USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 994 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 119 SER OG : rot 97:sc= 7e-05 USER MOD Set 1.2: A 121 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 107 SER OG : rot -14:sc= 0.242 USER MOD Set 2.2: A 113 THR OG1 : rot 113:sc= 0.543 USER MOD Set 3.1: A 73 HIS : no HE2:sc= 0.424 K(o=1.6,f=-6.7!) USER MOD Set 3.2: A 85 SER OG : rot -96:sc= 1.21 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 150:sc= -2.09 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.84) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 152:sc= -1.39 USER MOD Single : A 18 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.0394) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.186 X(o=-0.19,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc=-0.000576 K(o=-0.00058,f=-1.4!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= -0.71 USER MOD Single : A 53 THR OG1 : rot 64:sc= -3.85! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 151:sc= 0.264 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HE2:sc= -13.4! C(o=-13!,f=-15!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN :FLIP amide:sc= -0.0239 F(o=-0.98,f=-0.024) USER MOD Single : A 80 HIS : no HE2:sc= -1.93 K(o=-1.9,f=-2.5!) USER MOD Single : A 81 THR OG1 : rot 50:sc= 0.227 USER MOD Single : A 82 TYR OH : rot 150:sc= -5.44! USER MOD Single : A 83 SER OG : rot -62:sc= 1.29 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.0985 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 98 LYS NZ :NH3+ -160:sc=-0.00266 (180deg=-0.367) USER MOD Single : A 101 TYR OH : rot 23:sc= -1.49 USER MOD Single : A 103 THR OG1 : rot 170:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 HIS :FLIP no HE2:sc= -1.12 F(o=-2.7!,f=-1.1) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.152 K(o=-0.15,f=-0.73) USER MOD Single : A 146 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.117) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -7.945 -2.646 17.600 1.00 0.00 N ATOM 9 CA VAL A 3 -6.874 -2.873 16.589 1.00 0.00 C ATOM 10 C VAL A 3 -5.955 -1.652 16.534 1.00 0.00 C ATOM 11 O VAL A 3 -6.407 -0.524 16.501 1.00 0.00 O ATOM 12 CB VAL A 3 -7.508 -3.093 15.214 1.00 0.00 C ATOM 13 CG1 VAL A 3 -6.408 -3.191 14.156 1.00 0.00 C ATOM 14 CG2 VAL A 3 -8.319 -4.388 15.227 1.00 0.00 C ATOM 0 HA VAL A 3 -6.294 -3.753 16.868 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.165 -2.256 14.979 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -6.859 -3.348 13.176 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.830 -2.267 14.146 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -5.751 -4.028 14.391 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -8.771 -4.544 14.247 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -7.663 -5.226 15.462 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.103 -4.319 15.981 1.00 0.00 H new ATOM 24 N TYR A 4 -4.669 -1.866 16.521 1.00 0.00 N ATOM 25 CA TYR A 4 -3.722 -0.717 16.464 1.00 0.00 C ATOM 26 C TYR A 4 -2.912 -0.794 15.168 1.00 0.00 C ATOM 27 O TYR A 4 -2.517 -1.857 14.733 1.00 0.00 O ATOM 28 CB TYR A 4 -2.774 -0.777 17.663 1.00 0.00 C ATOM 29 CG TYR A 4 -3.581 -0.813 18.940 1.00 0.00 C ATOM 30 CD1 TYR A 4 -4.108 0.370 19.468 1.00 0.00 C ATOM 31 CD2 TYR A 4 -3.799 -2.032 19.594 1.00 0.00 C ATOM 32 CE1 TYR A 4 -4.855 0.336 20.652 1.00 0.00 C ATOM 33 CE2 TYR A 4 -4.546 -2.066 20.778 1.00 0.00 C ATOM 34 CZ TYR A 4 -5.074 -0.882 21.307 1.00 0.00 C ATOM 35 OH TYR A 4 -5.811 -0.916 22.473 1.00 0.00 O ATOM 0 H TYR A 4 -4.232 -2.787 16.547 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.280 0.219 16.491 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -2.140 -1.661 17.595 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.113 0.090 17.662 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -3.939 1.309 18.963 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -3.391 -2.945 19.186 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -5.262 1.249 21.060 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -4.715 -3.006 21.283 1.00 0.00 H new ATOM 0 HH TYR A 4 -5.869 -1.839 22.797 1.00 0.00 H new ATOM 45 N THR A 5 -2.661 0.325 14.547 1.00 0.00 N ATOM 46 CA THR A 5 -1.879 0.313 13.280 1.00 0.00 C ATOM 47 C THR A 5 -0.462 0.825 13.548 1.00 0.00 C ATOM 48 O THR A 5 -0.271 1.849 14.174 1.00 0.00 O ATOM 49 CB THR A 5 -2.561 1.214 12.248 1.00 0.00 C ATOM 50 OG1 THR A 5 -3.910 0.803 12.082 1.00 0.00 O ATOM 51 CG2 THR A 5 -1.825 1.112 10.912 1.00 0.00 C ATOM 0 H THR A 5 -2.964 1.247 14.862 1.00 0.00 H new ATOM 0 HA THR A 5 -1.830 -0.706 12.895 1.00 0.00 H new ATOM 0 HB THR A 5 -2.536 2.247 12.594 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.461 1.578 11.843 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.312 1.754 10.178 1.00 0.00 H new ATOM 0 HG22 THR A 5 -0.790 1.429 11.042 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.847 0.080 10.562 1.00 0.00 H new ATOM 59 N TYR A 6 0.530 0.122 13.078 1.00 0.00 N ATOM 60 CA TYR A 6 1.934 0.568 13.304 1.00 0.00 C ATOM 61 C TYR A 6 2.649 0.695 11.958 1.00 0.00 C ATOM 62 O TYR A 6 2.492 -0.129 11.079 1.00 0.00 O ATOM 63 CB TYR A 6 2.661 -0.459 14.173 1.00 0.00 C ATOM 64 CG TYR A 6 2.018 -0.509 15.538 1.00 0.00 C ATOM 65 CD1 TYR A 6 2.350 0.450 16.504 1.00 0.00 C ATOM 66 CD2 TYR A 6 1.089 -1.513 15.839 1.00 0.00 C ATOM 67 CE1 TYR A 6 1.753 0.404 17.769 1.00 0.00 C ATOM 68 CE2 TYR A 6 0.493 -1.559 17.104 1.00 0.00 C ATOM 69 CZ TYR A 6 0.825 -0.601 18.070 1.00 0.00 C ATOM 70 OH TYR A 6 0.236 -0.646 19.318 1.00 0.00 O ATOM 0 H TYR A 6 0.430 -0.743 12.547 1.00 0.00 H new ATOM 0 HA TYR A 6 1.933 1.534 13.808 1.00 0.00 H new ATOM 0 HB2 TYR A 6 2.620 -1.442 13.704 1.00 0.00 H new ATOM 0 HB3 TYR A 6 3.714 -0.193 14.265 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.066 1.224 16.273 1.00 0.00 H new ATOM 0 HD2 TYR A 6 0.833 -2.252 15.094 1.00 0.00 H new ATOM 0 HE1 TYR A 6 2.008 1.144 18.513 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -0.223 -2.333 17.336 1.00 0.00 H new ATOM 0 HH TYR A 6 -0.384 -1.404 19.360 1.00 0.00 H new ATOM 80 N GLU A 7 3.435 1.724 11.788 1.00 0.00 N ATOM 81 CA GLU A 7 4.159 1.902 10.497 1.00 0.00 C ATOM 82 C GLU A 7 5.663 1.750 10.730 1.00 0.00 C ATOM 83 O GLU A 7 6.210 2.273 11.681 1.00 0.00 O ATOM 84 CB GLU A 7 3.868 3.296 9.937 1.00 0.00 C ATOM 85 CG GLU A 7 4.551 3.451 8.576 1.00 0.00 C ATOM 86 CD GLU A 7 4.349 4.878 8.064 1.00 0.00 C ATOM 87 OE1 GLU A 7 3.776 5.673 8.792 1.00 0.00 O ATOM 88 OE2 GLU A 7 4.770 5.152 6.952 1.00 0.00 O ATOM 0 H GLU A 7 3.607 2.448 12.486 1.00 0.00 H new ATOM 0 HA GLU A 7 3.824 1.147 9.786 1.00 0.00 H new ATOM 0 HB2 GLU A 7 2.793 3.442 9.835 1.00 0.00 H new ATOM 0 HB3 GLU A 7 4.229 4.059 10.626 1.00 0.00 H new ATOM 0 HG2 GLU A 7 5.615 3.232 8.664 1.00 0.00 H new ATOM 0 HG3 GLU A 7 4.136 2.736 7.865 1.00 0.00 H new ATOM 95 N ASN A 8 6.337 1.038 9.869 1.00 0.00 N ATOM 96 CA ASN A 8 7.805 0.853 10.040 1.00 0.00 C ATOM 97 C ASN A 8 8.538 1.470 8.846 1.00 0.00 C ATOM 98 O ASN A 8 8.150 1.291 7.708 1.00 0.00 O ATOM 99 CB ASN A 8 8.125 -0.641 10.120 1.00 0.00 C ATOM 100 CG ASN A 8 9.551 -0.829 10.641 1.00 0.00 C ATOM 101 OD1 ASN A 8 9.965 -0.160 11.567 1.00 0.00 O ATOM 102 ND2 ASN A 8 10.325 -1.718 10.082 1.00 0.00 N ATOM 0 H ASN A 8 5.934 0.576 9.054 1.00 0.00 H new ATOM 0 HA ASN A 8 8.129 1.343 10.958 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.416 -1.141 10.780 1.00 0.00 H new ATOM 0 HB3 ASN A 8 8.022 -1.099 9.136 1.00 0.00 H new ATOM 0 HD21 ASN A 8 11.277 -1.851 10.422 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.978 -2.280 9.305 1.00 0.00 H new ATOM 109 N GLU A 9 9.594 2.194 9.095 1.00 0.00 N ATOM 110 CA GLU A 9 10.349 2.820 7.974 1.00 0.00 C ATOM 111 C GLU A 9 11.708 2.133 7.827 1.00 0.00 C ATOM 112 O GLU A 9 12.483 2.063 8.760 1.00 0.00 O ATOM 113 CB GLU A 9 10.560 4.306 8.270 1.00 0.00 C ATOM 114 CG GLU A 9 9.202 5.000 8.392 1.00 0.00 C ATOM 115 CD GLU A 9 9.414 6.503 8.585 1.00 0.00 C ATOM 116 OE1 GLU A 9 10.551 6.901 8.774 1.00 0.00 O ATOM 117 OE2 GLU A 9 8.435 7.230 8.540 1.00 0.00 O ATOM 0 H GLU A 9 9.967 2.379 10.026 1.00 0.00 H new ATOM 0 HA GLU A 9 9.784 2.709 7.049 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.126 4.427 9.193 1.00 0.00 H new ATOM 0 HB3 GLU A 9 11.146 4.767 7.474 1.00 0.00 H new ATOM 0 HG2 GLU A 9 8.607 4.818 7.497 1.00 0.00 H new ATOM 0 HG3 GLU A 9 8.646 4.589 9.234 1.00 0.00 H new ATOM 124 N PHE A 10 12.005 1.627 6.661 1.00 0.00 N ATOM 125 CA PHE A 10 13.314 0.946 6.458 1.00 0.00 C ATOM 126 C PHE A 10 13.801 1.190 5.029 1.00 0.00 C ATOM 127 O PHE A 10 13.027 1.200 4.091 1.00 0.00 O ATOM 128 CB PHE A 10 13.151 -0.557 6.690 1.00 0.00 C ATOM 129 CG PHE A 10 14.466 -1.251 6.430 1.00 0.00 C ATOM 130 CD1 PHE A 10 15.423 -1.342 7.449 1.00 0.00 C ATOM 131 CD2 PHE A 10 14.731 -1.803 5.171 1.00 0.00 C ATOM 132 CE1 PHE A 10 16.643 -1.986 7.208 1.00 0.00 C ATOM 133 CE2 PHE A 10 15.951 -2.447 4.931 1.00 0.00 C ATOM 134 CZ PHE A 10 16.906 -2.538 5.949 1.00 0.00 C ATOM 0 H PHE A 10 11.398 1.656 5.842 1.00 0.00 H new ATOM 0 HA PHE A 10 14.042 1.346 7.164 1.00 0.00 H new ATOM 0 HB2 PHE A 10 12.824 -0.745 7.713 1.00 0.00 H new ATOM 0 HB3 PHE A 10 12.380 -0.956 6.031 1.00 0.00 H new ATOM 0 HD1 PHE A 10 15.220 -0.916 8.420 1.00 0.00 H new ATOM 0 HD2 PHE A 10 13.994 -1.732 4.385 1.00 0.00 H new ATOM 0 HE1 PHE A 10 17.381 -2.057 7.994 1.00 0.00 H new ATOM 0 HE2 PHE A 10 16.155 -2.873 3.960 1.00 0.00 H new ATOM 0 HZ PHE A 10 17.847 -3.035 5.763 1.00 0.00 H new ATOM 144 N THR A 11 15.079 1.386 4.854 1.00 0.00 N ATOM 145 CA THR A 11 15.618 1.627 3.488 1.00 0.00 C ATOM 146 C THR A 11 16.396 0.393 3.026 1.00 0.00 C ATOM 147 O THR A 11 16.945 -0.339 3.825 1.00 0.00 O ATOM 148 CB THR A 11 16.550 2.840 3.514 1.00 0.00 C ATOM 149 OG1 THR A 11 17.771 2.483 4.149 1.00 0.00 O ATOM 150 CG2 THR A 11 15.885 3.980 4.286 1.00 0.00 C ATOM 0 H THR A 11 15.774 1.389 5.601 1.00 0.00 H new ATOM 0 HA THR A 11 14.795 1.818 2.799 1.00 0.00 H new ATOM 0 HB THR A 11 16.752 3.166 2.494 1.00 0.00 H new ATOM 0 HG1 THR A 11 18.370 3.258 4.165 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.550 4.844 4.304 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.949 4.253 3.798 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.681 3.658 5.307 1.00 0.00 H new ATOM 158 N SER A 12 16.448 0.155 1.744 1.00 0.00 N ATOM 159 CA SER A 12 17.190 -1.034 1.239 1.00 0.00 C ATOM 160 C SER A 12 17.717 -0.751 -0.169 1.00 0.00 C ATOM 161 O SER A 12 17.171 0.055 -0.897 1.00 0.00 O ATOM 162 CB SER A 12 16.251 -2.241 1.200 1.00 0.00 C ATOM 163 OG SER A 12 16.996 -3.412 0.900 1.00 0.00 O ATOM 0 H SER A 12 16.010 0.731 1.026 1.00 0.00 H new ATOM 0 HA SER A 12 18.029 -1.246 1.902 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.747 -2.354 2.160 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.476 -2.088 0.449 1.00 0.00 H new ATOM 0 HG SER A 12 16.553 -4.192 1.295 1.00 0.00 H new ATOM 169 N ASP A 13 18.772 -1.412 -0.560 1.00 0.00 N ATOM 170 CA ASP A 13 19.334 -1.186 -1.921 1.00 0.00 C ATOM 171 C ASP A 13 18.332 -1.675 -2.970 1.00 0.00 C ATOM 172 O ASP A 13 17.237 -2.090 -2.649 1.00 0.00 O ATOM 173 CB ASP A 13 20.644 -1.961 -2.067 1.00 0.00 C ATOM 174 CG ASP A 13 21.589 -1.199 -2.999 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.194 -0.151 -3.482 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.690 -1.677 -3.214 1.00 0.00 O ATOM 0 H ASP A 13 19.270 -2.100 0.005 1.00 0.00 H new ATOM 0 HA ASP A 13 19.524 -0.123 -2.065 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.110 -2.095 -1.091 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.447 -2.956 -2.466 1.00 0.00 H new ATOM 181 N ILE A 14 18.697 -1.629 -4.223 1.00 0.00 N ATOM 182 CA ILE A 14 17.761 -2.092 -5.286 1.00 0.00 C ATOM 183 C ILE A 14 16.632 -1.072 -5.447 1.00 0.00 C ATOM 184 O ILE A 14 16.154 -0.509 -4.482 1.00 0.00 O ATOM 185 CB ILE A 14 17.172 -3.448 -4.890 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.271 -4.335 -4.298 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.580 -4.128 -6.126 1.00 0.00 C ATOM 188 CD1 ILE A 14 19.510 -4.284 -5.194 1.00 0.00 C ATOM 0 H ILE A 14 19.600 -1.292 -4.555 1.00 0.00 H new ATOM 0 HA ILE A 14 18.299 -2.191 -6.229 1.00 0.00 H new ATOM 0 HB ILE A 14 16.389 -3.297 -4.146 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.523 -3.997 -3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 14 17.916 -5.362 -4.210 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.161 -5.094 -5.844 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.794 -3.500 -6.546 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.363 -4.276 -6.870 1.00 0.00 H new ATOM 0 HD11 ILE A 14 20.291 -4.916 -4.771 1.00 0.00 H new ATOM 0 HD12 ILE A 14 19.253 -4.643 -6.191 1.00 0.00 H new ATOM 0 HD13 ILE A 14 19.870 -3.257 -5.259 1.00 0.00 H new ATOM 200 N PRO A 15 16.199 -0.831 -6.694 1.00 0.00 N ATOM 201 CA PRO A 15 15.124 0.125 -6.984 1.00 0.00 C ATOM 202 C PRO A 15 13.762 -0.374 -6.489 1.00 0.00 C ATOM 203 O PRO A 15 13.481 -1.557 -6.485 1.00 0.00 O ATOM 204 CB PRO A 15 15.136 0.228 -8.509 1.00 0.00 C ATOM 205 CG PRO A 15 15.731 -1.059 -8.970 1.00 0.00 C ATOM 206 CD PRO A 15 16.721 -1.468 -7.916 1.00 0.00 C ATOM 0 HA PRO A 15 15.280 1.080 -6.483 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.129 0.363 -8.905 1.00 0.00 H new ATOM 0 HB3 PRO A 15 15.727 1.080 -8.844 1.00 0.00 H new ATOM 0 HG2 PRO A 15 14.961 -1.820 -9.096 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.220 -0.937 -9.936 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.774 -2.552 -7.813 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.727 -1.121 -8.152 1.00 0.00 H new ATOM 214 N ALA A 16 12.923 0.528 -6.061 1.00 0.00 N ATOM 215 CA ALA A 16 11.576 0.140 -5.548 1.00 0.00 C ATOM 216 C ALA A 16 10.918 -0.928 -6.437 1.00 0.00 C ATOM 217 O ALA A 16 10.417 -1.918 -5.943 1.00 0.00 O ATOM 218 CB ALA A 16 10.680 1.379 -5.506 1.00 0.00 C ATOM 0 H ALA A 16 13.114 1.530 -6.044 1.00 0.00 H new ATOM 0 HA ALA A 16 11.700 -0.279 -4.549 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.694 1.103 -5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.122 2.126 -4.846 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.584 1.793 -6.510 1.00 0.00 H new ATOM 224 N PRO A 17 10.888 -0.720 -7.768 1.00 0.00 N ATOM 225 CA PRO A 17 10.251 -1.671 -8.696 1.00 0.00 C ATOM 226 C PRO A 17 10.946 -3.039 -8.730 1.00 0.00 C ATOM 227 O PRO A 17 10.307 -4.064 -8.607 1.00 0.00 O ATOM 228 CB PRO A 17 10.368 -0.976 -10.053 1.00 0.00 C ATOM 229 CG PRO A 17 11.526 -0.055 -9.900 1.00 0.00 C ATOM 230 CD PRO A 17 11.466 0.435 -8.481 1.00 0.00 C ATOM 0 HA PRO A 17 9.226 -1.893 -8.398 1.00 0.00 H new ATOM 0 HB2 PRO A 17 10.536 -1.695 -10.854 1.00 0.00 H new ATOM 0 HB3 PRO A 17 9.457 -0.431 -10.300 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.466 -0.570 -10.098 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.463 0.774 -10.604 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.453 0.695 -8.099 1.00 0.00 H new ATOM 0 HD3 PRO A 17 10.843 1.324 -8.385 1.00 0.00 H new ATOM 238 N LYS A 18 12.239 -3.073 -8.900 1.00 0.00 N ATOM 239 CA LYS A 18 12.937 -4.391 -8.943 1.00 0.00 C ATOM 240 C LYS A 18 12.741 -5.119 -7.611 1.00 0.00 C ATOM 241 O LYS A 18 12.711 -6.333 -7.555 1.00 0.00 O ATOM 242 CB LYS A 18 14.432 -4.179 -9.192 1.00 0.00 C ATOM 243 CG LYS A 18 14.635 -3.560 -10.577 1.00 0.00 C ATOM 244 CD LYS A 18 16.132 -3.466 -10.879 1.00 0.00 C ATOM 245 CE LYS A 18 16.342 -2.710 -12.193 1.00 0.00 C ATOM 246 NZ LYS A 18 17.666 -2.027 -12.166 1.00 0.00 N ATOM 0 H LYS A 18 12.838 -2.255 -9.010 1.00 0.00 H new ATOM 0 HA LYS A 18 12.519 -4.991 -9.751 1.00 0.00 H new ATOM 0 HB2 LYS A 18 14.850 -3.527 -8.425 1.00 0.00 H new ATOM 0 HB3 LYS A 18 14.961 -5.130 -9.125 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.138 -4.166 -11.334 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.183 -2.569 -10.614 1.00 0.00 H new ATOM 0 HD2 LYS A 18 16.646 -2.953 -10.066 1.00 0.00 H new ATOM 0 HD3 LYS A 18 16.563 -4.465 -10.949 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.294 -3.401 -13.034 1.00 0.00 H new ATOM 0 HE3 LYS A 18 15.546 -1.979 -12.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 17.947 -1.776 -13.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 17.599 -1.163 -11.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.377 -2.664 -11.753 1.00 0.00 H new ATOM 260 N LEU A 19 12.608 -4.389 -6.538 1.00 0.00 N ATOM 261 CA LEU A 19 12.415 -5.041 -5.212 1.00 0.00 C ATOM 262 C LEU A 19 10.950 -5.452 -5.048 1.00 0.00 C ATOM 263 O LEU A 19 10.641 -6.450 -4.428 1.00 0.00 O ATOM 264 CB LEU A 19 12.793 -4.058 -4.102 1.00 0.00 C ATOM 265 CG LEU A 19 12.658 -4.745 -2.741 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.394 -6.087 -2.773 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.267 -3.855 -1.657 1.00 0.00 C ATOM 0 H LEU A 19 12.625 -3.369 -6.522 1.00 0.00 H new ATOM 0 HA LEU A 19 13.048 -5.926 -5.150 1.00 0.00 H new ATOM 0 HB2 LEU A 19 13.816 -3.708 -4.245 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.147 -3.181 -4.144 1.00 0.00 H new ATOM 0 HG LEU A 19 11.604 -4.913 -2.522 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.299 -6.577 -1.804 1.00 0.00 H new ATOM 0 HD12 LEU A 19 12.960 -6.722 -3.545 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.448 -5.919 -2.992 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.171 -4.344 -0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.322 -3.686 -1.875 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.743 -2.899 -1.634 1.00 0.00 H new ATOM 279 N PHE A 20 10.045 -4.688 -5.594 1.00 0.00 N ATOM 280 CA PHE A 20 8.600 -5.029 -5.464 1.00 0.00 C ATOM 281 C PHE A 20 8.324 -6.385 -6.119 1.00 0.00 C ATOM 282 O PHE A 20 7.581 -7.195 -5.601 1.00 0.00 O ATOM 283 CB PHE A 20 7.759 -3.952 -6.153 1.00 0.00 C ATOM 284 CG PHE A 20 6.296 -4.312 -6.049 1.00 0.00 C ATOM 285 CD1 PHE A 20 5.573 -3.973 -4.899 1.00 0.00 C ATOM 286 CD2 PHE A 20 5.664 -4.982 -7.102 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.216 -4.306 -4.803 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.307 -5.315 -7.006 1.00 0.00 C ATOM 289 CZ PHE A 20 3.584 -4.977 -5.856 1.00 0.00 C ATOM 0 H PHE A 20 10.244 -3.841 -6.126 1.00 0.00 H new ATOM 0 HA PHE A 20 8.338 -5.080 -4.407 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.940 -2.982 -5.689 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.049 -3.863 -7.200 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.061 -3.455 -4.087 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.223 -5.242 -7.989 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.657 -4.045 -3.916 1.00 0.00 H new ATOM 0 HE2 PHE A 20 3.819 -5.832 -7.819 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.538 -5.234 -5.781 1.00 0.00 H new ATOM 299 N LYS A 21 8.910 -6.638 -7.257 1.00 0.00 N ATOM 300 CA LYS A 21 8.671 -7.940 -7.944 1.00 0.00 C ATOM 301 C LYS A 21 9.234 -9.084 -7.096 1.00 0.00 C ATOM 302 O LYS A 21 8.536 -10.020 -6.762 1.00 0.00 O ATOM 303 CB LYS A 21 9.362 -7.929 -9.310 1.00 0.00 C ATOM 304 CG LYS A 21 8.677 -6.905 -10.218 1.00 0.00 C ATOM 305 CD LYS A 21 9.286 -6.977 -11.619 1.00 0.00 C ATOM 306 CE LYS A 21 8.721 -5.845 -12.479 1.00 0.00 C ATOM 307 NZ LYS A 21 9.842 -5.081 -13.096 1.00 0.00 N ATOM 0 H LYS A 21 9.543 -6.001 -7.741 1.00 0.00 H new ATOM 0 HA LYS A 21 7.599 -8.086 -8.078 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.417 -7.680 -9.194 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.316 -8.920 -9.761 1.00 0.00 H new ATOM 0 HG2 LYS A 21 7.606 -7.104 -10.265 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.798 -5.902 -9.809 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.371 -6.896 -11.560 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.062 -7.941 -12.075 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.074 -6.253 -13.256 1.00 0.00 H new ATOM 0 HE3 LYS A 21 8.108 -5.182 -11.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 9.457 -4.312 -13.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 10.442 -4.680 -12.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.410 -5.717 -13.691 1.00 0.00 H new ATOM 321 N ALA A 22 10.490 -9.020 -6.750 1.00 0.00 N ATOM 322 CA ALA A 22 11.094 -10.108 -5.930 1.00 0.00 C ATOM 323 C ALA A 22 10.535 -10.054 -4.506 1.00 0.00 C ATOM 324 O ALA A 22 10.735 -10.956 -3.717 1.00 0.00 O ATOM 325 CB ALA A 22 12.614 -9.932 -5.887 1.00 0.00 C ATOM 0 H ALA A 22 11.124 -8.261 -7.000 1.00 0.00 H new ATOM 0 HA ALA A 22 10.850 -11.072 -6.377 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.056 -10.728 -5.287 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.014 -9.976 -6.900 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.856 -8.966 -5.443 1.00 0.00 H new ATOM 331 N PHE A 23 9.840 -9.003 -4.167 1.00 0.00 N ATOM 332 CA PHE A 23 9.276 -8.900 -2.791 1.00 0.00 C ATOM 333 C PHE A 23 7.901 -9.570 -2.744 1.00 0.00 C ATOM 334 O PHE A 23 7.514 -10.138 -1.742 1.00 0.00 O ATOM 335 CB PHE A 23 9.136 -7.427 -2.403 1.00 0.00 C ATOM 336 CG PHE A 23 8.604 -7.330 -0.994 1.00 0.00 C ATOM 337 CD1 PHE A 23 9.489 -7.358 0.091 1.00 0.00 C ATOM 338 CD2 PHE A 23 7.227 -7.215 -0.771 1.00 0.00 C ATOM 339 CE1 PHE A 23 8.996 -7.270 1.398 1.00 0.00 C ATOM 340 CE2 PHE A 23 6.734 -7.127 0.537 1.00 0.00 C ATOM 341 CZ PHE A 23 7.619 -7.155 1.621 1.00 0.00 C ATOM 0 H PHE A 23 9.639 -8.214 -4.781 1.00 0.00 H new ATOM 0 HA PHE A 23 9.946 -9.400 -2.091 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.102 -6.927 -2.474 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.463 -6.920 -3.094 1.00 0.00 H new ATOM 0 HD1 PHE A 23 10.552 -7.447 -0.081 1.00 0.00 H new ATOM 0 HD2 PHE A 23 6.544 -7.194 -1.608 1.00 0.00 H new ATOM 0 HE1 PHE A 23 9.678 -7.291 2.235 1.00 0.00 H new ATOM 0 HE2 PHE A 23 5.672 -7.038 0.709 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.239 -7.088 2.630 1.00 0.00 H new ATOM 351 N VAL A 24 7.158 -9.505 -3.814 1.00 0.00 N ATOM 352 CA VAL A 24 5.809 -10.137 -3.818 1.00 0.00 C ATOM 353 C VAL A 24 5.773 -11.277 -4.838 1.00 0.00 C ATOM 354 O VAL A 24 5.211 -12.325 -4.591 1.00 0.00 O ATOM 355 CB VAL A 24 4.757 -9.090 -4.185 1.00 0.00 C ATOM 356 CG1 VAL A 24 4.948 -7.849 -3.310 1.00 0.00 C ATOM 357 CG2 VAL A 24 4.910 -8.703 -5.657 1.00 0.00 C ATOM 0 H VAL A 24 7.425 -9.043 -4.683 1.00 0.00 H new ATOM 0 HA VAL A 24 5.596 -10.536 -2.826 1.00 0.00 H new ATOM 0 HB VAL A 24 3.762 -9.503 -4.021 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.199 -7.101 -3.570 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.838 -8.123 -2.261 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.944 -7.437 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.159 -7.957 -5.917 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.905 -8.290 -5.823 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.775 -9.586 -6.281 1.00 0.00 H new ATOM 367 N LEU A 25 6.367 -11.085 -5.984 1.00 0.00 N ATOM 368 CA LEU A 25 6.360 -12.163 -7.013 1.00 0.00 C ATOM 369 C LEU A 25 7.276 -13.302 -6.563 1.00 0.00 C ATOM 370 O LEU A 25 7.017 -14.460 -6.825 1.00 0.00 O ATOM 371 CB LEU A 25 6.858 -11.605 -8.347 1.00 0.00 C ATOM 372 CG LEU A 25 6.653 -12.653 -9.443 1.00 0.00 C ATOM 373 CD1 LEU A 25 5.204 -13.143 -9.415 1.00 0.00 C ATOM 374 CD2 LEU A 25 6.954 -12.030 -10.808 1.00 0.00 C ATOM 0 H LEU A 25 6.856 -10.231 -6.252 1.00 0.00 H new ATOM 0 HA LEU A 25 5.344 -12.538 -7.136 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.318 -10.691 -8.596 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.913 -11.342 -8.273 1.00 0.00 H new ATOM 0 HG LEU A 25 7.325 -13.494 -9.271 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.057 -13.890 -10.196 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.989 -13.587 -8.443 1.00 0.00 H new ATOM 0 HD13 LEU A 25 4.532 -12.302 -9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 25 6.808 -12.776 -11.589 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.283 -11.189 -10.980 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.986 -11.680 -10.829 1.00 0.00 H new ATOM 386 N ASP A 26 8.347 -12.985 -5.889 1.00 0.00 N ATOM 387 CA ASP A 26 9.277 -14.051 -5.425 1.00 0.00 C ATOM 388 C ASP A 26 9.153 -14.213 -3.908 1.00 0.00 C ATOM 389 O ASP A 26 9.955 -14.872 -3.277 1.00 0.00 O ATOM 390 CB ASP A 26 10.715 -13.669 -5.782 1.00 0.00 C ATOM 391 CG ASP A 26 10.855 -13.575 -7.303 1.00 0.00 C ATOM 392 OD1 ASP A 26 9.962 -14.041 -7.990 1.00 0.00 O ATOM 393 OD2 ASP A 26 11.854 -13.039 -7.754 1.00 0.00 O ATOM 0 H ASP A 26 8.618 -12.034 -5.640 1.00 0.00 H new ATOM 0 HA ASP A 26 9.021 -14.991 -5.913 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.974 -12.715 -5.323 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.409 -14.412 -5.387 1.00 0.00 H new ATOM 398 N ALA A 27 8.155 -13.615 -3.317 1.00 0.00 N ATOM 399 CA ALA A 27 7.982 -13.738 -1.842 1.00 0.00 C ATOM 400 C ALA A 27 7.561 -15.167 -1.491 1.00 0.00 C ATOM 401 O ALA A 27 8.011 -15.736 -0.517 1.00 0.00 O ATOM 402 CB ALA A 27 6.903 -12.760 -1.372 1.00 0.00 C ATOM 0 H ALA A 27 7.453 -13.047 -3.791 1.00 0.00 H new ATOM 0 HA ALA A 27 8.925 -13.507 -1.347 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.776 -12.849 -0.293 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.203 -11.741 -1.619 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.961 -12.991 -1.869 1.00 0.00 H new ATOM 408 N ASP A 28 6.699 -15.751 -2.279 1.00 0.00 N ATOM 409 CA ASP A 28 6.245 -17.142 -1.992 1.00 0.00 C ATOM 410 C ASP A 28 7.455 -18.079 -1.940 1.00 0.00 C ATOM 411 O ASP A 28 7.473 -19.041 -1.198 1.00 0.00 O ATOM 412 CB ASP A 28 5.291 -17.603 -3.094 1.00 0.00 C ATOM 413 CG ASP A 28 4.716 -18.975 -2.731 1.00 0.00 C ATOM 414 OD1 ASP A 28 4.954 -19.420 -1.621 1.00 0.00 O ATOM 415 OD2 ASP A 28 4.049 -19.556 -3.571 1.00 0.00 O ATOM 0 H ASP A 28 6.289 -15.324 -3.110 1.00 0.00 H new ATOM 0 HA ASP A 28 5.731 -17.163 -1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 28 4.485 -16.880 -3.217 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.818 -17.658 -4.046 1.00 0.00 H new ATOM 420 N ASN A 29 8.464 -17.808 -2.720 1.00 0.00 N ATOM 421 CA ASN A 29 9.668 -18.688 -2.714 1.00 0.00 C ATOM 422 C ASN A 29 10.785 -18.022 -1.909 1.00 0.00 C ATOM 423 O ASN A 29 11.542 -18.677 -1.220 1.00 0.00 O ATOM 424 CB ASN A 29 10.141 -18.914 -4.151 1.00 0.00 C ATOM 425 CG ASN A 29 8.988 -19.469 -4.989 1.00 0.00 C ATOM 426 OD1 ASN A 29 8.752 -19.018 -6.093 1.00 0.00 O ATOM 427 ND2 ASN A 29 8.255 -20.436 -4.508 1.00 0.00 N ATOM 0 H ASN A 29 8.508 -17.016 -3.361 1.00 0.00 H new ATOM 0 HA ASN A 29 9.415 -19.646 -2.259 1.00 0.00 H new ATOM 0 HB2 ASN A 29 10.497 -17.977 -4.579 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.980 -19.609 -4.163 1.00 0.00 H new ATOM 0 HD21 ASN A 29 7.484 -20.814 -5.058 1.00 0.00 H new ATOM 0 HD22 ASN A 29 8.453 -20.814 -3.582 1.00 0.00 H new ATOM 434 N LEU A 30 10.895 -16.725 -1.992 1.00 0.00 N ATOM 435 CA LEU A 30 11.966 -16.017 -1.236 1.00 0.00 C ATOM 436 C LEU A 30 11.620 -16.006 0.255 1.00 0.00 C ATOM 437 O LEU A 30 12.487 -16.078 1.103 1.00 0.00 O ATOM 438 CB LEU A 30 12.080 -14.579 -1.744 1.00 0.00 C ATOM 439 CG LEU A 30 13.219 -13.867 -1.010 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.558 -14.467 -1.441 1.00 0.00 C ATOM 441 CD2 LEU A 30 13.193 -12.376 -1.354 1.00 0.00 C ATOM 0 H LEU A 30 10.289 -16.124 -2.551 1.00 0.00 H new ATOM 0 HA LEU A 30 12.915 -16.532 -1.383 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.267 -14.575 -2.818 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.141 -14.049 -1.582 1.00 0.00 H new ATOM 0 HG LEU A 30 13.094 -13.994 0.065 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.369 -13.960 -0.918 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.576 -15.529 -1.196 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.684 -14.340 -2.516 1.00 0.00 H new ATOM 0 HD21 LEU A 30 14.004 -11.868 -0.832 1.00 0.00 H new ATOM 0 HD22 LEU A 30 13.318 -12.248 -2.429 1.00 0.00 H new ATOM 0 HD23 LEU A 30 12.239 -11.948 -1.046 1.00 0.00 H new ATOM 453 N ILE A 31 10.360 -15.913 0.582 1.00 0.00 N ATOM 454 CA ILE A 31 9.964 -15.895 2.018 1.00 0.00 C ATOM 455 C ILE A 31 10.561 -17.114 2.732 1.00 0.00 C ATOM 456 O ILE A 31 11.263 -16.978 3.714 1.00 0.00 O ATOM 457 CB ILE A 31 8.435 -15.921 2.127 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.877 -14.544 1.763 1.00 0.00 C ATOM 459 CG2 ILE A 31 8.026 -16.271 3.560 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.431 -14.689 1.283 1.00 0.00 C ATOM 0 H ILE A 31 9.589 -15.849 -0.082 1.00 0.00 H new ATOM 0 HA ILE A 31 10.341 -14.987 2.489 1.00 0.00 H new ATOM 0 HB ILE A 31 8.037 -16.671 1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.919 -13.882 2.628 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.486 -14.088 0.983 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.939 -16.289 3.634 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.424 -17.251 3.823 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.424 -15.523 4.245 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.034 -13.708 1.024 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.402 -15.336 0.406 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.826 -15.127 2.077 1.00 0.00 H new ATOM 472 N PRO A 32 10.280 -18.328 2.228 1.00 0.00 N ATOM 473 CA PRO A 32 10.796 -19.568 2.824 1.00 0.00 C ATOM 474 C PRO A 32 12.311 -19.701 2.638 1.00 0.00 C ATOM 475 O PRO A 32 12.963 -20.471 3.313 1.00 0.00 O ATOM 476 CB PRO A 32 10.077 -20.667 2.042 1.00 0.00 C ATOM 477 CG PRO A 32 9.732 -20.033 0.738 1.00 0.00 C ATOM 478 CD PRO A 32 9.441 -18.592 1.043 1.00 0.00 C ATOM 0 HA PRO A 32 10.623 -19.607 3.899 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.717 -21.538 1.903 1.00 0.00 H new ATOM 0 HB3 PRO A 32 9.184 -21.008 2.566 1.00 0.00 H new ATOM 0 HG2 PRO A 32 10.556 -20.123 0.030 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.868 -20.518 0.285 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.704 -17.942 0.209 1.00 0.00 H new ATOM 0 HD3 PRO A 32 8.384 -18.429 1.253 1.00 0.00 H new ATOM 486 N LYS A 33 12.874 -18.955 1.727 1.00 0.00 N ATOM 487 CA LYS A 33 14.344 -19.039 1.500 1.00 0.00 C ATOM 488 C LYS A 33 15.080 -18.378 2.668 1.00 0.00 C ATOM 489 O LYS A 33 16.104 -18.852 3.117 1.00 0.00 O ATOM 490 CB LYS A 33 14.702 -18.318 0.200 1.00 0.00 C ATOM 491 CG LYS A 33 14.532 -19.277 -0.980 1.00 0.00 C ATOM 492 CD LYS A 33 14.919 -18.563 -2.276 1.00 0.00 C ATOM 493 CE LYS A 33 14.320 -19.308 -3.470 1.00 0.00 C ATOM 494 NZ LYS A 33 15.367 -19.496 -4.514 1.00 0.00 N ATOM 0 H LYS A 33 12.380 -18.291 1.131 1.00 0.00 H new ATOM 0 HA LYS A 33 14.640 -20.086 1.429 1.00 0.00 H new ATOM 0 HB2 LYS A 33 14.062 -17.445 0.068 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.729 -17.957 0.243 1.00 0.00 H new ATOM 0 HG2 LYS A 33 15.156 -20.160 -0.838 1.00 0.00 H new ATOM 0 HG3 LYS A 33 13.500 -19.622 -1.036 1.00 0.00 H new ATOM 0 HD2 LYS A 33 14.559 -17.534 -2.258 1.00 0.00 H new ATOM 0 HD3 LYS A 33 16.004 -18.519 -2.369 1.00 0.00 H new ATOM 0 HE2 LYS A 33 13.931 -20.275 -3.151 1.00 0.00 H new ATOM 0 HE3 LYS A 33 13.480 -18.746 -3.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 14.960 -20.003 -5.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 15.718 -18.568 -4.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 16.155 -20.049 -4.120 1.00 0.00 H new ATOM 508 N ILE A 34 14.565 -17.284 3.161 1.00 0.00 N ATOM 509 CA ILE A 34 15.237 -16.593 4.298 1.00 0.00 C ATOM 510 C ILE A 34 15.047 -17.409 5.578 1.00 0.00 C ATOM 511 O ILE A 34 15.899 -17.430 6.444 1.00 0.00 O ATOM 512 CB ILE A 34 14.622 -15.204 4.482 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.809 -14.389 3.200 1.00 0.00 C ATOM 514 CG2 ILE A 34 15.315 -14.491 5.645 1.00 0.00 C ATOM 515 CD1 ILE A 34 14.040 -13.071 3.315 1.00 0.00 C ATOM 0 H ILE A 34 13.710 -16.840 2.826 1.00 0.00 H new ATOM 0 HA ILE A 34 16.302 -16.496 4.086 1.00 0.00 H new ATOM 0 HB ILE A 34 13.558 -15.303 4.697 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.868 -14.191 3.034 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.452 -14.957 2.341 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.878 -13.501 5.777 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.183 -15.071 6.558 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.379 -14.392 5.429 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.174 -12.491 2.402 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.980 -13.280 3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.418 -12.502 4.165 1.00 0.00 H new ATOM 527 N ALA A 35 13.936 -18.083 5.705 1.00 0.00 N ATOM 528 CA ALA A 35 13.694 -18.897 6.929 1.00 0.00 C ATOM 529 C ALA A 35 12.940 -20.173 6.552 1.00 0.00 C ATOM 530 O ALA A 35 11.769 -20.320 6.835 1.00 0.00 O ATOM 531 CB ALA A 35 12.860 -18.088 7.924 1.00 0.00 C ATOM 0 H ALA A 35 13.186 -18.105 5.014 1.00 0.00 H new ATOM 0 HA ALA A 35 14.649 -19.160 7.384 1.00 0.00 H new ATOM 0 HB1 ALA A 35 12.683 -18.684 8.819 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.397 -17.178 8.194 1.00 0.00 H new ATOM 0 HB3 ALA A 35 11.905 -17.825 7.469 1.00 0.00 H new ATOM 537 N PRO A 36 13.635 -21.115 5.896 1.00 0.00 N ATOM 538 CA PRO A 36 13.040 -22.388 5.472 1.00 0.00 C ATOM 539 C PRO A 36 12.734 -23.298 6.665 1.00 0.00 C ATOM 540 O PRO A 36 11.791 -24.065 6.648 1.00 0.00 O ATOM 541 CB PRO A 36 14.126 -23.017 4.600 1.00 0.00 C ATOM 542 CG PRO A 36 15.398 -22.409 5.086 1.00 0.00 C ATOM 543 CD PRO A 36 15.055 -21.011 5.518 1.00 0.00 C ATOM 0 HA PRO A 36 12.090 -22.244 4.957 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.140 -24.102 4.705 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.961 -22.801 3.544 1.00 0.00 H new ATOM 0 HG2 PRO A 36 15.812 -22.982 5.915 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.151 -22.399 4.298 1.00 0.00 H new ATOM 0 HD2 PRO A 36 15.672 -20.685 6.356 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.206 -20.292 4.713 1.00 0.00 H new ATOM 551 N GLN A 37 13.524 -23.218 7.701 1.00 0.00 N ATOM 552 CA GLN A 37 13.277 -24.077 8.893 1.00 0.00 C ATOM 553 C GLN A 37 12.024 -23.588 9.623 1.00 0.00 C ATOM 554 O GLN A 37 11.354 -24.342 10.300 1.00 0.00 O ATOM 555 CB GLN A 37 14.479 -23.999 9.836 1.00 0.00 C ATOM 556 CG GLN A 37 15.710 -24.587 9.142 1.00 0.00 C ATOM 557 CD GLN A 37 16.928 -24.442 10.056 1.00 0.00 C ATOM 558 OE1 GLN A 37 16.917 -23.657 10.983 1.00 0.00 O ATOM 559 NE2 GLN A 37 17.987 -25.171 9.832 1.00 0.00 N ATOM 0 H GLN A 37 14.329 -22.596 7.773 1.00 0.00 H new ATOM 0 HA GLN A 37 13.132 -25.109 8.573 1.00 0.00 H new ATOM 0 HB2 GLN A 37 14.667 -22.963 10.118 1.00 0.00 H new ATOM 0 HB3 GLN A 37 14.270 -24.546 10.755 1.00 0.00 H new ATOM 0 HG2 GLN A 37 15.541 -25.638 8.907 1.00 0.00 H new ATOM 0 HG3 GLN A 37 15.888 -24.074 8.197 1.00 0.00 H new ATOM 0 HE21 GLN A 37 17.997 -25.830 9.054 1.00 0.00 H new ATOM 0 HE22 GLN A 37 18.805 -25.081 10.435 1.00 0.00 H new ATOM 568 N ALA A 38 11.701 -22.331 9.490 1.00 0.00 N ATOM 569 CA ALA A 38 10.492 -21.796 10.176 1.00 0.00 C ATOM 570 C ALA A 38 9.243 -22.474 9.610 1.00 0.00 C ATOM 571 O ALA A 38 8.391 -22.938 10.341 1.00 0.00 O ATOM 572 CB ALA A 38 10.401 -20.286 9.946 1.00 0.00 C ATOM 0 H ALA A 38 12.222 -21.652 8.936 1.00 0.00 H new ATOM 0 HA ALA A 38 10.562 -21.997 11.245 1.00 0.00 H new ATOM 0 HB1 ALA A 38 9.516 -19.894 10.448 1.00 0.00 H new ATOM 0 HB2 ALA A 38 11.291 -19.802 10.349 1.00 0.00 H new ATOM 0 HB3 ALA A 38 10.331 -20.084 8.877 1.00 0.00 H new ATOM 578 N VAL A 39 9.126 -22.536 8.312 1.00 0.00 N ATOM 579 CA VAL A 39 7.933 -23.184 7.700 1.00 0.00 C ATOM 580 C VAL A 39 8.388 -24.222 6.673 1.00 0.00 C ATOM 581 O VAL A 39 9.486 -24.159 6.157 1.00 0.00 O ATOM 582 CB VAL A 39 7.074 -22.124 7.010 1.00 0.00 C ATOM 583 CG1 VAL A 39 6.720 -21.022 8.011 1.00 0.00 C ATOM 584 CG2 VAL A 39 7.853 -21.518 5.841 1.00 0.00 C ATOM 0 H VAL A 39 9.806 -22.165 7.648 1.00 0.00 H new ATOM 0 HA VAL A 39 7.347 -23.675 8.477 1.00 0.00 H new ATOM 0 HB VAL A 39 6.159 -22.585 6.638 1.00 0.00 H new ATOM 0 HG11 VAL A 39 6.108 -20.266 7.519 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.165 -21.452 8.845 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.635 -20.561 8.384 1.00 0.00 H new ATOM 0 HG21 VAL A 39 7.241 -20.762 5.349 1.00 0.00 H new ATOM 0 HG22 VAL A 39 8.768 -21.058 6.213 1.00 0.00 H new ATOM 0 HG23 VAL A 39 8.106 -22.302 5.127 1.00 0.00 H new ATOM 594 N LYS A 40 7.552 -25.179 6.371 1.00 0.00 N ATOM 595 CA LYS A 40 7.938 -26.220 5.377 1.00 0.00 C ATOM 596 C LYS A 40 7.911 -25.618 3.970 1.00 0.00 C ATOM 597 O LYS A 40 8.791 -25.855 3.167 1.00 0.00 O ATOM 598 CB LYS A 40 6.951 -27.387 5.451 1.00 0.00 C ATOM 599 CG LYS A 40 7.432 -28.519 4.539 1.00 0.00 C ATOM 600 CD LYS A 40 6.413 -29.660 4.560 1.00 0.00 C ATOM 601 CE LYS A 40 6.968 -30.852 3.778 1.00 0.00 C ATOM 602 NZ LYS A 40 7.736 -31.738 4.699 1.00 0.00 N ATOM 0 H LYS A 40 6.619 -25.284 6.770 1.00 0.00 H new ATOM 0 HA LYS A 40 8.943 -26.579 5.599 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.868 -27.743 6.478 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.958 -27.057 5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.560 -28.151 3.521 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.405 -28.880 4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.200 -29.953 5.588 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.472 -29.330 4.121 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.153 -31.409 3.317 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.612 -30.503 2.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.113 -32.548 4.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 8.523 -31.203 5.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.108 -32.081 5.454 1.00 0.00 H new ATOM 616 N CYS A 41 6.908 -24.840 3.667 1.00 0.00 N ATOM 617 CA CYS A 41 6.827 -24.225 2.312 1.00 0.00 C ATOM 618 C CYS A 41 5.535 -23.413 2.197 1.00 0.00 C ATOM 619 O CYS A 41 4.476 -23.852 2.603 1.00 0.00 O ATOM 620 CB CYS A 41 6.832 -25.327 1.250 1.00 0.00 C ATOM 621 SG CYS A 41 5.841 -26.727 1.828 1.00 0.00 S ATOM 0 H CYS A 41 6.142 -24.604 4.298 1.00 0.00 H new ATOM 0 HA CYS A 41 7.684 -23.569 2.159 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.429 -24.945 0.312 1.00 0.00 H new ATOM 0 HB3 CYS A 41 7.854 -25.649 1.050 1.00 0.00 H new ATOM 0 HG CYS A 41 5.843 -27.662 0.925 1.00 0.00 H new ATOM 627 N ALA A 42 5.612 -22.232 1.646 1.00 0.00 N ATOM 628 CA ALA A 42 4.387 -21.395 1.506 1.00 0.00 C ATOM 629 C ALA A 42 3.682 -21.740 0.193 1.00 0.00 C ATOM 630 O ALA A 42 4.233 -21.587 -0.879 1.00 0.00 O ATOM 631 CB ALA A 42 4.780 -19.916 1.499 1.00 0.00 C ATOM 0 H ALA A 42 6.469 -21.811 1.287 1.00 0.00 H new ATOM 0 HA ALA A 42 3.715 -21.590 2.342 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.885 -19.302 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.284 -19.669 2.433 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.451 -19.722 0.662 1.00 0.00 H new ATOM 637 N GLU A 43 2.466 -22.208 0.268 1.00 0.00 N ATOM 638 CA GLU A 43 1.726 -22.564 -0.975 1.00 0.00 C ATOM 639 C GLU A 43 0.501 -21.658 -1.117 1.00 0.00 C ATOM 640 O GLU A 43 -0.090 -21.239 -0.141 1.00 0.00 O ATOM 641 CB GLU A 43 1.275 -24.024 -0.900 1.00 0.00 C ATOM 642 CG GLU A 43 0.622 -24.425 -2.224 1.00 0.00 C ATOM 643 CD GLU A 43 0.058 -25.842 -2.105 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.160 -26.410 -1.031 1.00 0.00 O ATOM 645 OE2 GLU A 43 -0.467 -26.334 -3.091 1.00 0.00 O ATOM 0 H GLU A 43 1.953 -22.359 1.137 1.00 0.00 H new ATOM 0 HA GLU A 43 2.379 -22.430 -1.837 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.129 -24.669 -0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.570 -24.156 -0.080 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -0.175 -23.725 -2.476 1.00 0.00 H new ATOM 0 HG3 GLU A 43 1.353 -24.380 -3.031 1.00 0.00 H new ATOM 652 N ILE A 44 0.116 -21.351 -2.325 1.00 0.00 N ATOM 653 CA ILE A 44 -1.071 -20.474 -2.530 1.00 0.00 C ATOM 654 C ILE A 44 -2.251 -21.317 -3.018 1.00 0.00 C ATOM 655 O ILE A 44 -2.181 -21.965 -4.042 1.00 0.00 O ATOM 656 CB ILE A 44 -0.742 -19.405 -3.576 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.553 -18.690 -3.186 1.00 0.00 C ATOM 658 CG2 ILE A 44 -1.885 -18.390 -3.645 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.938 -17.697 -4.284 1.00 0.00 C ATOM 0 H ILE A 44 0.572 -21.670 -3.180 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.333 -19.993 -1.588 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.616 -19.877 -4.550 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.421 -18.168 -2.238 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.353 -19.416 -3.041 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.651 -17.629 -4.389 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.807 -18.899 -3.924 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.012 -17.918 -2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.861 -17.187 -4.006 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.087 -18.232 -5.222 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.141 -16.963 -4.407 1.00 0.00 H new ATOM 671 N LEU A 45 -3.335 -21.314 -2.291 1.00 0.00 N ATOM 672 CA LEU A 45 -4.516 -22.116 -2.713 1.00 0.00 C ATOM 673 C LEU A 45 -5.076 -21.552 -4.020 1.00 0.00 C ATOM 674 O LEU A 45 -5.411 -22.285 -4.930 1.00 0.00 O ATOM 675 CB LEU A 45 -5.592 -22.050 -1.628 1.00 0.00 C ATOM 676 CG LEU A 45 -6.735 -23.003 -1.984 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.280 -24.448 -1.765 1.00 0.00 C ATOM 678 CD2 LEU A 45 -7.942 -22.708 -1.092 1.00 0.00 C ATOM 0 H LEU A 45 -3.453 -20.791 -1.423 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.215 -23.153 -2.864 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.166 -22.321 -0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -5.969 -21.031 -1.536 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.013 -22.863 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.093 -25.128 -2.018 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.420 -24.659 -2.400 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.002 -24.588 -0.720 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.756 -23.387 -1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.665 -22.848 -0.047 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.266 -21.679 -1.247 1.00 0.00 H new ATOM 690 N GLU A 46 -5.181 -20.255 -4.123 1.00 0.00 N ATOM 691 CA GLU A 46 -5.720 -19.648 -5.372 1.00 0.00 C ATOM 692 C GLU A 46 -5.275 -18.186 -5.464 1.00 0.00 C ATOM 693 O GLU A 46 -4.982 -17.553 -4.470 1.00 0.00 O ATOM 694 CB GLU A 46 -7.248 -19.713 -5.354 1.00 0.00 C ATOM 695 CG GLU A 46 -7.698 -21.176 -5.338 1.00 0.00 C ATOM 696 CD GLU A 46 -9.218 -21.244 -5.494 1.00 0.00 C ATOM 697 OE1 GLU A 46 -9.847 -20.200 -5.439 1.00 0.00 O ATOM 698 OE2 GLU A 46 -9.727 -22.340 -5.666 1.00 0.00 O ATOM 0 H GLU A 46 -4.917 -19.590 -3.396 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.342 -20.199 -6.234 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.634 -19.193 -4.477 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.654 -19.206 -6.229 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.214 -21.725 -6.146 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.396 -21.650 -4.404 1.00 0.00 H new ATOM 705 N GLY A 47 -5.224 -17.647 -6.651 1.00 0.00 N ATOM 706 CA GLY A 47 -4.800 -16.227 -6.808 1.00 0.00 C ATOM 707 C GLY A 47 -3.360 -16.179 -7.321 1.00 0.00 C ATOM 708 O GLY A 47 -3.019 -15.378 -8.169 1.00 0.00 O ATOM 0 H GLY A 47 -5.458 -18.129 -7.519 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.463 -15.713 -7.504 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -4.875 -15.706 -5.853 1.00 0.00 H new ATOM 712 N ASP A 48 -2.511 -17.031 -6.815 1.00 0.00 N ATOM 713 CA ASP A 48 -1.095 -17.034 -7.274 1.00 0.00 C ATOM 714 C ASP A 48 -0.456 -15.677 -6.974 1.00 0.00 C ATOM 715 O ASP A 48 0.299 -15.147 -7.765 1.00 0.00 O ATOM 716 CB ASP A 48 -1.049 -17.298 -8.780 1.00 0.00 C ATOM 717 CG ASP A 48 -1.517 -18.727 -9.061 1.00 0.00 C ATOM 718 OD1 ASP A 48 -1.643 -19.486 -8.113 1.00 0.00 O ATOM 719 OD2 ASP A 48 -1.741 -19.040 -10.219 1.00 0.00 O ATOM 0 H ASP A 48 -2.738 -17.725 -6.103 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.546 -17.816 -6.750 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.686 -16.586 -9.305 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.035 -17.156 -9.154 1.00 0.00 H new ATOM 724 N GLY A 49 -0.750 -15.109 -5.837 1.00 0.00 N ATOM 725 CA GLY A 49 -0.159 -13.787 -5.487 1.00 0.00 C ATOM 726 C GLY A 49 -0.998 -12.671 -6.111 1.00 0.00 C ATOM 727 O GLY A 49 -0.482 -11.651 -6.527 1.00 0.00 O ATOM 0 H GLY A 49 -1.375 -15.504 -5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.124 -13.668 -4.404 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.868 -13.729 -5.847 1.00 0.00 H new ATOM 731 N GLY A 50 -2.288 -12.853 -6.180 1.00 0.00 N ATOM 732 CA GLY A 50 -3.159 -11.800 -6.777 1.00 0.00 C ATOM 733 C GLY A 50 -4.185 -11.339 -5.741 1.00 0.00 C ATOM 734 O GLY A 50 -4.067 -11.628 -4.567 1.00 0.00 O ATOM 0 H GLY A 50 -2.777 -13.685 -5.849 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.553 -10.955 -7.106 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.667 -12.190 -7.659 1.00 0.00 H new ATOM 738 N PRO A 51 -5.213 -10.605 -6.190 1.00 0.00 N ATOM 739 CA PRO A 51 -6.270 -10.095 -5.308 1.00 0.00 C ATOM 740 C PRO A 51 -7.163 -11.223 -4.784 1.00 0.00 C ATOM 741 O PRO A 51 -7.654 -12.040 -5.539 1.00 0.00 O ATOM 742 CB PRO A 51 -7.077 -9.166 -6.215 1.00 0.00 C ATOM 743 CG PRO A 51 -6.829 -9.679 -7.593 1.00 0.00 C ATOM 744 CD PRO A 51 -5.425 -10.214 -7.595 1.00 0.00 C ATOM 0 HA PRO A 51 -5.865 -9.601 -4.425 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.138 -9.193 -5.967 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.752 -8.131 -6.113 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.544 -10.460 -7.852 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.944 -8.885 -8.331 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.318 -11.063 -8.270 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.707 -9.460 -7.916 1.00 0.00 H new ATOM 752 N GLY A 52 -7.377 -11.275 -3.499 1.00 0.00 N ATOM 753 CA GLY A 52 -8.236 -12.351 -2.929 1.00 0.00 C ATOM 754 C GLY A 52 -7.483 -13.682 -2.981 1.00 0.00 C ATOM 755 O GLY A 52 -8.076 -14.743 -2.991 1.00 0.00 O ATOM 0 H GLY A 52 -6.994 -10.619 -2.818 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.503 -12.112 -1.900 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.167 -12.425 -3.491 1.00 0.00 H new ATOM 759 N THR A 53 -6.179 -13.634 -3.016 1.00 0.00 N ATOM 760 CA THR A 53 -5.388 -14.895 -3.068 1.00 0.00 C ATOM 761 C THR A 53 -5.288 -15.496 -1.664 1.00 0.00 C ATOM 762 O THR A 53 -5.184 -14.788 -0.683 1.00 0.00 O ATOM 763 CB THR A 53 -3.983 -14.593 -3.594 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.077 -14.026 -4.894 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.170 -15.887 -3.656 1.00 0.00 C ATOM 0 H THR A 53 -5.628 -12.776 -3.011 1.00 0.00 H new ATOM 0 HA THR A 53 -5.881 -15.605 -3.732 1.00 0.00 H new ATOM 0 HB THR A 53 -3.488 -13.888 -2.926 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.543 -13.165 -4.843 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.170 -15.671 -4.031 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.098 -16.320 -2.658 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.662 -16.594 -4.323 1.00 0.00 H new ATOM 773 N ILE A 54 -5.317 -16.796 -1.562 1.00 0.00 N ATOM 774 CA ILE A 54 -5.223 -17.440 -0.222 1.00 0.00 C ATOM 775 C ILE A 54 -3.913 -18.225 -0.128 1.00 0.00 C ATOM 776 O ILE A 54 -3.602 -19.034 -0.979 1.00 0.00 O ATOM 777 CB ILE A 54 -6.404 -18.393 -0.028 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.715 -17.626 -0.215 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.356 -18.984 1.382 1.00 0.00 C ATOM 780 CD1 ILE A 54 -8.894 -18.595 -0.104 1.00 0.00 C ATOM 0 H ILE A 54 -5.402 -17.440 -2.348 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.246 -16.674 0.553 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.346 -19.197 -0.761 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.802 -16.844 0.539 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -7.725 -17.134 -1.188 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.197 -19.663 1.521 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.423 -19.531 1.516 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.414 -18.180 2.116 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -9.828 -18.049 -0.237 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -8.809 -19.361 -0.874 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -8.886 -19.066 0.879 1.00 0.00 H new ATOM 792 N LYS A 55 -3.142 -17.993 0.898 1.00 0.00 N ATOM 793 CA LYS A 55 -1.854 -18.726 1.043 1.00 0.00 C ATOM 794 C LYS A 55 -1.932 -19.667 2.246 1.00 0.00 C ATOM 795 O LYS A 55 -2.663 -19.429 3.187 1.00 0.00 O ATOM 796 CB LYS A 55 -0.718 -17.724 1.254 1.00 0.00 C ATOM 797 CG LYS A 55 -0.673 -16.747 0.077 1.00 0.00 C ATOM 798 CD LYS A 55 0.527 -15.810 0.239 1.00 0.00 C ATOM 799 CE LYS A 55 0.549 -14.806 -0.916 1.00 0.00 C ATOM 800 NZ LYS A 55 1.960 -14.447 -1.235 1.00 0.00 N ATOM 0 H LYS A 55 -3.349 -17.327 1.642 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.665 -19.307 0.140 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.868 -17.180 2.186 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.233 -18.249 1.341 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.596 -17.295 -0.862 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.596 -16.169 0.034 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.465 -15.284 1.192 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.452 -16.386 0.252 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.064 -15.234 -1.793 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.013 -13.912 -0.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.976 -13.765 -2.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.408 -14.022 -0.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.482 -15.303 -1.510 1.00 0.00 H new ATOM 814 N LYS A 56 -1.183 -20.736 2.225 1.00 0.00 N ATOM 815 CA LYS A 56 -1.212 -21.691 3.368 1.00 0.00 C ATOM 816 C LYS A 56 0.219 -22.078 3.745 1.00 0.00 C ATOM 817 O LYS A 56 0.994 -22.511 2.915 1.00 0.00 O ATOM 818 CB LYS A 56 -1.991 -22.945 2.966 1.00 0.00 C ATOM 819 CG LYS A 56 -2.211 -23.825 4.198 1.00 0.00 C ATOM 820 CD LYS A 56 -2.870 -25.140 3.775 1.00 0.00 C ATOM 821 CE LYS A 56 -3.223 -25.956 5.020 1.00 0.00 C ATOM 822 NZ LYS A 56 -2.574 -27.294 4.939 1.00 0.00 N ATOM 0 H LYS A 56 -0.552 -20.989 1.465 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.698 -21.220 4.222 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.950 -22.666 2.529 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.442 -23.498 2.204 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.259 -24.025 4.690 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.841 -23.306 4.921 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.769 -24.938 3.192 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.196 -25.708 3.134 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.891 -25.433 5.917 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -4.304 -26.069 5.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.814 -27.848 5.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.912 -27.793 4.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.542 -27.177 4.884 1.00 0.00 H new ATOM 836 N ILE A 57 0.576 -21.926 4.991 1.00 0.00 N ATOM 837 CA ILE A 57 1.958 -22.285 5.417 1.00 0.00 C ATOM 838 C ILE A 57 1.900 -23.439 6.421 1.00 0.00 C ATOM 839 O ILE A 57 1.051 -23.478 7.288 1.00 0.00 O ATOM 840 CB ILE A 57 2.620 -21.072 6.074 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.560 -19.877 5.121 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.082 -21.398 6.391 1.00 0.00 C ATOM 843 CD1 ILE A 57 2.888 -18.595 5.888 1.00 0.00 C ATOM 0 H ILE A 57 -0.028 -21.569 5.731 1.00 0.00 H new ATOM 0 HA ILE A 57 2.538 -22.590 4.546 1.00 0.00 H new ATOM 0 HB ILE A 57 2.093 -20.827 6.996 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.267 -20.015 4.303 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.568 -19.803 4.676 1.00 0.00 H new ATOM 0 HG21 ILE A 57 4.554 -20.534 6.859 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.126 -22.249 7.071 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.608 -21.644 5.469 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.845 -17.744 5.209 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.164 -18.456 6.691 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.889 -18.671 6.312 1.00 0.00 H new ATOM 855 N THR A 58 2.799 -24.379 6.309 1.00 0.00 N ATOM 856 CA THR A 58 2.797 -25.528 7.257 1.00 0.00 C ATOM 857 C THR A 58 4.083 -25.507 8.085 1.00 0.00 C ATOM 858 O THR A 58 5.173 -25.416 7.554 1.00 0.00 O ATOM 859 CB THR A 58 2.717 -26.838 6.470 1.00 0.00 C ATOM 860 OG1 THR A 58 1.571 -26.817 5.633 1.00 0.00 O ATOM 861 CG2 THR A 58 2.620 -28.015 7.444 1.00 0.00 C ATOM 0 H THR A 58 3.534 -24.400 5.602 1.00 0.00 H new ATOM 0 HA THR A 58 1.936 -25.451 7.921 1.00 0.00 H new ATOM 0 HB THR A 58 3.611 -26.949 5.857 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.520 -27.655 5.127 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.563 -28.948 6.883 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.501 -28.030 8.085 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.726 -27.906 8.058 1.00 0.00 H new ATOM 869 N PHE A 59 3.967 -25.587 9.382 1.00 0.00 N ATOM 870 CA PHE A 59 5.184 -25.570 10.242 1.00 0.00 C ATOM 871 C PHE A 59 5.548 -27.001 10.642 1.00 0.00 C ATOM 872 O PHE A 59 4.696 -27.793 10.993 1.00 0.00 O ATOM 873 CB PHE A 59 4.908 -24.743 11.498 1.00 0.00 C ATOM 874 CG PHE A 59 4.557 -23.328 11.102 1.00 0.00 C ATOM 875 CD1 PHE A 59 3.241 -23.008 10.749 1.00 0.00 C ATOM 876 CD2 PHE A 59 5.547 -22.339 11.088 1.00 0.00 C ATOM 877 CE1 PHE A 59 2.915 -21.696 10.380 1.00 0.00 C ATOM 878 CE2 PHE A 59 5.221 -21.028 10.719 1.00 0.00 C ATOM 879 CZ PHE A 59 3.905 -20.708 10.366 1.00 0.00 C ATOM 0 H PHE A 59 3.082 -25.663 9.884 1.00 0.00 H new ATOM 0 HA PHE A 59 6.013 -25.127 9.690 1.00 0.00 H new ATOM 0 HB2 PHE A 59 4.090 -25.187 12.066 1.00 0.00 H new ATOM 0 HB3 PHE A 59 5.784 -24.744 12.147 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.477 -23.772 10.761 1.00 0.00 H new ATOM 0 HD2 PHE A 59 6.562 -22.587 11.362 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.900 -21.448 10.107 1.00 0.00 H new ATOM 0 HE2 PHE A 59 5.985 -20.264 10.707 1.00 0.00 H new ATOM 0 HZ PHE A 59 3.654 -19.697 10.082 1.00 0.00 H new ATOM 974 N TYR A 67 -0.384 -24.289 11.344 1.00 0.00 N ATOM 975 CA TYR A 67 -0.245 -23.759 9.959 1.00 0.00 C ATOM 976 C TYR A 67 -0.801 -22.335 9.892 1.00 0.00 C ATOM 977 O TYR A 67 -1.770 -22.004 10.544 1.00 0.00 O ATOM 978 CB TYR A 67 -1.021 -24.655 8.991 1.00 0.00 C ATOM 979 CG TYR A 67 -2.503 -24.469 9.214 1.00 0.00 C ATOM 980 CD1 TYR A 67 -3.177 -25.273 10.141 1.00 0.00 C ATOM 981 CD2 TYR A 67 -3.202 -23.493 8.494 1.00 0.00 C ATOM 982 CE1 TYR A 67 -4.551 -25.100 10.348 1.00 0.00 C ATOM 983 CE2 TYR A 67 -4.576 -23.320 8.701 1.00 0.00 C ATOM 984 CZ TYR A 67 -5.250 -24.124 9.628 1.00 0.00 C ATOM 985 OH TYR A 67 -6.604 -23.954 9.832 1.00 0.00 O ATOM 0 HA TYR A 67 0.809 -23.747 9.682 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.763 -24.406 7.962 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.747 -25.699 9.145 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -2.638 -26.026 10.696 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -2.681 -22.873 7.779 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.072 -25.720 11.063 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.115 -22.567 8.146 1.00 0.00 H new ATOM 0 HH TYR A 67 -6.847 -23.021 9.655 1.00 0.00 H new ATOM 995 N VAL A 68 -0.194 -21.492 9.102 1.00 0.00 N ATOM 996 CA VAL A 68 -0.681 -20.090 8.985 1.00 0.00 C ATOM 997 C VAL A 68 -1.085 -19.815 7.535 1.00 0.00 C ATOM 998 O VAL A 68 -0.479 -20.311 6.607 1.00 0.00 O ATOM 999 CB VAL A 68 0.434 -19.129 9.397 1.00 0.00 C ATOM 1000 CG1 VAL A 68 -0.077 -17.690 9.319 1.00 0.00 C ATOM 1001 CG2 VAL A 68 0.873 -19.436 10.830 1.00 0.00 C ATOM 0 H VAL A 68 0.621 -21.716 8.531 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.543 -19.945 9.637 1.00 0.00 H new ATOM 0 HB VAL A 68 1.283 -19.251 8.724 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.718 -17.005 9.613 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.387 -17.469 8.298 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.927 -17.569 9.991 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.668 -18.750 11.122 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.025 -19.316 11.504 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.239 -20.461 10.887 1.00 0.00 H new ATOM 1011 N LYS A 69 -2.107 -19.028 7.332 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.549 -18.726 5.942 1.00 0.00 C ATOM 1013 C LYS A 69 -2.498 -17.215 5.705 1.00 0.00 C ATOM 1014 O LYS A 69 -2.875 -16.431 6.553 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.982 -19.223 5.745 1.00 0.00 C ATOM 1016 CG LYS A 69 -4.011 -20.749 5.852 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.426 -21.253 5.555 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.502 -22.755 5.838 1.00 0.00 C ATOM 1019 NZ LYS A 69 -5.859 -23.478 4.584 1.00 0.00 N ATOM 0 H LYS A 69 -2.654 -18.582 8.068 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.888 -19.227 5.235 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.638 -18.782 6.496 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.357 -18.909 4.771 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.302 -21.187 5.150 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.704 -21.060 6.851 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.150 -20.719 6.170 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.683 -21.055 4.515 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.545 -23.114 6.218 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.246 -22.954 6.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.911 -24.499 4.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.782 -23.143 4.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -5.134 -23.298 3.861 1.00 0.00 H new ATOM 1033 N HIS A 70 -2.033 -16.799 4.559 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.957 -15.338 4.271 1.00 0.00 C ATOM 1035 C HIS A 70 -2.957 -14.983 3.168 1.00 0.00 C ATOM 1036 O HIS A 70 -3.070 -15.675 2.174 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.542 -14.983 3.812 1.00 0.00 C ATOM 1038 CG HIS A 70 0.431 -15.270 4.922 1.00 0.00 C ATOM 1039 ND1 HIS A 70 0.723 -14.342 5.909 1.00 0.00 N ATOM 1040 CD2 HIS A 70 1.189 -16.378 5.214 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.620 -14.902 6.741 1.00 0.00 C ATOM 1042 NE2 HIS A 70 1.938 -16.143 6.364 1.00 0.00 N ATOM 0 H HIS A 70 -1.702 -17.407 3.810 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.198 -14.776 5.173 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.280 -15.561 2.926 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.492 -13.931 3.533 1.00 0.00 H new ATOM 0 HD1 HIS A 70 0.329 -13.405 5.990 1.00 0.00 H new ATOM 0 HD2 HIS A 70 1.202 -17.292 4.639 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.033 -14.408 7.608 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.681 -13.910 3.333 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.671 -13.512 2.293 1.00 0.00 C ATOM 1052 C LYS A 71 -4.226 -12.202 1.639 1.00 0.00 C ATOM 1053 O LYS A 71 -3.760 -11.294 2.298 1.00 0.00 O ATOM 1054 CB LYS A 71 -6.043 -13.318 2.944 1.00 0.00 C ATOM 1055 CG LYS A 71 -7.091 -13.070 1.857 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.440 -12.760 2.512 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.526 -12.692 1.437 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.722 -11.989 1.983 1.00 0.00 N ATOM 0 H LYS A 71 -3.630 -13.292 4.143 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.735 -14.292 1.534 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.309 -14.200 3.527 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.014 -12.476 3.635 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.783 -12.239 1.222 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -7.179 -13.946 1.215 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.686 -13.529 3.244 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.386 -11.813 3.050 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.151 -12.166 0.559 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.797 -13.697 1.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.461 -11.942 1.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -11.083 -12.509 2.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.457 -11.025 2.270 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.369 -12.095 0.346 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.955 -10.844 -0.348 1.00 0.00 C ATOM 1074 C ILE A 72 -5.198 -10.032 -0.719 1.00 0.00 C ATOM 1075 O ILE A 72 -6.151 -10.552 -1.264 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.179 -11.199 -1.618 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -2.022 -12.136 -1.264 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.624 -9.922 -2.252 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.249 -12.496 -2.534 1.00 0.00 C ATOM 0 H ILE A 72 -4.755 -12.820 -0.259 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.320 -10.254 0.313 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.846 -11.695 -2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.358 -11.656 -0.545 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.404 -13.040 -0.790 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.071 -10.175 -3.157 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.447 -9.254 -2.505 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.957 -9.426 -1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.425 -13.163 -2.282 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.917 -12.994 -3.237 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.854 -11.588 -2.989 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.197 -8.760 -0.425 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.380 -7.918 -0.758 1.00 0.00 C ATOM 1093 C HIS A 73 -6.223 -7.348 -2.170 1.00 0.00 C ATOM 1094 O HIS A 73 -7.131 -7.403 -2.975 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.487 -6.769 0.247 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.678 -7.328 1.629 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.831 -8.001 2.002 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.871 -7.324 2.741 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.688 -8.370 3.288 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.511 -7.982 3.787 1.00 0.00 N ATOM 0 H HIS A 73 -4.428 -8.268 0.031 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.283 -8.527 -0.712 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.586 -6.156 0.212 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.324 -6.121 -0.013 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.641 -8.183 1.409 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.889 -6.878 2.795 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.434 -8.914 3.849 1.00 0.00 H new ATOM 1108 N SER A 74 -5.078 -6.801 -2.477 1.00 0.00 N ATOM 1109 CA SER A 74 -4.869 -6.230 -3.837 1.00 0.00 C ATOM 1110 C SER A 74 -3.391 -5.887 -4.027 1.00 0.00 C ATOM 1111 O SER A 74 -2.676 -5.628 -3.079 1.00 0.00 O ATOM 1112 CB SER A 74 -5.710 -4.961 -3.991 1.00 0.00 C ATOM 1113 OG SER A 74 -5.555 -4.447 -5.306 1.00 0.00 O ATOM 0 H SER A 74 -4.280 -6.725 -1.846 1.00 0.00 H new ATOM 0 HA SER A 74 -5.171 -6.961 -4.587 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.760 -5.182 -3.797 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.400 -4.215 -3.259 1.00 0.00 H new ATOM 0 HG SER A 74 -6.095 -3.635 -5.406 1.00 0.00 H new ATOM 1119 N ILE A 75 -2.927 -5.882 -5.247 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.495 -5.555 -5.500 1.00 0.00 C ATOM 1121 C ILE A 75 -1.404 -4.467 -6.572 1.00 0.00 C ATOM 1122 O ILE A 75 -2.185 -4.432 -7.502 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.763 -6.808 -5.983 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.269 -7.190 -7.375 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.027 -7.960 -5.011 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.435 -8.351 -7.920 1.00 0.00 C ATOM 0 H ILE A 75 -3.478 -6.090 -6.080 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.035 -5.198 -4.578 1.00 0.00 H new ATOM 0 HB ILE A 75 0.308 -6.608 -6.028 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.320 -7.475 -7.326 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.202 -6.334 -8.046 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.505 -8.853 -5.355 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.666 -7.689 -4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.098 -8.160 -4.966 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.795 -8.624 -8.912 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.611 -8.049 -7.984 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.525 -9.208 -7.253 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.457 -3.578 -6.450 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.318 -2.494 -7.463 1.00 0.00 C ATOM 1140 C ASP A 76 1.101 -2.504 -8.032 1.00 0.00 C ATOM 1141 O ASP A 76 2.001 -1.890 -7.493 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.594 -1.142 -6.804 1.00 0.00 C ATOM 1143 CG ASP A 76 -2.049 -1.091 -6.333 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.817 -1.943 -6.750 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.371 -0.201 -5.563 1.00 0.00 O ATOM 0 H ASP A 76 0.226 -3.555 -5.693 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.033 -2.658 -8.270 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.078 -0.993 -5.959 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.401 -0.335 -7.511 1.00 0.00 H new ATOM 1150 N LYS A 77 1.310 -3.195 -9.119 1.00 0.00 N ATOM 1151 CA LYS A 77 2.671 -3.240 -9.722 1.00 0.00 C ATOM 1152 C LYS A 77 3.078 -1.833 -10.165 1.00 0.00 C ATOM 1153 O LYS A 77 4.229 -1.455 -10.085 1.00 0.00 O ATOM 1154 CB LYS A 77 2.661 -4.173 -10.934 1.00 0.00 C ATOM 1155 CG LYS A 77 2.435 -5.613 -10.469 1.00 0.00 C ATOM 1156 CD LYS A 77 2.581 -6.563 -11.659 1.00 0.00 C ATOM 1157 CE LYS A 77 2.195 -7.981 -11.231 1.00 0.00 C ATOM 1158 NZ LYS A 77 1.938 -8.811 -12.441 1.00 0.00 N ATOM 0 H LYS A 77 0.597 -3.730 -9.615 1.00 0.00 H new ATOM 0 HA LYS A 77 3.384 -3.610 -8.985 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.875 -3.876 -11.628 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.606 -4.098 -11.472 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.155 -5.873 -9.693 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.442 -5.713 -10.030 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.945 -6.234 -12.481 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.608 -6.549 -12.025 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.994 -8.423 -10.636 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.306 -7.953 -10.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.676 -9.775 -12.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.162 -8.391 -12.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.797 -8.847 -13.026 1.00 0.00 H new ATOM 1172 N VAL A 78 2.140 -1.054 -10.631 1.00 0.00 N ATOM 1173 CA VAL A 78 2.473 0.328 -11.078 1.00 0.00 C ATOM 1174 C VAL A 78 2.775 1.198 -9.856 1.00 0.00 C ATOM 1175 O VAL A 78 3.678 2.011 -9.869 1.00 0.00 O ATOM 1176 CB VAL A 78 1.286 0.917 -11.842 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.556 2.392 -12.143 1.00 0.00 C ATOM 1178 CG2 VAL A 78 1.095 0.154 -13.155 1.00 0.00 C ATOM 0 H VAL A 78 1.158 -1.315 -10.721 1.00 0.00 H new ATOM 0 HA VAL A 78 3.346 0.299 -11.730 1.00 0.00 H new ATOM 0 HB VAL A 78 0.384 0.829 -11.237 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.711 2.813 -12.688 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.692 2.935 -11.208 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.458 2.481 -12.749 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.249 0.573 -13.700 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.997 0.242 -13.761 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.903 -0.897 -12.940 1.00 0.00 H new ATOM 1188 N ASN A 79 2.026 1.036 -8.800 1.00 0.00 N ATOM 1189 CA ASN A 79 2.269 1.854 -7.579 1.00 0.00 C ATOM 1190 C ASN A 79 3.302 1.155 -6.692 1.00 0.00 C ATOM 1191 O ASN A 79 3.598 1.599 -5.600 1.00 0.00 O ATOM 1192 CB ASN A 79 0.960 2.016 -6.805 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.087 2.675 -7.706 1.00 0.00 C ATOM 1194 OD1 ASN A 79 -1.236 2.085 -7.888 1.00 0.00 O flip ATOM 1195 ND2 ASN A 79 0.143 3.737 -8.248 1.00 0.00 N flip ATOM 0 H ASN A 79 1.255 0.372 -8.730 1.00 0.00 H new ATOM 0 HA ASN A 79 2.644 2.835 -7.869 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.603 1.044 -6.466 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.124 2.624 -5.915 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.042 4.198 -8.106 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -0.562 4.168 -8.846 1.00 0.00 H new ATOM 1202 N HIS A 80 3.856 0.065 -7.151 1.00 0.00 N ATOM 1203 CA HIS A 80 4.868 -0.658 -6.332 1.00 0.00 C ATOM 1204 C HIS A 80 4.344 -0.825 -4.904 1.00 0.00 C ATOM 1205 O HIS A 80 5.082 -0.722 -3.945 1.00 0.00 O ATOM 1206 CB HIS A 80 6.171 0.144 -6.306 1.00 0.00 C ATOM 1207 CG HIS A 80 6.588 0.469 -7.714 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.455 1.740 -8.251 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.135 -0.303 -8.709 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.915 1.697 -9.515 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.341 0.475 -9.846 1.00 0.00 N ATOM 0 H HIS A 80 3.651 -0.355 -8.058 1.00 0.00 H new ATOM 0 HA HIS A 80 5.054 -1.639 -6.768 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.034 1.062 -5.735 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.953 -0.428 -5.807 1.00 0.00 H new ATOM 0 HD1 HIS A 80 6.077 2.559 -7.775 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.370 -1.354 -8.623 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.937 2.547 -10.181 1.00 0.00 H new ATOM 1219 N THR A 81 3.074 -1.085 -4.756 1.00 0.00 N ATOM 1220 CA THR A 81 2.504 -1.259 -3.391 1.00 0.00 C ATOM 1221 C THR A 81 1.885 -2.653 -3.269 1.00 0.00 C ATOM 1222 O THR A 81 1.226 -3.131 -4.171 1.00 0.00 O ATOM 1223 CB THR A 81 1.427 -0.199 -3.149 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.971 1.090 -3.394 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.941 -0.283 -1.701 1.00 0.00 C ATOM 0 H THR A 81 2.407 -1.184 -5.521 1.00 0.00 H new ATOM 0 HA THR A 81 3.296 -1.148 -2.650 1.00 0.00 H new ATOM 0 HB THR A 81 0.587 -0.374 -3.822 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.419 1.096 -4.266 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.174 0.472 -1.530 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.524 -1.272 -1.514 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.779 -0.109 -1.025 1.00 0.00 H new ATOM 1233 N TYR A 82 2.092 -3.308 -2.160 1.00 0.00 N ATOM 1234 CA TYR A 82 1.515 -4.670 -1.979 1.00 0.00 C ATOM 1235 C TYR A 82 0.692 -4.704 -0.689 1.00 0.00 C ATOM 1236 O TYR A 82 1.162 -4.330 0.366 1.00 0.00 O ATOM 1237 CB TYR A 82 2.647 -5.696 -1.892 1.00 0.00 C ATOM 1238 CG TYR A 82 2.064 -7.082 -1.763 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.675 -7.787 -2.908 1.00 0.00 C ATOM 1240 CD2 TYR A 82 1.910 -7.663 -0.498 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.133 -9.072 -2.789 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.370 -8.948 -0.379 1.00 0.00 C ATOM 1243 CZ TYR A 82 0.981 -9.653 -1.525 1.00 0.00 C ATOM 1244 OH TYR A 82 0.447 -10.920 -1.407 1.00 0.00 O ATOM 0 H TYR A 82 2.636 -2.959 -1.371 1.00 0.00 H new ATOM 0 HA TYR A 82 0.873 -4.911 -2.827 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.275 -5.636 -2.781 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.285 -5.477 -1.035 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.793 -7.339 -3.884 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.208 -7.119 0.386 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.832 -9.615 -3.673 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.253 -9.396 0.597 1.00 0.00 H new ATOM 0 HH TYR A 82 0.823 -11.361 -0.617 1.00 0.00 H new ATOM 1254 N SER A 83 -0.534 -5.145 -0.765 1.00 0.00 N ATOM 1255 CA SER A 83 -1.382 -5.194 0.460 1.00 0.00 C ATOM 1256 C SER A 83 -1.797 -6.640 0.742 1.00 0.00 C ATOM 1257 O SER A 83 -2.220 -7.359 -0.141 1.00 0.00 O ATOM 1258 CB SER A 83 -2.631 -4.337 0.249 1.00 0.00 C ATOM 1259 OG SER A 83 -3.424 -4.901 -0.785 1.00 0.00 O ATOM 0 H SER A 83 -0.984 -5.473 -1.620 1.00 0.00 H new ATOM 0 HA SER A 83 -0.815 -4.810 1.308 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.206 -4.280 1.173 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.346 -3.318 -0.012 1.00 0.00 H new ATOM 0 HG SER A 83 -2.915 -4.906 -1.622 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.686 -7.067 1.970 1.00 0.00 N ATOM 1266 CA TYR A 84 -2.078 -8.463 2.316 1.00 0.00 C ATOM 1267 C TYR A 84 -2.391 -8.542 3.813 1.00 0.00 C ATOM 1268 O TYR A 84 -2.139 -7.615 4.557 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.931 -9.418 1.976 1.00 0.00 C ATOM 1270 CG TYR A 84 0.196 -9.231 2.964 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.083 -8.157 2.820 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.354 -10.132 4.024 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.129 -7.986 3.736 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.399 -9.961 4.939 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.287 -8.887 4.795 1.00 0.00 C ATOM 1276 OH TYR A 84 3.318 -8.719 5.698 1.00 0.00 O ATOM 0 H TYR A 84 -1.340 -6.508 2.750 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.961 -8.748 1.744 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.283 -10.449 2.002 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.575 -9.229 0.963 1.00 0.00 H new ATOM 0 HD1 TYR A 84 0.961 -7.461 2.003 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -0.331 -10.959 4.136 1.00 0.00 H new ATOM 0 HE1 TYR A 84 2.814 -7.158 3.625 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.521 -10.657 5.756 1.00 0.00 H new ATOM 0 HH TYR A 84 3.283 -9.431 6.371 1.00 0.00 H new ATOM 1286 N SER A 85 -2.942 -9.638 4.262 1.00 0.00 N ATOM 1287 CA SER A 85 -3.270 -9.761 5.710 1.00 0.00 C ATOM 1288 C SER A 85 -3.157 -11.222 6.147 1.00 0.00 C ATOM 1289 O SER A 85 -3.259 -12.131 5.346 1.00 0.00 O ATOM 1290 CB SER A 85 -4.699 -9.269 5.950 1.00 0.00 C ATOM 1291 OG SER A 85 -5.610 -10.100 5.247 1.00 0.00 O ATOM 0 H SER A 85 -3.178 -10.450 3.691 1.00 0.00 H new ATOM 0 HA SER A 85 -2.570 -9.158 6.289 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.926 -9.283 7.016 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.800 -8.236 5.616 1.00 0.00 H new ATOM 0 HG SER A 85 -5.825 -9.692 4.383 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.951 -11.456 7.415 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.837 -12.857 7.909 1.00 0.00 C ATOM 1299 C LEU A 86 -4.220 -13.356 8.330 1.00 0.00 C ATOM 1300 O LEU A 86 -4.782 -12.902 9.306 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.891 -12.900 9.110 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.626 -14.356 9.493 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.926 -15.066 8.334 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -0.733 -14.403 10.735 1.00 0.00 C ATOM 0 H LEU A 86 -2.857 -10.735 8.131 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.443 -13.494 7.117 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.954 -12.400 8.867 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.329 -12.365 9.952 1.00 0.00 H new ATOM 0 HG LEU A 86 -2.571 -14.854 9.708 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.736 -16.105 8.605 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.562 -15.032 7.449 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.020 -14.568 8.120 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.544 -15.441 11.008 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.213 -13.906 10.522 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -1.231 -13.895 11.561 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.775 -14.283 7.600 1.00 0.00 N ATOM 1317 CA ILE A 87 -6.126 -14.803 7.955 1.00 0.00 C ATOM 1318 C ILE A 87 -6.027 -15.731 9.169 1.00 0.00 C ATOM 1319 O ILE A 87 -6.797 -15.625 10.104 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.704 -15.571 6.763 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -8.206 -15.778 6.966 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -6.013 -16.930 6.641 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -8.915 -15.733 5.611 1.00 0.00 C ATOM 0 H ILE A 87 -4.352 -14.703 6.773 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.780 -13.967 8.202 1.00 0.00 H new ATOM 0 HB ILE A 87 -6.537 -14.998 5.851 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -8.389 -16.736 7.453 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -8.605 -15.005 7.623 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -6.427 -17.474 5.792 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.944 -16.782 6.491 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -6.175 -17.504 7.553 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.985 -15.880 5.755 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.742 -14.764 5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -8.523 -16.522 4.969 1.00 0.00 H new ATOM 1335 N GLU A 88 -5.094 -16.643 9.166 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.964 -17.574 10.323 1.00 0.00 C ATOM 1337 C GLU A 88 -3.485 -17.846 10.609 1.00 0.00 C ATOM 1338 O GLU A 88 -2.620 -17.533 9.817 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.668 -18.893 9.998 1.00 0.00 C ATOM 1340 CG GLU A 88 -7.165 -18.638 9.816 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.877 -19.963 9.529 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -7.190 -20.953 9.341 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -9.096 -19.964 9.503 1.00 0.00 O ATOM 0 H GLU A 88 -4.418 -16.784 8.415 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.423 -17.119 11.201 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.249 -19.328 9.091 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.505 -19.612 10.801 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.578 -18.178 10.714 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.329 -17.940 8.995 1.00 0.00 H new ATOM 1350 N GLY A 89 -3.194 -18.430 11.740 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.775 -18.727 12.087 1.00 0.00 C ATOM 1352 C GLY A 89 -1.706 -19.245 13.526 1.00 0.00 C ATOM 1353 O GLY A 89 -2.475 -18.842 14.377 1.00 0.00 O ATOM 0 H GLY A 89 -3.879 -18.715 12.440 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.368 -19.470 11.401 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.167 -17.829 11.982 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.795 -20.136 13.805 1.00 0.00 N ATOM 1358 CA ASP A 90 -0.683 -20.679 15.188 1.00 0.00 C ATOM 1359 C ASP A 90 -0.419 -19.535 16.169 1.00 0.00 C ATOM 1360 O ASP A 90 -0.765 -19.608 17.331 1.00 0.00 O ATOM 1361 CB ASP A 90 0.470 -21.682 15.250 1.00 0.00 C ATOM 1362 CG ASP A 90 0.249 -22.779 14.208 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -0.899 -23.118 13.969 1.00 0.00 O ATOM 1364 OD2 ASP A 90 1.229 -23.262 13.667 1.00 0.00 O ATOM 0 H ASP A 90 -0.123 -20.511 13.135 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.614 -21.178 15.458 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.417 -21.175 15.065 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.532 -22.119 16.246 1.00 0.00 H new ATOM 1369 N ALA A 91 0.194 -18.476 15.712 1.00 0.00 N ATOM 1370 CA ALA A 91 0.479 -17.332 16.622 1.00 0.00 C ATOM 1371 C ALA A 91 -0.800 -16.518 16.836 1.00 0.00 C ATOM 1372 O ALA A 91 -0.980 -15.887 17.859 1.00 0.00 O ATOM 1373 CB ALA A 91 1.553 -16.438 15.997 1.00 0.00 C ATOM 0 H ALA A 91 0.509 -18.355 14.749 1.00 0.00 H new ATOM 0 HA ALA A 91 0.833 -17.711 17.581 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.762 -15.601 16.663 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.464 -17.016 15.844 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.199 -16.060 15.038 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.691 -16.529 15.882 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.957 -15.756 16.036 1.00 0.00 C ATOM 1381 C LEU A 92 -3.884 -16.512 16.978 1.00 0.00 C ATOM 1382 O LEU A 92 -4.649 -15.931 17.722 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.640 -15.607 14.674 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.583 -15.426 13.584 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -3.259 -14.954 12.296 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -1.559 -14.385 14.033 1.00 0.00 C ATOM 0 H LEU A 92 -1.597 -17.039 15.004 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.735 -14.768 16.439 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.247 -16.487 14.463 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.314 -14.750 14.686 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.079 -16.376 13.405 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.508 -14.824 11.517 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.989 -15.697 11.975 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.762 -14.004 12.476 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.806 -14.257 13.256 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.061 -13.434 14.212 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.078 -14.720 14.952 1.00 0.00 H new ATOM 1398 N SER A 93 -3.820 -17.811 16.944 1.00 0.00 N ATOM 1399 CA SER A 93 -4.695 -18.626 17.831 1.00 0.00 C ATOM 1400 C SER A 93 -6.155 -18.231 17.602 1.00 0.00 C ATOM 1401 O SER A 93 -6.456 -17.376 16.793 1.00 0.00 O ATOM 1402 CB SER A 93 -4.321 -18.372 19.293 1.00 0.00 C ATOM 1403 OG SER A 93 -3.163 -19.125 19.623 1.00 0.00 O ATOM 0 H SER A 93 -3.198 -18.347 16.339 1.00 0.00 H new ATOM 0 HA SER A 93 -4.562 -19.683 17.603 1.00 0.00 H new ATOM 0 HB2 SER A 93 -4.135 -17.310 19.453 1.00 0.00 H new ATOM 0 HB3 SER A 93 -5.148 -18.652 19.945 1.00 0.00 H new ATOM 0 HG SER A 93 -2.922 -18.961 20.559 1.00 0.00 H new ATOM 1409 N GLU A 94 -7.065 -18.848 18.304 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.502 -18.504 18.121 1.00 0.00 C ATOM 1411 C GLU A 94 -8.843 -17.262 18.948 1.00 0.00 C ATOM 1412 O GLU A 94 -9.984 -16.852 19.029 1.00 0.00 O ATOM 1413 CB GLU A 94 -9.369 -19.677 18.585 1.00 0.00 C ATOM 1414 CG GLU A 94 -9.135 -20.876 17.664 1.00 0.00 C ATOM 1415 CD GLU A 94 -10.094 -22.006 18.046 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.790 -21.856 19.036 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -10.117 -23.001 17.339 1.00 0.00 O ATOM 0 H GLU A 94 -6.876 -19.574 18.995 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.694 -18.301 17.067 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.123 -19.941 19.614 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.421 -19.394 18.571 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.292 -20.586 16.625 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -8.103 -21.216 17.747 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.862 -16.659 19.564 1.00 0.00 N ATOM 1425 CA ASN A 95 -8.133 -15.445 20.383 1.00 0.00 C ATOM 1426 C ASN A 95 -7.819 -14.193 19.562 1.00 0.00 C ATOM 1427 O ASN A 95 -8.391 -13.142 19.771 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.249 -15.465 21.632 1.00 0.00 C ATOM 1429 CG ASN A 95 -7.547 -16.723 22.450 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -8.627 -17.274 22.368 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.628 -17.205 23.240 1.00 0.00 N ATOM 0 H ASN A 95 -6.886 -16.955 19.535 1.00 0.00 H new ATOM 0 HA ASN A 95 -9.183 -15.434 20.677 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.197 -15.445 21.346 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.432 -14.575 22.234 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -6.816 -18.044 23.789 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.721 -16.743 23.309 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.911 -14.295 18.630 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.560 -13.107 17.801 1.00 0.00 C ATOM 1440 C ILE A 96 -7.175 -13.249 16.408 1.00 0.00 C ATOM 1441 O ILE A 96 -7.158 -14.308 15.813 1.00 0.00 O ATOM 1442 CB ILE A 96 -5.038 -13.005 17.678 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.416 -12.950 19.075 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.674 -11.734 16.908 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.892 -12.882 18.955 1.00 0.00 C ATOM 0 H ILE A 96 -6.398 -15.148 18.407 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.950 -12.207 18.277 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.657 -13.876 17.145 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.788 -12.080 19.616 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.707 -13.830 19.649 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.590 -11.660 16.820 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -5.117 -11.772 15.913 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -5.055 -10.863 17.442 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.450 -12.843 19.951 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.528 -13.766 18.431 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.610 -11.989 18.398 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.719 -12.185 15.883 1.00 0.00 N ATOM 1458 CA GLU A 97 -8.336 -12.249 14.528 1.00 0.00 C ATOM 1459 C GLU A 97 -7.248 -12.067 13.468 1.00 0.00 C ATOM 1460 O GLU A 97 -6.083 -11.918 13.777 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.382 -11.142 14.386 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.496 -11.358 15.412 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.151 -12.719 15.174 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -10.971 -13.261 14.095 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -11.822 -13.198 16.074 1.00 0.00 O ATOM 0 H GLU A 97 -7.763 -11.272 16.336 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.818 -13.217 14.393 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.918 -10.167 14.537 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.796 -11.145 13.378 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.089 -11.310 16.422 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.240 -10.565 15.330 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.619 -12.086 12.217 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.607 -11.922 11.136 1.00 0.00 C ATOM 1474 C LYS A 98 -5.854 -10.602 11.324 1.00 0.00 C ATOM 1475 O LYS A 98 -6.273 -9.733 12.064 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.314 -11.914 9.778 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.225 -10.688 9.684 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.964 -10.704 8.345 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.516 -9.307 8.051 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.297 -8.825 9.225 1.00 0.00 N ATOM 0 H LYS A 98 -8.580 -12.208 11.897 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.898 -12.749 11.178 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -6.579 -11.897 8.973 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -7.899 -12.825 9.655 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -8.940 -10.689 10.506 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -7.636 -9.776 9.775 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -8.288 -11.015 7.548 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -9.777 -11.429 8.375 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -8.698 -8.619 7.837 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.150 -9.334 7.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -10.939 -8.063 8.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.853 -9.611 9.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -9.646 -8.464 9.951 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.743 -10.450 10.655 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.954 -9.192 10.784 1.00 0.00 C ATOM 1496 C ILE A 99 -3.743 -8.588 9.394 1.00 0.00 C ATOM 1497 O ILE A 99 -3.397 -9.277 8.455 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.596 -9.506 11.416 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.804 -10.304 12.705 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.868 -8.200 11.737 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.458 -10.842 13.194 1.00 0.00 C ATOM 0 H ILE A 99 -4.347 -11.146 10.023 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.491 -8.483 11.414 1.00 0.00 H new ATOM 0 HB ILE A 99 -1.999 -10.093 10.718 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -3.254 -9.670 13.469 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.495 -11.128 12.528 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.901 -8.424 12.187 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.718 -7.632 10.819 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.465 -7.612 12.434 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.605 -11.411 14.112 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.026 -11.490 12.431 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.782 -10.009 13.387 1.00 0.00 H new ATOM 1513 N ASP A 100 -3.954 -7.309 9.252 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.769 -6.670 7.919 1.00 0.00 C ATOM 1515 C ASP A 100 -2.329 -6.175 7.775 1.00 0.00 C ATOM 1516 O ASP A 100 -1.831 -5.435 8.600 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.730 -5.487 7.782 1.00 0.00 C ATOM 1518 CG ASP A 100 -6.171 -6.002 7.749 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -6.347 -7.206 7.667 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -7.073 -5.183 7.807 1.00 0.00 O ATOM 0 H ASP A 100 -4.246 -6.680 10.000 1.00 0.00 H new ATOM 0 HA ASP A 100 -3.977 -7.402 7.139 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.598 -4.798 8.617 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.511 -4.930 6.871 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.658 -6.575 6.729 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.251 -6.126 6.525 1.00 0.00 C ATOM 1527 C TYR A 101 -0.147 -5.388 5.189 1.00 0.00 C ATOM 1528 O TYR A 101 -0.667 -5.830 4.184 1.00 0.00 O ATOM 1529 CB TYR A 101 0.678 -7.342 6.503 1.00 0.00 C ATOM 1530 CG TYR A 101 0.695 -7.994 7.866 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.483 -7.454 8.890 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.074 -9.139 8.103 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.502 -8.061 10.152 1.00 0.00 C ATOM 1534 CE2 TYR A 101 -0.056 -9.744 9.365 1.00 0.00 C ATOM 1535 CZ TYR A 101 0.732 -9.206 10.389 1.00 0.00 C ATOM 1536 OH TYR A 101 0.750 -9.804 11.633 1.00 0.00 O ATOM 0 H TYR A 101 -2.024 -7.194 6.006 1.00 0.00 H new ATOM 0 HA TYR A 101 0.040 -5.462 7.339 1.00 0.00 H new ATOM 0 HB2 TYR A 101 0.341 -8.056 5.752 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.686 -7.037 6.223 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.076 -6.570 8.707 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.681 -9.555 7.313 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.110 -7.646 10.942 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.651 -10.627 9.549 1.00 0.00 H new ATOM 0 HH TYR A 101 1.025 -9.148 12.307 1.00 0.00 H new ATOM 1546 N GLU A 102 0.519 -4.265 5.165 1.00 0.00 N ATOM 1547 CA GLU A 102 0.650 -3.507 3.888 1.00 0.00 C ATOM 1548 C GLU A 102 2.124 -3.190 3.627 1.00 0.00 C ATOM 1549 O GLU A 102 2.858 -2.821 4.522 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.143 -2.203 3.985 1.00 0.00 C ATOM 1551 CG GLU A 102 -0.435 -1.679 2.577 1.00 0.00 C ATOM 1552 CD GLU A 102 -1.166 -0.338 2.672 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.539 0.034 3.771 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -1.341 0.293 1.642 1.00 0.00 O ATOM 0 H GLU A 102 0.977 -3.841 5.972 1.00 0.00 H new ATOM 0 HA GLU A 102 0.260 -4.110 3.068 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.076 -2.371 4.523 1.00 0.00 H new ATOM 0 HB3 GLU A 102 0.422 -1.462 4.551 1.00 0.00 H new ATOM 0 HG2 GLU A 102 0.495 -1.559 2.022 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.043 -2.399 2.029 1.00 0.00 H new ATOM 1561 N THR A 103 2.562 -3.330 2.405 1.00 0.00 N ATOM 1562 CA THR A 103 3.988 -3.035 2.085 1.00 0.00 C ATOM 1563 C THR A 103 4.053 -2.082 0.889 1.00 0.00 C ATOM 1564 O THR A 103 3.370 -2.264 -0.100 1.00 0.00 O ATOM 1565 CB THR A 103 4.712 -4.338 1.739 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.572 -5.256 2.815 1.00 0.00 O ATOM 1567 CG2 THR A 103 6.195 -4.052 1.498 1.00 0.00 C ATOM 0 H THR A 103 1.994 -3.636 1.615 1.00 0.00 H new ATOM 0 HA THR A 103 4.467 -2.571 2.947 1.00 0.00 H new ATOM 0 HB THR A 103 4.277 -4.767 0.836 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.892 -6.139 2.535 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.709 -4.981 1.252 1.00 0.00 H new ATOM 0 HG22 THR A 103 6.300 -3.349 0.672 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.634 -3.622 2.398 1.00 0.00 H new ATOM 1575 N LYS A 104 4.870 -1.067 0.971 1.00 0.00 N ATOM 1576 CA LYS A 104 4.976 -0.106 -0.162 1.00 0.00 C ATOM 1577 C LYS A 104 6.451 0.150 -0.481 1.00 0.00 C ATOM 1578 O LYS A 104 7.254 0.391 0.400 1.00 0.00 O ATOM 1579 CB LYS A 104 4.302 1.213 0.223 1.00 0.00 C ATOM 1580 CG LYS A 104 4.189 2.109 -1.012 1.00 0.00 C ATOM 1581 CD LYS A 104 3.566 3.449 -0.616 1.00 0.00 C ATOM 1582 CE LYS A 104 3.399 4.322 -1.861 1.00 0.00 C ATOM 1583 NZ LYS A 104 3.541 5.757 -1.484 1.00 0.00 N ATOM 0 H LYS A 104 5.467 -0.863 1.772 1.00 0.00 H new ATOM 0 HA LYS A 104 4.483 -0.525 -1.039 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.312 1.020 0.637 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.880 1.716 0.998 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.174 2.269 -1.449 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.578 1.623 -1.772 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.599 3.286 -0.141 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.198 3.955 0.114 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.147 4.055 -2.608 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.422 4.148 -2.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 3.428 6.351 -2.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.812 6.006 -0.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.483 5.916 -1.073 1.00 0.00 H new ATOM 1597 N LEU A 105 6.815 0.101 -1.733 1.00 0.00 N ATOM 1598 CA LEU A 105 8.236 0.342 -2.108 1.00 0.00 C ATOM 1599 C LEU A 105 8.381 1.756 -2.677 1.00 0.00 C ATOM 1600 O LEU A 105 7.722 2.122 -3.629 1.00 0.00 O ATOM 1601 CB LEU A 105 8.665 -0.678 -3.165 1.00 0.00 C ATOM 1602 CG LEU A 105 8.638 -2.083 -2.561 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.437 -2.092 -1.256 1.00 0.00 C ATOM 1604 CD2 LEU A 105 7.189 -2.487 -2.274 1.00 0.00 C ATOM 0 H LEU A 105 6.188 -0.096 -2.513 1.00 0.00 H new ATOM 0 HA LEU A 105 8.867 0.238 -1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.998 -0.628 -4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.667 -0.445 -3.525 1.00 0.00 H new ATOM 0 HG LEU A 105 9.080 -2.789 -3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.418 -3.093 -0.825 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.468 -1.803 -1.459 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.994 -1.386 -0.553 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.169 -3.488 -1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.747 -1.781 -1.571 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.619 -2.480 -3.203 1.00 0.00 H new ATOM 1616 N VAL A 106 9.239 2.551 -2.100 1.00 0.00 N ATOM 1617 CA VAL A 106 9.424 3.940 -2.608 1.00 0.00 C ATOM 1618 C VAL A 106 10.914 4.206 -2.835 1.00 0.00 C ATOM 1619 O VAL A 106 11.755 3.771 -2.073 1.00 0.00 O ATOM 1620 CB VAL A 106 8.880 4.935 -1.581 1.00 0.00 C ATOM 1621 CG1 VAL A 106 9.006 6.356 -2.132 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.409 4.625 -1.300 1.00 0.00 C ATOM 0 H VAL A 106 9.819 2.300 -1.300 1.00 0.00 H new ATOM 0 HA VAL A 106 8.886 4.057 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 106 9.451 4.852 -0.656 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.619 7.065 -1.401 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.054 6.577 -2.332 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.435 6.440 -3.057 1.00 0.00 H new ATOM 0 HG21 VAL A 106 7.021 5.334 -0.568 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.837 4.708 -2.224 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.319 3.612 -0.907 1.00 0.00 H new ATOM 1632 N SER A 107 11.249 4.917 -3.877 1.00 0.00 N ATOM 1633 CA SER A 107 12.684 5.210 -4.149 1.00 0.00 C ATOM 1634 C SER A 107 12.939 6.710 -3.993 1.00 0.00 C ATOM 1635 O SER A 107 12.089 7.527 -4.285 1.00 0.00 O ATOM 1636 CB SER A 107 13.032 4.780 -5.576 1.00 0.00 C ATOM 1637 OG SER A 107 14.362 4.281 -5.608 1.00 0.00 O ATOM 0 H SER A 107 10.591 5.307 -4.551 1.00 0.00 H new ATOM 0 HA SER A 107 13.305 4.661 -3.442 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.336 4.013 -5.916 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.933 5.626 -6.257 1.00 0.00 H new ATOM 0 HG SER A 107 14.826 4.534 -4.783 1.00 0.00 H new ATOM 1643 N ALA A 108 14.104 7.078 -3.535 1.00 0.00 N ATOM 1644 CA ALA A 108 14.411 8.526 -3.360 1.00 0.00 C ATOM 1645 C ALA A 108 15.459 8.954 -4.389 1.00 0.00 C ATOM 1646 O ALA A 108 15.994 8.142 -5.119 1.00 0.00 O ATOM 1647 CB ALA A 108 14.952 8.767 -1.949 1.00 0.00 C ATOM 0 H ALA A 108 14.856 6.440 -3.275 1.00 0.00 H new ATOM 0 HA ALA A 108 13.502 9.109 -3.504 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.176 9.826 -1.821 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.205 8.464 -1.216 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.861 8.183 -1.803 1.00 0.00 H new ATOM 1653 N PRO A 109 15.755 10.261 -4.444 1.00 0.00 N ATOM 1654 CA PRO A 109 16.740 10.813 -5.382 1.00 0.00 C ATOM 1655 C PRO A 109 18.166 10.387 -5.025 1.00 0.00 C ATOM 1656 O PRO A 109 19.073 10.483 -5.829 1.00 0.00 O ATOM 1657 CB PRO A 109 16.586 12.325 -5.213 1.00 0.00 C ATOM 1658 CG PRO A 109 16.034 12.493 -3.837 1.00 0.00 C ATOM 1659 CD PRO A 109 15.152 11.302 -3.594 1.00 0.00 C ATOM 0 HA PRO A 109 16.574 10.466 -6.402 1.00 0.00 H new ATOM 0 HB2 PRO A 109 17.543 12.836 -5.322 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.915 12.742 -5.964 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.835 12.542 -3.099 1.00 0.00 H new ATOM 0 HG3 PRO A 109 15.468 13.421 -3.755 1.00 0.00 H new ATOM 0 HD2 PRO A 109 15.147 11.012 -2.543 1.00 0.00 H new ATOM 0 HD3 PRO A 109 14.118 11.502 -3.874 1.00 0.00 H new ATOM 1667 N HIS A 110 18.372 9.914 -3.827 1.00 0.00 N ATOM 1668 CA HIS A 110 19.739 9.481 -3.422 1.00 0.00 C ATOM 1669 C HIS A 110 20.116 8.215 -4.192 1.00 0.00 C ATOM 1670 O HIS A 110 21.277 7.879 -4.325 1.00 0.00 O ATOM 1671 CB HIS A 110 19.759 9.186 -1.921 1.00 0.00 C ATOM 1672 CG HIS A 110 19.401 10.432 -1.158 1.00 0.00 C ATOM 1673 ND1 HIS A 110 20.252 11.523 -1.085 1.00 0.00 N ATOM 1674 CD2 HIS A 110 18.288 10.775 -0.432 1.00 0.00 C ATOM 1675 CE1 HIS A 110 19.644 12.462 -0.337 1.00 0.00 C ATOM 1676 NE2 HIS A 110 18.443 12.057 0.087 1.00 0.00 N ATOM 0 H HIS A 110 17.653 9.809 -3.111 1.00 0.00 H new ATOM 0 HA HIS A 110 20.453 10.274 -3.645 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.053 8.389 -1.687 1.00 0.00 H new ATOM 0 HB3 HIS A 110 20.747 8.835 -1.622 1.00 0.00 H new ATOM 0 HD2 HIS A 110 17.423 10.145 -0.286 1.00 0.00 H new ATOM 0 HE1 HIS A 110 20.074 13.426 -0.107 1.00 0.00 H new ATOM 0 HE2 HIS A 110 17.783 12.576 0.666 1.00 0.00 H new ATOM 1684 N GLY A 111 19.145 7.508 -4.701 1.00 0.00 N ATOM 1685 CA GLY A 111 19.445 6.263 -5.461 1.00 0.00 C ATOM 1686 C GLY A 111 19.000 5.048 -4.644 1.00 0.00 C ATOM 1687 O GLY A 111 18.768 3.981 -5.176 1.00 0.00 O ATOM 0 H GLY A 111 18.155 7.740 -4.623 1.00 0.00 H new ATOM 0 HA2 GLY A 111 18.930 6.277 -6.422 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.512 6.201 -5.673 1.00 0.00 H new ATOM 1691 N GLY A 112 18.879 5.204 -3.354 1.00 0.00 N ATOM 1692 CA GLY A 112 18.447 4.059 -2.505 1.00 0.00 C ATOM 1693 C GLY A 112 16.927 3.911 -2.588 1.00 0.00 C ATOM 1694 O GLY A 112 16.252 4.699 -3.220 1.00 0.00 O ATOM 0 H GLY A 112 19.060 6.073 -2.852 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.932 3.141 -2.838 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.752 4.223 -1.471 1.00 0.00 H new ATOM 1698 N THR A 113 16.382 2.908 -1.956 1.00 0.00 N ATOM 1699 CA THR A 113 14.907 2.714 -2.003 1.00 0.00 C ATOM 1700 C THR A 113 14.349 2.642 -0.580 1.00 0.00 C ATOM 1701 O THR A 113 14.789 1.852 0.230 1.00 0.00 O ATOM 1702 CB THR A 113 14.586 1.411 -2.741 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.041 1.506 -4.084 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.075 1.175 -2.727 1.00 0.00 C ATOM 0 H THR A 113 16.895 2.216 -1.410 1.00 0.00 H new ATOM 0 HA THR A 113 14.451 3.554 -2.528 1.00 0.00 H new ATOM 0 HB THR A 113 15.086 0.578 -2.246 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.782 0.880 -4.223 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.847 0.248 -3.252 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.727 1.103 -1.696 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.572 2.006 -3.222 1.00 0.00 H new ATOM 1712 N ILE A 114 13.380 3.460 -0.273 1.00 0.00 N ATOM 1713 CA ILE A 114 12.790 3.435 1.096 1.00 0.00 C ATOM 1714 C ILE A 114 11.608 2.464 1.116 1.00 0.00 C ATOM 1715 O ILE A 114 10.839 2.390 0.178 1.00 0.00 O ATOM 1716 CB ILE A 114 12.306 4.838 1.469 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.464 5.829 1.339 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.798 4.835 2.912 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.950 7.250 1.586 1.00 0.00 C ATOM 0 H ILE A 114 12.971 4.144 -0.910 1.00 0.00 H new ATOM 0 HA ILE A 114 13.543 3.110 1.814 1.00 0.00 H new ATOM 0 HB ILE A 114 11.498 5.133 0.799 1.00 0.00 H new ATOM 0 HG12 ILE A 114 14.248 5.585 2.056 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.907 5.759 0.346 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.453 5.834 3.178 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.973 4.129 3.006 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.606 4.540 3.582 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.775 7.956 1.493 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.181 7.492 0.852 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.527 7.315 2.589 1.00 0.00 H new ATOM 1731 N ILE A 115 11.457 1.714 2.173 1.00 0.00 N ATOM 1732 CA ILE A 115 10.325 0.748 2.241 1.00 0.00 C ATOM 1733 C ILE A 115 9.487 1.018 3.492 1.00 0.00 C ATOM 1734 O ILE A 115 9.973 0.957 4.604 1.00 0.00 O ATOM 1735 CB ILE A 115 10.876 -0.679 2.299 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.828 -0.908 1.123 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.719 -1.676 2.220 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.620 -2.197 1.349 1.00 0.00 C ATOM 0 H ILE A 115 12.067 1.728 2.990 1.00 0.00 H new ATOM 0 HA ILE A 115 9.700 0.865 1.356 1.00 0.00 H new ATOM 0 HB ILE A 115 11.415 -0.822 3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.264 -0.974 0.193 1.00 0.00 H new ATOM 0 HG13 ILE A 115 12.509 -0.063 1.023 1.00 0.00 H new ATOM 0 HG21 ILE A 115 10.111 -2.692 2.261 1.00 0.00 H new ATOM 0 HG22 ILE A 115 9.041 -1.514 3.058 1.00 0.00 H new ATOM 0 HG23 ILE A 115 9.179 -1.533 1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 115 13.298 -2.359 0.511 1.00 0.00 H new ATOM 0 HD12 ILE A 115 13.196 -2.113 2.271 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.931 -3.038 1.427 1.00 0.00 H new ATOM 1750 N LYS A 116 8.227 1.310 3.318 1.00 0.00 N ATOM 1751 CA LYS A 116 7.352 1.577 4.495 1.00 0.00 C ATOM 1752 C LYS A 116 6.363 0.420 4.652 1.00 0.00 C ATOM 1753 O LYS A 116 5.740 -0.007 3.702 1.00 0.00 O ATOM 1754 CB LYS A 116 6.586 2.883 4.277 1.00 0.00 C ATOM 1755 CG LYS A 116 7.574 4.051 4.228 1.00 0.00 C ATOM 1756 CD LYS A 116 6.802 5.369 4.141 1.00 0.00 C ATOM 1757 CE LYS A 116 7.790 6.535 4.075 1.00 0.00 C ATOM 1758 NZ LYS A 116 7.482 7.381 2.887 1.00 0.00 N ATOM 0 H LYS A 116 7.765 1.375 2.411 1.00 0.00 H new ATOM 0 HA LYS A 116 7.960 1.665 5.395 1.00 0.00 H new ATOM 0 HB2 LYS A 116 6.018 2.834 3.348 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.867 3.034 5.082 1.00 0.00 H new ATOM 0 HG2 LYS A 116 8.205 4.045 5.117 1.00 0.00 H new ATOM 0 HG3 LYS A 116 8.235 3.947 3.367 1.00 0.00 H new ATOM 0 HD2 LYS A 116 6.162 5.370 3.259 1.00 0.00 H new ATOM 0 HD3 LYS A 116 6.150 5.479 5.008 1.00 0.00 H new ATOM 0 HE2 LYS A 116 7.727 7.131 4.985 1.00 0.00 H new ATOM 0 HE3 LYS A 116 8.811 6.158 4.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 8.154 8.174 2.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.564 6.809 2.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.514 7.752 2.967 1.00 0.00 H new ATOM 1772 N THR A 117 6.219 -0.099 5.841 1.00 0.00 N ATOM 1773 CA THR A 117 5.276 -1.234 6.043 1.00 0.00 C ATOM 1774 C THR A 117 4.302 -0.915 7.180 1.00 0.00 C ATOM 1775 O THR A 117 4.699 -0.546 8.268 1.00 0.00 O ATOM 1776 CB THR A 117 6.067 -2.496 6.393 1.00 0.00 C ATOM 1777 OG1 THR A 117 7.012 -2.761 5.365 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.109 -3.680 6.527 1.00 0.00 C ATOM 0 H THR A 117 6.712 0.213 6.678 1.00 0.00 H new ATOM 0 HA THR A 117 4.711 -1.394 5.124 1.00 0.00 H new ATOM 0 HB THR A 117 6.590 -2.347 7.338 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.521 -3.568 5.589 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.674 -4.578 6.776 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.386 -3.475 7.316 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.584 -3.832 5.584 1.00 0.00 H new ATOM 1786 N THR A 118 3.029 -1.066 6.934 1.00 0.00 N ATOM 1787 CA THR A 118 2.019 -0.788 7.996 1.00 0.00 C ATOM 1788 C THR A 118 1.200 -2.057 8.237 1.00 0.00 C ATOM 1789 O THR A 118 0.907 -2.797 7.319 1.00 0.00 O ATOM 1790 CB THR A 118 1.092 0.340 7.537 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.872 1.438 7.085 1.00 0.00 O ATOM 1792 CG2 THR A 118 0.210 0.785 8.704 1.00 0.00 C ATOM 0 H THR A 118 2.643 -1.371 6.040 1.00 0.00 H new ATOM 0 HA THR A 118 2.519 -0.487 8.917 1.00 0.00 H new ATOM 0 HB THR A 118 0.461 -0.017 6.723 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.280 2.160 6.789 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.450 1.588 8.376 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.389 -0.058 9.050 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.839 1.142 9.520 1.00 0.00 H new ATOM 1800 N SER A 119 0.833 -2.329 9.461 1.00 0.00 N ATOM 1801 CA SER A 119 0.044 -3.564 9.730 1.00 0.00 C ATOM 1802 C SER A 119 -0.970 -3.316 10.849 1.00 0.00 C ATOM 1803 O SER A 119 -0.731 -2.558 11.768 1.00 0.00 O ATOM 1804 CB SER A 119 0.993 -4.688 10.149 1.00 0.00 C ATOM 1805 OG SER A 119 1.566 -4.380 11.410 1.00 0.00 O ATOM 0 H SER A 119 1.043 -1.756 10.278 1.00 0.00 H new ATOM 0 HA SER A 119 -0.492 -3.845 8.823 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.452 -5.633 10.205 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.777 -4.813 9.402 1.00 0.00 H new ATOM 0 HG SER A 119 1.058 -4.828 12.118 1.00 0.00 H new ATOM 1811 N LYS A 120 -2.102 -3.965 10.778 1.00 0.00 N ATOM 1812 CA LYS A 120 -3.140 -3.792 11.834 1.00 0.00 C ATOM 1813 C LYS A 120 -3.449 -5.158 12.451 1.00 0.00 C ATOM 1814 O LYS A 120 -3.442 -6.167 11.776 1.00 0.00 O ATOM 1815 CB LYS A 120 -4.412 -3.212 11.212 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.090 -1.878 10.536 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.364 -1.295 9.923 1.00 0.00 C ATOM 1818 CE LYS A 120 -5.038 0.028 9.229 1.00 0.00 C ATOM 1819 NZ LYS A 120 -4.465 -0.247 7.880 1.00 0.00 N ATOM 0 H LYS A 120 -2.353 -4.611 10.029 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.776 -3.111 12.603 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -4.824 -3.910 10.483 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -5.172 -3.068 11.980 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -3.672 -1.182 11.263 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -3.335 -2.023 9.763 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.790 -1.998 9.207 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.113 -1.136 10.698 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -5.939 0.634 9.137 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -4.329 0.600 9.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -4.243 0.652 7.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -3.596 -0.809 7.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -5.156 -0.776 7.311 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.710 -5.204 13.729 1.00 0.00 N ATOM 1834 CA TYR A 121 -4.005 -6.514 14.376 1.00 0.00 C ATOM 1835 C TYR A 121 -5.468 -6.562 14.821 1.00 0.00 C ATOM 1836 O TYR A 121 -5.929 -5.719 15.565 1.00 0.00 O ATOM 1837 CB TYR A 121 -3.099 -6.694 15.595 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.658 -6.742 15.147 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -1.078 -7.965 14.793 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.903 -5.565 15.087 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.259 -8.011 14.376 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.433 -5.610 14.670 1.00 0.00 C ATOM 1843 CZ TYR A 121 1.013 -6.834 14.315 1.00 0.00 C ATOM 1844 OH TYR A 121 2.330 -6.879 13.904 1.00 0.00 O ATOM 0 H TYR A 121 -3.732 -4.395 14.350 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.823 -7.314 13.659 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.246 -5.872 16.296 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -3.358 -7.612 16.122 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.660 -8.873 14.841 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.351 -4.622 15.362 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.707 -8.955 14.102 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.015 -4.702 14.622 1.00 0.00 H new ATOM 0 HH TYR A 121 2.708 -5.975 13.918 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.199 -7.548 14.379 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.629 -7.657 14.786 1.00 0.00 C ATOM 1856 C HIS A 122 -7.753 -8.686 15.911 1.00 0.00 C ATOM 1857 O HIS A 122 -7.261 -9.793 15.808 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.469 -8.104 13.587 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.458 -7.027 12.538 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -9.279 -5.949 12.321 1.00 0.00 N flip ATOM 1861 CD2 HIS A 122 -7.501 -6.981 11.537 1.00 0.00 C flip ATOM 1862 CE1 HIS A 122 -8.841 -5.244 11.203 1.00 0.00 C flip ATOM 1863 NE2 HIS A 122 -7.767 -5.909 10.769 1.00 0.00 N flip ATOM 0 H HIS A 122 -5.868 -8.283 13.754 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.987 -6.688 15.135 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.070 -9.031 13.176 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.492 -8.309 13.902 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -10.087 -5.702 12.892 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -6.689 -7.679 11.398 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -9.276 -4.351 10.778 1.00 0.00 H new ATOM 1871 N THR A 123 -8.401 -8.332 16.987 1.00 0.00 N ATOM 1872 CA THR A 123 -8.546 -9.294 18.117 1.00 0.00 C ATOM 1873 C THR A 123 -10.029 -9.505 18.427 1.00 0.00 C ATOM 1874 O THR A 123 -10.870 -8.709 18.063 1.00 0.00 O ATOM 1875 CB THR A 123 -7.842 -8.736 19.355 1.00 0.00 C ATOM 1876 OG1 THR A 123 -8.550 -7.600 19.828 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.411 -8.335 18.994 1.00 0.00 C ATOM 0 H THR A 123 -8.835 -7.421 17.133 1.00 0.00 H new ATOM 0 HA THR A 123 -8.096 -10.247 17.839 1.00 0.00 H new ATOM 0 HB THR A 123 -7.817 -9.498 20.134 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.101 -7.242 20.622 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.911 -7.938 19.877 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.869 -9.208 18.632 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.432 -7.573 18.215 1.00 0.00 H new ATOM 2169 N ALA A 142 11.769 -6.003 9.352 1.00 0.00 N ATOM 2170 CA ALA A 142 12.915 -5.135 8.958 1.00 0.00 C ATOM 2171 C ALA A 142 14.149 -6.004 8.705 1.00 0.00 C ATOM 2172 O ALA A 142 14.900 -5.776 7.777 1.00 0.00 O ATOM 2173 CB ALA A 142 13.212 -4.141 10.082 1.00 0.00 C ATOM 0 HA ALA A 142 12.662 -4.589 8.049 1.00 0.00 H new ATOM 0 HB1 ALA A 142 14.050 -3.506 9.794 1.00 0.00 H new ATOM 0 HB2 ALA A 142 12.333 -3.522 10.262 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.465 -4.685 10.992 1.00 0.00 H new ATOM 2179 N HIS A 143 14.363 -6.998 9.521 1.00 0.00 N ATOM 2180 CA HIS A 143 15.549 -7.880 9.327 1.00 0.00 C ATOM 2181 C HIS A 143 15.404 -8.641 8.008 1.00 0.00 C ATOM 2182 O HIS A 143 16.361 -8.839 7.286 1.00 0.00 O ATOM 2183 CB HIS A 143 15.638 -8.875 10.484 1.00 0.00 C ATOM 2184 CG HIS A 143 16.882 -9.707 10.337 1.00 0.00 C ATOM 2185 ND1 HIS A 143 18.152 -9.163 10.448 1.00 0.00 N ATOM 2186 CD2 HIS A 143 17.068 -11.044 10.086 1.00 0.00 C ATOM 2187 CE1 HIS A 143 19.038 -10.159 10.266 1.00 0.00 C ATOM 2188 NE2 HIS A 143 18.430 -11.327 10.043 1.00 0.00 N ATOM 0 H HIS A 143 13.768 -7.238 10.314 1.00 0.00 H new ATOM 0 HA HIS A 143 16.455 -7.274 9.300 1.00 0.00 H new ATOM 0 HB2 HIS A 143 15.654 -8.342 11.435 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.757 -9.517 10.494 1.00 0.00 H new ATOM 0 HD2 HIS A 143 16.278 -11.766 9.944 1.00 0.00 H new ATOM 0 HE1 HIS A 143 20.110 -10.030 10.297 1.00 0.00 H new ATOM 0 HE2 HIS A 143 18.870 -12.232 9.877 1.00 0.00 H new ATOM 2196 N LEU A 144 14.214 -9.070 7.687 1.00 0.00 N ATOM 2197 CA LEU A 144 14.008 -9.818 6.415 1.00 0.00 C ATOM 2198 C LEU A 144 14.473 -8.959 5.238 1.00 0.00 C ATOM 2199 O LEU A 144 15.179 -9.419 4.362 1.00 0.00 O ATOM 2200 CB LEU A 144 12.523 -10.147 6.252 1.00 0.00 C ATOM 2201 CG LEU A 144 12.329 -11.031 5.018 1.00 0.00 C ATOM 2202 CD1 LEU A 144 11.989 -12.455 5.458 1.00 0.00 C ATOM 2203 CD2 LEU A 144 11.186 -10.473 4.167 1.00 0.00 C ATOM 0 H LEU A 144 13.375 -8.935 8.251 1.00 0.00 H new ATOM 0 HA LEU A 144 14.584 -10.743 6.439 1.00 0.00 H new ATOM 0 HB2 LEU A 144 12.153 -10.658 7.141 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.945 -9.229 6.149 1.00 0.00 H new ATOM 0 HG LEU A 144 13.248 -11.043 4.431 1.00 0.00 H new ATOM 0 HD11 LEU A 144 11.851 -13.084 4.579 1.00 0.00 H new ATOM 0 HD12 LEU A 144 12.803 -12.852 6.065 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.071 -12.445 6.045 1.00 0.00 H new ATOM 0 HD21 LEU A 144 11.047 -11.102 3.288 1.00 0.00 H new ATOM 0 HD22 LEU A 144 10.268 -10.461 4.754 1.00 0.00 H new ATOM 0 HD23 LEU A 144 11.429 -9.458 3.853 1.00 0.00 H new ATOM 2215 N PHE A 145 14.085 -7.714 5.209 1.00 0.00 N ATOM 2216 CA PHE A 145 14.505 -6.827 4.087 1.00 0.00 C ATOM 2217 C PHE A 145 16.029 -6.859 3.956 1.00 0.00 C ATOM 2218 O PHE A 145 16.570 -6.848 2.868 1.00 0.00 O ATOM 2219 CB PHE A 145 14.047 -5.395 4.368 1.00 0.00 C ATOM 2220 CG PHE A 145 12.545 -5.314 4.252 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.941 -5.261 2.990 1.00 0.00 C ATOM 2222 CD2 PHE A 145 11.753 -5.291 5.407 1.00 0.00 C ATOM 2223 CE1 PHE A 145 10.547 -5.185 2.882 1.00 0.00 C ATOM 2224 CE2 PHE A 145 10.359 -5.215 5.299 1.00 0.00 C ATOM 2225 CZ PHE A 145 9.756 -5.162 4.037 1.00 0.00 C ATOM 0 H PHE A 145 13.495 -7.272 5.914 1.00 0.00 H new ATOM 0 HA PHE A 145 14.052 -7.176 3.159 1.00 0.00 H new ATOM 0 HB2 PHE A 145 14.362 -5.091 5.366 1.00 0.00 H new ATOM 0 HB3 PHE A 145 14.514 -4.708 3.663 1.00 0.00 H new ATOM 0 HD1 PHE A 145 12.551 -5.279 2.099 1.00 0.00 H new ATOM 0 HD2 PHE A 145 12.218 -5.332 6.381 1.00 0.00 H new ATOM 0 HE1 PHE A 145 10.082 -5.144 1.908 1.00 0.00 H new ATOM 0 HE2 PHE A 145 9.749 -5.197 6.190 1.00 0.00 H new ATOM 0 HZ PHE A 145 8.681 -5.103 3.954 1.00 0.00 H new ATOM 2235 N LYS A 146 16.728 -6.897 5.057 1.00 0.00 N ATOM 2236 CA LYS A 146 18.217 -6.928 4.996 1.00 0.00 C ATOM 2237 C LYS A 146 18.669 -8.124 4.156 1.00 0.00 C ATOM 2238 O LYS A 146 19.562 -8.019 3.339 1.00 0.00 O ATOM 2239 CB LYS A 146 18.783 -7.057 6.411 1.00 0.00 C ATOM 2240 CG LYS A 146 20.307 -6.930 6.364 1.00 0.00 C ATOM 2241 CD LYS A 146 20.876 -7.087 7.775 1.00 0.00 C ATOM 2242 CE LYS A 146 22.384 -6.831 7.748 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.638 -5.366 7.637 1.00 0.00 N ATOM 0 H LYS A 146 16.332 -6.908 5.997 1.00 0.00 H new ATOM 0 HA LYS A 146 18.580 -6.006 4.541 1.00 0.00 H new ATOM 0 HB2 LYS A 146 18.363 -6.284 7.054 1.00 0.00 H new ATOM 0 HB3 LYS A 146 18.501 -8.018 6.841 1.00 0.00 H new ATOM 0 HG2 LYS A 146 20.726 -7.691 5.705 1.00 0.00 H new ATOM 0 HG3 LYS A 146 20.589 -5.961 5.952 1.00 0.00 H new ATOM 0 HD2 LYS A 146 20.390 -6.387 8.455 1.00 0.00 H new ATOM 0 HD3 LYS A 146 20.673 -8.090 8.151 1.00 0.00 H new ATOM 0 HE2 LYS A 146 22.846 -7.223 8.654 1.00 0.00 H new ATOM 0 HE3 LYS A 146 22.837 -7.354 6.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.636 -5.169 7.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 22.426 -5.049 6.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.030 -4.856 8.309 1.00 0.00 H new ATOM 2257 N LEU A 147 18.062 -9.262 4.352 1.00 0.00 N ATOM 2258 CA LEU A 147 18.458 -10.465 3.567 1.00 0.00 C ATOM 2259 C LEU A 147 18.113 -10.250 2.092 1.00 0.00 C ATOM 2260 O LEU A 147 18.882 -10.578 1.210 1.00 0.00 O ATOM 2261 CB LEU A 147 17.707 -11.688 4.095 1.00 0.00 C ATOM 2262 CG LEU A 147 18.305 -12.115 5.437 1.00 0.00 C ATOM 2263 CD1 LEU A 147 19.816 -12.304 5.285 1.00 0.00 C ATOM 2264 CD2 LEU A 147 18.030 -11.034 6.484 1.00 0.00 C ATOM 0 H LEU A 147 17.308 -9.411 5.023 1.00 0.00 H new ATOM 0 HA LEU A 147 19.531 -10.627 3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.649 -11.455 4.214 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.774 -12.506 3.378 1.00 0.00 H new ATOM 0 HG LEU A 147 17.851 -13.054 5.755 1.00 0.00 H new ATOM 0 HD11 LEU A 147 20.243 -12.608 6.241 1.00 0.00 H new ATOM 0 HD12 LEU A 147 20.013 -13.073 4.538 1.00 0.00 H new ATOM 0 HD13 LEU A 147 20.270 -11.365 4.967 1.00 0.00 H new ATOM 0 HD21 LEU A 147 18.456 -11.337 7.441 1.00 0.00 H new ATOM 0 HD22 LEU A 147 18.484 -10.096 6.166 1.00 0.00 H new ATOM 0 HD23 LEU A 147 16.954 -10.898 6.593 1.00 0.00 H new ATOM 2276 N ILE A 148 16.962 -9.702 1.815 1.00 0.00 N ATOM 2277 CA ILE A 148 16.570 -9.467 0.396 1.00 0.00 C ATOM 2278 C ILE A 148 17.577 -8.521 -0.260 1.00 0.00 C ATOM 2279 O ILE A 148 17.934 -8.678 -1.411 1.00 0.00 O ATOM 2280 CB ILE A 148 15.174 -8.842 0.348 1.00 0.00 C ATOM 2281 CG1 ILE A 148 14.168 -9.787 1.005 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.775 -8.601 -1.109 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.808 -9.092 1.108 1.00 0.00 C ATOM 0 H ILE A 148 16.276 -9.407 2.510 1.00 0.00 H new ATOM 0 HA ILE A 148 16.560 -10.416 -0.141 1.00 0.00 H new ATOM 0 HB ILE A 148 15.181 -7.893 0.884 1.00 0.00 H new ATOM 0 HG12 ILE A 148 14.077 -10.703 0.420 1.00 0.00 H new ATOM 0 HG13 ILE A 148 14.517 -10.075 1.996 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.781 -8.156 -1.145 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.492 -7.926 -1.576 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.767 -9.550 -1.646 1.00 0.00 H new ATOM 0 HD11 ILE A 148 12.090 -9.765 1.576 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.906 -8.189 1.711 1.00 0.00 H new ATOM 0 HD13 ILE A 148 12.459 -8.826 0.110 1.00 0.00 H new ATOM 2295 N GLU A 149 18.037 -7.537 0.463 1.00 0.00 N ATOM 2296 CA GLU A 149 19.019 -6.580 -0.118 1.00 0.00 C ATOM 2297 C GLU A 149 20.319 -7.317 -0.448 1.00 0.00 C ATOM 2298 O GLU A 149 20.968 -7.040 -1.437 1.00 0.00 O ATOM 2299 CB GLU A 149 19.305 -5.469 0.893 1.00 0.00 C ATOM 2300 CG GLU A 149 20.147 -4.378 0.228 1.00 0.00 C ATOM 2301 CD GLU A 149 20.688 -3.428 1.298 1.00 0.00 C ATOM 2302 OE1 GLU A 149 20.264 -3.548 2.437 1.00 0.00 O ATOM 2303 OE2 GLU A 149 21.514 -2.597 0.962 1.00 0.00 O ATOM 0 H GLU A 149 17.775 -7.355 1.432 1.00 0.00 H new ATOM 0 HA GLU A 149 18.608 -6.146 -1.029 1.00 0.00 H new ATOM 0 HB2 GLU A 149 18.369 -5.048 1.261 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.833 -5.875 1.756 1.00 0.00 H new ATOM 0 HG2 GLU A 149 20.972 -4.827 -0.325 1.00 0.00 H new ATOM 0 HG3 GLU A 149 19.543 -3.826 -0.492 1.00 0.00 H new ATOM 2310 N GLY A 150 20.707 -8.252 0.376 1.00 0.00 N ATOM 2311 CA GLY A 150 21.965 -9.004 0.111 1.00 0.00 C ATOM 2312 C GLY A 150 21.732 -10.010 -1.018 1.00 0.00 C ATOM 2313 O GLY A 150 22.564 -10.188 -1.886 1.00 0.00 O ATOM 0 H GLY A 150 20.207 -8.527 1.221 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.763 -8.314 -0.162 1.00 0.00 H new ATOM 0 HA3 GLY A 150 22.288 -9.523 1.014 1.00 0.00 H new ATOM 2317 N TYR A 151 20.608 -10.673 -1.012 1.00 0.00 N ATOM 2318 CA TYR A 151 20.323 -11.668 -2.084 1.00 0.00 C ATOM 2319 C TYR A 151 20.203 -10.951 -3.431 1.00 0.00 C ATOM 2320 O TYR A 151 20.708 -11.410 -4.436 1.00 0.00 O ATOM 2321 CB TYR A 151 19.011 -12.390 -1.771 1.00 0.00 C ATOM 2322 CG TYR A 151 19.193 -13.254 -0.546 1.00 0.00 C ATOM 2323 CD1 TYR A 151 20.343 -14.040 -0.409 1.00 0.00 C ATOM 2324 CD2 TYR A 151 18.213 -13.268 0.454 1.00 0.00 C ATOM 2325 CE1 TYR A 151 20.514 -14.840 0.727 1.00 0.00 C ATOM 2326 CE2 TYR A 151 18.383 -14.068 1.589 1.00 0.00 C ATOM 2327 CZ TYR A 151 19.533 -14.854 1.726 1.00 0.00 C ATOM 2328 OH TYR A 151 19.701 -15.644 2.846 1.00 0.00 O ATOM 0 H TYR A 151 19.875 -10.569 -0.311 1.00 0.00 H new ATOM 0 HA TYR A 151 21.136 -12.393 -2.132 1.00 0.00 H new ATOM 0 HB2 TYR A 151 18.215 -11.664 -1.603 1.00 0.00 H new ATOM 0 HB3 TYR A 151 18.709 -13.003 -2.620 1.00 0.00 H new ATOM 0 HD1 TYR A 151 21.099 -14.029 -1.180 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.326 -12.661 0.349 1.00 0.00 H new ATOM 0 HE1 TYR A 151 21.402 -15.446 0.833 1.00 0.00 H new ATOM 0 HE2 TYR A 151 17.627 -14.079 2.360 1.00 0.00 H new ATOM 0 HH TYR A 151 18.930 -15.537 3.441 1.00 0.00 H new ATOM 2338 N LEU A 152 19.537 -9.829 -3.459 1.00 0.00 N ATOM 2339 CA LEU A 152 19.386 -9.086 -4.742 1.00 0.00 C ATOM 2340 C LEU A 152 20.748 -8.547 -5.183 1.00 0.00 C ATOM 2341 O LEU A 152 21.027 -8.428 -6.359 1.00 0.00 O ATOM 2342 CB LEU A 152 18.416 -7.919 -4.544 1.00 0.00 C ATOM 2343 CG LEU A 152 17.021 -8.464 -4.229 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.029 -7.303 -4.141 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.586 -9.423 -5.339 1.00 0.00 C ATOM 0 H LEU A 152 19.092 -9.395 -2.650 1.00 0.00 H new ATOM 0 HA LEU A 152 18.996 -9.758 -5.507 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.760 -7.280 -3.731 1.00 0.00 H new ATOM 0 HB3 LEU A 152 18.383 -7.303 -5.442 1.00 0.00 H new ATOM 0 HG LEU A 152 17.044 -8.996 -3.278 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.035 -7.690 -3.917 1.00 0.00 H new ATOM 0 HD12 LEU A 152 16.339 -6.619 -3.351 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.005 -6.772 -5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.592 -9.812 -5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 152 16.562 -8.892 -6.290 1.00 0.00 H new ATOM 0 HD23 LEU A 152 17.293 -10.250 -5.403 1.00 0.00 H new