USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=16 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= 0.556 K(o=0.35,f=-0.66) USER MOD Set 1.2: F 55 GLN : amide:sc= -0.204 K(o=0.35,f=-0.81) USER MOD Set 2.1: E 23 ASN : amide:sc= -2.62! C(o=-5.9!,f=-9.8!) USER MOD Set 2.2: E 55 GLN : amide:sc= -3.3! C(o=-5.9!,f=-6.8!) USER MOD Single : C 16 LYS NZ :NH3+ -156:sc= -0.0388 (180deg=-0.344) USER MOD Single : C 26 SER OG : rot 77:sc= 0.812 USER MOD Single : C 27 ASN : amide:sc= -0.0862 X(o=-0.086,f=-0.086) USER MOD Single : C 28 LYS NZ :NH3+ 140:sc=-0.00521 (180deg=-0.212) USER MOD Single : C 35 MET CE :methyl 173:sc= -1.16 (180deg=-1.19) USER MOD Single : E 18 TYR OH : rot 145:sc= 1.18 USER MOD Single : E 21 ASN : amide:sc= -1.78! X(o=-1.8!,f=-1.9) USER MOD Single : E 26 GLN : amide:sc= -2.32 K(o=-2.3,f=-0.58) USER MOD Single : E 32 HIS : no HE2:sc= 1.05 K(o=2,f=-6!) USER MOD Single : E 33 SER OG : rot 160:sc= 0 USER MOD Single : E 35 HIS : no HD1:sc= -0.473 X(o=-0.47,f=-0.87) USER MOD Single : E 39 SER OG : rot 180:sc= 0 USER MOD Single : E 40 GLN : amide:sc= -0.211 X(o=-0.21,f=0) USER MOD Single : E 41 SER OG : rot -92:sc= 1.2 USER MOD Single : E 43 ASN : amide:sc= -0.0286 X(o=-0.029,f=0) USER MOD Single : E 49 LYS NZ :NH3+ 140:sc= 0.932 (180deg=-0.793) USER MOD Single : E 50 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0734) USER MOD Single : E 52 ASN : amide:sc=-0.00769 K(o=-0.0077,f=-0.81) USER MOD Single : F 18 TYR OH : rot -74:sc= 0.747 USER MOD Single : F 21 ASN : amide:sc= -0.187 K(o=-0.19,f=-0.93) USER MOD Single : F 26 GLN : amide:sc= -0.968 X(o=-0.97,f=-0.91) USER MOD Single : F 32 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : F 33 SER OG : rot 140:sc= -0.335 USER MOD Single : F 35 HIS : no HD1:sc= 0 X(o=0,f=-0.0053) USER MOD Single : F 39 SER OG : rot 180:sc= 0 USER MOD Single : F 40 GLN : amide:sc= -0.782 K(o=-0.78,f=-0.21) USER MOD Single : F 41 SER OG : rot -67:sc= 0.906 USER MOD Single : F 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : F 49 LYS NZ :NH3+ -112:sc= 0 (180deg=-0.105) USER MOD Single : F 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 52 ASN : amide:sc= -0.0183 X(o=-0.018,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS C 16 126.011 -9.373 -3.755 1.00 0.00 N ATOM 2 CA LYS C 16 124.852 -9.290 -2.875 1.00 0.00 C ATOM 3 C LYS C 16 124.269 -7.881 -2.857 1.00 0.00 C ATOM 4 O LYS C 16 124.965 -6.921 -2.519 1.00 0.00 O ATOM 5 CB LYS C 16 125.303 -9.698 -1.464 1.00 0.00 C ATOM 6 CG LYS C 16 124.104 -10.159 -0.623 1.00 0.00 C ATOM 7 CD LYS C 16 123.631 -9.015 0.278 1.00 0.00 C ATOM 8 CE LYS C 16 124.430 -9.020 1.585 1.00 0.00 C ATOM 9 NZ LYS C 16 123.980 -10.159 2.439 1.00 0.00 N ATOM 0 HA LYS C 16 124.069 -9.957 -3.237 1.00 0.00 H new ATOM 0 HB2 LYS C 16 126.038 -10.501 -1.530 1.00 0.00 H new ATOM 0 HB3 LYS C 16 125.794 -8.856 -0.976 1.00 0.00 H new ATOM 0 HG2 LYS C 16 123.292 -10.479 -1.276 1.00 0.00 H new ATOM 0 HG3 LYS C 16 124.384 -11.020 -0.016 1.00 0.00 H new ATOM 0 HD2 LYS C 16 123.758 -8.061 -0.233 1.00 0.00 H new ATOM 0 HD3 LYS C 16 122.567 -9.123 0.491 1.00 0.00 H new ATOM 0 HE2 LYS C 16 125.495 -9.110 1.372 1.00 0.00 H new ATOM 0 HE3 LYS C 16 124.289 -8.077 2.114 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 124.192 -9.950 3.436 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 122.955 -10.296 2.324 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 124.479 -11.026 2.153 1.00 0.00 H new ATOM 23 N LEU C 17 122.982 -7.775 -3.209 1.00 0.00 N ATOM 24 CA LEU C 17 122.285 -6.487 -3.223 1.00 0.00 C ATOM 25 C LEU C 17 121.427 -6.346 -1.971 1.00 0.00 C ATOM 26 O LEU C 17 120.698 -7.272 -1.607 1.00 0.00 O ATOM 27 CB LEU C 17 121.379 -6.369 -4.464 1.00 0.00 C ATOM 28 CG LEU C 17 122.105 -5.656 -5.621 1.00 0.00 C ATOM 29 CD1 LEU C 17 122.542 -4.248 -5.210 1.00 0.00 C ATOM 30 CD2 LEU C 17 123.325 -6.480 -6.064 1.00 0.00 C ATOM 0 H LEU C 17 122.403 -8.567 -3.488 1.00 0.00 H new ATOM 0 HA LEU C 17 123.035 -5.697 -3.251 1.00 0.00 H new ATOM 0 HB2 LEU C 17 121.067 -7.363 -4.785 1.00 0.00 H new ATOM 0 HB3 LEU C 17 120.474 -5.819 -4.205 1.00 0.00 H new ATOM 0 HG LEU C 17 121.411 -5.566 -6.456 1.00 0.00 H new ATOM 0 HD11 LEU C 17 123.052 -3.767 -6.045 1.00 0.00 H new ATOM 0 HD12 LEU C 17 121.666 -3.661 -4.933 1.00 0.00 H new ATOM 0 HD13 LEU C 17 123.220 -4.311 -4.359 1.00 0.00 H new ATOM 0 HD21 LEU C 17 123.832 -5.968 -6.882 1.00 0.00 H new ATOM 0 HD22 LEU C 17 124.012 -6.593 -5.225 1.00 0.00 H new ATOM 0 HD23 LEU C 17 122.997 -7.464 -6.399 1.00 0.00 H new ATOM 42 N VAL C 18 121.502 -5.174 -1.333 1.00 0.00 N ATOM 43 CA VAL C 18 120.707 -4.901 -0.130 1.00 0.00 C ATOM 44 C VAL C 18 119.976 -3.577 -0.299 1.00 0.00 C ATOM 45 O VAL C 18 120.596 -2.578 -0.640 1.00 0.00 O ATOM 46 CB VAL C 18 121.604 -4.842 1.127 1.00 0.00 C ATOM 47 CG1 VAL C 18 120.722 -4.694 2.385 1.00 0.00 C ATOM 48 CG2 VAL C 18 122.434 -6.130 1.235 1.00 0.00 C ATOM 0 H VAL C 18 122.101 -4.403 -1.627 1.00 0.00 H new ATOM 0 HA VAL C 18 119.988 -5.710 0.001 1.00 0.00 H new ATOM 0 HB VAL C 18 122.274 -3.986 1.048 1.00 0.00 H new ATOM 0 HG11 VAL C 18 121.356 -4.653 3.271 1.00 0.00 H new ATOM 0 HG12 VAL C 18 120.137 -3.777 2.314 1.00 0.00 H new ATOM 0 HG13 VAL C 18 120.049 -5.548 2.460 1.00 0.00 H new ATOM 0 HG21 VAL C 18 123.065 -6.083 2.123 1.00 0.00 H new ATOM 0 HG22 VAL C 18 121.766 -6.988 1.309 1.00 0.00 H new ATOM 0 HG23 VAL C 18 123.061 -6.234 0.350 1.00 0.00 H new ATOM 58 N PHE C 19 118.668 -3.575 -0.034 1.00 0.00 N ATOM 59 CA PHE C 19 117.872 -2.358 -0.139 1.00 0.00 C ATOM 60 C PHE C 19 117.653 -1.791 1.249 1.00 0.00 C ATOM 61 O PHE C 19 117.171 -2.485 2.145 1.00 0.00 O ATOM 62 CB PHE C 19 116.511 -2.639 -0.807 1.00 0.00 C ATOM 63 CG PHE C 19 116.509 -2.052 -2.202 1.00 0.00 C ATOM 64 CD1 PHE C 19 117.358 -2.591 -3.175 1.00 0.00 C ATOM 65 CD2 PHE C 19 115.676 -0.960 -2.522 1.00 0.00 C ATOM 66 CE1 PHE C 19 117.381 -2.055 -4.463 1.00 0.00 C ATOM 67 CE2 PHE C 19 115.709 -0.424 -3.816 1.00 0.00 C ATOM 68 CZ PHE C 19 116.560 -0.972 -4.784 1.00 0.00 C ATOM 0 H PHE C 19 118.142 -4.401 0.253 1.00 0.00 H new ATOM 0 HA PHE C 19 118.409 -1.640 -0.759 1.00 0.00 H new ATOM 0 HB2 PHE C 19 116.329 -3.713 -0.851 1.00 0.00 H new ATOM 0 HB3 PHE C 19 115.706 -2.204 -0.215 1.00 0.00 H new ATOM 0 HD1 PHE C 19 117.998 -3.425 -2.928 1.00 0.00 H new ATOM 0 HD2 PHE C 19 115.018 -0.540 -1.776 1.00 0.00 H new ATOM 0 HE1 PHE C 19 118.034 -2.478 -5.212 1.00 0.00 H new ATOM 0 HE2 PHE C 19 115.076 0.414 -4.068 1.00 0.00 H new ATOM 0 HZ PHE C 19 116.581 -0.556 -5.781 1.00 0.00 H new ATOM 78 N PHE C 20 118.023 -0.529 1.411 1.00 0.00 N ATOM 79 CA PHE C 20 117.880 0.151 2.697 1.00 0.00 C ATOM 80 C PHE C 20 117.317 1.557 2.521 1.00 0.00 C ATOM 81 O PHE C 20 117.461 2.168 1.460 1.00 0.00 O ATOM 82 CB PHE C 20 119.235 0.214 3.410 1.00 0.00 C ATOM 83 CG PHE C 20 120.220 1.020 2.608 1.00 0.00 C ATOM 84 CD1 PHE C 20 120.188 2.417 2.661 1.00 0.00 C ATOM 85 CD2 PHE C 20 121.165 0.370 1.811 1.00 0.00 C ATOM 86 CE1 PHE C 20 121.095 3.162 1.917 1.00 0.00 C ATOM 87 CE2 PHE C 20 122.070 1.114 1.068 1.00 0.00 C ATOM 88 CZ PHE C 20 122.038 2.514 1.117 1.00 0.00 C ATOM 0 H PHE C 20 118.424 0.047 0.671 1.00 0.00 H new ATOM 0 HA PHE C 20 117.178 -0.420 3.304 1.00 0.00 H new ATOM 0 HB2 PHE C 20 119.112 0.659 4.397 1.00 0.00 H new ATOM 0 HB3 PHE C 20 119.620 -0.795 3.561 1.00 0.00 H new ATOM 0 HD1 PHE C 20 119.458 2.917 3.280 1.00 0.00 H new ATOM 0 HD2 PHE C 20 121.191 -0.709 1.773 1.00 0.00 H new ATOM 0 HE1 PHE C 20 121.070 4.241 1.958 1.00 0.00 H new ATOM 0 HE2 PHE C 20 122.801 0.613 0.450 1.00 0.00 H new ATOM 0 HZ PHE C 20 122.742 3.091 0.536 1.00 0.00 H new ATOM 98 N ALA C 21 116.690 2.066 3.583 1.00 0.00 N ATOM 99 CA ALA C 21 116.123 3.408 3.561 1.00 0.00 C ATOM 100 C ALA C 21 116.840 4.290 4.580 1.00 0.00 C ATOM 101 O ALA C 21 117.080 3.865 5.714 1.00 0.00 O ATOM 102 CB ALA C 21 114.633 3.338 3.875 1.00 0.00 C ATOM 0 H ALA C 21 116.564 1.568 4.464 1.00 0.00 H new ATOM 0 HA ALA C 21 116.255 3.842 2.570 1.00 0.00 H new ATOM 0 HB1 ALA C 21 114.210 4.342 3.858 1.00 0.00 H new ATOM 0 HB2 ALA C 21 114.132 2.721 3.129 1.00 0.00 H new ATOM 0 HB3 ALA C 21 114.490 2.900 4.863 1.00 0.00 H new ATOM 108 N GLU C 22 117.180 5.514 4.164 1.00 0.00 N ATOM 109 CA GLU C 22 117.869 6.467 5.012 1.00 0.00 C ATOM 110 C GLU C 22 116.904 7.570 5.419 1.00 0.00 C ATOM 111 O GLU C 22 116.301 8.197 4.557 1.00 0.00 O ATOM 112 CB GLU C 22 119.043 7.053 4.215 1.00 0.00 C ATOM 113 CG GLU C 22 119.754 8.130 5.031 1.00 0.00 C ATOM 114 CD GLU C 22 120.898 8.747 4.220 1.00 0.00 C ATOM 115 OE1 GLU C 22 121.853 8.038 3.943 1.00 0.00 O ATOM 116 OE2 GLU C 22 120.803 9.917 3.886 1.00 0.00 O ATOM 0 H GLU C 22 116.981 5.864 3.227 1.00 0.00 H new ATOM 0 HA GLU C 22 118.241 5.982 5.914 1.00 0.00 H new ATOM 0 HB2 GLU C 22 119.746 6.261 3.955 1.00 0.00 H new ATOM 0 HB3 GLU C 22 118.680 7.477 3.279 1.00 0.00 H new ATOM 0 HG2 GLU C 22 119.044 8.906 5.318 1.00 0.00 H new ATOM 0 HG3 GLU C 22 120.145 7.698 5.953 1.00 0.00 H new ATOM 123 N ASP C 23 116.780 7.813 6.724 1.00 0.00 N ATOM 124 CA ASP C 23 115.892 8.861 7.219 1.00 0.00 C ATOM 125 C ASP C 23 116.571 10.208 6.995 1.00 0.00 C ATOM 126 O ASP C 23 117.616 10.491 7.582 1.00 0.00 O ATOM 127 CB ASP C 23 115.585 8.647 8.715 1.00 0.00 C ATOM 128 CG ASP C 23 114.327 9.424 9.146 1.00 0.00 C ATOM 129 OD1 ASP C 23 114.141 10.547 8.696 1.00 0.00 O ATOM 130 OD2 ASP C 23 113.564 8.879 9.929 1.00 0.00 O ATOM 0 H ASP C 23 117.280 7.302 7.451 1.00 0.00 H new ATOM 0 HA ASP C 23 114.944 8.831 6.682 1.00 0.00 H new ATOM 0 HB2 ASP C 23 115.443 7.584 8.911 1.00 0.00 H new ATOM 0 HB3 ASP C 23 116.437 8.970 9.313 1.00 0.00 H new ATOM 135 N VAL C 24 115.992 11.005 6.102 1.00 0.00 N ATOM 136 CA VAL C 24 116.560 12.313 5.743 1.00 0.00 C ATOM 137 C VAL C 24 115.625 13.468 6.105 1.00 0.00 C ATOM 138 O VAL C 24 116.029 14.634 6.038 1.00 0.00 O ATOM 139 CB VAL C 24 116.855 12.319 4.230 1.00 0.00 C ATOM 140 CG1 VAL C 24 117.708 11.085 3.889 1.00 0.00 C ATOM 141 CG2 VAL C 24 115.533 12.292 3.425 1.00 0.00 C ATOM 0 H VAL C 24 115.129 10.773 5.610 1.00 0.00 H new ATOM 0 HA VAL C 24 117.477 12.461 6.313 1.00 0.00 H new ATOM 0 HB VAL C 24 117.396 13.227 3.965 1.00 0.00 H new ATOM 0 HG11 VAL C 24 117.925 11.076 2.821 1.00 0.00 H new ATOM 0 HG12 VAL C 24 118.643 11.123 4.448 1.00 0.00 H new ATOM 0 HG13 VAL C 24 117.162 10.180 4.156 1.00 0.00 H new ATOM 0 HG21 VAL C 24 115.756 12.297 2.358 1.00 0.00 H new ATOM 0 HG22 VAL C 24 114.973 11.391 3.675 1.00 0.00 H new ATOM 0 HG23 VAL C 24 114.937 13.170 3.675 1.00 0.00 H new ATOM 151 N GLY C 25 114.374 13.144 6.458 1.00 0.00 N ATOM 152 CA GLY C 25 113.390 14.171 6.793 1.00 0.00 C ATOM 153 C GLY C 25 113.225 15.108 5.603 1.00 0.00 C ATOM 154 O GLY C 25 112.927 14.655 4.496 1.00 0.00 O ATOM 0 H GLY C 25 114.026 12.187 6.518 1.00 0.00 H new ATOM 0 HA2 GLY C 25 112.435 13.710 7.044 1.00 0.00 H new ATOM 0 HA3 GLY C 25 113.714 14.731 7.671 1.00 0.00 H new ATOM 158 N SER C 26 113.466 16.403 5.834 1.00 0.00 N ATOM 159 CA SER C 26 113.390 17.422 4.775 1.00 0.00 C ATOM 160 C SER C 26 112.112 17.292 3.926 1.00 0.00 C ATOM 161 O SER C 26 112.109 17.642 2.742 1.00 0.00 O ATOM 162 CB SER C 26 114.630 17.304 3.874 1.00 0.00 C ATOM 163 OG SER C 26 115.793 17.142 4.681 1.00 0.00 O ATOM 0 H SER C 26 113.717 16.774 6.750 1.00 0.00 H new ATOM 0 HA SER C 26 113.358 18.401 5.254 1.00 0.00 H new ATOM 0 HB2 SER C 26 114.522 16.455 3.199 1.00 0.00 H new ATOM 0 HB3 SER C 26 114.727 18.195 3.253 1.00 0.00 H new ATOM 0 HG SER C 26 115.836 16.220 5.011 1.00 0.00 H new ATOM 169 N ASN C 27 111.045 16.767 4.542 1.00 0.00 N ATOM 170 CA ASN C 27 109.756 16.552 3.863 1.00 0.00 C ATOM 171 C ASN C 27 109.856 15.422 2.830 1.00 0.00 C ATOM 172 O ASN C 27 108.849 15.009 2.251 1.00 0.00 O ATOM 173 CB ASN C 27 109.256 17.847 3.194 1.00 0.00 C ATOM 174 CG ASN C 27 107.779 17.716 2.825 1.00 0.00 C ATOM 175 OD1 ASN C 27 107.441 17.547 1.654 1.00 0.00 O ATOM 176 ND2 ASN C 27 106.874 17.787 3.762 1.00 0.00 N ATOM 0 H ASN C 27 111.048 16.480 5.521 1.00 0.00 H new ATOM 0 HA ASN C 27 109.032 16.258 4.623 1.00 0.00 H new ATOM 0 HB2 ASN C 27 109.396 18.691 3.870 1.00 0.00 H new ATOM 0 HB3 ASN C 27 109.844 18.053 2.300 1.00 0.00 H new ATOM 0 HD21 ASN C 27 105.886 17.702 3.524 1.00 0.00 H new ATOM 0 HD22 ASN C 27 107.155 17.927 4.733 1.00 0.00 H new ATOM 183 N LYS C 28 111.074 14.912 2.636 1.00 0.00 N ATOM 184 CA LYS C 28 111.332 13.814 1.712 1.00 0.00 C ATOM 185 C LYS C 28 111.194 12.472 2.431 1.00 0.00 C ATOM 186 O LYS C 28 111.313 11.411 1.810 1.00 0.00 O ATOM 187 CB LYS C 28 112.755 13.939 1.163 1.00 0.00 C ATOM 188 CG LYS C 28 112.902 15.238 0.358 1.00 0.00 C ATOM 189 CD LYS C 28 114.133 15.157 -0.560 1.00 0.00 C ATOM 190 CE LYS C 28 115.428 15.202 0.266 1.00 0.00 C ATOM 191 NZ LYS C 28 115.698 16.607 0.690 1.00 0.00 N ATOM 0 H LYS C 28 111.907 15.251 3.117 1.00 0.00 H new ATOM 0 HA LYS C 28 110.608 13.861 0.898 1.00 0.00 H new ATOM 0 HB2 LYS C 28 113.471 13.929 1.984 1.00 0.00 H new ATOM 0 HB3 LYS C 28 112.984 13.082 0.529 1.00 0.00 H new ATOM 0 HG2 LYS C 28 112.005 15.409 -0.238 1.00 0.00 H new ATOM 0 HG3 LYS C 28 113.000 16.086 1.036 1.00 0.00 H new ATOM 0 HD2 LYS C 28 114.099 14.236 -1.143 1.00 0.00 H new ATOM 0 HD3 LYS C 28 114.119 15.984 -1.270 1.00 0.00 H new ATOM 0 HE2 LYS C 28 115.337 14.558 1.141 1.00 0.00 H new ATOM 0 HE3 LYS C 28 116.262 14.822 -0.324 1.00 0.00 H new ATOM 0 HZ1 LYS C 28 116.051 16.613 1.668 1.00 0.00 H new ATOM 0 HZ2 LYS C 28 116.412 17.028 0.062 1.00 0.00 H new ATOM 0 HZ3 LYS C 28 114.819 17.161 0.636 1.00 0.00 H new ATOM 205 N GLY C 29 110.966 12.525 3.747 1.00 0.00 N ATOM 206 CA GLY C 29 110.842 11.311 4.541 1.00 0.00 C ATOM 207 C GLY C 29 112.181 10.594 4.553 1.00 0.00 C ATOM 208 O GLY C 29 113.122 11.053 5.203 1.00 0.00 O ATOM 0 H GLY C 29 110.865 13.391 4.276 1.00 0.00 H new ATOM 0 HA2 GLY C 29 110.536 11.555 5.558 1.00 0.00 H new ATOM 0 HA3 GLY C 29 110.071 10.664 4.123 1.00 0.00 H new ATOM 212 N ALA C 30 112.268 9.483 3.814 1.00 0.00 N ATOM 213 CA ALA C 30 113.508 8.718 3.721 1.00 0.00 C ATOM 214 C ALA C 30 113.927 8.552 2.259 1.00 0.00 C ATOM 215 O ALA C 30 113.126 8.775 1.344 1.00 0.00 O ATOM 216 CB ALA C 30 113.336 7.346 4.371 1.00 0.00 C ATOM 0 H ALA C 30 111.494 9.097 3.274 1.00 0.00 H new ATOM 0 HA ALA C 30 114.288 9.265 4.250 1.00 0.00 H new ATOM 0 HB1 ALA C 30 114.269 6.787 4.294 1.00 0.00 H new ATOM 0 HB2 ALA C 30 113.074 7.471 5.422 1.00 0.00 H new ATOM 0 HB3 ALA C 30 112.542 6.799 3.862 1.00 0.00 H new ATOM 222 N ILE C 31 115.189 8.158 2.054 1.00 0.00 N ATOM 223 CA ILE C 31 115.736 7.956 0.710 1.00 0.00 C ATOM 224 C ILE C 31 116.062 6.488 0.490 1.00 0.00 C ATOM 225 O ILE C 31 116.664 5.843 1.351 1.00 0.00 O ATOM 226 CB ILE C 31 117.027 8.777 0.507 1.00 0.00 C ATOM 227 CG1 ILE C 31 116.748 10.271 0.738 1.00 0.00 C ATOM 228 CG2 ILE C 31 117.545 8.565 -0.921 1.00 0.00 C ATOM 229 CD1 ILE C 31 118.017 11.102 0.479 1.00 0.00 C ATOM 0 H ILE C 31 115.852 7.972 2.806 1.00 0.00 H new ATOM 0 HA ILE C 31 114.981 8.286 -0.004 1.00 0.00 H new ATOM 0 HB ILE C 31 117.778 8.444 1.224 1.00 0.00 H new ATOM 0 HG12 ILE C 31 115.947 10.604 0.078 1.00 0.00 H new ATOM 0 HG13 ILE C 31 116.405 10.429 1.760 1.00 0.00 H new ATOM 0 HG21 ILE C 31 118.457 9.144 -1.067 1.00 0.00 H new ATOM 0 HG22 ILE C 31 117.758 7.507 -1.078 1.00 0.00 H new ATOM 0 HG23 ILE C 31 116.789 8.893 -1.635 1.00 0.00 H new ATOM 0 HD11 ILE C 31 117.802 12.157 0.647 1.00 0.00 H new ATOM 0 HD12 ILE C 31 118.807 10.780 1.157 1.00 0.00 H new ATOM 0 HD13 ILE C 31 118.342 10.958 -0.551 1.00 0.00 H new ATOM 241 N ILE C 32 115.689 5.983 -0.686 1.00 0.00 N ATOM 242 CA ILE C 32 115.969 4.602 -1.039 1.00 0.00 C ATOM 243 C ILE C 32 117.370 4.497 -1.626 1.00 0.00 C ATOM 244 O ILE C 32 117.660 5.046 -2.695 1.00 0.00 O ATOM 245 CB ILE C 32 114.914 4.066 -2.042 1.00 0.00 C ATOM 246 CG1 ILE C 32 113.715 3.483 -1.273 1.00 0.00 C ATOM 247 CG2 ILE C 32 115.514 2.981 -2.958 1.00 0.00 C ATOM 248 CD1 ILE C 32 114.107 2.168 -0.571 1.00 0.00 C ATOM 0 H ILE C 32 115.194 6.512 -1.404 1.00 0.00 H new ATOM 0 HA ILE C 32 115.915 3.990 -0.139 1.00 0.00 H new ATOM 0 HB ILE C 32 114.586 4.898 -2.665 1.00 0.00 H new ATOM 0 HG12 ILE C 32 113.364 4.204 -0.535 1.00 0.00 H new ATOM 0 HG13 ILE C 32 112.889 3.302 -1.960 1.00 0.00 H new ATOM 0 HG21 ILE C 32 114.750 2.625 -3.649 1.00 0.00 H new ATOM 0 HG22 ILE C 32 116.347 3.401 -3.522 1.00 0.00 H new ATOM 0 HG23 ILE C 32 115.870 2.148 -2.351 1.00 0.00 H new ATOM 0 HD11 ILE C 32 113.246 1.772 -0.033 1.00 0.00 H new ATOM 0 HD12 ILE C 32 114.435 1.442 -1.315 1.00 0.00 H new ATOM 0 HD13 ILE C 32 114.918 2.359 0.132 1.00 0.00 H new ATOM 260 N GLY C 33 118.213 3.757 -0.921 1.00 0.00 N ATOM 261 CA GLY C 33 119.580 3.511 -1.345 1.00 0.00 C ATOM 262 C GLY C 33 119.883 2.040 -1.145 1.00 0.00 C ATOM 263 O GLY C 33 119.382 1.430 -0.202 1.00 0.00 O ATOM 0 H GLY C 33 117.966 3.310 -0.038 1.00 0.00 H new ATOM 0 HA2 GLY C 33 119.708 3.786 -2.392 1.00 0.00 H new ATOM 0 HA3 GLY C 33 120.273 4.123 -0.768 1.00 0.00 H new ATOM 267 N LEU C 34 120.685 1.469 -2.032 1.00 0.00 N ATOM 268 CA LEU C 34 121.026 0.052 -1.927 1.00 0.00 C ATOM 269 C LEU C 34 122.522 -0.155 -1.864 1.00 0.00 C ATOM 270 O LEU C 34 123.306 0.703 -2.257 1.00 0.00 O ATOM 271 CB LEU C 34 120.461 -0.756 -3.098 1.00 0.00 C ATOM 272 CG LEU C 34 120.726 -0.036 -4.421 1.00 0.00 C ATOM 273 CD1 LEU C 34 121.010 -1.083 -5.513 1.00 0.00 C ATOM 274 CD2 LEU C 34 119.505 0.831 -4.787 1.00 0.00 C ATOM 0 H LEU C 34 121.108 1.954 -2.823 1.00 0.00 H new ATOM 0 HA LEU C 34 120.575 -0.303 -1.001 1.00 0.00 H new ATOM 0 HB2 LEU C 34 120.917 -1.746 -3.118 1.00 0.00 H new ATOM 0 HB3 LEU C 34 119.389 -0.901 -2.964 1.00 0.00 H new ATOM 0 HG LEU C 34 121.593 0.618 -4.330 1.00 0.00 H new ATOM 0 HD11 LEU C 34 121.200 -0.578 -6.460 1.00 0.00 H new ATOM 0 HD12 LEU C 34 121.884 -1.672 -5.234 1.00 0.00 H new ATOM 0 HD13 LEU C 34 120.148 -1.741 -5.619 1.00 0.00 H new ATOM 0 HD21 LEU C 34 119.693 1.345 -5.730 1.00 0.00 H new ATOM 0 HD22 LEU C 34 118.625 0.196 -4.889 1.00 0.00 H new ATOM 0 HD23 LEU C 34 119.332 1.567 -4.001 1.00 0.00 H new ATOM 286 N MET C 35 122.884 -1.321 -1.362 1.00 0.00 N ATOM 287 CA MET C 35 124.281 -1.719 -1.222 1.00 0.00 C ATOM 288 C MET C 35 124.596 -2.790 -2.260 1.00 0.00 C ATOM 289 O MET C 35 123.737 -3.618 -2.569 1.00 0.00 O ATOM 290 CB MET C 35 124.523 -2.200 0.235 1.00 0.00 C ATOM 291 CG MET C 35 125.161 -3.604 0.326 1.00 0.00 C ATOM 292 SD MET C 35 126.950 -3.443 0.485 1.00 0.00 S ATOM 293 CE MET C 35 126.943 -3.215 2.272 1.00 0.00 C ATOM 0 H MET C 35 122.219 -2.024 -1.038 1.00 0.00 H new ATOM 0 HA MET C 35 124.955 -0.882 -1.404 1.00 0.00 H new ATOM 0 HB2 MET C 35 125.169 -1.483 0.743 1.00 0.00 H new ATOM 0 HB3 MET C 35 123.573 -2.207 0.769 1.00 0.00 H new ATOM 0 HG2 MET C 35 124.756 -4.144 1.182 1.00 0.00 H new ATOM 0 HG3 MET C 35 124.915 -4.185 -0.563 1.00 0.00 H new ATOM 0 HE1 MET C 35 127.968 -3.214 2.643 1.00 0.00 H new ATOM 0 HE2 MET C 35 126.468 -2.265 2.516 1.00 0.00 H new ATOM 0 HE3 MET C 35 126.389 -4.028 2.740 1.00 0.00 H new ATOM 303 N VAL C 36 125.819 -2.756 -2.795 1.00 0.00 N ATOM 304 CA VAL C 36 126.247 -3.716 -3.817 1.00 0.00 C ATOM 305 C VAL C 36 127.497 -4.476 -3.361 1.00 0.00 C ATOM 306 O VAL C 36 128.525 -3.864 -3.058 1.00 0.00 O ATOM 307 CB VAL C 36 126.564 -2.970 -5.131 1.00 0.00 C ATOM 308 CG1 VAL C 36 126.755 -3.981 -6.269 1.00 0.00 C ATOM 309 CG2 VAL C 36 125.430 -1.990 -5.501 1.00 0.00 C ATOM 0 H VAL C 36 126.532 -2.073 -2.537 1.00 0.00 H new ATOM 0 HA VAL C 36 125.438 -4.429 -3.976 1.00 0.00 H new ATOM 0 HB VAL C 36 127.481 -2.399 -4.984 1.00 0.00 H new ATOM 0 HG11 VAL C 36 126.978 -3.450 -7.194 1.00 0.00 H new ATOM 0 HG12 VAL C 36 127.580 -4.650 -6.026 1.00 0.00 H new ATOM 0 HG13 VAL C 36 125.842 -4.563 -6.396 1.00 0.00 H new ATOM 0 HG21 VAL C 36 125.680 -1.478 -6.430 1.00 0.00 H new ATOM 0 HG22 VAL C 36 124.499 -2.542 -5.630 1.00 0.00 H new ATOM 0 HG23 VAL C 36 125.309 -1.256 -4.704 1.00 0.00 H new ATOM 319 N GLY C 37 127.408 -5.810 -3.348 1.00 0.00 N ATOM 320 CA GLY C 37 128.534 -6.662 -2.968 1.00 0.00 C ATOM 321 C GLY C 37 128.789 -6.672 -1.462 1.00 0.00 C ATOM 322 O GLY C 37 128.837 -5.621 -0.818 1.00 0.00 O ATOM 0 H GLY C 37 126.562 -6.323 -3.598 1.00 0.00 H new ATOM 0 HA2 GLY C 37 128.343 -7.681 -3.306 1.00 0.00 H new ATOM 0 HA3 GLY C 37 129.432 -6.319 -3.481 1.00 0.00 H new ATOM 326 N GLY C 38 128.971 -7.879 -0.918 1.00 0.00 N ATOM 327 CA GLY C 38 129.246 -8.056 0.504 1.00 0.00 C ATOM 328 C GLY C 38 128.117 -7.524 1.374 1.00 0.00 C ATOM 329 O GLY C 38 127.047 -7.158 0.877 1.00 0.00 O ATOM 0 H GLY C 38 128.932 -8.750 -1.447 1.00 0.00 H new ATOM 0 HA2 GLY C 38 129.398 -9.115 0.715 1.00 0.00 H new ATOM 0 HA3 GLY C 38 130.173 -7.544 0.760 1.00 0.00 H new ATOM 333 N VAL C 39 128.370 -7.503 2.684 1.00 0.00 N ATOM 334 CA VAL C 39 127.383 -7.032 3.654 1.00 0.00 C ATOM 335 C VAL C 39 128.048 -6.195 4.753 1.00 0.00 C ATOM 336 O VAL C 39 129.187 -6.456 5.144 1.00 0.00 O ATOM 337 CB VAL C 39 126.641 -8.243 4.259 1.00 0.00 C ATOM 338 CG1 VAL C 39 127.625 -9.153 5.015 1.00 0.00 C ATOM 339 CG2 VAL C 39 125.532 -7.763 5.214 1.00 0.00 C ATOM 0 H VAL C 39 129.252 -7.807 3.097 1.00 0.00 H new ATOM 0 HA VAL C 39 126.664 -6.390 3.145 1.00 0.00 H new ATOM 0 HB VAL C 39 126.189 -8.813 3.447 1.00 0.00 H new ATOM 0 HG11 VAL C 39 127.086 -10.002 5.435 1.00 0.00 H new ATOM 0 HG12 VAL C 39 128.389 -9.513 4.327 1.00 0.00 H new ATOM 0 HG13 VAL C 39 128.098 -8.589 5.819 1.00 0.00 H new ATOM 0 HG21 VAL C 39 125.015 -8.626 5.635 1.00 0.00 H new ATOM 0 HG22 VAL C 39 125.974 -7.177 6.019 1.00 0.00 H new ATOM 0 HG23 VAL C 39 124.820 -7.147 4.665 1.00 0.00 H new ATOM 349 N VAL C 40 127.314 -5.196 5.253 1.00 0.00 N ATOM 350 CA VAL C 40 127.814 -4.317 6.316 1.00 0.00 C ATOM 351 C VAL C 40 128.203 -5.143 7.558 1.00 0.00 C ATOM 352 O VAL C 40 129.386 -5.209 7.854 1.00 0.00 O ATOM 353 CB VAL C 40 126.730 -3.277 6.676 1.00 0.00 C ATOM 354 CG1 VAL C 40 127.203 -2.388 7.839 1.00 0.00 C ATOM 355 CG2 VAL C 40 126.432 -2.396 5.453 1.00 0.00 C ATOM 356 OXT VAL C 40 127.315 -5.707 8.182 1.00 0.00 O ATOM 0 H VAL C 40 126.369 -4.975 4.938 1.00 0.00 H new ATOM 0 HA VAL C 40 128.704 -3.797 5.962 1.00 0.00 H new ATOM 0 HB VAL C 40 125.827 -3.807 6.979 1.00 0.00 H new ATOM 0 HG11 VAL C 40 126.428 -1.661 8.080 1.00 0.00 H new ATOM 0 HG12 VAL C 40 127.403 -3.008 8.713 1.00 0.00 H new ATOM 0 HG13 VAL C 40 128.114 -1.864 7.549 1.00 0.00 H new ATOM 0 HG21 VAL C 40 125.667 -1.663 5.710 1.00 0.00 H new ATOM 0 HG22 VAL C 40 127.341 -1.879 5.147 1.00 0.00 H new ATOM 0 HG23 VAL C 40 126.076 -3.020 4.633 1.00 0.00 H new TER 366 VAL C 40 ATOM 367 N GLY E 14 131.767 -2.922 -0.254 1.00 0.00 N ATOM 368 CA GLY E 14 130.730 -2.890 -1.287 1.00 0.00 C ATOM 369 C GLY E 14 130.507 -1.472 -1.816 1.00 0.00 C ATOM 370 O GLY E 14 131.017 -0.498 -1.252 1.00 0.00 O ATOM 0 HA2 GLY E 14 131.015 -3.546 -2.110 1.00 0.00 H new ATOM 0 HA3 GLY E 14 129.797 -3.278 -0.879 1.00 0.00 H new ATOM 374 N GLU E 15 129.715 -1.374 -2.890 1.00 0.00 N ATOM 375 CA GLU E 15 129.376 -0.087 -3.506 1.00 0.00 C ATOM 376 C GLU E 15 127.956 0.280 -3.111 1.00 0.00 C ATOM 377 O GLU E 15 127.037 -0.501 -3.345 1.00 0.00 O ATOM 378 CB GLU E 15 129.482 -0.195 -5.039 1.00 0.00 C ATOM 379 CG GLU E 15 129.083 1.134 -5.704 1.00 0.00 C ATOM 380 CD GLU E 15 129.174 1.012 -7.227 1.00 0.00 C ATOM 381 OE1 GLU E 15 130.277 0.853 -7.725 1.00 0.00 O ATOM 382 OE2 GLU E 15 128.139 1.079 -7.875 1.00 0.00 O ATOM 0 H GLU E 15 129.294 -2.179 -3.354 1.00 0.00 H new ATOM 0 HA GLU E 15 130.068 0.682 -3.163 1.00 0.00 H new ATOM 0 HB2 GLU E 15 130.502 -0.457 -5.321 1.00 0.00 H new ATOM 0 HB3 GLU E 15 128.836 -0.996 -5.398 1.00 0.00 H new ATOM 0 HG2 GLU E 15 128.068 1.404 -5.414 1.00 0.00 H new ATOM 0 HG3 GLU E 15 129.737 1.934 -5.356 1.00 0.00 H new ATOM 389 N ILE E 16 127.780 1.457 -2.509 1.00 0.00 N ATOM 390 CA ILE E 16 126.452 1.889 -2.074 1.00 0.00 C ATOM 391 C ILE E 16 125.865 2.911 -3.056 1.00 0.00 C ATOM 392 O ILE E 16 126.488 3.927 -3.372 1.00 0.00 O ATOM 393 CB ILE E 16 126.526 2.453 -0.642 1.00 0.00 C ATOM 394 CG1 ILE E 16 127.278 1.426 0.270 1.00 0.00 C ATOM 395 CG2 ILE E 16 125.099 2.704 -0.135 1.00 0.00 C ATOM 396 CD1 ILE E 16 126.609 1.248 1.648 1.00 0.00 C ATOM 0 H ILE E 16 128.530 2.120 -2.314 1.00 0.00 H new ATOM 0 HA ILE E 16 125.783 1.029 -2.064 1.00 0.00 H new ATOM 0 HB ILE E 16 127.072 3.396 -0.624 1.00 0.00 H new ATOM 0 HG12 ILE E 16 127.320 0.461 -0.235 1.00 0.00 H new ATOM 0 HG13 ILE E 16 128.307 1.757 0.411 1.00 0.00 H new ATOM 0 HG21 ILE E 16 125.138 3.104 0.878 1.00 0.00 H new ATOM 0 HG22 ILE E 16 124.601 3.420 -0.789 1.00 0.00 H new ATOM 0 HG23 ILE E 16 124.543 1.766 -0.134 1.00 0.00 H new ATOM 0 HD11 ILE E 16 127.174 0.525 2.236 1.00 0.00 H new ATOM 0 HD12 ILE E 16 126.591 2.205 2.170 1.00 0.00 H new ATOM 0 HD13 ILE E 16 125.589 0.888 1.513 1.00 0.00 H new ATOM 408 N VAL E 17 124.664 2.582 -3.548 1.00 0.00 N ATOM 409 CA VAL E 17 123.934 3.390 -4.532 1.00 0.00 C ATOM 410 C VAL E 17 122.680 4.037 -3.929 1.00 0.00 C ATOM 411 O VAL E 17 122.008 3.444 -3.091 1.00 0.00 O ATOM 412 CB VAL E 17 123.527 2.469 -5.703 1.00 0.00 C ATOM 413 CG1 VAL E 17 122.530 3.178 -6.641 1.00 0.00 C ATOM 414 CG2 VAL E 17 124.778 2.075 -6.496 1.00 0.00 C ATOM 0 H VAL E 17 124.166 1.736 -3.270 1.00 0.00 H new ATOM 0 HA VAL E 17 124.583 4.197 -4.872 1.00 0.00 H new ATOM 0 HB VAL E 17 123.046 1.581 -5.294 1.00 0.00 H new ATOM 0 HG11 VAL E 17 122.259 2.508 -7.457 1.00 0.00 H new ATOM 0 HG12 VAL E 17 121.635 3.449 -6.082 1.00 0.00 H new ATOM 0 HG13 VAL E 17 122.990 4.078 -7.048 1.00 0.00 H new ATOM 0 HG21 VAL E 17 124.494 1.425 -7.324 1.00 0.00 H new ATOM 0 HG22 VAL E 17 125.258 2.972 -6.887 1.00 0.00 H new ATOM 0 HG23 VAL E 17 125.472 1.548 -5.842 1.00 0.00 H new ATOM 424 N TYR E 18 122.370 5.250 -4.402 1.00 0.00 N ATOM 425 CA TYR E 18 121.179 5.990 -3.967 1.00 0.00 C ATOM 426 C TYR E 18 120.337 6.357 -5.191 1.00 0.00 C ATOM 427 O TYR E 18 120.852 6.967 -6.133 1.00 0.00 O ATOM 428 CB TYR E 18 121.584 7.263 -3.205 1.00 0.00 C ATOM 429 CG TYR E 18 121.873 6.924 -1.767 1.00 0.00 C ATOM 430 CD1 TYR E 18 123.022 6.208 -1.433 1.00 0.00 C ATOM 431 CD2 TYR E 18 120.989 7.337 -0.766 1.00 0.00 C ATOM 432 CE1 TYR E 18 123.289 5.907 -0.100 1.00 0.00 C ATOM 433 CE2 TYR E 18 121.250 7.036 0.567 1.00 0.00 C ATOM 434 CZ TYR E 18 122.406 6.320 0.905 1.00 0.00 C ATOM 435 OH TYR E 18 122.676 6.022 2.227 1.00 0.00 O ATOM 0 H TYR E 18 122.934 5.744 -5.093 1.00 0.00 H new ATOM 0 HA TYR E 18 120.594 5.361 -3.296 1.00 0.00 H new ATOM 0 HB2 TYR E 18 122.464 7.710 -3.667 1.00 0.00 H new ATOM 0 HB3 TYR E 18 120.784 8.002 -3.261 1.00 0.00 H new ATOM 0 HD1 TYR E 18 123.704 5.887 -2.207 1.00 0.00 H new ATOM 0 HD2 TYR E 18 120.100 7.892 -1.028 1.00 0.00 H new ATOM 0 HE1 TYR E 18 124.179 5.354 0.159 1.00 0.00 H new ATOM 0 HE2 TYR E 18 120.564 7.353 1.339 1.00 0.00 H new ATOM 0 HH TYR E 18 122.372 6.759 2.797 1.00 0.00 H new ATOM 445 N LEU E 19 119.047 5.982 -5.173 1.00 0.00 N ATOM 446 CA LEU E 19 118.141 6.276 -6.293 1.00 0.00 C ATOM 447 C LEU E 19 116.933 7.110 -5.816 1.00 0.00 C ATOM 448 O LEU E 19 115.778 6.691 -5.963 1.00 0.00 O ATOM 449 CB LEU E 19 117.653 4.959 -6.941 1.00 0.00 C ATOM 450 CG LEU E 19 118.835 4.175 -7.550 1.00 0.00 C ATOM 451 CD1 LEU E 19 118.426 2.714 -7.802 1.00 0.00 C ATOM 452 CD2 LEU E 19 119.279 4.819 -8.875 1.00 0.00 C ATOM 0 H LEU E 19 118.612 5.478 -4.400 1.00 0.00 H new ATOM 0 HA LEU E 19 118.689 6.857 -7.034 1.00 0.00 H new ATOM 0 HB2 LEU E 19 117.151 4.345 -6.193 1.00 0.00 H new ATOM 0 HB3 LEU E 19 116.920 5.180 -7.717 1.00 0.00 H new ATOM 0 HG LEU E 19 119.666 4.201 -6.845 1.00 0.00 H new ATOM 0 HD11 LEU E 19 119.267 2.170 -8.232 1.00 0.00 H new ATOM 0 HD12 LEU E 19 118.137 2.249 -6.859 1.00 0.00 H new ATOM 0 HD13 LEU E 19 117.584 2.686 -8.494 1.00 0.00 H new ATOM 0 HD21 LEU E 19 120.113 4.255 -9.292 1.00 0.00 H new ATOM 0 HD22 LEU E 19 118.447 4.812 -9.580 1.00 0.00 H new ATOM 0 HD23 LEU E 19 119.591 5.847 -8.693 1.00 0.00 H new ATOM 464 N PRO E 20 117.175 8.290 -5.268 1.00 0.00 N ATOM 465 CA PRO E 20 116.083 9.202 -4.787 1.00 0.00 C ATOM 466 C PRO E 20 115.303 9.800 -5.950 1.00 0.00 C ATOM 467 O PRO E 20 114.172 10.264 -5.786 1.00 0.00 O ATOM 468 CB PRO E 20 116.835 10.312 -4.038 1.00 0.00 C ATOM 469 CG PRO E 20 118.194 10.335 -4.651 1.00 0.00 C ATOM 470 CD PRO E 20 118.506 8.892 -5.047 1.00 0.00 C ATOM 0 HA PRO E 20 115.354 8.676 -4.170 1.00 0.00 H new ATOM 0 HB2 PRO E 20 116.334 11.274 -4.150 1.00 0.00 H new ATOM 0 HB3 PRO E 20 116.887 10.103 -2.970 1.00 0.00 H new ATOM 0 HG2 PRO E 20 118.218 10.991 -5.521 1.00 0.00 H new ATOM 0 HG3 PRO E 20 118.933 10.714 -3.945 1.00 0.00 H new ATOM 0 HD2 PRO E 20 119.119 8.848 -5.947 1.00 0.00 H new ATOM 0 HD3 PRO E 20 119.055 8.372 -4.262 1.00 0.00 H new ATOM 478 N ASN E 21 115.946 9.809 -7.116 1.00 0.00 N ATOM 479 CA ASN E 21 115.364 10.379 -8.324 1.00 0.00 C ATOM 480 C ASN E 21 114.456 9.389 -9.054 1.00 0.00 C ATOM 481 O ASN E 21 113.793 9.770 -10.020 1.00 0.00 O ATOM 482 CB ASN E 21 116.500 10.818 -9.256 1.00 0.00 C ATOM 483 CG ASN E 21 117.397 11.847 -8.559 1.00 0.00 C ATOM 484 OD1 ASN E 21 116.949 12.571 -7.669 1.00 0.00 O ATOM 485 ND2 ASN E 21 118.648 11.954 -8.913 1.00 0.00 N ATOM 0 H ASN E 21 116.881 9.423 -7.247 1.00 0.00 H new ATOM 0 HA ASN E 21 114.747 11.229 -8.035 1.00 0.00 H new ATOM 0 HB2 ASN E 21 117.092 9.952 -9.551 1.00 0.00 H new ATOM 0 HB3 ASN E 21 116.085 11.247 -10.168 1.00 0.00 H new ATOM 0 HD21 ASN E 21 119.252 12.636 -8.453 1.00 0.00 H new ATOM 0 HD22 ASN E 21 119.023 11.356 -9.650 1.00 0.00 H new ATOM 492 N LEU E 22 114.421 8.127 -8.601 1.00 0.00 N ATOM 493 CA LEU E 22 113.581 7.120 -9.246 1.00 0.00 C ATOM 494 C LEU E 22 112.213 7.051 -8.581 1.00 0.00 C ATOM 495 O LEU E 22 112.092 7.197 -7.361 1.00 0.00 O ATOM 496 CB LEU E 22 114.267 5.751 -9.197 1.00 0.00 C ATOM 497 CG LEU E 22 115.182 5.572 -10.425 1.00 0.00 C ATOM 498 CD1 LEU E 22 116.245 6.685 -10.481 1.00 0.00 C ATOM 499 CD2 LEU E 22 115.864 4.196 -10.350 1.00 0.00 C ATOM 0 H LEU E 22 114.957 7.788 -7.803 1.00 0.00 H new ATOM 0 HA LEU E 22 113.439 7.406 -10.288 1.00 0.00 H new ATOM 0 HB2 LEU E 22 114.852 5.661 -8.282 1.00 0.00 H new ATOM 0 HB3 LEU E 22 113.517 4.960 -9.174 1.00 0.00 H new ATOM 0 HG LEU E 22 114.578 5.635 -11.330 1.00 0.00 H new ATOM 0 HD11 LEU E 22 116.879 6.539 -11.355 1.00 0.00 H new ATOM 0 HD12 LEU E 22 115.753 7.655 -10.548 1.00 0.00 H new ATOM 0 HD13 LEU E 22 116.856 6.650 -9.579 1.00 0.00 H new ATOM 0 HD21 LEU E 22 116.513 4.064 -11.216 1.00 0.00 H new ATOM 0 HD22 LEU E 22 116.459 4.134 -9.439 1.00 0.00 H new ATOM 0 HD23 LEU E 22 115.105 3.414 -10.342 1.00 0.00 H new ATOM 511 N ASN E 23 111.192 6.818 -9.404 1.00 0.00 N ATOM 512 CA ASN E 23 109.814 6.718 -8.911 1.00 0.00 C ATOM 513 C ASN E 23 109.542 5.289 -8.419 1.00 0.00 C ATOM 514 O ASN E 23 110.295 4.371 -8.755 1.00 0.00 O ATOM 515 CB ASN E 23 108.827 7.112 -10.024 1.00 0.00 C ATOM 516 CG ASN E 23 109.176 6.400 -11.325 1.00 0.00 C ATOM 517 OD1 ASN E 23 108.863 5.226 -11.486 1.00 0.00 O ATOM 518 ND2 ASN E 23 109.810 7.045 -12.266 1.00 0.00 N ATOM 0 H ASN E 23 111.289 6.695 -10.412 1.00 0.00 H new ATOM 0 HA ASN E 23 109.677 7.404 -8.075 1.00 0.00 H new ATOM 0 HB2 ASN E 23 107.811 6.856 -9.724 1.00 0.00 H new ATOM 0 HB3 ASN E 23 108.852 8.191 -10.175 1.00 0.00 H new ATOM 0 HD21 ASN E 23 110.046 6.572 -13.138 1.00 0.00 H new ATOM 0 HD22 ASN E 23 110.069 8.022 -12.129 1.00 0.00 H new ATOM 525 N PRO E 24 108.506 5.077 -7.622 1.00 0.00 N ATOM 526 CA PRO E 24 108.182 3.719 -7.079 1.00 0.00 C ATOM 527 C PRO E 24 108.096 2.656 -8.174 1.00 0.00 C ATOM 528 O PRO E 24 108.526 1.519 -7.968 1.00 0.00 O ATOM 529 CB PRO E 24 106.827 3.908 -6.383 1.00 0.00 C ATOM 530 CG PRO E 24 106.752 5.363 -6.055 1.00 0.00 C ATOM 531 CD PRO E 24 107.540 6.092 -7.144 1.00 0.00 C ATOM 0 HA PRO E 24 108.960 3.359 -6.406 1.00 0.00 H new ATOM 0 HB2 PRO E 24 106.005 3.609 -7.034 1.00 0.00 H new ATOM 0 HB3 PRO E 24 106.759 3.298 -5.482 1.00 0.00 H new ATOM 0 HG2 PRO E 24 105.717 5.703 -6.031 1.00 0.00 H new ATOM 0 HG3 PRO E 24 107.175 5.562 -5.070 1.00 0.00 H new ATOM 0 HD2 PRO E 24 106.888 6.434 -7.948 1.00 0.00 H new ATOM 0 HD3 PRO E 24 108.047 6.972 -6.749 1.00 0.00 H new ATOM 539 N ASP E 25 107.559 3.032 -9.339 1.00 0.00 N ATOM 540 CA ASP E 25 107.449 2.095 -10.458 1.00 0.00 C ATOM 541 C ASP E 25 108.845 1.665 -10.912 1.00 0.00 C ATOM 542 O ASP E 25 109.093 0.480 -11.146 1.00 0.00 O ATOM 543 CB ASP E 25 106.702 2.745 -11.631 1.00 0.00 C ATOM 544 CG ASP E 25 105.283 3.143 -11.208 1.00 0.00 C ATOM 545 OD1 ASP E 25 104.499 2.251 -10.919 1.00 0.00 O ATOM 546 OD2 ASP E 25 105.000 4.331 -11.183 1.00 0.00 O ATOM 0 H ASP E 25 107.198 3.967 -9.529 1.00 0.00 H new ATOM 0 HA ASP E 25 106.889 1.221 -10.127 1.00 0.00 H new ATOM 0 HB2 ASP E 25 107.246 3.625 -11.974 1.00 0.00 H new ATOM 0 HB3 ASP E 25 106.657 2.051 -12.470 1.00 0.00 H new ATOM 551 N GLN E 26 109.749 2.644 -11.025 1.00 0.00 N ATOM 552 CA GLN E 26 111.123 2.386 -11.441 1.00 0.00 C ATOM 553 C GLN E 26 111.882 1.570 -10.390 1.00 0.00 C ATOM 554 O GLN E 26 112.566 0.602 -10.735 1.00 0.00 O ATOM 555 CB GLN E 26 111.830 3.722 -11.693 1.00 0.00 C ATOM 556 CG GLN E 26 111.371 4.307 -13.040 1.00 0.00 C ATOM 557 CD GLN E 26 111.923 3.469 -14.191 1.00 0.00 C ATOM 558 OE1 GLN E 26 111.210 3.173 -15.149 1.00 0.00 O ATOM 559 NE2 GLN E 26 113.159 3.070 -14.147 1.00 0.00 N ATOM 0 H GLN E 26 109.548 3.625 -10.832 1.00 0.00 H new ATOM 0 HA GLN E 26 111.106 1.799 -12.359 1.00 0.00 H new ATOM 0 HB2 GLN E 26 111.606 4.421 -10.887 1.00 0.00 H new ATOM 0 HB3 GLN E 26 112.910 3.577 -11.698 1.00 0.00 H new ATOM 0 HG2 GLN E 26 110.282 4.328 -13.084 1.00 0.00 H new ATOM 0 HG3 GLN E 26 111.713 5.338 -13.133 1.00 0.00 H new ATOM 0 HE21 GLN E 26 113.747 3.318 -13.351 1.00 0.00 H new ATOM 0 HE22 GLN E 26 113.541 2.509 -14.908 1.00 0.00 H new ATOM 568 N LEU E 27 111.755 1.956 -9.110 1.00 0.00 N ATOM 569 CA LEU E 27 112.436 1.226 -8.037 1.00 0.00 C ATOM 570 C LEU E 27 111.904 -0.206 -7.964 1.00 0.00 C ATOM 571 O LEU E 27 112.677 -1.147 -7.782 1.00 0.00 O ATOM 572 CB LEU E 27 112.253 1.930 -6.681 1.00 0.00 C ATOM 573 CG LEU E 27 112.897 3.332 -6.706 1.00 0.00 C ATOM 574 CD1 LEU E 27 112.679 4.033 -5.355 1.00 0.00 C ATOM 575 CD2 LEU E 27 114.411 3.230 -6.972 1.00 0.00 C ATOM 0 H LEU E 27 111.199 2.753 -8.800 1.00 0.00 H new ATOM 0 HA LEU E 27 113.502 1.204 -8.262 1.00 0.00 H new ATOM 0 HB2 LEU E 27 111.191 2.016 -6.450 1.00 0.00 H new ATOM 0 HB3 LEU E 27 112.704 1.331 -5.890 1.00 0.00 H new ATOM 0 HG LEU E 27 112.428 3.906 -7.505 1.00 0.00 H new ATOM 0 HD11 LEU E 27 113.136 5.022 -5.380 1.00 0.00 H new ATOM 0 HD12 LEU E 27 111.610 4.132 -5.165 1.00 0.00 H new ATOM 0 HD13 LEU E 27 113.136 3.442 -4.561 1.00 0.00 H new ATOM 0 HD21 LEU E 27 114.846 4.229 -6.986 1.00 0.00 H new ATOM 0 HD22 LEU E 27 114.880 2.641 -6.184 1.00 0.00 H new ATOM 0 HD23 LEU E 27 114.580 2.748 -7.935 1.00 0.00 H new ATOM 587 N CYS E 28 110.584 -0.363 -8.133 1.00 0.00 N ATOM 588 CA CYS E 28 109.963 -1.691 -8.109 1.00 0.00 C ATOM 589 C CYS E 28 110.421 -2.505 -9.321 1.00 0.00 C ATOM 590 O CYS E 28 110.723 -3.695 -9.199 1.00 0.00 O ATOM 591 CB CYS E 28 108.434 -1.567 -8.117 1.00 0.00 C ATOM 592 SG CYS E 28 107.868 -0.948 -6.511 1.00 0.00 S ATOM 0 H CYS E 28 109.932 0.406 -8.286 1.00 0.00 H new ATOM 0 HA CYS E 28 110.270 -2.201 -7.196 1.00 0.00 H new ATOM 0 HB2 CYS E 28 108.118 -0.891 -8.911 1.00 0.00 H new ATOM 0 HB3 CYS E 28 107.981 -2.536 -8.325 1.00 0.00 H new ATOM 597 N ALA E 29 110.474 -1.842 -10.485 1.00 0.00 N ATOM 598 CA ALA E 29 110.903 -2.493 -11.727 1.00 0.00 C ATOM 599 C ALA E 29 112.338 -2.990 -11.586 1.00 0.00 C ATOM 600 O ALA E 29 112.660 -4.124 -11.953 1.00 0.00 O ATOM 601 CB ALA E 29 110.828 -1.490 -12.886 1.00 0.00 C ATOM 0 H ALA E 29 110.226 -0.858 -10.590 1.00 0.00 H new ATOM 0 HA ALA E 29 110.246 -3.339 -11.929 1.00 0.00 H new ATOM 0 HB1 ALA E 29 111.147 -1.975 -13.808 1.00 0.00 H new ATOM 0 HB2 ALA E 29 109.802 -1.138 -12.997 1.00 0.00 H new ATOM 0 HB3 ALA E 29 111.481 -0.643 -12.677 1.00 0.00 H new ATOM 607 N PHE E 30 113.181 -2.119 -11.041 1.00 0.00 N ATOM 608 CA PHE E 30 114.591 -2.426 -10.821 1.00 0.00 C ATOM 609 C PHE E 30 114.750 -3.521 -9.762 1.00 0.00 C ATOM 610 O PHE E 30 115.475 -4.490 -9.968 1.00 0.00 O ATOM 611 CB PHE E 30 115.296 -1.133 -10.377 1.00 0.00 C ATOM 612 CG PHE E 30 116.716 -1.403 -9.911 1.00 0.00 C ATOM 613 CD1 PHE E 30 117.652 -1.982 -10.779 1.00 0.00 C ATOM 614 CD2 PHE E 30 117.095 -1.052 -8.609 1.00 0.00 C ATOM 615 CE1 PHE E 30 118.963 -2.207 -10.339 1.00 0.00 C ATOM 616 CE2 PHE E 30 118.405 -1.280 -8.174 1.00 0.00 C ATOM 617 CZ PHE E 30 119.337 -1.855 -9.039 1.00 0.00 C ATOM 0 H PHE E 30 112.908 -1.183 -10.740 1.00 0.00 H new ATOM 0 HA PHE E 30 115.039 -2.799 -11.742 1.00 0.00 H new ATOM 0 HB2 PHE E 30 115.313 -0.424 -11.205 1.00 0.00 H new ATOM 0 HB3 PHE E 30 114.730 -0.668 -9.570 1.00 0.00 H new ATOM 0 HD1 PHE E 30 117.364 -2.254 -11.784 1.00 0.00 H new ATOM 0 HD2 PHE E 30 116.375 -0.605 -7.940 1.00 0.00 H new ATOM 0 HE1 PHE E 30 119.686 -2.653 -11.006 1.00 0.00 H new ATOM 0 HE2 PHE E 30 118.695 -1.011 -7.169 1.00 0.00 H new ATOM 0 HZ PHE E 30 120.349 -2.028 -8.703 1.00 0.00 H new ATOM 627 N ILE E 31 114.076 -3.332 -8.630 1.00 0.00 N ATOM 628 CA ILE E 31 114.139 -4.269 -7.503 1.00 0.00 C ATOM 629 C ILE E 31 113.712 -5.690 -7.873 1.00 0.00 C ATOM 630 O ILE E 31 114.324 -6.647 -7.396 1.00 0.00 O ATOM 631 CB ILE E 31 113.282 -3.702 -6.350 1.00 0.00 C ATOM 632 CG1 ILE E 31 114.102 -2.639 -5.621 1.00 0.00 C ATOM 633 CG2 ILE E 31 112.873 -4.780 -5.336 1.00 0.00 C ATOM 634 CD1 ILE E 31 113.207 -1.843 -4.671 1.00 0.00 C ATOM 0 H ILE E 31 113.471 -2.528 -8.465 1.00 0.00 H new ATOM 0 HA ILE E 31 115.179 -4.360 -7.190 1.00 0.00 H new ATOM 0 HB ILE E 31 112.370 -3.290 -6.782 1.00 0.00 H new ATOM 0 HG12 ILE E 31 114.909 -3.112 -5.062 1.00 0.00 H new ATOM 0 HG13 ILE E 31 114.566 -1.968 -6.344 1.00 0.00 H new ATOM 0 HG21 ILE E 31 112.272 -4.328 -4.547 1.00 0.00 H new ATOM 0 HG22 ILE E 31 112.290 -5.551 -5.840 1.00 0.00 H new ATOM 0 HG23 ILE E 31 113.766 -5.228 -4.901 1.00 0.00 H new ATOM 0 HD11 ILE E 31 113.802 -1.088 -4.157 1.00 0.00 H new ATOM 0 HD12 ILE E 31 112.415 -1.355 -5.240 1.00 0.00 H new ATOM 0 HD13 ILE E 31 112.764 -2.517 -3.938 1.00 0.00 H new ATOM 646 N HIS E 32 112.675 -5.839 -8.699 1.00 0.00 N ATOM 647 CA HIS E 32 112.215 -7.177 -9.076 1.00 0.00 C ATOM 648 C HIS E 32 113.292 -7.903 -9.874 1.00 0.00 C ATOM 649 O HIS E 32 113.646 -9.040 -9.565 1.00 0.00 O ATOM 650 CB HIS E 32 110.917 -7.090 -9.895 1.00 0.00 C ATOM 651 CG HIS E 32 109.733 -7.030 -8.963 1.00 0.00 C ATOM 652 ND1 HIS E 32 109.123 -5.837 -8.612 1.00 0.00 N ATOM 653 CD2 HIS E 32 109.043 -8.014 -8.298 1.00 0.00 C ATOM 654 CE1 HIS E 32 108.112 -6.130 -7.771 1.00 0.00 C ATOM 655 NE2 HIS E 32 108.021 -7.444 -7.545 1.00 0.00 N ATOM 0 H HIS E 32 112.148 -5.069 -9.112 1.00 0.00 H new ATOM 0 HA HIS E 32 112.014 -7.741 -8.165 1.00 0.00 H new ATOM 0 HB2 HIS E 32 110.936 -6.206 -10.532 1.00 0.00 H new ATOM 0 HB3 HIS E 32 110.831 -7.955 -10.553 1.00 0.00 H new ATOM 0 HD1 HIS E 32 109.390 -4.906 -8.932 1.00 0.00 H new ATOM 0 HD2 HIS E 32 109.261 -9.070 -8.351 1.00 0.00 H new ATOM 0 HE1 HIS E 32 107.455 -5.393 -7.333 1.00 0.00 H new ATOM 664 N SER E 33 113.808 -7.226 -10.894 1.00 0.00 N ATOM 665 CA SER E 33 114.849 -7.793 -11.747 1.00 0.00 C ATOM 666 C SER E 33 116.159 -7.988 -10.976 1.00 0.00 C ATOM 667 O SER E 33 116.825 -9.020 -11.113 1.00 0.00 O ATOM 668 CB SER E 33 115.072 -6.859 -12.936 1.00 0.00 C ATOM 669 OG SER E 33 115.974 -7.458 -13.860 1.00 0.00 O ATOM 0 H SER E 33 113.522 -6.281 -11.152 1.00 0.00 H new ATOM 0 HA SER E 33 114.525 -8.774 -12.095 1.00 0.00 H new ATOM 0 HB2 SER E 33 114.122 -6.648 -13.427 1.00 0.00 H new ATOM 0 HB3 SER E 33 115.471 -5.905 -12.591 1.00 0.00 H new ATOM 0 HG SER E 33 115.873 -7.034 -14.738 1.00 0.00 H new ATOM 675 N LEU E 34 116.510 -6.985 -10.175 1.00 0.00 N ATOM 676 CA LEU E 34 117.734 -7.008 -9.369 1.00 0.00 C ATOM 677 C LEU E 34 117.750 -8.219 -8.441 1.00 0.00 C ATOM 678 O LEU E 34 118.796 -8.841 -8.232 1.00 0.00 O ATOM 679 CB LEU E 34 117.795 -5.715 -8.542 1.00 0.00 C ATOM 680 CG LEU E 34 119.120 -5.622 -7.776 1.00 0.00 C ATOM 681 CD1 LEU E 34 120.291 -5.556 -8.773 1.00 0.00 C ATOM 682 CD2 LEU E 34 119.106 -4.363 -6.881 1.00 0.00 C ATOM 0 H LEU E 34 115.958 -6.135 -10.064 1.00 0.00 H new ATOM 0 HA LEU E 34 118.600 -7.078 -10.027 1.00 0.00 H new ATOM 0 HB2 LEU E 34 117.688 -4.852 -9.199 1.00 0.00 H new ATOM 0 HB3 LEU E 34 116.961 -5.687 -7.841 1.00 0.00 H new ATOM 0 HG LEU E 34 119.244 -6.504 -7.148 1.00 0.00 H new ATOM 0 HD11 LEU E 34 121.231 -5.490 -8.226 1.00 0.00 H new ATOM 0 HD12 LEU E 34 120.293 -6.454 -9.391 1.00 0.00 H new ATOM 0 HD13 LEU E 34 120.179 -4.678 -9.409 1.00 0.00 H new ATOM 0 HD21 LEU E 34 120.047 -4.294 -6.335 1.00 0.00 H new ATOM 0 HD22 LEU E 34 118.981 -3.476 -7.502 1.00 0.00 H new ATOM 0 HD23 LEU E 34 118.280 -4.429 -6.173 1.00 0.00 H new ATOM 694 N HIS E 35 116.582 -8.533 -7.884 1.00 0.00 N ATOM 695 CA HIS E 35 116.439 -9.659 -6.962 1.00 0.00 C ATOM 696 C HIS E 35 116.285 -10.992 -7.706 1.00 0.00 C ATOM 697 O HIS E 35 116.937 -11.979 -7.353 1.00 0.00 O ATOM 698 CB HIS E 35 115.218 -9.407 -6.068 1.00 0.00 C ATOM 699 CG HIS E 35 115.648 -8.678 -4.819 1.00 0.00 C ATOM 700 ND1 HIS E 35 115.891 -9.338 -3.624 1.00 0.00 N ATOM 701 CD2 HIS E 35 115.889 -7.350 -4.568 1.00 0.00 C ATOM 702 CE1 HIS E 35 116.259 -8.414 -2.717 1.00 0.00 C ATOM 703 NE2 HIS E 35 116.274 -7.186 -3.240 1.00 0.00 N ATOM 0 H HIS E 35 115.717 -8.021 -8.056 1.00 0.00 H new ATOM 0 HA HIS E 35 117.344 -9.733 -6.358 1.00 0.00 H new ATOM 0 HB2 HIS E 35 114.475 -8.819 -6.607 1.00 0.00 H new ATOM 0 HB3 HIS E 35 114.746 -10.353 -5.805 1.00 0.00 H new ATOM 0 HD2 HIS E 35 115.794 -6.553 -5.291 1.00 0.00 H new ATOM 0 HE1 HIS E 35 116.511 -8.639 -1.691 1.00 0.00 H new ATOM 0 HE2 HIS E 35 116.516 -6.315 -2.768 1.00 0.00 H new ATOM 712 N ASP E 36 115.407 -11.018 -8.715 1.00 0.00 N ATOM 713 CA ASP E 36 115.155 -12.242 -9.491 1.00 0.00 C ATOM 714 C ASP E 36 116.422 -12.759 -10.182 1.00 0.00 C ATOM 715 O ASP E 36 116.611 -13.974 -10.288 1.00 0.00 O ATOM 716 CB ASP E 36 114.060 -11.992 -10.547 1.00 0.00 C ATOM 717 CG ASP E 36 112.682 -11.741 -9.901 1.00 0.00 C ATOM 718 OD1 ASP E 36 112.454 -12.195 -8.786 1.00 0.00 O ATOM 719 OD2 ASP E 36 111.861 -11.108 -10.548 1.00 0.00 O ATOM 0 H ASP E 36 114.860 -10.210 -9.014 1.00 0.00 H new ATOM 0 HA ASP E 36 114.822 -13.004 -8.786 1.00 0.00 H new ATOM 0 HB2 ASP E 36 114.336 -11.133 -11.159 1.00 0.00 H new ATOM 0 HB3 ASP E 36 113.997 -12.852 -11.214 1.00 0.00 H new ATOM 724 N ASP E 37 117.275 -11.840 -10.661 1.00 0.00 N ATOM 725 CA ASP E 37 118.514 -12.225 -11.353 1.00 0.00 C ATOM 726 C ASP E 37 119.733 -11.504 -10.747 1.00 0.00 C ATOM 727 O ASP E 37 120.221 -10.510 -11.299 1.00 0.00 O ATOM 728 CB ASP E 37 118.390 -11.903 -12.853 1.00 0.00 C ATOM 729 CG ASP E 37 119.414 -12.703 -13.665 1.00 0.00 C ATOM 730 OD1 ASP E 37 120.597 -12.568 -13.395 1.00 0.00 O ATOM 731 OD2 ASP E 37 119.002 -13.431 -14.555 1.00 0.00 O ATOM 0 H ASP E 37 117.131 -10.833 -10.583 1.00 0.00 H new ATOM 0 HA ASP E 37 118.665 -13.297 -11.227 1.00 0.00 H new ATOM 0 HB2 ASP E 37 117.383 -12.136 -13.198 1.00 0.00 H new ATOM 0 HB3 ASP E 37 118.543 -10.836 -13.015 1.00 0.00 H new ATOM 736 N PRO E 38 120.237 -11.988 -9.631 1.00 0.00 N ATOM 737 CA PRO E 38 121.422 -11.375 -8.956 1.00 0.00 C ATOM 738 C PRO E 38 122.674 -11.407 -9.840 1.00 0.00 C ATOM 739 O PRO E 38 123.562 -10.568 -9.690 1.00 0.00 O ATOM 740 CB PRO E 38 121.618 -12.213 -7.682 1.00 0.00 C ATOM 741 CG PRO E 38 120.363 -13.007 -7.508 1.00 0.00 C ATOM 742 CD PRO E 38 119.741 -13.160 -8.894 1.00 0.00 C ATOM 0 HA PRO E 38 121.258 -10.319 -8.740 1.00 0.00 H new ATOM 0 HB2 PRO E 38 122.484 -12.869 -7.777 1.00 0.00 H new ATOM 0 HB3 PRO E 38 121.796 -11.572 -6.818 1.00 0.00 H new ATOM 0 HG2 PRO E 38 120.580 -13.982 -7.072 1.00 0.00 H new ATOM 0 HG3 PRO E 38 119.676 -12.500 -6.830 1.00 0.00 H new ATOM 0 HD2 PRO E 38 120.048 -14.091 -9.370 1.00 0.00 H new ATOM 0 HD3 PRO E 38 118.652 -13.171 -8.845 1.00 0.00 H new ATOM 750 N SER E 39 122.737 -12.380 -10.757 1.00 0.00 N ATOM 751 CA SER E 39 123.889 -12.505 -11.657 1.00 0.00 C ATOM 752 C SER E 39 124.032 -11.246 -12.518 1.00 0.00 C ATOM 753 O SER E 39 125.147 -10.781 -12.770 1.00 0.00 O ATOM 754 CB SER E 39 123.730 -13.736 -12.558 1.00 0.00 C ATOM 755 OG SER E 39 123.496 -14.884 -11.751 1.00 0.00 O ATOM 0 H SER E 39 122.013 -13.085 -10.895 1.00 0.00 H new ATOM 0 HA SER E 39 124.788 -12.623 -11.051 1.00 0.00 H new ATOM 0 HB2 SER E 39 122.901 -13.589 -13.250 1.00 0.00 H new ATOM 0 HB3 SER E 39 124.627 -13.878 -13.161 1.00 0.00 H new ATOM 0 HG SER E 39 123.392 -15.672 -12.325 1.00 0.00 H new ATOM 761 N GLN E 40 122.889 -10.699 -12.952 1.00 0.00 N ATOM 762 CA GLN E 40 122.866 -9.484 -13.776 1.00 0.00 C ATOM 763 C GLN E 40 122.734 -8.229 -12.906 1.00 0.00 C ATOM 764 O GLN E 40 122.461 -7.147 -13.422 1.00 0.00 O ATOM 765 CB GLN E 40 121.680 -9.537 -14.756 1.00 0.00 C ATOM 766 CG GLN E 40 121.880 -10.665 -15.769 1.00 0.00 C ATOM 767 CD GLN E 40 120.749 -10.659 -16.796 1.00 0.00 C ATOM 768 OE1 GLN E 40 120.733 -9.822 -17.698 1.00 0.00 O ATOM 769 NE2 GLN E 40 119.798 -11.549 -16.715 1.00 0.00 N ATOM 0 H GLN E 40 121.966 -11.080 -12.745 1.00 0.00 H new ATOM 0 HA GLN E 40 123.806 -9.436 -14.326 1.00 0.00 H new ATOM 0 HB2 GLN E 40 120.752 -9.693 -14.206 1.00 0.00 H new ATOM 0 HB3 GLN E 40 121.586 -8.584 -15.276 1.00 0.00 H new ATOM 0 HG2 GLN E 40 122.839 -10.545 -16.273 1.00 0.00 H new ATOM 0 HG3 GLN E 40 121.908 -11.625 -15.254 1.00 0.00 H new ATOM 0 HE21 GLN E 40 119.811 -12.243 -15.967 1.00 0.00 H new ATOM 0 HE22 GLN E 40 119.042 -11.551 -17.399 1.00 0.00 H new ATOM 778 N SER E 41 122.905 -8.377 -11.589 1.00 0.00 N ATOM 779 CA SER E 41 122.765 -7.244 -10.665 1.00 0.00 C ATOM 780 C SER E 41 123.650 -6.056 -11.052 1.00 0.00 C ATOM 781 O SER E 41 123.207 -4.907 -10.981 1.00 0.00 O ATOM 782 CB SER E 41 123.108 -7.684 -9.244 1.00 0.00 C ATOM 783 OG SER E 41 124.462 -8.119 -9.190 1.00 0.00 O ATOM 0 H SER E 41 123.139 -9.262 -11.140 1.00 0.00 H new ATOM 0 HA SER E 41 121.727 -6.916 -10.722 1.00 0.00 H new ATOM 0 HB2 SER E 41 122.953 -6.858 -8.550 1.00 0.00 H new ATOM 0 HB3 SER E 41 122.444 -8.490 -8.933 1.00 0.00 H new ATOM 0 HG SER E 41 124.502 -9.085 -9.349 1.00 0.00 H new ATOM 789 N ALA E 42 124.888 -6.335 -11.458 1.00 0.00 N ATOM 790 CA ALA E 42 125.810 -5.268 -11.845 1.00 0.00 C ATOM 791 C ALA E 42 125.321 -4.569 -13.114 1.00 0.00 C ATOM 792 O ALA E 42 125.278 -3.337 -13.173 1.00 0.00 O ATOM 793 CB ALA E 42 127.211 -5.841 -12.073 1.00 0.00 C ATOM 0 H ALA E 42 125.272 -7.277 -11.527 1.00 0.00 H new ATOM 0 HA ALA E 42 125.850 -4.537 -11.038 1.00 0.00 H new ATOM 0 HB1 ALA E 42 127.890 -5.038 -12.361 1.00 0.00 H new ATOM 0 HB2 ALA E 42 127.568 -6.306 -11.154 1.00 0.00 H new ATOM 0 HB3 ALA E 42 127.174 -6.587 -12.867 1.00 0.00 H new ATOM 799 N ASN E 43 124.948 -5.362 -14.122 1.00 0.00 N ATOM 800 CA ASN E 43 124.460 -4.804 -15.383 1.00 0.00 C ATOM 801 C ASN E 43 123.162 -4.032 -15.169 1.00 0.00 C ATOM 802 O ASN E 43 123.046 -2.883 -15.597 1.00 0.00 O ATOM 803 CB ASN E 43 124.226 -5.927 -16.401 1.00 0.00 C ATOM 804 CG ASN E 43 125.561 -6.513 -16.850 1.00 0.00 C ATOM 805 OD1 ASN E 43 125.827 -7.696 -16.641 1.00 0.00 O ATOM 806 ND2 ASN E 43 126.420 -5.747 -17.463 1.00 0.00 N ATOM 0 H ASN E 43 124.974 -6.381 -14.090 1.00 0.00 H new ATOM 0 HA ASN E 43 125.216 -4.118 -15.765 1.00 0.00 H new ATOM 0 HB2 ASN E 43 123.608 -6.708 -15.958 1.00 0.00 H new ATOM 0 HB3 ASN E 43 123.682 -5.540 -17.262 1.00 0.00 H new ATOM 0 HD21 ASN E 43 127.315 -6.128 -17.770 1.00 0.00 H new ATOM 0 HD22 ASN E 43 126.197 -4.767 -17.635 1.00 0.00 H new ATOM 813 N LEU E 44 122.196 -4.677 -14.498 1.00 0.00 N ATOM 814 CA LEU E 44 120.889 -4.067 -14.216 1.00 0.00 C ATOM 815 C LEU E 44 121.049 -2.756 -13.463 1.00 0.00 C ATOM 816 O LEU E 44 120.433 -1.744 -13.813 1.00 0.00 O ATOM 817 CB LEU E 44 120.042 -5.020 -13.363 1.00 0.00 C ATOM 818 CG LEU E 44 119.695 -6.285 -14.162 1.00 0.00 C ATOM 819 CD1 LEU E 44 119.236 -7.387 -13.196 1.00 0.00 C ATOM 820 CD2 LEU E 44 118.570 -5.971 -15.159 1.00 0.00 C ATOM 0 H LEU E 44 122.297 -5.626 -14.139 1.00 0.00 H new ATOM 0 HA LEU E 44 120.398 -3.874 -15.170 1.00 0.00 H new ATOM 0 HB2 LEU E 44 120.587 -5.291 -12.459 1.00 0.00 H new ATOM 0 HB3 LEU E 44 119.127 -4.519 -13.046 1.00 0.00 H new ATOM 0 HG LEU E 44 120.575 -6.624 -14.708 1.00 0.00 H new ATOM 0 HD11 LEU E 44 118.989 -8.286 -13.761 1.00 0.00 H new ATOM 0 HD12 LEU E 44 120.037 -7.610 -12.491 1.00 0.00 H new ATOM 0 HD13 LEU E 44 118.356 -7.048 -12.650 1.00 0.00 H new ATOM 0 HD21 LEU E 44 118.325 -6.869 -15.725 1.00 0.00 H new ATOM 0 HD22 LEU E 44 117.687 -5.632 -14.617 1.00 0.00 H new ATOM 0 HD23 LEU E 44 118.898 -5.189 -15.844 1.00 0.00 H new ATOM 832 N LEU E 45 121.888 -2.787 -12.433 1.00 0.00 N ATOM 833 CA LEU E 45 122.145 -1.602 -11.630 1.00 0.00 C ATOM 834 C LEU E 45 122.789 -0.518 -12.480 1.00 0.00 C ATOM 835 O LEU E 45 122.490 0.663 -12.305 1.00 0.00 O ATOM 836 CB LEU E 45 123.027 -1.974 -10.433 1.00 0.00 C ATOM 837 CG LEU E 45 123.505 -0.719 -9.683 1.00 0.00 C ATOM 838 CD1 LEU E 45 122.323 0.229 -9.351 1.00 0.00 C ATOM 839 CD2 LEU E 45 124.213 -1.158 -8.389 1.00 0.00 C ATOM 0 H LEU E 45 122.399 -3.618 -12.137 1.00 0.00 H new ATOM 0 HA LEU E 45 121.202 -1.207 -11.251 1.00 0.00 H new ATOM 0 HB2 LEU E 45 122.469 -2.617 -9.753 1.00 0.00 H new ATOM 0 HB3 LEU E 45 123.889 -2.546 -10.777 1.00 0.00 H new ATOM 0 HG LEU E 45 124.195 -0.167 -10.322 1.00 0.00 H new ATOM 0 HD11 LEU E 45 122.697 1.105 -8.821 1.00 0.00 H new ATOM 0 HD12 LEU E 45 121.838 0.543 -10.275 1.00 0.00 H new ATOM 0 HD13 LEU E 45 121.602 -0.294 -8.723 1.00 0.00 H new ATOM 0 HD21 LEU E 45 124.558 -0.278 -7.846 1.00 0.00 H new ATOM 0 HD22 LEU E 45 123.517 -1.719 -7.766 1.00 0.00 H new ATOM 0 HD23 LEU E 45 125.067 -1.788 -8.637 1.00 0.00 H new ATOM 851 N ALA E 46 123.644 -0.920 -13.422 1.00 0.00 N ATOM 852 CA ALA E 46 124.283 0.047 -14.308 1.00 0.00 C ATOM 853 C ALA E 46 123.197 0.854 -15.017 1.00 0.00 C ATOM 854 O ALA E 46 123.342 2.057 -15.228 1.00 0.00 O ATOM 855 CB ALA E 46 125.159 -0.673 -15.343 1.00 0.00 C ATOM 0 H ALA E 46 123.905 -1.892 -13.588 1.00 0.00 H new ATOM 0 HA ALA E 46 124.920 0.711 -13.724 1.00 0.00 H new ATOM 0 HB1 ALA E 46 125.629 0.062 -15.996 1.00 0.00 H new ATOM 0 HB2 ALA E 46 125.930 -1.248 -14.830 1.00 0.00 H new ATOM 0 HB3 ALA E 46 124.541 -1.345 -15.938 1.00 0.00 H new ATOM 861 N GLU E 47 122.097 0.168 -15.346 1.00 0.00 N ATOM 862 CA GLU E 47 120.955 0.801 -16.007 1.00 0.00 C ATOM 863 C GLU E 47 120.208 1.683 -15.030 1.00 0.00 C ATOM 864 O GLU E 47 119.729 2.757 -15.389 1.00 0.00 O ATOM 865 CB GLU E 47 119.974 -0.255 -16.522 1.00 0.00 C ATOM 866 CG GLU E 47 120.744 -1.464 -17.035 1.00 0.00 C ATOM 867 CD GLU E 47 119.884 -2.321 -17.976 1.00 0.00 C ATOM 868 OE1 GLU E 47 119.371 -1.782 -18.947 1.00 0.00 O ATOM 869 OE2 GLU E 47 119.767 -3.510 -17.724 1.00 0.00 O ATOM 0 H GLU E 47 121.975 -0.828 -15.164 1.00 0.00 H new ATOM 0 HA GLU E 47 121.342 1.391 -16.838 1.00 0.00 H new ATOM 0 HB2 GLU E 47 119.296 -0.556 -15.723 1.00 0.00 H new ATOM 0 HB3 GLU E 47 119.361 0.163 -17.320 1.00 0.00 H new ATOM 0 HG2 GLU E 47 121.639 -1.131 -17.561 1.00 0.00 H new ATOM 0 HG3 GLU E 47 121.077 -2.069 -16.192 1.00 0.00 H new ATOM 876 N ALA E 48 120.105 1.224 -13.780 1.00 0.00 N ATOM 877 CA ALA E 48 119.404 1.991 -12.773 1.00 0.00 C ATOM 878 C ALA E 48 120.187 3.257 -12.477 1.00 0.00 C ATOM 879 O ALA E 48 119.610 4.309 -12.194 1.00 0.00 O ATOM 880 CB ALA E 48 119.182 1.177 -11.503 1.00 0.00 C ATOM 0 H ALA E 48 120.494 0.339 -13.454 1.00 0.00 H new ATOM 0 HA ALA E 48 118.418 2.256 -13.156 1.00 0.00 H new ATOM 0 HB1 ALA E 48 118.653 1.785 -10.769 1.00 0.00 H new ATOM 0 HB2 ALA E 48 118.589 0.293 -11.737 1.00 0.00 H new ATOM 0 HB3 ALA E 48 120.145 0.871 -11.094 1.00 0.00 H new ATOM 886 N LYS E 49 121.515 3.151 -12.591 1.00 0.00 N ATOM 887 CA LYS E 49 122.375 4.300 -12.385 1.00 0.00 C ATOM 888 C LYS E 49 122.107 5.292 -13.514 1.00 0.00 C ATOM 889 O LYS E 49 121.997 6.497 -13.282 1.00 0.00 O ATOM 890 CB LYS E 49 123.856 3.888 -12.346 1.00 0.00 C ATOM 891 CG LYS E 49 124.488 4.311 -11.003 1.00 0.00 C ATOM 892 CD LYS E 49 124.130 3.292 -9.917 1.00 0.00 C ATOM 893 CE LYS E 49 125.143 2.144 -9.908 1.00 0.00 C ATOM 894 NZ LYS E 49 126.502 2.667 -9.576 1.00 0.00 N ATOM 0 H LYS E 49 122.005 2.287 -12.823 1.00 0.00 H new ATOM 0 HA LYS E 49 122.156 4.762 -11.422 1.00 0.00 H new ATOM 0 HB2 LYS E 49 123.945 2.809 -12.475 1.00 0.00 H new ATOM 0 HB3 LYS E 49 124.393 4.354 -13.172 1.00 0.00 H new ATOM 0 HG2 LYS E 49 125.571 4.381 -11.106 1.00 0.00 H new ATOM 0 HG3 LYS E 49 124.131 5.301 -10.718 1.00 0.00 H new ATOM 0 HD2 LYS E 49 124.115 3.780 -8.942 1.00 0.00 H new ATOM 0 HD3 LYS E 49 123.128 2.900 -10.093 1.00 0.00 H new ATOM 0 HE2 LYS E 49 124.846 1.391 -9.178 1.00 0.00 H new ATOM 0 HE3 LYS E 49 125.160 1.655 -10.882 1.00 0.00 H new ATOM 0 HZ1 LYS E 49 126.986 1.999 -8.942 1.00 0.00 H new ATOM 0 HZ2 LYS E 49 127.055 2.777 -10.450 1.00 0.00 H new ATOM 0 HZ3 LYS E 49 126.413 3.590 -9.104 1.00 0.00 H new ATOM 908 N LYS E 50 121.934 4.758 -14.736 1.00 0.00 N ATOM 909 CA LYS E 50 121.592 5.595 -15.885 1.00 0.00 C ATOM 910 C LYS E 50 120.238 6.245 -15.603 1.00 0.00 C ATOM 911 O LYS E 50 120.016 7.406 -15.939 1.00 0.00 O ATOM 912 CB LYS E 50 121.525 4.763 -17.179 1.00 0.00 C ATOM 913 CG LYS E 50 122.931 4.308 -17.589 1.00 0.00 C ATOM 914 CD LYS E 50 122.850 3.486 -18.885 1.00 0.00 C ATOM 915 CE LYS E 50 124.182 2.771 -19.136 1.00 0.00 C ATOM 916 NZ LYS E 50 125.248 3.779 -19.405 1.00 0.00 N ATOM 0 H LYS E 50 122.025 3.764 -14.946 1.00 0.00 H new ATOM 0 HA LYS E 50 122.361 6.354 -16.029 1.00 0.00 H new ATOM 0 HB2 LYS E 50 120.883 3.895 -17.029 1.00 0.00 H new ATOM 0 HB3 LYS E 50 121.079 5.355 -17.978 1.00 0.00 H new ATOM 0 HG2 LYS E 50 123.576 5.174 -17.736 1.00 0.00 H new ATOM 0 HG3 LYS E 50 123.377 3.710 -16.794 1.00 0.00 H new ATOM 0 HD2 LYS E 50 122.044 2.756 -18.813 1.00 0.00 H new ATOM 0 HD3 LYS E 50 122.614 4.139 -19.725 1.00 0.00 H new ATOM 0 HE2 LYS E 50 124.450 2.166 -18.270 1.00 0.00 H new ATOM 0 HE3 LYS E 50 124.088 2.092 -19.983 1.00 0.00 H new ATOM 0 HZ1 LYS E 50 126.122 3.293 -19.691 1.00 0.00 H new ATOM 0 HZ2 LYS E 50 124.940 4.415 -20.168 1.00 0.00 H new ATOM 0 HZ3 LYS E 50 125.427 4.333 -18.543 1.00 0.00 H new ATOM 930 N LEU E 51 119.358 5.481 -14.934 1.00 0.00 N ATOM 931 CA LEU E 51 118.037 5.977 -14.543 1.00 0.00 C ATOM 932 C LEU E 51 118.208 7.103 -13.532 1.00 0.00 C ATOM 933 O LEU E 51 117.483 8.100 -13.573 1.00 0.00 O ATOM 934 CB LEU E 51 117.214 4.848 -13.899 1.00 0.00 C ATOM 935 CG LEU E 51 116.097 4.324 -14.822 1.00 0.00 C ATOM 936 CD1 LEU E 51 114.919 5.315 -14.846 1.00 0.00 C ATOM 937 CD2 LEU E 51 116.618 4.083 -16.253 1.00 0.00 C ATOM 0 H LEU E 51 119.542 4.517 -14.655 1.00 0.00 H new ATOM 0 HA LEU E 51 117.516 6.339 -15.429 1.00 0.00 H new ATOM 0 HB2 LEU E 51 117.878 4.025 -13.636 1.00 0.00 H new ATOM 0 HB3 LEU E 51 116.772 5.210 -12.971 1.00 0.00 H new ATOM 0 HG LEU E 51 115.753 3.369 -14.424 1.00 0.00 H new ATOM 0 HD11 LEU E 51 114.136 4.934 -15.502 1.00 0.00 H new ATOM 0 HD12 LEU E 51 114.522 5.433 -13.838 1.00 0.00 H new ATOM 0 HD13 LEU E 51 115.263 6.281 -15.216 1.00 0.00 H new ATOM 0 HD21 LEU E 51 115.805 3.714 -16.879 1.00 0.00 H new ATOM 0 HD22 LEU E 51 116.997 5.019 -16.665 1.00 0.00 H new ATOM 0 HD23 LEU E 51 117.421 3.346 -16.229 1.00 0.00 H new ATOM 949 N ASN E 52 119.188 6.931 -12.627 1.00 0.00 N ATOM 950 CA ASN E 52 119.480 7.935 -11.603 1.00 0.00 C ATOM 951 C ASN E 52 119.737 9.277 -12.291 1.00 0.00 C ATOM 952 O ASN E 52 119.262 10.325 -11.842 1.00 0.00 O ATOM 953 CB ASN E 52 120.706 7.503 -10.765 1.00 0.00 C ATOM 954 CG ASN E 52 120.813 8.368 -9.507 1.00 0.00 C ATOM 955 OD1 ASN E 52 119.906 8.377 -8.676 1.00 0.00 O ATOM 956 ND2 ASN E 52 121.876 9.100 -9.318 1.00 0.00 N ATOM 0 H ASN E 52 119.787 6.106 -12.589 1.00 0.00 H new ATOM 0 HA ASN E 52 118.632 8.033 -10.926 1.00 0.00 H new ATOM 0 HB2 ASN E 52 120.615 6.453 -10.487 1.00 0.00 H new ATOM 0 HB3 ASN E 52 121.615 7.598 -11.360 1.00 0.00 H new ATOM 0 HD21 ASN E 52 121.954 9.679 -8.482 1.00 0.00 H new ATOM 0 HD22 ASN E 52 122.629 9.093 -10.006 1.00 0.00 H new ATOM 963 N ASP E 53 120.459 9.208 -13.415 1.00 0.00 N ATOM 964 CA ASP E 53 120.760 10.387 -14.227 1.00 0.00 C ATOM 965 C ASP E 53 119.561 10.749 -15.123 1.00 0.00 C ATOM 966 O ASP E 53 119.346 11.919 -15.449 1.00 0.00 O ATOM 967 CB ASP E 53 121.992 10.114 -15.100 1.00 0.00 C ATOM 968 CG ASP E 53 122.403 11.385 -15.846 1.00 0.00 C ATOM 969 OD1 ASP E 53 123.106 12.193 -15.260 1.00 0.00 O ATOM 970 OD2 ASP E 53 122.005 11.536 -16.991 1.00 0.00 O ATOM 0 H ASP E 53 120.847 8.340 -13.783 1.00 0.00 H new ATOM 0 HA ASP E 53 120.963 11.225 -13.560 1.00 0.00 H new ATOM 0 HB2 ASP E 53 122.817 9.765 -14.479 1.00 0.00 H new ATOM 0 HB3 ASP E 53 121.772 9.320 -15.813 1.00 0.00 H new ATOM 975 N ALA E 54 118.807 9.722 -15.536 1.00 0.00 N ATOM 976 CA ALA E 54 117.643 9.900 -16.415 1.00 0.00 C ATOM 977 C ALA E 54 116.519 10.680 -15.730 1.00 0.00 C ATOM 978 O ALA E 54 115.758 11.386 -16.397 1.00 0.00 O ATOM 979 CB ALA E 54 117.103 8.529 -16.854 1.00 0.00 C ATOM 0 H ALA E 54 118.984 8.752 -15.273 1.00 0.00 H new ATOM 0 HA ALA E 54 117.977 10.472 -17.280 1.00 0.00 H new ATOM 0 HB1 ALA E 54 116.240 8.669 -17.505 1.00 0.00 H new ATOM 0 HB2 ALA E 54 117.880 7.987 -17.393 1.00 0.00 H new ATOM 0 HB3 ALA E 54 116.805 7.957 -15.975 1.00 0.00 H new ATOM 985 N GLN E 55 116.415 10.536 -14.403 1.00 0.00 N ATOM 986 CA GLN E 55 115.369 11.219 -13.628 1.00 0.00 C ATOM 987 C GLN E 55 115.983 12.208 -12.641 1.00 0.00 C ATOM 988 O GLN E 55 115.285 12.787 -11.802 1.00 0.00 O ATOM 989 CB GLN E 55 114.502 10.189 -12.895 1.00 0.00 C ATOM 990 CG GLN E 55 113.902 9.219 -13.926 1.00 0.00 C ATOM 991 CD GLN E 55 112.742 8.402 -13.340 1.00 0.00 C ATOM 992 OE1 GLN E 55 112.133 7.604 -14.052 1.00 0.00 O ATOM 993 NE2 GLN E 55 112.388 8.551 -12.091 1.00 0.00 N ATOM 0 H GLN E 55 117.040 9.955 -13.844 1.00 0.00 H new ATOM 0 HA GLN E 55 114.738 11.781 -14.316 1.00 0.00 H new ATOM 0 HB2 GLN E 55 115.101 9.642 -12.167 1.00 0.00 H new ATOM 0 HB3 GLN E 55 113.708 10.690 -12.342 1.00 0.00 H new ATOM 0 HG2 GLN E 55 113.549 9.781 -14.790 1.00 0.00 H new ATOM 0 HG3 GLN E 55 114.679 8.542 -14.282 1.00 0.00 H new ATOM 0 HE21 GLN E 55 112.888 9.210 -11.494 1.00 0.00 H new ATOM 0 HE22 GLN E 55 111.612 8.008 -11.713 1.00 0.00 H new ATOM 1002 N ALA E 56 117.296 12.382 -12.760 1.00 0.00 N ATOM 1003 CA ALA E 56 118.056 13.270 -11.910 1.00 0.00 C ATOM 1004 C ALA E 56 117.508 14.696 -11.933 1.00 0.00 C ATOM 1005 O ALA E 56 116.771 15.086 -12.845 1.00 0.00 O ATOM 1006 CB ALA E 56 119.519 13.259 -12.362 1.00 0.00 C ATOM 0 H ALA E 56 117.861 11.901 -13.460 1.00 0.00 H new ATOM 0 HA ALA E 56 117.975 12.914 -10.883 1.00 0.00 H new ATOM 0 HB1 ALA E 56 120.101 13.926 -11.727 1.00 0.00 H new ATOM 0 HB2 ALA E 56 119.916 12.247 -12.285 1.00 0.00 H new ATOM 0 HB3 ALA E 56 119.583 13.596 -13.397 1.00 0.00 H new TER 1012 ALA E 56 ATOM 1013 N GLY F 14 118.562 10.705 10.023 1.00 0.00 N ATOM 1014 CA GLY F 14 119.923 10.169 10.006 1.00 0.00 C ATOM 1015 C GLY F 14 119.945 8.690 10.333 1.00 0.00 C ATOM 1016 O GLY F 14 121.018 8.088 10.419 1.00 0.00 O ATOM 0 HA2 GLY F 14 120.366 10.331 9.023 1.00 0.00 H new ATOM 0 HA3 GLY F 14 120.537 10.710 10.726 1.00 0.00 H new ATOM 1020 N GLU F 15 118.762 8.110 10.509 1.00 0.00 N ATOM 1021 CA GLU F 15 118.659 6.703 10.823 1.00 0.00 C ATOM 1022 C GLU F 15 118.513 5.904 9.545 1.00 0.00 C ATOM 1023 O GLU F 15 117.753 6.279 8.652 1.00 0.00 O ATOM 1024 CB GLU F 15 117.452 6.449 11.711 1.00 0.00 C ATOM 1025 CG GLU F 15 117.655 5.129 12.439 1.00 0.00 C ATOM 1026 CD GLU F 15 116.455 4.819 13.335 1.00 0.00 C ATOM 1027 OE1 GLU F 15 116.257 5.543 14.299 1.00 0.00 O ATOM 1028 OE2 GLU F 15 115.750 3.863 13.048 1.00 0.00 O ATOM 0 H GLU F 15 117.868 8.597 10.438 1.00 0.00 H new ATOM 0 HA GLU F 15 119.563 6.396 11.349 1.00 0.00 H new ATOM 0 HB2 GLU F 15 117.332 7.262 12.427 1.00 0.00 H new ATOM 0 HB3 GLU F 15 116.542 6.415 11.112 1.00 0.00 H new ATOM 0 HG2 GLU F 15 117.793 4.326 11.715 1.00 0.00 H new ATOM 0 HG3 GLU F 15 118.563 5.175 13.041 1.00 0.00 H new ATOM 1035 N ILE F 16 119.246 4.804 9.471 1.00 0.00 N ATOM 1036 CA ILE F 16 119.214 3.938 8.304 1.00 0.00 C ATOM 1037 C ILE F 16 118.663 2.563 8.670 1.00 0.00 C ATOM 1038 O ILE F 16 118.887 2.059 9.775 1.00 0.00 O ATOM 1039 CB ILE F 16 120.624 3.827 7.727 1.00 0.00 C ATOM 1040 CG1 ILE F 16 121.060 5.193 7.159 1.00 0.00 C ATOM 1041 CG2 ILE F 16 120.661 2.760 6.618 1.00 0.00 C ATOM 1042 CD1 ILE F 16 122.531 5.143 6.727 1.00 0.00 C ATOM 0 H ILE F 16 119.874 4.489 10.211 1.00 0.00 H new ATOM 0 HA ILE F 16 118.553 4.366 7.551 1.00 0.00 H new ATOM 0 HB ILE F 16 121.311 3.531 8.520 1.00 0.00 H new ATOM 0 HG12 ILE F 16 120.433 5.458 6.308 1.00 0.00 H new ATOM 0 HG13 ILE F 16 120.921 5.969 7.912 1.00 0.00 H new ATOM 0 HG21 ILE F 16 121.671 2.690 6.214 1.00 0.00 H new ATOM 0 HG22 ILE F 16 120.368 1.795 7.032 1.00 0.00 H new ATOM 0 HG23 ILE F 16 119.971 3.039 5.822 1.00 0.00 H new ATOM 0 HD11 ILE F 16 122.826 6.113 6.328 1.00 0.00 H new ATOM 0 HD12 ILE F 16 123.155 4.899 7.587 1.00 0.00 H new ATOM 0 HD13 ILE F 16 122.659 4.381 5.959 1.00 0.00 H new ATOM 1054 N VAL F 17 117.923 1.986 7.726 1.00 0.00 N ATOM 1055 CA VAL F 17 117.292 0.682 7.904 1.00 0.00 C ATOM 1056 C VAL F 17 117.638 -0.237 6.729 1.00 0.00 C ATOM 1057 O VAL F 17 117.238 0.036 5.600 1.00 0.00 O ATOM 1058 CB VAL F 17 115.774 0.922 7.983 1.00 0.00 C ATOM 1059 CG1 VAL F 17 114.983 -0.366 7.692 1.00 0.00 C ATOM 1060 CG2 VAL F 17 115.419 1.447 9.382 1.00 0.00 C ATOM 0 H VAL F 17 117.744 2.410 6.816 1.00 0.00 H new ATOM 0 HA VAL F 17 117.648 0.195 8.812 1.00 0.00 H new ATOM 0 HB VAL F 17 115.501 1.657 7.226 1.00 0.00 H new ATOM 0 HG11 VAL F 17 113.915 -0.159 7.757 1.00 0.00 H new ATOM 0 HG12 VAL F 17 115.224 -0.722 6.690 1.00 0.00 H new ATOM 0 HG13 VAL F 17 115.250 -1.130 8.423 1.00 0.00 H new ATOM 0 HG21 VAL F 17 114.344 1.619 9.444 1.00 0.00 H new ATOM 0 HG22 VAL F 17 115.713 0.712 10.132 1.00 0.00 H new ATOM 0 HG23 VAL F 17 115.947 2.383 9.564 1.00 0.00 H new ATOM 1070 N TYR F 18 118.366 -1.327 7.012 1.00 0.00 N ATOM 1071 CA TYR F 18 118.756 -2.290 5.972 1.00 0.00 C ATOM 1072 C TYR F 18 117.737 -3.418 5.890 1.00 0.00 C ATOM 1073 O TYR F 18 117.335 -3.976 6.915 1.00 0.00 O ATOM 1074 CB TYR F 18 120.161 -2.859 6.276 1.00 0.00 C ATOM 1075 CG TYR F 18 121.215 -2.044 5.547 1.00 0.00 C ATOM 1076 CD1 TYR F 18 121.145 -0.646 5.557 1.00 0.00 C ATOM 1077 CD2 TYR F 18 122.241 -2.684 4.838 1.00 0.00 C ATOM 1078 CE1 TYR F 18 122.088 0.108 4.863 1.00 0.00 C ATOM 1079 CE2 TYR F 18 123.192 -1.924 4.148 1.00 0.00 C ATOM 1080 CZ TYR F 18 123.114 -0.527 4.158 1.00 0.00 C ATOM 1081 OH TYR F 18 124.048 0.222 3.472 1.00 0.00 O ATOM 0 H TYR F 18 118.695 -1.563 7.948 1.00 0.00 H new ATOM 0 HA TYR F 18 118.785 -1.777 5.011 1.00 0.00 H new ATOM 0 HB2 TYR F 18 120.348 -2.836 7.350 1.00 0.00 H new ATOM 0 HB3 TYR F 18 120.216 -3.902 5.965 1.00 0.00 H new ATOM 0 HD1 TYR F 18 120.357 -0.150 6.105 1.00 0.00 H new ATOM 0 HD2 TYR F 18 122.297 -3.762 4.824 1.00 0.00 H new ATOM 0 HE1 TYR F 18 122.026 1.186 4.870 1.00 0.00 H new ATOM 0 HE2 TYR F 18 123.987 -2.416 3.607 1.00 0.00 H new ATOM 0 HH TYR F 18 123.638 0.595 2.664 1.00 0.00 H new ATOM 1091 N LEU F 19 117.298 -3.719 4.657 1.00 0.00 N ATOM 1092 CA LEU F 19 116.283 -4.763 4.436 1.00 0.00 C ATOM 1093 C LEU F 19 116.778 -5.856 3.465 1.00 0.00 C ATOM 1094 O LEU F 19 116.469 -5.816 2.268 1.00 0.00 O ATOM 1095 CB LEU F 19 114.994 -4.116 3.889 1.00 0.00 C ATOM 1096 CG LEU F 19 114.558 -2.932 4.782 1.00 0.00 C ATOM 1097 CD1 LEU F 19 114.210 -1.726 3.903 1.00 0.00 C ATOM 1098 CD2 LEU F 19 113.338 -3.332 5.626 1.00 0.00 C ATOM 0 H LEU F 19 117.625 -3.260 3.807 1.00 0.00 H new ATOM 0 HA LEU F 19 116.083 -5.245 5.393 1.00 0.00 H new ATOM 0 HB2 LEU F 19 115.160 -3.768 2.870 1.00 0.00 H new ATOM 0 HB3 LEU F 19 114.198 -4.859 3.846 1.00 0.00 H new ATOM 0 HG LEU F 19 115.378 -2.667 5.450 1.00 0.00 H new ATOM 0 HD11 LEU F 19 113.903 -0.892 4.534 1.00 0.00 H new ATOM 0 HD12 LEU F 19 115.084 -1.437 3.320 1.00 0.00 H new ATOM 0 HD13 LEU F 19 113.395 -1.990 3.229 1.00 0.00 H new ATOM 0 HD21 LEU F 19 113.038 -2.492 6.252 1.00 0.00 H new ATOM 0 HD22 LEU F 19 112.514 -3.607 4.967 1.00 0.00 H new ATOM 0 HD23 LEU F 19 113.596 -4.182 6.258 1.00 0.00 H new ATOM 1110 N PRO F 20 117.527 -6.832 3.952 1.00 0.00 N ATOM 1111 CA PRO F 20 118.049 -7.952 3.114 1.00 0.00 C ATOM 1112 C PRO F 20 117.058 -9.124 3.023 1.00 0.00 C ATOM 1113 O PRO F 20 116.645 -9.515 1.928 1.00 0.00 O ATOM 1114 CB PRO F 20 119.330 -8.357 3.849 1.00 0.00 C ATOM 1115 CG PRO F 20 119.082 -8.043 5.294 1.00 0.00 C ATOM 1116 CD PRO F 20 117.970 -6.981 5.353 1.00 0.00 C ATOM 0 HA PRO F 20 118.215 -7.660 2.077 1.00 0.00 H new ATOM 0 HB2 PRO F 20 119.544 -9.417 3.709 1.00 0.00 H new ATOM 0 HB3 PRO F 20 120.190 -7.806 3.470 1.00 0.00 H new ATOM 0 HG2 PRO F 20 118.784 -8.941 5.836 1.00 0.00 H new ATOM 0 HG3 PRO F 20 119.991 -7.673 5.767 1.00 0.00 H new ATOM 0 HD2 PRO F 20 117.150 -7.300 5.997 1.00 0.00 H new ATOM 0 HD3 PRO F 20 118.342 -6.038 5.754 1.00 0.00 H new ATOM 1124 N ASN F 21 116.695 -9.676 4.185 1.00 0.00 N ATOM 1125 CA ASN F 21 115.765 -10.812 4.261 1.00 0.00 C ATOM 1126 C ASN F 21 114.400 -10.473 3.656 1.00 0.00 C ATOM 1127 O ASN F 21 113.676 -11.369 3.211 1.00 0.00 O ATOM 1128 CB ASN F 21 115.575 -11.235 5.726 1.00 0.00 C ATOM 1129 CG ASN F 21 116.892 -11.728 6.331 1.00 0.00 C ATOM 1130 OD1 ASN F 21 117.766 -12.230 5.622 1.00 0.00 O ATOM 1131 ND2 ASN F 21 117.082 -11.615 7.615 1.00 0.00 N ATOM 0 H ASN F 21 117.032 -9.354 5.092 1.00 0.00 H new ATOM 0 HA ASN F 21 116.200 -11.629 3.685 1.00 0.00 H new ATOM 0 HB2 ASN F 21 115.198 -10.392 6.305 1.00 0.00 H new ATOM 0 HB3 ASN F 21 114.825 -12.024 5.786 1.00 0.00 H new ATOM 0 HD21 ASN F 21 117.953 -11.942 8.032 1.00 0.00 H new ATOM 0 HD22 ASN F 21 116.359 -11.200 8.203 1.00 0.00 H new ATOM 1138 N LEU F 22 114.048 -9.182 3.667 1.00 0.00 N ATOM 1139 CA LEU F 22 112.759 -8.708 3.145 1.00 0.00 C ATOM 1140 C LEU F 22 112.522 -9.183 1.704 1.00 0.00 C ATOM 1141 O LEU F 22 113.467 -9.286 0.917 1.00 0.00 O ATOM 1142 CB LEU F 22 112.746 -7.173 3.189 1.00 0.00 C ATOM 1143 CG LEU F 22 111.323 -6.644 3.467 1.00 0.00 C ATOM 1144 CD1 LEU F 22 111.199 -6.219 4.945 1.00 0.00 C ATOM 1145 CD2 LEU F 22 111.045 -5.443 2.545 1.00 0.00 C ATOM 0 H LEU F 22 114.643 -8.440 4.035 1.00 0.00 H new ATOM 0 HA LEU F 22 111.961 -9.118 3.764 1.00 0.00 H new ATOM 0 HB2 LEU F 22 113.427 -6.821 3.964 1.00 0.00 H new ATOM 0 HB3 LEU F 22 113.108 -6.775 2.241 1.00 0.00 H new ATOM 0 HG LEU F 22 110.594 -7.430 3.270 1.00 0.00 H new ATOM 0 HD11 LEU F 22 110.192 -5.847 5.133 1.00 0.00 H new ATOM 0 HD12 LEU F 22 111.395 -7.077 5.588 1.00 0.00 H new ATOM 0 HD13 LEU F 22 111.922 -5.432 5.159 1.00 0.00 H new ATOM 0 HD21 LEU F 22 110.041 -5.063 2.735 1.00 0.00 H new ATOM 0 HD22 LEU F 22 111.774 -4.657 2.742 1.00 0.00 H new ATOM 0 HD23 LEU F 22 111.123 -5.758 1.504 1.00 0.00 H new ATOM 1157 N ASN F 23 111.254 -9.462 1.368 1.00 0.00 N ATOM 1158 CA ASN F 23 110.906 -9.916 0.020 1.00 0.00 C ATOM 1159 C ASN F 23 110.900 -8.725 -0.943 1.00 0.00 C ATOM 1160 O ASN F 23 110.593 -7.603 -0.529 1.00 0.00 O ATOM 1161 CB ASN F 23 109.527 -10.588 0.029 1.00 0.00 C ATOM 1162 CG ASN F 23 109.614 -11.953 0.709 1.00 0.00 C ATOM 1163 OD1 ASN F 23 109.983 -12.941 0.074 1.00 0.00 O ATOM 1164 ND2 ASN F 23 109.296 -12.068 1.967 1.00 0.00 N ATOM 0 H ASN F 23 110.462 -9.381 2.006 1.00 0.00 H new ATOM 0 HA ASN F 23 111.649 -10.641 -0.312 1.00 0.00 H new ATOM 0 HB2 ASN F 23 108.809 -9.957 0.553 1.00 0.00 H new ATOM 0 HB3 ASN F 23 109.163 -10.704 -0.992 1.00 0.00 H new ATOM 0 HD21 ASN F 23 109.353 -12.977 2.426 1.00 0.00 H new ATOM 0 HD22 ASN F 23 108.990 -11.249 2.493 1.00 0.00 H new ATOM 1171 N PRO F 24 111.227 -8.925 -2.207 1.00 0.00 N ATOM 1172 CA PRO F 24 111.242 -7.807 -3.194 1.00 0.00 C ATOM 1173 C PRO F 24 109.855 -7.188 -3.345 1.00 0.00 C ATOM 1174 O PRO F 24 109.719 -5.966 -3.461 1.00 0.00 O ATOM 1175 CB PRO F 24 111.721 -8.444 -4.509 1.00 0.00 C ATOM 1176 CG PRO F 24 112.253 -9.797 -4.152 1.00 0.00 C ATOM 1177 CD PRO F 24 111.608 -10.207 -2.829 1.00 0.00 C ATOM 0 HA PRO F 24 111.894 -6.992 -2.880 1.00 0.00 H new ATOM 0 HB2 PRO F 24 110.901 -8.525 -5.223 1.00 0.00 H new ATOM 0 HB3 PRO F 24 112.493 -7.834 -4.978 1.00 0.00 H new ATOM 0 HG2 PRO F 24 112.019 -10.520 -4.933 1.00 0.00 H new ATOM 0 HG3 PRO F 24 113.339 -9.770 -4.058 1.00 0.00 H new ATOM 0 HD2 PRO F 24 110.740 -10.847 -2.989 1.00 0.00 H new ATOM 0 HD3 PRO F 24 112.303 -10.764 -2.201 1.00 0.00 H new ATOM 1185 N ASP F 25 108.826 -8.040 -3.304 1.00 0.00 N ATOM 1186 CA ASP F 25 107.448 -7.562 -3.394 1.00 0.00 C ATOM 1187 C ASP F 25 107.171 -6.656 -2.196 1.00 0.00 C ATOM 1188 O ASP F 25 106.521 -5.615 -2.323 1.00 0.00 O ATOM 1189 CB ASP F 25 106.467 -8.746 -3.406 1.00 0.00 C ATOM 1190 CG ASP F 25 106.685 -9.609 -4.656 1.00 0.00 C ATOM 1191 OD1 ASP F 25 106.496 -9.098 -5.751 1.00 0.00 O ATOM 1192 OD2 ASP F 25 107.039 -10.768 -4.500 1.00 0.00 O ATOM 0 H ASP F 25 108.921 -9.051 -3.210 1.00 0.00 H new ATOM 0 HA ASP F 25 107.311 -7.005 -4.321 1.00 0.00 H new ATOM 0 HB2 ASP F 25 106.606 -9.351 -2.510 1.00 0.00 H new ATOM 0 HB3 ASP F 25 105.442 -8.377 -3.385 1.00 0.00 H new ATOM 1197 N GLN F 26 107.712 -7.056 -1.038 1.00 0.00 N ATOM 1198 CA GLN F 26 107.570 -6.283 0.178 1.00 0.00 C ATOM 1199 C GLN F 26 108.264 -4.928 0.007 1.00 0.00 C ATOM 1200 O GLN F 26 107.750 -3.903 0.462 1.00 0.00 O ATOM 1201 CB GLN F 26 108.173 -7.059 1.351 1.00 0.00 C ATOM 1202 CG GLN F 26 107.717 -6.441 2.674 1.00 0.00 C ATOM 1203 CD GLN F 26 106.225 -6.692 2.893 1.00 0.00 C ATOM 1204 OE1 GLN F 26 105.456 -5.750 3.084 1.00 0.00 O ATOM 1205 NE2 GLN F 26 105.767 -7.914 2.879 1.00 0.00 N ATOM 0 H GLN F 26 108.252 -7.915 -0.929 1.00 0.00 H new ATOM 0 HA GLN F 26 106.514 -6.108 0.385 1.00 0.00 H new ATOM 0 HB2 GLN F 26 107.866 -8.104 1.303 1.00 0.00 H new ATOM 0 HB3 GLN F 26 109.261 -7.043 1.288 1.00 0.00 H new ATOM 0 HG2 GLN F 26 108.289 -6.867 3.498 1.00 0.00 H new ATOM 0 HG3 GLN F 26 107.915 -5.369 2.670 1.00 0.00 H new ATOM 0 HE21 GLN F 26 106.403 -8.695 2.721 1.00 0.00 H new ATOM 0 HE22 GLN F 26 104.773 -8.088 3.026 1.00 0.00 H new ATOM 1214 N LEU F 27 109.429 -4.933 -0.671 1.00 0.00 N ATOM 1215 CA LEU F 27 110.173 -3.690 -0.918 1.00 0.00 C ATOM 1216 C LEU F 27 109.333 -2.732 -1.759 1.00 0.00 C ATOM 1217 O LEU F 27 109.315 -1.532 -1.501 1.00 0.00 O ATOM 1218 CB LEU F 27 111.507 -3.958 -1.651 1.00 0.00 C ATOM 1219 CG LEU F 27 112.578 -4.500 -0.687 1.00 0.00 C ATOM 1220 CD1 LEU F 27 113.811 -4.946 -1.488 1.00 0.00 C ATOM 1221 CD2 LEU F 27 112.996 -3.403 0.308 1.00 0.00 C ATOM 0 H LEU F 27 109.867 -5.772 -1.051 1.00 0.00 H new ATOM 0 HA LEU F 27 110.392 -3.246 0.053 1.00 0.00 H new ATOM 0 HB2 LEU F 27 111.344 -4.674 -2.456 1.00 0.00 H new ATOM 0 HB3 LEU F 27 111.863 -3.036 -2.111 1.00 0.00 H new ATOM 0 HG LEU F 27 112.164 -5.347 -0.139 1.00 0.00 H new ATOM 0 HD11 LEU F 27 114.569 -5.330 -0.805 1.00 0.00 H new ATOM 0 HD12 LEU F 27 113.525 -5.729 -2.190 1.00 0.00 H new ATOM 0 HD13 LEU F 27 114.215 -4.096 -2.038 1.00 0.00 H new ATOM 0 HD21 LEU F 27 113.754 -3.796 0.986 1.00 0.00 H new ATOM 0 HD22 LEU F 27 113.404 -2.552 -0.238 1.00 0.00 H new ATOM 0 HD23 LEU F 27 112.127 -3.082 0.882 1.00 0.00 H new ATOM 1233 N CYS F 28 108.630 -3.270 -2.765 1.00 0.00 N ATOM 1234 CA CYS F 28 107.786 -2.438 -3.630 1.00 0.00 C ATOM 1235 C CYS F 28 106.701 -1.743 -2.805 1.00 0.00 C ATOM 1236 O CYS F 28 106.491 -0.534 -2.933 1.00 0.00 O ATOM 1237 CB CYS F 28 107.144 -3.293 -4.732 1.00 0.00 C ATOM 1238 SG CYS F 28 106.387 -2.213 -5.974 1.00 0.00 S ATOM 0 H CYS F 28 108.629 -4.263 -2.997 1.00 0.00 H new ATOM 0 HA CYS F 28 108.413 -1.678 -4.097 1.00 0.00 H new ATOM 0 HB2 CYS F 28 107.897 -3.929 -5.198 1.00 0.00 H new ATOM 0 HB3 CYS F 28 106.391 -3.953 -4.302 1.00 0.00 H new ATOM 1243 N ALA F 29 106.040 -2.517 -1.942 1.00 0.00 N ATOM 1244 CA ALA F 29 104.999 -1.972 -1.073 1.00 0.00 C ATOM 1245 C ALA F 29 105.611 -0.957 -0.107 1.00 0.00 C ATOM 1246 O ALA F 29 105.018 0.089 0.175 1.00 0.00 O ATOM 1247 CB ALA F 29 104.337 -3.105 -0.280 1.00 0.00 C ATOM 0 H ALA F 29 106.207 -3.517 -1.827 1.00 0.00 H new ATOM 0 HA ALA F 29 104.246 -1.477 -1.686 1.00 0.00 H new ATOM 0 HB1 ALA F 29 103.562 -2.692 0.366 1.00 0.00 H new ATOM 0 HB2 ALA F 29 103.891 -3.820 -0.971 1.00 0.00 H new ATOM 0 HB3 ALA F 29 105.087 -3.609 0.330 1.00 0.00 H new ATOM 1253 N PHE F 30 106.810 -1.284 0.388 1.00 0.00 N ATOM 1254 CA PHE F 30 107.526 -0.415 1.321 1.00 0.00 C ATOM 1255 C PHE F 30 107.860 0.922 0.659 1.00 0.00 C ATOM 1256 O PHE F 30 107.518 1.979 1.188 1.00 0.00 O ATOM 1257 CB PHE F 30 108.816 -1.128 1.778 1.00 0.00 C ATOM 1258 CG PHE F 30 109.707 -0.195 2.582 1.00 0.00 C ATOM 1259 CD1 PHE F 30 109.223 0.408 3.752 1.00 0.00 C ATOM 1260 CD2 PHE F 30 111.022 0.065 2.152 1.00 0.00 C ATOM 1261 CE1 PHE F 30 110.046 1.264 4.489 1.00 0.00 C ATOM 1262 CE2 PHE F 30 111.840 0.922 2.895 1.00 0.00 C ATOM 1263 CZ PHE F 30 111.351 1.521 4.062 1.00 0.00 C ATOM 0 H PHE F 30 107.303 -2.146 0.156 1.00 0.00 H new ATOM 0 HA PHE F 30 106.895 -0.212 2.186 1.00 0.00 H new ATOM 0 HB2 PHE F 30 108.559 -1.998 2.381 1.00 0.00 H new ATOM 0 HB3 PHE F 30 109.360 -1.493 0.907 1.00 0.00 H new ATOM 0 HD1 PHE F 30 108.214 0.211 4.084 1.00 0.00 H new ATOM 0 HD2 PHE F 30 111.398 -0.396 1.251 1.00 0.00 H new ATOM 0 HE1 PHE F 30 109.672 1.728 5.390 1.00 0.00 H new ATOM 0 HE2 PHE F 30 112.850 1.122 2.568 1.00 0.00 H new ATOM 0 HZ PHE F 30 111.984 2.183 4.634 1.00 0.00 H new ATOM 1273 N ILE F 31 108.520 0.859 -0.500 1.00 0.00 N ATOM 1274 CA ILE F 31 108.905 2.064 -1.240 1.00 0.00 C ATOM 1275 C ILE F 31 107.678 2.906 -1.584 1.00 0.00 C ATOM 1276 O ILE F 31 107.716 4.136 -1.482 1.00 0.00 O ATOM 1277 CB ILE F 31 109.685 1.674 -2.509 1.00 0.00 C ATOM 1278 CG1 ILE F 31 111.002 0.995 -2.090 1.00 0.00 C ATOM 1279 CG2 ILE F 31 110.007 2.924 -3.347 1.00 0.00 C ATOM 1280 CD1 ILE F 31 111.721 0.418 -3.311 1.00 0.00 C ATOM 0 H ILE F 31 108.799 -0.014 -0.947 1.00 0.00 H new ATOM 0 HA ILE F 31 109.554 2.672 -0.609 1.00 0.00 H new ATOM 0 HB ILE F 31 109.079 0.995 -3.109 1.00 0.00 H new ATOM 0 HG12 ILE F 31 111.647 1.717 -1.589 1.00 0.00 H new ATOM 0 HG13 ILE F 31 110.796 0.200 -1.373 1.00 0.00 H new ATOM 0 HG21 ILE F 31 110.559 2.631 -4.240 1.00 0.00 H new ATOM 0 HG22 ILE F 31 109.079 3.416 -3.638 1.00 0.00 H new ATOM 0 HG23 ILE F 31 110.612 3.612 -2.756 1.00 0.00 H new ATOM 0 HD11 ILE F 31 112.649 -0.058 -2.995 1.00 0.00 H new ATOM 0 HD12 ILE F 31 111.081 -0.320 -3.795 1.00 0.00 H new ATOM 0 HD13 ILE F 31 111.945 1.220 -4.014 1.00 0.00 H new ATOM 1292 N HIS F 32 106.586 2.236 -1.972 1.00 0.00 N ATOM 1293 CA HIS F 32 105.338 2.931 -2.305 1.00 0.00 C ATOM 1294 C HIS F 32 104.830 3.701 -1.082 1.00 0.00 C ATOM 1295 O HIS F 32 104.343 4.828 -1.203 1.00 0.00 O ATOM 1296 CB HIS F 32 104.279 1.919 -2.769 1.00 0.00 C ATOM 1297 CG HIS F 32 103.052 2.646 -3.255 1.00 0.00 C ATOM 1298 ND1 HIS F 32 101.969 2.904 -2.429 1.00 0.00 N ATOM 1299 CD2 HIS F 32 102.724 3.174 -4.480 1.00 0.00 C ATOM 1300 CE1 HIS F 32 101.049 3.561 -3.160 1.00 0.00 C ATOM 1301 NE2 HIS F 32 101.458 3.751 -4.417 1.00 0.00 N ATOM 0 H HIS F 32 106.541 1.221 -2.062 1.00 0.00 H new ATOM 0 HA HIS F 32 105.528 3.636 -3.114 1.00 0.00 H new ATOM 0 HB2 HIS F 32 104.683 1.297 -3.567 1.00 0.00 H new ATOM 0 HB3 HIS F 32 104.016 1.253 -1.948 1.00 0.00 H new ATOM 0 HD2 HIS F 32 103.352 3.146 -5.358 1.00 0.00 H new ATOM 0 HE1 HIS F 32 100.096 3.894 -2.776 1.00 0.00 H new ATOM 0 HE2 HIS F 32 100.952 4.218 -5.169 1.00 0.00 H new ATOM 1310 N SER F 33 104.967 3.077 0.093 1.00 0.00 N ATOM 1311 CA SER F 33 104.540 3.698 1.347 1.00 0.00 C ATOM 1312 C SER F 33 105.385 4.942 1.654 1.00 0.00 C ATOM 1313 O SER F 33 104.842 5.976 2.055 1.00 0.00 O ATOM 1314 CB SER F 33 104.648 2.686 2.493 1.00 0.00 C ATOM 1315 OG SER F 33 103.843 3.123 3.580 1.00 0.00 O ATOM 0 H SER F 33 105.369 2.146 0.200 1.00 0.00 H new ATOM 0 HA SER F 33 103.501 4.010 1.244 1.00 0.00 H new ATOM 0 HB2 SER F 33 104.323 1.702 2.157 1.00 0.00 H new ATOM 0 HB3 SER F 33 105.686 2.587 2.810 1.00 0.00 H new ATOM 0 HG SER F 33 103.387 2.353 3.980 1.00 0.00 H new ATOM 1321 N LEU F 34 106.716 4.839 1.458 1.00 0.00 N ATOM 1322 CA LEU F 34 107.623 5.969 1.710 1.00 0.00 C ATOM 1323 C LEU F 34 107.225 7.170 0.844 1.00 0.00 C ATOM 1324 O LEU F 34 107.177 8.305 1.322 1.00 0.00 O ATOM 1325 CB LEU F 34 109.084 5.592 1.371 1.00 0.00 C ATOM 1326 CG LEU F 34 109.560 4.365 2.176 1.00 0.00 C ATOM 1327 CD1 LEU F 34 110.964 3.935 1.695 1.00 0.00 C ATOM 1328 CD2 LEU F 34 109.607 4.713 3.669 1.00 0.00 C ATOM 0 H LEU F 34 107.179 3.992 1.129 1.00 0.00 H new ATOM 0 HA LEU F 34 107.547 6.222 2.767 1.00 0.00 H new ATOM 0 HB2 LEU F 34 109.167 5.382 0.305 1.00 0.00 H new ATOM 0 HB3 LEU F 34 109.736 6.440 1.581 1.00 0.00 H new ATOM 0 HG LEU F 34 108.862 3.542 2.021 1.00 0.00 H new ATOM 0 HD11 LEU F 34 111.295 3.068 2.267 1.00 0.00 H new ATOM 0 HD12 LEU F 34 110.923 3.677 0.637 1.00 0.00 H new ATOM 0 HD13 LEU F 34 111.666 4.756 1.841 1.00 0.00 H new ATOM 0 HD21 LEU F 34 109.944 3.844 4.235 1.00 0.00 H new ATOM 0 HD22 LEU F 34 110.299 5.540 3.828 1.00 0.00 H new ATOM 0 HD23 LEU F 34 108.612 5.002 4.007 1.00 0.00 H new ATOM 1340 N HIS F 35 106.952 6.895 -0.436 1.00 0.00 N ATOM 1341 CA HIS F 35 106.569 7.936 -1.394 1.00 0.00 C ATOM 1342 C HIS F 35 105.169 8.489 -1.095 1.00 0.00 C ATOM 1343 O HIS F 35 104.972 9.707 -1.059 1.00 0.00 O ATOM 1344 CB HIS F 35 106.611 7.356 -2.819 1.00 0.00 C ATOM 1345 CG HIS F 35 106.389 8.449 -3.835 1.00 0.00 C ATOM 1346 ND1 HIS F 35 107.308 9.466 -4.041 1.00 0.00 N ATOM 1347 CD2 HIS F 35 105.358 8.695 -4.709 1.00 0.00 C ATOM 1348 CE1 HIS F 35 106.818 10.269 -5.004 1.00 0.00 C ATOM 1349 NE2 HIS F 35 105.632 9.844 -5.446 1.00 0.00 N ATOM 0 H HIS F 35 106.990 5.956 -0.833 1.00 0.00 H new ATOM 0 HA HIS F 35 107.277 8.761 -1.306 1.00 0.00 H new ATOM 0 HB2 HIS F 35 107.574 6.876 -2.995 1.00 0.00 H new ATOM 0 HB3 HIS F 35 105.846 6.587 -2.929 1.00 0.00 H new ATOM 0 HD2 HIS F 35 104.470 8.089 -4.809 1.00 0.00 H new ATOM 0 HE1 HIS F 35 107.323 11.149 -5.374 1.00 0.00 H new ATOM 0 HE2 HIS F 35 105.051 10.270 -6.168 1.00 0.00 H new ATOM 1358 N ASP F 36 104.203 7.582 -0.911 1.00 0.00 N ATOM 1359 CA ASP F 36 102.814 7.971 -0.644 1.00 0.00 C ATOM 1360 C ASP F 36 102.696 8.827 0.619 1.00 0.00 C ATOM 1361 O ASP F 36 101.913 9.780 0.651 1.00 0.00 O ATOM 1362 CB ASP F 36 101.940 6.709 -0.501 1.00 0.00 C ATOM 1363 CG ASP F 36 100.453 7.068 -0.318 1.00 0.00 C ATOM 1364 OD1 ASP F 36 100.012 8.059 -0.885 1.00 0.00 O ATOM 1365 OD2 ASP F 36 99.776 6.337 0.387 1.00 0.00 O ATOM 0 H ASP F 36 104.358 6.574 -0.942 1.00 0.00 H new ATOM 0 HA ASP F 36 102.468 8.571 -1.486 1.00 0.00 H new ATOM 0 HB2 ASP F 36 102.058 6.082 -1.385 1.00 0.00 H new ATOM 0 HB3 ASP F 36 102.282 6.124 0.353 1.00 0.00 H new ATOM 1370 N ASP F 37 103.465 8.474 1.655 1.00 0.00 N ATOM 1371 CA ASP F 37 103.440 9.206 2.926 1.00 0.00 C ATOM 1372 C ASP F 37 104.868 9.426 3.456 1.00 0.00 C ATOM 1373 O ASP F 37 105.368 8.628 4.257 1.00 0.00 O ATOM 1374 CB ASP F 37 102.600 8.424 3.950 1.00 0.00 C ATOM 1375 CG ASP F 37 101.114 8.539 3.605 1.00 0.00 C ATOM 1376 OD1 ASP F 37 100.484 9.471 4.083 1.00 0.00 O ATOM 1377 OD2 ASP F 37 100.628 7.698 2.866 1.00 0.00 O ATOM 0 H ASP F 37 104.112 7.686 1.638 1.00 0.00 H new ATOM 0 HA ASP F 37 102.989 10.185 2.763 1.00 0.00 H new ATOM 0 HB2 ASP F 37 102.901 7.376 3.955 1.00 0.00 H new ATOM 0 HB3 ASP F 37 102.780 8.812 4.953 1.00 0.00 H new ATOM 1382 N PRO F 38 105.532 10.488 3.024 1.00 0.00 N ATOM 1383 CA PRO F 38 106.927 10.802 3.472 1.00 0.00 C ATOM 1384 C PRO F 38 107.018 10.940 4.991 1.00 0.00 C ATOM 1385 O PRO F 38 107.993 10.506 5.605 1.00 0.00 O ATOM 1386 CB PRO F 38 107.258 12.134 2.777 1.00 0.00 C ATOM 1387 CG PRO F 38 106.291 12.252 1.647 1.00 0.00 C ATOM 1388 CD PRO F 38 105.034 11.498 2.072 1.00 0.00 C ATOM 0 HA PRO F 38 107.626 10.007 3.213 1.00 0.00 H new ATOM 0 HB2 PRO F 38 107.157 12.971 3.467 1.00 0.00 H new ATOM 0 HB3 PRO F 38 108.286 12.142 2.415 1.00 0.00 H new ATOM 0 HG2 PRO F 38 106.064 13.297 1.438 1.00 0.00 H new ATOM 0 HG3 PRO F 38 106.708 11.828 0.734 1.00 0.00 H new ATOM 0 HD2 PRO F 38 104.308 12.163 2.539 1.00 0.00 H new ATOM 0 HD3 PRO F 38 104.539 11.034 1.219 1.00 0.00 H new ATOM 1396 N SER F 39 105.985 11.538 5.584 1.00 0.00 N ATOM 1397 CA SER F 39 105.935 11.729 7.035 1.00 0.00 C ATOM 1398 C SER F 39 105.972 10.379 7.753 1.00 0.00 C ATOM 1399 O SER F 39 106.569 10.253 8.826 1.00 0.00 O ATOM 1400 CB SER F 39 104.657 12.484 7.421 1.00 0.00 C ATOM 1401 OG SER F 39 104.602 13.712 6.705 1.00 0.00 O ATOM 0 H SER F 39 105.172 11.898 5.084 1.00 0.00 H new ATOM 0 HA SER F 39 106.804 12.313 7.338 1.00 0.00 H new ATOM 0 HB2 SER F 39 103.780 11.878 7.194 1.00 0.00 H new ATOM 0 HB3 SER F 39 104.644 12.675 8.494 1.00 0.00 H new ATOM 0 HG SER F 39 103.785 14.196 6.948 1.00 0.00 H new ATOM 1407 N GLN F 40 105.322 9.379 7.149 1.00 0.00 N ATOM 1408 CA GLN F 40 105.267 8.033 7.719 1.00 0.00 C ATOM 1409 C GLN F 40 106.541 7.236 7.451 1.00 0.00 C ATOM 1410 O GLN F 40 106.707 6.164 8.018 1.00 0.00 O ATOM 1411 CB GLN F 40 104.076 7.261 7.131 1.00 0.00 C ATOM 1412 CG GLN F 40 102.768 7.886 7.612 1.00 0.00 C ATOM 1413 CD GLN F 40 101.570 7.104 7.072 1.00 0.00 C ATOM 1414 OE1 GLN F 40 101.496 5.884 7.232 1.00 0.00 O ATOM 1415 NE2 GLN F 40 100.619 7.736 6.444 1.00 0.00 N ATOM 0 H GLN F 40 104.826 9.479 6.263 1.00 0.00 H new ATOM 0 HA GLN F 40 105.157 8.152 8.797 1.00 0.00 H new ATOM 0 HB2 GLN F 40 104.120 7.280 6.042 1.00 0.00 H new ATOM 0 HB3 GLN F 40 104.123 6.215 7.434 1.00 0.00 H new ATOM 0 HG2 GLN F 40 102.742 7.896 8.702 1.00 0.00 H new ATOM 0 HG3 GLN F 40 102.711 8.923 7.282 1.00 0.00 H new ATOM 0 HE21 GLN F 40 100.679 8.746 6.311 1.00 0.00 H new ATOM 0 HE22 GLN F 40 99.815 7.221 6.086 1.00 0.00 H new ATOM 1424 N SER F 41 107.422 7.734 6.569 1.00 0.00 N ATOM 1425 CA SER F 41 108.654 7.000 6.225 1.00 0.00 C ATOM 1426 C SER F 41 109.398 6.514 7.473 1.00 0.00 C ATOM 1427 O SER F 41 109.831 5.365 7.529 1.00 0.00 O ATOM 1428 CB SER F 41 109.579 7.885 5.384 1.00 0.00 C ATOM 1429 OG SER F 41 110.042 8.975 6.172 1.00 0.00 O ATOM 0 H SER F 41 107.310 8.626 6.087 1.00 0.00 H new ATOM 0 HA SER F 41 108.360 6.123 5.648 1.00 0.00 H new ATOM 0 HB2 SER F 41 110.424 7.302 5.019 1.00 0.00 H new ATOM 0 HB3 SER F 41 109.047 8.256 4.508 1.00 0.00 H new ATOM 0 HG SER F 41 109.289 9.563 6.392 1.00 0.00 H new ATOM 1435 N ALA F 42 109.524 7.390 8.465 1.00 0.00 N ATOM 1436 CA ALA F 42 110.206 7.043 9.715 1.00 0.00 C ATOM 1437 C ALA F 42 109.500 5.880 10.420 1.00 0.00 C ATOM 1438 O ALA F 42 110.143 4.894 10.792 1.00 0.00 O ATOM 1439 CB ALA F 42 110.246 8.263 10.642 1.00 0.00 C ATOM 0 H ALA F 42 109.165 8.344 8.431 1.00 0.00 H new ATOM 0 HA ALA F 42 111.223 6.734 9.475 1.00 0.00 H new ATOM 0 HB1 ALA F 42 110.754 7.999 11.569 1.00 0.00 H new ATOM 0 HB2 ALA F 42 110.784 9.075 10.152 1.00 0.00 H new ATOM 0 HB3 ALA F 42 109.229 8.584 10.865 1.00 0.00 H new ATOM 1445 N ASN F 43 108.177 5.995 10.593 1.00 0.00 N ATOM 1446 CA ASN F 43 107.402 4.933 11.245 1.00 0.00 C ATOM 1447 C ASN F 43 107.448 3.657 10.406 1.00 0.00 C ATOM 1448 O ASN F 43 107.561 2.550 10.939 1.00 0.00 O ATOM 1449 CB ASN F 43 105.945 5.373 11.435 1.00 0.00 C ATOM 1450 CG ASN F 43 105.872 6.539 12.419 1.00 0.00 C ATOM 1451 OD1 ASN F 43 105.467 7.642 12.052 1.00 0.00 O ATOM 1452 ND2 ASN F 43 106.238 6.356 13.656 1.00 0.00 N ATOM 0 H ASN F 43 107.628 6.801 10.295 1.00 0.00 H new ATOM 0 HA ASN F 43 107.842 4.736 12.222 1.00 0.00 H new ATOM 0 HB2 ASN F 43 105.519 5.669 10.477 1.00 0.00 H new ATOM 0 HB3 ASN F 43 105.350 4.538 11.804 1.00 0.00 H new ATOM 0 HD21 ASN F 43 106.189 7.127 14.322 1.00 0.00 H new ATOM 0 HD22 ASN F 43 106.573 5.441 13.959 1.00 0.00 H new ATOM 1459 N LEU F 44 107.374 3.836 9.089 1.00 0.00 N ATOM 1460 CA LEU F 44 107.422 2.721 8.151 1.00 0.00 C ATOM 1461 C LEU F 44 108.763 2.019 8.253 1.00 0.00 C ATOM 1462 O LEU F 44 108.841 0.802 8.110 1.00 0.00 O ATOM 1463 CB LEU F 44 107.209 3.228 6.720 1.00 0.00 C ATOM 1464 CG LEU F 44 105.767 3.733 6.553 1.00 0.00 C ATOM 1465 CD1 LEU F 44 105.688 4.670 5.340 1.00 0.00 C ATOM 1466 CD2 LEU F 44 104.828 2.536 6.342 1.00 0.00 C ATOM 0 H LEU F 44 107.280 4.750 8.647 1.00 0.00 H new ATOM 0 HA LEU F 44 106.629 2.016 8.399 1.00 0.00 H new ATOM 0 HB2 LEU F 44 107.912 4.031 6.501 1.00 0.00 H new ATOM 0 HB3 LEU F 44 107.408 2.427 6.008 1.00 0.00 H new ATOM 0 HG LEU F 44 105.466 4.277 7.448 1.00 0.00 H new ATOM 0 HD11 LEU F 44 104.665 5.028 5.222 1.00 0.00 H new ATOM 0 HD12 LEU F 44 106.354 5.519 5.492 1.00 0.00 H new ATOM 0 HD13 LEU F 44 105.989 4.129 4.443 1.00 0.00 H new ATOM 0 HD21 LEU F 44 103.805 2.893 6.223 1.00 0.00 H new ATOM 0 HD22 LEU F 44 105.128 1.991 5.447 1.00 0.00 H new ATOM 0 HD23 LEU F 44 104.883 1.873 7.206 1.00 0.00 H new ATOM 1478 N LEU F 45 109.816 2.801 8.509 1.00 0.00 N ATOM 1479 CA LEU F 45 111.161 2.251 8.647 1.00 0.00 C ATOM 1480 C LEU F 45 111.207 1.292 9.832 1.00 0.00 C ATOM 1481 O LEU F 45 111.842 0.243 9.761 1.00 0.00 O ATOM 1482 CB LEU F 45 112.187 3.385 8.849 1.00 0.00 C ATOM 1483 CG LEU F 45 113.075 3.518 7.604 1.00 0.00 C ATOM 1484 CD1 LEU F 45 112.264 4.135 6.447 1.00 0.00 C ATOM 1485 CD2 LEU F 45 114.284 4.422 7.909 1.00 0.00 C ATOM 0 H LEU F 45 109.760 3.813 8.624 1.00 0.00 H new ATOM 0 HA LEU F 45 111.414 1.710 7.736 1.00 0.00 H new ATOM 0 HB2 LEU F 45 111.669 4.325 9.039 1.00 0.00 H new ATOM 0 HB3 LEU F 45 112.803 3.178 9.724 1.00 0.00 H new ATOM 0 HG LEU F 45 113.427 2.526 7.319 1.00 0.00 H new ATOM 0 HD11 LEU F 45 112.899 4.227 5.566 1.00 0.00 H new ATOM 0 HD12 LEU F 45 111.414 3.493 6.216 1.00 0.00 H new ATOM 0 HD13 LEU F 45 111.905 5.122 6.740 1.00 0.00 H new ATOM 0 HD21 LEU F 45 114.907 4.509 7.019 1.00 0.00 H new ATOM 0 HD22 LEU F 45 113.934 5.411 8.205 1.00 0.00 H new ATOM 0 HD23 LEU F 45 114.868 3.987 8.720 1.00 0.00 H new ATOM 1497 N ALA F 46 110.518 1.661 10.912 1.00 0.00 N ATOM 1498 CA ALA F 46 110.475 0.826 12.108 1.00 0.00 C ATOM 1499 C ALA F 46 109.792 -0.506 11.806 1.00 0.00 C ATOM 1500 O ALA F 46 110.329 -1.568 12.129 1.00 0.00 O ATOM 1501 CB ALA F 46 109.718 1.556 13.225 1.00 0.00 C ATOM 0 H ALA F 46 109.985 2.528 10.981 1.00 0.00 H new ATOM 0 HA ALA F 46 111.497 0.629 12.432 1.00 0.00 H new ATOM 0 HB1 ALA F 46 109.689 0.928 14.115 1.00 0.00 H new ATOM 0 HB2 ALA F 46 110.226 2.492 13.457 1.00 0.00 H new ATOM 0 HB3 ALA F 46 108.700 1.767 12.897 1.00 0.00 H new ATOM 1507 N GLU F 47 108.607 -0.445 11.184 1.00 0.00 N ATOM 1508 CA GLU F 47 107.867 -1.664 10.847 1.00 0.00 C ATOM 1509 C GLU F 47 108.582 -2.465 9.769 1.00 0.00 C ATOM 1510 O GLU F 47 108.617 -3.684 9.837 1.00 0.00 O ATOM 1511 CB GLU F 47 106.467 -1.340 10.341 1.00 0.00 C ATOM 1512 CG GLU F 47 105.637 -0.686 11.448 1.00 0.00 C ATOM 1513 CD GLU F 47 104.204 -0.450 10.962 1.00 0.00 C ATOM 1514 OE1 GLU F 47 104.007 0.471 10.187 1.00 0.00 O ATOM 1515 OE2 GLU F 47 103.328 -1.197 11.370 1.00 0.00 O ATOM 0 H GLU F 47 108.147 0.423 10.908 1.00 0.00 H new ATOM 0 HA GLU F 47 107.804 -2.250 11.764 1.00 0.00 H new ATOM 0 HB2 GLU F 47 106.530 -0.672 9.482 1.00 0.00 H new ATOM 0 HB3 GLU F 47 105.976 -2.252 10.001 1.00 0.00 H new ATOM 0 HG2 GLU F 47 105.629 -1.324 12.332 1.00 0.00 H new ATOM 0 HG3 GLU F 47 106.090 0.261 11.742 1.00 0.00 H new ATOM 1522 N ALA F 48 109.138 -1.767 8.774 1.00 0.00 N ATOM 1523 CA ALA F 48 109.852 -2.419 7.678 1.00 0.00 C ATOM 1524 C ALA F 48 111.070 -3.136 8.234 1.00 0.00 C ATOM 1525 O ALA F 48 111.316 -4.307 7.928 1.00 0.00 O ATOM 1526 CB ALA F 48 110.289 -1.369 6.649 1.00 0.00 C ATOM 0 H ALA F 48 109.106 -0.750 8.707 1.00 0.00 H new ATOM 0 HA ALA F 48 109.196 -3.141 7.190 1.00 0.00 H new ATOM 0 HB1 ALA F 48 110.821 -1.858 5.833 1.00 0.00 H new ATOM 0 HB2 ALA F 48 109.410 -0.858 6.255 1.00 0.00 H new ATOM 0 HB3 ALA F 48 110.947 -0.643 7.127 1.00 0.00 H new ATOM 1532 N LYS F 49 111.806 -2.422 9.082 1.00 0.00 N ATOM 1533 CA LYS F 49 112.979 -2.977 9.728 1.00 0.00 C ATOM 1534 C LYS F 49 112.557 -4.130 10.643 1.00 0.00 C ATOM 1535 O LYS F 49 113.275 -5.127 10.773 1.00 0.00 O ATOM 1536 CB LYS F 49 113.685 -1.886 10.542 1.00 0.00 C ATOM 1537 CG LYS F 49 115.061 -2.392 11.003 1.00 0.00 C ATOM 1538 CD LYS F 49 115.212 -2.193 12.516 1.00 0.00 C ATOM 1539 CE LYS F 49 115.482 -0.716 12.833 1.00 0.00 C ATOM 1540 NZ LYS F 49 116.900 -0.388 12.509 1.00 0.00 N ATOM 0 H LYS F 49 111.605 -1.455 9.335 1.00 0.00 H new ATOM 0 HA LYS F 49 113.669 -3.354 8.973 1.00 0.00 H new ATOM 0 HB2 LYS F 49 113.801 -0.986 9.938 1.00 0.00 H new ATOM 0 HB3 LYS F 49 113.079 -1.614 11.406 1.00 0.00 H new ATOM 0 HG2 LYS F 49 115.172 -3.447 10.754 1.00 0.00 H new ATOM 0 HG3 LYS F 49 115.850 -1.855 10.477 1.00 0.00 H new ATOM 0 HD2 LYS F 49 114.306 -2.522 13.025 1.00 0.00 H new ATOM 0 HD3 LYS F 49 116.030 -2.808 12.891 1.00 0.00 H new ATOM 0 HE2 LYS F 49 114.810 -0.081 12.256 1.00 0.00 H new ATOM 0 HE3 LYS F 49 115.283 -0.517 13.886 1.00 0.00 H new ATOM 0 HZ1 LYS F 49 117.420 -0.192 13.388 1.00 0.00 H new ATOM 0 HZ2 LYS F 49 117.339 -1.193 12.019 1.00 0.00 H new ATOM 0 HZ3 LYS F 49 116.931 0.450 11.894 1.00 0.00 H new ATOM 1554 N LYS F 50 111.366 -3.993 11.250 1.00 0.00 N ATOM 1555 CA LYS F 50 110.825 -5.030 12.125 1.00 0.00 C ATOM 1556 C LYS F 50 110.411 -6.216 11.274 1.00 0.00 C ATOM 1557 O LYS F 50 110.546 -7.370 11.675 1.00 0.00 O ATOM 1558 CB LYS F 50 109.624 -4.471 12.910 1.00 0.00 C ATOM 1559 CG LYS F 50 109.011 -5.551 13.814 1.00 0.00 C ATOM 1560 CD LYS F 50 107.959 -4.924 14.745 1.00 0.00 C ATOM 1561 CE LYS F 50 106.698 -4.556 13.951 1.00 0.00 C ATOM 1562 NZ LYS F 50 105.593 -4.235 14.898 1.00 0.00 N ATOM 0 H LYS F 50 110.766 -3.174 11.147 1.00 0.00 H new ATOM 0 HA LYS F 50 111.579 -5.352 12.843 1.00 0.00 H new ATOM 0 HB2 LYS F 50 109.943 -3.622 13.515 1.00 0.00 H new ATOM 0 HB3 LYS F 50 108.870 -4.102 12.215 1.00 0.00 H new ATOM 0 HG2 LYS F 50 108.551 -6.329 13.204 1.00 0.00 H new ATOM 0 HG3 LYS F 50 109.793 -6.029 14.405 1.00 0.00 H new ATOM 0 HD2 LYS F 50 107.705 -5.624 15.541 1.00 0.00 H new ATOM 0 HD3 LYS F 50 108.370 -4.034 15.222 1.00 0.00 H new ATOM 0 HE2 LYS F 50 106.898 -3.701 13.305 1.00 0.00 H new ATOM 0 HE3 LYS F 50 106.408 -5.384 13.304 1.00 0.00 H new ATOM 0 HZ1 LYS F 50 104.738 -3.985 14.362 1.00 0.00 H new ATOM 0 HZ2 LYS F 50 105.397 -5.063 15.496 1.00 0.00 H new ATOM 0 HZ3 LYS F 50 105.872 -3.432 15.498 1.00 0.00 H new ATOM 1576 N LEU F 51 109.912 -5.902 10.081 1.00 0.00 N ATOM 1577 CA LEU F 51 109.477 -6.914 9.137 1.00 0.00 C ATOM 1578 C LEU F 51 110.671 -7.756 8.713 1.00 0.00 C ATOM 1579 O LEU F 51 110.569 -8.972 8.582 1.00 0.00 O ATOM 1580 CB LEU F 51 108.849 -6.239 7.917 1.00 0.00 C ATOM 1581 CG LEU F 51 107.869 -7.200 7.252 1.00 0.00 C ATOM 1582 CD1 LEU F 51 106.676 -7.429 8.192 1.00 0.00 C ATOM 1583 CD2 LEU F 51 107.397 -6.594 5.927 1.00 0.00 C ATOM 0 H LEU F 51 109.800 -4.944 9.748 1.00 0.00 H new ATOM 0 HA LEU F 51 108.734 -7.559 9.606 1.00 0.00 H new ATOM 0 HB2 LEU F 51 108.333 -5.327 8.218 1.00 0.00 H new ATOM 0 HB3 LEU F 51 109.625 -5.947 7.210 1.00 0.00 H new ATOM 0 HG LEU F 51 108.352 -8.157 7.052 1.00 0.00 H new ATOM 0 HD11 LEU F 51 105.970 -8.115 7.724 1.00 0.00 H new ATOM 0 HD12 LEU F 51 107.029 -7.856 9.131 1.00 0.00 H new ATOM 0 HD13 LEU F 51 106.181 -6.478 8.390 1.00 0.00 H new ATOM 0 HD21 LEU F 51 106.696 -7.275 5.445 1.00 0.00 H new ATOM 0 HD22 LEU F 51 106.904 -5.641 6.118 1.00 0.00 H new ATOM 0 HD23 LEU F 51 108.255 -6.434 5.274 1.00 0.00 H new ATOM 1595 N ASN F 52 111.814 -7.083 8.540 1.00 0.00 N ATOM 1596 CA ASN F 52 113.056 -7.758 8.178 1.00 0.00 C ATOM 1597 C ASN F 52 113.381 -8.791 9.266 1.00 0.00 C ATOM 1598 O ASN F 52 113.835 -9.897 8.967 1.00 0.00 O ATOM 1599 CB ASN F 52 114.175 -6.698 8.001 1.00 0.00 C ATOM 1600 CG ASN F 52 115.488 -7.115 8.661 1.00 0.00 C ATOM 1601 OD1 ASN F 52 116.100 -8.110 8.276 1.00 0.00 O ATOM 1602 ND2 ASN F 52 115.954 -6.393 9.637 1.00 0.00 N ATOM 0 H ASN F 52 111.900 -6.072 8.646 1.00 0.00 H new ATOM 0 HA ASN F 52 112.964 -8.289 7.231 1.00 0.00 H new ATOM 0 HB2 ASN F 52 114.345 -6.528 6.938 1.00 0.00 H new ATOM 0 HB3 ASN F 52 113.844 -5.751 8.426 1.00 0.00 H new ATOM 0 HD21 ASN F 52 116.832 -6.651 10.088 1.00 0.00 H new ATOM 0 HD22 ASN F 52 115.442 -5.569 9.952 1.00 0.00 H new ATOM 1609 N ASP F 53 113.097 -8.419 10.523 1.00 0.00 N ATOM 1610 CA ASP F 53 113.308 -9.312 11.661 1.00 0.00 C ATOM 1611 C ASP F 53 112.230 -10.405 11.682 1.00 0.00 C ATOM 1612 O ASP F 53 112.499 -11.555 12.037 1.00 0.00 O ATOM 1613 CB ASP F 53 113.268 -8.516 12.970 1.00 0.00 C ATOM 1614 CG ASP F 53 113.625 -9.424 14.149 1.00 0.00 C ATOM 1615 OD1 ASP F 53 114.808 -9.602 14.399 1.00 0.00 O ATOM 1616 OD2 ASP F 53 112.713 -9.930 14.784 1.00 0.00 O ATOM 0 H ASP F 53 112.721 -7.504 10.772 1.00 0.00 H new ATOM 0 HA ASP F 53 114.287 -9.781 11.561 1.00 0.00 H new ATOM 0 HB2 ASP F 53 113.967 -7.682 12.919 1.00 0.00 H new ATOM 0 HB3 ASP F 53 112.275 -8.091 13.116 1.00 0.00 H new ATOM 1621 N ALA F 54 111.004 -10.019 11.305 1.00 0.00 N ATOM 1622 CA ALA F 54 109.863 -10.942 11.276 1.00 0.00 C ATOM 1623 C ALA F 54 109.999 -11.973 10.152 1.00 0.00 C ATOM 1624 O ALA F 54 109.552 -13.115 10.294 1.00 0.00 O ATOM 1625 CB ALA F 54 108.565 -10.149 11.084 1.00 0.00 C ATOM 0 H ALA F 54 110.777 -9.068 11.014 1.00 0.00 H new ATOM 0 HA ALA F 54 109.841 -11.477 12.226 1.00 0.00 H new ATOM 0 HB1 ALA F 54 107.719 -10.836 11.063 1.00 0.00 H new ATOM 0 HB2 ALA F 54 108.442 -9.447 11.909 1.00 0.00 H new ATOM 0 HB3 ALA F 54 108.610 -9.599 10.144 1.00 0.00 H new ATOM 1631 N GLN F 55 110.606 -11.554 9.036 1.00 0.00 N ATOM 1632 CA GLN F 55 110.797 -12.429 7.871 1.00 0.00 C ATOM 1633 C GLN F 55 112.194 -13.048 7.880 1.00 0.00 C ATOM 1634 O GLN F 55 112.535 -13.857 7.013 1.00 0.00 O ATOM 1635 CB GLN F 55 110.590 -11.627 6.577 1.00 0.00 C ATOM 1636 CG GLN F 55 109.155 -11.089 6.535 1.00 0.00 C ATOM 1637 CD GLN F 55 108.884 -10.403 5.198 1.00 0.00 C ATOM 1638 OE1 GLN F 55 108.281 -10.995 4.305 1.00 0.00 O ATOM 1639 NE2 GLN F 55 109.302 -9.184 5.003 1.00 0.00 N ATOM 0 H GLN F 55 110.975 -10.611 8.914 1.00 0.00 H new ATOM 0 HA GLN F 55 110.063 -13.234 7.920 1.00 0.00 H new ATOM 0 HB2 GLN F 55 111.301 -10.802 6.530 1.00 0.00 H new ATOM 0 HB3 GLN F 55 110.778 -12.260 5.710 1.00 0.00 H new ATOM 0 HG2 GLN F 55 108.449 -11.906 6.682 1.00 0.00 H new ATOM 0 HG3 GLN F 55 109.000 -10.383 7.351 1.00 0.00 H new ATOM 0 HE21 GLN F 55 109.802 -8.692 5.743 1.00 0.00 H new ATOM 0 HE22 GLN F 55 109.129 -8.722 4.110 1.00 0.00 H new ATOM 1648 N ALA F 56 112.989 -12.649 8.869 1.00 0.00 N ATOM 1649 CA ALA F 56 114.350 -13.130 9.021 1.00 0.00 C ATOM 1650 C ALA F 56 114.383 -14.650 9.226 1.00 0.00 C ATOM 1651 O ALA F 56 113.349 -15.279 9.472 1.00 0.00 O ATOM 1652 CB ALA F 56 115.002 -12.426 10.219 1.00 0.00 C ATOM 0 H ALA F 56 112.703 -11.982 9.586 1.00 0.00 H new ATOM 0 HA ALA F 56 114.903 -12.904 8.110 1.00 0.00 H new ATOM 0 HB1 ALA F 56 116.025 -12.783 10.338 1.00 0.00 H new ATOM 0 HB2 ALA F 56 115.011 -11.350 10.048 1.00 0.00 H new ATOM 0 HB3 ALA F 56 114.434 -12.645 11.123 1.00 0.00 H new TER 1658 ALA F 56