS C 16 124.791 -7.480 -2.127 1.00 0.00 O ATOM 5 CB LYS C 16 124.754 -10.395 -1.463 1.00 0.00 C ATOM 6 CG LYS C 16 123.403 -10.518 -0.747 1.00 0.00 C ATOM 7 CD LYS C 16 123.144 -9.299 0.152 1.00 0.00 C ATOM 8 CE LYS C 16 124.239 -9.153 1.225 1.00 0.00 C ATOM 9 NZ LYS C 16 124.543 -10.481 1.838 1.00 0.00 N ATOM 0 HA LYS C 16 123.816 -10.315 -3.410 1.00 0.00 H new ATOM 0 HB2 LYS C 16 125.212 -11.380 -1.559 1.00 0.00 H new ATOM 0 HB3 LYS C 16 125.433 -9.784 -0.868 1.00 0.00 H new ATOM 0 HG2 LYS C 16 122.604 -10.608 -1.483 1.00 0.00 H new ATOM 0 HG3 LYS C 16 123.387 -11.427 -0.146 1.00 0.00 H new ATOM 0 HD2 LYS C 16 123.106 -8.396 -0.458 1.00 0.00 H new ATOM 0 HD3 LYS C 16 122.171 -9.399 0.633 1.00 0.00 H new ATOM 0 HE2 LYS C 16 125.142 -8.735 0.779 1.00 0.00 H new ATOM 0 HE3 LYS C 16 123.912 -8.455 1.996 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 124.945 -10.341 2.787 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 123.668 -11.038 1.911 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 125.228 -10.989 1.243 1.00 0.00 H new ATOM 23 N LEU C 17 122.925 -8.015 -3.304 1.00 0.00 N ATOM 24 CA LEU C 17 122.351 -6.658 -3.250 1.00 0.00 C ATOM 25 C LEU C 17 121.569 -6.484 -1.953 1.00 0.00 C ATOM 26 O LEU C 17 120.934 -7.429 -1.470 1.00 0.00 O ATOM 27 CB LEU C 17 121.384 -6.409 -4.435 1.00 0.00 C ATOM 28 CG LEU C 17 122.016 -5.555 -5.559 1.00 0.00 C ATOM 29 CD1 LEU C 17 122.615 -4.249 -5.017 1.00 0.00 C ATOM 30 CD2 LEU C 17 123.086 -6.359 -6.301 1.00 0.00 C ATOM 0 H LEU C 17 122.353 -8.693 -3.807 1.00 0.00 H new ATOM 0 HA LEU C 17 123.175 -5.947 -3.305 1.00 0.00 H new ATOM 0 HB2 LEU C 17 121.069 -7.367 -4.848 1.00 0.00 H new ATOM 0 HB3 LEU C 17 120.488 -5.910 -4.067 1.00 0.00 H new ATOM 0 HG LEU C 17 121.220 -5.289 -6.255 1.00 0.00 H new ATOM 0 HD11 LEU C 17 123.048 -3.679 -5.839 1.00 0.00 H new ATOM 0 HD12 LEU C 17 121.832 -3.660 -4.540 1.00 0.00 H new ATOM 0 HD13 LEU C 17 123.391 -4.480 -4.287 1.00 0.00 H new ATOM 0 HD21 LEU C 17 123.522 -5.745 -7.089 1.00 0.00 H new ATOM 0 HD22 LEU C 17 123.866 -6.659 -5.601 1.00 0.00 H new ATOM 0 HD23 LEU C 17 122.633 -7.247 -6.742 1.00 0.00 H new ATOM 42 N VAL C 18 121.608 -5.269 -1.406 1.00 0.00 N ATOM 43 CA VAL C 18 120.890 -4.958 -0.169 1.00 0.00 C ATOM 44 C VAL C 18 120.155 -3.628 -0.327 1.00 0.00 C ATOM 45 O VAL C 18 120.747 -2.654 -0.773 1.00 0.00 O ATOM 46 CB VAL C 18 121.882 -4.880 1.008 1.00 0.00 C ATOM 47 CG1 VAL C 18 121.112 -4.779 2.332 1.00 0.00 C ATOM 48 CG2 VAL C 18 122.770 -6.140 1.033 1.00 0.00 C ATOM 0 H VAL C 18 122.128 -4.485 -1.799 1.00 0.00 H new ATOM 0 HA VAL C 18 120.165 -5.745 0.036 1.00 0.00 H new ATOM 0 HB VAL C 18 122.509 -3.997 0.881 1.00 0.00 H new ATOM 0 HG11 VAL C 18 121.818 -4.724 3.160 1.00 0.00 H new ATOM 0 HG12 VAL C 18 120.491 -3.883 2.324 1.00 0.00 H new ATOM 0 HG13 VAL C 18 120.479 -5.658 2.453 1.00 0.00 H new ATOM 0 HG21 VAL C 18 123.468 -6.077 1.868 1.00 0.00 H new ATOM 0 HG22 VAL C 18 122.144 -7.024 1.150 1.00 0.00 H new ATOM 0 HG23 VAL C 18 123.327 -6.211 0.099 1.00 0.00 H new ATOM 58 N PHE C 19 118.868 -3.596 0.040 1.00 0.00 N ATOM 59 CA PHE C 19 118.065 -2.377 -0.064 1.00 0.00 C ATOM 60 C PHE C 19 117.838 -1.792 1.317 1.00 0.00 C ATOM 61 O PHE C 19 117.391 -2.491 2.223 1.00 0.00 O ATOM 62 CB PHE C 19 116.699 -2.674 -0.717 1.00 0.00 C ATOM 63 CG PHE C 19 116.672 -2.119 -2.126 1.00 0.00 C ATOM 64 CD1 PHE C 19 117.518 -2.672 -3.097 1.00 0.00 C ATOM 65 CD2 PHE C 19 115.811 -1.053 -2.465 1.00 0.00 C ATOM 66 CE1 PHE C 19 117.515 -2.171 -4.398 1.00 0.00 C ATOM 67 CE2 PHE C 19 115.816 -0.556 -3.776 1.00 0.00 C ATOM 68 CZ PHE C 19 116.667 -1.117 -4.739 1.00 0.00 C ATOM 0 H PHE C 19 118.363 -4.401 0.411 1.00 0.00 H new ATOM 0 HA PHE C 19 118.607 -1.664 -0.686 1.00 0.00 H new ATOM 0 HB2 PHE C 19 116.521 -3.749 -0.736 1.00 0.00 H new ATOM 0 HB3 PHE C 19 115.899 -2.229 -0.126 1.00 0.00 H new ATOM 0 HD1 PHE C 19 118.174 -3.489 -2.836 1.00 0.00 H new ATOM 0 HD2 PHE C 19 115.155 -0.624 -1.722 1.00 0.00 H new ATOM 0 HE1 PHE C 19 118.170 -2.599 -5.143 1.00 0.00 H new ATOM 0 HE2 PHE C 19 115.163 0.261 -4.045 1.00 0.00 H new ATOM 0 HZ PHE C 19 116.666 -0.732 -5.748 1.00 0.00 H new ATOM 78 N PHE C 20 118.141 -0.511 1.461 1.00 0.00 N ATOM 79 CA PHE C 20 117.955 0.181 2.742 1.00 0.00 C ATOM 80 C PHE C 20 117.371 1.580 2.538 1.00 0.00 C ATOM 81 O PHE C 20 117.533 2.182 1.476 1.00 0.00 O ATOM 82 CB PHE C 20 119.288 0.275 3.494 1.00 0.00 C ATOM 83 CG PHE C 20 120.274 1.085 2.702 1.00 0.00 C ATOM 84 CD1 PHE C 20 120.224 2.483 2.743 1.00 0.00 C ATOM 85 CD2 PHE C 20 121.230 0.439 1.920 1.00 0.00 C ATOM 86 CE1 PHE C 20 121.131 3.231 2.001 1.00 0.00 C ATOM 87 CE2 PHE C 20 122.134 1.186 1.178 1.00 0.00 C ATOM 88 CZ PHE C 20 122.087 2.587 1.215 1.00 0.00 C ATOM 0 H PHE C 20 118.516 0.075 0.715 1.00 0.00 H new ATOM 0 HA PHE C 20 117.248 -0.399 3.335 1.00 0.00 H new ATOM 0 HB2 PHE C 20 119.131 0.733 4.471 1.00 0.00 H new ATOM 0 HB3 PHE C 20 119.686 -0.724 3.670 1.00 0.00 H new ATOM 0 HD1 PHE C 20 119.482 2.980 3.350 1.00 0.00 H new ATOM 0 HD2 PHE C 20 121.267 -0.640 1.892 1.00 0.00 H new ATOM 0 HE1 PHE C 20 121.096 4.310 2.033 1.00 0.00 H new ATOM 0 HE2 PHE C 20 122.875 0.687 0.571 1.00 0.00 H new ATOM 0 HZ PHE C 20 122.790 3.167 0.636 1.00 0.00 H new ATOM 98 N ALA C 21 116.711 2.099 3.578 1.00 0.00 N ATOM 99 CA ALA C 21 116.128 3.433 3.526 1.00 0.00 C ATOM 100 C ALA C 21 116.815 4.334 4.548 1.00 0.00 C ATOM 101 O ALA C 21 117.005 3.938 5.702 1.00 0.00 O ATOM 102 CB ALA C 21 114.632 3.356 3.813 1.00 0.00 C ATOM 0 H ALA C 21 116.570 1.612 4.463 1.00 0.00 H new ATOM 0 HA ALA C 21 116.273 3.852 2.530 1.00 0.00 H new ATOM 0 HB1 ALA C 21 114.202 4.357 3.773 1.00 0.00 H new ATOM 0 HB2 ALA C 21 114.150 2.724 3.067 1.00 0.00 H new ATOM 0 HB3 ALA C 21 114.473 2.932 4.805 1.00 0.00 H new ATOM 108 N GLU C 22 117.193 5.539 4.113 1.00 0.00 N ATOM 109 CA GLU C 22 117.866 6.499 4.969 1.00 0.00 C ATOM 110 C GLU C 22 116.897 7.598 5.385 1.00 0.00 C ATOM 111 O GLU C 22 116.282 8.221 4.532 1.00 0.00 O ATOM 112 CB GLU C 22 119.035 7.106 4.179 1.00 0.00 C ATOM 113 CG GLU C 22 119.721 8.192 5.005 1.00 0.00 C ATOM 114 CD GLU C 22 120.860 8.831 4.205 1.00 0.00 C ATOM 115 OE1 GLU C 22 121.830 8.141 3.941 1.00 0.00 O ATOM 116 OE2 GLU C 22 120.744 9.999 3.868 1.00 0.00 O ATOM 0 H GLU C 22 117.038 5.868 3.160 1.00 0.00 H new ATOM 0 HA GLU C 22 118.233 6.006 5.869 1.00 0.00 H new ATOM 0 HB2 GLU C 22 119.753 6.327 3.921 1.00 0.00 H new ATOM 0 HB3 GLU C 22 118.671 7.527 3.242 1.00 0.00 H new ATOM 0 HG2 GLU C 22 118.996 8.954 5.290 1.00 0.00 H new ATOM 0 HG3 GLU C 22 120.112 7.764 5.928 1.00 0.00 H new ATOM 123 N ASP C 23 116.799 7.850 6.694 1.00 0.00 N ATOM 124 CA ASP C 23 115.929 8.901 7.206 1.00 0.00 C ATOM 125 C ASP C 23 116.590 10.246 6.936 1.00 0.00 C ATOM 126 O ASP C 23 117.696 10.511 7.409 1.00 0.00 O ATOM 127 CB ASP C 23 115.696 8.717 8.711 1.00 0.00 C ATOM 128 CG ASP C 23 114.705 9.765 9.219 1.00 0.00 C ATOM 129 OD1 ASP C 23 113.512 9.536 9.094 1.00 0.00 O ATOM 130 OD2 ASP C 23 115.153 10.783 9.725 1.00 0.00 O ATOM 0 H ASP C 23 117.312 7.339 7.413 1.00 0.00 H new ATOM 0 HA ASP C 23 114.961 8.855 6.708 1.00 0.00 H new ATOM 0 HB2 ASP C 23 115.312 7.716 8.908 1.00 0.00 H new ATOM 0 HB3 ASP C 23 116.641 8.808 9.247 1.00 0.00 H new ATOM 135 N VAL C 24 115.929 11.061 6.123 1.00 0.00 N ATOM 136 CA VAL C 24 116.471 12.369 5.731 1.00 0.00 C ATOM 137 C VAL C 24 115.519 13.515 6.074 1.00 0.00 C ATOM 138 O VAL C 24 115.911 14.686 6.010 1.00 0.00 O ATOM 139 CB VAL C 24 116.756 12.346 4.214 1.00 0.00 C ATOM 140 CG1 VAL C 24 117.607 11.107 3.893 1.00 0.00 C ATOM 141 CG2 VAL C 24 115.427 12.304 3.424 1.00 0.00 C ATOM 0 H VAL C 24 115.017 10.845 5.719 1.00 0.00 H new ATOM 0 HA VAL C 24 117.390 12.546 6.290 1.00 0.00 H new ATOM 0 HB VAL C 24 117.296 13.247 3.924 1.00 0.00 H new ATOM 0 HG11 VAL C 24 117.817 11.077 2.824 1.00 0.00 H new ATOM 0 HG12 VAL C 24 118.545 11.157 4.446 1.00 0.00 H new ATOM 0 HG13 VAL C 24 117.063 10.207 4.182 1.00 0.00 H new ATOM 0 HG21 VAL C 24 115.640 12.288 2.355 1.00 0.00 H new ATOM 0 HG22 VAL C 24 114.870 11.408 3.697 1.00 0.00 H new ATOM 0 HG23 VAL C 24 114.834 13.187 3.663 1.00 0.00 H new ATOM 151 N GLY C 25 114.267 13.178 6.410 1.00 0.00 N ATOM 152 CA GLY C 25 113.267 14.196 6.727 1.00 0.00 C ATOM 153 C GLY C 25 113.097 15.119 5.527 1.00 0.00 C ATOM 154 O GLY C 25 112.852 14.647 4.417 1.00 0.00 O ATOM 0 H GLY C 25 113.928 12.218 6.468 1.00 0.00 H new ATOM 0 HA2 GLY C 25 112.316 13.724 6.976 1.00 0.00 H new ATOM 0 HA3 GLY C 25 113.577 14.769 7.601 1.00 0.00 H new ATOM 158 N SER C 26 113.268 16.424 5.753 1.00 0.00 N ATOM 159 CA SER C 26 113.170 17.422 4.678 1.00 0.00 C ATOM 160 C SER C 26 111.892 17.245 3.836 1.00 0.00 C ATOM 161 O SER C 26 111.874 17.574 2.646 1.00 0.00 O ATOM 162 CB SER C 26 114.410 17.318 3.776 1.00 0.00 C ATOM 163 OG SER C 26 115.580 17.232 4.584 1.00 0.00 O ATOM 0 H SER C 26 113.475 16.817 6.671 1.00 0.00 H new ATOM 0 HA SER C 26 113.120 18.409 5.139 1.00 0.00 H new ATOM 0 HB2 SER C 26 114.333 16.440 3.134 1.00 0.00 H new ATOM 0 HB3 SER C 26 114.470 18.187 3.121 1.00 0.00 H new ATOM 0 HG SER C 26 115.653 16.330 4.959 1.00 0.00 H new ATOM 169 N ASN C 27 110.843 16.703 4.466 1.00 0.00 N ATOM 170 CA ASN C 27 109.558 16.446 3.796 1.00 0.00 C ATOM 171 C ASN C 27 109.689 15.324 2.757 1.00 0.00 C ATOM 172 O ASN C 27 108.711 14.954 2.102 1.00 0.00 O ATOM 173 CB ASN C 27 109.016 17.728 3.134 1.00 0.00 C ATOM 174 CG ASN C 27 107.522 17.582 2.848 1.00 0.00 C ATOM 175 OD1 ASN C 27 106.708 17.598 3.769 1.00 0.00 O ATOM 176 ND2 ASN C 27 107.114 17.435 1.618 1.00 0.00 N ATOM 0 H ASN C 27 110.858 16.431 5.449 1.00 0.00 H new ATOM 0 HA ASN C 27 108.848 16.124 4.558 1.00 0.00 H new ATOM 0 HB2 ASN C 27 109.187 18.584 3.787 1.00 0.00 H new ATOM 0 HB3 ASN C 27 109.554 17.923 2.206 1.00 0.00 H new ATOM 0 HD21 ASN C 27 106.119 17.333 1.420 1.00 0.00 H new ATOM 0 HD22 ASN C 27 107.790 17.422 0.854 1.00 0.00 H new ATOM 183 N LYS C 28 110.901 14.773 2.643 1.00 0.00 N ATOM 184 CA LYS C 28 111.184 13.674 1.720 1.00 0.00 C ATOM 185 C LYS C 28 111.059 12.329 2.437 1.00 0.00 C ATOM 186 O LYS C 28 111.175 11.272 1.809 1.00 0.00 O ATOM 187 CB LYS C 28 112.607 13.819 1.169 1.00 0.00 C ATOM 188 CG LYS C 28 112.719 15.088 0.309 1.00 0.00 C ATOM 189 CD LYS C 28 113.967 15.011 -0.587 1.00 0.00 C ATOM 190 CE LYS C 28 115.246 15.147 0.252 1.00 0.00 C ATOM 191 NZ LYS C 28 115.445 16.576 0.630 1.00 0.00 N ATOM 0 H LYS C 28 111.709 15.076 3.186 1.00 0.00 H new ATOM 0 HA LYS C 28 110.463 13.711 0.903 1.00 0.00 H new ATOM 0 HB2 LYS C 28 113.320 13.865 1.992 1.00 0.00 H new ATOM 0 HB3 LYS C 28 112.864 12.944 0.573 1.00 0.00 H new ATOM 0 HG2 LYS C 28 111.826 15.200 -0.306 1.00 0.00 H new ATOM 0 HG3 LYS C 28 112.776 15.967 0.950 1.00 0.00 H new ATOM 0 HD2 LYS C 28 113.977 14.063 -1.124 1.00 0.00 H new ATOM 0 HD3 LYS C 28 113.932 15.801 -1.337 1.00 0.00 H new ATOM 0 HE2 LYS C 28 115.173 14.530 1.148 1.00 0.00 H new ATOM 0 HE3 LYS C 28 116.105 14.787 -0.314 1.00 0.00 H new ATOM 0 HZ1 LYS C 28 115.833 16.629 1.594 1.00 0.00 H new ATOM 0 HZ2 LYS C 28 116.108 17.022 -0.035 1.00 0.00 H new ATOM 0 HZ3 LYS C 28 114.533 17.074 0.596 1.00 0.00 H new ATOM 205 N GLY C 29 110.842 12.379 3.756 1.00 0.00 N ATOM 206 CA GLY C 29 110.727 11.164 4.559 1.00 0.00 C ATOM 207 C GLY C 29 112.077 10.460 4.609 1.00 0.00 C ATOM 208 O GLY C 29 112.954 10.840 5.392 1.00 0.00 O ATOM 0 H GLY C 29 110.743 13.245 4.285 1.00 0.00 H new ATOM 0 HA2 GLY C 29 110.396 11.412 5.568 1.00 0.00 H new ATOM 0 HA3 GLY C 29 109.975 10.502 4.130 1.00 0.00 H new ATOM 212 N ALA C 30 112.240 9.448 3.752 1.00 0.00 N ATOM 213 CA ALA C 30 113.491 8.698 3.670 1.00 0.00 C ATOM 214 C ALA C 30 113.913 8.518 2.210 1.00 0.00 C ATOM 215 O ALA C 30 113.104 8.699 1.294 1.00 0.00 O ATOM 216 CB ALA C 30 113.339 7.333 4.340 1.00 0.00 C ATOM 0 H ALA C 30 111.518 9.131 3.105 1.00 0.00 H new ATOM 0 HA ALA C 30 114.263 9.263 4.192 1.00 0.00 H new ATOM 0 HB1 ALA C 30 114.280 6.787 4.270 1.00 0.00 H new ATOM 0 HB2 ALA C 30 113.076 7.470 5.389 1.00 0.00 H new ATOM 0 HB3 ALA C 30 112.553 6.767 3.839 1.00 0.00 H new ATOM 222 N ILE C 31 115.186 8.159 2.010 1.00 0.00 N ATOM 223 CA ILE C 31 115.736 7.951 0.669 1.00 0.00 C ATOM 224 C ILE C 31 116.084 6.485 0.465 1.00 0.00 C ATOM 225 O ILE C 31 116.693 5.860 1.337 1.00 0.00 O ATOM 226 CB ILE C 31 117.014 8.789 0.460 1.00 0.00 C ATOM 227 CG1 ILE C 31 116.718 10.280 0.695 1.00 0.00 C ATOM 228 CG2 ILE C 31 117.523 8.587 -0.973 1.00 0.00 C ATOM 229 CD1 ILE C 31 117.982 11.123 0.459 1.00 0.00 C ATOM 0 H ILE C 31 115.856 8.006 2.764 1.00 0.00 H new ATOM 0 HA ILE C 31 114.978 8.261 -0.050 1.00 0.00 H new ATOM 0 HB ILE C 31 117.773 8.465 1.172 1.00 0.00 H new ATOM 0 HG12 ILE C 31 115.924 10.609 0.025 1.00 0.00 H new ATOM 0 HG13 ILE C 31 116.359 10.430 1.713 1.00 0.00 H new ATOM 0 HG21 ILE C 31 118.426 9.178 -1.125 1.00 0.00 H new ATOM 0 HG22 ILE C 31 117.748 7.533 -1.134 1.00 0.00 H new ATOM 0 HG23 ILE C 31 116.757 8.907 -1.680 1.00 0.00 H new ATOM 0 HD11 ILE C 31 117.755 12.175 0.630 1.00 0.00 H new ATOM 0 HD12 ILE C 31 118.765 10.805 1.147 1.00 0.00 H new ATOM 0 HD13 ILE C 31 118.323 10.987 -0.567 1.00 0.00 H new ATOM 241 N ILE C 32 115.718 5.958 -0.701 1.00 0.00 N ATOM 242 CA ILE C 32 116.015 4.576 -1.034 1.00 0.00 C ATOM 243 C ILE C 32 117.425 4.475 -1.602 1.00 0.00 C ATOM 244 O ILE C 32 117.719 5.001 -2.680 1.00 0.00 O ATOM 245 CB ILE C 32 114.972 4.020 -2.038 1.00 0.00 C ATOM 246 CG1 ILE C 32 113.768 3.445 -1.269 1.00 0.00 C ATOM 247 CG2 ILE C 32 115.584 2.923 -2.933 1.00 0.00 C ATOM 248 CD1 ILE C 32 114.149 2.122 -0.578 1.00 0.00 C ATOM 0 H ILE C 32 115.216 6.470 -1.427 1.00 0.00 H new ATOM 0 HA ILE C 32 115.959 3.973 -0.128 1.00 0.00 H new ATOM 0 HB ILE C 32 114.647 4.840 -2.678 1.00 0.00 H new ATOM 0 HG12 ILE C 32 113.427 4.165 -0.525 1.00 0.00 H new ATOM 0 HG13 ILE C 32 112.938 3.278 -1.955 1.00 0.00 H new ATOM 0 HG21 ILE C 32 114.827 2.554 -3.625 1.00 0.00 H new ATOM 0 HG22 ILE C 32 116.420 3.337 -3.496 1.00 0.00 H new ATOM 0 HG23 ILE C 32 115.938 2.101 -2.311 1.00 0.00 H new ATOM 0 HD11 ILE C 32 113.286 1.731 -0.040 1.00 0.00 H new ATOM 0 HD12 ILE C 32 114.467 1.398 -1.328 1.00 0.00 H new ATOM 0 HD13 ILE C 32 114.964 2.300 0.124 1.00 0.00 H new ATOM 260 N GLY C 33 118.271 3.760 -0.870 1.00 0.00 N ATOM 261 CA GLY C 33 119.647 3.524 -1.273 1.00 0.00 C ATOM 262 C GLY C 33 119.966 2.059 -1.058 1.00 0.00 C ATOM 263 O GLY C 33 119.454 1.443 -0.124 1.00 0.00 O ATOM 0 H GLY C 33 118.020 3.329 0.019 1.00 0.00 H new ATOM 0 HA2 GLY C 33 119.786 3.792 -2.320 1.00 0.00 H new ATOM 0 HA3 GLY C 33 120.325 4.149 -0.691 1.00 0.00 H new ATOM 267 N LEU C 34 120.789 1.501 -1.926 1.00 0.00 N ATOM 268 CA LEU C 34 121.151 0.089 -1.820 1.00 0.00 C ATOM 269 C LEU C 34 122.648 -0.092 -1.724 1.00 0.00 C ATOM 270 O LEU C 34 123.425 0.808 -2.040 1.00 0.00 O ATOM 271 CB LEU C 34 120.627 -0.706 -3.019 1.00 0.00 C ATOM 272 CG LEU C 34 120.850 0.077 -4.317 1.00 0.00 C ATOM 273 CD1 LEU C 34 121.210 -0.905 -5.441 1.00 0.00 C ATOM 274 CD2 LEU C 34 119.574 0.861 -4.667 1.00 0.00 C ATOM 0 H LEU C 34 121.220 1.994 -2.708 1.00 0.00 H new ATOM 0 HA LEU C 34 120.689 -0.288 -0.907 1.00 0.00 H new ATOM 0 HB2 LEU C 34 121.135 -1.669 -3.075 1.00 0.00 H new ATOM 0 HB3 LEU C 34 119.565 -0.914 -2.890 1.00 0.00 H new ATOM 0 HG LEU C 34 121.669 0.786 -4.193 1.00 0.00 H new ATOM 0 HD11 LEU C 34 121.370 -0.354 -6.368 1.00 0.00 H new ATOM 0 HD12 LEU C 34 122.120 -1.443 -5.177 1.00 0.00 H new ATOM 0 HD13 LEU C 34 120.395 -1.616 -5.578 1.00 0.00 H new ATOM 0 HD21 LEU C 34 119.731 1.419 -5.590 1.00 0.00 H new ATOM 0 HD22 LEU C 34 118.745 0.166 -4.800 1.00 0.00 H new ATOM 0 HD23 LEU C 34 119.340 1.555 -3.860 1.00 0.00 H new ATOM 286 N MET C 35 123.026 -1.281 -1.279 1.00 0.00 N ATOM 287 CA MET C 35 124.430 -1.644 -1.120 1.00 0.00 C ATOM 288 C MET C 35 124.790 -2.736 -2.127 1.00 0.00 C ATOM 289 O MET C 35 123.966 -3.605 -2.428 1.00 0.00 O ATOM 290 CB MET C 35 124.681 -2.075 0.349 1.00 0.00 C ATOM 291 CG MET C 35 125.121 -3.545 0.462 1.00 0.00 C ATOM 292 SD MET C 35 125.019 -4.079 2.184 1.00 0.00 S ATOM 293 CE MET C 35 126.214 -2.902 2.840 1.00 0.00 C ATOM 0 H MET C 35 122.373 -2.020 -1.018 1.00 0.00 H new ATOM 0 HA MET C 35 125.078 -0.792 -1.325 1.00 0.00 H new ATOM 0 HB2 MET C 35 125.447 -1.435 0.787 1.00 0.00 H new ATOM 0 HB3 MET C 35 123.770 -1.925 0.929 1.00 0.00 H new ATOM 0 HG2 MET C 35 124.486 -4.174 -0.162 1.00 0.00 H new ATOM 0 HG3 MET C 35 126.141 -3.659 0.096 1.00 0.00 H new ATOM 0 HE1 MET C 35 126.477 -3.181 3.860 1.00 0.00 H new ATOM 0 HE2 MET C 35 127.110 -2.909 2.219 1.00 0.00 H new ATOM 0 HE3 MET C 35 125.779 -1.903 2.838 1.00 0.00 H new ATOM 303 N VAL C 36 126.016 -2.667 -2.650 1.00 0.00 N ATOM 304 CA VAL C 36 126.488 -3.634 -3.641 1.00 0.00 C ATOM 305 C VAL C 36 127.794 -4.289 -3.167 1.00 0.00 C ATOM 306 O VAL C 36 128.801 -3.604 -2.968 1.00 0.00 O ATOM 307 CB VAL C 36 126.743 -2.925 -4.990 1.00 0.00 C ATOM 308 CG1 VAL C 36 126.849 -3.970 -6.110 1.00 0.00 C ATOM 309 CG2 VAL C 36 125.604 -1.940 -5.316 1.00 0.00 C ATOM 0 H VAL C 36 126.699 -1.951 -2.403 1.00 0.00 H new ATOM 0 HA VAL C 36 125.723 -4.400 -3.766 1.00 0.00 H new ATOM 0 HB VAL C 36 127.676 -2.366 -4.914 1.00 0.00 H new ATOM 0 HG11 VAL C 36 127.029 -3.468 -7.060 1.00 0.00 H new ATOM 0 HG12 VAL C 36 127.674 -4.649 -5.897 1.00 0.00 H new ATOM 0 HG13 VAL C 36 125.919 -4.536 -6.169 1.00 0.00 H new ATOM 0 HG21 VAL C 36 125.806 -1.453 -6.270 1.00 0.00 H new ATOM 0 HG22 VAL C 36 124.661 -2.482 -5.378 1.00 0.00 H new ATOM 0 HG23 VAL C 36 125.539 -1.187 -4.531 1.00 0.00 H new ATOM 319 N GLY C 37 127.771 -5.615 -3.016 1.00 0.00 N ATOM 320 CA GLY C 37 128.958 -6.376 -2.597 1.00 0.00 C ATOM 321 C GLY C 37 128.958 -6.684 -1.111 1.00 0.00 C ATOM 322 O GLY C 37 129.215 -5.806 -0.283 1.00 0.00 O ATOM 0 H GLY C 37 126.943 -6.188 -3.177 1.00 0.00 H new ATOM 0 HA2 GLY C 37 129.003 -7.309 -3.158 1.00 0.00 H new ATOM 0 HA3 GLY C 37 129.855 -5.810 -2.847 1.00 0.00 H new ATOM 326 N GLY C 38 128.679 -7.955 -0.788 1.00 0.00 N ATOM 327 CA GLY C 38 128.652 -8.420 0.590 1.00 0.00 C ATOM 328 C GLY C 38 127.712 -7.578 1.432 1.00 0.00 C ATOM 329 O GLY C 38 126.775 -6.961 0.914 1.00 0.00 O ATOM 0 H GLY C 38 128.468 -8.679 -1.475 1.00 0.00 H new ATOM 0 HA2 GLY C 38 128.336 -9.463 0.619 1.00 0.00 H new ATOM 0 HA3 GLY C 38 129.657 -8.380 1.011 1.00 0.00 H new ATOM 333 N VAL C 39 127.975 -7.562 2.729 1.00 0.00 N ATOM 334 CA VAL C 39 127.163 -6.799 3.661 1.00 0.00 C ATOM 335 C VAL C 39 128.052 -6.140 4.725 1.00 0.00 C ATOM 336 O VAL C 39 129.106 -6.677 5.080 1.00 0.00 O ATOM 337 CB VAL C 39 126.125 -7.732 4.311 1.00 0.00 C ATOM 338 CG1 VAL C 39 126.836 -8.921 4.974 1.00 0.00 C ATOM 339 CG2 VAL C 39 125.301 -6.966 5.362 1.00 0.00 C ATOM 0 H VAL C 39 128.747 -8.071 3.160 1.00 0.00 H new ATOM 0 HA VAL C 39 126.639 -6.007 3.126 1.00 0.00 H new ATOM 0 HB VAL C 39 125.452 -8.100 3.537 1.00 0.00 H new ATOM 0 HG11 VAL C 39 126.096 -9.578 5.432 1.00 0.00 H new ATOM 0 HG12 VAL C 39 127.397 -9.475 4.221 1.00 0.00 H new ATOM 0 HG13 VAL C 39 127.520 -8.555 5.740 1.00 0.00 H new ATOM 0 HG21 VAL C 39 124.571 -7.638 5.813 1.00 0.00 H new ATOM 0 HG22 VAL C 39 125.966 -6.581 6.135 1.00 0.00 H new ATOM 0 HG23 VAL C 39 124.782 -6.136 4.883 1.00 0.00 H new ATOM 349 N VAL C 40 127.611 -4.981 5.228 1.00 0.00 N ATOM 350 CA VAL C 40 128.357 -4.242 6.258 1.00 0.00 C ATOM 351 C VAL C 40 127.690 -4.436 7.627 1.00 0.00 C ATOM 352 O VAL C 40 126.508 -4.150 7.735 1.00 0.00 O ATOM 353 CB VAL C 40 128.405 -2.739 5.903 1.00 0.00 C ATOM 354 CG1 VAL C 40 129.126 -1.951 7.011 1.00 0.00 C ATOM 355 CG2 VAL C 40 129.156 -2.541 4.574 1.00 0.00 C ATOM 356 OXT VAL C 40 128.372 -4.861 8.546 1.00 0.00 O ATOM 0 H VAL C 40 126.741 -4.533 4.940 1.00 0.00 H new ATOM 0 HA VAL C 40 129.376 -4.627 6.301 1.00 0.00 H new ATOM 0 HB VAL C 40 127.383 -2.372 5.808 1.00 0.00 H new ATOM 0 HG11 VAL C 40 129.152 -0.894 6.747 1.00 0.00 H new ATOM 0 HG12 VAL C 40 128.592 -2.077 7.953 1.00 0.00 H new ATOM 0 HG13 VAL C 40 130.145 -2.324 7.118 1.00 0.00 H new ATOM 0 HG21 VAL C 40 129.187 -1.480 4.328 1.00 0.00 H new ATOM 0 HG22 VAL C 40 130.173 -2.921 4.671 1.00 0.00 H new ATOM 0 HG23 VAL C 40 128.640 -3.082 3.781 1.00 0.00 H new TER 366 VAL C 40 ATOM 367 N GLY E 14 131.163 -2.586 0.589 1.00 0.00 N ATOM 368 CA GLY E 14 130.530 -2.638 -0.728 1.00 0.00 C ATOM 369 C GLY E 14 130.141 -1.247 -1.231 1.00 0.00 C ATOM 370 O GLY E 14 129.941 -0.320 -0.442 1.00 0.00 O ATOM 0 HA2 GLY E 14 131.212 -3.104 -1.440 1.00 0.00 H new ATOM 0 HA3 GLY E 14 129.642 -3.268 -0.679 1.00 0.00 H new ATOM 374 N GLU E 15 130.008 -1.128 -2.557 1.00 0.00 N ATOM 375 CA GLU E 15 129.609 0.132 -3.185 1.00 0.00 C ATOM 376 C GLU E 15 128.166 0.439 -2.812 1.00 0.00 C ATOM 377 O GLU E 15 127.298 -0.418 -2.956 1.00 0.00 O ATOM 378 CB GLU E 15 129.754 0.014 -4.716 1.00 0.00 C ATOM 379 CG GLU E 15 129.214 1.275 -5.416 1.00 0.00 C ATOM 380 CD GLU E 15 129.349 1.137 -6.935 1.00 0.00 C ATOM 381 OE1 GLU E 15 130.473 1.095 -7.410 1.00 0.00 O ATOM 382 OE2 GLU E 15 128.327 1.077 -7.604 1.00 0.00 O ATOM 0 H GLU E 15 130.171 -1.891 -3.214 1.00 0.00 H new ATOM 0 HA GLU E 15 130.249 0.942 -2.835 1.00 0.00 H new ATOM 0 HB2 GLU E 15 130.803 -0.131 -4.976 1.00 0.00 H new ATOM 0 HB3 GLU E 15 129.213 -0.864 -5.070 1.00 0.00 H new ATOM 0 HG2 GLU E 15 128.168 1.428 -5.149 1.00 0.00 H new ATOM 0 HG3 GLU E 15 129.762 2.153 -5.073 1.00 0.00 H new ATOM 389 N ILE E 16 127.916 1.660 -2.331 1.00 0.00 N ATOM 390 CA ILE E 16 126.566 2.054 -1.932 1.00 0.00 C ATOM 391 C ILE E 16 125.969 3.038 -2.947 1.00 0.00 C ATOM 392 O ILE E 16 126.585 4.044 -3.304 1.00 0.00 O ATOM 393 CB ILE E 16 126.588 2.646 -0.508 1.00 0.00 C ATOM 394 CG1 ILE E 16 127.282 1.624 0.451 1.00 0.00 C ATOM 395 CG2 ILE E 16 125.146 2.940 -0.063 1.00 0.00 C ATOM 396 CD1 ILE E 16 126.566 1.499 1.810 1.00 0.00 C ATOM 0 H ILE E 16 128.624 2.385 -2.210 1.00 0.00 H new ATOM 0 HA ILE E 16 125.926 1.172 -1.919 1.00 0.00 H new ATOM 0 HB ILE E 16 127.149 3.580 -0.485 1.00 0.00 H new ATOM 0 HG12 ILE E 16 127.314 0.646 -0.029 1.00 0.00 H new ATOM 0 HG13 ILE E 16 128.315 1.931 0.616 1.00 0.00 H new ATOM 0 HG21 ILE E 16 125.154 3.359 0.943 1.00 0.00 H new ATOM 0 HG22 ILE E 16 124.692 3.654 -0.750 1.00 0.00 H new ATOM 0 HG23 ILE E 16 124.568 2.016 -0.067 1.00 0.00 H new ATOM 0 HD11 ILE E 16 127.092 0.776 2.433 1.00 0.00 H new ATOM 0 HD12 ILE E 16 126.558 2.469 2.307 1.00 0.00 H new ATOM 0 HD13 ILE E 16 125.541 1.163 1.652 1.00 0.00 H new ATOM 408 N VAL E 17 124.768 2.685 -3.417 1.00 0.00 N ATOM 409 CA VAL E 17 124.028 3.457 -4.424 1.00 0.00 C ATOM 410 C VAL E 17 122.752 4.083 -3.847 1.00 0.00 C ATOM 411 O VAL E 17 122.084 3.488 -3.006 1.00 0.00 O ATOM 412 CB VAL E 17 123.668 2.504 -5.585 1.00 0.00 C ATOM 413 CG1 VAL E 17 122.633 3.145 -6.531 1.00 0.00 C ATOM 414 CG2 VAL E 17 124.940 2.172 -6.375 1.00 0.00 C ATOM 0 H VAL E 17 124.276 1.847 -3.107 1.00 0.00 H new ATOM 0 HA VAL E 17 124.655 4.278 -4.771 1.00 0.00 H new ATOM 0 HB VAL E 17 123.233 1.597 -5.166 1.00 0.00 H new ATOM 0 HG11 VAL E 17 122.399 2.451 -7.338 1.00 0.00 H new ATOM 0 HG12 VAL E 17 121.724 3.374 -5.975 1.00 0.00 H new ATOM 0 HG13 VAL E 17 123.043 4.064 -6.950 1.00 0.00 H new ATOM 0 HG21 VAL E 17 124.693 1.499 -7.196 1.00 0.00 H new ATOM 0 HG22 VAL E 17 125.370 3.090 -6.775 1.00 0.00 H new ATOM 0 HG23 VAL E 17 125.662 1.690 -5.716 1.00 0.00 H new ATOM 424 N TYR E 18 122.423 5.283 -4.342 1.00 0.00 N ATOM 425 CA TYR E 18 121.213 6.009 -3.929 1.00 0.00 C ATOM 426 C TYR E 18 120.379 6.354 -5.166 1.00 0.00 C ATOM 427 O TYR E 18 120.909 6.909 -6.131 1.00 0.00 O ATOM 428 CB TYR E 18 121.595 7.297 -3.176 1.00 0.00 C ATOM 429 CG TYR E 18 121.884 6.980 -1.734 1.00 0.00 C ATOM 430 CD1 TYR E 18 123.054 6.304 -1.386 1.00 0.00 C ATOM 431 CD2 TYR E 18 120.979 7.372 -0.743 1.00 0.00 C ATOM 432 CE1 TYR E 18 123.318 6.019 -0.049 1.00 0.00 C ATOM 433 CE2 TYR E 18 121.241 7.091 0.593 1.00 0.00 C ATOM 434 CZ TYR E 18 122.415 6.411 0.947 1.00 0.00 C ATOM 435 OH TYR E 18 122.683 6.130 2.271 1.00 0.00 O ATOM 0 H TYR E 18 122.984 5.777 -5.036 1.00 0.00 H new ATOM 0 HA TYR E 18 120.627 5.377 -3.261 1.00 0.00 H new ATOM 0 HB2 TYR E 18 122.469 7.754 -3.639 1.00 0.00 H new ATOM 0 HB3 TYR E 18 120.784 8.022 -3.243 1.00 0.00 H new ATOM 0 HD1 TYR E 18 123.753 6.003 -2.152 1.00 0.00 H new ATOM 0 HD2 TYR E 18 120.074 7.894 -1.016 1.00 0.00 H new ATOM 0 HE1 TYR E 18 124.222 5.494 0.221 1.00 0.00 H new ATOM 0 HE2 TYR E 18 120.541 7.396 1.357 1.00 0.00 H new ATOM 0 HH TYR E 18 122.366 6.868 2.833 1.00 0.00 H new ATOM 445 N LEU E 19 119.076 6.023 -5.130 1.00 0.00 N ATOM 446 CA LEU E 19 118.178 6.306 -6.262 1.00 0.00 C ATOM 447 C LEU E 19 116.952 7.126 -5.802 1.00 0.00 C ATOM 448 O LEU E 19 115.804 6.695 -5.976 1.00 0.00 O ATOM 449 CB LEU E 19 117.712 4.986 -6.917 1.00 0.00 C ATOM 450 CG LEU E 19 118.907 4.201 -7.501 1.00 0.00 C ATOM 451 CD1 LEU E 19 118.513 2.728 -7.706 1.00 0.00 C ATOM 452 CD2 LEU E 19 119.344 4.804 -8.848 1.00 0.00 C ATOM 0 H LEU E 19 118.626 5.564 -4.338 1.00 0.00 H new ATOM 0 HA LEU E 19 118.731 6.894 -6.995 1.00 0.00 H new ATOM 0 HB2 LEU E 19 117.196 4.372 -6.178 1.00 0.00 H new ATOM 0 HB3 LEU E 19 116.994 5.203 -7.708 1.00 0.00 H new ATOM 0 HG LEU E 19 119.738 4.265 -6.799 1.00 0.00 H new ATOM 0 HD11 LEU E 19 119.360 2.179 -8.118 1.00 0.00 H new ATOM 0 HD12 LEU E 19 118.228 2.291 -6.749 1.00 0.00 H new ATOM 0 HD13 LEU E 19 117.672 2.669 -8.396 1.00 0.00 H new ATOM 0 HD21 LEU E 19 120.187 4.238 -9.244 1.00 0.00 H new ATOM 0 HD22 LEU E 19 118.514 4.760 -9.553 1.00 0.00 H new ATOM 0 HD23 LEU E 19 119.641 5.843 -8.702 1.00 0.00 H new ATOM 464 N PRO E 20 117.166 8.307 -5.242 1.00 0.00 N ATOM 465 CA PRO E 20 116.049 9.199 -4.781 1.00 0.00 C ATOM 466 C PRO E 20 115.273 9.773 -5.960 1.00 0.00 C ATOM 467 O PRO E 20 114.142 10.243 -5.809 1.00 0.00 O ATOM 468 CB PRO E 20 116.764 10.329 -4.027 1.00 0.00 C ATOM 469 CG PRO E 20 118.148 10.359 -4.583 1.00 0.00 C ATOM 470 CD PRO E 20 118.482 8.924 -4.988 1.00 0.00 C ATOM 0 HA PRO E 20 115.324 8.661 -4.170 1.00 0.00 H new ATOM 0 HB2 PRO E 20 116.259 11.283 -4.177 1.00 0.00 H new ATOM 0 HB3 PRO E 20 116.775 10.140 -2.954 1.00 0.00 H new ATOM 0 HG2 PRO E 20 118.207 11.028 -5.441 1.00 0.00 H new ATOM 0 HG3 PRO E 20 118.856 10.728 -3.841 1.00 0.00 H new ATOM 0 HD2 PRO E 20 119.113 8.897 -5.876 1.00 0.00 H new ATOM 0 HD3 PRO E 20 119.021 8.402 -4.198 1.00 0.00 H new ATOM 478 N ASN E 21 115.924 9.762 -7.122 1.00 0.00 N ATOM 479 CA ASN E 21 115.351 10.313 -8.342 1.00 0.00 C ATOM 480 C ASN E 21 114.488 9.299 -9.095 1.00 0.00 C ATOM 481 O ASN E 21 113.887 9.647 -10.114 1.00 0.00 O ATOM 482 CB ASN E 21 116.497 10.787 -9.246 1.00 0.00 C ATOM 483 CG ASN E 21 117.356 11.832 -8.523 1.00 0.00 C ATOM 484 OD1 ASN E 21 116.871 12.549 -7.647 1.00 0.00 O ATOM 485 ND2 ASN E 21 118.616 11.962 -8.841 1.00 0.00 N ATOM 0 H ASN E 21 116.859 9.372 -7.241 1.00 0.00 H new ATOM 0 HA ASN E 21 114.699 11.142 -8.066 1.00 0.00 H new ATOM 0 HB2 ASN E 21 117.115 9.937 -9.535 1.00 0.00 H new ATOM 0 HB3 ASN E 21 116.091 11.213 -10.164 1.00 0.00 H new ATOM 0 HD21 ASN E 21 119.193 12.655 -8.365 1.00 0.00 H new ATOM 0 HD22 ASN E 21 119.023 11.371 -9.566 1.00 0.00 H new ATOM 492 N LEU E 22 114.421 8.051 -8.603 1.00 0.00 N ATOM 493 CA LEU E 22 113.622 7.022 -9.266 1.00 0.00 C ATOM 494 C LEU E 22 112.253 6.893 -8.618 1.00 0.00 C ATOM 495 O LEU E 22 112.133 6.838 -7.391 1.00 0.00 O ATOM 496 CB LEU E 22 114.360 5.678 -9.225 1.00 0.00 C ATOM 497 CG LEU E 22 115.285 5.545 -10.451 1.00 0.00 C ATOM 498 CD1 LEU E 22 116.289 6.714 -10.508 1.00 0.00 C ATOM 499 CD2 LEU E 22 116.038 4.207 -10.371 1.00 0.00 C ATOM 0 H LEU E 22 114.905 7.739 -7.761 1.00 0.00 H new ATOM 0 HA LEU E 22 113.476 7.317 -10.305 1.00 0.00 H new ATOM 0 HB2 LEU E 22 114.945 5.603 -8.308 1.00 0.00 H new ATOM 0 HB3 LEU E 22 113.641 4.859 -9.212 1.00 0.00 H new ATOM 0 HG LEU E 22 114.680 5.574 -11.357 1.00 0.00 H new ATOM 0 HD11 LEU E 22 116.932 6.600 -11.381 1.00 0.00 H new ATOM 0 HD12 LEU E 22 115.746 7.657 -10.578 1.00 0.00 H new ATOM 0 HD13 LEU E 22 116.900 6.713 -9.605 1.00 0.00 H new ATOM 0 HD21 LEU E 22 116.694 4.107 -11.236 1.00 0.00 H new ATOM 0 HD22 LEU E 22 116.633 4.178 -9.458 1.00 0.00 H new ATOM 0 HD23 LEU E 22 115.321 3.386 -10.362 1.00 0.00 H new ATOM 511 N ASN E 23 111.228 6.835 -9.466 1.00 0.00 N ATOM 512 CA ASN E 23 109.846 6.701 -9.000 1.00 0.00 C ATOM 513 C ASN E 23 109.624 5.290 -8.444 1.00 0.00 C ATOM 514 O ASN E 23 110.390 4.377 -8.769 1.00 0.00 O ATOM 515 CB ASN E 23 108.877 6.962 -10.164 1.00 0.00 C ATOM 516 CG ASN E 23 109.129 8.347 -10.763 1.00 0.00 C ATOM 517 OD1 ASN E 23 109.596 8.449 -11.977 1.00 0.00 O flip ATOM 518 ND2 ASN E 23 108.896 9.360 -10.105 1.00 0.00 N flip ATOM 0 H ASN E 23 111.327 6.879 -10.480 1.00 0.00 H new ATOM 0 HA ASN E 23 109.660 7.430 -8.212 1.00 0.00 H new ATOM 0 HB2 ASN E 23 109.004 6.198 -10.931 1.00 0.00 H new ATOM 0 HB3 ASN E 23 107.848 6.892 -9.812 1.00 0.00 H new ATOM 0 HD21 ASN E 23 108.531 9.279 -9.156 1.00 0.00 H new ATOM 0 HD22 ASN E 23 109.068 10.281 -10.508 1.00 0.00 H new ATOM 525 N PRO E 24 108.601 5.075 -7.627 1.00 0.00 N ATOM 526 CA PRO E 24 108.313 3.718 -7.051 1.00 0.00 C ATOM 527 C PRO E 24 108.220 2.655 -8.147 1.00 0.00 C ATOM 528 O PRO E 24 108.590 1.499 -7.938 1.00 0.00 O ATOM 529 CB PRO E 24 106.968 3.893 -6.333 1.00 0.00 C ATOM 530 CG PRO E 24 106.854 5.356 -6.052 1.00 0.00 C ATOM 531 CD PRO E 24 107.620 6.078 -7.163 1.00 0.00 C ATOM 0 HA PRO E 24 109.102 3.376 -6.382 1.00 0.00 H new ATOM 0 HB2 PRO E 24 106.143 3.547 -6.956 1.00 0.00 H new ATOM 0 HB3 PRO E 24 106.937 3.312 -5.411 1.00 0.00 H new ATOM 0 HG2 PRO E 24 105.809 5.667 -6.037 1.00 0.00 H new ATOM 0 HG3 PRO E 24 107.272 5.596 -5.074 1.00 0.00 H new ATOM 0 HD2 PRO E 24 106.956 6.390 -7.969 1.00 0.00 H new ATOM 0 HD3 PRO E 24 108.113 6.976 -6.790 1.00 0.00 H new ATOM 539 N ASP E 25 107.753 3.083 -9.323 1.00 0.00 N ATOM 540 CA ASP E 25 107.641 2.193 -10.476 1.00 0.00 C ATOM 541 C ASP E 25 109.032 1.763 -10.926 1.00 0.00 C ATOM 542 O ASP E 25 109.295 0.577 -11.133 1.00 0.00 O ATOM 543 CB ASP E 25 106.949 2.929 -11.631 1.00 0.00 C ATOM 544 CG ASP E 25 105.534 3.356 -11.226 1.00 0.00 C ATOM 545 OD1 ASP E 25 104.712 2.482 -11.003 1.00 0.00 O ATOM 546 OD2 ASP E 25 105.296 4.551 -11.142 1.00 0.00 O ATOM 0 H ASP E 25 107.447 4.040 -9.499 1.00 0.00 H new ATOM 0 HA ASP E 25 107.056 1.317 -10.195 1.00 0.00 H new ATOM 0 HB2 ASP E 25 107.533 3.805 -11.913 1.00 0.00 H new ATOM 0 HB3 ASP E 25 106.903 2.282 -12.507 1.00 0.00 H new ATOM 551 N GLN E 26 109.917 2.752 -11.072 1.00 0.00 N ATOM 552 CA GLN E 26 111.286 2.509 -11.495 1.00 0.00 C ATOM 553 C GLN E 26 112.016 1.633 -10.480 1.00 0.00 C ATOM 554 O GLN E 26 112.688 0.668 -10.858 1.00 0.00 O ATOM 555 CB GLN E 26 112.007 3.853 -11.641 1.00 0.00 C ATOM 556 CG GLN E 26 111.326 4.703 -12.726 1.00 0.00 C ATOM 557 CD GLN E 26 111.451 4.027 -14.089 1.00 0.00 C ATOM 558 OE1 GLN E 26 112.625 3.665 -14.516 1.00 0.00 O flip ATOM 559 NE2 GLN E 26 110.453 3.823 -14.781 1.00 0.00 N flip ATOM 0 H GLN E 26 109.701 3.734 -10.900 1.00 0.00 H new ATOM 0 HA GLN E 26 111.278 1.986 -12.451 1.00 0.00 H new ATOM 0 HB2 GLN E 26 111.995 4.386 -10.690 1.00 0.00 H new ATOM 0 HB3 GLN E 26 113.053 3.687 -11.901 1.00 0.00 H new ATOM 0 HG2 GLN E 26 110.274 4.845 -12.479 1.00 0.00 H new ATOM 0 HG3 GLN E 26 111.782 5.693 -12.761 1.00 0.00 H new ATOM 0 HE21 GLN E 26 109.533 4.107 -14.445 1.00 0.00 H new ATOM 0 HE22 GLN E 26 110.547 3.370 -15.690 1.00 0.00 H new ATOM 568 N LEU E 27 111.870 1.965 -9.190 1.00 0.00 N ATOM 569 CA LEU E 27 112.517 1.184 -8.133 1.00 0.00 C ATOM 570 C LEU E 27 111.962 -0.242 -8.129 1.00 0.00 C ATOM 571 O LEU E 27 112.711 -1.198 -7.930 1.00 0.00 O ATOM 572 CB LEU E 27 112.310 1.835 -6.750 1.00 0.00 C ATOM 573 CG LEU E 27 112.947 3.243 -6.706 1.00 0.00 C ATOM 574 CD1 LEU E 27 112.746 3.866 -5.316 1.00 0.00 C ATOM 575 CD2 LEU E 27 114.458 3.169 -6.998 1.00 0.00 C ATOM 0 H LEU E 27 111.318 2.757 -8.859 1.00 0.00 H new ATOM 0 HA LEU E 27 113.588 1.157 -8.336 1.00 0.00 H new ATOM 0 HB2 LEU E 27 111.244 1.906 -6.532 1.00 0.00 H new ATOM 0 HB3 LEU E 27 112.752 1.206 -5.977 1.00 0.00 H new ATOM 0 HG LEU E 27 112.462 3.856 -7.466 1.00 0.00 H new ATOM 0 HD11 LEU E 27 113.198 4.858 -5.293 1.00 0.00 H new ATOM 0 HD12 LEU E 27 111.680 3.948 -5.105 1.00 0.00 H new ATOM 0 HD13 LEU E 27 113.218 3.235 -4.563 1.00 0.00 H new ATOM 0 HD21 LEU E 27 114.885 4.171 -6.962 1.00 0.00 H new ATOM 0 HD22 LEU E 27 114.943 2.541 -6.251 1.00 0.00 H new ATOM 0 HD23 LEU E 27 114.617 2.743 -7.988 1.00 0.00 H new ATOM 587 N CYS E 28 110.651 -0.378 -8.373 1.00 0.00 N ATOM 588 CA CYS E 28 110.018 -1.702 -8.416 1.00 0.00 C ATOM 589 C CYS E 28 110.524 -2.490 -9.622 1.00 0.00 C ATOM 590 O CYS E 28 110.815 -3.682 -9.511 1.00 0.00 O ATOM 591 CB CYS E 28 108.491 -1.571 -8.490 1.00 0.00 C ATOM 592 SG CYS E 28 107.812 -1.518 -6.814 1.00 0.00 S ATOM 0 H CYS E 28 110.016 0.402 -8.542 1.00 0.00 H new ATOM 0 HA CYS E 28 110.281 -2.234 -7.502 1.00 0.00 H new ATOM 0 HB2 CYS E 28 108.218 -0.667 -9.034 1.00 0.00 H new ATOM 0 HB3 CYS E 28 108.069 -2.413 -9.039 1.00 0.00 H new ATOM 597 N ALA E 29 110.632 -1.809 -10.768 1.00 0.00 N ATOM 598 CA ALA E 29 111.116 -2.443 -11.998 1.00 0.00 C ATOM 599 C ALA E 29 112.543 -2.945 -11.793 1.00 0.00 C ATOM 600 O ALA E 29 112.890 -4.061 -12.190 1.00 0.00 O ATOM 601 CB ALA E 29 111.091 -1.426 -13.146 1.00 0.00 C ATOM 0 H ALA E 29 110.392 -0.823 -10.869 1.00 0.00 H new ATOM 0 HA ALA E 29 110.470 -3.285 -12.245 1.00 0.00 H new ATOM 0 HB1 ALA E 29 111.451 -1.899 -14.059 1.00 0.00 H new ATOM 0 HB2 ALA E 29 110.071 -1.074 -13.298 1.00 0.00 H new ATOM 0 HB3 ALA E 29 111.733 -0.581 -12.898 1.00 0.00 H new ATOM 607 N PHE E 30 113.349 -2.100 -11.157 1.00 0.00 N ATOM 608 CA PHE E 30 114.742 -2.416 -10.866 1.00 0.00 C ATOM 609 C PHE E 30 114.834 -3.556 -9.846 1.00 0.00 C ATOM 610 O PHE E 30 115.506 -4.553 -10.087 1.00 0.00 O ATOM 611 CB PHE E 30 115.416 -1.142 -10.326 1.00 0.00 C ATOM 612 CG PHE E 30 116.820 -1.417 -9.822 1.00 0.00 C ATOM 613 CD1 PHE E 30 117.762 -2.051 -10.644 1.00 0.00 C ATOM 614 CD2 PHE E 30 117.182 -1.016 -8.528 1.00 0.00 C ATOM 615 CE1 PHE E 30 119.059 -2.282 -10.169 1.00 0.00 C ATOM 616 CE2 PHE E 30 118.479 -1.244 -8.059 1.00 0.00 C ATOM 617 CZ PHE E 30 119.415 -1.876 -8.878 1.00 0.00 C ATOM 0 H PHE E 30 113.055 -1.180 -10.830 1.00 0.00 H new ATOM 0 HA PHE E 30 115.249 -2.749 -11.771 1.00 0.00 H new ATOM 0 HB2 PHE E 30 115.454 -0.389 -11.113 1.00 0.00 H new ATOM 0 HB3 PHE E 30 114.814 -0.728 -9.517 1.00 0.00 H new ATOM 0 HD1 PHE E 30 117.488 -2.361 -11.642 1.00 0.00 H new ATOM 0 HD2 PHE E 30 116.457 -0.530 -7.892 1.00 0.00 H new ATOM 0 HE1 PHE E 30 119.785 -2.774 -10.799 1.00 0.00 H new ATOM 0 HE2 PHE E 30 118.756 -0.931 -7.063 1.00 0.00 H new ATOM 0 HZ PHE E 30 120.417 -2.052 -8.515 1.00 0.00 H new ATOM 627 N ILE E 31 114.154 -3.383 -8.713 1.00 0.00 N ATOM 628 CA ILE E 31 114.151 -4.378 -7.631 1.00 0.00 C ATOM 629 C ILE E 31 113.580 -5.730 -8.079 1.00 0.00 C ATOM 630 O ILE E 31 114.014 -6.776 -7.586 1.00 0.00 O ATOM 631 CB ILE E 31 113.355 -3.804 -6.438 1.00 0.00 C ATOM 632 CG1 ILE E 31 114.179 -2.685 -5.791 1.00 0.00 C ATOM 633 CG2 ILE E 31 113.061 -4.873 -5.375 1.00 0.00 C ATOM 634 CD1 ILE E 31 113.335 -1.941 -4.752 1.00 0.00 C ATOM 0 H ILE E 31 113.591 -2.555 -8.516 1.00 0.00 H new ATOM 0 HA ILE E 31 115.181 -4.573 -7.333 1.00 0.00 H new ATOM 0 HB ILE E 31 112.403 -3.431 -6.816 1.00 0.00 H new ATOM 0 HG12 ILE E 31 115.066 -3.104 -5.317 1.00 0.00 H new ATOM 0 HG13 ILE E 31 114.525 -1.989 -6.555 1.00 0.00 H new ATOM 0 HG21 ILE E 31 112.500 -4.426 -4.555 1.00 0.00 H new ATOM 0 HG22 ILE E 31 112.475 -5.677 -5.820 1.00 0.00 H new ATOM 0 HG23 ILE E 31 114.000 -5.276 -4.995 1.00 0.00 H new ATOM 0 HD11 ILE E 31 113.931 -1.149 -4.299 1.00 0.00 H new ATOM 0 HD12 ILE E 31 112.461 -1.506 -5.237 1.00 0.00 H new ATOM 0 HD13 ILE E 31 113.011 -2.638 -3.979 1.00 0.00 H new ATOM 646 N HIS E 32 112.614 -5.712 -9.001 1.00 0.00 N ATOM 647 CA HIS E 32 112.006 -6.953 -9.481 1.00 0.00 C ATOM 648 C HIS E 32 113.033 -7.770 -10.265 1.00 0.00 C ATOM 649 O HIS E 32 113.225 -8.961 -10.008 1.00 0.00 O ATOM 650 CB HIS E 32 110.794 -6.622 -10.370 1.00 0.00 C ATOM 651 CG HIS E 32 110.080 -7.885 -10.781 1.00 0.00 C ATOM 652 ND1 HIS E 32 110.212 -8.431 -12.049 1.00 0.00 N ATOM 653 CD2 HIS E 32 109.215 -8.711 -10.105 1.00 0.00 C ATOM 654 CE1 HIS E 32 109.443 -9.536 -12.096 1.00 0.00 C ATOM 655 NE2 HIS E 32 108.814 -9.751 -10.938 1.00 0.00 N ATOM 0 H HIS E 32 112.241 -4.863 -9.425 1.00 0.00 H new ATOM 0 HA HIS E 32 111.671 -7.544 -8.629 1.00 0.00 H new ATOM 0 HB2 HIS E 32 110.108 -5.968 -9.831 1.00 0.00 H new ATOM 0 HB3 HIS E 32 111.123 -6.078 -11.256 1.00 0.00 H new ATOM 0 HD2 HIS E 32 108.895 -8.574 -9.083 1.00 0.00 H new ATOM 0 HE1 HIS E 32 109.347 -10.171 -12.965 1.00 0.00 H new ATOM 0 HE2 HIS E 32 108.176 -10.514 -10.712 1.00 0.00 H new ATOM 664 N SER E 33 113.687 -7.107 -11.216 1.00 0.00 N ATOM 665 CA SER E 33 114.700 -7.746 -12.053 1.00 0.00 C ATOM 666 C SER E 33 115.985 -8.021 -11.265 1.00 0.00 C ATOM 667 O SER E 33 116.638 -9.044 -11.467 1.00 0.00 O ATOM 668 CB SER E 33 115.000 -6.842 -13.247 1.00 0.00 C ATOM 669 OG SER E 33 115.794 -7.550 -14.195 1.00 0.00 O ATOM 0 H SER E 33 113.532 -6.121 -11.427 1.00 0.00 H new ATOM 0 HA SER E 33 114.314 -8.705 -12.398 1.00 0.00 H new ATOM 0 HB2 SER E 33 114.070 -6.513 -13.710 1.00 0.00 H new ATOM 0 HB3 SER E 33 115.525 -5.946 -12.915 1.00 0.00 H new ATOM 0 HG SER E 33 115.556 -8.501 -14.176 1.00 0.00 H new ATOM 675 N LEU E 34 116.335 -7.089 -10.377 1.00 0.00 N ATOM 676 CA LEU E 34 117.539 -7.206 -9.549 1.00 0.00 C ATOM 677 C LEU E 34 117.497 -8.486 -8.716 1.00 0.00 C ATOM 678 O LEU E 34 118.521 -9.149 -8.532 1.00 0.00 O ATOM 679 CB LEU E 34 117.629 -5.969 -8.638 1.00 0.00 C ATOM 680 CG LEU E 34 118.913 -5.979 -7.787 1.00 0.00 C ATOM 681 CD1 LEU E 34 120.160 -6.021 -8.699 1.00 0.00 C ATOM 682 CD2 LEU E 34 118.936 -4.704 -6.908 1.00 0.00 C ATOM 0 H LEU E 34 115.798 -6.238 -10.211 1.00 0.00 H new ATOM 0 HA LEU E 34 118.421 -7.257 -10.188 1.00 0.00 H new ATOM 0 HB2 LEU E 34 117.604 -5.066 -9.248 1.00 0.00 H new ATOM 0 HB3 LEU E 34 116.759 -5.936 -7.983 1.00 0.00 H new ATOM 0 HG LEU E 34 118.926 -6.865 -7.152 1.00 0.00 H new ATOM 0 HD11 LEU E 34 121.060 -6.028 -8.084 1.00 0.00 H new ATOM 0 HD12 LEU E 34 120.132 -6.922 -9.312 1.00 0.00 H new ATOM 0 HD13 LEU E 34 120.168 -5.143 -9.345 1.00 0.00 H new ATOM 0 HD21 LEU E 34 119.840 -4.698 -6.300 1.00 0.00 H new ATOM 0 HD22 LEU E 34 118.923 -3.821 -7.547 1.00 0.00 H new ATOM 0 HD23 LEU E 34 118.061 -4.695 -6.258 1.00 0.00 H new ATOM 694 N HIS E 35 116.303 -8.821 -8.219 1.00 0.00 N ATOM 695 CA HIS E 35 116.118 -10.021 -7.403 1.00 0.00 C ATOM 696 C HIS E 35 115.953 -11.279 -8.271 1.00 0.00 C ATOM 697 O HIS E 35 116.648 -12.276 -8.068 1.00 0.00 O ATOM 698 CB HIS E 35 114.881 -9.848 -6.517 1.00 0.00 C ATOM 699 CG HIS E 35 114.829 -10.967 -5.507 1.00 0.00 C ATOM 700 ND1 HIS E 35 115.479 -10.891 -4.285 1.00 0.00 N ATOM 701 CD2 HIS E 35 114.225 -12.201 -5.533 1.00 0.00 C ATOM 702 CE1 HIS E 35 115.254 -12.047 -3.632 1.00 0.00 C ATOM 703 NE2 HIS E 35 114.494 -12.880 -4.348 1.00 0.00 N ATOM 0 H HIS E 35 115.452 -8.278 -8.368 1.00 0.00 H new ATOM 0 HA HIS E 35 117.009 -10.151 -6.789 1.00 0.00 H new ATOM 0 HB2 HIS E 35 114.916 -8.885 -6.008 1.00 0.00 H new ATOM 0 HB3 HIS E 35 113.979 -9.853 -7.128 1.00 0.00 H new ATOM 0 HD2 HIS E 35 113.632 -12.586 -6.349 1.00 0.00 H new ATOM 0 HE1 HIS E 35 115.641 -12.273 -2.649 1.00 0.00 H new ATOM 0 HE2 HIS E 35 114.179 -13.813 -4.083 1.00 0.00 H new ATOM 712 N ASP E 36 115.000 -11.226 -9.210 1.00 0.00 N ATOM 713 CA ASP E 36 114.702 -12.367 -10.086 1.00 0.00 C ATOM 714 C ASP E 36 115.864 -12.728 -11.018 1.00 0.00 C ATOM 715 O ASP E 36 116.069 -13.908 -11.314 1.00 0.00 O ATOM 716 CB ASP E 36 113.451 -12.064 -10.930 1.00 0.00 C ATOM 717 CG ASP E 36 112.204 -11.891 -10.045 1.00 0.00 C ATOM 718 OD1 ASP E 36 112.103 -12.565 -9.027 1.00 0.00 O ATOM 719 OD2 ASP E 36 111.358 -11.091 -10.406 1.00 0.00 O ATOM 0 H ASP E 36 114.421 -10.404 -9.383 1.00 0.00 H new ATOM 0 HA ASP E 36 114.530 -13.224 -9.435 1.00 0.00 H new ATOM 0 HB2 ASP E 36 113.614 -11.157 -11.512 1.00 0.00 H new ATOM 0 HB3 ASP E 36 113.285 -12.874 -11.641 1.00 0.00 H new ATOM 724 N ASP E 37 116.598 -11.716 -11.497 1.00 0.00 N ATOM 725 CA ASP E 37 117.716 -11.946 -12.427 1.00 0.00 C ATOM 726 C ASP E 37 119.058 -11.510 -11.809 1.00 0.00 C ATOM 727 O ASP E 37 119.615 -10.470 -12.185 1.00 0.00 O ATOM 728 CB ASP E 37 117.470 -11.178 -13.743 1.00 0.00 C ATOM 729 CG ASP E 37 116.036 -11.389 -14.239 1.00 0.00 C ATOM 730 OD1 ASP E 37 115.697 -12.518 -14.556 1.00 0.00 O ATOM 731 OD2 ASP E 37 115.298 -10.415 -14.297 1.00 0.00 O ATOM 0 H ASP E 37 116.442 -10.736 -11.260 1.00 0.00 H new ATOM 0 HA ASP E 37 117.770 -13.015 -12.633 1.00 0.00 H new ATOM 0 HB2 ASP E 37 117.653 -10.115 -13.588 1.00 0.00 H new ATOM 0 HB3 ASP E 37 118.175 -11.515 -14.503 1.00 0.00 H new ATOM 736 N PRO E 38 119.601 -12.285 -10.887 1.00 0.00 N ATOM 737 CA PRO E 38 120.911 -11.959 -10.244 1.00 0.00 C ATOM 738 C PRO E 38 122.066 -12.075 -11.245 1.00 0.00 C ATOM 739 O PRO E 38 123.144 -11.519 -11.027 1.00 0.00 O ATOM 740 CB PRO E 38 121.037 -12.972 -9.105 1.00 0.00 C ATOM 741 CG PRO E 38 120.168 -14.121 -9.497 1.00 0.00 C ATOM 742 CD PRO E 38 119.041 -13.547 -10.359 1.00 0.00 C ATOM 0 HA PRO E 38 120.954 -10.932 -9.881 1.00 0.00 H new ATOM 0 HB2 PRO E 38 122.072 -13.289 -8.974 1.00 0.00 H new ATOM 0 HB3 PRO E 38 120.714 -12.540 -8.158 1.00 0.00 H new ATOM 0 HG2 PRO E 38 120.738 -14.866 -10.052 1.00 0.00 H new ATOM 0 HG3 PRO E 38 119.765 -14.620 -8.616 1.00 0.00 H new ATOM 0 HD2 PRO E 38 118.767 -14.229 -11.164 1.00 0.00 H new ATOM 0 HD3 PRO E 38 118.140 -13.369 -9.771 1.00 0.00 H new ATOM 750 N SER E 39 121.814 -12.787 -12.354 1.00 0.00 N ATOM 751 CA SER E 39 122.817 -12.960 -13.411 1.00 0.00 C ATOM 752 C SER E 39 123.227 -11.593 -13.967 1.00 0.00 C ATOM 753 O SER E 39 124.367 -11.400 -14.395 1.00 0.00 O ATOM 754 CB SER E 39 122.249 -13.831 -14.539 1.00 0.00 C ATOM 755 OG SER E 39 121.794 -15.066 -13.999 1.00 0.00 O ATOM 0 H SER E 39 120.925 -13.251 -12.540 1.00 0.00 H new ATOM 0 HA SER E 39 123.693 -13.453 -12.990 1.00 0.00 H new ATOM 0 HB2 SER E 39 121.428 -13.313 -15.034 1.00 0.00 H new ATOM 0 HB3 SER E 39 123.014 -14.011 -15.294 1.00 0.00 H new ATOM 0 HG SER E 39 121.429 -15.623 -14.718 1.00 0.00 H new ATOM 761 N GLN E 40 122.275 -10.655 -13.935 1.00 0.00 N ATOM 762 CA GLN E 40 122.498 -9.284 -14.403 1.00 0.00 C ATOM 763 C GLN E 40 122.507 -8.324 -13.206 1.00 0.00 C ATOM 764 O GLN E 40 122.122 -7.160 -13.325 1.00 0.00 O ATOM 765 CB GLN E 40 121.383 -8.873 -15.382 1.00 0.00 C ATOM 766 CG GLN E 40 121.288 -9.855 -16.562 1.00 0.00 C ATOM 767 CD GLN E 40 122.628 -9.978 -17.291 1.00 0.00 C ATOM 768 OE1 GLN E 40 123.180 -8.980 -17.754 1.00 0.00 O ATOM 769 NE2 GLN E 40 123.182 -11.150 -17.421 1.00 0.00 N ATOM 0 H GLN E 40 121.332 -10.824 -13.585 1.00 0.00 H new ATOM 0 HA GLN E 40 123.459 -9.237 -14.915 1.00 0.00 H new ATOM 0 HB2 GLN E 40 120.429 -8.839 -14.856 1.00 0.00 H new ATOM 0 HB3 GLN E 40 121.577 -7.868 -15.757 1.00 0.00 H new ATOM 0 HG2 GLN E 40 120.978 -10.835 -16.199 1.00 0.00 H new ATOM 0 HG3 GLN E 40 120.522 -9.516 -17.259 1.00 0.00 H new ATOM 0 HE21 GLN E 40 122.724 -11.976 -17.037 1.00 0.00 H new ATOM 0 HE22 GLN E 40 124.074 -11.241 -17.907 1.00 0.00 H new ATOM 778 N SER E 41 122.935 -8.836 -12.044 1.00 0.00 N ATOM 779 CA SER E 41 122.981 -8.052 -10.800 1.00 0.00 C ATOM 780 C SER E 41 123.701 -6.709 -10.978 1.00 0.00 C ATOM 781 O SER E 41 123.165 -5.658 -10.611 1.00 0.00 O ATOM 782 CB SER E 41 123.690 -8.882 -9.726 1.00 0.00 C ATOM 783 OG SER E 41 123.916 -8.092 -8.567 1.00 0.00 O ATOM 0 H SER E 41 123.257 -9.798 -11.939 1.00 0.00 H new ATOM 0 HA SER E 41 121.957 -7.825 -10.504 1.00 0.00 H new ATOM 0 HB2 SER E 41 123.085 -9.752 -9.470 1.00 0.00 H new ATOM 0 HB3 SER E 41 124.639 -9.255 -10.112 1.00 0.00 H new ATOM 0 HG SER E 41 124.368 -8.632 -7.886 1.00 0.00 H new ATOM 789 N ALA E 42 124.907 -6.753 -11.543 1.00 0.00 N ATOM 790 CA ALA E 42 125.690 -5.538 -11.769 1.00 0.00 C ATOM 791 C ALA E 42 125.183 -4.772 -12.995 1.00 0.00 C ATOM 792 O ALA E 42 125.158 -3.538 -12.994 1.00 0.00 O ATOM 793 CB ALA E 42 127.168 -5.897 -11.961 1.00 0.00 C ATOM 0 H ALA E 42 125.362 -7.612 -11.851 1.00 0.00 H new ATOM 0 HA ALA E 42 125.579 -4.897 -10.894 1.00 0.00 H new ATOM 0 HB1 ALA E 42 127.745 -4.987 -12.129 1.00 0.00 H new ATOM 0 HB2 ALA E 42 127.539 -6.402 -11.069 1.00 0.00 H new ATOM 0 HB3 ALA E 42 127.273 -6.557 -12.822 1.00 0.00 H new ATOM 799 N ASN E 43 124.804 -5.514 -14.042 1.00 0.00 N ATOM 800 CA ASN E 43 124.323 -4.903 -15.284 1.00 0.00 C ATOM 801 C ASN E 43 123.062 -4.068 -15.061 1.00 0.00 C ATOM 802 O ASN E 43 123.021 -2.906 -15.463 1.00 0.00 O ATOM 803 CB ASN E 43 124.035 -5.990 -16.328 1.00 0.00 C ATOM 804 CG ASN E 43 125.338 -6.666 -16.751 1.00 0.00 C ATOM 805 OD1 ASN E 43 125.537 -7.854 -16.496 1.00 0.00 O ATOM 806 ND2 ASN E 43 126.241 -5.974 -17.389 1.00 0.00 N ATOM 0 H ASN E 43 124.821 -6.534 -14.053 1.00 0.00 H new ATOM 0 HA ASN E 43 125.108 -4.238 -15.643 1.00 0.00 H new ATOM 0 HB2 ASN E 43 123.349 -6.730 -15.915 1.00 0.00 H new ATOM 0 HB3 ASN E 43 123.545 -5.551 -17.197 1.00 0.00 H new ATOM 0 HD21 ASN E 43 127.113 -6.417 -17.677 1.00 0.00 H new ATOM 0 HD22 ASN E 43 126.075 -4.990 -17.600 1.00 0.00 H new ATOM 813 N LEU E 44 122.042 -4.663 -14.422 1.00 0.00 N ATOM 814 CA LEU E 44 120.771 -3.963 -14.157 1.00 0.00 C ATOM 815 C LEU E 44 121.000 -2.669 -13.391 1.00 0.00 C ATOM 816 O LEU E 44 120.446 -1.620 -13.735 1.00 0.00 O ATOM 817 CB LEU E 44 119.837 -4.851 -13.325 1.00 0.00 C ATOM 818 CG LEU E 44 119.362 -6.055 -14.147 1.00 0.00 C ATOM 819 CD1 LEU E 44 118.723 -7.085 -13.208 1.00 0.00 C ATOM 820 CD2 LEU E 44 118.327 -5.596 -15.187 1.00 0.00 C ATOM 0 H LEU E 44 122.070 -5.623 -14.080 1.00 0.00 H new ATOM 0 HA LEU E 44 120.321 -3.737 -15.124 1.00 0.00 H new ATOM 0 HB2 LEU E 44 120.356 -5.196 -12.431 1.00 0.00 H new ATOM 0 HB3 LEU E 44 118.977 -4.270 -12.990 1.00 0.00 H new ATOM 0 HG LEU E 44 120.212 -6.504 -14.661 1.00 0.00 H new ATOM 0 HD11 LEU E 44 118.383 -7.944 -13.787 1.00 0.00 H new ATOM 0 HD12 LEU E 44 119.458 -7.411 -12.472 1.00 0.00 H new ATOM 0 HD13 LEU E 44 117.873 -6.633 -12.696 1.00 0.00 H new ATOM 0 HD21 LEU E 44 117.991 -6.454 -15.770 1.00 0.00 H new ATOM 0 HD22 LEU E 44 117.474 -5.147 -14.678 1.00 0.00 H new ATOM 0 HD23 LEU E 44 118.781 -4.861 -15.852 1.00 0.00 H new ATOM 832 N LEU E 45 121.817 -2.760 -12.350 1.00 0.00 N ATOM 833 CA LEU E 45 122.127 -1.603 -11.527 1.00 0.00 C ATOM 834 C LEU E 45 122.845 -0.544 -12.351 1.00 0.00 C ATOM 835 O LEU E 45 122.599 0.649 -12.174 1.00 0.00 O ATOM 836 CB LEU E 45 122.962 -2.048 -10.320 1.00 0.00 C ATOM 837 CG LEU E 45 123.452 -0.845 -9.490 1.00 0.00 C ATOM 838 CD1 LEU E 45 122.317 0.180 -9.234 1.00 0.00 C ATOM 839 CD2 LEU E 45 123.988 -1.371 -8.151 1.00 0.00 C ATOM 0 H LEU E 45 122.276 -3.623 -12.057 1.00 0.00 H new ATOM 0 HA LEU E 45 121.204 -1.154 -11.158 1.00 0.00 H new ATOM 0 HB2 LEU E 45 122.366 -2.707 -9.689 1.00 0.00 H new ATOM 0 HB3 LEU E 45 123.820 -2.626 -10.664 1.00 0.00 H new ATOM 0 HG LEU E 45 124.234 -0.329 -10.047 1.00 0.00 H new ATOM 0 HD11 LEU E 45 122.704 1.012 -8.646 1.00 0.00 H new ATOM 0 HD12 LEU E 45 121.942 0.553 -10.187 1.00 0.00 H new ATOM 0 HD13 LEU E 45 121.506 -0.303 -8.689 1.00 0.00 H new ATOM 0 HD21 LEU E 45 124.341 -0.535 -7.547 1.00 0.00 H new ATOM 0 HD22 LEU E 45 123.192 -1.892 -7.620 1.00 0.00 H new ATOM 0 HD23 LEU E 45 124.813 -2.060 -8.334 1.00 0.00 H new ATOM 851 N ALA E 46 123.700 -0.979 -13.280 1.00 0.00 N ATOM 852 CA ALA E 46 124.403 -0.035 -14.143 1.00 0.00 C ATOM 853 C ALA E 46 123.372 0.826 -14.876 1.00 0.00 C ATOM 854 O ALA E 46 123.584 2.018 -15.092 1.00 0.00 O ATOM 855 CB ALA E 46 125.272 -0.788 -15.160 1.00 0.00 C ATOM 0 H ALA E 46 123.918 -1.961 -13.450 1.00 0.00 H new ATOM 0 HA ALA E 46 125.052 0.598 -13.537 1.00 0.00 H new ATOM 0 HB1 ALA E 46 125.790 -0.071 -15.797 1.00 0.00 H new ATOM 0 HB2 ALA E 46 126.004 -1.399 -14.632 1.00 0.00 H new ATOM 0 HB3 ALA E 46 124.640 -1.429 -15.775 1.00 0.00 H new ATOM 861 N GLU E 47 122.243 0.195 -15.218 1.00 0.00 N ATOM 862 CA GLU E 47 121.140 0.877 -15.902 1.00 0.00 C ATOM 863 C GLU E 47 120.394 1.770 -14.933 1.00 0.00 C ATOM 864 O GLU E 47 119.964 2.866 -15.287 1.00 0.00 O ATOM 865 CB GLU E 47 120.135 -0.138 -16.452 1.00 0.00 C ATOM 866 CG GLU E 47 120.869 -1.367 -16.958 1.00 0.00 C ATOM 867 CD GLU E 47 119.988 -2.168 -17.921 1.00 0.00 C ATOM 868 OE1 GLU E 47 118.926 -2.602 -17.503 1.00 0.00 O ATOM 869 OE2 GLU E 47 120.388 -2.337 -19.063 1.00 0.00 O ATOM 0 H GLU E 47 122.069 -0.793 -15.031 1.00 0.00 H new ATOM 0 HA GLU E 47 121.571 1.462 -16.714 1.00 0.00 H new ATOM 0 HB2 GLU E 47 119.427 -0.421 -15.673 1.00 0.00 H new ATOM 0 HB3 GLU E 47 119.557 0.310 -17.260 1.00 0.00 H new ATOM 0 HG2 GLU E 47 121.787 -1.066 -17.463 1.00 0.00 H new ATOM 0 HG3 GLU E 47 121.160 -1.995 -16.116 1.00 0.00 H new ATOM 876 N ALA E 48 120.236 1.290 -13.696 1.00 0.00 N ATOM 877 CA ALA E 48 119.530 2.059 -12.692 1.00 0.00 C ATOM 878 C ALA E 48 120.345 3.296 -12.351 1.00 0.00 C ATOM 879 O ALA E 48 119.795 4.349 -12.027 1.00 0.00 O ATOM 880 CB ALA E 48 119.257 1.223 -11.446 1.00 0.00 C ATOM 0 H ALA E 48 120.585 0.386 -13.378 1.00 0.00 H new ATOM 0 HA ALA E 48 118.562 2.363 -13.091 1.00 0.00 H new ATOM 0 HB1 ALA E 48 118.726 1.828 -10.711 1.00 0.00 H new ATOM 0 HB2 ALA E 48 118.648 0.360 -11.713 1.00 0.00 H new ATOM 0 HB3 ALA E 48 120.202 0.883 -11.022 1.00 0.00 H new ATOM 886 N LYS E 49 121.669 3.159 -12.481 1.00 0.00 N ATOM 887 CA LYS E 49 122.564 4.274 -12.244 1.00 0.00 C ATOM 888 C LYS E 49 122.340 5.297 -13.357 1.00 0.00 C ATOM 889 O LYS E 49 122.305 6.502 -13.111 1.00 0.00 O ATOM 890 CB LYS E 49 124.030 3.811 -12.208 1.00 0.00 C ATOM 891 CG LYS E 49 124.683 4.208 -10.869 1.00 0.00 C ATOM 892 CD LYS E 49 124.298 3.199 -9.783 1.00 0.00 C ATOM 893 CE LYS E 49 125.270 2.011 -9.786 1.00 0.00 C ATOM 894 NZ LYS E 49 126.651 2.477 -9.454 1.00 0.00 N ATOM 0 H LYS E 49 122.132 2.290 -12.747 1.00 0.00 H new ATOM 0 HA LYS E 49 122.353 4.722 -11.273 1.00 0.00 H new ATOM 0 HB2 LYS E 49 124.081 2.730 -12.339 1.00 0.00 H new ATOM 0 HB3 LYS E 49 124.580 4.258 -13.036 1.00 0.00 H new ATOM 0 HG2 LYS E 49 125.767 4.242 -10.979 1.00 0.00 H new ATOM 0 HG3 LYS E 49 124.361 5.208 -10.579 1.00 0.00 H new ATOM 0 HD2 LYS E 49 124.310 3.684 -8.807 1.00 0.00 H new ATOM 0 HD3 LYS E 49 123.281 2.845 -9.951 1.00 0.00 H new ATOM 0 HE2 LYS E 49 124.946 1.264 -9.062 1.00 0.00 H new ATOM 0 HE3 LYS E 49 125.265 1.530 -10.764 1.00 0.00 H new ATOM 0 HZ1 LYS E 49 127.072 1.839 -8.749 1.00 0.00 H new ATOM 0 HZ2 LYS E 49 127.234 2.475 -10.315 1.00 0.00 H new ATOM 0 HZ3 LYS E 49 126.608 3.441 -9.067 1.00 0.00 H new ATOM 908 N LYS E 50 122.120 4.786 -14.584 1.00 0.00 N ATOM 909 CA LYS E 50 121.814 5.651 -15.726 1.00 0.00 C ATOM 910 C LYS E 50 120.470 6.330 -15.462 1.00 0.00 C ATOM 911 O LYS E 50 120.289 7.505 -15.771 1.00 0.00 O ATOM 912 CB LYS E 50 121.754 4.846 -17.037 1.00 0.00 C ATOM 913 CG LYS E 50 123.153 4.345 -17.417 1.00 0.00 C ATOM 914 CD LYS E 50 123.086 3.589 -18.753 1.00 0.00 C ATOM 915 CE LYS E 50 124.392 2.821 -18.985 1.00 0.00 C ATOM 916 NZ LYS E 50 124.494 2.434 -20.422 1.00 0.00 N ATOM 0 H LYS E 50 122.149 3.790 -14.802 1.00 0.00 H new ATOM 0 HA LYS E 50 122.603 6.395 -15.838 1.00 0.00 H new ATOM 0 HB2 LYS E 50 121.076 4.000 -16.922 1.00 0.00 H new ATOM 0 HB3 LYS E 50 121.354 5.469 -17.837 1.00 0.00 H new ATOM 0 HG2 LYS E 50 123.842 5.186 -17.498 1.00 0.00 H new ATOM 0 HG3 LYS E 50 123.540 3.690 -16.636 1.00 0.00 H new ATOM 0 HD2 LYS E 50 122.244 2.897 -18.747 1.00 0.00 H new ATOM 0 HD3 LYS E 50 122.917 4.291 -19.570 1.00 0.00 H new ATOM 0 HE2 LYS E 50 125.244 3.439 -18.703 1.00 0.00 H new ATOM 0 HE3 LYS E 50 124.420 1.932 -18.355 1.00 0.00 H new ATOM 0 HZ1 LYS E 50 125.380 1.913 -20.579 1.00 0.00 H new ATOM 0 HZ2 LYS E 50 123.687 1.829 -20.677 1.00 0.00 H new ATOM 0 HZ3 LYS E 50 124.486 3.289 -21.013 1.00 0.00 H new ATOM 930 N LEU E 51 119.552 5.573 -14.835 1.00 0.00 N ATOM 931 CA LEU E 51 118.236 6.098 -14.465 1.00 0.00 C ATOM 932 C LEU E 51 118.416 7.201 -13.431 1.00 0.00 C ATOM 933 O LEU E 51 117.712 8.212 -13.462 1.00 0.00 O ATOM 934 CB LEU E 51 117.361 4.984 -13.863 1.00 0.00 C ATOM 935 CG LEU E 51 116.332 4.429 -14.869 1.00 0.00 C ATOM 936 CD1 LEU E 51 115.101 5.350 -14.924 1.00 0.00 C ATOM 937 CD2 LEU E 51 116.938 4.277 -16.280 1.00 0.00 C ATOM 0 H LEU E 51 119.702 4.598 -14.576 1.00 0.00 H new ATOM 0 HA LEU E 51 117.747 6.489 -15.357 1.00 0.00 H new ATOM 0 HB2 LEU E 51 118.000 4.172 -13.517 1.00 0.00 H new ATOM 0 HB3 LEU E 51 116.837 5.371 -12.989 1.00 0.00 H new ATOM 0 HG LEU E 51 116.033 3.439 -14.526 1.00 0.00 H new ATOM 0 HD11 LEU E 51 114.379 4.951 -15.637 1.00 0.00 H new ATOM 0 HD12 LEU E 51 114.643 5.405 -13.936 1.00 0.00 H new ATOM 0 HD13 LEU E 51 115.407 6.348 -15.238 1.00 0.00 H new ATOM 0 HD21 LEU E 51 116.182 3.883 -16.960 1.00 0.00 H new ATOM 0 HD22 LEU E 51 117.277 5.250 -16.637 1.00 0.00 H new ATOM 0 HD23 LEU E 51 117.784 3.590 -16.241 1.00 0.00 H new ATOM 949 N ASN E 52 119.381 6.991 -12.519 1.00 0.00 N ATOM 950 CA ASN E 52 119.679 7.969 -11.475 1.00 0.00 C ATOM 951 C ASN E 52 119.973 9.319 -12.132 1.00 0.00 C ATOM 952 O ASN E 52 119.522 10.369 -11.662 1.00 0.00 O ATOM 953 CB ASN E 52 120.887 7.494 -10.630 1.00 0.00 C ATOM 954 CG ASN E 52 121.000 8.332 -9.356 1.00 0.00 C ATOM 955 OD1 ASN E 52 120.075 8.363 -8.545 1.00 0.00 O ATOM 956 ND2 ASN E 52 122.088 9.016 -9.131 1.00 0.00 N ATOM 0 H ASN E 52 119.963 6.154 -12.489 1.00 0.00 H new ATOM 0 HA ASN E 52 118.823 8.073 -10.808 1.00 0.00 H new ATOM 0 HB2 ASN E 52 120.769 6.441 -10.373 1.00 0.00 H new ATOM 0 HB3 ASN E 52 121.804 7.579 -11.213 1.00 0.00 H new ATOM 0 HD21 ASN E 52 122.172 9.576 -8.283 1.00 0.00 H new ATOM 0 HD22 ASN E 52 122.855 8.990 -9.803 1.00 0.00 H new ATOM 963 N ASP E 53 120.703 9.258 -13.253 1.00 0.00 N ATOM 964 CA ASP E 53 121.039 10.444 -14.038 1.00 0.00 C ATOM 965 C ASP E 53 119.871 10.834 -14.962 1.00 0.00 C ATOM 966 O ASP E 53 119.690 12.008 -15.291 1.00 0.00 O ATOM 967 CB ASP E 53 122.294 10.173 -14.888 1.00 0.00 C ATOM 968 CG ASP E 53 123.505 9.861 -13.998 1.00 0.00 C ATOM 969 OD1 ASP E 53 123.764 10.623 -13.077 1.00 0.00 O ATOM 970 OD2 ASP E 53 124.167 8.872 -14.264 1.00 0.00 O ATOM 0 H ASP E 53 121.074 8.389 -13.636 1.00 0.00 H new ATOM 0 HA ASP E 53 121.233 11.266 -13.349 1.00 0.00 H new ATOM 0 HB2 ASP E 53 122.108 9.336 -15.561 1.00 0.00 H new ATOM 0 HB3 ASP E 53 122.510 11.041 -15.511 1.00 0.00 H new ATOM 975 N ALA E 54 119.112 9.821 -15.401 1.00 0.00 N ATOM 976 CA ALA E 54 117.980 10.021 -16.320 1.00 0.00 C ATOM 977 C ALA E 54 116.832 10.799 -15.673 1.00 0.00 C ATOM 978 O ALA E 54 116.134 11.556 -16.355 1.00 0.00 O ATOM 979 CB ALA E 54 117.448 8.661 -16.800 1.00 0.00 C ATOM 0 H ALA E 54 119.262 8.848 -15.133 1.00 0.00 H new ATOM 0 HA ALA E 54 118.354 10.606 -17.160 1.00 0.00 H new ATOM 0 HB1 ALA E 54 116.610 8.817 -17.480 1.00 0.00 H new ATOM 0 HB2 ALA E 54 118.241 8.123 -17.319 1.00 0.00 H new ATOM 0 HB3 ALA E 54 117.115 8.077 -15.942 1.00 0.00 H new ATOM 985 N GLN E 55 116.633 10.595 -14.367 1.00 0.00 N ATOM 986 CA GLN E 55 115.550 11.265 -13.633 1.00 0.00 C ATOM 987 C GLN E 55 116.115 12.250 -12.614 1.00 0.00 C ATOM 988 O GLN E 55 115.383 12.808 -11.792 1.00 0.00 O ATOM 989 CB GLN E 55 114.664 10.219 -12.945 1.00 0.00 C ATOM 990 CG GLN E 55 114.127 9.249 -14.013 1.00 0.00 C ATOM 991 CD GLN E 55 112.967 8.396 -13.485 1.00 0.00 C ATOM 992 OE1 GLN E 55 112.399 7.604 -14.237 1.00 0.00 O ATOM 993 NE2 GLN E 55 112.571 8.504 -12.245 1.00 0.00 N ATOM 0 H GLN E 55 117.205 9.973 -13.796 1.00 0.00 H new ATOM 0 HA GLN E 55 114.943 11.829 -14.341 1.00 0.00 H new ATOM 0 HB2 GLN E 55 115.236 9.675 -12.193 1.00 0.00 H new ATOM 0 HB3 GLN E 55 113.838 10.706 -12.427 1.00 0.00 H new ATOM 0 HG2 GLN E 55 113.794 9.816 -14.882 1.00 0.00 H new ATOM 0 HG3 GLN E 55 114.933 8.597 -14.348 1.00 0.00 H new ATOM 0 HE21 GLN E 55 113.037 9.158 -11.616 1.00 0.00 H new ATOM 0 HE22 GLN E 55 111.796 7.934 -11.906 1.00 0.00 H new ATOM 1002 N ALA E 56 117.428 12.440 -12.689 1.00 0.00 N ATOM 1003 CA ALA E 56 118.149 13.324 -11.804 1.00 0.00 C ATOM 1004 C ALA E 56 117.600 14.750 -11.844 1.00 0.00 C ATOM 1005 O ALA E 56 116.888 15.134 -12.776 1.00 0.00 O ATOM 1006 CB ALA E 56 119.629 13.310 -12.192 1.00 0.00 C ATOM 0 H ALA E 56 118.021 11.975 -13.377 1.00 0.00 H new ATOM 0 HA ALA E 56 118.024 12.967 -10.782 1.00 0.00 H new ATOM 0 HB1 ALA E 56 120.185 13.974 -11.530 1.00 0.00 H new ATOM 0 HB2 ALA E 56 120.020 12.297 -12.100 1.00 0.00 H new ATOM 0 HB3 ALA E 56 119.738 13.649 -13.222 1.00 0.00 H new TER 1012 ALA E 56 ATOM 1013 N GLY F 14 120.034 10.896 9.087 1.00 0.00 N ATOM 1014 CA GLY F 14 119.086 10.325 10.048 1.00 0.00 C ATOM 1015 C GLY F 14 119.323 8.839 10.239 1.00 0.00 C ATOM 1016 O GLY F 14 120.375 8.312 9.871 1.00 0.00 O ATOM 0 HA2 GLY F 14 119.183 10.837 11.005 1.00 0.00 H new ATOM 0 HA3 GLY F 14 118.067 10.491 9.699 1.00 0.00 H new ATOM 1020 N GLU F 15 118.328 8.170 10.818 1.00 0.00 N ATOM 1021 CA GLU F 15 118.412 6.740 11.058 1.00 0.00 C ATOM 1022 C GLU F 15 118.319 5.994 9.742 1.00 0.00 C ATOM 1023 O GLU F 15 117.585 6.401 8.838 1.00 0.00 O ATOM 1024 CB GLU F 15 117.267 6.278 11.956 1.00 0.00 C ATOM 1025 CG GLU F 15 117.552 4.851 12.454 1.00 0.00 C ATOM 1026 CD GLU F 15 116.406 4.293 13.324 1.00 0.00 C ATOM 1027 OE1 GLU F 15 115.477 5.029 13.636 1.00 0.00 O ATOM 1028 OE2 GLU F 15 116.482 3.123 13.673 1.00 0.00 O ATOM 0 H GLU F 15 117.456 8.600 11.128 1.00 0.00 H new ATOM 0 HA GLU F 15 119.364 6.532 11.546 1.00 0.00 H new ATOM 0 HB2 GLU F 15 117.158 6.956 12.803 1.00 0.00 H new ATOM 0 HB3 GLU F 15 116.326 6.302 11.406 1.00 0.00 H new ATOM 0 HG2 GLU F 15 117.708 4.194 11.598 1.00 0.00 H new ATOM 0 HG3 GLU F 15 118.477 4.848 13.030 1.00 0.00 H new ATOM 1035 N ILE F 16 119.053 4.895 9.655 1.00 0.00 N ATOM 1036 CA ILE F 16 119.052 4.068 8.461 1.00 0.00 C ATOM 1037 C ILE F 16 118.468 2.690 8.775 1.00 0.00 C ATOM 1038 O ILE F 16 118.682 2.145 9.862 1.00 0.00 O ATOM 1039 CB ILE F 16 120.476 3.923 7.928 1.00 0.00 C ATOM 1040 CG1 ILE F 16 121.041 5.301 7.527 1.00 0.00 C ATOM 1041 CG2 ILE F 16 120.465 2.991 6.707 1.00 0.00 C ATOM 1042 CD1 ILE F 16 122.514 5.164 7.108 1.00 0.00 C ATOM 0 H ILE F 16 119.659 4.555 10.402 1.00 0.00 H new ATOM 0 HA ILE F 16 118.434 4.546 7.701 1.00 0.00 H new ATOM 0 HB ILE F 16 121.110 3.501 8.708 1.00 0.00 H new ATOM 0 HG12 ILE F 16 120.458 5.717 6.705 1.00 0.00 H new ATOM 0 HG13 ILE F 16 120.955 5.996 8.363 1.00 0.00 H new ATOM 0 HG21 ILE F 16 121.479 2.884 6.322 1.00 0.00 H new ATOM 0 HG22 ILE F 16 120.082 2.013 6.999 1.00 0.00 H new ATOM 0 HG23 ILE F 16 119.826 3.414 5.932 1.00 0.00 H new ATOM 0 HD11 ILE F 16 122.905 6.142 6.826 1.00 0.00 H new ATOM 0 HD12 ILE F 16 123.094 4.768 7.941 1.00 0.00 H new ATOM 0 HD13 ILE F 16 122.589 4.485 6.259 1.00 0.00 H new ATOM 1054 N VAL F 17 117.726 2.151 7.809 1.00 0.00 N ATOM 1055 CA VAL F 17 117.084 0.845 7.944 1.00 0.00 C ATOM 1056 C VAL F 17 117.451 -0.052 6.762 1.00 0.00 C ATOM 1057 O VAL F 17 117.182 0.300 5.616 1.00 0.00 O ATOM 1058 CB VAL F 17 115.566 1.074 7.988 1.00 0.00 C ATOM 1059 CG1 VAL F 17 114.795 -0.234 7.737 1.00 0.00 C ATOM 1060 CG2 VAL F 17 115.182 1.638 9.362 1.00 0.00 C ATOM 0 H VAL F 17 117.553 2.606 6.913 1.00 0.00 H new ATOM 0 HA VAL F 17 117.420 0.349 8.855 1.00 0.00 H new ATOM 0 HB VAL F 17 115.301 1.780 7.201 1.00 0.00 H new ATOM 0 HG11 VAL F 17 113.723 -0.038 7.775 1.00 0.00 H new ATOM 0 HG12 VAL F 17 115.057 -0.628 6.755 1.00 0.00 H new ATOM 0 HG13 VAL F 17 115.057 -0.964 8.503 1.00 0.00 H new ATOM 0 HG21 VAL F 17 114.105 1.803 9.400 1.00 0.00 H new ATOM 0 HG22 VAL F 17 115.468 0.929 10.139 1.00 0.00 H new ATOM 0 HG23 VAL F 17 115.700 2.583 9.525 1.00 0.00 H new ATOM 1070 N TYR F 18 118.053 -1.211 7.058 1.00 0.00 N ATOM 1071 CA TYR F 18 118.453 -2.165 6.019 1.00 0.00 C ATOM 1072 C TYR F 18 117.431 -3.285 5.879 1.00 0.00 C ATOM 1073 O TYR F 18 116.943 -3.825 6.875 1.00 0.00 O ATOM 1074 CB TYR F 18 119.843 -2.754 6.350 1.00 0.00 C ATOM 1075 CG TYR F 18 120.922 -1.929 5.670 1.00 0.00 C ATOM 1076 CD1 TYR F 18 120.975 -0.547 5.876 1.00 0.00 C ATOM 1077 CD2 TYR F 18 121.852 -2.541 4.815 1.00 0.00 C ATOM 1078 CE1 TYR F 18 121.947 0.220 5.235 1.00 0.00 C ATOM 1079 CE2 TYR F 18 122.824 -1.768 4.173 1.00 0.00 C ATOM 1080 CZ TYR F 18 122.871 -0.387 4.381 1.00 0.00 C ATOM 1081 OH TYR F 18 123.831 0.375 3.748 1.00 0.00 O ATOM 0 H TYR F 18 118.273 -1.509 8.008 1.00 0.00 H new ATOM 0 HA TYR F 18 118.504 -1.632 5.069 1.00 0.00 H new ATOM 0 HB2 TYR F 18 120.000 -2.758 7.429 1.00 0.00 H new ATOM 0 HB3 TYR F 18 119.899 -3.790 6.016 1.00 0.00 H new ATOM 0 HD1 TYR F 18 120.261 -0.073 6.533 1.00 0.00 H new ATOM 0 HD2 TYR F 18 121.817 -3.608 4.653 1.00 0.00 H new ATOM 0 HE1 TYR F 18 121.986 1.287 5.399 1.00 0.00 H new ATOM 0 HE2 TYR F 18 123.540 -2.239 3.515 1.00 0.00 H new ATOM 0 HH TYR F 18 123.466 0.732 2.911 1.00 0.00 H new ATOM 1091 N LEU F 19 117.125 -3.625 4.618 1.00 0.00 N ATOM 1092 CA LEU F 19 116.162 -4.692 4.306 1.00 0.00 C ATOM 1093 C LEU F 19 116.872 -5.834 3.542 1.00 0.00 C ATOM 1094 O LEU F 19 116.667 -6.003 2.334 1.00 0.00 O ATOM 1095 CB LEU F 19 115.002 -4.140 3.433 1.00 0.00 C ATOM 1096 CG LEU F 19 114.087 -3.137 4.183 1.00 0.00 C ATOM 1097 CD1 LEU F 19 113.707 -3.649 5.583 1.00 0.00 C ATOM 1098 CD2 LEU F 19 114.766 -1.764 4.288 1.00 0.00 C ATOM 0 H LEU F 19 117.531 -3.176 3.797 1.00 0.00 H new ATOM 0 HA LEU F 19 115.755 -5.072 5.243 1.00 0.00 H new ATOM 0 HB2 LEU F 19 115.421 -3.650 2.554 1.00 0.00 H new ATOM 0 HB3 LEU F 19 114.398 -4.974 3.076 1.00 0.00 H new ATOM 0 HG LEU F 19 113.169 -3.037 3.604 1.00 0.00 H new ATOM 0 HD11 LEU F 19 113.066 -2.918 6.076 1.00 0.00 H new ATOM 0 HD12 LEU F 19 113.175 -4.596 5.492 1.00 0.00 H new ATOM 0 HD13 LEU F 19 114.611 -3.796 6.174 1.00 0.00 H new ATOM 0 HD21 LEU F 19 114.110 -1.073 4.817 1.00 0.00 H new ATOM 0 HD22 LEU F 19 115.704 -1.863 4.834 1.00 0.00 H new ATOM 0 HD23 LEU F 19 114.967 -1.380 3.288 1.00 0.00 H new ATOM 1110 N PRO F 20 117.706 -6.619 4.215 1.00 0.00 N ATOM 1111 CA PRO F 20 118.447 -7.751 3.573 1.00 0.00 C ATOM 1112 C PRO F 20 117.588 -9.009 3.418 1.00 0.00 C ATOM 1113 O PRO F 20 117.470 -9.559 2.321 1.00 0.00 O ATOM 1114 CB PRO F 20 119.612 -7.994 4.534 1.00 0.00 C ATOM 1115 CG PRO F 20 119.096 -7.602 5.880 1.00 0.00 C ATOM 1116 CD PRO F 20 118.038 -6.515 5.653 1.00 0.00 C ATOM 0 HA PRO F 20 118.760 -7.512 2.557 1.00 0.00 H new ATOM 0 HB2 PRO F 20 119.923 -9.039 4.520 1.00 0.00 H new ATOM 0 HB3 PRO F 20 120.482 -7.399 4.257 1.00 0.00 H new ATOM 0 HG2 PRO F 20 118.663 -8.461 6.393 1.00 0.00 H new ATOM 0 HG3 PRO F 20 119.904 -7.229 6.510 1.00 0.00 H new ATOM 0 HD2 PRO F 20 117.159 -6.679 6.277 1.00 0.00 H new ATOM 0 HD3 PRO F 20 118.424 -5.526 5.901 1.00 0.00 H new ATOM 1124 N ASN F 21 117.004 -9.459 4.534 1.00 0.00 N ATOM 1125 CA ASN F 21 116.161 -10.667 4.546 1.00 0.00 C ATOM 1126 C ASN F 21 114.706 -10.353 4.175 1.00 0.00 C ATOM 1127 O ASN F 21 113.838 -11.230 4.254 1.00 0.00 O ATOM 1128 CB ASN F 21 116.215 -11.328 5.936 1.00 0.00 C ATOM 1129 CG ASN F 21 116.058 -10.290 7.048 1.00 0.00 C ATOM 1130 OD1 ASN F 21 115.463 -9.231 6.842 1.00 0.00 O ATOM 1131 ND2 ASN F 21 116.556 -10.537 8.228 1.00 0.00 N ATOM 0 H ASN F 21 117.098 -9.006 5.443 1.00 0.00 H new ATOM 0 HA ASN F 21 116.554 -11.352 3.795 1.00 0.00 H new ATOM 0 HB2 ASN F 21 115.425 -12.075 6.018 1.00 0.00 H new ATOM 0 HB3 ASN F 21 117.163 -11.853 6.056 1.00 0.00 H new ATOM 0 HD21 ASN F 21 116.453 -9.854 8.978 1.00 0.00 H new ATOM 0 HD22 ASN F 21 117.049 -11.413 8.400 1.00 0.00 H new ATOM 1138 N LEU F 22 114.446 -9.111 3.764 1.00 0.00 N ATOM 1139 CA LEU F 22 113.097 -8.694 3.376 1.00 0.00 C ATOM 1140 C LEU F 22 112.780 -9.185 1.959 1.00 0.00 C ATOM 1141 O LEU F 22 113.686 -9.325 1.130 1.00 0.00 O ATOM 1142 CB LEU F 22 112.998 -7.163 3.427 1.00 0.00 C ATOM 1143 CG LEU F 22 111.546 -6.725 3.730 1.00 0.00 C ATOM 1144 CD1 LEU F 22 111.382 -6.410 5.236 1.00 0.00 C ATOM 1145 CD2 LEU F 22 111.204 -5.481 2.889 1.00 0.00 C ATOM 0 H LEU F 22 115.150 -8.377 3.691 1.00 0.00 H new ATOM 0 HA LEU F 22 112.377 -9.128 4.070 1.00 0.00 H new ATOM 0 HB2 LEU F 22 113.669 -6.774 4.193 1.00 0.00 H new ATOM 0 HB3 LEU F 22 113.321 -6.740 2.476 1.00 0.00 H new ATOM 0 HG LEU F 22 110.865 -7.536 3.472 1.00 0.00 H new ATOM 0 HD11 LEU F 22 110.355 -6.103 5.434 1.00 0.00 H new ATOM 0 HD12 LEU F 22 111.614 -7.300 5.821 1.00 0.00 H new ATOM 0 HD13 LEU F 22 112.061 -5.605 5.515 1.00 0.00 H new ATOM 0 HD21 LEU F 22 110.181 -5.169 3.100 1.00 0.00 H new ATOM 0 HD22 LEU F 22 111.889 -4.672 3.141 1.00 0.00 H new ATOM 0 HD23 LEU F 22 111.299 -5.720 1.830 1.00 0.00 H new ATOM 1157 N ASN F 23 111.495 -9.435 1.684 1.00 0.00 N ATOM 1158 CA ASN F 23 111.071 -9.902 0.358 1.00 0.00 C ATOM 1159 C ASN F 23 111.074 -8.717 -0.617 1.00 0.00 C ATOM 1160 O ASN F 23 110.768 -7.594 -0.214 1.00 0.00 O ATOM 1161 CB ASN F 23 109.656 -10.544 0.399 1.00 0.00 C ATOM 1162 CG ASN F 23 109.131 -10.722 1.834 1.00 0.00 C ATOM 1163 OD1 ASN F 23 109.123 -9.780 2.623 1.00 0.00 O ATOM 1164 ND2 ASN F 23 108.672 -11.875 2.219 1.00 0.00 N ATOM 0 H ASN F 23 110.735 -9.323 2.356 1.00 0.00 H new ATOM 0 HA ASN F 23 111.772 -10.668 0.025 1.00 0.00 H new ATOM 0 HB2 ASN F 23 108.961 -9.921 -0.164 1.00 0.00 H new ATOM 0 HB3 ASN F 23 109.686 -11.515 -0.096 1.00 0.00 H new ATOM 0 HD21 ASN F 23 108.311 -11.990 3.166 1.00 0.00 H new ATOM 0 HD22 ASN F 23 108.673 -12.665 1.574 1.00 0.00 H new ATOM 1171 N PRO F 24 111.408 -8.922 -1.879 1.00 0.00 N ATOM 1172 CA PRO F 24 111.428 -7.807 -2.872 1.00 0.00 C ATOM 1173 C PRO F 24 110.029 -7.239 -3.086 1.00 0.00 C ATOM 1174 O PRO F 24 109.861 -6.027 -3.240 1.00 0.00 O ATOM 1175 CB PRO F 24 111.994 -8.437 -4.149 1.00 0.00 C ATOM 1176 CG PRO F 24 111.778 -9.908 -3.998 1.00 0.00 C ATOM 1177 CD PRO F 24 111.791 -10.207 -2.496 1.00 0.00 C ATOM 0 HA PRO F 24 112.032 -6.962 -2.540 1.00 0.00 H new ATOM 0 HB2 PRO F 24 111.486 -8.054 -5.034 1.00 0.00 H new ATOM 0 HB3 PRO F 24 113.053 -8.206 -4.265 1.00 0.00 H new ATOM 0 HG2 PRO F 24 110.829 -10.207 -4.443 1.00 0.00 H new ATOM 0 HG3 PRO F 24 112.561 -10.468 -4.510 1.00 0.00 H new ATOM 0 HD2 PRO F 24 111.088 -10.999 -2.240 1.00 0.00 H new ATOM 0 HD3 PRO F 24 112.776 -10.534 -2.161 1.00 0.00 H new ATOM 1185 N ASP F 25 109.021 -8.117 -3.042 1.00 0.00 N ATOM 1186 CA ASP F 25 107.631 -7.679 -3.173 1.00 0.00 C ATOM 1187 C ASP F 25 107.326 -6.746 -2.001 1.00 0.00 C ATOM 1188 O ASP F 25 106.619 -5.744 -2.141 1.00 0.00 O ATOM 1189 CB ASP F 25 106.680 -8.887 -3.146 1.00 0.00 C ATOM 1190 CG ASP F 25 106.959 -9.810 -4.337 1.00 0.00 C ATOM 1191 OD1 ASP F 25 106.735 -9.385 -5.459 1.00 0.00 O ATOM 1192 OD2 ASP F 25 107.388 -10.931 -4.109 1.00 0.00 O ATOM 0 H ASP F 25 109.141 -9.122 -2.918 1.00 0.00 H new ATOM 0 HA ASP F 25 107.488 -7.163 -4.122 1.00 0.00 H new ATOM 0 HB2 ASP F 25 106.806 -9.437 -2.213 1.00 0.00 H new ATOM 0 HB3 ASP F 25 105.646 -8.545 -3.177 1.00 0.00 H new ATOM 1197 N GLN F 26 107.915 -7.092 -0.853 1.00 0.00 N ATOM 1198 CA GLN F 26 107.783 -6.317 0.364 1.00 0.00 C ATOM 1199 C GLN F 26 108.440 -4.945 0.169 1.00 0.00 C ATOM 1200 O GLN F 26 107.904 -3.928 0.615 1.00 0.00 O ATOM 1201 CB GLN F 26 108.454 -7.091 1.501 1.00 0.00 C ATOM 1202 CG GLN F 26 107.741 -6.846 2.831 1.00 0.00 C ATOM 1203 CD GLN F 26 106.377 -7.533 2.833 1.00 0.00 C ATOM 1204 OE1 GLN F 26 105.342 -6.869 2.871 1.00 0.00 O ATOM 1205 NE2 GLN F 26 106.319 -8.835 2.793 1.00 0.00 N ATOM 0 H GLN F 26 108.498 -7.923 -0.751 1.00 0.00 H new ATOM 0 HA GLN F 26 106.733 -6.157 0.610 1.00 0.00 H new ATOM 0 HB2 GLN F 26 108.448 -8.157 1.273 1.00 0.00 H new ATOM 0 HB3 GLN F 26 109.498 -6.789 1.584 1.00 0.00 H new ATOM 0 HG2 GLN F 26 108.348 -7.225 3.653 1.00 0.00 H new ATOM 0 HG3 GLN F 26 107.617 -5.775 2.994 1.00 0.00 H new ATOM 0 HE21 GLN F 26 107.179 -9.383 2.762 1.00 0.00 H new ATOM 0 HE22 GLN F 26 105.414 -9.305 2.793 1.00 0.00 H new ATOM 1214 N LEU F 27 109.597 -4.930 -0.526 1.00 0.00 N ATOM 1215 CA LEU F 27 110.307 -3.673 -0.805 1.00 0.00 C ATOM 1216 C LEU F 27 109.425 -2.758 -1.652 1.00 0.00 C ATOM 1217 O LEU F 27 109.375 -1.556 -1.419 1.00 0.00 O ATOM 1218 CB LEU F 27 111.625 -3.919 -1.566 1.00 0.00 C ATOM 1219 CG LEU F 27 112.679 -4.559 -0.651 1.00 0.00 C ATOM 1220 CD1 LEU F 27 113.927 -4.912 -1.474 1.00 0.00 C ATOM 1221 CD2 LEU F 27 113.073 -3.573 0.463 1.00 0.00 C ATOM 0 H LEU F 27 110.051 -5.764 -0.898 1.00 0.00 H new ATOM 0 HA LEU F 27 110.537 -3.209 0.154 1.00 0.00 H new ATOM 0 HB2 LEU F 27 111.439 -4.568 -2.422 1.00 0.00 H new ATOM 0 HB3 LEU F 27 112.004 -2.975 -1.958 1.00 0.00 H new ATOM 0 HG LEU F 27 112.262 -5.462 -0.206 1.00 0.00 H new ATOM 0 HD11 LEU F 27 114.675 -5.366 -0.824 1.00 0.00 H new ATOM 0 HD12 LEU F 27 113.656 -5.615 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU F 27 114.337 -4.006 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU F 27 113.821 -4.033 1.109 1.00 0.00 H new ATOM 0 HD22 LEU F 27 113.485 -2.667 0.018 1.00 0.00 H new ATOM 0 HD23 LEU F 27 112.192 -3.319 1.052 1.00 0.00 H new ATOM 1233 N CYS F 28 108.724 -3.338 -2.637 1.00 0.00 N ATOM 1234 CA CYS F 28 107.838 -2.551 -3.511 1.00 0.00 C ATOM 1235 C CYS F 28 106.752 -1.869 -2.684 1.00 0.00 C ATOM 1236 O CYS F 28 106.518 -0.664 -2.822 1.00 0.00 O ATOM 1237 CB CYS F 28 107.188 -3.453 -4.568 1.00 0.00 C ATOM 1238 SG CYS F 28 108.149 -3.379 -6.099 1.00 0.00 S ATOM 0 H CYS F 28 108.751 -4.336 -2.848 1.00 0.00 H new ATOM 0 HA CYS F 28 108.438 -1.792 -4.013 1.00 0.00 H new ATOM 0 HB2 CYS F 28 107.140 -4.480 -4.205 1.00 0.00 H new ATOM 0 HB3 CYS F 28 106.163 -3.133 -4.754 1.00 0.00 H new ATOM 1243 N ALA F 29 106.122 -2.648 -1.806 1.00 0.00 N ATOM 1244 CA ALA F 29 105.084 -2.121 -0.924 1.00 0.00 C ATOM 1245 C ALA F 29 105.691 -1.072 0.007 1.00 0.00 C ATOM 1246 O ALA F 29 105.075 -0.042 0.289 1.00 0.00 O ATOM 1247 CB ALA F 29 104.483 -3.261 -0.092 1.00 0.00 C ATOM 0 H ALA F 29 106.312 -3.643 -1.687 1.00 0.00 H new ATOM 0 HA ALA F 29 104.298 -1.663 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA F 29 103.709 -2.863 0.565 1.00 0.00 H new ATOM 0 HB2 ALA F 29 104.047 -4.006 -0.757 1.00 0.00 H new ATOM 0 HB3 ALA F 29 105.265 -3.725 0.509 1.00 0.00 H new ATOM 1253 N PHE F 30 106.909 -1.358 0.472 1.00 0.00 N ATOM 1254 CA PHE F 30 107.631 -0.463 1.372 1.00 0.00 C ATOM 1255 C PHE F 30 107.956 0.867 0.681 1.00 0.00 C ATOM 1256 O PHE F 30 107.595 1.934 1.183 1.00 0.00 O ATOM 1257 CB PHE F 30 108.925 -1.173 1.821 1.00 0.00 C ATOM 1258 CG PHE F 30 109.809 -0.247 2.630 1.00 0.00 C ATOM 1259 CD1 PHE F 30 109.303 0.379 3.777 1.00 0.00 C ATOM 1260 CD2 PHE F 30 111.140 -0.017 2.234 1.00 0.00 C ATOM 1261 CE1 PHE F 30 110.117 1.232 4.524 1.00 0.00 C ATOM 1262 CE2 PHE F 30 111.950 0.837 2.985 1.00 0.00 C ATOM 1263 CZ PHE F 30 111.437 1.461 4.129 1.00 0.00 C ATOM 0 H PHE F 30 107.417 -2.210 0.236 1.00 0.00 H new ATOM 0 HA PHE F 30 107.010 -0.233 2.238 1.00 0.00 H new ATOM 0 HB2 PHE F 30 108.673 -2.051 2.416 1.00 0.00 H new ATOM 0 HB3 PHE F 30 109.470 -1.527 0.946 1.00 0.00 H new ATOM 0 HD1 PHE F 30 108.283 0.201 4.083 1.00 0.00 H new ATOM 0 HD2 PHE F 30 111.534 -0.500 1.352 1.00 0.00 H new ATOM 0 HE1 PHE F 30 109.726 1.715 5.407 1.00 0.00 H new ATOM 0 HE2 PHE F 30 112.972 1.016 2.684 1.00 0.00 H new ATOM 0 HZ PHE F 30 112.065 2.122 4.708 1.00 0.00 H new ATOM 1273 N ILE F 31 108.620 0.789 -0.478 1.00 0.00 N ATOM 1274 CA ILE F 31 108.991 1.986 -1.245 1.00 0.00 C ATOM 1275 C ILE F 31 107.752 2.806 -1.597 1.00 0.00 C ATOM 1276 O ILE F 31 107.771 4.039 -1.512 1.00 0.00 O ATOM 1277 CB ILE F 31 109.760 1.577 -2.520 1.00 0.00 C ATOM 1278 CG1 ILE F 31 111.085 0.902 -2.114 1.00 0.00 C ATOM 1279 CG2 ILE F 31 110.074 2.814 -3.380 1.00 0.00 C ATOM 1280 CD1 ILE F 31 111.794 0.321 -3.342 1.00 0.00 C ATOM 0 H ILE F 31 108.912 -0.090 -0.906 1.00 0.00 H new ATOM 0 HA ILE F 31 109.641 2.609 -0.631 1.00 0.00 H new ATOM 0 HB ILE F 31 109.143 0.889 -3.098 1.00 0.00 H new ATOM 0 HG12 ILE F 31 111.733 1.628 -1.623 1.00 0.00 H new ATOM 0 HG13 ILE F 31 110.889 0.109 -1.392 1.00 0.00 H new ATOM 0 HG21 ILE F 31 110.616 2.507 -4.274 1.00 0.00 H new ATOM 0 HG22 ILE F 31 109.143 3.302 -3.669 1.00 0.00 H new ATOM 0 HG23 ILE F 31 110.685 3.510 -2.806 1.00 0.00 H new ATOM 0 HD11 ILE F 31 112.727 -0.151 -3.034 1.00 0.00 H new ATOM 0 HD12 ILE F 31 111.151 -0.421 -3.816 1.00 0.00 H new ATOM 0 HD13 ILE F 31 112.009 1.121 -4.051 1.00 0.00 H new ATOM 1292 N HIS F 32 106.676 2.111 -1.972 1.00 0.00 N ATOM 1293 CA HIS F 32 105.418 2.772 -2.312 1.00 0.00 C ATOM 1294 C HIS F 32 104.886 3.543 -1.099 1.00 0.00 C ATOM 1295 O HIS F 32 104.398 4.664 -1.237 1.00 0.00 O ATOM 1296 CB HIS F 32 104.384 1.732 -2.768 1.00 0.00 C ATOM 1297 CG HIS F 32 103.145 2.427 -3.272 1.00 0.00 C ATOM 1298 ND1 HIS F 32 103.137 3.161 -4.447 1.00 0.00 N ATOM 1299 CD2 HIS F 32 101.868 2.507 -2.772 1.00 0.00 C ATOM 1300 CE1 HIS F 32 101.893 3.645 -4.616 1.00 0.00 C ATOM 1301 NE2 HIS F 32 101.080 3.277 -3.623 1.00 0.00 N ATOM 0 H HIS F 32 106.652 1.094 -2.047 1.00 0.00 H new ATOM 0 HA HIS F 32 105.597 3.474 -3.127 1.00 0.00 H new ATOM 0 HB2 HIS F 32 104.807 1.107 -3.555 1.00 0.00 H new ATOM 0 HB3 HIS F 32 104.129 1.072 -1.939 1.00 0.00 H new ATOM 0 HD2 HIS F 32 101.527 2.043 -1.858 1.00 0.00 H new ATOM 0 HE1 HIS F 32 101.589 4.257 -5.453 1.00 0.00 H new ATOM 0 HE2 HIS F 32 100.093 3.510 -3.512 1.00 0.00 H new ATOM 1310 N SER F 33 104.996 2.925 0.086 1.00 0.00 N ATOM 1311 CA SER F 33 104.530 3.557 1.323 1.00 0.00 C ATOM 1312 C SER F 33 105.359 4.807 1.654 1.00 0.00 C ATOM 1313 O SER F 33 104.804 5.824 2.083 1.00 0.00 O ATOM 1314 CB SER F 33 104.592 2.558 2.483 1.00 0.00 C ATOM 1315 OG SER F 33 103.835 1.401 2.151 1.00 0.00 O ATOM 0 H SER F 33 105.400 1.997 0.211 1.00 0.00 H new ATOM 0 HA SER F 33 103.496 3.867 1.175 1.00 0.00 H new ATOM 0 HB2 SER F 33 105.627 2.283 2.686 1.00 0.00 H new ATOM 0 HB3 SER F 33 104.200 3.014 3.392 1.00 0.00 H new ATOM 0 HG SER F 33 104.369 0.815 1.575 1.00 0.00 H new ATOM 1321 N LEU F 34 106.684 4.724 1.447 1.00 0.00 N ATOM 1322 CA LEU F 34 107.579 5.856 1.722 1.00 0.00 C ATOM 1323 C LEU F 34 107.184 7.061 0.864 1.00 0.00 C ATOM 1324 O LEU F 34 107.228 8.205 1.326 1.00 0.00 O ATOM 1325 CB LEU F 34 109.046 5.479 1.410 1.00 0.00 C ATOM 1326 CG LEU F 34 109.512 4.285 2.270 1.00 0.00 C ATOM 1327 CD1 LEU F 34 110.745 3.612 1.624 1.00 0.00 C ATOM 1328 CD2 LEU F 34 109.882 4.778 3.676 1.00 0.00 C ATOM 0 H LEU F 34 107.154 3.891 1.093 1.00 0.00 H new ATOM 0 HA LEU F 34 107.488 6.109 2.778 1.00 0.00 H new ATOM 0 HB2 LEU F 34 109.143 5.229 0.353 1.00 0.00 H new ATOM 0 HB3 LEU F 34 109.692 6.337 1.595 1.00 0.00 H new ATOM 0 HG LEU F 34 108.701 3.559 2.335 1.00 0.00 H new ATOM 0 HD11 LEU F 34 111.065 2.771 2.239 1.00 0.00 H new ATOM 0 HD12 LEU F 34 110.484 3.254 0.628 1.00 0.00 H new ATOM 0 HD13 LEU F 34 111.557 4.336 1.548 1.00 0.00 H new ATOM 0 HD21 LEU F 34 110.211 3.934 4.283 1.00 0.00 H new ATOM 0 HD22 LEU F 34 110.687 5.509 3.605 1.00 0.00 H new ATOM 0 HD23 LEU F 34 109.011 5.241 4.140 1.00 0.00 H new ATOM 1340 N HIS F 35 106.811 6.787 -0.391 1.00 0.00 N ATOM 1341 CA HIS F 35 106.415 7.838 -1.333 1.00 0.00 C ATOM 1342 C HIS F 35 104.953 8.260 -1.136 1.00 0.00 C ATOM 1343 O HIS F 35 104.611 9.426 -1.355 1.00 0.00 O ATOM 1344 CB HIS F 35 106.624 7.339 -2.771 1.00 0.00 C ATOM 1345 CG HIS F 35 108.097 7.313 -3.084 1.00 0.00 C ATOM 1346 ND1 HIS F 35 108.905 6.236 -2.757 1.00 0.00 N ATOM 1347 CD2 HIS F 35 108.921 8.227 -3.695 1.00 0.00 C ATOM 1348 CE1 HIS F 35 110.154 6.525 -3.168 1.00 0.00 C ATOM 1349 NE2 HIS F 35 110.219 7.727 -3.746 1.00 0.00 N ATOM 0 H HIS F 35 106.775 5.844 -0.778 1.00 0.00 H new ATOM 0 HA HIS F 35 107.038 8.712 -1.145 1.00 0.00 H new ATOM 0 HB2 HIS F 35 106.199 6.342 -2.887 1.00 0.00 H new ATOM 0 HB3 HIS F 35 106.104 7.991 -3.473 1.00 0.00 H new ATOM 0 HD1 HIS F 35 108.607 5.380 -2.290 1.00 0.00 H new ATOM 0 HD2 HIS F 35 108.609 9.188 -4.078 1.00 0.00 H new ATOM 0 HE1 HIS F 35 111.000 5.865 -3.045 1.00 0.00 H new ATOM 1358 N ASP F 36 104.100 7.310 -0.738 1.00 0.00 N ATOM 1359 CA ASP F 36 102.675 7.593 -0.526 1.00 0.00 C ATOM 1360 C ASP F 36 102.482 8.662 0.552 1.00 0.00 C ATOM 1361 O ASP F 36 101.641 9.553 0.405 1.00 0.00 O ATOM 1362 CB ASP F 36 101.939 6.309 -0.119 1.00 0.00 C ATOM 1363 CG ASP F 36 100.430 6.559 -0.052 1.00 0.00 C ATOM 1364 OD1 ASP F 36 99.790 6.493 -1.089 1.00 0.00 O ATOM 1365 OD2 ASP F 36 99.937 6.818 1.035 1.00 0.00 O ATOM 0 H ASP F 36 104.369 6.343 -0.557 1.00 0.00 H new ATOM 0 HA ASP F 36 102.261 7.968 -1.462 1.00 0.00 H new ATOM 0 HB2 ASP F 36 102.152 5.517 -0.837 1.00 0.00 H new ATOM 0 HB3 ASP F 36 102.301 5.966 0.850 1.00 0.00 H new ATOM 1370 N ASP F 37 103.267 8.562 1.630 1.00 0.00 N ATOM 1371 CA ASP F 37 103.184 9.519 2.735 1.00 0.00 C ATOM 1372 C ASP F 37 104.547 9.636 3.442 1.00 0.00 C ATOM 1373 O ASP F 37 104.804 8.960 4.442 1.00 0.00 O ATOM 1374 CB ASP F 37 102.083 9.078 3.717 1.00 0.00 C ATOM 1375 CG ASP F 37 101.831 10.140 4.800 1.00 0.00 C ATOM 1376 OD1 ASP F 37 101.910 11.324 4.497 1.00 0.00 O ATOM 1377 OD2 ASP F 37 101.543 9.753 5.921 1.00 0.00 O ATOM 0 H ASP F 37 103.965 7.829 1.759 1.00 0.00 H new ATOM 0 HA ASP F 37 102.926 10.504 2.345 1.00 0.00 H new ATOM 0 HB2 ASP F 37 101.160 8.891 3.169 1.00 0.00 H new ATOM 0 HB3 ASP F 37 102.370 8.138 4.188 1.00 0.00 H new ATOM 1382 N PRO F 38 105.426 10.471 2.920 1.00 0.00 N ATOM 1383 CA PRO F 38 106.802 10.680 3.487 1.00 0.00 C ATOM 1384 C PRO F 38 106.792 11.054 4.971 1.00 0.00 C ATOM 1385 O PRO F 38 107.786 10.845 5.671 1.00 0.00 O ATOM 1386 CB PRO F 38 107.372 11.829 2.647 1.00 0.00 C ATOM 1387 CG PRO F 38 106.605 11.802 1.368 1.00 0.00 C ATOM 1388 CD PRO F 38 105.207 11.307 1.725 1.00 0.00 C ATOM 0 HA PRO F 38 107.392 9.764 3.439 1.00 0.00 H new ATOM 0 HB2 PRO F 38 107.253 12.785 3.157 1.00 0.00 H new ATOM 0 HB3 PRO F 38 108.439 11.694 2.468 1.00 0.00 H new ATOM 0 HG2 PRO F 38 106.564 12.793 0.917 1.00 0.00 H new ATOM 0 HG3 PRO F 38 107.079 11.141 0.643 1.00 0.00 H new ATOM 0 HD2 PRO F 38 104.530 12.135 1.935 1.00 0.00 H new ATOM 0 HD3 PRO F 38 104.765 10.733 0.910 1.00 0.00 H new ATOM 1396 N SER F 39 105.675 11.613 5.438 1.00 0.00 N ATOM 1397 CA SER F 39 105.555 12.023 6.838 1.00 0.00 C ATOM 1398 C SER F 39 105.679 10.822 7.780 1.00 0.00 C ATOM 1399 O SER F 39 106.177 10.965 8.900 1.00 0.00 O ATOM 1400 CB SER F 39 104.214 12.728 7.070 1.00 0.00 C ATOM 1401 OG SER F 39 103.158 11.780 7.001 1.00 0.00 O ATOM 0 H SER F 39 104.845 11.791 4.872 1.00 0.00 H new ATOM 0 HA SER F 39 106.369 12.714 7.055 1.00 0.00 H new ATOM 0 HB2 SER F 39 104.213 13.218 8.044 1.00 0.00 H new ATOM 0 HB3 SER F 39 104.067 13.506 6.321 1.00 0.00 H new ATOM 0 HG SER F 39 102.302 12.233 7.151 1.00 0.00 H new ATOM 1407 N GLN F 40 105.224 9.643 7.322 1.00 0.00 N ATOM 1408 CA GLN F 40 105.291 8.424 8.145 1.00 0.00 C ATOM 1409 C GLN F 40 106.391 7.472 7.675 1.00 0.00 C ATOM 1410 O GLN F 40 106.474 6.341 8.154 1.00 0.00 O ATOM 1411 CB GLN F 40 103.945 7.690 8.147 1.00 0.00 C ATOM 1412 CG GLN F 40 103.585 7.184 6.747 1.00 0.00 C ATOM 1413 CD GLN F 40 102.264 6.423 6.794 1.00 0.00 C ATOM 1414 OE1 GLN F 40 102.253 5.201 6.939 1.00 0.00 O ATOM 1415 NE2 GLN F 40 101.143 7.078 6.687 1.00 0.00 N ATOM 0 H GLN F 40 104.811 9.509 6.399 1.00 0.00 H new ATOM 0 HA GLN F 40 105.530 8.745 9.159 1.00 0.00 H new ATOM 0 HB2 GLN F 40 103.988 6.850 8.840 1.00 0.00 H new ATOM 0 HB3 GLN F 40 103.164 8.360 8.506 1.00 0.00 H new ATOM 0 HG2 GLN F 40 103.507 8.024 6.056 1.00 0.00 H new ATOM 0 HG3 GLN F 40 104.376 6.535 6.371 1.00 0.00 H new ATOM 0 HE21 GLN F 40 101.154 8.091 6.567 1.00 0.00 H new ATOM 0 HE22 GLN F 40 100.255 6.578 6.723 1.00 0.00 H new ATOM 1424 N SER F 41 107.231 7.927 6.746 1.00 0.00 N ATOM 1425 CA SER F 41 108.323 7.096 6.230 1.00 0.00 C ATOM 1426 C SER F 41 109.173 6.557 7.382 1.00 0.00 C ATOM 1427 O SER F 41 109.586 5.396 7.370 1.00 0.00 O ATOM 1428 CB SER F 41 109.159 7.929 5.268 1.00 0.00 C ATOM 1429 OG SER F 41 110.446 7.345 5.097 1.00 0.00 O ATOM 0 H SER F 41 107.179 8.860 6.336 1.00 0.00 H new ATOM 0 HA SER F 41 107.917 6.237 5.696 1.00 0.00 H new ATOM 0 HB2 SER F 41 108.654 8.000 4.305 1.00 0.00 H new ATOM 0 HB3 SER F 41 109.261 8.945 5.650 1.00 0.00 H new ATOM 0 HG SER F 41 111.027 7.610 5.840 1.00 0.00 H new ATOM 1435 N ALA F 42 109.388 7.403 8.386 1.00 0.00 N ATOM 1436 CA ALA F 42 110.144 7.012 9.574 1.00 0.00 C ATOM 1437 C ALA F 42 109.413 5.874 10.293 1.00 0.00 C ATOM 1438 O ALA F 42 110.035 4.891 10.709 1.00 0.00 O ATOM 1439 CB ALA F 42 110.299 8.212 10.516 1.00 0.00 C ATOM 0 H ALA F 42 109.049 8.365 8.401 1.00 0.00 H new ATOM 0 HA ALA F 42 111.135 6.671 9.274 1.00 0.00 H new ATOM 0 HB1 ALA F 42 110.864 7.911 11.399 1.00 0.00 H new ATOM 0 HB2 ALA F 42 110.830 9.013 10.001 1.00 0.00 H new ATOM 0 HB3 ALA F 42 109.314 8.566 10.819 1.00 0.00 H new ATOM 1445 N ASN F 43 108.081 6.001 10.409 1.00 0.00 N ATOM 1446 CA ASN F 43 107.274 4.959 11.051 1.00 0.00 C ATOM 1447 C ASN F 43 107.344 3.678 10.228 1.00 0.00 C ATOM 1448 O ASN F 43 107.477 2.582 10.779 1.00 0.00 O ATOM 1449 CB ASN F 43 105.813 5.401 11.178 1.00 0.00 C ATOM 1450 CG ASN F 43 105.704 6.574 12.148 1.00 0.00 C ATOM 1451 OD1 ASN F 43 105.329 7.678 11.753 1.00 0.00 O ATOM 1452 ND2 ASN F 43 106.005 6.395 13.403 1.00 0.00 N ATOM 0 H ASN F 43 107.550 6.803 10.071 1.00 0.00 H new ATOM 0 HA ASN F 43 107.673 4.782 12.050 1.00 0.00 H new ATOM 0 HB2 ASN F 43 105.426 5.690 10.201 1.00 0.00 H new ATOM 0 HB3 ASN F 43 105.202 4.570 11.530 1.00 0.00 H new ATOM 0 HD21 ASN F 43 105.930 7.171 14.061 1.00 0.00 H new ATOM 0 HD22 ASN F 43 106.315 5.479 13.727 1.00 0.00 H new ATOM 1459 N LEU F 44 107.274 3.834 8.898 1.00 0.00 N ATOM 1460 CA LEU F 44 107.353 2.697 7.981 1.00 0.00 C ATOM 1461 C LEU F 44 108.703 2.014 8.135 1.00 0.00 C ATOM 1462 O LEU F 44 108.800 0.792 8.062 1.00 0.00 O ATOM 1463 CB LEU F 44 107.187 3.166 6.530 1.00 0.00 C ATOM 1464 CG LEU F 44 105.781 3.747 6.308 1.00 0.00 C ATOM 1465 CD1 LEU F 44 105.773 4.582 5.018 1.00 0.00 C ATOM 1466 CD2 LEU F 44 104.763 2.603 6.186 1.00 0.00 C ATOM 0 H LEU F 44 107.163 4.737 8.438 1.00 0.00 H new ATOM 0 HA LEU F 44 106.552 1.997 8.221 1.00 0.00 H new ATOM 0 HB2 LEU F 44 107.939 3.920 6.297 1.00 0.00 H new ATOM 0 HB3 LEU F 44 107.353 2.330 5.850 1.00 0.00 H new ATOM 0 HG LEU F 44 105.512 4.380 7.154 1.00 0.00 H new ATOM 0 HD11 LEU F 44 104.777 4.995 4.858 1.00 0.00 H new ATOM 0 HD12 LEU F 44 106.493 5.395 5.107 1.00 0.00 H new ATOM 0 HD13 LEU F 44 106.043 3.949 4.173 1.00 0.00 H new ATOM 0 HD21 LEU F 44 103.767 3.017 6.029 1.00 0.00 H new ATOM 0 HD22 LEU F 44 105.029 1.968 5.341 1.00 0.00 H new ATOM 0 HD23 LEU F 44 104.769 2.011 7.101 1.00 0.00 H new ATOM 1478 N LEU F 45 109.736 2.832 8.364 1.00 0.00 N ATOM 1479 CA LEU F 45 111.092 2.329 8.549 1.00 0.00 C ATOM 1480 C LEU F 45 111.153 1.409 9.757 1.00 0.00 C ATOM 1481 O LEU F 45 111.821 0.378 9.723 1.00 0.00 O ATOM 1482 CB LEU F 45 112.072 3.501 8.750 1.00 0.00 C ATOM 1483 CG LEU F 45 113.005 3.605 7.542 1.00 0.00 C ATOM 1484 CD1 LEU F 45 112.233 4.215 6.358 1.00 0.00 C ATOM 1485 CD2 LEU F 45 114.216 4.500 7.873 1.00 0.00 C ATOM 0 H LEU F 45 109.653 3.847 8.425 1.00 0.00 H new ATOM 0 HA LEU F 45 111.376 1.770 7.657 1.00 0.00 H new ATOM 0 HB2 LEU F 45 111.520 4.432 8.876 1.00 0.00 H new ATOM 0 HB3 LEU F 45 112.654 3.350 9.659 1.00 0.00 H new ATOM 0 HG LEU F 45 113.362 2.608 7.284 1.00 0.00 H new ATOM 0 HD11 LEU F 45 112.893 4.292 5.494 1.00 0.00 H new ATOM 0 HD12 LEU F 45 111.384 3.578 6.111 1.00 0.00 H new ATOM 0 HD13 LEU F 45 111.875 5.208 6.630 1.00 0.00 H new ATOM 0 HD21 LEU F 45 114.870 4.564 7.003 1.00 0.00 H new ATOM 0 HD22 LEU F 45 113.869 5.498 8.140 1.00 0.00 H new ATOM 0 HD23 LEU F 45 114.767 4.072 8.710 1.00 0.00 H new ATOM 1497 N ALA F 46 110.447 1.793 10.820 1.00 0.00 N ATOM 1498 CA ALA F 46 110.426 0.999 12.041 1.00 0.00 C ATOM 1499 C ALA F 46 109.832 -0.380 11.773 1.00 0.00 C ATOM 1500 O ALA F 46 110.498 -1.388 11.987 1.00 0.00 O ATOM 1501 CB ALA F 46 109.607 1.724 13.119 1.00 0.00 C ATOM 0 H ALA F 46 109.886 2.644 10.858 1.00 0.00 H new ATOM 0 HA ALA F 46 111.450 0.872 12.393 1.00 0.00 H new ATOM 0 HB1 ALA F 46 109.594 1.126 14.030 1.00 0.00 H new ATOM 0 HB2 ALA F 46 110.058 2.694 13.328 1.00 0.00 H new ATOM 0 HB3 ALA F 46 108.586 1.868 12.765 1.00 0.00 H new ATOM 1507 N GLU F 47 108.583 -0.418 11.296 1.00 0.00 N ATOM 1508 CA GLU F 47 107.928 -1.696 11.011 1.00 0.00 C ATOM 1509 C GLU F 47 108.665 -2.467 9.923 1.00 0.00 C ATOM 1510 O GLU F 47 108.825 -3.676 10.039 1.00 0.00 O ATOM 1511 CB GLU F 47 106.481 -1.483 10.566 1.00 0.00 C ATOM 1512 CG GLU F 47 105.625 -0.921 11.715 1.00 0.00 C ATOM 1513 CD GLU F 47 105.639 -1.842 12.944 1.00 0.00 C ATOM 1514 OE1 GLU F 47 105.389 -3.028 12.787 1.00 0.00 O ATOM 1515 OE2 GLU F 47 105.884 -1.340 14.027 1.00 0.00 O ATOM 0 H GLU F 47 108.015 0.407 11.102 1.00 0.00 H new ATOM 0 HA GLU F 47 107.946 -2.273 11.935 1.00 0.00 H new ATOM 0 HB2 GLU F 47 106.455 -0.797 9.720 1.00 0.00 H new ATOM 0 HB3 GLU F 47 106.060 -2.428 10.223 1.00 0.00 H new ATOM 0 HG2 GLU F 47 105.996 0.065 11.996 1.00 0.00 H new ATOM 0 HG3 GLU F 47 104.599 -0.789 11.372 1.00 0.00 H new ATOM 1522 N ALA F 48 109.120 -1.764 8.879 1.00 0.00 N ATOM 1523 CA ALA F 48 109.854 -2.405 7.786 1.00 0.00 C ATOM 1524 C ALA F 48 111.097 -3.077 8.347 1.00 0.00 C ATOM 1525 O ALA F 48 111.422 -4.215 7.996 1.00 0.00 O ATOM 1526 CB ALA F 48 110.265 -1.360 6.745 1.00 0.00 C ATOM 0 H ALA F 48 108.993 -0.758 8.770 1.00 0.00 H new ATOM 0 HA ALA F 48 109.214 -3.147 7.309 1.00 0.00 H new ATOM 0 HB1 ALA F 48 110.810 -1.847 5.936 1.00 0.00 H new ATOM 0 HB2 ALA F 48 109.374 -0.877 6.343 1.00 0.00 H new ATOM 0 HB3 ALA F 48 110.903 -0.611 7.214 1.00 0.00 H new ATOM 1532 N LYS F 49 111.764 -2.362 9.246 1.00 0.00 N ATOM 1533 CA LYS F 49 112.949 -2.877 9.895 1.00 0.00 C ATOM 1534 C LYS F 49 112.574 -4.058 10.803 1.00 0.00 C ATOM 1535 O LYS F 49 113.291 -5.061 10.851 1.00 0.00 O ATOM 1536 CB LYS F 49 113.621 -1.763 10.704 1.00 0.00 C ATOM 1537 CG LYS F 49 115.004 -2.237 11.170 1.00 0.00 C ATOM 1538 CD LYS F 49 115.290 -1.703 12.579 1.00 0.00 C ATOM 1539 CE LYS F 49 115.631 -0.209 12.521 1.00 0.00 C ATOM 1540 NZ LYS F 49 115.944 0.288 13.893 1.00 0.00 N ATOM 0 H LYS F 49 111.498 -1.422 9.538 1.00 0.00 H new ATOM 0 HA LYS F 49 113.652 -3.231 9.141 1.00 0.00 H new ATOM 0 HB2 LYS F 49 113.718 -0.864 10.095 1.00 0.00 H new ATOM 0 HB3 LYS F 49 113.005 -1.501 11.564 1.00 0.00 H new ATOM 0 HG2 LYS F 49 115.044 -3.326 11.169 1.00 0.00 H new ATOM 0 HG3 LYS F 49 115.770 -1.889 10.477 1.00 0.00 H new ATOM 0 HD2 LYS F 49 114.422 -1.860 13.219 1.00 0.00 H new ATOM 0 HD3 LYS F 49 116.118 -2.255 13.024 1.00 0.00 H new ATOM 0 HE2 LYS F 49 116.483 -0.046 11.861 1.00 0.00 H new ATOM 0 HE3 LYS F 49 114.793 0.349 12.104 1.00 0.00 H new ATOM 0 HZ1 LYS F 49 116.158 1.305 13.853 1.00 0.00 H new ATOM 0 HZ2 LYS F 49 115.125 0.131 14.514 1.00 0.00 H new ATOM 0 HZ3 LYS F 49 116.767 -0.225 14.269 1.00 0.00 H new ATOM 1554 N LYS F 50 111.423 -3.953 11.493 1.00 0.00 N ATOM 1555 CA LYS F 50 110.959 -5.043 12.357 1.00 0.00 C ATOM 1556 C LYS F 50 110.615 -6.231 11.490 1.00 0.00 C ATOM 1557 O LYS F 50 110.784 -7.381 11.889 1.00 0.00 O ATOM 1558 CB LYS F 50 109.711 -4.625 13.148 1.00 0.00 C ATOM 1559 CG LYS F 50 110.070 -3.586 14.219 1.00 0.00 C ATOM 1560 CD LYS F 50 108.792 -3.146 14.951 1.00 0.00 C ATOM 1561 CE LYS F 50 108.950 -1.710 15.456 1.00 0.00 C ATOM 1562 NZ LYS F 50 107.712 -1.301 16.181 1.00 0.00 N ATOM 0 H LYS F 50 110.810 -3.138 11.468 1.00 0.00 H new ATOM 0 HA LYS F 50 111.749 -5.293 13.065 1.00 0.00 H new ATOM 0 HB2 LYS F 50 108.965 -4.212 12.469 1.00 0.00 H new ATOM 0 HB3 LYS F 50 109.263 -5.500 13.619 1.00 0.00 H new ATOM 0 HG2 LYS F 50 110.781 -4.009 14.928 1.00 0.00 H new ATOM 0 HG3 LYS F 50 110.554 -2.725 13.758 1.00 0.00 H new ATOM 0 HD2 LYS F 50 107.936 -3.212 14.279 1.00 0.00 H new ATOM 0 HD3 LYS F 50 108.593 -3.815 15.788 1.00 0.00 H new ATOM 0 HE2 LYS F 50 109.813 -1.638 16.118 1.00 0.00 H new ATOM 0 HE3 LYS F 50 109.134 -1.037 14.619 1.00 0.00 H new ATOM 0 HZ1 LYS F 50 107.855 -0.365 16.612 1.00 0.00 H new ATOM 0 HZ2 LYS F 50 106.917 -1.256 15.512 1.00 0.00 H new ATOM 0 HZ3 LYS F 50 107.500 -1.996 16.925 1.00 0.00 H new ATOM 1576 N LEU F 51 110.120 -5.920 10.295 1.00 0.00 N ATOM 1577 CA LEU F 51 109.728 -6.930 9.330 1.00 0.00 C ATOM 1578 C LEU F 51 110.941 -7.757 8.928 1.00 0.00 C ATOM 1579 O LEU F 51 110.849 -8.975 8.784 1.00 0.00 O ATOM 1580 CB LEU F 51 109.120 -6.247 8.103 1.00 0.00 C ATOM 1581 CG LEU F 51 108.147 -7.198 7.411 1.00 0.00 C ATOM 1582 CD1 LEU F 51 106.945 -7.451 8.337 1.00 0.00 C ATOM 1583 CD2 LEU F 51 107.682 -6.562 6.096 1.00 0.00 C ATOM 0 H LEU F 51 109.982 -4.962 9.974 1.00 0.00 H new ATOM 0 HA LEU F 51 108.986 -7.594 9.774 1.00 0.00 H new ATOM 0 HB2 LEU F 51 108.602 -5.336 8.402 1.00 0.00 H new ATOM 0 HB3 LEU F 51 109.909 -5.952 7.411 1.00 0.00 H new ATOM 0 HG LEU F 51 108.634 -8.149 7.196 1.00 0.00 H new ATOM 0 HD11 LEU F 51 106.246 -8.130 7.848 1.00 0.00 H new ATOM 0 HD12 LEU F 51 107.292 -7.896 9.270 1.00 0.00 H new ATOM 0 HD13 LEU F 51 106.445 -6.506 8.550 1.00 0.00 H new ATOM 0 HD21 LEU F 51 106.986 -7.234 5.593 1.00 0.00 H new ATOM 0 HD22 LEU F 51 107.185 -5.615 6.306 1.00 0.00 H new ATOM 0 HD23 LEU F 51 108.544 -6.385 5.453 1.00 0.00 H new ATOM 1595 N ASN F 52 112.087 -7.078 8.795 1.00 0.00 N ATOM 1596 CA ASN F 52 113.340 -7.753 8.464 1.00 0.00 C ATOM 1597 C ASN F 52 113.625 -8.792 9.558 1.00 0.00 C ATOM 1598 O ASN F 52 114.047 -9.911 9.272 1.00 0.00 O ATOM 1599 CB ASN F 52 114.483 -6.705 8.338 1.00 0.00 C ATOM 1600 CG ASN F 52 115.653 -7.015 9.274 1.00 0.00 C ATOM 1601 OD1 ASN F 52 116.584 -7.730 8.907 1.00 0.00 O ATOM 1602 ND2 ASN F 52 115.646 -6.510 10.469 1.00 0.00 N ATOM 0 H ASN F 52 112.169 -6.068 8.911 1.00 0.00 H new ATOM 0 HA ASN F 52 113.270 -8.266 7.505 1.00 0.00 H new ATOM 0 HB2 ASN F 52 114.840 -6.680 7.308 1.00 0.00 H new ATOM 0 HB3 ASN F 52 114.091 -5.713 8.564 1.00 0.00 H new ATOM 0 HD21 ASN F 52 116.415 -6.705 11.110 1.00 0.00 H new ATOM 0 HD22 ASN F 52 114.871 -5.918 10.768 1.00 0.00 H new ATOM 1609 N ASP F 53 113.353 -8.399 10.810 1.00 0.00 N ATOM 1610 CA ASP F 53 113.541 -9.281 11.962 1.00 0.00 C ATOM 1611 C ASP F 53 112.441 -10.355 12.005 1.00 0.00 C ATOM 1612 O ASP F 53 112.684 -11.489 12.428 1.00 0.00 O ATOM 1613 CB ASP F 53 113.528 -8.464 13.265 1.00 0.00 C ATOM 1614 CG ASP F 53 114.641 -7.408 13.249 1.00 0.00 C ATOM 1615 OD1 ASP F 53 115.801 -7.789 13.167 1.00 0.00 O ATOM 1616 OD2 ASP F 53 114.320 -6.231 13.323 1.00 0.00 O ATOM 0 H ASP F 53 113.001 -7.472 11.048 1.00 0.00 H new ATOM 0 HA ASP F 53 114.507 -9.775 11.863 1.00 0.00 H new ATOM 0 HB2 ASP F 53 112.560 -7.978 13.387 1.00 0.00 H new ATOM 0 HB3 ASP F 53 113.661 -9.128 14.119 1.00 0.00 H new ATOM 1621 N ALA F 54 111.231 -9.976 11.576 1.00 0.00 N ATOM 1622 CA ALA F 54 110.078 -10.885 11.567 1.00 0.00 C ATOM 1623 C ALA F 54 110.196 -11.944 10.466 1.00 0.00 C ATOM 1624 O ALA F 54 109.743 -13.078 10.637 1.00 0.00 O ATOM 1625 CB ALA F 54 108.788 -10.083 11.362 1.00 0.00 C ATOM 0 H ALA F 54 111.024 -9.040 11.228 1.00 0.00 H new ATOM 0 HA ALA F 54 110.055 -11.398 12.529 1.00 0.00 H new ATOM 0 HB1 ALA F 54 107.935 -10.761 11.356 1.00 0.00 H new ATOM 0 HB2 ALA F 54 108.674 -9.364 12.173 1.00 0.00 H new ATOM 0 HB3 ALA F 54 108.837 -9.553 10.411 1.00 0.00 H new ATOM 1631 N GLN F 55 110.793 -11.551 9.336 1.00 0.00 N ATOM 1632 CA GLN F 55 110.965 -12.449 8.183 1.00 0.00 C ATOM 1633 C GLN F 55 112.406 -12.950 8.097 1.00 0.00 C ATOM 1634 O GLN F 55 112.789 -13.622 7.133 1.00 0.00 O ATOM 1635 CB GLN F 55 110.599 -11.707 6.891 1.00 0.00 C ATOM 1636 CG GLN F 55 109.145 -11.235 6.969 1.00 0.00 C ATOM 1637 CD GLN F 55 108.720 -10.625 5.637 1.00 0.00 C ATOM 1638 OE1 GLN F 55 107.931 -11.219 4.901 1.00 0.00 O ATOM 1639 NE2 GLN F 55 109.209 -9.473 5.275 1.00 0.00 N ATOM 0 H GLN F 55 111.168 -10.613 9.192 1.00 0.00 H new ATOM 0 HA GLN F 55 110.306 -13.308 8.312 1.00 0.00 H new ATOM 0 HB2 GLN F 55 111.262 -10.854 6.748 1.00 0.00 H new ATOM 0 HB3 GLN F 55 110.734 -12.363 6.031 1.00 0.00 H new ATOM 0 HG2 GLN F 55 108.495 -12.074 7.218 1.00 0.00 H new ATOM 0 HG3 GLN F 55 109.035 -10.500 7.766 1.00 0.00 H new ATOM 0 HE21 GLN F 55 109.862 -8.982 5.885 1.00 0.00 H new ATOM 0 HE22 GLN F 55 108.938 -9.062 4.381 1.00 0.00 H new ATOM 1648 N ALA F 56 113.194 -12.592 9.106 1.00 0.00 N ATOM 1649 CA ALA F 56 114.600 -12.956 9.178 1.00 0.00 C ATOM 1650 C ALA F 56 114.811 -14.470 9.144 1.00 0.00 C ATOM 1651 O ALA F 56 113.866 -15.253 9.284 1.00 0.00 O ATOM 1652 CB ALA F 56 115.204 -12.388 10.468 1.00 0.00 C ATOM 0 H ALA F 56 112.871 -12.038 9.899 1.00 0.00 H new ATOM 0 HA ALA F 56 115.095 -12.536 8.303 1.00 0.00 H new ATOM 0 HB1 ALA F 56 116.258 -12.659 10.526 1.00 0.00 H new ATOM 0 HB2 ALA F 56 115.108 -11.302 10.468 1.00 0.00 H new ATOM 0 HB3 ALA F 56 114.676 -12.799 11.329 1.00 0.00 H new TER 1658 ALA F 56