USER MOD reduce.3.24.130724 H: found=0, std=0, add=819, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 822 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: F 23 ASN : amide:sc= 0.899 K(o=0.38,f=-0.44) USER MOD Set 1.2: F 55 GLN : amide:sc= -0.518 K(o=0.38,f=-0.44) USER MOD Set 2.1: E 23 ASN : amide:sc= 0.483 K(o=1.2,f=-3.3) USER MOD Set 2.2: E 55 GLN : amide:sc= 0.684 K(o=1.2,f=-1.2) USER MOD Set 3.1: C 26 SER OG : rot 11:sc= 0.679 USER MOD Set 3.2: C 28 LYS NZ :NH3+ -153:sc= 1.13 (180deg=-0.497) USER MOD Single : C 16 LYS NZ :NH3+ -114:sc= -0.0414 (180deg=-1.25) USER MOD Single : C 27 ASN : amide:sc= -0.0162 X(o=-0.016,f=-0.28) USER MOD Single : C 35 MET CE :methyl -136:sc= -0.414 (180deg=-3.21!) USER MOD Single : E 18 TYR OH : rot 144:sc= 0.862 USER MOD Single : E 21 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.2) USER MOD Single : E 26 GLN :FLIP amide:sc= -0.93 F(o=-2.5!,f=-0.93) USER MOD Single : E 32 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.011) USER MOD Single : E 33 SER OG : rot 170:sc= 0 USER MOD Single : E 35 HIS : no HD1:sc= -1.23 X(o=-1.2,f=-0.97) USER MOD Single : E 39 SER OG : rot 180:sc= 0 USER MOD Single : E 40 GLN : amide:sc= -0.145 X(o=-0.15,f=-0.22) USER MOD Single : E 41 SER OG : rot 83:sc= 0.213 USER MOD Single : E 43 ASN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : E 49 LYS NZ :NH3+ -179:sc= -0.73 (180deg=-0.782) USER MOD Single : E 50 LYS NZ :NH3+ 166:sc=-0.00172 (180deg=-0.266) USER MOD Single : E 52 ASN : amide:sc= -0.0992 K(o=-0.099,f=-1.9!) USER MOD Single : F 18 TYR OH : rot -77:sc= 0.518 USER MOD Single : F 21 ASN : amide:sc= -1.17 X(o=-1.2,f=-1.3) USER MOD Single : F 26 GLN :FLIP amide:sc= -0.303 F(o=-1.3,f=-0.3) USER MOD Single : F 32 HIS : no HE2:sc= 0.00143 K(o=0.0014,f=-2.8) USER MOD Single : F 33 SER OG : rot 180:sc= 0 USER MOD Single : F 35 HIS : no HD1:sc= -0.428 K(o=-0.43,f=-1.2) USER MOD Single : F 39 SER OG : rot 180:sc= 0 USER MOD Single : F 40 GLN : amide:sc= 0.124 X(o=0.12,f=0) USER MOD Single : F 41 SER OG : rot -103:sc= 1.15 USER MOD Single : F 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : F 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : F 50 LYS NZ :NH3+ 174:sc= 1.09 (180deg=1.05) USER MOD Single : F 52 ASN : amide:sc= 0.51 K(o=0.51,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS C 16 125.858 -9.244 -3.897 1.00 0.00 N ATOM 2 CA LYS C 16 124.683 -9.143 -3.034 1.00 0.00 C ATOM 3 C LYS C 16 124.102 -7.731 -3.034 1.00 0.00 C ATOM 4 O LYS C 16 124.835 -6.740 -2.980 1.00 0.00 O ATOM 5 CB LYS C 16 125.063 -9.606 -1.617 1.00 0.00 C ATOM 6 CG LYS C 16 125.875 -8.526 -0.892 1.00 0.00 C ATOM 7 CD LYS C 16 124.920 -7.658 -0.061 1.00 0.00 C ATOM 8 CE LYS C 16 124.875 -8.151 1.395 1.00 0.00 C ATOM 9 NZ LYS C 16 123.647 -8.971 1.611 1.00 0.00 N ATOM 0 HA LYS C 16 123.898 -9.793 -3.421 1.00 0.00 H new ATOM 0 HB2 LYS C 16 124.161 -9.832 -1.049 1.00 0.00 H new ATOM 0 HB3 LYS C 16 125.643 -10.527 -1.674 1.00 0.00 H new ATOM 0 HG2 LYS C 16 126.623 -8.987 -0.247 1.00 0.00 H new ATOM 0 HG3 LYS C 16 126.412 -7.910 -1.614 1.00 0.00 H new ATOM 0 HD2 LYS C 16 125.246 -6.618 -0.089 1.00 0.00 H new ATOM 0 HD3 LYS C 16 123.920 -7.690 -0.493 1.00 0.00 H new ATOM 0 HE2 LYS C 16 125.763 -8.743 1.616 1.00 0.00 H new ATOM 0 HE3 LYS C 16 124.881 -7.301 2.077 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 123.016 -8.482 2.277 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 123.156 -9.106 0.704 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 123.912 -9.897 2.002 1.00 0.00 H new ATOM 23 N LEU C 17 122.771 -7.665 -3.093 1.00 0.00 N ATOM 24 CA LEU C 17 122.052 -6.391 -3.092 1.00 0.00 C ATOM 25 C LEU C 17 121.225 -6.258 -1.822 1.00 0.00 C ATOM 26 O LEU C 17 120.523 -7.194 -1.429 1.00 0.00 O ATOM 27 CB LEU C 17 121.113 -6.286 -4.306 1.00 0.00 C ATOM 28 CG LEU C 17 121.840 -5.700 -5.532 1.00 0.00 C ATOM 29 CD1 LEU C 17 122.417 -4.310 -5.221 1.00 0.00 C ATOM 30 CD2 LEU C 17 122.958 -6.650 -5.990 1.00 0.00 C ATOM 0 H LEU C 17 122.166 -8.485 -3.142 1.00 0.00 H new ATOM 0 HA LEU C 17 122.792 -5.592 -3.142 1.00 0.00 H new ATOM 0 HB2 LEU C 17 120.721 -7.273 -4.551 1.00 0.00 H new ATOM 0 HB3 LEU C 17 120.259 -5.658 -4.054 1.00 0.00 H new ATOM 0 HG LEU C 17 121.114 -5.592 -6.338 1.00 0.00 H new ATOM 0 HD11 LEU C 17 122.924 -3.921 -6.104 1.00 0.00 H new ATOM 0 HD12 LEU C 17 121.609 -3.635 -4.940 1.00 0.00 H new ATOM 0 HD13 LEU C 17 123.128 -4.387 -4.398 1.00 0.00 H new ATOM 0 HD21 LEU C 17 123.464 -6.225 -6.857 1.00 0.00 H new ATOM 0 HD22 LEU C 17 123.676 -6.784 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU C 17 122.528 -7.615 -6.258 1.00 0.00 H new ATOM 42 N VAL C 18 121.299 -5.081 -1.206 1.00 0.00 N ATOM 43 CA VAL C 18 120.541 -4.800 0.013 1.00 0.00 C ATOM 44 C VAL C 18 119.842 -3.460 -0.136 1.00 0.00 C ATOM 45 O VAL C 18 120.495 -2.459 -0.411 1.00 0.00 O ATOM 46 CB VAL C 18 121.477 -4.757 1.231 1.00 0.00 C ATOM 47 CG1 VAL C 18 120.640 -4.636 2.516 1.00 0.00 C ATOM 48 CG2 VAL C 18 122.327 -6.038 1.276 1.00 0.00 C ATOM 0 H VAL C 18 121.876 -4.305 -1.530 1.00 0.00 H new ATOM 0 HA VAL C 18 119.807 -5.591 0.166 1.00 0.00 H new ATOM 0 HB VAL C 18 122.139 -3.895 1.152 1.00 0.00 H new ATOM 0 HG11 VAL C 18 121.303 -4.605 3.381 1.00 0.00 H new ATOM 0 HG12 VAL C 18 120.048 -3.721 2.480 1.00 0.00 H new ATOM 0 HG13 VAL C 18 119.975 -5.495 2.599 1.00 0.00 H new ATOM 0 HG21 VAL C 18 122.990 -6.005 2.141 1.00 0.00 H new ATOM 0 HG22 VAL C 18 121.673 -6.906 1.354 1.00 0.00 H new ATOM 0 HG23 VAL C 18 122.922 -6.112 0.366 1.00 0.00 H new ATOM 58 N PHE C 19 118.523 -3.444 0.065 1.00 0.00 N ATOM 59 CA PHE C 19 117.754 -2.213 -0.040 1.00 0.00 C ATOM 60 C PHE C 19 117.555 -1.631 1.340 1.00 0.00 C ATOM 61 O PHE C 19 117.093 -2.316 2.254 1.00 0.00 O ATOM 62 CB PHE C 19 116.384 -2.470 -0.694 1.00 0.00 C ATOM 63 CG PHE C 19 116.394 -1.920 -2.101 1.00 0.00 C ATOM 64 CD1 PHE C 19 117.206 -2.527 -3.067 1.00 0.00 C ATOM 65 CD2 PHE C 19 115.613 -0.797 -2.438 1.00 0.00 C ATOM 66 CE1 PHE C 19 117.242 -2.024 -4.367 1.00 0.00 C ATOM 67 CE2 PHE C 19 115.658 -0.296 -3.746 1.00 0.00 C ATOM 68 CZ PHE C 19 116.471 -0.912 -4.708 1.00 0.00 C ATOM 0 H PHE C 19 117.971 -4.269 0.300 1.00 0.00 H new ATOM 0 HA PHE C 19 118.305 -1.512 -0.667 1.00 0.00 H new ATOM 0 HB2 PHE C 19 116.170 -3.539 -0.710 1.00 0.00 H new ATOM 0 HB3 PHE C 19 115.595 -1.996 -0.111 1.00 0.00 H new ATOM 0 HD1 PHE C 19 117.805 -3.386 -2.805 1.00 0.00 H new ATOM 0 HD2 PHE C 19 114.986 -0.327 -1.695 1.00 0.00 H new ATOM 0 HE1 PHE C 19 117.867 -2.496 -5.111 1.00 0.00 H new ATOM 0 HE2 PHE C 19 115.065 0.566 -4.014 1.00 0.00 H new ATOM 0 HZ PHE C 19 116.501 -0.525 -5.716 1.00 0.00 H new ATOM 78 N PHE C 20 117.913 -0.364 1.476 1.00 0.00 N ATOM 79 CA PHE C 20 117.782 0.329 2.755 1.00 0.00 C ATOM 80 C PHE C 20 117.255 1.745 2.573 1.00 0.00 C ATOM 81 O PHE C 20 117.416 2.353 1.511 1.00 0.00 O ATOM 82 CB PHE C 20 119.134 0.373 3.469 1.00 0.00 C ATOM 83 CG PHE C 20 120.112 1.193 2.675 1.00 0.00 C ATOM 84 CD1 PHE C 20 120.126 2.586 2.808 1.00 0.00 C ATOM 85 CD2 PHE C 20 120.996 0.562 1.801 1.00 0.00 C ATOM 86 CE1 PHE C 20 121.026 3.345 2.066 1.00 0.00 C ATOM 87 CE2 PHE C 20 121.892 1.319 1.060 1.00 0.00 C ATOM 88 CZ PHE C 20 121.911 2.714 1.189 1.00 0.00 C ATOM 0 H PHE C 20 118.295 0.206 0.722 1.00 0.00 H new ATOM 0 HA PHE C 20 117.064 -0.226 3.360 1.00 0.00 H new ATOM 0 HB2 PHE C 20 119.014 0.800 4.465 1.00 0.00 H new ATOM 0 HB3 PHE C 20 119.518 -0.639 3.600 1.00 0.00 H new ATOM 0 HD1 PHE C 20 119.439 3.071 3.486 1.00 0.00 H new ATOM 0 HD2 PHE C 20 120.983 -0.513 1.701 1.00 0.00 H new ATOM 0 HE1 PHE C 20 121.040 4.420 2.168 1.00 0.00 H new ATOM 0 HE2 PHE C 20 122.577 0.832 0.382 1.00 0.00 H new ATOM 0 HZ PHE C 20 122.609 3.301 0.611 1.00 0.00 H new ATOM 98 N ALA C 21 116.653 2.267 3.640 1.00 0.00 N ATOM 99 CA ALA C 21 116.125 3.622 3.640 1.00 0.00 C ATOM 100 C ALA C 21 116.803 4.415 4.751 1.00 0.00 C ATOM 101 O ALA C 21 116.923 3.924 5.877 1.00 0.00 O ATOM 102 CB ALA C 21 114.616 3.584 3.855 1.00 0.00 C ATOM 0 H ALA C 21 116.520 1.766 4.518 1.00 0.00 H new ATOM 0 HA ALA C 21 116.325 4.102 2.682 1.00 0.00 H new ATOM 0 HB1 ALA C 21 114.223 4.601 3.855 1.00 0.00 H new ATOM 0 HB2 ALA C 21 114.148 3.014 3.052 1.00 0.00 H new ATOM 0 HB3 ALA C 21 114.397 3.110 4.812 1.00 0.00 H new ATOM 108 N GLU C 22 117.253 5.634 4.431 1.00 0.00 N ATOM 109 CA GLU C 22 117.931 6.482 5.418 1.00 0.00 C ATOM 110 C GLU C 22 117.086 7.697 5.748 1.00 0.00 C ATOM 111 O GLU C 22 116.731 8.457 4.855 1.00 0.00 O ATOM 112 CB GLU C 22 119.303 6.955 4.900 1.00 0.00 C ATOM 113 CG GLU C 22 119.257 7.290 3.408 1.00 0.00 C ATOM 114 CD GLU C 22 120.412 8.236 3.065 1.00 0.00 C ATOM 115 OE1 GLU C 22 121.554 7.814 3.176 1.00 0.00 O ATOM 116 OE2 GLU C 22 120.142 9.371 2.710 1.00 0.00 O ATOM 0 H GLU C 22 117.161 6.052 3.505 1.00 0.00 H new ATOM 0 HA GLU C 22 118.077 5.881 6.315 1.00 0.00 H new ATOM 0 HB2 GLU C 22 119.621 7.834 5.461 1.00 0.00 H new ATOM 0 HB3 GLU C 22 120.047 6.178 5.076 1.00 0.00 H new ATOM 0 HG2 GLU C 22 119.331 6.378 2.816 1.00 0.00 H new ATOM 0 HG3 GLU C 22 118.304 7.756 3.157 1.00 0.00 H new ATOM 123 N ASP C 23 116.803 7.889 7.037 1.00 0.00 N ATOM 124 CA ASP C 23 116.024 9.036 7.473 1.00 0.00 C ATOM 125 C ASP C 23 116.875 10.277 7.273 1.00 0.00 C ATOM 126 O ASP C 23 117.984 10.376 7.804 1.00 0.00 O ATOM 127 CB ASP C 23 115.615 8.895 8.951 1.00 0.00 C ATOM 128 CG ASP C 23 114.505 9.896 9.326 1.00 0.00 C ATOM 129 OD1 ASP C 23 114.431 10.962 8.723 1.00 0.00 O ATOM 130 OD2 ASP C 23 113.746 9.585 10.231 1.00 0.00 O ATOM 0 H ASP C 23 117.101 7.267 7.788 1.00 0.00 H new ATOM 0 HA ASP C 23 115.106 9.106 6.890 1.00 0.00 H new ATOM 0 HB2 ASP C 23 115.269 7.879 9.139 1.00 0.00 H new ATOM 0 HB3 ASP C 23 116.484 9.058 9.588 1.00 0.00 H new ATOM 135 N VAL C 24 116.366 11.183 6.454 1.00 0.00 N ATOM 136 CA VAL C 24 117.089 12.409 6.101 1.00 0.00 C ATOM 137 C VAL C 24 116.436 13.681 6.669 1.00 0.00 C ATOM 138 O VAL C 24 116.855 14.794 6.339 1.00 0.00 O ATOM 139 CB VAL C 24 117.249 12.446 4.565 1.00 0.00 C ATOM 140 CG1 VAL C 24 118.296 11.390 4.179 1.00 0.00 C ATOM 141 CG2 VAL C 24 115.903 12.119 3.877 1.00 0.00 C ATOM 0 H VAL C 24 115.449 11.098 6.015 1.00 0.00 H new ATOM 0 HA VAL C 24 118.074 12.391 6.566 1.00 0.00 H new ATOM 0 HB VAL C 24 117.564 13.439 4.244 1.00 0.00 H new ATOM 0 HG11 VAL C 24 118.432 11.391 3.098 1.00 0.00 H new ATOM 0 HG12 VAL C 24 119.244 11.623 4.664 1.00 0.00 H new ATOM 0 HG13 VAL C 24 117.956 10.406 4.501 1.00 0.00 H new ATOM 0 HG21 VAL C 24 116.031 12.149 2.795 1.00 0.00 H new ATOM 0 HG22 VAL C 24 115.574 11.124 4.176 1.00 0.00 H new ATOM 0 HG23 VAL C 24 115.155 12.854 4.174 1.00 0.00 H new ATOM 151 N GLY C 25 115.462 13.502 7.576 1.00 0.00 N ATOM 152 CA GLY C 25 114.798 14.629 8.257 1.00 0.00 C ATOM 153 C GLY C 25 113.913 15.482 7.343 1.00 0.00 C ATOM 154 O GLY C 25 112.787 15.823 7.717 1.00 0.00 O ATOM 0 H GLY C 25 115.115 12.585 7.856 1.00 0.00 H new ATOM 0 HA2 GLY C 25 114.189 14.238 9.072 1.00 0.00 H new ATOM 0 HA3 GLY C 25 115.559 15.267 8.706 1.00 0.00 H new ATOM 158 N SER C 26 114.434 15.847 6.168 1.00 0.00 N ATOM 159 CA SER C 26 113.697 16.689 5.214 1.00 0.00 C ATOM 160 C SER C 26 112.351 16.068 4.834 1.00 0.00 C ATOM 161 O SER C 26 112.042 14.937 5.220 1.00 0.00 O ATOM 162 CB SER C 26 114.543 16.900 3.954 1.00 0.00 C ATOM 163 OG SER C 26 114.753 15.650 3.307 1.00 0.00 O ATOM 0 H SER C 26 115.364 15.573 5.852 1.00 0.00 H new ATOM 0 HA SER C 26 113.499 17.647 5.695 1.00 0.00 H new ATOM 0 HB2 SER C 26 114.041 17.591 3.278 1.00 0.00 H new ATOM 0 HB3 SER C 26 115.500 17.350 4.217 1.00 0.00 H new ATOM 0 HG SER C 26 114.173 14.971 3.711 1.00 0.00 H new ATOM 169 N ASN C 27 111.553 16.825 4.058 1.00 0.00 N ATOM 170 CA ASN C 27 110.224 16.368 3.600 1.00 0.00 C ATOM 171 C ASN C 27 110.310 15.007 2.908 1.00 0.00 C ATOM 172 O ASN C 27 109.338 14.251 2.871 1.00 0.00 O ATOM 173 CB ASN C 27 109.610 17.400 2.640 1.00 0.00 C ATOM 174 CG ASN C 27 109.420 18.747 3.343 1.00 0.00 C ATOM 175 OD1 ASN C 27 108.935 18.802 4.473 1.00 0.00 O ATOM 176 ND2 ASN C 27 109.775 19.845 2.734 1.00 0.00 N ATOM 0 H ASN C 27 111.805 17.759 3.733 1.00 0.00 H new ATOM 0 HA ASN C 27 109.587 16.264 4.479 1.00 0.00 H new ATOM 0 HB2 ASN C 27 110.256 17.526 1.771 1.00 0.00 H new ATOM 0 HB3 ASN C 27 108.650 17.037 2.273 1.00 0.00 H new ATOM 0 HD21 ASN C 27 109.650 20.747 3.194 1.00 0.00 H new ATOM 0 HD22 ASN C 27 110.177 19.802 1.798 1.00 0.00 H new ATOM 183 N LYS C 28 111.496 14.718 2.390 1.00 0.00 N ATOM 184 CA LYS C 28 111.777 13.461 1.716 1.00 0.00 C ATOM 185 C LYS C 28 111.521 12.274 2.652 1.00 0.00 C ATOM 186 O LYS C 28 111.271 11.156 2.192 1.00 0.00 O ATOM 187 CB LYS C 28 113.240 13.463 1.268 1.00 0.00 C ATOM 188 CG LYS C 28 113.491 14.668 0.344 1.00 0.00 C ATOM 189 CD LYS C 28 114.784 14.467 -0.467 1.00 0.00 C ATOM 190 CE LYS C 28 116.014 14.571 0.444 1.00 0.00 C ATOM 191 NZ LYS C 28 116.127 15.962 0.973 1.00 0.00 N ATOM 0 H LYS C 28 112.293 15.353 2.427 1.00 0.00 H new ATOM 0 HA LYS C 28 111.119 13.360 0.853 1.00 0.00 H new ATOM 0 HB2 LYS C 28 113.897 13.513 2.136 1.00 0.00 H new ATOM 0 HB3 LYS C 28 113.473 12.535 0.745 1.00 0.00 H new ATOM 0 HG2 LYS C 28 112.647 14.796 -0.333 1.00 0.00 H new ATOM 0 HG3 LYS C 28 113.565 15.579 0.937 1.00 0.00 H new ATOM 0 HD2 LYS C 28 114.767 13.492 -0.954 1.00 0.00 H new ATOM 0 HD3 LYS C 28 114.845 15.216 -1.256 1.00 0.00 H new ATOM 0 HE2 LYS C 28 115.930 13.863 1.268 1.00 0.00 H new ATOM 0 HE3 LYS C 28 116.914 14.308 -0.111 1.00 0.00 H new ATOM 0 HZ1 LYS C 28 117.123 16.173 1.186 1.00 0.00 H new ATOM 0 HZ2 LYS C 28 115.776 16.634 0.261 1.00 0.00 H new ATOM 0 HZ3 LYS C 28 115.561 16.050 1.841 1.00 0.00 H new ATOM 205 N GLY C 29 111.610 12.529 3.965 1.00 0.00 N ATOM 206 CA GLY C 29 111.417 11.487 4.972 1.00 0.00 C ATOM 207 C GLY C 29 112.665 10.627 5.024 1.00 0.00 C ATOM 208 O GLY C 29 113.540 10.830 5.872 1.00 0.00 O ATOM 0 H GLY C 29 111.815 13.451 4.351 1.00 0.00 H new ATOM 0 HA2 GLY C 29 111.225 11.934 5.947 1.00 0.00 H new ATOM 0 HA3 GLY C 29 110.548 10.878 4.724 1.00 0.00 H new ATOM 212 N ALA C 30 112.753 9.696 4.076 1.00 0.00 N ATOM 213 CA ALA C 30 113.910 8.820 3.952 1.00 0.00 C ATOM 214 C ALA C 30 114.287 8.672 2.480 1.00 0.00 C ATOM 215 O ALA C 30 113.480 8.979 1.594 1.00 0.00 O ATOM 216 CB ALA C 30 113.624 7.450 4.562 1.00 0.00 C ATOM 0 H ALA C 30 112.028 9.530 3.378 1.00 0.00 H new ATOM 0 HA ALA C 30 114.743 9.265 4.496 1.00 0.00 H new ATOM 0 HB1 ALA C 30 114.503 6.814 4.457 1.00 0.00 H new ATOM 0 HB2 ALA C 30 113.384 7.565 5.619 1.00 0.00 H new ATOM 0 HB3 ALA C 30 112.781 6.991 4.046 1.00 0.00 H new ATOM 222 N ILE C 31 115.513 8.205 2.223 1.00 0.00 N ATOM 223 CA ILE C 31 115.991 8.028 0.845 1.00 0.00 C ATOM 224 C ILE C 31 116.253 6.563 0.563 1.00 0.00 C ATOM 225 O ILE C 31 116.971 5.907 1.320 1.00 0.00 O ATOM 226 CB ILE C 31 117.306 8.790 0.597 1.00 0.00 C ATOM 227 CG1 ILE C 31 117.229 10.215 1.168 1.00 0.00 C ATOM 228 CG2 ILE C 31 117.557 8.871 -0.909 1.00 0.00 C ATOM 229 CD1 ILE C 31 118.384 11.074 0.614 1.00 0.00 C ATOM 0 H ILE C 31 116.188 7.945 2.942 1.00 0.00 H new ATOM 0 HA ILE C 31 115.213 8.418 0.190 1.00 0.00 H new ATOM 0 HB ILE C 31 118.118 8.258 1.093 1.00 0.00 H new ATOM 0 HG12 ILE C 31 116.272 10.668 0.908 1.00 0.00 H new ATOM 0 HG13 ILE C 31 117.280 10.182 2.256 1.00 0.00 H new ATOM 0 HG21 ILE C 31 118.487 9.409 -1.095 1.00 0.00 H new ATOM 0 HG22 ILE C 31 117.632 7.864 -1.320 1.00 0.00 H new ATOM 0 HG23 ILE C 31 116.731 9.397 -1.388 1.00 0.00 H new ATOM 0 HD11 ILE C 31 118.318 12.081 1.026 1.00 0.00 H new ATOM 0 HD12 ILE C 31 119.337 10.628 0.897 1.00 0.00 H new ATOM 0 HD13 ILE C 31 118.314 11.121 -0.473 1.00 0.00 H new ATOM 241 N ILE C 32 115.712 6.068 -0.550 1.00 0.00 N ATOM 242 CA ILE C 32 115.936 4.690 -0.940 1.00 0.00 C ATOM 243 C ILE C 32 117.299 4.585 -1.589 1.00 0.00 C ATOM 244 O ILE C 32 117.557 5.195 -2.629 1.00 0.00 O ATOM 245 CB ILE C 32 114.835 4.187 -1.908 1.00 0.00 C ATOM 246 CG1 ILE C 32 113.707 3.525 -1.099 1.00 0.00 C ATOM 247 CG2 ILE C 32 115.392 3.158 -2.916 1.00 0.00 C ATOM 248 CD1 ILE C 32 114.229 2.264 -0.380 1.00 0.00 C ATOM 0 H ILE C 32 115.121 6.601 -1.188 1.00 0.00 H new ATOM 0 HA ILE C 32 115.895 4.060 -0.052 1.00 0.00 H new ATOM 0 HB ILE C 32 114.459 5.047 -2.462 1.00 0.00 H new ATOM 0 HG12 ILE C 32 113.313 4.231 -0.368 1.00 0.00 H new ATOM 0 HG13 ILE C 32 112.884 3.259 -1.762 1.00 0.00 H new ATOM 0 HG21 ILE C 32 114.592 2.828 -3.578 1.00 0.00 H new ATOM 0 HG22 ILE C 32 116.184 3.619 -3.506 1.00 0.00 H new ATOM 0 HG23 ILE C 32 115.793 2.300 -2.376 1.00 0.00 H new ATOM 0 HD11 ILE C 32 113.419 1.807 0.188 1.00 0.00 H new ATOM 0 HD12 ILE C 32 114.601 1.553 -1.117 1.00 0.00 H new ATOM 0 HD13 ILE C 32 115.037 2.540 0.298 1.00 0.00 H new ATOM 260 N GLY C 33 118.142 3.779 -0.970 1.00 0.00 N ATOM 261 CA GLY C 33 119.481 3.520 -1.462 1.00 0.00 C ATOM 262 C GLY C 33 119.782 2.056 -1.239 1.00 0.00 C ATOM 263 O GLY C 33 119.239 1.449 -0.311 1.00 0.00 O ATOM 0 H GLY C 33 117.915 3.284 -0.108 1.00 0.00 H new ATOM 0 HA2 GLY C 33 119.553 3.767 -2.521 1.00 0.00 H new ATOM 0 HA3 GLY C 33 120.207 4.143 -0.939 1.00 0.00 H new ATOM 267 N LEU C 34 120.623 1.481 -2.085 1.00 0.00 N ATOM 268 CA LEU C 34 120.955 0.065 -1.947 1.00 0.00 C ATOM 269 C LEU C 34 122.448 -0.156 -1.887 1.00 0.00 C ATOM 270 O LEU C 34 123.240 0.658 -2.353 1.00 0.00 O ATOM 271 CB LEU C 34 120.373 -0.760 -3.094 1.00 0.00 C ATOM 272 CG LEU C 34 120.650 -0.072 -4.430 1.00 0.00 C ATOM 273 CD1 LEU C 34 120.925 -1.141 -5.495 1.00 0.00 C ATOM 274 CD2 LEU C 34 119.442 0.800 -4.821 1.00 0.00 C ATOM 0 H LEU C 34 121.082 1.958 -2.861 1.00 0.00 H new ATOM 0 HA LEU C 34 120.511 -0.265 -1.008 1.00 0.00 H new ATOM 0 HB2 LEU C 34 120.811 -1.758 -3.093 1.00 0.00 H new ATOM 0 HB3 LEU C 34 119.299 -0.883 -2.955 1.00 0.00 H new ATOM 0 HG LEU C 34 121.524 0.574 -4.348 1.00 0.00 H new ATOM 0 HD11 LEU C 34 121.124 -0.659 -6.452 1.00 0.00 H new ATOM 0 HD12 LEU C 34 121.791 -1.734 -5.201 1.00 0.00 H new ATOM 0 HD13 LEU C 34 120.056 -1.792 -5.590 1.00 0.00 H new ATOM 0 HD21 LEU C 34 119.640 1.290 -5.774 1.00 0.00 H new ATOM 0 HD22 LEU C 34 118.555 0.173 -4.913 1.00 0.00 H new ATOM 0 HD23 LEU C 34 119.274 1.555 -4.053 1.00 0.00 H new ATOM 286 N MET C 35 122.797 -1.288 -1.308 1.00 0.00 N ATOM 287 CA MET C 35 124.194 -1.698 -1.158 1.00 0.00 C ATOM 288 C MET C 35 124.521 -2.751 -2.220 1.00 0.00 C ATOM 289 O MET C 35 123.647 -3.528 -2.609 1.00 0.00 O ATOM 290 CB MET C 35 124.434 -2.213 0.286 1.00 0.00 C ATOM 291 CG MET C 35 124.820 -3.701 0.308 1.00 0.00 C ATOM 292 SD MET C 35 124.830 -4.305 2.008 1.00 0.00 S ATOM 293 CE MET C 35 126.199 -3.283 2.582 1.00 0.00 C ATOM 0 H MET C 35 122.126 -1.955 -0.926 1.00 0.00 H new ATOM 0 HA MET C 35 124.864 -0.852 -1.312 1.00 0.00 H new ATOM 0 HB2 MET C 35 125.224 -1.626 0.754 1.00 0.00 H new ATOM 0 HB3 MET C 35 123.532 -2.063 0.879 1.00 0.00 H new ATOM 0 HG2 MET C 35 124.113 -4.278 -0.288 1.00 0.00 H new ATOM 0 HG3 MET C 35 125.803 -3.838 -0.142 1.00 0.00 H new ATOM 0 HE1 MET C 35 126.875 -3.887 3.187 1.00 0.00 H new ATOM 0 HE2 MET C 35 126.739 -2.883 1.724 1.00 0.00 H new ATOM 0 HE3 MET C 35 125.812 -2.460 3.183 1.00 0.00 H new ATOM 303 N VAL C 36 125.768 -2.747 -2.704 1.00 0.00 N ATOM 304 CA VAL C 36 126.184 -3.689 -3.749 1.00 0.00 C ATOM 305 C VAL C 36 127.473 -4.427 -3.369 1.00 0.00 C ATOM 306 O VAL C 36 128.496 -3.796 -3.087 1.00 0.00 O ATOM 307 CB VAL C 36 126.431 -2.929 -5.069 1.00 0.00 C ATOM 308 CG1 VAL C 36 126.423 -3.918 -6.239 1.00 0.00 C ATOM 309 CG2 VAL C 36 125.350 -1.857 -5.299 1.00 0.00 C ATOM 0 H VAL C 36 126.500 -2.109 -2.393 1.00 0.00 H new ATOM 0 HA VAL C 36 125.383 -4.419 -3.866 1.00 0.00 H new ATOM 0 HB VAL C 36 127.401 -2.435 -5.005 1.00 0.00 H new ATOM 0 HG11 VAL C 36 126.598 -3.380 -7.171 1.00 0.00 H new ATOM 0 HG12 VAL C 36 127.209 -4.659 -6.095 1.00 0.00 H new ATOM 0 HG13 VAL C 36 125.456 -4.419 -6.285 1.00 0.00 H new ATOM 0 HG21 VAL C 36 125.548 -1.336 -6.236 1.00 0.00 H new ATOM 0 HG22 VAL C 36 124.370 -2.333 -5.348 1.00 0.00 H new ATOM 0 HG23 VAL C 36 125.366 -1.142 -4.476 1.00 0.00 H new ATOM 319 N GLY C 37 127.416 -5.765 -3.420 1.00 0.00 N ATOM 320 CA GLY C 37 128.578 -6.613 -3.138 1.00 0.00 C ATOM 321 C GLY C 37 129.034 -6.555 -1.683 1.00 0.00 C ATOM 322 O GLY C 37 129.259 -5.478 -1.129 1.00 0.00 O ATOM 0 H GLY C 37 126.570 -6.284 -3.656 1.00 0.00 H new ATOM 0 HA2 GLY C 37 128.336 -7.645 -3.394 1.00 0.00 H new ATOM 0 HA3 GLY C 37 129.404 -6.310 -3.782 1.00 0.00 H new ATOM 326 N GLY C 38 129.192 -7.740 -1.080 1.00 0.00 N ATOM 327 CA GLY C 38 129.650 -7.845 0.304 1.00 0.00 C ATOM 328 C GLY C 38 128.589 -7.353 1.276 1.00 0.00 C ATOM 329 O GLY C 38 127.557 -6.814 0.869 1.00 0.00 O ATOM 0 H GLY C 38 129.009 -8.636 -1.531 1.00 0.00 H new ATOM 0 HA2 GLY C 38 129.900 -8.882 0.529 1.00 0.00 H new ATOM 0 HA3 GLY C 38 130.562 -7.262 0.433 1.00 0.00 H new ATOM 333 N VAL C 39 128.857 -7.539 2.568 1.00 0.00 N ATOM 334 CA VAL C 39 127.928 -7.114 3.612 1.00 0.00 C ATOM 335 C VAL C 39 128.646 -6.236 4.647 1.00 0.00 C ATOM 336 O VAL C 39 129.824 -6.455 4.948 1.00 0.00 O ATOM 337 CB VAL C 39 127.298 -8.353 4.286 1.00 0.00 C ATOM 338 CG1 VAL C 39 128.381 -9.207 4.968 1.00 0.00 C ATOM 339 CG2 VAL C 39 126.252 -7.912 5.326 1.00 0.00 C ATOM 0 H VAL C 39 129.708 -7.980 2.915 1.00 0.00 H new ATOM 0 HA VAL C 39 127.134 -6.519 3.160 1.00 0.00 H new ATOM 0 HB VAL C 39 126.811 -8.954 3.518 1.00 0.00 H new ATOM 0 HG11 VAL C 39 127.918 -10.075 5.437 1.00 0.00 H new ATOM 0 HG12 VAL C 39 129.104 -9.540 4.224 1.00 0.00 H new ATOM 0 HG13 VAL C 39 128.889 -8.612 5.727 1.00 0.00 H new ATOM 0 HG21 VAL C 39 125.813 -8.792 5.796 1.00 0.00 H new ATOM 0 HG22 VAL C 39 126.732 -7.296 6.086 1.00 0.00 H new ATOM 0 HG23 VAL C 39 125.469 -7.336 4.833 1.00 0.00 H new ATOM 349 N VAL C 40 127.921 -5.245 5.181 1.00 0.00 N ATOM 350 CA VAL C 40 128.475 -4.326 6.183 1.00 0.00 C ATOM 351 C VAL C 40 128.155 -4.810 7.606 1.00 0.00 C ATOM 352 O VAL C 40 127.039 -5.256 7.829 1.00 0.00 O ATOM 353 CB VAL C 40 127.920 -2.901 5.955 1.00 0.00 C ATOM 354 CG1 VAL C 40 126.391 -2.866 6.153 1.00 0.00 C ATOM 355 CG2 VAL C 40 128.586 -1.918 6.935 1.00 0.00 C ATOM 356 OXT VAL C 40 129.031 -4.725 8.453 1.00 0.00 O ATOM 0 H VAL C 40 126.949 -5.059 4.936 1.00 0.00 H new ATOM 0 HA VAL C 40 129.559 -4.304 6.073 1.00 0.00 H new ATOM 0 HB VAL C 40 128.145 -2.608 4.929 1.00 0.00 H new ATOM 0 HG11 VAL C 40 126.026 -1.853 5.987 1.00 0.00 H new ATOM 0 HG12 VAL C 40 125.917 -3.544 5.443 1.00 0.00 H new ATOM 0 HG13 VAL C 40 126.148 -3.177 7.169 1.00 0.00 H new ATOM 0 HG21 VAL C 40 128.191 -0.916 6.770 1.00 0.00 H new ATOM 0 HG22 VAL C 40 128.376 -2.227 7.959 1.00 0.00 H new ATOM 0 HG23 VAL C 40 129.664 -1.915 6.771 1.00 0.00 H new TER 366 VAL C 40 ATOM 367 N GLY E 14 131.593 -2.218 0.432 1.00 0.00 N ATOM 368 CA GLY E 14 130.843 -2.413 -0.811 1.00 0.00 C ATOM 369 C GLY E 14 130.398 -1.074 -1.400 1.00 0.00 C ATOM 370 O GLY E 14 130.442 -0.040 -0.726 1.00 0.00 O ATOM 0 HA2 GLY E 14 131.462 -2.944 -1.534 1.00 0.00 H new ATOM 0 HA3 GLY E 14 129.971 -3.038 -0.619 1.00 0.00 H new ATOM 374 N GLU E 15 129.946 -1.112 -2.657 1.00 0.00 N ATOM 375 CA GLU E 15 129.466 0.088 -3.340 1.00 0.00 C ATOM 376 C GLU E 15 128.012 0.326 -2.955 1.00 0.00 C ATOM 377 O GLU E 15 127.200 -0.591 -3.026 1.00 0.00 O ATOM 378 CB GLU E 15 129.598 -0.098 -4.869 1.00 0.00 C ATOM 379 CG GLU E 15 129.108 1.161 -5.620 1.00 0.00 C ATOM 380 CD GLU E 15 129.191 0.977 -7.147 1.00 0.00 C ATOM 381 OE1 GLU E 15 130.096 0.297 -7.613 1.00 0.00 O ATOM 382 OE2 GLU E 15 128.341 1.528 -7.834 1.00 0.00 O ATOM 0 H GLU E 15 129.903 -1.961 -3.220 1.00 0.00 H new ATOM 0 HA GLU E 15 130.061 0.952 -3.044 1.00 0.00 H new ATOM 0 HB2 GLU E 15 130.638 -0.299 -5.127 1.00 0.00 H new ATOM 0 HB3 GLU E 15 129.018 -0.965 -5.186 1.00 0.00 H new ATOM 0 HG2 GLU E 15 128.079 1.379 -5.334 1.00 0.00 H new ATOM 0 HG3 GLU E 15 129.710 2.020 -5.323 1.00 0.00 H new ATOM 389 N ILE E 16 127.694 1.561 -2.551 1.00 0.00 N ATOM 390 CA ILE E 16 126.325 1.902 -2.158 1.00 0.00 C ATOM 391 C ILE E 16 125.728 2.909 -3.149 1.00 0.00 C ATOM 392 O ILE E 16 126.319 3.953 -3.437 1.00 0.00 O ATOM 393 CB ILE E 16 126.299 2.438 -0.711 1.00 0.00 C ATOM 394 CG1 ILE E 16 126.983 1.392 0.229 1.00 0.00 C ATOM 395 CG2 ILE E 16 124.840 2.679 -0.293 1.00 0.00 C ATOM 396 CD1 ILE E 16 126.319 1.327 1.621 1.00 0.00 C ATOM 0 H ILE E 16 128.359 2.332 -2.488 1.00 0.00 H new ATOM 0 HA ILE E 16 125.709 1.003 -2.185 1.00 0.00 H new ATOM 0 HB ILE E 16 126.842 3.380 -0.640 1.00 0.00 H new ATOM 0 HG12 ILE E 16 126.941 0.407 -0.237 1.00 0.00 H new ATOM 0 HG13 ILE E 16 128.037 1.646 0.344 1.00 0.00 H new ATOM 0 HG21 ILE E 16 124.812 3.058 0.729 1.00 0.00 H new ATOM 0 HG22 ILE E 16 124.385 3.408 -0.963 1.00 0.00 H new ATOM 0 HG23 ILE E 16 124.286 1.742 -0.348 1.00 0.00 H new ATOM 0 HD11 ILE E 16 126.831 0.586 2.234 1.00 0.00 H new ATOM 0 HD12 ILE E 16 126.384 2.303 2.101 1.00 0.00 H new ATOM 0 HD13 ILE E 16 125.272 1.046 1.512 1.00 0.00 H new ATOM 408 N VAL E 17 124.561 2.537 -3.685 1.00 0.00 N ATOM 409 CA VAL E 17 123.834 3.328 -4.686 1.00 0.00 C ATOM 410 C VAL E 17 122.596 4.020 -4.101 1.00 0.00 C ATOM 411 O VAL E 17 121.925 3.479 -3.228 1.00 0.00 O ATOM 412 CB VAL E 17 123.395 2.388 -5.826 1.00 0.00 C ATOM 413 CG1 VAL E 17 122.429 3.111 -6.781 1.00 0.00 C ATOM 414 CG2 VAL E 17 124.630 1.911 -6.603 1.00 0.00 C ATOM 0 H VAL E 17 124.089 1.669 -3.434 1.00 0.00 H new ATOM 0 HA VAL E 17 124.502 4.109 -5.048 1.00 0.00 H new ATOM 0 HB VAL E 17 122.880 1.530 -5.394 1.00 0.00 H new ATOM 0 HG11 VAL E 17 122.130 2.432 -7.579 1.00 0.00 H new ATOM 0 HG12 VAL E 17 121.546 3.434 -6.230 1.00 0.00 H new ATOM 0 HG13 VAL E 17 122.926 3.980 -7.212 1.00 0.00 H new ATOM 0 HG21 VAL E 17 124.319 1.246 -7.409 1.00 0.00 H new ATOM 0 HG22 VAL E 17 125.150 2.772 -7.023 1.00 0.00 H new ATOM 0 HG23 VAL E 17 125.299 1.376 -5.929 1.00 0.00 H new ATOM 424 N TYR E 18 122.299 5.211 -4.638 1.00 0.00 N ATOM 425 CA TYR E 18 121.123 5.992 -4.236 1.00 0.00 C ATOM 426 C TYR E 18 120.320 6.381 -5.480 1.00 0.00 C ATOM 427 O TYR E 18 120.879 6.943 -6.426 1.00 0.00 O ATOM 428 CB TYR E 18 121.560 7.251 -3.471 1.00 0.00 C ATOM 429 CG TYR E 18 121.957 6.866 -2.076 1.00 0.00 C ATOM 430 CD1 TYR E 18 123.244 6.386 -1.818 1.00 0.00 C ATOM 431 CD2 TYR E 18 121.031 6.987 -1.039 1.00 0.00 C ATOM 432 CE1 TYR E 18 123.602 6.029 -0.519 1.00 0.00 C ATOM 433 CE2 TYR E 18 121.388 6.634 0.254 1.00 0.00 C ATOM 434 CZ TYR E 18 122.675 6.153 0.522 1.00 0.00 C ATOM 435 OH TYR E 18 123.030 5.808 1.810 1.00 0.00 O ATOM 0 H TYR E 18 122.865 5.658 -5.360 1.00 0.00 H new ATOM 0 HA TYR E 18 120.497 5.388 -3.579 1.00 0.00 H new ATOM 0 HB2 TYR E 18 122.396 7.730 -3.981 1.00 0.00 H new ATOM 0 HB3 TYR E 18 120.746 7.976 -3.444 1.00 0.00 H new ATOM 0 HD1 TYR E 18 123.959 6.292 -2.622 1.00 0.00 H new ATOM 0 HD2 TYR E 18 120.037 7.355 -1.243 1.00 0.00 H new ATOM 0 HE1 TYR E 18 124.595 5.657 -0.316 1.00 0.00 H new ATOM 0 HE2 TYR E 18 120.671 6.730 1.056 1.00 0.00 H new ATOM 0 HH TYR E 18 122.597 6.418 2.443 1.00 0.00 H new ATOM 445 N LEU E 19 119.010 6.079 -5.472 1.00 0.00 N ATOM 446 CA LEU E 19 118.133 6.400 -6.612 1.00 0.00 C ATOM 447 C LEU E 19 116.944 7.281 -6.162 1.00 0.00 C ATOM 448 O LEU E 19 115.780 6.950 -6.421 1.00 0.00 O ATOM 449 CB LEU E 19 117.594 5.101 -7.258 1.00 0.00 C ATOM 450 CG LEU E 19 118.742 4.148 -7.657 1.00 0.00 C ATOM 451 CD1 LEU E 19 118.183 2.752 -7.986 1.00 0.00 C ATOM 452 CD2 LEU E 19 119.496 4.701 -8.879 1.00 0.00 C ATOM 0 H LEU E 19 118.538 5.617 -4.695 1.00 0.00 H new ATOM 0 HA LEU E 19 118.723 6.951 -7.344 1.00 0.00 H new ATOM 0 HB2 LEU E 19 116.927 4.596 -6.560 1.00 0.00 H new ATOM 0 HB3 LEU E 19 117.003 5.350 -8.140 1.00 0.00 H new ATOM 0 HG LEU E 19 119.433 4.070 -6.817 1.00 0.00 H new ATOM 0 HD11 LEU E 19 119.002 2.089 -8.266 1.00 0.00 H new ATOM 0 HD12 LEU E 19 117.673 2.349 -7.111 1.00 0.00 H new ATOM 0 HD13 LEU E 19 117.478 2.828 -8.814 1.00 0.00 H new ATOM 0 HD21 LEU E 19 120.302 4.019 -9.148 1.00 0.00 H new ATOM 0 HD22 LEU E 19 118.807 4.798 -9.718 1.00 0.00 H new ATOM 0 HD23 LEU E 19 119.914 5.678 -8.637 1.00 0.00 H new ATOM 464 N PRO E 20 117.204 8.404 -5.514 1.00 0.00 N ATOM 465 CA PRO E 20 116.120 9.328 -5.049 1.00 0.00 C ATOM 466 C PRO E 20 115.331 9.900 -6.221 1.00 0.00 C ATOM 467 O PRO E 20 114.215 10.400 -6.048 1.00 0.00 O ATOM 468 CB PRO E 20 116.869 10.445 -4.306 1.00 0.00 C ATOM 469 CG PRO E 20 118.275 10.383 -4.804 1.00 0.00 C ATOM 470 CD PRO E 20 118.536 8.921 -5.156 1.00 0.00 C ATOM 0 HA PRO E 20 115.390 8.817 -4.422 1.00 0.00 H new ATOM 0 HB2 PRO E 20 116.423 11.419 -4.509 1.00 0.00 H new ATOM 0 HB3 PRO E 20 116.828 10.295 -3.227 1.00 0.00 H new ATOM 0 HG2 PRO E 20 118.408 11.023 -5.676 1.00 0.00 H new ATOM 0 HG3 PRO E 20 118.974 10.731 -4.043 1.00 0.00 H new ATOM 0 HD2 PRO E 20 119.238 8.828 -5.985 1.00 0.00 H new ATOM 0 HD3 PRO E 20 118.964 8.377 -4.314 1.00 0.00 H new ATOM 478 N ASN E 21 115.941 9.845 -7.405 1.00 0.00 N ATOM 479 CA ASN E 21 115.332 10.379 -8.618 1.00 0.00 C ATOM 480 C ASN E 21 114.411 9.363 -9.296 1.00 0.00 C ATOM 481 O ASN E 21 113.783 9.689 -10.306 1.00 0.00 O ATOM 482 CB ASN E 21 116.442 10.790 -9.594 1.00 0.00 C ATOM 483 CG ASN E 21 117.360 11.839 -8.960 1.00 0.00 C ATOM 484 OD1 ASN E 21 116.903 12.703 -8.211 1.00 0.00 O ATOM 485 ND2 ASN E 21 118.638 11.820 -9.225 1.00 0.00 N ATOM 0 H ASN E 21 116.863 9.432 -7.548 1.00 0.00 H new ATOM 0 HA ASN E 21 114.724 11.239 -8.338 1.00 0.00 H new ATOM 0 HB2 ASN E 21 117.025 9.914 -9.879 1.00 0.00 H new ATOM 0 HB3 ASN E 21 116.001 11.190 -10.507 1.00 0.00 H new ATOM 0 HD21 ASN E 21 119.255 12.519 -8.812 1.00 0.00 H new ATOM 0 HD22 ASN E 21 119.020 11.106 -9.845 1.00 0.00 H new ATOM 492 N LEU E 22 114.333 8.139 -8.753 1.00 0.00 N ATOM 493 CA LEU E 22 113.485 7.102 -9.344 1.00 0.00 C ATOM 494 C LEU E 22 112.129 7.038 -8.649 1.00 0.00 C ATOM 495 O LEU E 22 112.043 7.061 -7.417 1.00 0.00 O ATOM 496 CB LEU E 22 114.198 5.744 -9.264 1.00 0.00 C ATOM 497 CG LEU E 22 115.065 5.523 -10.521 1.00 0.00 C ATOM 498 CD1 LEU E 22 116.060 6.684 -10.713 1.00 0.00 C ATOM 499 CD2 LEU E 22 115.829 4.191 -10.388 1.00 0.00 C ATOM 0 H LEU E 22 114.840 7.849 -7.917 1.00 0.00 H new ATOM 0 HA LEU E 22 113.308 7.352 -10.390 1.00 0.00 H new ATOM 0 HB2 LEU E 22 114.822 5.705 -8.371 1.00 0.00 H new ATOM 0 HB3 LEU E 22 113.463 4.944 -9.175 1.00 0.00 H new ATOM 0 HG LEU E 22 114.413 5.487 -11.394 1.00 0.00 H new ATOM 0 HD11 LEU E 22 116.660 6.505 -11.605 1.00 0.00 H new ATOM 0 HD12 LEU E 22 115.511 7.619 -10.826 1.00 0.00 H new ATOM 0 HD13 LEU E 22 116.714 6.750 -9.844 1.00 0.00 H new ATOM 0 HD21 LEU E 22 116.442 4.033 -11.275 1.00 0.00 H new ATOM 0 HD22 LEU E 22 116.469 4.225 -9.506 1.00 0.00 H new ATOM 0 HD23 LEU E 22 115.117 3.372 -10.288 1.00 0.00 H new ATOM 511 N ASN E 23 111.077 6.954 -9.464 1.00 0.00 N ATOM 512 CA ASN E 23 109.701 6.881 -8.958 1.00 0.00 C ATOM 513 C ASN E 23 109.432 5.485 -8.380 1.00 0.00 C ATOM 514 O ASN E 23 110.222 4.565 -8.608 1.00 0.00 O ATOM 515 CB ASN E 23 108.696 7.179 -10.089 1.00 0.00 C ATOM 516 CG ASN E 23 109.295 8.151 -11.105 1.00 0.00 C ATOM 517 OD1 ASN E 23 109.888 7.726 -12.097 1.00 0.00 O ATOM 518 ND2 ASN E 23 109.183 9.434 -10.912 1.00 0.00 N ATOM 0 H ASN E 23 111.149 6.935 -10.481 1.00 0.00 H new ATOM 0 HA ASN E 23 109.577 7.627 -8.173 1.00 0.00 H new ATOM 0 HB2 ASN E 23 108.417 6.251 -10.588 1.00 0.00 H new ATOM 0 HB3 ASN E 23 107.783 7.602 -9.669 1.00 0.00 H new ATOM 0 HD21 ASN E 23 109.587 10.088 -11.583 1.00 0.00 H new ATOM 0 HD22 ASN E 23 108.692 9.785 -10.090 1.00 0.00 H new ATOM 525 N PRO E 24 108.342 5.296 -7.651 1.00 0.00 N ATOM 526 CA PRO E 24 108.002 3.962 -7.060 1.00 0.00 C ATOM 527 C PRO E 24 107.960 2.882 -8.137 1.00 0.00 C ATOM 528 O PRO E 24 108.358 1.741 -7.903 1.00 0.00 O ATOM 529 CB PRO E 24 106.621 4.169 -6.424 1.00 0.00 C ATOM 530 CG PRO E 24 106.492 5.642 -6.218 1.00 0.00 C ATOM 531 CD PRO E 24 107.324 6.311 -7.313 1.00 0.00 C ATOM 0 HA PRO E 24 108.743 3.626 -6.335 1.00 0.00 H new ATOM 0 HB2 PRO E 24 105.830 3.793 -7.073 1.00 0.00 H new ATOM 0 HB3 PRO E 24 106.540 3.632 -5.479 1.00 0.00 H new ATOM 0 HG2 PRO E 24 105.449 5.952 -6.280 1.00 0.00 H new ATOM 0 HG3 PRO E 24 106.851 5.928 -5.229 1.00 0.00 H new ATOM 0 HD2 PRO E 24 106.713 6.569 -8.178 1.00 0.00 H new ATOM 0 HD3 PRO E 24 107.782 7.235 -6.959 1.00 0.00 H new ATOM 539 N ASP E 25 107.497 3.278 -9.324 1.00 0.00 N ATOM 540 CA ASP E 25 107.426 2.366 -10.461 1.00 0.00 C ATOM 541 C ASP E 25 108.834 1.926 -10.850 1.00 0.00 C ATOM 542 O ASP E 25 109.088 0.741 -11.078 1.00 0.00 O ATOM 543 CB ASP E 25 106.775 3.073 -11.656 1.00 0.00 C ATOM 544 CG ASP E 25 105.342 3.496 -11.313 1.00 0.00 C ATOM 545 OD1 ASP E 25 104.518 2.619 -11.108 1.00 0.00 O ATOM 546 OD2 ASP E 25 105.090 4.690 -11.266 1.00 0.00 O ATOM 0 H ASP E 25 107.167 4.223 -9.520 1.00 0.00 H new ATOM 0 HA ASP E 25 106.830 1.497 -10.183 1.00 0.00 H new ATOM 0 HB2 ASP E 25 107.363 3.948 -11.933 1.00 0.00 H new ATOM 0 HB3 ASP E 25 106.768 2.408 -12.520 1.00 0.00 H new ATOM 551 N GLN E 26 109.740 2.905 -10.923 1.00 0.00 N ATOM 552 CA GLN E 26 111.127 2.653 -11.283 1.00 0.00 C ATOM 553 C GLN E 26 111.838 1.826 -10.207 1.00 0.00 C ATOM 554 O GLN E 26 112.536 0.861 -10.531 1.00 0.00 O ATOM 555 CB GLN E 26 111.845 3.994 -11.485 1.00 0.00 C ATOM 556 CG GLN E 26 111.241 4.745 -12.686 1.00 0.00 C ATOM 557 CD GLN E 26 111.456 3.953 -13.974 1.00 0.00 C ATOM 558 OE1 GLN E 26 112.653 3.542 -14.280 1.00 0.00 O flip ATOM 559 NE2 GLN E 26 110.508 3.701 -14.717 1.00 0.00 N flip ATOM 0 H GLN E 26 109.529 3.885 -10.735 1.00 0.00 H new ATOM 0 HA GLN E 26 111.151 2.079 -12.209 1.00 0.00 H new ATOM 0 HB2 GLN E 26 111.756 4.602 -10.585 1.00 0.00 H new ATOM 0 HB3 GLN E 26 112.909 3.824 -11.651 1.00 0.00 H new ATOM 0 HG2 GLN E 26 110.175 4.905 -12.524 1.00 0.00 H new ATOM 0 HG3 GLN E 26 111.701 5.729 -12.776 1.00 0.00 H new ATOM 0 HE21 GLN E 26 109.571 4.024 -14.476 1.00 0.00 H new ATOM 0 HE22 GLN E 26 110.659 3.169 -15.574 1.00 0.00 H new ATOM 568 N LEU E 27 111.656 2.196 -8.928 1.00 0.00 N ATOM 569 CA LEU E 27 112.293 1.453 -7.835 1.00 0.00 C ATOM 570 C LEU E 27 111.735 0.032 -7.772 1.00 0.00 C ATOM 571 O LEU E 27 112.493 -0.930 -7.640 1.00 0.00 O ATOM 572 CB LEU E 27 112.075 2.148 -6.478 1.00 0.00 C ATOM 573 CG LEU E 27 112.688 3.565 -6.474 1.00 0.00 C ATOM 574 CD1 LEU E 27 112.474 4.220 -5.101 1.00 0.00 C ATOM 575 CD2 LEU E 27 114.200 3.507 -6.768 1.00 0.00 C ATOM 0 H LEU E 27 111.085 2.988 -8.632 1.00 0.00 H new ATOM 0 HA LEU E 27 113.364 1.422 -8.037 1.00 0.00 H new ATOM 0 HB2 LEU E 27 111.008 2.210 -6.265 1.00 0.00 H new ATOM 0 HB3 LEU E 27 112.525 1.552 -5.684 1.00 0.00 H new ATOM 0 HG LEU E 27 112.196 4.151 -7.250 1.00 0.00 H new ATOM 0 HD11 LEU E 27 112.908 5.220 -5.103 1.00 0.00 H new ATOM 0 HD12 LEU E 27 111.406 4.289 -4.893 1.00 0.00 H new ATOM 0 HD13 LEU E 27 112.955 3.617 -4.331 1.00 0.00 H new ATOM 0 HD21 LEU E 27 114.611 4.516 -6.760 1.00 0.00 H new ATOM 0 HD22 LEU E 27 114.696 2.907 -6.005 1.00 0.00 H new ATOM 0 HD23 LEU E 27 114.363 3.056 -7.747 1.00 0.00 H new ATOM 587 N CYS E 28 110.409 -0.092 -7.876 1.00 0.00 N ATOM 588 CA CYS E 28 109.761 -1.404 -7.838 1.00 0.00 C ATOM 589 C CYS E 28 110.200 -2.249 -9.035 1.00 0.00 C ATOM 590 O CYS E 28 110.492 -3.438 -8.887 1.00 0.00 O ATOM 591 CB CYS E 28 108.235 -1.246 -7.836 1.00 0.00 C ATOM 592 SG CYS E 28 107.463 -2.831 -7.418 1.00 0.00 S ATOM 0 H CYS E 28 109.768 0.694 -7.986 1.00 0.00 H new ATOM 0 HA CYS E 28 110.062 -1.911 -6.921 1.00 0.00 H new ATOM 0 HB2 CYS E 28 107.939 -0.484 -7.115 1.00 0.00 H new ATOM 0 HB3 CYS E 28 107.892 -0.910 -8.815 1.00 0.00 H new ATOM 597 N ALA E 29 110.247 -1.619 -10.217 1.00 0.00 N ATOM 598 CA ALA E 29 110.656 -2.311 -11.443 1.00 0.00 C ATOM 599 C ALA E 29 112.099 -2.795 -11.318 1.00 0.00 C ATOM 600 O ALA E 29 112.414 -3.947 -11.629 1.00 0.00 O ATOM 601 CB ALA E 29 110.547 -1.353 -12.637 1.00 0.00 C ATOM 0 H ALA E 29 110.008 -0.636 -10.348 1.00 0.00 H new ATOM 0 HA ALA E 29 110.001 -3.169 -11.597 1.00 0.00 H new ATOM 0 HB1 ALA E 29 110.852 -1.870 -13.547 1.00 0.00 H new ATOM 0 HB2 ALA E 29 109.516 -1.015 -12.739 1.00 0.00 H new ATOM 0 HB3 ALA E 29 111.196 -0.493 -12.474 1.00 0.00 H new ATOM 607 N PHE E 30 112.962 -1.901 -10.842 1.00 0.00 N ATOM 608 CA PHE E 30 114.371 -2.219 -10.650 1.00 0.00 C ATOM 609 C PHE E 30 114.524 -3.323 -9.603 1.00 0.00 C ATOM 610 O PHE E 30 115.216 -4.311 -9.835 1.00 0.00 O ATOM 611 CB PHE E 30 115.114 -0.946 -10.213 1.00 0.00 C ATOM 612 CG PHE E 30 116.545 -1.263 -9.823 1.00 0.00 C ATOM 613 CD1 PHE E 30 117.445 -1.766 -10.771 1.00 0.00 C ATOM 614 CD2 PHE E 30 116.968 -1.040 -8.508 1.00 0.00 C ATOM 615 CE1 PHE E 30 118.765 -2.045 -10.398 1.00 0.00 C ATOM 616 CE2 PHE E 30 118.286 -1.322 -8.137 1.00 0.00 C ATOM 617 CZ PHE E 30 119.184 -1.823 -9.081 1.00 0.00 C ATOM 0 H PHE E 30 112.707 -0.948 -10.582 1.00 0.00 H new ATOM 0 HA PHE E 30 114.799 -2.581 -11.585 1.00 0.00 H new ATOM 0 HB2 PHE E 30 115.106 -0.219 -11.025 1.00 0.00 H new ATOM 0 HB3 PHE E 30 114.596 -0.488 -9.370 1.00 0.00 H new ATOM 0 HD1 PHE E 30 117.121 -1.938 -11.787 1.00 0.00 H new ATOM 0 HD2 PHE E 30 116.275 -0.649 -7.778 1.00 0.00 H new ATOM 0 HE1 PHE E 30 119.461 -2.432 -11.127 1.00 0.00 H new ATOM 0 HE2 PHE E 30 118.609 -1.152 -7.121 1.00 0.00 H new ATOM 0 HZ PHE E 30 120.203 -2.039 -8.795 1.00 0.00 H new ATOM 627 N ILE E 31 113.868 -3.134 -8.460 1.00 0.00 N ATOM 628 CA ILE E 31 113.914 -4.097 -7.355 1.00 0.00 C ATOM 629 C ILE E 31 113.401 -5.475 -7.787 1.00 0.00 C ATOM 630 O ILE E 31 113.877 -6.497 -7.283 1.00 0.00 O ATOM 631 CB ILE E 31 113.100 -3.523 -6.170 1.00 0.00 C ATOM 632 CG1 ILE E 31 113.935 -2.430 -5.492 1.00 0.00 C ATOM 633 CG2 ILE E 31 112.752 -4.594 -5.124 1.00 0.00 C ATOM 634 CD1 ILE E 31 113.089 -1.673 -4.460 1.00 0.00 C ATOM 0 H ILE E 31 113.291 -2.314 -8.271 1.00 0.00 H new ATOM 0 HA ILE E 31 114.948 -4.246 -7.042 1.00 0.00 H new ATOM 0 HB ILE E 31 112.164 -3.129 -6.566 1.00 0.00 H new ATOM 0 HG12 ILE E 31 114.802 -2.876 -5.004 1.00 0.00 H new ATOM 0 HG13 ILE E 31 114.313 -1.735 -6.242 1.00 0.00 H new ATOM 0 HG21 ILE E 31 112.181 -4.140 -4.314 1.00 0.00 H new ATOM 0 HG22 ILE E 31 112.157 -5.379 -5.591 1.00 0.00 H new ATOM 0 HG23 ILE E 31 113.670 -5.024 -4.724 1.00 0.00 H new ATOM 0 HD11 ILE E 31 113.696 -0.901 -3.988 1.00 0.00 H new ATOM 0 HD12 ILE E 31 112.236 -1.211 -4.957 1.00 0.00 H new ATOM 0 HD13 ILE E 31 112.733 -2.369 -3.701 1.00 0.00 H new ATOM 646 N HIS E 32 112.441 -5.503 -8.716 1.00 0.00 N ATOM 647 CA HIS E 32 111.892 -6.772 -9.193 1.00 0.00 C ATOM 648 C HIS E 32 112.927 -7.519 -10.033 1.00 0.00 C ATOM 649 O HIS E 32 113.194 -8.700 -9.800 1.00 0.00 O ATOM 650 CB HIS E 32 110.633 -6.514 -10.033 1.00 0.00 C ATOM 651 CG HIS E 32 109.961 -7.822 -10.360 1.00 0.00 C ATOM 652 ND1 HIS E 32 108.817 -8.246 -9.704 1.00 0.00 N ATOM 653 CD2 HIS E 32 110.265 -8.811 -11.262 1.00 0.00 C ATOM 654 CE1 HIS E 32 108.477 -9.444 -10.215 1.00 0.00 C ATOM 655 NE2 HIS E 32 109.327 -9.835 -11.169 1.00 0.00 N ATOM 0 H HIS E 32 112.034 -4.673 -9.147 1.00 0.00 H new ATOM 0 HA HIS E 32 111.631 -7.384 -8.330 1.00 0.00 H new ATOM 0 HB2 HIS E 32 109.946 -5.868 -9.486 1.00 0.00 H new ATOM 0 HB3 HIS E 32 110.899 -5.991 -10.952 1.00 0.00 H new ATOM 0 HD2 HIS E 32 111.105 -8.797 -11.941 1.00 0.00 H new ATOM 0 HE1 HIS E 32 107.621 -10.019 -9.893 1.00 0.00 H new ATOM 0 HE2 HIS E 32 109.295 -10.698 -11.712 1.00 0.00 H new ATOM 664 N SER E 33 113.504 -6.811 -11.008 1.00 0.00 N ATOM 665 CA SER E 33 114.514 -7.389 -11.901 1.00 0.00 C ATOM 666 C SER E 33 115.806 -7.717 -11.146 1.00 0.00 C ATOM 667 O SER E 33 116.383 -8.796 -11.319 1.00 0.00 O ATOM 668 CB SER E 33 114.809 -6.395 -13.027 1.00 0.00 C ATOM 669 OG SER E 33 115.683 -6.993 -13.979 1.00 0.00 O ATOM 0 H SER E 33 113.288 -5.833 -11.200 1.00 0.00 H new ATOM 0 HA SER E 33 114.124 -8.320 -12.312 1.00 0.00 H new ATOM 0 HB2 SER E 33 113.880 -6.093 -13.511 1.00 0.00 H new ATOM 0 HB3 SER E 33 115.264 -5.492 -12.618 1.00 0.00 H new ATOM 0 HG SER E 33 115.742 -6.422 -14.773 1.00 0.00 H new ATOM 675 N LEU E 34 116.238 -6.768 -10.312 1.00 0.00 N ATOM 676 CA LEU E 34 117.457 -6.903 -9.504 1.00 0.00 C ATOM 677 C LEU E 34 117.435 -8.206 -8.706 1.00 0.00 C ATOM 678 O LEU E 34 118.458 -8.884 -8.576 1.00 0.00 O ATOM 679 CB LEU E 34 117.536 -5.696 -8.554 1.00 0.00 C ATOM 680 CG LEU E 34 118.862 -5.678 -7.780 1.00 0.00 C ATOM 681 CD1 LEU E 34 120.044 -5.573 -8.765 1.00 0.00 C ATOM 682 CD2 LEU E 34 118.866 -4.470 -6.815 1.00 0.00 C ATOM 0 H LEU E 34 115.753 -5.881 -10.176 1.00 0.00 H new ATOM 0 HA LEU E 34 118.331 -6.929 -10.154 1.00 0.00 H new ATOM 0 HB2 LEU E 34 117.434 -4.774 -9.126 1.00 0.00 H new ATOM 0 HB3 LEU E 34 116.703 -5.729 -7.851 1.00 0.00 H new ATOM 0 HG LEU E 34 118.966 -6.601 -7.209 1.00 0.00 H new ATOM 0 HD11 LEU E 34 120.981 -5.561 -8.209 1.00 0.00 H new ATOM 0 HD12 LEU E 34 120.033 -6.430 -9.439 1.00 0.00 H new ATOM 0 HD13 LEU E 34 119.954 -4.654 -9.345 1.00 0.00 H new ATOM 0 HD21 LEU E 34 119.805 -4.450 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU E 34 118.762 -3.548 -7.386 1.00 0.00 H new ATOM 0 HD23 LEU E 34 118.034 -4.560 -6.116 1.00 0.00 H new ATOM 694 N HIS E 35 116.255 -8.546 -8.191 1.00 0.00 N ATOM 695 CA HIS E 35 116.074 -9.767 -7.413 1.00 0.00 C ATOM 696 C HIS E 35 115.873 -10.987 -8.329 1.00 0.00 C ATOM 697 O HIS E 35 116.328 -12.088 -8.010 1.00 0.00 O ATOM 698 CB HIS E 35 114.858 -9.603 -6.492 1.00 0.00 C ATOM 699 CG HIS E 35 114.773 -10.774 -5.547 1.00 0.00 C ATOM 700 ND1 HIS E 35 115.573 -10.871 -4.419 1.00 0.00 N ATOM 701 CD2 HIS E 35 113.995 -11.907 -5.552 1.00 0.00 C ATOM 702 CE1 HIS E 35 115.262 -12.024 -3.797 1.00 0.00 C ATOM 703 NE2 HIS E 35 114.306 -12.694 -4.446 1.00 0.00 N ATOM 0 H HIS E 35 115.407 -7.989 -8.300 1.00 0.00 H new ATOM 0 HA HIS E 35 116.972 -9.937 -6.819 1.00 0.00 H new ATOM 0 HB2 HIS E 35 114.940 -8.674 -5.928 1.00 0.00 H new ATOM 0 HB3 HIS E 35 113.947 -9.536 -7.086 1.00 0.00 H new ATOM 0 HD2 HIS E 35 113.255 -12.150 -6.300 1.00 0.00 H new ATOM 0 HE1 HIS E 35 115.729 -12.365 -2.885 1.00 0.00 H new ATOM 0 HE2 HIS E 35 113.893 -13.590 -4.187 1.00 0.00 H new ATOM 712 N ASP E 36 115.164 -10.784 -9.448 1.00 0.00 N ATOM 713 CA ASP E 36 114.873 -11.875 -10.391 1.00 0.00 C ATOM 714 C ASP E 36 116.149 -12.501 -10.965 1.00 0.00 C ATOM 715 O ASP E 36 116.227 -13.725 -11.106 1.00 0.00 O ATOM 716 CB ASP E 36 113.990 -11.355 -11.539 1.00 0.00 C ATOM 717 CG ASP E 36 113.245 -12.516 -12.212 1.00 0.00 C ATOM 718 OD1 ASP E 36 113.906 -13.407 -12.723 1.00 0.00 O ATOM 719 OD2 ASP E 36 112.024 -12.495 -12.207 1.00 0.00 O ATOM 0 H ASP E 36 114.782 -9.879 -9.722 1.00 0.00 H new ATOM 0 HA ASP E 36 114.345 -12.651 -9.837 1.00 0.00 H new ATOM 0 HB2 ASP E 36 113.273 -10.629 -11.154 1.00 0.00 H new ATOM 0 HB3 ASP E 36 114.606 -10.836 -12.273 1.00 0.00 H new ATOM 724 N ASP E 37 117.140 -11.662 -11.298 1.00 0.00 N ATOM 725 CA ASP E 37 118.408 -12.152 -11.864 1.00 0.00 C ATOM 726 C ASP E 37 119.616 -11.545 -11.112 1.00 0.00 C ATOM 727 O ASP E 37 120.235 -10.593 -11.605 1.00 0.00 O ATOM 728 CB ASP E 37 118.488 -11.805 -13.360 1.00 0.00 C ATOM 729 CG ASP E 37 117.386 -12.529 -14.138 1.00 0.00 C ATOM 730 OD1 ASP E 37 116.231 -12.193 -13.939 1.00 0.00 O ATOM 731 OD2 ASP E 37 117.713 -13.407 -14.922 1.00 0.00 O ATOM 0 H ASP E 37 117.091 -10.649 -11.187 1.00 0.00 H new ATOM 0 HA ASP E 37 118.440 -13.235 -11.747 1.00 0.00 H new ATOM 0 HB2 ASP E 37 118.389 -10.728 -13.495 1.00 0.00 H new ATOM 0 HB3 ASP E 37 119.465 -12.087 -13.753 1.00 0.00 H new ATOM 736 N PRO E 38 119.976 -12.061 -9.931 1.00 0.00 N ATOM 737 CA PRO E 38 121.135 -11.518 -9.154 1.00 0.00 C ATOM 738 C PRO E 38 122.455 -11.666 -9.914 1.00 0.00 C ATOM 739 O PRO E 38 123.419 -10.952 -9.632 1.00 0.00 O ATOM 740 CB PRO E 38 121.148 -12.328 -7.846 1.00 0.00 C ATOM 741 CG PRO E 38 119.829 -13.027 -7.777 1.00 0.00 C ATOM 742 CD PRO E 38 119.346 -13.193 -9.213 1.00 0.00 C ATOM 0 HA PRO E 38 121.030 -10.448 -8.974 1.00 0.00 H new ATOM 0 HB2 PRO E 38 121.969 -13.045 -7.840 1.00 0.00 H new ATOM 0 HB3 PRO E 38 121.288 -11.675 -6.985 1.00 0.00 H new ATOM 0 HG2 PRO E 38 119.930 -13.996 -7.288 1.00 0.00 H new ATOM 0 HG3 PRO E 38 119.114 -12.448 -7.193 1.00 0.00 H new ATOM 0 HD2 PRO E 38 119.653 -14.152 -9.630 1.00 0.00 H new ATOM 0 HD3 PRO E 38 118.259 -13.152 -9.277 1.00 0.00 H new ATOM 750 N SER E 39 122.488 -12.590 -10.883 1.00 0.00 N ATOM 751 CA SER E 39 123.690 -12.817 -11.694 1.00 0.00 C ATOM 752 C SER E 39 124.081 -11.533 -12.432 1.00 0.00 C ATOM 753 O SER E 39 125.266 -11.243 -12.615 1.00 0.00 O ATOM 754 CB SER E 39 123.436 -13.940 -12.708 1.00 0.00 C ATOM 755 OG SER E 39 123.000 -15.108 -12.023 1.00 0.00 O ATOM 0 H SER E 39 121.699 -13.190 -11.123 1.00 0.00 H new ATOM 0 HA SER E 39 124.506 -13.109 -11.033 1.00 0.00 H new ATOM 0 HB2 SER E 39 122.683 -13.628 -13.432 1.00 0.00 H new ATOM 0 HB3 SER E 39 124.347 -14.152 -13.267 1.00 0.00 H new ATOM 0 HG SER E 39 122.836 -15.825 -12.671 1.00 0.00 H new ATOM 761 N GLN E 40 123.060 -10.769 -12.831 1.00 0.00 N ATOM 762 CA GLN E 40 123.251 -9.496 -13.535 1.00 0.00 C ATOM 763 C GLN E 40 123.133 -8.326 -12.554 1.00 0.00 C ATOM 764 O GLN E 40 122.732 -7.224 -12.931 1.00 0.00 O ATOM 765 CB GLN E 40 122.183 -9.340 -14.622 1.00 0.00 C ATOM 766 CG GLN E 40 122.287 -10.466 -15.664 1.00 0.00 C ATOM 767 CD GLN E 40 123.653 -10.448 -16.352 1.00 0.00 C ATOM 768 OE1 GLN E 40 124.043 -9.439 -16.939 1.00 0.00 O ATOM 769 NE2 GLN E 40 124.406 -11.512 -16.315 1.00 0.00 N ATOM 0 H GLN E 40 122.082 -11.013 -12.676 1.00 0.00 H new ATOM 0 HA GLN E 40 124.243 -9.494 -13.986 1.00 0.00 H new ATOM 0 HB2 GLN E 40 121.192 -9.351 -14.167 1.00 0.00 H new ATOM 0 HB3 GLN E 40 122.298 -8.374 -15.113 1.00 0.00 H new ATOM 0 HG2 GLN E 40 122.132 -11.430 -15.180 1.00 0.00 H new ATOM 0 HG3 GLN E 40 121.499 -10.352 -16.408 1.00 0.00 H new ATOM 0 HE21 GLN E 40 124.083 -12.348 -15.829 1.00 0.00 H new ATOM 0 HE22 GLN E 40 125.318 -11.508 -16.772 1.00 0.00 H new ATOM 778 N SER E 41 123.461 -8.588 -11.292 1.00 0.00 N ATOM 779 CA SER E 41 123.369 -7.578 -10.233 1.00 0.00 C ATOM 780 C SER E 41 123.988 -6.238 -10.644 1.00 0.00 C ATOM 781 O SER E 41 123.345 -5.193 -10.519 1.00 0.00 O ATOM 782 CB SER E 41 124.085 -8.108 -8.993 1.00 0.00 C ATOM 783 OG SER E 41 123.143 -8.732 -8.129 1.00 0.00 O ATOM 0 H SER E 41 123.796 -9.497 -10.973 1.00 0.00 H new ATOM 0 HA SER E 41 122.313 -7.396 -10.032 1.00 0.00 H new ATOM 0 HB2 SER E 41 124.856 -8.822 -9.283 1.00 0.00 H new ATOM 0 HB3 SER E 41 124.586 -7.291 -8.473 1.00 0.00 H new ATOM 0 HG SER E 41 122.980 -9.650 -8.431 1.00 0.00 H new ATOM 789 N ALA E 42 125.233 -6.274 -11.124 1.00 0.00 N ATOM 790 CA ALA E 42 125.918 -5.048 -11.538 1.00 0.00 C ATOM 791 C ALA E 42 125.351 -4.501 -12.851 1.00 0.00 C ATOM 792 O ALA E 42 125.207 -3.287 -13.006 1.00 0.00 O ATOM 793 CB ALA E 42 127.419 -5.308 -11.692 1.00 0.00 C ATOM 0 H ALA E 42 125.781 -7.127 -11.235 1.00 0.00 H new ATOM 0 HA ALA E 42 125.755 -4.301 -10.762 1.00 0.00 H new ATOM 0 HB1 ALA E 42 127.918 -4.389 -12.000 1.00 0.00 H new ATOM 0 HB2 ALA E 42 127.830 -5.642 -10.739 1.00 0.00 H new ATOM 0 HB3 ALA E 42 127.579 -6.078 -12.446 1.00 0.00 H new ATOM 799 N ASN E 43 125.050 -5.403 -13.795 1.00 0.00 N ATOM 800 CA ASN E 43 124.518 -4.996 -15.100 1.00 0.00 C ATOM 801 C ASN E 43 123.183 -4.268 -14.957 1.00 0.00 C ATOM 802 O ASN E 43 123.032 -3.153 -15.460 1.00 0.00 O ATOM 803 CB ASN E 43 124.344 -6.222 -16.004 1.00 0.00 C ATOM 804 CG ASN E 43 125.703 -6.679 -16.524 1.00 0.00 C ATOM 805 OD1 ASN E 43 126.203 -7.733 -16.131 1.00 0.00 O ATOM 806 ND2 ASN E 43 126.335 -5.939 -17.392 1.00 0.00 N ATOM 0 H ASN E 43 125.165 -6.410 -13.680 1.00 0.00 H new ATOM 0 HA ASN E 43 125.234 -4.308 -15.551 1.00 0.00 H new ATOM 0 HB2 ASN E 43 123.867 -7.030 -15.449 1.00 0.00 H new ATOM 0 HB3 ASN E 43 123.688 -5.979 -16.840 1.00 0.00 H new ATOM 0 HD21 ASN E 43 127.245 -6.233 -17.746 1.00 0.00 H new ATOM 0 HD22 ASN E 43 125.919 -5.066 -17.717 1.00 0.00 H new ATOM 813 N LEU E 44 122.226 -4.898 -14.257 1.00 0.00 N ATOM 814 CA LEU E 44 120.902 -4.297 -14.042 1.00 0.00 C ATOM 815 C LEU E 44 121.036 -2.961 -13.320 1.00 0.00 C ATOM 816 O LEU E 44 120.364 -1.985 -13.663 1.00 0.00 O ATOM 817 CB LEU E 44 120.023 -5.229 -13.196 1.00 0.00 C ATOM 818 CG LEU E 44 119.746 -6.543 -13.944 1.00 0.00 C ATOM 819 CD1 LEU E 44 118.990 -7.502 -13.015 1.00 0.00 C ATOM 820 CD2 LEU E 44 118.896 -6.264 -15.196 1.00 0.00 C ATOM 0 H LEU E 44 122.344 -5.818 -13.833 1.00 0.00 H new ATOM 0 HA LEU E 44 120.440 -4.142 -15.017 1.00 0.00 H new ATOM 0 HB2 LEU E 44 120.517 -5.442 -12.248 1.00 0.00 H new ATOM 0 HB3 LEU E 44 119.081 -4.734 -12.960 1.00 0.00 H new ATOM 0 HG LEU E 44 120.691 -6.992 -14.248 1.00 0.00 H new ATOM 0 HD11 LEU E 44 118.791 -8.436 -13.540 1.00 0.00 H new ATOM 0 HD12 LEU E 44 119.595 -7.705 -12.131 1.00 0.00 H new ATOM 0 HD13 LEU E 44 118.047 -7.047 -12.713 1.00 0.00 H new ATOM 0 HD21 LEU E 44 118.704 -7.200 -15.721 1.00 0.00 H new ATOM 0 HD22 LEU E 44 117.949 -5.813 -14.900 1.00 0.00 H new ATOM 0 HD23 LEU E 44 119.432 -5.582 -15.855 1.00 0.00 H new ATOM 832 N LEU E 45 121.918 -2.936 -12.325 1.00 0.00 N ATOM 833 CA LEU E 45 122.160 -1.727 -11.554 1.00 0.00 C ATOM 834 C LEU E 45 122.755 -0.657 -12.459 1.00 0.00 C ATOM 835 O LEU E 45 122.431 0.518 -12.327 1.00 0.00 O ATOM 836 CB LEU E 45 123.078 -2.056 -10.365 1.00 0.00 C ATOM 837 CG LEU E 45 123.261 -0.874 -9.370 1.00 0.00 C ATOM 838 CD1 LEU E 45 122.090 0.144 -9.379 1.00 0.00 C ATOM 839 CD2 LEU E 45 123.405 -1.460 -7.962 1.00 0.00 C ATOM 0 H LEU E 45 122.475 -3.740 -12.036 1.00 0.00 H new ATOM 0 HA LEU E 45 121.224 -1.337 -11.154 1.00 0.00 H new ATOM 0 HB2 LEU E 45 122.669 -2.912 -9.828 1.00 0.00 H new ATOM 0 HB3 LEU E 45 124.055 -2.355 -10.744 1.00 0.00 H new ATOM 0 HG LEU E 45 124.147 -0.321 -9.682 1.00 0.00 H new ATOM 0 HD11 LEU E 45 122.292 0.937 -8.659 1.00 0.00 H new ATOM 0 HD12 LEU E 45 121.990 0.575 -10.375 1.00 0.00 H new ATOM 0 HD13 LEU E 45 121.164 -0.364 -9.109 1.00 0.00 H new ATOM 0 HD21 LEU E 45 123.535 -0.651 -7.243 1.00 0.00 H new ATOM 0 HD22 LEU E 45 122.509 -2.028 -7.711 1.00 0.00 H new ATOM 0 HD23 LEU E 45 124.273 -2.118 -7.929 1.00 0.00 H new ATOM 851 N ALA E 46 123.588 -1.078 -13.419 1.00 0.00 N ATOM 852 CA ALA E 46 124.176 -0.136 -14.375 1.00 0.00 C ATOM 853 C ALA E 46 123.053 0.648 -15.061 1.00 0.00 C ATOM 854 O ALA E 46 123.167 1.855 -15.297 1.00 0.00 O ATOM 855 CB ALA E 46 124.996 -0.897 -15.428 1.00 0.00 C ATOM 0 H ALA E 46 123.866 -2.050 -13.553 1.00 0.00 H new ATOM 0 HA ALA E 46 124.836 0.552 -13.847 1.00 0.00 H new ATOM 0 HB1 ALA E 46 125.429 -0.188 -16.134 1.00 0.00 H new ATOM 0 HB2 ALA E 46 125.794 -1.452 -14.936 1.00 0.00 H new ATOM 0 HB3 ALA E 46 124.347 -1.591 -15.962 1.00 0.00 H new ATOM 861 N GLU E 47 121.958 -0.067 -15.344 1.00 0.00 N ATOM 862 CA GLU E 47 120.781 0.528 -15.977 1.00 0.00 C ATOM 863 C GLU E 47 120.089 1.470 -15.016 1.00 0.00 C ATOM 864 O GLU E 47 119.579 2.513 -15.423 1.00 0.00 O ATOM 865 CB GLU E 47 119.763 -0.554 -16.370 1.00 0.00 C ATOM 866 CG GLU E 47 120.490 -1.771 -16.914 1.00 0.00 C ATOM 867 CD GLU E 47 119.504 -2.724 -17.592 1.00 0.00 C ATOM 868 OE1 GLU E 47 118.687 -3.295 -16.888 1.00 0.00 O ATOM 869 OE2 GLU E 47 119.576 -2.864 -18.803 1.00 0.00 O ATOM 0 H GLU E 47 121.865 -1.063 -15.143 1.00 0.00 H new ATOM 0 HA GLU E 47 121.125 1.061 -16.863 1.00 0.00 H new ATOM 0 HB2 GLU E 47 119.164 -0.834 -15.504 1.00 0.00 H new ATOM 0 HB3 GLU E 47 119.076 -0.164 -17.121 1.00 0.00 H new ATOM 0 HG2 GLU E 47 121.252 -1.458 -17.628 1.00 0.00 H new ATOM 0 HG3 GLU E 47 121.005 -2.287 -16.104 1.00 0.00 H new ATOM 876 N ALA E 48 120.060 1.078 -13.739 1.00 0.00 N ATOM 877 CA ALA E 48 119.410 1.881 -12.731 1.00 0.00 C ATOM 878 C ALA E 48 120.208 3.147 -12.497 1.00 0.00 C ATOM 879 O ALA E 48 119.639 4.213 -12.268 1.00 0.00 O ATOM 880 CB ALA E 48 119.228 1.105 -11.432 1.00 0.00 C ATOM 0 H ALA E 48 120.479 0.215 -13.393 1.00 0.00 H new ATOM 0 HA ALA E 48 118.415 2.147 -13.089 1.00 0.00 H new ATOM 0 HB1 ALA E 48 118.736 1.740 -10.695 1.00 0.00 H new ATOM 0 HB2 ALA E 48 118.616 0.223 -11.618 1.00 0.00 H new ATOM 0 HB3 ALA E 48 120.202 0.797 -11.053 1.00 0.00 H new ATOM 886 N LYS E 49 121.538 3.024 -12.589 1.00 0.00 N ATOM 887 CA LYS E 49 122.414 4.174 -12.421 1.00 0.00 C ATOM 888 C LYS E 49 122.143 5.143 -13.560 1.00 0.00 C ATOM 889 O LYS E 49 121.969 6.344 -13.351 1.00 0.00 O ATOM 890 CB LYS E 49 123.889 3.748 -12.435 1.00 0.00 C ATOM 891 CG LYS E 49 124.562 4.065 -11.085 1.00 0.00 C ATOM 892 CD LYS E 49 124.455 2.854 -10.154 1.00 0.00 C ATOM 893 CE LYS E 49 125.229 1.661 -10.739 1.00 0.00 C ATOM 894 NZ LYS E 49 126.136 1.090 -9.697 1.00 0.00 N ATOM 0 H LYS E 49 122.021 2.145 -12.777 1.00 0.00 H new ATOM 0 HA LYS E 49 122.215 4.647 -11.459 1.00 0.00 H new ATOM 0 HB2 LYS E 49 123.962 2.680 -12.641 1.00 0.00 H new ATOM 0 HB3 LYS E 49 124.414 4.264 -13.239 1.00 0.00 H new ATOM 0 HG2 LYS E 49 125.609 4.323 -11.242 1.00 0.00 H new ATOM 0 HG3 LYS E 49 124.086 4.931 -10.626 1.00 0.00 H new ATOM 0 HD2 LYS E 49 124.852 3.107 -9.171 1.00 0.00 H new ATOM 0 HD3 LYS E 49 123.408 2.584 -10.016 1.00 0.00 H new ATOM 0 HE2 LYS E 49 124.532 0.898 -11.086 1.00 0.00 H new ATOM 0 HE3 LYS E 49 125.809 1.981 -11.605 1.00 0.00 H new ATOM 0 HZ1 LYS E 49 126.671 0.294 -10.100 1.00 0.00 H new ATOM 0 HZ2 LYS E 49 126.798 1.824 -9.374 1.00 0.00 H new ATOM 0 HZ3 LYS E 49 125.571 0.754 -8.891 1.00 0.00 H new ATOM 908 N LYS E 50 122.057 4.582 -14.770 1.00 0.00 N ATOM 909 CA LYS E 50 121.737 5.370 -15.953 1.00 0.00 C ATOM 910 C LYS E 50 120.344 5.975 -15.765 1.00 0.00 C ATOM 911 O LYS E 50 120.083 7.101 -16.185 1.00 0.00 O ATOM 912 CB LYS E 50 121.789 4.479 -17.201 1.00 0.00 C ATOM 913 CG LYS E 50 123.257 4.129 -17.524 1.00 0.00 C ATOM 914 CD LYS E 50 123.346 2.806 -18.309 1.00 0.00 C ATOM 915 CE LYS E 50 122.577 2.905 -19.631 1.00 0.00 C ATOM 916 NZ LYS E 50 123.215 3.929 -20.509 1.00 0.00 N ATOM 0 H LYS E 50 122.205 3.589 -14.951 1.00 0.00 H new ATOM 0 HA LYS E 50 122.463 6.172 -16.087 1.00 0.00 H new ATOM 0 HB2 LYS E 50 121.215 3.567 -17.034 1.00 0.00 H new ATOM 0 HB3 LYS E 50 121.332 4.993 -18.047 1.00 0.00 H new ATOM 0 HG2 LYS E 50 123.707 4.933 -18.106 1.00 0.00 H new ATOM 0 HG3 LYS E 50 123.828 4.047 -16.599 1.00 0.00 H new ATOM 0 HD2 LYS E 50 124.390 2.565 -18.508 1.00 0.00 H new ATOM 0 HD3 LYS E 50 122.940 1.993 -17.707 1.00 0.00 H new ATOM 0 HE2 LYS E 50 122.569 1.937 -20.132 1.00 0.00 H new ATOM 0 HE3 LYS E 50 121.538 3.173 -19.439 1.00 0.00 H new ATOM 0 HZ1 LYS E 50 122.850 3.831 -21.478 1.00 0.00 H new ATOM 0 HZ2 LYS E 50 122.994 4.880 -20.150 1.00 0.00 H new ATOM 0 HZ3 LYS E 50 124.246 3.790 -20.512 1.00 0.00 H new ATOM 930 N LEU E 51 119.477 5.215 -15.080 1.00 0.00 N ATOM 931 CA LEU E 51 118.117 5.661 -14.765 1.00 0.00 C ATOM 932 C LEU E 51 118.202 6.834 -13.791 1.00 0.00 C ATOM 933 O LEU E 51 117.444 7.802 -13.890 1.00 0.00 O ATOM 934 CB LEU E 51 117.351 4.508 -14.095 1.00 0.00 C ATOM 935 CG LEU E 51 116.043 4.157 -14.815 1.00 0.00 C ATOM 936 CD1 LEU E 51 115.028 5.310 -14.706 1.00 0.00 C ATOM 937 CD2 LEU E 51 116.311 3.817 -16.293 1.00 0.00 C ATOM 0 H LEU E 51 119.699 4.282 -14.732 1.00 0.00 H new ATOM 0 HA LEU E 51 117.602 5.964 -15.676 1.00 0.00 H new ATOM 0 HB2 LEU E 51 117.990 3.625 -14.063 1.00 0.00 H new ATOM 0 HB3 LEU E 51 117.129 4.778 -13.063 1.00 0.00 H new ATOM 0 HG LEU E 51 115.617 3.280 -14.329 1.00 0.00 H new ATOM 0 HD11 LEU E 51 114.109 5.036 -15.225 1.00 0.00 H new ATOM 0 HD12 LEU E 51 114.808 5.503 -13.656 1.00 0.00 H new ATOM 0 HD13 LEU E 51 115.447 6.208 -15.160 1.00 0.00 H new ATOM 0 HD21 LEU E 51 115.371 3.571 -16.786 1.00 0.00 H new ATOM 0 HD22 LEU E 51 116.766 4.675 -16.787 1.00 0.00 H new ATOM 0 HD23 LEU E 51 116.986 2.964 -16.353 1.00 0.00 H new ATOM 949 N ASN E 52 119.154 6.723 -12.848 1.00 0.00 N ATOM 950 CA ASN E 52 119.380 7.759 -11.840 1.00 0.00 C ATOM 951 C ASN E 52 119.684 9.079 -12.544 1.00 0.00 C ATOM 952 O ASN E 52 119.191 10.139 -12.148 1.00 0.00 O ATOM 953 CB ASN E 52 120.553 7.349 -10.917 1.00 0.00 C ATOM 954 CG ASN E 52 120.565 8.201 -9.641 1.00 0.00 C ATOM 955 OD1 ASN E 52 119.546 8.776 -9.252 1.00 0.00 O ATOM 956 ND2 ASN E 52 121.672 8.316 -8.961 1.00 0.00 N ATOM 0 H ASN E 52 119.779 5.921 -12.768 1.00 0.00 H new ATOM 0 HA ASN E 52 118.488 7.879 -11.225 1.00 0.00 H new ATOM 0 HB2 ASN E 52 120.464 6.295 -10.655 1.00 0.00 H new ATOM 0 HB3 ASN E 52 121.498 7.467 -11.448 1.00 0.00 H new ATOM 0 HD21 ASN E 52 121.692 8.880 -8.111 1.00 0.00 H new ATOM 0 HD22 ASN E 52 122.517 7.842 -9.279 1.00 0.00 H new ATOM 963 N ASP E 53 120.471 8.982 -13.621 1.00 0.00 N ATOM 964 CA ASP E 53 120.820 10.142 -14.436 1.00 0.00 C ATOM 965 C ASP E 53 119.665 10.484 -15.386 1.00 0.00 C ATOM 966 O ASP E 53 119.479 11.641 -15.768 1.00 0.00 O ATOM 967 CB ASP E 53 122.081 9.845 -15.255 1.00 0.00 C ATOM 968 CG ASP E 53 122.540 11.108 -15.985 1.00 0.00 C ATOM 969 OD1 ASP E 53 123.298 11.867 -15.400 1.00 0.00 O ATOM 970 OD2 ASP E 53 122.126 11.302 -17.117 1.00 0.00 O ATOM 0 H ASP E 53 120.878 8.105 -13.947 1.00 0.00 H new ATOM 0 HA ASP E 53 121.007 10.990 -13.777 1.00 0.00 H new ATOM 0 HB2 ASP E 53 122.874 9.485 -14.599 1.00 0.00 H new ATOM 0 HB3 ASP E 53 121.879 9.052 -15.975 1.00 0.00 H new ATOM 975 N ALA E 54 118.906 9.450 -15.770 1.00 0.00 N ATOM 976 CA ALA E 54 117.768 9.609 -16.684 1.00 0.00 C ATOM 977 C ALA E 54 116.651 10.435 -16.048 1.00 0.00 C ATOM 978 O ALA E 54 115.837 11.032 -16.759 1.00 0.00 O ATOM 979 CB ALA E 54 117.212 8.229 -17.076 1.00 0.00 C ATOM 0 H ALA E 54 119.060 8.491 -15.460 1.00 0.00 H new ATOM 0 HA ALA E 54 118.126 10.134 -17.570 1.00 0.00 H new ATOM 0 HB1 ALA E 54 116.368 8.356 -17.754 1.00 0.00 H new ATOM 0 HB2 ALA E 54 117.991 7.650 -17.571 1.00 0.00 H new ATOM 0 HB3 ALA E 54 116.882 7.702 -16.181 1.00 0.00 H new ATOM 985 N GLN E 55 116.613 10.454 -14.710 1.00 0.00 N ATOM 986 CA GLN E 55 115.584 11.197 -13.971 1.00 0.00 C ATOM 987 C GLN E 55 116.226 12.186 -13.000 1.00 0.00 C ATOM 988 O GLN E 55 115.547 12.797 -12.169 1.00 0.00 O ATOM 989 CB GLN E 55 114.667 10.211 -13.232 1.00 0.00 C ATOM 990 CG GLN E 55 114.078 9.228 -14.261 1.00 0.00 C ATOM 991 CD GLN E 55 112.913 8.415 -13.683 1.00 0.00 C ATOM 992 OE1 GLN E 55 112.306 7.619 -14.400 1.00 0.00 O ATOM 993 NE2 GLN E 55 112.555 8.559 -12.436 1.00 0.00 N ATOM 0 H GLN E 55 117.282 9.964 -14.117 1.00 0.00 H new ATOM 0 HA GLN E 55 114.983 11.771 -14.676 1.00 0.00 H new ATOM 0 HB2 GLN E 55 115.228 9.671 -12.470 1.00 0.00 H new ATOM 0 HB3 GLN E 55 113.868 10.747 -12.720 1.00 0.00 H new ATOM 0 HG2 GLN E 55 113.734 9.782 -15.135 1.00 0.00 H new ATOM 0 HG3 GLN E 55 114.860 8.549 -14.601 1.00 0.00 H new ATOM 0 HE21 GLN E 55 113.053 9.216 -11.835 1.00 0.00 H new ATOM 0 HE22 GLN E 55 111.778 8.014 -12.062 1.00 0.00 H new ATOM 1002 N ALA E 56 117.547 12.327 -13.128 1.00 0.00 N ATOM 1003 CA ALA E 56 118.337 13.210 -12.296 1.00 0.00 C ATOM 1004 C ALA E 56 117.805 14.644 -12.315 1.00 0.00 C ATOM 1005 O ALA E 56 117.080 15.043 -13.232 1.00 0.00 O ATOM 1006 CB ALA E 56 119.790 13.185 -12.781 1.00 0.00 C ATOM 0 H ALA E 56 118.096 11.821 -13.823 1.00 0.00 H new ATOM 0 HA ALA E 56 118.274 12.856 -11.267 1.00 0.00 H new ATOM 0 HB1 ALA E 56 120.392 13.848 -12.160 1.00 0.00 H new ATOM 0 HB2 ALA E 56 120.179 12.169 -12.712 1.00 0.00 H new ATOM 0 HB3 ALA E 56 119.834 13.520 -13.817 1.00 0.00 H new TER 1012 ALA E 56 ATOM 1013 N GLY F 14 118.438 10.712 10.443 1.00 0.00 N ATOM 1014 CA GLY F 14 119.772 10.103 10.454 1.00 0.00 C ATOM 1015 C GLY F 14 119.726 8.614 10.724 1.00 0.00 C ATOM 1016 O GLY F 14 120.772 7.957 10.752 1.00 0.00 O ATOM 0 HA2 GLY F 14 120.257 10.280 9.494 1.00 0.00 H new ATOM 0 HA3 GLY F 14 120.383 10.588 11.215 1.00 0.00 H new ATOM 1020 N GLU F 15 118.528 8.081 10.922 1.00 0.00 N ATOM 1021 CA GLU F 15 118.380 6.667 11.186 1.00 0.00 C ATOM 1022 C GLU F 15 118.291 5.906 9.883 1.00 0.00 C ATOM 1023 O GLU F 15 117.557 6.300 8.977 1.00 0.00 O ATOM 1024 CB GLU F 15 117.121 6.408 11.992 1.00 0.00 C ATOM 1025 CG GLU F 15 117.257 5.058 12.678 1.00 0.00 C ATOM 1026 CD GLU F 15 116.005 4.746 13.503 1.00 0.00 C ATOM 1027 OE1 GLU F 15 115.777 5.440 14.481 1.00 0.00 O ATOM 1028 OE2 GLU F 15 115.295 3.819 13.145 1.00 0.00 O ATOM 0 H GLU F 15 117.654 8.607 10.904 1.00 0.00 H new ATOM 0 HA GLU F 15 119.248 6.332 11.753 1.00 0.00 H new ATOM 0 HB2 GLU F 15 116.976 7.196 12.731 1.00 0.00 H new ATOM 0 HB3 GLU F 15 116.246 6.416 11.342 1.00 0.00 H new ATOM 0 HG2 GLU F 15 117.411 4.278 11.932 1.00 0.00 H new ATOM 0 HG3 GLU F 15 118.135 5.059 13.324 1.00 0.00 H new ATOM 1035 N ILE F 16 119.034 4.814 9.803 1.00 0.00 N ATOM 1036 CA ILE F 16 119.043 3.984 8.611 1.00 0.00 C ATOM 1037 C ILE F 16 118.431 2.621 8.902 1.00 0.00 C ATOM 1038 O ILE F 16 118.543 2.094 10.013 1.00 0.00 O ATOM 1039 CB ILE F 16 120.471 3.834 8.102 1.00 0.00 C ATOM 1040 CG1 ILE F 16 121.017 5.221 7.681 1.00 0.00 C ATOM 1041 CG2 ILE F 16 120.494 2.851 6.915 1.00 0.00 C ATOM 1042 CD1 ILE F 16 122.367 5.089 6.954 1.00 0.00 C ATOM 0 H ILE F 16 119.640 4.482 10.553 1.00 0.00 H new ATOM 0 HA ILE F 16 118.441 4.465 7.840 1.00 0.00 H new ATOM 0 HB ILE F 16 121.107 3.436 8.892 1.00 0.00 H new ATOM 0 HG12 ILE F 16 120.297 5.716 7.030 1.00 0.00 H new ATOM 0 HG13 ILE F 16 121.135 5.851 8.562 1.00 0.00 H new ATOM 0 HG21 ILE F 16 121.516 2.744 6.551 1.00 0.00 H new ATOM 0 HG22 ILE F 16 120.121 1.880 7.240 1.00 0.00 H new ATOM 0 HG23 ILE F 16 119.862 3.233 6.114 1.00 0.00 H new ATOM 0 HD11 ILE F 16 122.726 6.078 6.670 1.00 0.00 H new ATOM 0 HD12 ILE F 16 123.092 4.616 7.616 1.00 0.00 H new ATOM 0 HD13 ILE F 16 122.240 4.479 6.060 1.00 0.00 H new ATOM 1054 N VAL F 17 117.768 2.078 7.885 1.00 0.00 N ATOM 1055 CA VAL F 17 117.096 0.788 7.984 1.00 0.00 C ATOM 1056 C VAL F 17 117.483 -0.105 6.801 1.00 0.00 C ATOM 1057 O VAL F 17 117.114 0.187 5.666 1.00 0.00 O ATOM 1058 CB VAL F 17 115.580 1.062 7.987 1.00 0.00 C ATOM 1059 CG1 VAL F 17 114.776 -0.197 7.619 1.00 0.00 C ATOM 1060 CG2 VAL F 17 115.157 1.561 9.379 1.00 0.00 C ATOM 0 H VAL F 17 117.682 2.520 6.970 1.00 0.00 H new ATOM 0 HA VAL F 17 117.390 0.267 8.895 1.00 0.00 H new ATOM 0 HB VAL F 17 115.369 1.823 7.235 1.00 0.00 H new ATOM 0 HG11 VAL F 17 113.711 0.035 7.631 1.00 0.00 H new ATOM 0 HG12 VAL F 17 115.063 -0.533 6.623 1.00 0.00 H new ATOM 0 HG13 VAL F 17 114.984 -0.986 8.342 1.00 0.00 H new ATOM 0 HG21 VAL F 17 114.085 1.756 9.385 1.00 0.00 H new ATOM 0 HG22 VAL F 17 115.392 0.802 10.125 1.00 0.00 H new ATOM 0 HG23 VAL F 17 115.694 2.480 9.615 1.00 0.00 H new ATOM 1070 N TYR F 18 118.208 -1.196 7.086 1.00 0.00 N ATOM 1071 CA TYR F 18 118.628 -2.140 6.041 1.00 0.00 C ATOM 1072 C TYR F 18 117.632 -3.282 5.942 1.00 0.00 C ATOM 1073 O TYR F 18 117.210 -3.839 6.960 1.00 0.00 O ATOM 1074 CB TYR F 18 120.040 -2.689 6.346 1.00 0.00 C ATOM 1075 CG TYR F 18 121.078 -1.856 5.620 1.00 0.00 C ATOM 1076 CD1 TYR F 18 121.002 -0.461 5.663 1.00 0.00 C ATOM 1077 CD2 TYR F 18 122.103 -2.473 4.886 1.00 0.00 C ATOM 1078 CE1 TYR F 18 121.934 0.315 4.982 1.00 0.00 C ATOM 1079 CE2 TYR F 18 123.040 -1.692 4.203 1.00 0.00 C ATOM 1080 CZ TYR F 18 122.955 -0.297 4.249 1.00 0.00 C ATOM 1081 OH TYR F 18 123.881 0.474 3.577 1.00 0.00 O ATOM 0 H TYR F 18 118.514 -1.446 8.026 1.00 0.00 H new ATOM 0 HA TYR F 18 118.660 -1.614 5.087 1.00 0.00 H new ATOM 0 HB2 TYR F 18 120.226 -2.665 7.420 1.00 0.00 H new ATOM 0 HB3 TYR F 18 120.111 -3.731 6.033 1.00 0.00 H new ATOM 0 HD1 TYR F 18 120.215 0.017 6.228 1.00 0.00 H new ATOM 0 HD2 TYR F 18 122.168 -3.550 4.849 1.00 0.00 H new ATOM 0 HE1 TYR F 18 121.869 1.392 5.020 1.00 0.00 H new ATOM 0 HE2 TYR F 18 123.830 -2.166 3.640 1.00 0.00 H new ATOM 0 HH TYR F 18 123.482 0.819 2.751 1.00 0.00 H new ATOM 1091 N LEU F 19 117.234 -3.599 4.703 1.00 0.00 N ATOM 1092 CA LEU F 19 116.243 -4.658 4.462 1.00 0.00 C ATOM 1093 C LEU F 19 116.791 -5.746 3.517 1.00 0.00 C ATOM 1094 O LEU F 19 116.435 -5.788 2.333 1.00 0.00 O ATOM 1095 CB LEU F 19 114.963 -4.031 3.871 1.00 0.00 C ATOM 1096 CG LEU F 19 114.485 -2.844 4.743 1.00 0.00 C ATOM 1097 CD1 LEU F 19 114.102 -1.664 3.844 1.00 0.00 C ATOM 1098 CD2 LEU F 19 113.275 -3.269 5.590 1.00 0.00 C ATOM 0 H LEU F 19 117.579 -3.143 3.858 1.00 0.00 H new ATOM 0 HA LEU F 19 116.015 -5.139 5.413 1.00 0.00 H new ATOM 0 HB2 LEU F 19 115.155 -3.688 2.854 1.00 0.00 H new ATOM 0 HB3 LEU F 19 114.177 -4.784 3.810 1.00 0.00 H new ATOM 0 HG LEU F 19 115.294 -2.541 5.408 1.00 0.00 H new ATOM 0 HD11 LEU F 19 113.766 -0.831 4.461 1.00 0.00 H new ATOM 0 HD12 LEU F 19 114.969 -1.356 3.259 1.00 0.00 H new ATOM 0 HD13 LEU F 19 113.298 -1.965 3.172 1.00 0.00 H new ATOM 0 HD21 LEU F 19 112.945 -2.428 6.200 1.00 0.00 H new ATOM 0 HD22 LEU F 19 112.463 -3.582 4.933 1.00 0.00 H new ATOM 0 HD23 LEU F 19 113.558 -4.099 6.238 1.00 0.00 H new ATOM 1110 N PRO F 20 117.637 -6.634 4.016 1.00 0.00 N ATOM 1111 CA PRO F 20 118.220 -7.743 3.203 1.00 0.00 C ATOM 1112 C PRO F 20 117.281 -8.954 3.120 1.00 0.00 C ATOM 1113 O PRO F 20 116.905 -9.386 2.028 1.00 0.00 O ATOM 1114 CB PRO F 20 119.510 -8.085 3.955 1.00 0.00 C ATOM 1115 CG PRO F 20 119.240 -7.747 5.388 1.00 0.00 C ATOM 1116 CD PRO F 20 118.138 -6.678 5.406 1.00 0.00 C ATOM 0 HA PRO F 20 118.389 -7.457 2.165 1.00 0.00 H new ATOM 0 HB2 PRO F 20 119.763 -9.139 3.841 1.00 0.00 H new ATOM 0 HB3 PRO F 20 120.353 -7.512 3.569 1.00 0.00 H new ATOM 0 HG2 PRO F 20 118.925 -8.633 5.939 1.00 0.00 H new ATOM 0 HG3 PRO F 20 120.143 -7.376 5.872 1.00 0.00 H new ATOM 0 HD2 PRO F 20 117.344 -6.939 6.105 1.00 0.00 H new ATOM 0 HD3 PRO F 20 118.530 -5.710 5.717 1.00 0.00 H new ATOM 1124 N ASN F 21 116.916 -9.494 4.286 1.00 0.00 N ATOM 1125 CA ASN F 21 116.029 -10.659 4.361 1.00 0.00 C ATOM 1126 C ASN F 21 114.660 -10.374 3.738 1.00 0.00 C ATOM 1127 O ASN F 21 113.975 -11.297 3.289 1.00 0.00 O ATOM 1128 CB ASN F 21 115.844 -11.078 5.825 1.00 0.00 C ATOM 1129 CG ASN F 21 117.173 -11.519 6.439 1.00 0.00 C ATOM 1130 OD1 ASN F 21 118.131 -11.816 5.724 1.00 0.00 O ATOM 1131 ND2 ASN F 21 117.285 -11.576 7.734 1.00 0.00 N ATOM 0 H ASN F 21 117.222 -9.142 5.193 1.00 0.00 H new ATOM 0 HA ASN F 21 116.496 -11.465 3.796 1.00 0.00 H new ATOM 0 HB2 ASN F 21 115.433 -10.246 6.396 1.00 0.00 H new ATOM 0 HB3 ASN F 21 115.123 -11.893 5.886 1.00 0.00 H new ATOM 0 HD21 ASN F 21 118.166 -11.867 8.157 1.00 0.00 H new ATOM 0 HD22 ASN F 21 116.492 -11.330 8.326 1.00 0.00 H new ATOM 1138 N LEU F 22 114.260 -9.096 3.738 1.00 0.00 N ATOM 1139 CA LEU F 22 112.959 -8.675 3.197 1.00 0.00 C ATOM 1140 C LEU F 22 112.755 -9.168 1.759 1.00 0.00 C ATOM 1141 O LEU F 22 113.724 -9.365 1.019 1.00 0.00 O ATOM 1142 CB LEU F 22 112.878 -7.142 3.228 1.00 0.00 C ATOM 1143 CG LEU F 22 111.435 -6.679 3.520 1.00 0.00 C ATOM 1144 CD1 LEU F 22 111.303 -6.280 5.004 1.00 0.00 C ATOM 1145 CD2 LEU F 22 111.094 -5.477 2.621 1.00 0.00 C ATOM 0 H LEU F 22 114.822 -8.330 4.109 1.00 0.00 H new ATOM 0 HA LEU F 22 112.174 -9.114 3.814 1.00 0.00 H new ATOM 0 HB2 LEU F 22 113.552 -6.752 3.991 1.00 0.00 H new ATOM 0 HB3 LEU F 22 113.209 -6.736 2.272 1.00 0.00 H new ATOM 0 HG LEU F 22 110.743 -7.495 3.312 1.00 0.00 H new ATOM 0 HD11 LEU F 22 110.282 -5.954 5.204 1.00 0.00 H new ATOM 0 HD12 LEU F 22 111.540 -7.138 5.634 1.00 0.00 H new ATOM 0 HD13 LEU F 22 111.993 -5.466 5.225 1.00 0.00 H new ATOM 0 HD21 LEU F 22 110.075 -5.148 2.825 1.00 0.00 H new ATOM 0 HD22 LEU F 22 111.787 -4.661 2.826 1.00 0.00 H new ATOM 0 HD23 LEU F 22 111.178 -5.770 1.574 1.00 0.00 H new ATOM 1157 N ASN F 23 111.485 -9.355 1.374 1.00 0.00 N ATOM 1158 CA ASN F 23 111.151 -9.814 0.026 1.00 0.00 C ATOM 1159 C ASN F 23 110.931 -8.607 -0.892 1.00 0.00 C ATOM 1160 O ASN F 23 110.518 -7.545 -0.420 1.00 0.00 O ATOM 1161 CB ASN F 23 109.883 -10.678 0.068 1.00 0.00 C ATOM 1162 CG ASN F 23 110.220 -12.084 0.565 1.00 0.00 C ATOM 1163 OD1 ASN F 23 110.665 -12.928 -0.213 1.00 0.00 O ATOM 1164 ND2 ASN F 23 110.037 -12.387 1.821 1.00 0.00 N ATOM 0 H ASN F 23 110.678 -9.195 1.977 1.00 0.00 H new ATOM 0 HA ASN F 23 111.975 -10.413 -0.363 1.00 0.00 H new ATOM 0 HB2 ASN F 23 109.143 -10.220 0.724 1.00 0.00 H new ATOM 0 HB3 ASN F 23 109.438 -10.732 -0.925 1.00 0.00 H new ATOM 0 HD21 ASN F 23 110.263 -13.323 2.158 1.00 0.00 H new ATOM 0 HD22 ASN F 23 109.668 -11.688 2.466 1.00 0.00 H new ATOM 1171 N PRO F 24 111.192 -8.732 -2.182 1.00 0.00 N ATOM 1172 CA PRO F 24 111.001 -7.596 -3.135 1.00 0.00 C ATOM 1173 C PRO F 24 109.562 -7.090 -3.113 1.00 0.00 C ATOM 1174 O PRO F 24 109.316 -5.890 -3.246 1.00 0.00 O ATOM 1175 CB PRO F 24 111.367 -8.178 -4.508 1.00 0.00 C ATOM 1176 CG PRO F 24 112.156 -9.413 -4.226 1.00 0.00 C ATOM 1177 CD PRO F 24 111.690 -9.937 -2.869 1.00 0.00 C ATOM 0 HA PRO F 24 111.617 -6.735 -2.876 1.00 0.00 H new ATOM 0 HB2 PRO F 24 110.472 -8.409 -5.087 1.00 0.00 H new ATOM 0 HB3 PRO F 24 111.950 -7.466 -5.092 1.00 0.00 H new ATOM 0 HG2 PRO F 24 111.996 -10.160 -5.004 1.00 0.00 H new ATOM 0 HG3 PRO F 24 113.224 -9.194 -4.209 1.00 0.00 H new ATOM 0 HD2 PRO F 24 110.908 -10.689 -2.977 1.00 0.00 H new ATOM 0 HD3 PRO F 24 112.507 -10.404 -2.318 1.00 0.00 H new ATOM 1185 N ASP F 25 108.621 -8.019 -2.910 1.00 0.00 N ATOM 1186 CA ASP F 25 107.204 -7.669 -2.828 1.00 0.00 C ATOM 1187 C ASP F 25 107.010 -6.683 -1.687 1.00 0.00 C ATOM 1188 O ASP F 25 106.334 -5.658 -1.828 1.00 0.00 O ATOM 1189 CB ASP F 25 106.378 -8.927 -2.542 1.00 0.00 C ATOM 1190 CG ASP F 25 104.885 -8.609 -2.634 1.00 0.00 C ATOM 1191 OD1 ASP F 25 104.361 -8.622 -3.737 1.00 0.00 O ATOM 1192 OD2 ASP F 25 104.287 -8.353 -1.600 1.00 0.00 O ATOM 0 H ASP F 25 108.817 -9.014 -2.800 1.00 0.00 H new ATOM 0 HA ASP F 25 106.880 -7.228 -3.771 1.00 0.00 H new ATOM 0 HB2 ASP F 25 106.635 -9.710 -3.255 1.00 0.00 H new ATOM 0 HB3 ASP F 25 106.616 -9.309 -1.549 1.00 0.00 H new ATOM 1197 N GLN F 26 107.648 -7.010 -0.564 1.00 0.00 N ATOM 1198 CA GLN F 26 107.602 -6.174 0.620 1.00 0.00 C ATOM 1199 C GLN F 26 108.314 -4.846 0.349 1.00 0.00 C ATOM 1200 O GLN F 26 107.868 -3.794 0.812 1.00 0.00 O ATOM 1201 CB GLN F 26 108.247 -6.914 1.799 1.00 0.00 C ATOM 1202 CG GLN F 26 107.419 -8.160 2.162 1.00 0.00 C ATOM 1203 CD GLN F 26 106.001 -7.771 2.593 1.00 0.00 C ATOM 1204 OE1 GLN F 26 105.817 -6.743 3.376 1.00 0.00 O flip ATOM 1205 NE2 GLN F 26 105.033 -8.422 2.202 1.00 0.00 N flip ATOM 0 H GLN F 26 108.206 -7.857 -0.456 1.00 0.00 H new ATOM 0 HA GLN F 26 106.564 -5.957 0.875 1.00 0.00 H new ATOM 0 HB2 GLN F 26 109.265 -7.207 1.541 1.00 0.00 H new ATOM 0 HB3 GLN F 26 108.315 -6.250 2.661 1.00 0.00 H new ATOM 0 HG2 GLN F 26 107.371 -8.831 1.305 1.00 0.00 H new ATOM 0 HG3 GLN F 26 107.911 -8.706 2.967 1.00 0.00 H new ATOM 0 HE21 GLN F 26 105.173 -9.226 1.590 1.00 0.00 H new ATOM 0 HE22 GLN F 26 104.091 -8.158 2.490 1.00 0.00 H new ATOM 1214 N LEU F 27 109.409 -4.896 -0.428 1.00 0.00 N ATOM 1215 CA LEU F 27 110.146 -3.674 -0.771 1.00 0.00 C ATOM 1216 C LEU F 27 109.271 -2.752 -1.614 1.00 0.00 C ATOM 1217 O LEU F 27 109.290 -1.537 -1.426 1.00 0.00 O ATOM 1218 CB LEU F 27 111.434 -3.987 -1.557 1.00 0.00 C ATOM 1219 CG LEU F 27 112.549 -4.507 -0.626 1.00 0.00 C ATOM 1220 CD1 LEU F 27 113.746 -4.968 -1.469 1.00 0.00 C ATOM 1221 CD2 LEU F 27 113.005 -3.388 0.327 1.00 0.00 C ATOM 0 H LEU F 27 109.796 -5.753 -0.823 1.00 0.00 H new ATOM 0 HA LEU F 27 110.417 -3.187 0.166 1.00 0.00 H new ATOM 0 HB2 LEU F 27 111.222 -4.731 -2.324 1.00 0.00 H new ATOM 0 HB3 LEU F 27 111.776 -3.088 -2.071 1.00 0.00 H new ATOM 0 HG LEU F 27 112.162 -5.343 -0.043 1.00 0.00 H new ATOM 0 HD11 LEU F 27 114.534 -5.335 -0.812 1.00 0.00 H new ATOM 0 HD12 LEU F 27 113.432 -5.767 -2.141 1.00 0.00 H new ATOM 0 HD13 LEU F 27 114.123 -4.129 -2.054 1.00 0.00 H new ATOM 0 HD21 LEU F 27 113.792 -3.765 0.980 1.00 0.00 H new ATOM 0 HD22 LEU F 27 113.386 -2.548 -0.254 1.00 0.00 H new ATOM 0 HD23 LEU F 27 112.160 -3.057 0.931 1.00 0.00 H new ATOM 1233 N CYS F 28 108.513 -3.338 -2.548 1.00 0.00 N ATOM 1234 CA CYS F 28 107.636 -2.550 -3.416 1.00 0.00 C ATOM 1235 C CYS F 28 106.554 -1.870 -2.581 1.00 0.00 C ATOM 1236 O CYS F 28 106.322 -0.667 -2.718 1.00 0.00 O ATOM 1237 CB CYS F 28 106.997 -3.448 -4.485 1.00 0.00 C ATOM 1238 SG CYS F 28 106.310 -2.419 -5.808 1.00 0.00 S ATOM 0 H CYS F 28 108.490 -4.343 -2.720 1.00 0.00 H new ATOM 0 HA CYS F 28 108.230 -1.785 -3.917 1.00 0.00 H new ATOM 0 HB2 CYS F 28 107.741 -4.133 -4.892 1.00 0.00 H new ATOM 0 HB3 CYS F 28 106.211 -4.059 -4.040 1.00 0.00 H new ATOM 1243 N ALA F 29 105.914 -2.648 -1.702 1.00 0.00 N ATOM 1244 CA ALA F 29 104.871 -2.118 -0.822 1.00 0.00 C ATOM 1245 C ALA F 29 105.473 -1.075 0.119 1.00 0.00 C ATOM 1246 O ALA F 29 104.859 -0.039 0.395 1.00 0.00 O ATOM 1247 CB ALA F 29 104.256 -3.258 -0.003 1.00 0.00 C ATOM 0 H ALA F 29 106.100 -3.644 -1.582 1.00 0.00 H new ATOM 0 HA ALA F 29 104.094 -1.651 -1.427 1.00 0.00 H new ATOM 0 HB1 ALA F 29 103.480 -2.859 0.651 1.00 0.00 H new ATOM 0 HB2 ALA F 29 103.819 -3.995 -0.677 1.00 0.00 H new ATOM 0 HB3 ALA F 29 105.031 -3.732 0.600 1.00 0.00 H new ATOM 1253 N PHE F 30 106.685 -1.367 0.595 1.00 0.00 N ATOM 1254 CA PHE F 30 107.405 -0.474 1.499 1.00 0.00 C ATOM 1255 C PHE F 30 107.678 0.866 0.817 1.00 0.00 C ATOM 1256 O PHE F 30 107.348 1.923 1.358 1.00 0.00 O ATOM 1257 CB PHE F 30 108.731 -1.150 1.909 1.00 0.00 C ATOM 1258 CG PHE F 30 109.640 -0.181 2.648 1.00 0.00 C ATOM 1259 CD1 PHE F 30 109.193 0.448 3.818 1.00 0.00 C ATOM 1260 CD2 PHE F 30 110.937 0.084 2.163 1.00 0.00 C ATOM 1261 CE1 PHE F 30 110.030 1.335 4.500 1.00 0.00 C ATOM 1262 CE2 PHE F 30 111.769 0.973 2.850 1.00 0.00 C ATOM 1263 CZ PHE F 30 111.314 1.597 4.017 1.00 0.00 C ATOM 0 H PHE F 30 107.190 -2.223 0.366 1.00 0.00 H new ATOM 0 HA PHE F 30 106.801 -0.283 2.386 1.00 0.00 H new ATOM 0 HB2 PHE F 30 108.522 -2.011 2.543 1.00 0.00 H new ATOM 0 HB3 PHE F 30 109.240 -1.525 1.021 1.00 0.00 H new ATOM 0 HD1 PHE F 30 108.200 0.247 4.193 1.00 0.00 H new ATOM 0 HD2 PHE F 30 111.287 -0.399 1.263 1.00 0.00 H new ATOM 0 HE1 PHE F 30 109.684 1.818 5.402 1.00 0.00 H new ATOM 0 HE2 PHE F 30 112.763 1.178 2.480 1.00 0.00 H new ATOM 0 HZ PHE F 30 111.958 2.284 4.546 1.00 0.00 H new ATOM 1273 N ILE F 31 108.283 0.804 -0.369 1.00 0.00 N ATOM 1274 CA ILE F 31 108.614 2.008 -1.130 1.00 0.00 C ATOM 1275 C ILE F 31 107.356 2.752 -1.591 1.00 0.00 C ATOM 1276 O ILE F 31 107.371 3.981 -1.704 1.00 0.00 O ATOM 1277 CB ILE F 31 109.516 1.643 -2.323 1.00 0.00 C ATOM 1278 CG1 ILE F 31 110.860 1.125 -1.779 1.00 0.00 C ATOM 1279 CG2 ILE F 31 109.770 2.879 -3.205 1.00 0.00 C ATOM 1280 CD1 ILE F 31 111.711 0.559 -2.924 1.00 0.00 C ATOM 0 H ILE F 31 108.554 -0.068 -0.824 1.00 0.00 H new ATOM 0 HA ILE F 31 109.159 2.687 -0.474 1.00 0.00 H new ATOM 0 HB ILE F 31 109.025 0.879 -2.926 1.00 0.00 H new ATOM 0 HG12 ILE F 31 111.396 1.934 -1.283 1.00 0.00 H new ATOM 0 HG13 ILE F 31 110.684 0.353 -1.030 1.00 0.00 H new ATOM 0 HG21 ILE F 31 110.409 2.603 -4.043 1.00 0.00 H new ATOM 0 HG22 ILE F 31 108.820 3.258 -3.582 1.00 0.00 H new ATOM 0 HG23 ILE F 31 110.260 3.653 -2.614 1.00 0.00 H new ATOM 0 HD11 ILE F 31 112.659 0.196 -2.527 1.00 0.00 H new ATOM 0 HD12 ILE F 31 111.178 -0.264 -3.401 1.00 0.00 H new ATOM 0 HD13 ILE F 31 111.901 1.342 -3.658 1.00 0.00 H new ATOM 1292 N HIS F 32 106.281 2.008 -1.866 1.00 0.00 N ATOM 1293 CA HIS F 32 105.031 2.620 -2.322 1.00 0.00 C ATOM 1294 C HIS F 32 104.487 3.588 -1.267 1.00 0.00 C ATOM 1295 O HIS F 32 104.166 4.734 -1.582 1.00 0.00 O ATOM 1296 CB HIS F 32 103.993 1.524 -2.615 1.00 0.00 C ATOM 1297 CG HIS F 32 102.742 2.104 -3.233 1.00 0.00 C ATOM 1298 ND1 HIS F 32 102.619 3.441 -3.595 1.00 0.00 N ATOM 1299 CD2 HIS F 32 101.550 1.517 -3.573 1.00 0.00 C ATOM 1300 CE1 HIS F 32 101.393 3.605 -4.126 1.00 0.00 C ATOM 1301 NE2 HIS F 32 100.701 2.464 -4.137 1.00 0.00 N ATOM 0 H HIS F 32 106.251 0.992 -1.782 1.00 0.00 H new ATOM 0 HA HIS F 32 105.230 3.182 -3.234 1.00 0.00 H new ATOM 0 HB2 HIS F 32 104.424 0.783 -3.288 1.00 0.00 H new ATOM 0 HB3 HIS F 32 103.738 1.005 -1.691 1.00 0.00 H new ATOM 0 HD1 HIS F 32 103.328 4.165 -3.479 1.00 0.00 H new ATOM 0 HD2 HIS F 32 101.307 0.475 -3.425 1.00 0.00 H new ATOM 0 HE1 HIS F 32 101.015 4.546 -4.498 1.00 0.00 H new ATOM 1310 N SER F 33 104.405 3.126 -0.015 1.00 0.00 N ATOM 1311 CA SER F 33 103.910 3.969 1.081 1.00 0.00 C ATOM 1312 C SER F 33 104.959 5.018 1.466 1.00 0.00 C ATOM 1313 O SER F 33 104.627 6.171 1.752 1.00 0.00 O ATOM 1314 CB SER F 33 103.563 3.100 2.293 1.00 0.00 C ATOM 1315 OG SER F 33 102.605 2.120 1.912 1.00 0.00 O ATOM 0 H SER F 33 104.672 2.182 0.264 1.00 0.00 H new ATOM 0 HA SER F 33 103.011 4.486 0.746 1.00 0.00 H new ATOM 0 HB2 SER F 33 104.461 2.617 2.677 1.00 0.00 H new ATOM 0 HB3 SER F 33 103.166 3.720 3.097 1.00 0.00 H new ATOM 0 HG SER F 33 102.383 1.562 2.686 1.00 0.00 H new ATOM 1321 N LEU F 34 106.221 4.590 1.457 1.00 0.00 N ATOM 1322 CA LEU F 34 107.360 5.446 1.784 1.00 0.00 C ATOM 1323 C LEU F 34 107.390 6.687 0.883 1.00 0.00 C ATOM 1324 O LEU F 34 107.670 7.793 1.353 1.00 0.00 O ATOM 1325 CB LEU F 34 108.628 4.599 1.582 1.00 0.00 C ATOM 1326 CG LEU F 34 109.922 5.391 1.837 1.00 0.00 C ATOM 1327 CD1 LEU F 34 110.433 5.094 3.252 1.00 0.00 C ATOM 1328 CD2 LEU F 34 110.990 4.962 0.815 1.00 0.00 C ATOM 0 H LEU F 34 106.483 3.633 1.221 1.00 0.00 H new ATOM 0 HA LEU F 34 107.289 5.803 2.812 1.00 0.00 H new ATOM 0 HB2 LEU F 34 108.596 3.740 2.252 1.00 0.00 H new ATOM 0 HB3 LEU F 34 108.641 4.209 0.564 1.00 0.00 H new ATOM 0 HG LEU F 34 109.721 6.458 1.737 1.00 0.00 H new ATOM 0 HD11 LEU F 34 111.350 5.655 3.433 1.00 0.00 H new ATOM 0 HD12 LEU F 34 109.678 5.388 3.981 1.00 0.00 H new ATOM 0 HD13 LEU F 34 110.635 4.027 3.349 1.00 0.00 H new ATOM 0 HD21 LEU F 34 111.909 5.521 0.992 1.00 0.00 H new ATOM 0 HD22 LEU F 34 111.188 3.895 0.922 1.00 0.00 H new ATOM 0 HD23 LEU F 34 110.631 5.165 -0.194 1.00 0.00 H new ATOM 1340 N HIS F 35 107.113 6.486 -0.410 1.00 0.00 N ATOM 1341 CA HIS F 35 107.123 7.585 -1.383 1.00 0.00 C ATOM 1342 C HIS F 35 105.811 8.383 -1.368 1.00 0.00 C ATOM 1343 O HIS F 35 105.833 9.611 -1.244 1.00 0.00 O ATOM 1344 CB HIS F 35 107.357 7.018 -2.787 1.00 0.00 C ATOM 1345 CG HIS F 35 107.618 8.142 -3.754 1.00 0.00 C ATOM 1346 ND1 HIS F 35 106.601 8.938 -4.258 1.00 0.00 N ATOM 1347 CD2 HIS F 35 108.777 8.611 -4.325 1.00 0.00 C ATOM 1348 CE1 HIS F 35 107.162 9.835 -5.092 1.00 0.00 C ATOM 1349 NE2 HIS F 35 108.487 9.678 -5.169 1.00 0.00 N ATOM 0 H HIS F 35 106.880 5.576 -0.807 1.00 0.00 H new ATOM 0 HA HIS F 35 107.928 8.266 -1.106 1.00 0.00 H new ATOM 0 HB2 HIS F 35 108.204 6.332 -2.776 1.00 0.00 H new ATOM 0 HB3 HIS F 35 106.487 6.445 -3.107 1.00 0.00 H new ATOM 0 HD2 HIS F 35 109.764 8.211 -4.145 1.00 0.00 H new ATOM 0 HE1 HIS F 35 106.609 10.589 -5.632 1.00 0.00 H new ATOM 0 HE2 HIS F 35 109.144 10.223 -5.727 1.00 0.00 H new ATOM 1358 N ASP F 36 104.680 7.679 -1.519 1.00 0.00 N ATOM 1359 CA ASP F 36 103.360 8.327 -1.546 1.00 0.00 C ATOM 1360 C ASP F 36 103.071 9.108 -0.262 1.00 0.00 C ATOM 1361 O ASP F 36 102.418 10.154 -0.308 1.00 0.00 O ATOM 1362 CB ASP F 36 102.261 7.276 -1.771 1.00 0.00 C ATOM 1363 CG ASP F 36 102.234 6.846 -3.243 1.00 0.00 C ATOM 1364 OD1 ASP F 36 103.203 6.251 -3.690 1.00 0.00 O ATOM 1365 OD2 ASP F 36 101.244 7.122 -3.903 1.00 0.00 O ATOM 0 H ASP F 36 104.652 6.665 -1.624 1.00 0.00 H new ATOM 0 HA ASP F 36 103.367 9.039 -2.371 1.00 0.00 H new ATOM 0 HB2 ASP F 36 102.440 6.409 -1.135 1.00 0.00 H new ATOM 0 HB3 ASP F 36 101.292 7.686 -1.486 1.00 0.00 H new ATOM 1370 N ASP F 37 103.542 8.590 0.876 1.00 0.00 N ATOM 1371 CA ASP F 37 103.318 9.242 2.172 1.00 0.00 C ATOM 1372 C ASP F 37 104.645 9.408 2.931 1.00 0.00 C ATOM 1373 O ASP F 37 104.988 8.580 3.782 1.00 0.00 O ATOM 1374 CB ASP F 37 102.321 8.413 3.003 1.00 0.00 C ATOM 1375 CG ASP F 37 100.890 8.637 2.499 1.00 0.00 C ATOM 1376 OD1 ASP F 37 100.642 8.390 1.327 1.00 0.00 O ATOM 1377 OD2 ASP F 37 100.060 9.050 3.296 1.00 0.00 O ATOM 0 H ASP F 37 104.079 7.724 0.928 1.00 0.00 H new ATOM 0 HA ASP F 37 102.900 10.234 2.001 1.00 0.00 H new ATOM 0 HB2 ASP F 37 102.575 7.355 2.938 1.00 0.00 H new ATOM 0 HB3 ASP F 37 102.392 8.694 4.054 1.00 0.00 H new ATOM 1382 N PRO F 38 105.393 10.461 2.640 1.00 0.00 N ATOM 1383 CA PRO F 38 106.702 10.731 3.316 1.00 0.00 C ATOM 1384 C PRO F 38 106.548 10.808 4.836 1.00 0.00 C ATOM 1385 O PRO F 38 107.461 10.449 5.579 1.00 0.00 O ATOM 1386 CB PRO F 38 107.159 12.078 2.737 1.00 0.00 C ATOM 1387 CG PRO F 38 106.393 12.255 1.467 1.00 0.00 C ATOM 1388 CD PRO F 38 105.078 11.500 1.640 1.00 0.00 C ATOM 0 HA PRO F 38 107.424 9.934 3.140 1.00 0.00 H new ATOM 0 HB2 PRO F 38 106.956 12.892 3.433 1.00 0.00 H new ATOM 0 HB3 PRO F 38 108.233 12.079 2.550 1.00 0.00 H new ATOM 0 HG2 PRO F 38 106.210 13.311 1.269 1.00 0.00 H new ATOM 0 HG3 PRO F 38 106.955 11.865 0.618 1.00 0.00 H new ATOM 0 HD2 PRO F 38 104.282 12.159 1.986 1.00 0.00 H new ATOM 0 HD3 PRO F 38 104.743 11.061 0.700 1.00 0.00 H new ATOM 1396 N SER F 39 105.381 11.275 5.284 1.00 0.00 N ATOM 1397 CA SER F 39 105.098 11.391 6.715 1.00 0.00 C ATOM 1398 C SER F 39 105.122 10.018 7.391 1.00 0.00 C ATOM 1399 O SER F 39 105.439 9.917 8.578 1.00 0.00 O ATOM 1400 CB SER F 39 103.728 12.041 6.930 1.00 0.00 C ATOM 1401 OG SER F 39 103.484 12.165 8.326 1.00 0.00 O ATOM 0 H SER F 39 104.619 11.578 4.678 1.00 0.00 H new ATOM 0 HA SER F 39 105.872 12.014 7.162 1.00 0.00 H new ATOM 0 HB2 SER F 39 103.699 13.022 6.455 1.00 0.00 H new ATOM 0 HB3 SER F 39 102.949 11.438 6.464 1.00 0.00 H new ATOM 0 HG SER F 39 102.609 12.582 8.469 1.00 0.00 H new ATOM 1407 N GLN F 40 104.769 8.975 6.629 1.00 0.00 N ATOM 1408 CA GLN F 40 104.734 7.607 7.151 1.00 0.00 C ATOM 1409 C GLN F 40 106.052 6.875 6.928 1.00 0.00 C ATOM 1410 O GLN F 40 106.236 5.790 7.467 1.00 0.00 O ATOM 1411 CB GLN F 40 103.611 6.808 6.467 1.00 0.00 C ATOM 1412 CG GLN F 40 102.248 7.304 6.949 1.00 0.00 C ATOM 1413 CD GLN F 40 101.131 6.473 6.320 1.00 0.00 C ATOM 1414 OE1 GLN F 40 100.881 5.345 6.744 1.00 0.00 O ATOM 1415 NE2 GLN F 40 100.439 6.965 5.329 1.00 0.00 N ATOM 0 H GLN F 40 104.503 9.055 5.647 1.00 0.00 H new ATOM 0 HA GLN F 40 104.554 7.681 8.223 1.00 0.00 H new ATOM 0 HB2 GLN F 40 103.684 6.915 5.385 1.00 0.00 H new ATOM 0 HB3 GLN F 40 103.721 5.747 6.690 1.00 0.00 H new ATOM 0 HG2 GLN F 40 102.192 7.238 8.036 1.00 0.00 H new ATOM 0 HG3 GLN F 40 102.122 8.354 6.687 1.00 0.00 H new ATOM 0 HE21 GLN F 40 100.646 7.900 4.977 1.00 0.00 H new ATOM 0 HE22 GLN F 40 99.691 6.415 4.906 1.00 0.00 H new ATOM 1424 N SER F 41 106.955 7.445 6.122 1.00 0.00 N ATOM 1425 CA SER F 41 108.238 6.786 5.826 1.00 0.00 C ATOM 1426 C SER F 41 108.967 6.360 7.103 1.00 0.00 C ATOM 1427 O SER F 41 109.479 5.244 7.191 1.00 0.00 O ATOM 1428 CB SER F 41 109.132 7.727 5.013 1.00 0.00 C ATOM 1429 OG SER F 41 109.506 8.844 5.810 1.00 0.00 O ATOM 0 H SER F 41 106.827 8.349 5.667 1.00 0.00 H new ATOM 0 HA SER F 41 108.022 5.888 5.248 1.00 0.00 H new ATOM 0 HB2 SER F 41 110.022 7.196 4.674 1.00 0.00 H new ATOM 0 HB3 SER F 41 108.604 8.065 4.121 1.00 0.00 H new ATOM 0 HG SER F 41 108.975 9.625 5.548 1.00 0.00 H new ATOM 1435 N ALA F 42 108.999 7.260 8.076 1.00 0.00 N ATOM 1436 CA ALA F 42 109.662 6.997 9.357 1.00 0.00 C ATOM 1437 C ALA F 42 109.015 5.810 10.075 1.00 0.00 C ATOM 1438 O ALA F 42 109.707 4.873 10.484 1.00 0.00 O ATOM 1439 CB ALA F 42 109.582 8.241 10.248 1.00 0.00 C ATOM 0 H ALA F 42 108.573 8.184 8.007 1.00 0.00 H new ATOM 0 HA ALA F 42 110.706 6.754 9.158 1.00 0.00 H new ATOM 0 HB1 ALA F 42 110.076 8.040 11.199 1.00 0.00 H new ATOM 0 HB2 ALA F 42 110.076 9.076 9.752 1.00 0.00 H new ATOM 0 HB3 ALA F 42 108.537 8.493 10.428 1.00 0.00 H new ATOM 1445 N ASN F 43 107.685 5.849 10.215 1.00 0.00 N ATOM 1446 CA ASN F 43 106.957 4.759 10.873 1.00 0.00 C ATOM 1447 C ASN F 43 107.100 3.473 10.064 1.00 0.00 C ATOM 1448 O ASN F 43 107.241 2.384 10.626 1.00 0.00 O ATOM 1449 CB ASN F 43 105.472 5.110 11.022 1.00 0.00 C ATOM 1450 CG ASN F 43 105.301 6.300 11.964 1.00 0.00 C ATOM 1451 OD1 ASN F 43 104.861 7.372 11.544 1.00 0.00 O ATOM 1452 ND2 ASN F 43 105.619 6.174 13.222 1.00 0.00 N ATOM 0 H ASN F 43 107.097 6.614 9.886 1.00 0.00 H new ATOM 0 HA ASN F 43 107.383 4.613 11.866 1.00 0.00 H new ATOM 0 HB2 ASN F 43 105.047 5.346 10.046 1.00 0.00 H new ATOM 0 HB3 ASN F 43 104.925 4.250 11.408 1.00 0.00 H new ATOM 0 HD21 ASN F 43 105.504 6.963 13.859 1.00 0.00 H new ATOM 0 HD22 ASN F 43 105.983 5.287 13.570 1.00 0.00 H new ATOM 1459 N LEU F 44 107.074 3.619 8.738 1.00 0.00 N ATOM 1460 CA LEU F 44 107.216 2.480 7.839 1.00 0.00 C ATOM 1461 C LEU F 44 108.593 1.868 8.010 1.00 0.00 C ATOM 1462 O LEU F 44 108.743 0.653 7.932 1.00 0.00 O ATOM 1463 CB LEU F 44 107.031 2.916 6.381 1.00 0.00 C ATOM 1464 CG LEU F 44 105.554 3.252 6.111 1.00 0.00 C ATOM 1465 CD1 LEU F 44 105.451 4.193 4.903 1.00 0.00 C ATOM 1466 CD2 LEU F 44 104.777 1.959 5.821 1.00 0.00 C ATOM 0 H LEU F 44 106.956 4.516 8.266 1.00 0.00 H new ATOM 0 HA LEU F 44 106.450 1.745 8.085 1.00 0.00 H new ATOM 0 HB2 LEU F 44 107.654 3.786 6.172 1.00 0.00 H new ATOM 0 HB3 LEU F 44 107.359 2.121 5.711 1.00 0.00 H new ATOM 0 HG LEU F 44 105.130 3.742 6.988 1.00 0.00 H new ATOM 0 HD11 LEU F 44 104.404 4.429 4.714 1.00 0.00 H new ATOM 0 HD12 LEU F 44 105.999 5.112 5.110 1.00 0.00 H new ATOM 0 HD13 LEU F 44 105.877 3.707 4.026 1.00 0.00 H new ATOM 0 HD21 LEU F 44 103.731 2.198 5.630 1.00 0.00 H new ATOM 0 HD22 LEU F 44 105.202 1.467 4.946 1.00 0.00 H new ATOM 0 HD23 LEU F 44 104.846 1.293 6.681 1.00 0.00 H new ATOM 1478 N LEU F 45 109.592 2.728 8.249 1.00 0.00 N ATOM 1479 CA LEU F 45 110.972 2.280 8.446 1.00 0.00 C ATOM 1480 C LEU F 45 111.055 1.337 9.640 1.00 0.00 C ATOM 1481 O LEU F 45 111.760 0.331 9.595 1.00 0.00 O ATOM 1482 CB LEU F 45 111.896 3.490 8.696 1.00 0.00 C ATOM 1483 CG LEU F 45 112.896 3.647 7.540 1.00 0.00 C ATOM 1484 CD1 LEU F 45 112.191 4.313 6.343 1.00 0.00 C ATOM 1485 CD2 LEU F 45 114.083 4.528 7.980 1.00 0.00 C ATOM 0 H LEU F 45 109.467 3.738 8.310 1.00 0.00 H new ATOM 0 HA LEU F 45 111.293 1.757 7.545 1.00 0.00 H new ATOM 0 HB2 LEU F 45 111.300 4.397 8.795 1.00 0.00 H new ATOM 0 HB3 LEU F 45 112.433 3.358 9.635 1.00 0.00 H new ATOM 0 HG LEU F 45 113.266 2.662 7.255 1.00 0.00 H new ATOM 0 HD11 LEU F 45 112.898 4.426 5.521 1.00 0.00 H new ATOM 0 HD12 LEU F 45 111.356 3.691 6.021 1.00 0.00 H new ATOM 0 HD13 LEU F 45 111.820 5.294 6.639 1.00 0.00 H new ATOM 0 HD21 LEU F 45 114.785 4.632 7.153 1.00 0.00 H new ATOM 0 HD22 LEU F 45 113.717 5.512 8.272 1.00 0.00 H new ATOM 0 HD23 LEU F 45 114.587 4.063 8.827 1.00 0.00 H new ATOM 1497 N ALA F 46 110.325 1.681 10.699 1.00 0.00 N ATOM 1498 CA ALA F 46 110.317 0.873 11.909 1.00 0.00 C ATOM 1499 C ALA F 46 109.737 -0.513 11.629 1.00 0.00 C ATOM 1500 O ALA F 46 110.423 -1.515 11.822 1.00 0.00 O ATOM 1501 CB ALA F 46 109.494 1.579 12.996 1.00 0.00 C ATOM 0 H ALA F 46 109.734 2.512 10.741 1.00 0.00 H new ATOM 0 HA ALA F 46 111.343 0.751 12.255 1.00 0.00 H new ATOM 0 HB1 ALA F 46 109.490 0.972 13.901 1.00 0.00 H new ATOM 0 HB2 ALA F 46 109.936 2.551 13.213 1.00 0.00 H new ATOM 0 HB3 ALA F 46 108.471 1.716 12.646 1.00 0.00 H new ATOM 1507 N GLU F 47 108.482 -0.567 11.176 1.00 0.00 N ATOM 1508 CA GLU F 47 107.839 -1.853 10.888 1.00 0.00 C ATOM 1509 C GLU F 47 108.578 -2.611 9.796 1.00 0.00 C ATOM 1510 O GLU F 47 108.708 -3.828 9.877 1.00 0.00 O ATOM 1511 CB GLU F 47 106.393 -1.653 10.448 1.00 0.00 C ATOM 1512 CG GLU F 47 105.530 -1.134 11.609 1.00 0.00 C ATOM 1513 CD GLU F 47 105.542 -2.108 12.800 1.00 0.00 C ATOM 1514 OE1 GLU F 47 105.195 -3.265 12.604 1.00 0.00 O ATOM 1515 OE2 GLU F 47 105.885 -1.679 13.891 1.00 0.00 O ATOM 0 H GLU F 47 107.898 0.251 11.003 1.00 0.00 H new ATOM 0 HA GLU F 47 107.866 -2.433 11.810 1.00 0.00 H new ATOM 0 HB2 GLU F 47 106.356 -0.947 9.619 1.00 0.00 H new ATOM 0 HB3 GLU F 47 105.987 -2.596 10.082 1.00 0.00 H new ATOM 0 HG2 GLU F 47 105.899 -0.160 11.931 1.00 0.00 H new ATOM 0 HG3 GLU F 47 104.505 -0.990 11.266 1.00 0.00 H new ATOM 1522 N ALA F 48 109.064 -1.888 8.781 1.00 0.00 N ATOM 1523 CA ALA F 48 109.799 -2.516 7.680 1.00 0.00 C ATOM 1524 C ALA F 48 111.046 -3.183 8.237 1.00 0.00 C ATOM 1525 O ALA F 48 111.338 -4.351 7.948 1.00 0.00 O ATOM 1526 CB ALA F 48 110.201 -1.457 6.644 1.00 0.00 C ATOM 0 H ALA F 48 108.963 -0.876 8.700 1.00 0.00 H new ATOM 0 HA ALA F 48 109.165 -3.259 7.196 1.00 0.00 H new ATOM 0 HB1 ALA F 48 110.747 -1.933 5.830 1.00 0.00 H new ATOM 0 HB2 ALA F 48 109.306 -0.977 6.249 1.00 0.00 H new ATOM 0 HB3 ALA F 48 110.836 -0.708 7.117 1.00 0.00 H new ATOM 1532 N LYS F 49 111.757 -2.427 9.069 1.00 0.00 N ATOM 1533 CA LYS F 49 112.955 -2.920 9.708 1.00 0.00 C ATOM 1534 C LYS F 49 112.614 -4.105 10.622 1.00 0.00 C ATOM 1535 O LYS F 49 113.375 -5.071 10.693 1.00 0.00 O ATOM 1536 CB LYS F 49 113.613 -1.792 10.508 1.00 0.00 C ATOM 1537 CG LYS F 49 115.011 -2.234 10.962 1.00 0.00 C ATOM 1538 CD LYS F 49 115.137 -2.084 12.482 1.00 0.00 C ATOM 1539 CE LYS F 49 115.250 -0.601 12.859 1.00 0.00 C ATOM 1540 NZ LYS F 49 115.390 -0.475 14.338 1.00 0.00 N ATOM 0 H LYS F 49 111.515 -1.466 9.312 1.00 0.00 H new ATOM 0 HA LYS F 49 113.655 -3.264 8.947 1.00 0.00 H new ATOM 0 HB2 LYS F 49 113.685 -0.892 9.897 1.00 0.00 H new ATOM 0 HB3 LYS F 49 113.000 -1.541 11.374 1.00 0.00 H new ATOM 0 HG2 LYS F 49 115.185 -3.271 10.674 1.00 0.00 H new ATOM 0 HG3 LYS F 49 115.772 -1.633 10.464 1.00 0.00 H new ATOM 0 HD2 LYS F 49 114.270 -2.526 12.972 1.00 0.00 H new ATOM 0 HD3 LYS F 49 116.014 -2.625 12.837 1.00 0.00 H new ATOM 0 HE2 LYS F 49 116.110 -0.153 12.362 1.00 0.00 H new ATOM 0 HE3 LYS F 49 114.367 -0.060 12.519 1.00 0.00 H new ATOM 0 HZ1 LYS F 49 115.467 0.530 14.595 1.00 0.00 H new ATOM 0 HZ2 LYS F 49 114.556 -0.888 14.802 1.00 0.00 H new ATOM 0 HZ3 LYS F 49 116.245 -0.978 14.650 1.00 0.00 H new ATOM 1554 N LYS F 50 111.444 -4.046 11.286 1.00 0.00 N ATOM 1555 CA LYS F 50 111.011 -5.149 12.149 1.00 0.00 C ATOM 1556 C LYS F 50 110.658 -6.338 11.277 1.00 0.00 C ATOM 1557 O LYS F 50 110.867 -7.490 11.657 1.00 0.00 O ATOM 1558 CB LYS F 50 109.779 -4.753 12.981 1.00 0.00 C ATOM 1559 CG LYS F 50 110.156 -3.733 14.065 1.00 0.00 C ATOM 1560 CD LYS F 50 108.898 -3.352 14.867 1.00 0.00 C ATOM 1561 CE LYS F 50 108.983 -1.891 15.321 1.00 0.00 C ATOM 1562 NZ LYS F 50 107.730 -1.524 16.040 1.00 0.00 N ATOM 0 H LYS F 50 110.796 -3.260 11.240 1.00 0.00 H new ATOM 0 HA LYS F 50 111.822 -5.397 12.834 1.00 0.00 H new ATOM 0 HB2 LYS F 50 109.015 -4.331 12.329 1.00 0.00 H new ATOM 0 HB3 LYS F 50 109.348 -5.640 13.445 1.00 0.00 H new ATOM 0 HG2 LYS F 50 110.911 -4.154 14.729 1.00 0.00 H new ATOM 0 HG3 LYS F 50 110.593 -2.845 13.608 1.00 0.00 H new ATOM 0 HD2 LYS F 50 108.009 -3.499 14.254 1.00 0.00 H new ATOM 0 HD3 LYS F 50 108.799 -4.005 15.734 1.00 0.00 H new ATOM 0 HE2 LYS F 50 109.845 -1.751 15.974 1.00 0.00 H new ATOM 0 HE3 LYS F 50 109.126 -1.238 14.460 1.00 0.00 H new ATOM 0 HZ1 LYS F 50 107.825 -0.568 16.437 1.00 0.00 H new ATOM 0 HZ2 LYS F 50 106.930 -1.545 15.376 1.00 0.00 H new ATOM 0 HZ3 LYS F 50 107.560 -2.203 16.809 1.00 0.00 H new ATOM 1576 N LEU F 51 110.114 -6.030 10.098 1.00 0.00 N ATOM 1577 CA LEU F 51 109.711 -7.048 9.143 1.00 0.00 C ATOM 1578 C LEU F 51 110.928 -7.836 8.692 1.00 0.00 C ATOM 1579 O LEU F 51 110.868 -9.055 8.538 1.00 0.00 O ATOM 1580 CB LEU F 51 109.032 -6.381 7.945 1.00 0.00 C ATOM 1581 CG LEU F 51 108.044 -7.348 7.293 1.00 0.00 C ATOM 1582 CD1 LEU F 51 106.903 -7.655 8.276 1.00 0.00 C ATOM 1583 CD2 LEU F 51 107.482 -6.695 6.029 1.00 0.00 C ATOM 0 H LEU F 51 109.944 -5.074 9.786 1.00 0.00 H new ATOM 0 HA LEU F 51 109.006 -7.734 9.612 1.00 0.00 H new ATOM 0 HB2 LEU F 51 108.511 -5.480 8.268 1.00 0.00 H new ATOM 0 HB3 LEU F 51 109.783 -6.071 7.218 1.00 0.00 H new ATOM 0 HG LEU F 51 108.546 -8.280 7.033 1.00 0.00 H new ATOM 0 HD11 LEU F 51 106.198 -8.345 7.811 1.00 0.00 H new ATOM 0 HD12 LEU F 51 107.313 -8.108 9.179 1.00 0.00 H new ATOM 0 HD13 LEU F 51 106.388 -6.730 8.536 1.00 0.00 H new ATOM 0 HD21 LEU F 51 106.775 -7.374 5.552 1.00 0.00 H new ATOM 0 HD22 LEU F 51 106.973 -5.768 6.294 1.00 0.00 H new ATOM 0 HD23 LEU F 51 108.297 -6.477 5.339 1.00 0.00 H new ATOM 1595 N ASN F 52 112.043 -7.124 8.531 1.00 0.00 N ATOM 1596 CA ASN F 52 113.305 -7.749 8.152 1.00 0.00 C ATOM 1597 C ASN F 52 113.655 -8.804 9.213 1.00 0.00 C ATOM 1598 O ASN F 52 114.070 -9.918 8.886 1.00 0.00 O ATOM 1599 CB ASN F 52 114.401 -6.655 8.021 1.00 0.00 C ATOM 1600 CG ASN F 52 115.619 -6.953 8.896 1.00 0.00 C ATOM 1601 OD1 ASN F 52 116.567 -7.600 8.453 1.00 0.00 O ATOM 1602 ND2 ASN F 52 115.638 -6.518 10.120 1.00 0.00 N ATOM 0 H ASN F 52 112.096 -6.113 8.658 1.00 0.00 H new ATOM 0 HA ASN F 52 113.229 -8.247 7.185 1.00 0.00 H new ATOM 0 HB2 ASN F 52 114.713 -6.578 6.980 1.00 0.00 H new ATOM 0 HB3 ASN F 52 113.983 -5.688 8.300 1.00 0.00 H new ATOM 0 HD21 ASN F 52 116.441 -6.712 10.718 1.00 0.00 H new ATOM 0 HD22 ASN F 52 114.850 -5.982 10.483 1.00 0.00 H new ATOM 1609 N ASP F 53 113.451 -8.429 10.483 1.00 0.00 N ATOM 1610 CA ASP F 53 113.709 -9.328 11.606 1.00 0.00 C ATOM 1611 C ASP F 53 112.652 -10.438 11.655 1.00 0.00 C ATOM 1612 O ASP F 53 112.943 -11.571 12.044 1.00 0.00 O ATOM 1613 CB ASP F 53 113.713 -8.541 12.925 1.00 0.00 C ATOM 1614 CG ASP F 53 114.863 -7.527 12.927 1.00 0.00 C ATOM 1615 OD1 ASP F 53 116.006 -7.957 12.941 1.00 0.00 O ATOM 1616 OD2 ASP F 53 114.587 -6.340 12.914 1.00 0.00 O ATOM 0 H ASP F 53 113.108 -7.508 10.754 1.00 0.00 H new ATOM 0 HA ASP F 53 114.688 -9.786 11.467 1.00 0.00 H new ATOM 0 HB2 ASP F 53 112.762 -8.025 13.053 1.00 0.00 H new ATOM 0 HB3 ASP F 53 113.820 -9.226 13.766 1.00 0.00 H new ATOM 1621 N ALA F 54 111.421 -10.088 11.264 1.00 0.00 N ATOM 1622 CA ALA F 54 110.301 -11.034 11.260 1.00 0.00 C ATOM 1623 C ALA F 54 110.439 -12.069 10.138 1.00 0.00 C ATOM 1624 O ALA F 54 109.998 -13.211 10.286 1.00 0.00 O ATOM 1625 CB ALA F 54 108.982 -10.274 11.093 1.00 0.00 C ATOM 0 H ALA F 54 111.175 -9.151 10.945 1.00 0.00 H new ATOM 0 HA ALA F 54 110.309 -11.564 12.213 1.00 0.00 H new ATOM 0 HB1 ALA F 54 108.152 -10.981 11.091 1.00 0.00 H new ATOM 0 HB2 ALA F 54 108.859 -9.573 11.919 1.00 0.00 H new ATOM 0 HB3 ALA F 54 108.995 -9.726 10.151 1.00 0.00 H new ATOM 1631 N GLN F 55 111.048 -11.655 9.020 1.00 0.00 N ATOM 1632 CA GLN F 55 111.239 -12.543 7.864 1.00 0.00 C ATOM 1633 C GLN F 55 112.628 -13.176 7.896 1.00 0.00 C ATOM 1634 O GLN F 55 112.968 -14.007 7.050 1.00 0.00 O ATOM 1635 CB GLN F 55 111.064 -11.755 6.558 1.00 0.00 C ATOM 1636 CG GLN F 55 109.629 -11.226 6.468 1.00 0.00 C ATOM 1637 CD GLN F 55 109.404 -10.547 5.119 1.00 0.00 C ATOM 1638 OE1 GLN F 55 109.013 -11.198 4.152 1.00 0.00 O ATOM 1639 NE2 GLN F 55 109.641 -9.273 4.995 1.00 0.00 N ATOM 0 H GLN F 55 111.417 -10.713 8.890 1.00 0.00 H new ATOM 0 HA GLN F 55 110.490 -13.333 7.913 1.00 0.00 H new ATOM 0 HB2 GLN F 55 111.771 -10.926 6.524 1.00 0.00 H new ATOM 0 HB3 GLN F 55 111.281 -12.395 5.703 1.00 0.00 H new ATOM 0 HG2 GLN F 55 108.922 -12.046 6.593 1.00 0.00 H new ATOM 0 HG3 GLN F 55 109.443 -10.518 7.276 1.00 0.00 H new ATOM 0 HE21 GLN F 55 109.965 -8.734 5.798 1.00 0.00 H new ATOM 0 HE22 GLN F 55 109.502 -8.814 4.095 1.00 0.00 H new ATOM 1648 N ALA F 56 113.423 -12.754 8.874 1.00 0.00 N ATOM 1649 CA ALA F 56 114.783 -13.235 9.043 1.00 0.00 C ATOM 1650 C ALA F 56 114.829 -14.748 9.270 1.00 0.00 C ATOM 1651 O ALA F 56 113.798 -15.395 9.479 1.00 0.00 O ATOM 1652 CB ALA F 56 115.425 -12.519 10.238 1.00 0.00 C ATOM 0 H ALA F 56 113.138 -12.067 9.572 1.00 0.00 H new ATOM 0 HA ALA F 56 115.334 -13.020 8.127 1.00 0.00 H new ATOM 0 HB1 ALA F 56 116.446 -12.876 10.370 1.00 0.00 H new ATOM 0 HB2 ALA F 56 115.437 -11.445 10.055 1.00 0.00 H new ATOM 0 HB3 ALA F 56 114.849 -12.727 11.139 1.00 0.00 H new TER 1658 ALA F 56