USER MOD reduce.3.24.130724 H: found=0, std=0, add=1099, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1093 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 51 SER OG : rot -130:sc= -0.022 USER MOD Set 1.2: A 88 MET CE :methyl 174:sc= -1.14 (180deg=-1.14) USER MOD Single : A 1 GLY N :NH3+ -141:sc= 0.0773 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.2 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 86:sc= 0.0649 USER MOD Single : A 15 MET CE :methyl -161:sc= -3.73 (180deg=-6.33) USER MOD Single : A 20 THR OG1 : rot -78:sc= 0.32 USER MOD Single : A 21 SER OG : rot 22:sc= 0.0781 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0543) USER MOD Single : A 36 CYS SG : rot -39:sc= 0.992 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 94:sc= 0.159 USER MOD Single : A 43 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 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 60 ASN : amide:sc= 0.171 K(o=0.17,f=-6.4!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 150:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 158:sc= 1.75 (180deg=0.82) USER MOD Single : A 67 GLN : amide:sc= -1.61 K(o=-1.6,f=-3) USER MOD Single : A 68 LYS NZ :NH3+ 141:sc= 2.32 (180deg=0.0285) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 30:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -151:sc= -0.188 (180deg=-0.768) USER MOD Single : A 80 SER OG : rot -110:sc= 0.0592 USER MOD Single : A 82 SER OG : rot 180:sc= 0.664 USER MOD Single : A 89 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 92 SER OG : rot 171:sc= 0.301 USER MOD Single : A 97 ASN : amide:sc= -0.128 K(o=-0.13,f=-1.2) USER MOD Single : A 100 HIS : no HD1:sc= -0.0954 X(o=-0.095,f=-0.084) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.521 K(o=-0.52,f=-0.00088) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc= -1.59 X(o=-1.6,f=-1.5) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 126:sc= 1.29 USER MOD Single : A 122 HIS : no HD1:sc= -0.618 X(o=-0.62,f=-0.52) USER MOD Single : A 124 THR OG1 : rot -83:sc= 0.28 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.0132 X(o=-0.013,f=-0.14) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.504 30.472 -7.984 1.00 0.00 N ATOM 2 CA GLY A 1 18.420 29.112 -8.528 1.00 0.00 C ATOM 3 C GLY A 1 17.642 28.239 -7.563 1.00 0.00 C ATOM 4 O GLY A 1 16.749 28.742 -6.877 1.00 0.00 O ATOM 0 H1 GLY A 1 18.398 31.162 -8.755 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.746 30.614 -7.286 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.427 30.606 -7.525 1.00 0.00 H new ATOM 0 HA2 GLY A 1 17.930 29.126 -9.501 1.00 0.00 H new ATOM 0 HA3 GLY A 1 19.420 28.706 -8.680 1.00 0.00 H new ATOM 8 N SER A 2 17.955 26.946 -7.480 1.00 0.00 N ATOM 9 CA SER A 2 17.465 26.132 -6.378 1.00 0.00 C ATOM 10 C SER A 2 18.454 25.027 -6.004 1.00 0.00 C ATOM 11 O SER A 2 19.544 24.909 -6.577 1.00 0.00 O ATOM 12 CB SER A 2 16.055 25.613 -6.680 1.00 0.00 C ATOM 13 OG SER A 2 15.442 25.302 -5.447 1.00 0.00 O ATOM 0 H SER A 2 18.537 26.449 -8.154 1.00 0.00 H new ATOM 0 HA SER A 2 17.386 26.759 -5.490 1.00 0.00 H new ATOM 0 HB2 SER A 2 15.477 26.365 -7.216 1.00 0.00 H new ATOM 0 HB3 SER A 2 16.100 24.731 -7.319 1.00 0.00 H new ATOM 0 HG SER A 2 14.535 24.968 -5.608 1.00 0.00 H new ATOM 19 N SER A 3 18.086 24.279 -4.969 1.00 0.00 N ATOM 20 CA SER A 3 18.834 23.251 -4.275 1.00 0.00 C ATOM 21 C SER A 3 17.801 22.312 -3.621 1.00 0.00 C ATOM 22 O SER A 3 16.590 22.537 -3.714 1.00 0.00 O ATOM 23 CB SER A 3 19.747 23.983 -3.278 1.00 0.00 C ATOM 24 OG SER A 3 20.666 23.160 -2.575 1.00 0.00 O ATOM 0 H SER A 3 17.160 24.395 -4.558 1.00 0.00 H new ATOM 0 HA SER A 3 19.469 22.633 -4.911 1.00 0.00 H new ATOM 0 HB2 SER A 3 20.308 24.746 -3.818 1.00 0.00 H new ATOM 0 HB3 SER A 3 19.121 24.502 -2.552 1.00 0.00 H new ATOM 0 HG SER A 3 21.202 23.712 -1.968 1.00 0.00 H new ATOM 30 N GLY A 4 18.254 21.245 -2.968 1.00 0.00 N ATOM 31 CA GLY A 4 17.394 20.258 -2.329 1.00 0.00 C ATOM 32 C GLY A 4 18.218 19.370 -1.405 1.00 0.00 C ATOM 33 O GLY A 4 19.450 19.462 -1.425 1.00 0.00 O ATOM 0 H GLY A 4 19.248 21.040 -2.867 1.00 0.00 H new ATOM 0 HA2 GLY A 4 16.610 20.759 -1.761 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.900 19.650 -3.086 1.00 0.00 H new ATOM 37 N SER A 5 17.562 18.480 -0.659 1.00 0.00 N ATOM 38 CA SER A 5 18.180 17.362 0.053 1.00 0.00 C ATOM 39 C SER A 5 17.605 16.063 -0.526 1.00 0.00 C ATOM 40 O SER A 5 16.584 16.093 -1.221 1.00 0.00 O ATOM 41 CB SER A 5 17.960 17.528 1.569 1.00 0.00 C ATOM 42 OG SER A 5 18.722 16.620 2.351 1.00 0.00 O ATOM 0 H SER A 5 16.551 18.520 -0.530 1.00 0.00 H new ATOM 0 HA SER A 5 19.261 17.333 -0.084 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.216 18.548 1.857 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.902 17.390 1.793 1.00 0.00 H new ATOM 0 HG SER A 5 18.541 16.775 3.302 1.00 0.00 H new ATOM 48 N SER A 6 18.269 14.929 -0.295 1.00 0.00 N ATOM 49 CA SER A 6 17.999 13.666 -0.997 1.00 0.00 C ATOM 50 C SER A 6 17.601 12.525 -0.049 1.00 0.00 C ATOM 51 O SER A 6 17.466 11.380 -0.480 1.00 0.00 O ATOM 52 CB SER A 6 19.193 13.300 -1.895 1.00 0.00 C ATOM 53 OG SER A 6 19.470 14.371 -2.781 1.00 0.00 O ATOM 0 H SER A 6 19.019 14.858 0.393 1.00 0.00 H new ATOM 0 HA SER A 6 17.127 13.817 -1.633 1.00 0.00 H new ATOM 0 HB2 SER A 6 20.069 13.086 -1.283 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.971 12.395 -2.461 1.00 0.00 H new ATOM 0 HG SER A 6 20.232 14.136 -3.351 1.00 0.00 H new ATOM 59 N GLY A 7 17.408 12.813 1.238 1.00 0.00 N ATOM 60 CA GLY A 7 16.803 11.918 2.212 1.00 0.00 C ATOM 61 C GLY A 7 15.801 12.719 3.037 1.00 0.00 C ATOM 62 O GLY A 7 15.748 13.940 2.903 1.00 0.00 O ATOM 0 H GLY A 7 17.680 13.710 1.641 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.305 11.089 1.709 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.568 11.486 2.857 1.00 0.00 H new ATOM 66 N GLU A 8 14.994 12.041 3.855 1.00 0.00 N ATOM 67 CA GLU A 8 13.929 12.583 4.708 1.00 0.00 C ATOM 68 C GLU A 8 13.072 13.690 4.063 1.00 0.00 C ATOM 69 O GLU A 8 12.612 14.609 4.744 1.00 0.00 O ATOM 70 CB GLU A 8 14.454 12.867 6.130 1.00 0.00 C ATOM 71 CG GLU A 8 15.380 14.087 6.261 1.00 0.00 C ATOM 72 CD GLU A 8 16.410 13.962 7.385 1.00 0.00 C ATOM 73 OE1 GLU A 8 17.036 12.889 7.533 1.00 0.00 O ATOM 74 OE2 GLU A 8 16.753 15.000 7.993 1.00 0.00 O ATOM 0 H GLU A 8 15.071 11.028 3.947 1.00 0.00 H new ATOM 0 HA GLU A 8 13.180 11.799 4.822 1.00 0.00 H new ATOM 0 HB2 GLU A 8 13.600 13.008 6.793 1.00 0.00 H new ATOM 0 HB3 GLU A 8 14.990 11.986 6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 8 15.903 14.238 5.317 1.00 0.00 H new ATOM 0 HG3 GLU A 8 14.773 14.975 6.434 1.00 0.00 H new ATOM 81 N SER A 9 12.827 13.607 2.751 1.00 0.00 N ATOM 82 CA SER A 9 11.975 14.537 2.020 1.00 0.00 C ATOM 83 C SER A 9 10.521 14.424 2.478 1.00 0.00 C ATOM 84 O SER A 9 9.966 13.328 2.484 1.00 0.00 O ATOM 85 CB SER A 9 12.027 14.211 0.523 1.00 0.00 C ATOM 86 OG SER A 9 13.254 14.593 -0.073 1.00 0.00 O ATOM 0 H SER A 9 13.225 12.876 2.161 1.00 0.00 H new ATOM 0 HA SER A 9 12.338 15.547 2.212 1.00 0.00 H new ATOM 0 HB2 SER A 9 11.876 13.141 0.382 1.00 0.00 H new ATOM 0 HB3 SER A 9 11.207 14.718 0.015 1.00 0.00 H new ATOM 0 HG SER A 9 13.240 14.364 -1.026 1.00 0.00 H new ATOM 92 N TYR A 10 9.862 15.558 2.714 1.00 0.00 N ATOM 93 CA TYR A 10 8.408 15.617 2.819 1.00 0.00 C ATOM 94 C TYR A 10 7.758 15.154 1.510 1.00 0.00 C ATOM 95 O TYR A 10 6.770 14.417 1.525 1.00 0.00 O ATOM 96 CB TYR A 10 7.995 17.050 3.168 1.00 0.00 C ATOM 97 CG TYR A 10 6.506 17.304 3.068 1.00 0.00 C ATOM 98 CD1 TYR A 10 5.654 16.965 4.133 1.00 0.00 C ATOM 99 CD2 TYR A 10 5.973 17.852 1.887 1.00 0.00 C ATOM 100 CE1 TYR A 10 4.270 17.191 4.031 1.00 0.00 C ATOM 101 CE2 TYR A 10 4.592 18.064 1.772 1.00 0.00 C ATOM 102 CZ TYR A 10 3.735 17.744 2.848 1.00 0.00 C ATOM 103 OH TYR A 10 2.389 17.914 2.722 1.00 0.00 O ATOM 0 H TYR A 10 10.322 16.460 2.837 1.00 0.00 H new ATOM 0 HA TYR A 10 8.066 14.947 3.608 1.00 0.00 H new ATOM 0 HB2 TYR A 10 8.324 17.275 4.182 1.00 0.00 H new ATOM 0 HB3 TYR A 10 8.516 17.739 2.504 1.00 0.00 H new ATOM 0 HD1 TYR A 10 6.064 16.530 5.032 1.00 0.00 H new ATOM 0 HD2 TYR A 10 6.628 18.110 1.068 1.00 0.00 H new ATOM 0 HE1 TYR A 10 3.618 16.942 4.856 1.00 0.00 H new ATOM 0 HE2 TYR A 10 4.183 18.472 0.860 1.00 0.00 H new ATOM 0 HH TYR A 10 2.189 18.307 1.847 1.00 0.00 H new ATOM 113 N TRP A 11 8.334 15.525 0.357 1.00 0.00 N ATOM 114 CA TRP A 11 7.771 15.180 -0.945 1.00 0.00 C ATOM 115 C TRP A 11 7.629 13.668 -1.168 1.00 0.00 C ATOM 116 O TRP A 11 6.778 13.237 -1.940 1.00 0.00 O ATOM 117 CB TRP A 11 8.549 15.853 -2.072 1.00 0.00 C ATOM 118 CG TRP A 11 7.662 16.183 -3.228 1.00 0.00 C ATOM 119 CD1 TRP A 11 6.934 17.309 -3.360 1.00 0.00 C ATOM 120 CD2 TRP A 11 7.314 15.353 -4.367 1.00 0.00 C ATOM 121 NE1 TRP A 11 6.173 17.236 -4.509 1.00 0.00 N ATOM 122 CE2 TRP A 11 6.345 16.033 -5.155 1.00 0.00 C ATOM 123 CE3 TRP A 11 7.716 14.079 -4.794 1.00 0.00 C ATOM 124 CZ2 TRP A 11 5.804 15.469 -6.321 1.00 0.00 C ATOM 125 CZ3 TRP A 11 7.223 13.525 -5.989 1.00 0.00 C ATOM 126 CH2 TRP A 11 6.262 14.214 -6.750 1.00 0.00 C ATOM 0 H TRP A 11 9.196 16.068 0.306 1.00 0.00 H new ATOM 0 HA TRP A 11 6.753 15.570 -0.955 1.00 0.00 H new ATOM 0 HB2 TRP A 11 9.017 16.764 -1.699 1.00 0.00 H new ATOM 0 HB3 TRP A 11 9.352 15.195 -2.404 1.00 0.00 H new ATOM 0 HD1 TRP A 11 6.944 18.141 -2.672 1.00 0.00 H new ATOM 0 HE1 TRP A 11 5.559 17.981 -4.839 1.00 0.00 H new ATOM 0 HE3 TRP A 11 8.415 13.514 -4.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 5.045 15.995 -6.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 7.585 12.564 -6.324 1.00 0.00 H new ATOM 0 HH2 TRP A 11 5.878 13.779 -7.661 1.00 0.00 H new ATOM 137 N ARG A 12 8.390 12.843 -0.446 1.00 0.00 N ATOM 138 CA ARG A 12 8.249 11.391 -0.454 1.00 0.00 C ATOM 139 C ARG A 12 6.808 10.972 -0.140 1.00 0.00 C ATOM 140 O ARG A 12 6.309 10.019 -0.737 1.00 0.00 O ATOM 141 CB ARG A 12 9.220 10.833 0.592 1.00 0.00 C ATOM 142 CG ARG A 12 9.671 9.389 0.345 1.00 0.00 C ATOM 143 CD ARG A 12 10.801 9.322 -0.691 1.00 0.00 C ATOM 144 NE ARG A 12 12.037 9.948 -0.206 1.00 0.00 N ATOM 145 CZ ARG A 12 13.175 10.044 -0.892 1.00 0.00 C ATOM 146 NH1 ARG A 12 13.174 9.895 -2.212 1.00 0.00 N ATOM 147 NH2 ARG A 12 14.296 10.254 -0.219 1.00 0.00 N ATOM 0 H ARG A 12 9.133 13.174 0.170 1.00 0.00 H new ATOM 0 HA ARG A 12 8.481 10.995 -1.443 1.00 0.00 H new ATOM 0 HB2 ARG A 12 10.102 11.473 0.627 1.00 0.00 H new ATOM 0 HB3 ARG A 12 8.747 10.888 1.572 1.00 0.00 H new ATOM 0 HG2 ARG A 12 10.009 8.947 1.282 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.824 8.796 -0.000 1.00 0.00 H new ATOM 0 HD2 ARG A 12 10.998 8.280 -0.944 1.00 0.00 H new ATOM 0 HD3 ARG A 12 10.481 9.817 -1.608 1.00 0.00 H new ATOM 0 HE ARG A 12 12.023 10.342 0.735 1.00 0.00 H new ATOM 0 HH11 ARG A 12 12.300 9.707 -2.703 1.00 0.00 H new ATOM 0 HH12 ARG A 12 14.047 9.969 -2.734 1.00 0.00 H new ATOM 0 HH21 ARG A 12 14.273 10.338 0.797 1.00 0.00 H new ATOM 0 HH22 ARG A 12 15.183 10.332 -0.717 1.00 0.00 H new ATOM 161 N SER A 13 6.139 11.675 0.780 1.00 0.00 N ATOM 162 CA SER A 13 4.763 11.397 1.151 1.00 0.00 C ATOM 163 C SER A 13 3.852 11.651 -0.039 1.00 0.00 C ATOM 164 O SER A 13 2.922 10.885 -0.270 1.00 0.00 O ATOM 165 CB SER A 13 4.385 12.279 2.347 1.00 0.00 C ATOM 166 OG SER A 13 3.124 11.929 2.889 1.00 0.00 O ATOM 0 H SER A 13 6.549 12.459 1.288 1.00 0.00 H new ATOM 0 HA SER A 13 4.649 10.352 1.440 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.149 12.189 3.119 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.368 13.323 2.036 1.00 0.00 H new ATOM 0 HG SER A 13 3.238 11.209 3.544 1.00 0.00 H new ATOM 172 N ARG A 14 4.105 12.732 -0.782 1.00 0.00 N ATOM 173 CA ARG A 14 3.252 13.194 -1.869 1.00 0.00 C ATOM 174 C ARG A 14 3.098 12.148 -2.959 1.00 0.00 C ATOM 175 O ARG A 14 2.081 12.174 -3.645 1.00 0.00 O ATOM 176 CB ARG A 14 3.788 14.495 -2.478 1.00 0.00 C ATOM 177 CG ARG A 14 4.009 15.626 -1.459 1.00 0.00 C ATOM 178 CD ARG A 14 2.754 16.053 -0.691 1.00 0.00 C ATOM 179 NE ARG A 14 1.776 16.789 -1.513 1.00 0.00 N ATOM 180 CZ ARG A 14 1.816 18.080 -1.880 1.00 0.00 C ATOM 181 NH1 ARG A 14 2.881 18.843 -1.640 1.00 0.00 N ATOM 182 NH2 ARG A 14 0.777 18.629 -2.499 1.00 0.00 N ATOM 0 H ARG A 14 4.927 13.319 -0.638 1.00 0.00 H new ATOM 0 HA ARG A 14 2.270 13.379 -1.434 1.00 0.00 H new ATOM 0 HB2 ARG A 14 4.732 14.285 -2.981 1.00 0.00 H new ATOM 0 HB3 ARG A 14 3.090 14.840 -3.241 1.00 0.00 H new ATOM 0 HG2 ARG A 14 4.766 15.307 -0.742 1.00 0.00 H new ATOM 0 HG3 ARG A 14 4.411 16.494 -1.982 1.00 0.00 H new ATOM 0 HD2 ARG A 14 2.273 15.167 -0.277 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.050 16.678 0.152 1.00 0.00 H new ATOM 0 HE ARG A 14 0.973 16.253 -1.842 1.00 0.00 H new ATOM 0 HH11 ARG A 14 3.694 18.449 -1.166 1.00 0.00 H new ATOM 0 HH12 ARG A 14 2.884 19.821 -1.930 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -0.053 18.070 -2.696 1.00 0.00 H new ATOM 0 HH22 ARG A 14 0.809 19.610 -2.777 1.00 0.00 H new ATOM 196 N MET A 15 4.067 11.242 -3.129 1.00 0.00 N ATOM 197 CA MET A 15 3.937 10.205 -4.142 1.00 0.00 C ATOM 198 C MET A 15 2.795 9.275 -3.754 1.00 0.00 C ATOM 199 O MET A 15 1.915 9.005 -4.568 1.00 0.00 O ATOM 200 CB MET A 15 5.228 9.401 -4.310 1.00 0.00 C ATOM 201 CG MET A 15 6.482 10.252 -4.545 1.00 0.00 C ATOM 202 SD MET A 15 7.482 9.780 -5.979 1.00 0.00 S ATOM 203 CE MET A 15 7.570 7.981 -5.788 1.00 0.00 C ATOM 0 H MET A 15 4.931 11.210 -2.587 1.00 0.00 H new ATOM 0 HA MET A 15 3.729 10.686 -5.098 1.00 0.00 H new ATOM 0 HB2 MET A 15 5.380 8.791 -3.419 1.00 0.00 H new ATOM 0 HB3 MET A 15 5.107 8.715 -5.149 1.00 0.00 H new ATOM 0 HG2 MET A 15 6.178 11.292 -4.662 1.00 0.00 H new ATOM 0 HG3 MET A 15 7.108 10.201 -3.654 1.00 0.00 H new ATOM 0 HE1 MET A 15 8.404 7.593 -6.373 1.00 0.00 H new ATOM 0 HE2 MET A 15 7.718 7.734 -4.737 1.00 0.00 H new ATOM 0 HE3 MET A 15 6.641 7.532 -6.139 1.00 0.00 H new ATOM 213 N ILE A 16 2.823 8.789 -2.508 1.00 0.00 N ATOM 214 CA ILE A 16 1.789 7.913 -1.971 1.00 0.00 C ATOM 215 C ILE A 16 0.471 8.687 -2.018 1.00 0.00 C ATOM 216 O ILE A 16 -0.502 8.234 -2.613 1.00 0.00 O ATOM 217 CB ILE A 16 2.128 7.430 -0.535 1.00 0.00 C ATOM 218 CG1 ILE A 16 3.566 6.879 -0.337 1.00 0.00 C ATOM 219 CG2 ILE A 16 1.088 6.380 -0.088 1.00 0.00 C ATOM 220 CD1 ILE A 16 3.998 5.836 -1.359 1.00 0.00 C ATOM 0 H ILE A 16 3.570 8.996 -1.845 1.00 0.00 H new ATOM 0 HA ILE A 16 1.714 7.006 -2.570 1.00 0.00 H new ATOM 0 HB ILE A 16 2.086 8.322 0.091 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.267 7.713 -0.372 1.00 0.00 H new ATOM 0 HG13 ILE A 16 3.639 6.443 0.659 1.00 0.00 H new ATOM 0 HG21 ILE A 16 1.325 6.040 0.920 1.00 0.00 H new ATOM 0 HG22 ILE A 16 0.094 6.826 -0.096 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.111 5.532 -0.772 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.015 5.511 -1.139 1.00 0.00 H new ATOM 0 HD12 ILE A 16 3.325 4.980 -1.312 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.964 6.270 -2.358 1.00 0.00 H new ATOM 232 N ASP A 17 0.473 9.880 -1.420 1.00 0.00 N ATOM 233 CA ASP A 17 -0.694 10.729 -1.227 1.00 0.00 C ATOM 234 C ASP A 17 -1.419 11.007 -2.544 1.00 0.00 C ATOM 235 O ASP A 17 -2.653 11.022 -2.580 1.00 0.00 O ATOM 236 CB ASP A 17 -0.275 12.031 -0.526 1.00 0.00 C ATOM 237 CG ASP A 17 -0.642 11.998 0.951 1.00 0.00 C ATOM 238 OD1 ASP A 17 -1.796 12.364 1.274 1.00 0.00 O ATOM 239 OD2 ASP A 17 0.158 11.502 1.777 1.00 0.00 O ATOM 0 H ASP A 17 1.326 10.294 -1.043 1.00 0.00 H new ATOM 0 HA ASP A 17 -1.404 10.201 -0.590 1.00 0.00 H new ATOM 0 HB2 ASP A 17 0.800 12.177 -0.634 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -0.762 12.880 -1.006 1.00 0.00 H new ATOM 244 N ALA A 18 -0.671 11.192 -3.638 1.00 0.00 N ATOM 245 CA ALA A 18 -1.217 11.373 -4.972 1.00 0.00 C ATOM 246 C ALA A 18 -2.029 10.149 -5.398 1.00 0.00 C ATOM 247 O ALA A 18 -3.201 10.285 -5.759 1.00 0.00 O ATOM 248 CB ALA A 18 -0.085 11.661 -5.970 1.00 0.00 C ATOM 0 H ALA A 18 0.348 11.219 -3.612 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.892 12.229 -4.961 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -0.504 11.795 -6.967 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.440 12.568 -5.672 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.613 10.824 -5.980 1.00 0.00 H new ATOM 254 N VAL A 19 -1.418 8.962 -5.437 1.00 0.00 N ATOM 255 CA VAL A 19 -2.075 7.764 -5.963 1.00 0.00 C ATOM 256 C VAL A 19 -3.176 7.235 -5.037 1.00 0.00 C ATOM 257 O VAL A 19 -4.020 6.452 -5.487 1.00 0.00 O ATOM 258 CB VAL A 19 -1.049 6.672 -6.307 1.00 0.00 C ATOM 259 CG1 VAL A 19 -0.118 7.125 -7.435 1.00 0.00 C ATOM 260 CG2 VAL A 19 -0.199 6.215 -5.118 1.00 0.00 C ATOM 0 H VAL A 19 -0.465 8.805 -5.109 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.572 8.060 -6.887 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.647 5.818 -6.625 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.597 6.333 -7.657 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.706 7.343 -8.326 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.419 8.022 -7.126 1.00 0.00 H new ATOM 0 HG21 VAL A 19 0.499 5.444 -5.445 1.00 0.00 H new ATOM 0 HG22 VAL A 19 0.358 7.064 -4.721 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.848 5.811 -4.341 1.00 0.00 H new ATOM 270 N THR A 20 -3.226 7.676 -3.777 1.00 0.00 N ATOM 271 CA THR A 20 -4.255 7.266 -2.833 1.00 0.00 C ATOM 272 C THR A 20 -5.503 8.153 -2.873 1.00 0.00 C ATOM 273 O THR A 20 -6.419 7.889 -2.106 1.00 0.00 O ATOM 274 CB THR A 20 -3.669 7.189 -1.415 1.00 0.00 C ATOM 275 OG1 THR A 20 -3.037 8.394 -1.036 1.00 0.00 O ATOM 276 CG2 THR A 20 -2.646 6.057 -1.303 1.00 0.00 C ATOM 0 H THR A 20 -2.548 8.330 -3.387 1.00 0.00 H new ATOM 0 HA THR A 20 -4.590 6.274 -3.137 1.00 0.00 H new ATOM 0 HB THR A 20 -4.511 7.002 -0.749 1.00 0.00 H new ATOM 0 HG1 THR A 20 -2.152 8.445 -1.455 1.00 0.00 H new ATOM 0 HG21 THR A 20 -2.248 6.026 -0.289 1.00 0.00 H new ATOM 0 HG22 THR A 20 -3.128 5.107 -1.533 1.00 0.00 H new ATOM 0 HG23 THR A 20 -1.832 6.231 -2.007 1.00 0.00 H new ATOM 284 N SER A 21 -5.531 9.223 -3.678 1.00 0.00 N ATOM 285 CA SER A 21 -6.434 10.346 -3.459 1.00 0.00 C ATOM 286 C SER A 21 -7.887 9.879 -3.574 1.00 0.00 C ATOM 287 O SER A 21 -8.275 9.347 -4.611 1.00 0.00 O ATOM 288 CB SER A 21 -6.052 11.507 -4.393 1.00 0.00 C ATOM 289 OG SER A 21 -6.321 11.250 -5.759 1.00 0.00 O ATOM 0 H SER A 21 -4.929 9.329 -4.494 1.00 0.00 H new ATOM 0 HA SER A 21 -6.335 10.736 -2.446 1.00 0.00 H new ATOM 0 HB2 SER A 21 -6.594 12.402 -4.087 1.00 0.00 H new ATOM 0 HB3 SER A 21 -4.990 11.722 -4.275 1.00 0.00 H new ATOM 0 HG SER A 21 -6.998 10.545 -5.832 1.00 0.00 H new ATOM 295 N ASP A 22 -8.654 9.978 -2.493 1.00 0.00 N ATOM 296 CA ASP A 22 -10.040 9.546 -2.377 1.00 0.00 C ATOM 297 C ASP A 22 -10.897 10.275 -3.402 1.00 0.00 C ATOM 298 O ASP A 22 -11.247 11.430 -3.192 1.00 0.00 O ATOM 299 CB ASP A 22 -10.581 9.742 -0.945 1.00 0.00 C ATOM 300 CG ASP A 22 -10.346 11.131 -0.341 1.00 0.00 C ATOM 301 OD1 ASP A 22 -9.173 11.573 -0.306 1.00 0.00 O ATOM 302 OD2 ASP A 22 -11.278 11.746 0.227 1.00 0.00 O ATOM 0 H ASP A 22 -8.304 10.385 -1.626 1.00 0.00 H new ATOM 0 HA ASP A 22 -10.085 8.477 -2.584 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -11.652 9.542 -0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -10.120 8.998 -0.295 1.00 0.00 H new ATOM 307 N GLU A 23 -11.216 9.608 -4.513 1.00 0.00 N ATOM 308 CA GLU A 23 -12.180 9.943 -5.545 1.00 0.00 C ATOM 309 C GLU A 23 -12.692 8.671 -6.210 1.00 0.00 C ATOM 310 O GLU A 23 -12.063 7.614 -6.118 1.00 0.00 O ATOM 311 CB GLU A 23 -11.538 10.815 -6.637 1.00 0.00 C ATOM 312 CG GLU A 23 -11.780 12.285 -6.330 1.00 0.00 C ATOM 313 CD GLU A 23 -13.218 12.755 -6.574 1.00 0.00 C ATOM 314 OE1 GLU A 23 -14.166 11.941 -6.494 1.00 0.00 O ATOM 315 OE2 GLU A 23 -13.414 13.975 -6.772 1.00 0.00 O ATOM 0 H GLU A 23 -10.751 8.726 -4.728 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.995 10.488 -5.069 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.468 10.617 -6.691 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -11.959 10.563 -7.611 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -11.521 12.473 -5.288 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -11.106 12.887 -6.940 1.00 0.00 H new ATOM 322 N ASP A 24 -13.794 8.797 -6.951 1.00 0.00 N ATOM 323 CA ASP A 24 -14.405 7.714 -7.721 1.00 0.00 C ATOM 324 C ASP A 24 -13.480 7.136 -8.796 1.00 0.00 C ATOM 325 O ASP A 24 -13.720 6.024 -9.265 1.00 0.00 O ATOM 326 CB ASP A 24 -15.709 8.188 -8.388 1.00 0.00 C ATOM 327 CG ASP A 24 -15.477 9.024 -9.656 1.00 0.00 C ATOM 328 OD1 ASP A 24 -15.170 10.236 -9.528 1.00 0.00 O ATOM 329 OD2 ASP A 24 -15.614 8.486 -10.779 1.00 0.00 O ATOM 0 H ASP A 24 -14.299 9.679 -7.034 1.00 0.00 H new ATOM 0 HA ASP A 24 -14.611 6.921 -7.002 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.316 7.319 -8.641 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -16.281 8.778 -7.672 1.00 0.00 H new ATOM 334 N LYS A 25 -12.445 7.870 -9.216 1.00 0.00 N ATOM 335 CA LYS A 25 -11.544 7.445 -10.283 1.00 0.00 C ATOM 336 C LYS A 25 -10.396 6.586 -9.761 1.00 0.00 C ATOM 337 O LYS A 25 -9.987 6.724 -8.608 1.00 0.00 O ATOM 338 CB LYS A 25 -11.016 8.675 -11.031 1.00 0.00 C ATOM 339 CG LYS A 25 -10.026 9.527 -10.211 1.00 0.00 C ATOM 340 CD LYS A 25 -9.482 10.713 -11.007 1.00 0.00 C ATOM 341 CE LYS A 25 -8.718 10.248 -12.247 1.00 0.00 C ATOM 342 NZ LYS A 25 -8.074 11.379 -12.930 1.00 0.00 N ATOM 0 H LYS A 25 -12.210 8.781 -8.821 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.110 6.819 -10.973 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.526 8.348 -11.948 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.860 9.299 -11.326 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.523 9.893 -9.312 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.196 8.901 -9.884 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.306 11.361 -11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.824 11.307 -10.373 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.963 9.516 -11.959 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.402 9.748 -12.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.563 11.034 -13.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.798 12.065 -13.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.404 11.840 -12.282 1.00 0.00 H new ATOM 356 N VAL A 26 -9.799 5.778 -10.633 1.00 0.00 N ATOM 357 CA VAL A 26 -8.497 5.158 -10.389 1.00 0.00 C ATOM 358 C VAL A 26 -7.360 6.164 -10.632 1.00 0.00 C ATOM 359 O VAL A 26 -7.590 7.292 -11.077 1.00 0.00 O ATOM 360 CB VAL A 26 -8.343 3.887 -11.253 1.00 0.00 C ATOM 361 CG1 VAL A 26 -9.446 2.869 -10.933 1.00 0.00 C ATOM 362 CG2 VAL A 26 -8.348 4.188 -12.756 1.00 0.00 C ATOM 0 H VAL A 26 -10.207 5.533 -11.535 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.437 4.856 -9.343 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.370 3.465 -11.001 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.315 1.983 -11.555 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -9.387 2.587 -9.882 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -10.421 3.313 -11.135 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.237 3.258 -13.314 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -9.290 4.664 -13.029 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -7.521 4.856 -12.996 1.00 0.00 H new ATOM 372 N ALA A 27 -6.125 5.746 -10.343 1.00 0.00 N ATOM 373 CA ALA A 27 -4.891 6.350 -10.836 1.00 0.00 C ATOM 374 C ALA A 27 -4.287 5.410 -11.895 1.00 0.00 C ATOM 375 O ALA A 27 -4.591 4.203 -11.876 1.00 0.00 O ATOM 376 CB ALA A 27 -3.917 6.538 -9.659 1.00 0.00 C ATOM 0 H ALA A 27 -5.954 4.945 -9.735 1.00 0.00 H new ATOM 0 HA ALA A 27 -5.085 7.325 -11.284 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -2.993 6.989 -10.020 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -4.371 7.189 -8.912 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -3.697 5.569 -9.210 1.00 0.00 H new ATOM 382 N PRO A 28 -3.404 5.899 -12.782 1.00 0.00 N ATOM 383 CA PRO A 28 -2.720 5.038 -13.735 1.00 0.00 C ATOM 384 C PRO A 28 -1.631 4.228 -13.032 1.00 0.00 C ATOM 385 O PRO A 28 -1.163 4.590 -11.950 1.00 0.00 O ATOM 386 CB PRO A 28 -2.099 5.977 -14.762 1.00 0.00 C ATOM 387 CG PRO A 28 -1.840 7.250 -13.957 1.00 0.00 C ATOM 388 CD PRO A 28 -2.948 7.279 -12.916 1.00 0.00 C ATOM 0 HA PRO A 28 -3.403 4.326 -14.198 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -1.178 5.568 -15.177 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -2.772 6.160 -15.600 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -0.856 7.229 -13.488 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -1.871 8.134 -14.593 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -2.581 7.664 -11.965 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -3.763 7.931 -13.230 1.00 0.00 H new ATOM 396 N VAL A 29 -1.184 3.149 -13.670 1.00 0.00 N ATOM 397 CA VAL A 29 -0.148 2.292 -13.113 1.00 0.00 C ATOM 398 C VAL A 29 1.207 2.991 -13.089 1.00 0.00 C ATOM 399 O VAL A 29 1.946 2.780 -12.130 1.00 0.00 O ATOM 400 CB VAL A 29 -0.105 0.965 -13.883 1.00 0.00 C ATOM 401 CG1 VAL A 29 1.058 0.061 -13.470 1.00 0.00 C ATOM 402 CG2 VAL A 29 -1.410 0.211 -13.611 1.00 0.00 C ATOM 0 H VAL A 29 -1.529 2.848 -14.582 1.00 0.00 H new ATOM 0 HA VAL A 29 -0.393 2.073 -12.074 1.00 0.00 H new ATOM 0 HB VAL A 29 0.028 1.208 -14.937 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.028 -0.859 -14.053 1.00 0.00 H new ATOM 0 HG12 VAL A 29 2.001 0.576 -13.652 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.974 -0.178 -12.410 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.402 -0.737 -14.149 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.504 0.020 -12.542 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.255 0.812 -13.948 1.00 0.00 H new ATOM 412 N TYR A 30 1.516 3.847 -14.069 1.00 0.00 N ATOM 413 CA TYR A 30 2.824 4.490 -14.102 1.00 0.00 C ATOM 414 C TYR A 30 3.056 5.342 -12.852 1.00 0.00 C ATOM 415 O TYR A 30 4.178 5.415 -12.352 1.00 0.00 O ATOM 416 CB TYR A 30 3.004 5.302 -15.386 1.00 0.00 C ATOM 417 CG TYR A 30 2.074 6.492 -15.570 1.00 0.00 C ATOM 418 CD1 TYR A 30 2.375 7.740 -14.995 1.00 0.00 C ATOM 419 CD2 TYR A 30 0.943 6.378 -16.397 1.00 0.00 C ATOM 420 CE1 TYR A 30 1.554 8.856 -15.232 1.00 0.00 C ATOM 421 CE2 TYR A 30 0.136 7.492 -16.664 1.00 0.00 C ATOM 422 CZ TYR A 30 0.425 8.742 -16.077 1.00 0.00 C ATOM 423 OH TYR A 30 -0.390 9.807 -16.323 1.00 0.00 O ATOM 0 H TYR A 30 0.890 4.104 -14.832 1.00 0.00 H new ATOM 0 HA TYR A 30 3.583 3.708 -14.102 1.00 0.00 H new ATOM 0 HB2 TYR A 30 4.032 5.663 -15.420 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.873 4.632 -16.235 1.00 0.00 H new ATOM 0 HD1 TYR A 30 3.246 7.842 -14.365 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.693 5.421 -16.831 1.00 0.00 H new ATOM 0 HE1 TYR A 30 1.786 9.803 -14.768 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -0.713 7.393 -17.324 1.00 0.00 H new ATOM 0 HH TYR A 30 -1.111 9.534 -16.928 1.00 0.00 H new ATOM 433 N LYS A 31 2.000 5.957 -12.305 1.00 0.00 N ATOM 434 CA LYS A 31 2.147 6.717 -11.075 1.00 0.00 C ATOM 435 C LYS A 31 2.355 5.808 -9.867 1.00 0.00 C ATOM 436 O LYS A 31 2.838 6.311 -8.861 1.00 0.00 O ATOM 437 CB LYS A 31 0.957 7.654 -10.841 1.00 0.00 C ATOM 438 CG LYS A 31 0.995 8.814 -11.840 1.00 0.00 C ATOM 439 CD LYS A 31 0.238 10.036 -11.333 1.00 0.00 C ATOM 440 CE LYS A 31 0.485 11.206 -12.283 1.00 0.00 C ATOM 441 NZ LYS A 31 1.834 11.808 -12.128 1.00 0.00 N ATOM 0 H LYS A 31 1.056 5.940 -12.691 1.00 0.00 H new ATOM 0 HA LYS A 31 3.041 7.329 -11.193 1.00 0.00 H new ATOM 0 HB2 LYS A 31 0.023 7.102 -10.948 1.00 0.00 H new ATOM 0 HB3 LYS A 31 0.984 8.040 -9.822 1.00 0.00 H new ATOM 0 HG2 LYS A 31 2.032 9.087 -12.038 1.00 0.00 H new ATOM 0 HG3 LYS A 31 0.565 8.489 -12.787 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -0.829 9.819 -11.273 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.569 10.292 -10.327 1.00 0.00 H new ATOM 0 HE2 LYS A 31 0.362 10.864 -13.311 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -0.270 11.972 -12.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.878 12.702 -12.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.018 11.992 -11.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 2.551 11.152 -12.497 1.00 0.00 H new ATOM 455 N LEU A 32 1.951 4.529 -9.913 1.00 0.00 N ATOM 456 CA LEU A 32 2.163 3.571 -8.834 1.00 0.00 C ATOM 457 C LEU A 32 3.599 3.056 -8.882 1.00 0.00 C ATOM 458 O LEU A 32 4.221 2.912 -7.832 1.00 0.00 O ATOM 459 CB LEU A 32 1.216 2.355 -8.935 1.00 0.00 C ATOM 460 CG LEU A 32 -0.295 2.636 -8.971 1.00 0.00 C ATOM 461 CD1 LEU A 32 -1.064 1.334 -9.236 1.00 0.00 C ATOM 462 CD2 LEU A 32 -0.801 3.223 -7.653 1.00 0.00 C ATOM 0 H LEU A 32 1.462 4.133 -10.715 1.00 0.00 H new ATOM 0 HA LEU A 32 1.959 4.094 -7.899 1.00 0.00 H new ATOM 0 HB2 LEU A 32 1.477 1.799 -9.836 1.00 0.00 H new ATOM 0 HB3 LEU A 32 1.417 1.700 -8.087 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.464 3.360 -9.768 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.134 1.542 -9.260 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.754 0.917 -10.194 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.851 0.618 -8.442 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.873 3.406 -7.724 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.605 2.520 -6.843 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -0.286 4.162 -7.451 1.00 0.00 H new ATOM 474 N GLU A 33 4.106 2.717 -10.072 1.00 0.00 N ATOM 475 CA GLU A 33 5.418 2.083 -10.192 1.00 0.00 C ATOM 476 C GLU A 33 6.541 3.052 -9.820 1.00 0.00 C ATOM 477 O GLU A 33 7.569 2.622 -9.308 1.00 0.00 O ATOM 478 CB GLU A 33 5.613 1.449 -11.575 1.00 0.00 C ATOM 479 CG GLU A 33 5.976 2.411 -12.705 1.00 0.00 C ATOM 480 CD GLU A 33 5.964 1.662 -14.031 1.00 0.00 C ATOM 481 OE1 GLU A 33 6.900 0.867 -14.283 1.00 0.00 O ATOM 482 OE2 GLU A 33 5.001 1.819 -14.814 1.00 0.00 O ATOM 0 H GLU A 33 3.629 2.871 -10.960 1.00 0.00 H new ATOM 0 HA GLU A 33 5.463 1.266 -9.472 1.00 0.00 H new ATOM 0 HB2 GLU A 33 6.396 0.695 -11.500 1.00 0.00 H new ATOM 0 HB3 GLU A 33 4.695 0.929 -11.848 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.266 3.238 -12.735 1.00 0.00 H new ATOM 0 HG3 GLU A 33 6.961 2.843 -12.528 1.00 0.00 H new ATOM 489 N GLU A 34 6.309 4.354 -9.972 1.00 0.00 N ATOM 490 CA GLU A 34 7.198 5.410 -9.510 1.00 0.00 C ATOM 491 C GLU A 34 7.564 5.229 -8.021 1.00 0.00 C ATOM 492 O GLU A 34 8.705 5.475 -7.627 1.00 0.00 O ATOM 493 CB GLU A 34 6.513 6.748 -9.847 1.00 0.00 C ATOM 494 CG GLU A 34 7.169 7.968 -9.198 1.00 0.00 C ATOM 495 CD GLU A 34 6.851 9.283 -9.916 1.00 0.00 C ATOM 496 OE1 GLU A 34 5.652 9.571 -10.150 1.00 0.00 O ATOM 497 OE2 GLU A 34 7.824 10.022 -10.202 1.00 0.00 O ATOM 0 H GLU A 34 5.472 4.711 -10.434 1.00 0.00 H new ATOM 0 HA GLU A 34 8.163 5.379 -10.015 1.00 0.00 H new ATOM 0 HB2 GLU A 34 6.513 6.881 -10.929 1.00 0.00 H new ATOM 0 HB3 GLU A 34 5.471 6.699 -9.532 1.00 0.00 H new ATOM 0 HG2 GLU A 34 6.840 8.040 -8.161 1.00 0.00 H new ATOM 0 HG3 GLU A 34 8.249 7.824 -9.180 1.00 0.00 H new ATOM 504 N ILE A 35 6.634 4.752 -7.186 1.00 0.00 N ATOM 505 CA ILE A 35 6.891 4.491 -5.774 1.00 0.00 C ATOM 506 C ILE A 35 7.813 3.276 -5.638 1.00 0.00 C ATOM 507 O ILE A 35 8.755 3.315 -4.841 1.00 0.00 O ATOM 508 CB ILE A 35 5.556 4.313 -5.010 1.00 0.00 C ATOM 509 CG1 ILE A 35 4.745 5.625 -4.904 1.00 0.00 C ATOM 510 CG2 ILE A 35 5.785 3.804 -3.573 1.00 0.00 C ATOM 511 CD1 ILE A 35 4.023 6.093 -6.164 1.00 0.00 C ATOM 0 H ILE A 35 5.680 4.537 -7.476 1.00 0.00 H new ATOM 0 HA ILE A 35 7.400 5.343 -5.324 1.00 0.00 H new ATOM 0 HB ILE A 35 4.996 3.583 -5.595 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.004 5.503 -4.114 1.00 0.00 H new ATOM 0 HG13 ILE A 35 5.422 6.418 -4.587 1.00 0.00 H new ATOM 0 HG21 ILE A 35 4.825 3.692 -3.069 1.00 0.00 H new ATOM 0 HG22 ILE A 35 6.293 2.840 -3.605 1.00 0.00 H new ATOM 0 HG23 ILE A 35 6.400 4.520 -3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.493 7.022 -5.956 1.00 0.00 H new ATOM 0 HD12 ILE A 35 4.750 6.260 -6.959 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.310 5.331 -6.479 1.00 0.00 H new ATOM 523 N CYS A 36 7.512 2.177 -6.345 1.00 0.00 N ATOM 524 CA CYS A 36 8.317 0.965 -6.236 1.00 0.00 C ATOM 525 C CYS A 36 9.745 1.234 -6.705 1.00 0.00 C ATOM 526 O CYS A 36 10.683 0.693 -6.123 1.00 0.00 O ATOM 527 CB CYS A 36 7.648 -0.246 -6.911 1.00 0.00 C ATOM 528 SG CYS A 36 7.883 -0.392 -8.705 1.00 0.00 S ATOM 0 H CYS A 36 6.725 2.108 -6.990 1.00 0.00 H new ATOM 0 HA CYS A 36 8.382 0.683 -5.185 1.00 0.00 H new ATOM 0 HB2 CYS A 36 8.027 -1.153 -6.441 1.00 0.00 H new ATOM 0 HB3 CYS A 36 6.578 -0.204 -6.708 1.00 0.00 H new ATOM 0 HG CYS A 36 7.817 0.787 -9.249 1.00 0.00 H new ATOM 534 N ASP A 37 9.910 2.106 -7.700 1.00 0.00 N ATOM 535 CA ASP A 37 11.193 2.558 -8.207 1.00 0.00 C ATOM 536 C ASP A 37 11.981 3.269 -7.123 1.00 0.00 C ATOM 537 O ASP A 37 13.104 2.860 -6.830 1.00 0.00 O ATOM 538 CB ASP A 37 10.985 3.530 -9.370 1.00 0.00 C ATOM 539 CG ASP A 37 12.318 3.941 -9.986 1.00 0.00 C ATOM 540 OD1 ASP A 37 13.205 3.083 -10.160 1.00 0.00 O ATOM 541 OD2 ASP A 37 12.461 5.136 -10.338 1.00 0.00 O ATOM 0 H ASP A 37 9.121 2.529 -8.189 1.00 0.00 H new ATOM 0 HA ASP A 37 11.747 1.681 -8.543 1.00 0.00 H new ATOM 0 HB2 ASP A 37 10.358 3.064 -10.130 1.00 0.00 H new ATOM 0 HB3 ASP A 37 10.455 4.415 -9.018 1.00 0.00 H new ATOM 546 N LEU A 38 11.406 4.312 -6.506 1.00 0.00 N ATOM 547 CA LEU A 38 12.126 5.089 -5.506 1.00 0.00 C ATOM 548 C LEU A 38 12.618 4.194 -4.383 1.00 0.00 C ATOM 549 O LEU A 38 13.790 4.251 -4.032 1.00 0.00 O ATOM 550 CB LEU A 38 11.323 6.241 -4.924 1.00 0.00 C ATOM 551 CG LEU A 38 11.228 7.437 -5.876 1.00 0.00 C ATOM 552 CD1 LEU A 38 10.782 8.708 -5.155 1.00 0.00 C ATOM 553 CD2 LEU A 38 12.484 7.821 -6.679 1.00 0.00 C ATOM 0 H LEU A 38 10.453 4.629 -6.685 1.00 0.00 H new ATOM 0 HA LEU A 38 12.971 5.531 -6.034 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.318 5.893 -4.683 1.00 0.00 H new ATOM 0 HB3 LEU A 38 11.782 6.562 -3.989 1.00 0.00 H new ATOM 0 HG LEU A 38 10.496 7.062 -6.591 1.00 0.00 H new ATOM 0 HD11 LEU A 38 10.728 9.531 -5.868 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.800 8.548 -4.710 1.00 0.00 H new ATOM 0 HD13 LEU A 38 11.499 8.953 -4.372 1.00 0.00 H new ATOM 0 HD21 LEU A 38 12.264 8.684 -7.308 1.00 0.00 H new ATOM 0 HD22 LEU A 38 13.293 8.069 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 38 12.785 6.982 -7.307 1.00 0.00 H new ATOM 565 N LEU A 39 11.745 3.344 -3.845 1.00 0.00 N ATOM 566 CA LEU A 39 12.118 2.405 -2.798 1.00 0.00 C ATOM 567 C LEU A 39 13.262 1.507 -3.245 1.00 0.00 C ATOM 568 O LEU A 39 14.154 1.231 -2.451 1.00 0.00 O ATOM 569 CB LEU A 39 10.911 1.550 -2.412 1.00 0.00 C ATOM 570 CG LEU A 39 9.882 2.323 -1.602 1.00 0.00 C ATOM 571 CD1 LEU A 39 8.499 1.711 -1.752 1.00 0.00 C ATOM 572 CD2 LEU A 39 10.296 2.226 -0.149 1.00 0.00 C ATOM 0 H LEU A 39 10.765 3.290 -4.123 1.00 0.00 H new ATOM 0 HA LEU A 39 12.452 2.978 -1.933 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.440 1.163 -3.316 1.00 0.00 H new ATOM 0 HB3 LEU A 39 11.250 0.689 -1.836 1.00 0.00 H new ATOM 0 HG LEU A 39 9.840 3.355 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.782 2.283 -1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.204 1.731 -2.801 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.517 0.680 -1.400 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.582 2.769 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.316 1.179 0.154 1.00 0.00 H new ATOM 0 HD23 LEU A 39 11.288 2.660 -0.024 1.00 0.00 H new ATOM 584 N ARG A 40 13.250 1.015 -4.484 1.00 0.00 N ATOM 585 CA ARG A 40 14.316 0.155 -4.999 1.00 0.00 C ATOM 586 C ARG A 40 15.614 0.943 -5.150 1.00 0.00 C ATOM 587 O ARG A 40 16.696 0.398 -4.952 1.00 0.00 O ATOM 588 CB ARG A 40 13.826 -0.465 -6.322 1.00 0.00 C ATOM 589 CG ARG A 40 14.342 -1.874 -6.624 1.00 0.00 C ATOM 590 CD ARG A 40 15.670 -1.896 -7.380 1.00 0.00 C ATOM 591 NE ARG A 40 16.365 -3.196 -7.288 1.00 0.00 N ATOM 592 CZ ARG A 40 15.888 -4.411 -7.597 1.00 0.00 C ATOM 593 NH1 ARG A 40 14.701 -4.572 -8.165 1.00 0.00 N ATOM 594 NH2 ARG A 40 16.629 -5.479 -7.351 1.00 0.00 N ATOM 0 H ARG A 40 12.505 1.200 -5.156 1.00 0.00 H new ATOM 0 HA ARG A 40 14.541 -0.652 -4.302 1.00 0.00 H new ATOM 0 HB2 ARG A 40 12.736 -0.492 -6.308 1.00 0.00 H new ATOM 0 HB3 ARG A 40 14.118 0.193 -7.141 1.00 0.00 H new ATOM 0 HG2 ARG A 40 14.460 -2.416 -5.686 1.00 0.00 H new ATOM 0 HG3 ARG A 40 13.593 -2.408 -7.209 1.00 0.00 H new ATOM 0 HD2 ARG A 40 15.489 -1.661 -8.429 1.00 0.00 H new ATOM 0 HD3 ARG A 40 16.319 -1.114 -6.986 1.00 0.00 H new ATOM 0 HE ARG A 40 17.326 -3.166 -6.948 1.00 0.00 H new ATOM 0 HH11 ARG A 40 14.123 -3.759 -8.379 1.00 0.00 H new ATOM 0 HH12 ARG A 40 14.365 -5.509 -8.388 1.00 0.00 H new ATOM 0 HH21 ARG A 40 17.552 -5.373 -6.931 1.00 0.00 H new ATOM 0 HH22 ARG A 40 16.277 -6.408 -7.582 1.00 0.00 H new ATOM 608 N SER A 41 15.510 2.221 -5.499 1.00 0.00 N ATOM 609 CA SER A 41 16.590 3.181 -5.660 1.00 0.00 C ATOM 610 C SER A 41 17.159 3.650 -4.300 1.00 0.00 C ATOM 611 O SER A 41 18.242 4.242 -4.265 1.00 0.00 O ATOM 612 CB SER A 41 15.997 4.330 -6.509 1.00 0.00 C ATOM 613 OG SER A 41 16.961 5.200 -7.078 1.00 0.00 O ATOM 0 H SER A 41 14.600 2.641 -5.690 1.00 0.00 H new ATOM 0 HA SER A 41 17.453 2.742 -6.162 1.00 0.00 H new ATOM 0 HB2 SER A 41 15.397 3.900 -7.311 1.00 0.00 H new ATOM 0 HB3 SER A 41 15.322 4.915 -5.884 1.00 0.00 H new ATOM 0 HG SER A 41 16.507 5.895 -7.599 1.00 0.00 H new ATOM 619 N SER A 42 16.490 3.398 -3.165 1.00 0.00 N ATOM 620 CA SER A 42 16.727 4.120 -1.913 1.00 0.00 C ATOM 621 C SER A 42 17.222 3.253 -0.744 1.00 0.00 C ATOM 622 O SER A 42 17.070 2.027 -0.722 1.00 0.00 O ATOM 623 CB SER A 42 15.428 4.820 -1.510 1.00 0.00 C ATOM 624 OG SER A 42 15.247 6.057 -2.170 1.00 0.00 O ATOM 0 H SER A 42 15.766 2.683 -3.093 1.00 0.00 H new ATOM 0 HA SER A 42 17.536 4.823 -2.111 1.00 0.00 H new ATOM 0 HB2 SER A 42 14.584 4.167 -1.733 1.00 0.00 H new ATOM 0 HB3 SER A 42 15.428 4.984 -0.432 1.00 0.00 H new ATOM 0 HG SER A 42 14.712 5.921 -2.980 1.00 0.00 H new ATOM 630 N HIS A 43 17.771 3.946 0.260 1.00 0.00 N ATOM 631 CA HIS A 43 18.238 3.434 1.542 1.00 0.00 C ATOM 632 C HIS A 43 17.079 3.067 2.482 1.00 0.00 C ATOM 633 O HIS A 43 15.955 3.543 2.309 1.00 0.00 O ATOM 634 CB HIS A 43 19.156 4.504 2.158 1.00 0.00 C ATOM 635 CG HIS A 43 19.990 4.020 3.313 1.00 0.00 C ATOM 636 ND1 HIS A 43 20.130 4.643 4.535 1.00 0.00 N ATOM 637 CD2 HIS A 43 20.808 2.922 3.306 1.00 0.00 C ATOM 638 CE1 HIS A 43 20.996 3.921 5.260 1.00 0.00 C ATOM 639 NE2 HIS A 43 21.447 2.875 4.547 1.00 0.00 N ATOM 0 H HIS A 43 17.908 4.954 0.186 1.00 0.00 H new ATOM 0 HA HIS A 43 18.788 2.505 1.390 1.00 0.00 H new ATOM 0 HB2 HIS A 43 19.819 4.886 1.382 1.00 0.00 H new ATOM 0 HB3 HIS A 43 18.543 5.341 2.494 1.00 0.00 H new ATOM 0 HD2 HIS A 43 20.935 2.223 2.493 1.00 0.00 H new ATOM 0 HE1 HIS A 43 21.290 4.148 6.274 1.00 0.00 H new ATOM 0 HE2 HIS A 43 22.127 2.179 4.854 1.00 0.00 H new ATOM 647 N VAL A 44 17.366 2.284 3.526 1.00 0.00 N ATOM 648 CA VAL A 44 16.378 1.759 4.468 1.00 0.00 C ATOM 649 C VAL A 44 15.610 2.881 5.176 1.00 0.00 C ATOM 650 O VAL A 44 14.390 2.805 5.290 1.00 0.00 O ATOM 651 CB VAL A 44 17.054 0.753 5.427 1.00 0.00 C ATOM 652 CG1 VAL A 44 18.136 1.385 6.316 1.00 0.00 C ATOM 653 CG2 VAL A 44 16.022 0.025 6.298 1.00 0.00 C ATOM 0 H VAL A 44 18.318 1.991 3.744 1.00 0.00 H new ATOM 0 HA VAL A 44 15.613 1.209 3.920 1.00 0.00 H new ATOM 0 HB VAL A 44 17.553 0.031 4.781 1.00 0.00 H new ATOM 0 HG11 VAL A 44 18.567 0.621 6.963 1.00 0.00 H new ATOM 0 HG12 VAL A 44 18.918 1.813 5.689 1.00 0.00 H new ATOM 0 HG13 VAL A 44 17.691 2.170 6.928 1.00 0.00 H new ATOM 0 HG21 VAL A 44 16.533 -0.674 6.960 1.00 0.00 H new ATOM 0 HG22 VAL A 44 15.471 0.752 6.894 1.00 0.00 H new ATOM 0 HG23 VAL A 44 15.328 -0.521 5.660 1.00 0.00 H new ATOM 663 N SER A 45 16.280 3.969 5.559 1.00 0.00 N ATOM 664 CA SER A 45 15.637 5.135 6.153 1.00 0.00 C ATOM 665 C SER A 45 14.581 5.791 5.255 1.00 0.00 C ATOM 666 O SER A 45 13.787 6.598 5.738 1.00 0.00 O ATOM 667 CB SER A 45 16.721 6.157 6.463 1.00 0.00 C ATOM 668 OG SER A 45 17.384 5.835 7.665 1.00 0.00 O ATOM 0 H SER A 45 17.291 4.063 5.464 1.00 0.00 H new ATOM 0 HA SER A 45 15.111 4.796 7.046 1.00 0.00 H new ATOM 0 HB2 SER A 45 17.440 6.191 5.644 1.00 0.00 H new ATOM 0 HB3 SER A 45 16.279 7.150 6.541 1.00 0.00 H new ATOM 0 HG SER A 45 18.078 6.503 7.845 1.00 0.00 H new ATOM 674 N ILE A 46 14.577 5.504 3.954 1.00 0.00 N ATOM 675 CA ILE A 46 13.568 5.997 3.031 1.00 0.00 C ATOM 676 C ILE A 46 12.425 4.985 2.977 1.00 0.00 C ATOM 677 O ILE A 46 11.264 5.385 2.958 1.00 0.00 O ATOM 678 CB ILE A 46 14.174 6.174 1.630 1.00 0.00 C ATOM 679 CG1 ILE A 46 15.599 6.787 1.586 1.00 0.00 C ATOM 680 CG2 ILE A 46 13.222 6.977 0.737 1.00 0.00 C ATOM 681 CD1 ILE A 46 15.753 8.135 2.284 1.00 0.00 C ATOM 0 H ILE A 46 15.283 4.916 3.511 1.00 0.00 H new ATOM 0 HA ILE A 46 13.197 6.964 3.371 1.00 0.00 H new ATOM 0 HB ILE A 46 14.297 5.160 1.251 1.00 0.00 H new ATOM 0 HG12 ILE A 46 16.294 6.081 2.040 1.00 0.00 H new ATOM 0 HG13 ILE A 46 15.895 6.901 0.543 1.00 0.00 H new ATOM 0 HG21 ILE A 46 13.664 7.095 -0.252 1.00 0.00 H new ATOM 0 HG22 ILE A 46 12.273 6.449 0.650 1.00 0.00 H new ATOM 0 HG23 ILE A 46 13.052 7.959 1.178 1.00 0.00 H new ATOM 0 HD11 ILE A 46 16.785 8.475 2.195 1.00 0.00 H new ATOM 0 HD12 ILE A 46 15.089 8.864 1.818 1.00 0.00 H new ATOM 0 HD13 ILE A 46 15.495 8.031 3.338 1.00 0.00 H new ATOM 693 N VAL A 47 12.749 3.685 2.950 1.00 0.00 N ATOM 694 CA VAL A 47 11.780 2.599 2.990 1.00 0.00 C ATOM 695 C VAL A 47 10.865 2.801 4.190 1.00 0.00 C ATOM 696 O VAL A 47 9.655 2.728 4.013 1.00 0.00 O ATOM 697 CB VAL A 47 12.487 1.236 3.098 1.00 0.00 C ATOM 698 CG1 VAL A 47 11.470 0.096 3.190 1.00 0.00 C ATOM 699 CG2 VAL A 47 13.392 0.998 1.887 1.00 0.00 C ATOM 0 H VAL A 47 13.714 3.360 2.899 1.00 0.00 H new ATOM 0 HA VAL A 47 11.199 2.607 2.068 1.00 0.00 H new ATOM 0 HB VAL A 47 13.090 1.253 4.006 1.00 0.00 H new ATOM 0 HG11 VAL A 47 11.996 -0.856 3.265 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.845 0.236 4.072 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.843 0.095 2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 47 13.882 0.029 1.984 1.00 0.00 H new ATOM 0 HG22 VAL A 47 12.793 1.012 0.977 1.00 0.00 H new ATOM 0 HG23 VAL A 47 14.147 1.783 1.837 1.00 0.00 H new ATOM 709 N LYS A 48 11.426 3.034 5.385 1.00 0.00 N ATOM 710 CA LYS A 48 10.660 3.215 6.617 1.00 0.00 C ATOM 711 C LYS A 48 9.602 4.290 6.415 1.00 0.00 C ATOM 712 O LYS A 48 8.422 4.041 6.664 1.00 0.00 O ATOM 713 CB LYS A 48 11.587 3.594 7.785 1.00 0.00 C ATOM 714 CG LYS A 48 12.529 2.462 8.215 1.00 0.00 C ATOM 715 CD LYS A 48 13.427 2.949 9.360 1.00 0.00 C ATOM 716 CE LYS A 48 14.389 1.848 9.809 1.00 0.00 C ATOM 717 NZ LYS A 48 15.288 2.325 10.879 1.00 0.00 N ATOM 0 H LYS A 48 12.435 3.102 5.520 1.00 0.00 H new ATOM 0 HA LYS A 48 10.170 2.273 6.863 1.00 0.00 H new ATOM 0 HB2 LYS A 48 12.182 4.461 7.499 1.00 0.00 H new ATOM 0 HB3 LYS A 48 10.978 3.893 8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 48 11.951 1.596 8.536 1.00 0.00 H new ATOM 0 HG3 LYS A 48 13.140 2.143 7.371 1.00 0.00 H new ATOM 0 HD2 LYS A 48 13.994 3.822 9.036 1.00 0.00 H new ATOM 0 HD3 LYS A 48 12.810 3.264 10.202 1.00 0.00 H new ATOM 0 HE2 LYS A 48 13.821 0.988 10.165 1.00 0.00 H new ATOM 0 HE3 LYS A 48 14.980 1.509 8.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 15.929 1.556 11.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 15.846 3.130 10.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 14.723 2.625 11.699 1.00 0.00 H new ATOM 731 N GLU A 49 10.031 5.466 5.958 1.00 0.00 N ATOM 732 CA GLU A 49 9.154 6.619 5.827 1.00 0.00 C ATOM 733 C GLU A 49 8.068 6.353 4.797 1.00 0.00 C ATOM 734 O GLU A 49 6.903 6.697 5.011 1.00 0.00 O ATOM 735 CB GLU A 49 9.988 7.840 5.428 1.00 0.00 C ATOM 736 CG GLU A 49 10.512 8.511 6.711 1.00 0.00 C ATOM 737 CD GLU A 49 11.654 9.507 6.514 1.00 0.00 C ATOM 738 OE1 GLU A 49 11.914 9.948 5.373 1.00 0.00 O ATOM 739 OE2 GLU A 49 12.321 9.878 7.512 1.00 0.00 O ATOM 0 H GLU A 49 10.994 5.642 5.670 1.00 0.00 H new ATOM 0 HA GLU A 49 8.666 6.811 6.783 1.00 0.00 H new ATOM 0 HB2 GLU A 49 10.819 7.539 4.790 1.00 0.00 H new ATOM 0 HB3 GLU A 49 9.383 8.541 4.853 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.683 9.027 7.195 1.00 0.00 H new ATOM 0 HG3 GLU A 49 10.847 7.732 7.397 1.00 0.00 H new ATOM 746 N PHE A 50 8.448 5.733 3.682 1.00 0.00 N ATOM 747 CA PHE A 50 7.516 5.397 2.632 1.00 0.00 C ATOM 748 C PHE A 50 6.483 4.390 3.132 1.00 0.00 C ATOM 749 O PHE A 50 5.294 4.556 2.864 1.00 0.00 O ATOM 750 CB PHE A 50 8.251 4.770 1.448 1.00 0.00 C ATOM 751 CG PHE A 50 8.512 5.635 0.239 1.00 0.00 C ATOM 752 CD1 PHE A 50 7.465 6.346 -0.378 1.00 0.00 C ATOM 753 CD2 PHE A 50 9.767 5.565 -0.383 1.00 0.00 C ATOM 754 CE1 PHE A 50 7.661 6.929 -1.643 1.00 0.00 C ATOM 755 CE2 PHE A 50 9.952 6.112 -1.658 1.00 0.00 C ATOM 756 CZ PHE A 50 8.891 6.771 -2.302 1.00 0.00 C ATOM 0 H PHE A 50 9.410 5.454 3.490 1.00 0.00 H new ATOM 0 HA PHE A 50 7.021 6.318 2.324 1.00 0.00 H new ATOM 0 HB2 PHE A 50 9.211 4.401 1.808 1.00 0.00 H new ATOM 0 HB3 PHE A 50 7.678 3.902 1.121 1.00 0.00 H new ATOM 0 HD1 PHE A 50 6.512 6.444 0.120 1.00 0.00 H new ATOM 0 HD2 PHE A 50 10.593 5.088 0.123 1.00 0.00 H new ATOM 0 HE1 PHE A 50 6.868 7.497 -2.106 1.00 0.00 H new ATOM 0 HE2 PHE A 50 10.911 6.028 -2.147 1.00 0.00 H new ATOM 0 HZ PHE A 50 9.021 7.156 -3.303 1.00 0.00 H new ATOM 766 N SER A 51 6.954 3.323 3.787 1.00 0.00 N ATOM 767 CA SER A 51 6.154 2.237 4.328 1.00 0.00 C ATOM 768 C SER A 51 5.075 2.869 5.182 1.00 0.00 C ATOM 769 O SER A 51 3.901 2.674 4.903 1.00 0.00 O ATOM 770 CB SER A 51 7.058 1.270 5.121 1.00 0.00 C ATOM 771 OG SER A 51 6.487 -0.002 5.348 1.00 0.00 O ATOM 0 H SER A 51 7.951 3.194 3.958 1.00 0.00 H new ATOM 0 HA SER A 51 5.684 1.641 3.546 1.00 0.00 H new ATOM 0 HB2 SER A 51 7.997 1.143 4.582 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.301 1.723 6.082 1.00 0.00 H new ATOM 0 HG SER A 51 6.565 -0.231 6.298 1.00 0.00 H new ATOM 777 N GLU A 52 5.468 3.684 6.153 1.00 0.00 N ATOM 778 CA GLU A 52 4.560 4.468 6.967 1.00 0.00 C ATOM 779 C GLU A 52 3.499 5.201 6.136 1.00 0.00 C ATOM 780 O GLU A 52 2.315 4.960 6.369 1.00 0.00 O ATOM 781 CB GLU A 52 5.396 5.412 7.826 1.00 0.00 C ATOM 782 CG GLU A 52 5.921 4.763 9.117 1.00 0.00 C ATOM 783 CD GLU A 52 5.160 5.293 10.332 1.00 0.00 C ATOM 784 OE1 GLU A 52 5.116 6.538 10.500 1.00 0.00 O ATOM 785 OE2 GLU A 52 4.541 4.505 11.078 1.00 0.00 O ATOM 0 H GLU A 52 6.449 3.818 6.398 1.00 0.00 H new ATOM 0 HA GLU A 52 3.984 3.805 7.612 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.242 5.771 7.240 1.00 0.00 H new ATOM 0 HB3 GLU A 52 4.795 6.283 8.085 1.00 0.00 H new ATOM 0 HG2 GLU A 52 5.812 3.680 9.057 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.985 4.971 9.228 1.00 0.00 H new ATOM 792 N PHE A 53 3.873 6.036 5.157 1.00 0.00 N ATOM 793 CA PHE A 53 2.892 6.785 4.364 1.00 0.00 C ATOM 794 C PHE A 53 1.899 5.869 3.635 1.00 0.00 C ATOM 795 O PHE A 53 0.786 6.308 3.310 1.00 0.00 O ATOM 796 CB PHE A 53 3.610 7.673 3.336 1.00 0.00 C ATOM 797 CG PHE A 53 4.600 8.684 3.879 1.00 0.00 C ATOM 798 CD1 PHE A 53 4.330 9.388 5.069 1.00 0.00 C ATOM 799 CD2 PHE A 53 5.803 8.920 3.184 1.00 0.00 C ATOM 800 CE1 PHE A 53 5.258 10.325 5.554 1.00 0.00 C ATOM 801 CE2 PHE A 53 6.755 9.811 3.709 1.00 0.00 C ATOM 802 CZ PHE A 53 6.481 10.517 4.891 1.00 0.00 C ATOM 0 H PHE A 53 4.844 6.209 4.897 1.00 0.00 H new ATOM 0 HA PHE A 53 2.325 7.399 5.064 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.136 7.024 2.636 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.854 8.211 2.765 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.411 9.208 5.608 1.00 0.00 H new ATOM 0 HD2 PHE A 53 5.994 8.416 2.248 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.030 10.899 6.440 1.00 0.00 H new ATOM 0 HE2 PHE A 53 7.698 9.953 3.202 1.00 0.00 H new ATOM 0 HZ PHE A 53 7.210 11.207 5.290 1.00 0.00 H new ATOM 812 N ILE A 54 2.299 4.625 3.349 1.00 0.00 N ATOM 813 CA ILE A 54 1.457 3.610 2.745 1.00 0.00 C ATOM 814 C ILE A 54 0.511 3.030 3.792 1.00 0.00 C ATOM 815 O ILE A 54 -0.696 2.993 3.543 1.00 0.00 O ATOM 816 CB ILE A 54 2.275 2.520 2.025 1.00 0.00 C ATOM 817 CG1 ILE A 54 3.097 3.126 0.861 1.00 0.00 C ATOM 818 CG2 ILE A 54 1.344 1.437 1.442 1.00 0.00 C ATOM 819 CD1 ILE A 54 4.337 2.304 0.505 1.00 0.00 C ATOM 0 H ILE A 54 3.246 4.297 3.540 1.00 0.00 H new ATOM 0 HA ILE A 54 0.857 4.084 1.968 1.00 0.00 H new ATOM 0 HB ILE A 54 2.946 2.079 2.762 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.460 3.210 -0.019 1.00 0.00 H new ATOM 0 HG13 ILE A 54 3.404 4.137 1.130 1.00 0.00 H new ATOM 0 HG21 ILE A 54 1.941 0.677 0.938 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.774 0.975 2.248 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.658 1.893 0.728 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.868 2.784 -0.318 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.994 2.241 1.373 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.035 1.300 0.206 1.00 0.00 H new ATOM 831 N LEU A 55 1.062 2.516 4.894 1.00 0.00 N ATOM 832 CA LEU A 55 0.356 1.714 5.886 1.00 0.00 C ATOM 833 C LEU A 55 -0.745 2.551 6.519 1.00 0.00 C ATOM 834 O LEU A 55 -1.888 2.109 6.623 1.00 0.00 O ATOM 835 CB LEU A 55 1.322 1.238 6.985 1.00 0.00 C ATOM 836 CG LEU A 55 2.494 0.354 6.538 1.00 0.00 C ATOM 837 CD1 LEU A 55 3.656 0.536 7.516 1.00 0.00 C ATOM 838 CD2 LEU A 55 2.128 -1.131 6.404 1.00 0.00 C ATOM 0 H LEU A 55 2.046 2.654 5.125 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.072 0.843 5.390 1.00 0.00 H new ATOM 0 HB2 LEU A 55 1.730 2.117 7.483 1.00 0.00 H new ATOM 0 HB3 LEU A 55 0.746 0.688 7.729 1.00 0.00 H new ATOM 0 HG LEU A 55 2.782 0.677 5.537 1.00 0.00 H new ATOM 0 HD11 LEU A 55 4.494 -0.089 7.206 1.00 0.00 H new ATOM 0 HD12 LEU A 55 3.966 1.581 7.523 1.00 0.00 H new ATOM 0 HD13 LEU A 55 3.338 0.246 8.517 1.00 0.00 H new ATOM 0 HD21 LEU A 55 3.005 -1.694 6.085 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.784 -1.509 7.367 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.335 -1.245 5.665 1.00 0.00 H new ATOM 850 N LYS A 56 -0.407 3.789 6.892 1.00 0.00 N ATOM 851 CA LYS A 56 -1.293 4.724 7.581 1.00 0.00 C ATOM 852 C LYS A 56 -2.511 5.068 6.730 1.00 0.00 C ATOM 853 O LYS A 56 -3.499 5.591 7.244 1.00 0.00 O ATOM 854 CB LYS A 56 -0.517 6.006 7.912 1.00 0.00 C ATOM 855 CG LYS A 56 0.733 5.742 8.766 1.00 0.00 C ATOM 856 CD LYS A 56 0.573 6.072 10.245 1.00 0.00 C ATOM 857 CE LYS A 56 1.961 5.816 10.822 1.00 0.00 C ATOM 858 NZ LYS A 56 2.167 6.421 12.148 1.00 0.00 N ATOM 0 H LYS A 56 0.520 4.177 6.716 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.646 4.250 8.497 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -0.221 6.496 6.984 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.174 6.696 8.441 1.00 0.00 H new ATOM 0 HG2 LYS A 56 1.008 4.692 8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 56 1.561 6.326 8.365 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.262 7.106 10.394 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.180 5.441 10.717 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.123 4.741 10.893 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.710 6.207 10.133 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.129 6.209 12.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.043 7.451 12.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 1.475 6.031 12.819 1.00 0.00 H new ATOM 872 N ARG A 57 -2.488 4.791 5.425 1.00 0.00 N ATOM 873 CA ARG A 57 -3.662 4.985 4.591 1.00 0.00 C ATOM 874 C ARG A 57 -4.792 4.047 5.006 1.00 0.00 C ATOM 875 O ARG A 57 -5.953 4.405 4.828 1.00 0.00 O ATOM 876 CB ARG A 57 -3.278 4.777 3.123 1.00 0.00 C ATOM 877 CG ARG A 57 -4.070 5.682 2.176 1.00 0.00 C ATOM 878 CD ARG A 57 -3.829 7.184 2.399 1.00 0.00 C ATOM 879 NE ARG A 57 -2.404 7.529 2.536 1.00 0.00 N ATOM 880 CZ ARG A 57 -1.863 8.733 2.322 1.00 0.00 C ATOM 881 NH1 ARG A 57 -2.624 9.782 2.013 1.00 0.00 N ATOM 882 NH2 ARG A 57 -0.545 8.858 2.410 1.00 0.00 N ATOM 0 H ARG A 57 -1.671 4.434 4.930 1.00 0.00 H new ATOM 0 HA ARG A 57 -4.029 6.003 4.721 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -2.213 4.970 2.999 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.447 3.735 2.851 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -3.809 5.431 1.148 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.133 5.473 2.295 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.252 7.741 1.563 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.361 7.501 3.296 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.772 6.781 2.820 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.635 9.674 1.937 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.195 10.694 1.853 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.030 8.047 2.636 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.107 9.765 2.251 1.00 0.00 H new ATOM 896 N LEU A 58 -4.478 2.862 5.541 1.00 0.00 N ATOM 897 CA LEU A 58 -5.494 1.907 5.970 1.00 0.00 C ATOM 898 C LEU A 58 -6.132 2.330 7.286 1.00 0.00 C ATOM 899 O LEU A 58 -7.305 2.035 7.520 1.00 0.00 O ATOM 900 CB LEU A 58 -4.930 0.481 6.094 1.00 0.00 C ATOM 901 CG LEU A 58 -4.686 -0.288 4.781 1.00 0.00 C ATOM 902 CD1 LEU A 58 -5.947 -0.351 3.909 1.00 0.00 C ATOM 903 CD2 LEU A 58 -3.516 0.261 3.954 1.00 0.00 C ATOM 0 H LEU A 58 -3.520 2.544 5.686 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.261 1.900 5.195 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.986 0.535 6.636 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -5.616 -0.103 6.707 1.00 0.00 H new ATOM 0 HG LEU A 58 -4.417 -1.296 5.096 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.729 -0.902 2.994 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -6.743 -0.856 4.456 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.266 0.660 3.657 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -3.404 -0.330 3.045 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.713 1.300 3.690 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.598 0.203 4.539 1.00 0.00 H new ATOM 915 N ASP A 59 -5.400 3.075 8.112 1.00 0.00 N ATOM 916 CA ASP A 59 -5.889 3.658 9.358 1.00 0.00 C ATOM 917 C ASP A 59 -6.939 4.750 9.112 1.00 0.00 C ATOM 918 O ASP A 59 -7.568 5.217 10.063 1.00 0.00 O ATOM 919 CB ASP A 59 -4.717 4.263 10.133 1.00 0.00 C ATOM 920 CG ASP A 59 -3.881 3.228 10.864 1.00 0.00 C ATOM 921 OD1 ASP A 59 -4.293 2.794 11.962 1.00 0.00 O ATOM 922 OD2 ASP A 59 -2.728 2.981 10.443 1.00 0.00 O ATOM 0 H ASP A 59 -4.422 3.296 7.927 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.360 2.859 9.931 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -4.079 4.813 9.441 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -5.101 4.984 10.854 1.00 0.00 H new ATOM 927 N ASN A 60 -7.139 5.184 7.864 1.00 0.00 N ATOM 928 CA ASN A 60 -8.024 6.302 7.558 1.00 0.00 C ATOM 929 C ASN A 60 -9.505 5.924 7.729 1.00 0.00 C ATOM 930 O ASN A 60 -9.860 4.740 7.817 1.00 0.00 O ATOM 931 CB ASN A 60 -7.756 6.818 6.140 1.00 0.00 C ATOM 932 CG ASN A 60 -8.174 8.278 6.050 1.00 0.00 C ATOM 933 OD1 ASN A 60 -9.308 8.586 5.694 1.00 0.00 O ATOM 934 ND2 ASN A 60 -7.291 9.179 6.438 1.00 0.00 N ATOM 0 H ASN A 60 -6.693 4.771 7.045 1.00 0.00 H new ATOM 0 HA ASN A 60 -7.810 7.099 8.270 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -6.699 6.715 5.897 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -8.310 6.224 5.413 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -7.542 10.168 6.449 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -6.358 8.887 6.727 1.00 0.00 H new ATOM 941 N LYS A 61 -10.405 6.911 7.701 1.00 0.00 N ATOM 942 CA LYS A 61 -11.848 6.701 7.663 1.00 0.00 C ATOM 943 C LYS A 61 -12.380 6.498 6.245 1.00 0.00 C ATOM 944 O LYS A 61 -13.385 5.815 6.080 1.00 0.00 O ATOM 945 CB LYS A 61 -12.605 7.825 8.381 1.00 0.00 C ATOM 946 CG LYS A 61 -12.446 9.225 7.768 1.00 0.00 C ATOM 947 CD LYS A 61 -13.406 10.234 8.421 1.00 0.00 C ATOM 948 CE LYS A 61 -14.880 9.973 8.069 1.00 0.00 C ATOM 949 NZ LYS A 61 -15.217 10.366 6.685 1.00 0.00 N ATOM 0 H LYS A 61 -10.142 7.896 7.704 1.00 0.00 H new ATOM 0 HA LYS A 61 -12.032 5.773 8.204 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -13.665 7.573 8.397 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -12.270 7.861 9.418 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -11.418 9.565 7.894 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -12.638 9.179 6.696 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -13.284 10.195 9.503 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -13.135 11.242 8.105 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -15.099 8.914 8.205 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -15.517 10.522 8.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -16.222 10.168 6.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -15.036 11.382 6.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -14.631 9.825 6.018 1.00 0.00 H new ATOM 963 N SER A 62 -11.763 7.091 5.219 1.00 0.00 N ATOM 964 CA SER A 62 -12.320 7.029 3.873 1.00 0.00 C ATOM 965 C SER A 62 -12.204 5.591 3.343 1.00 0.00 C ATOM 966 O SER A 62 -11.114 5.015 3.370 1.00 0.00 O ATOM 967 CB SER A 62 -11.625 8.031 2.943 1.00 0.00 C ATOM 968 OG SER A 62 -12.160 7.954 1.628 1.00 0.00 O ATOM 0 H SER A 62 -10.889 7.612 5.296 1.00 0.00 H new ATOM 0 HA SER A 62 -13.374 7.306 3.905 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.749 9.042 3.332 1.00 0.00 H new ATOM 0 HB3 SER A 62 -10.554 7.828 2.917 1.00 0.00 H new ATOM 0 HG SER A 62 -12.097 8.832 1.197 1.00 0.00 H new ATOM 974 N PRO A 63 -13.280 4.999 2.796 1.00 0.00 N ATOM 975 CA PRO A 63 -13.213 3.700 2.135 1.00 0.00 C ATOM 976 C PRO A 63 -12.251 3.746 0.940 1.00 0.00 C ATOM 977 O PRO A 63 -11.480 2.816 0.713 1.00 0.00 O ATOM 978 CB PRO A 63 -14.661 3.377 1.728 1.00 0.00 C ATOM 979 CG PRO A 63 -15.300 4.755 1.614 1.00 0.00 C ATOM 980 CD PRO A 63 -14.619 5.560 2.702 1.00 0.00 C ATOM 0 HA PRO A 63 -12.817 2.919 2.784 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.703 2.833 0.784 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -15.162 2.760 2.474 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -15.134 5.193 0.630 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -16.378 4.710 1.765 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -14.587 6.620 2.449 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -15.151 5.474 3.649 1.00 0.00 H new ATOM 988 N ILE A 64 -12.298 4.817 0.153 1.00 0.00 N ATOM 989 CA ILE A 64 -11.630 4.890 -1.141 1.00 0.00 C ATOM 990 C ILE A 64 -10.133 4.937 -0.912 1.00 0.00 C ATOM 991 O ILE A 64 -9.387 4.167 -1.515 1.00 0.00 O ATOM 992 CB ILE A 64 -12.103 6.137 -1.905 1.00 0.00 C ATOM 993 CG1 ILE A 64 -13.632 6.138 -2.075 1.00 0.00 C ATOM 994 CG2 ILE A 64 -11.445 6.225 -3.282 1.00 0.00 C ATOM 995 CD1 ILE A 64 -14.210 7.523 -1.776 1.00 0.00 C ATOM 0 H ILE A 64 -12.806 5.667 0.399 1.00 0.00 H new ATOM 0 HA ILE A 64 -11.876 4.013 -1.740 1.00 0.00 H new ATOM 0 HB ILE A 64 -11.809 7.004 -1.313 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -13.890 5.843 -3.092 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -14.077 5.401 -1.407 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -11.799 7.117 -3.798 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -10.363 6.279 -3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -11.703 5.341 -3.866 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -15.292 7.501 -1.902 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -13.970 7.804 -0.750 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -13.780 8.253 -2.462 1.00 0.00 H new ATOM 1007 N VAL A 65 -9.700 5.835 -0.028 1.00 0.00 N ATOM 1008 CA VAL A 65 -8.298 5.995 0.304 1.00 0.00 C ATOM 1009 C VAL A 65 -7.733 4.659 0.809 1.00 0.00 C ATOM 1010 O VAL A 65 -6.563 4.365 0.559 1.00 0.00 O ATOM 1011 CB VAL A 65 -8.171 7.170 1.303 1.00 0.00 C ATOM 1012 CG1 VAL A 65 -8.097 6.739 2.769 1.00 0.00 C ATOM 1013 CG2 VAL A 65 -6.995 8.084 0.967 1.00 0.00 C ATOM 0 H VAL A 65 -10.319 6.470 0.476 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.694 6.253 -0.566 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.100 7.728 1.186 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.009 7.621 3.404 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -9.001 6.190 3.033 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.228 6.098 2.916 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -6.945 8.894 1.694 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -6.068 7.511 0.998 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.131 8.500 -0.031 1.00 0.00 H new ATOM 1023 N LYS A 66 -8.554 3.849 1.504 1.00 0.00 N ATOM 1024 CA LYS A 66 -8.079 2.552 1.996 1.00 0.00 C ATOM 1025 C LYS A 66 -7.834 1.672 0.776 1.00 0.00 C ATOM 1026 O LYS A 66 -6.745 1.122 0.623 1.00 0.00 O ATOM 1027 CB LYS A 66 -9.074 1.876 2.965 1.00 0.00 C ATOM 1028 CG LYS A 66 -8.823 2.102 4.467 1.00 0.00 C ATOM 1029 CD LYS A 66 -10.078 2.333 5.325 1.00 0.00 C ATOM 1030 CE LYS A 66 -11.149 1.251 5.132 1.00 0.00 C ATOM 1031 NZ LYS A 66 -12.213 1.345 6.157 1.00 0.00 N ATOM 0 H LYS A 66 -9.524 4.066 1.731 1.00 0.00 H new ATOM 0 HA LYS A 66 -7.165 2.700 2.572 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.077 2.231 2.728 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.062 0.803 2.774 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -8.290 1.237 4.862 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -8.164 2.963 4.581 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -9.791 2.367 6.376 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -10.505 3.305 5.079 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.590 1.348 4.140 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.684 0.266 5.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.075 0.881 5.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -11.897 0.875 7.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -12.415 2.345 6.357 1.00 0.00 H new ATOM 1045 N GLN A 67 -8.845 1.521 -0.089 1.00 0.00 N ATOM 1046 CA GLN A 67 -8.752 0.685 -1.278 1.00 0.00 C ATOM 1047 C GLN A 67 -7.551 1.091 -2.133 1.00 0.00 C ATOM 1048 O GLN A 67 -6.793 0.212 -2.530 1.00 0.00 O ATOM 1049 CB GLN A 67 -10.085 0.683 -2.052 1.00 0.00 C ATOM 1050 CG GLN A 67 -10.104 -0.319 -3.223 1.00 0.00 C ATOM 1051 CD GLN A 67 -9.569 0.228 -4.549 1.00 0.00 C ATOM 1052 OE1 GLN A 67 -9.134 1.365 -4.680 1.00 0.00 O ATOM 1053 NE2 GLN A 67 -9.548 -0.597 -5.580 1.00 0.00 N ATOM 0 H GLN A 67 -9.750 1.979 0.022 1.00 0.00 H new ATOM 0 HA GLN A 67 -8.576 -0.347 -0.976 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -10.897 0.445 -1.365 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -10.277 1.685 -2.436 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -9.516 -1.193 -2.944 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -11.128 -0.659 -3.374 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -9.908 -1.546 -5.481 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -9.172 -0.285 -6.475 1.00 0.00 H new ATOM 1062 N LYS A 68 -7.327 2.380 -2.407 1.00 0.00 N ATOM 1063 CA LYS A 68 -6.280 2.807 -3.339 1.00 0.00 C ATOM 1064 C LYS A 68 -4.872 2.385 -2.895 1.00 0.00 C ATOM 1065 O LYS A 68 -4.034 2.161 -3.771 1.00 0.00 O ATOM 1066 CB LYS A 68 -6.326 4.336 -3.512 1.00 0.00 C ATOM 1067 CG LYS A 68 -7.547 4.879 -4.272 1.00 0.00 C ATOM 1068 CD LYS A 68 -7.178 5.993 -5.272 1.00 0.00 C ATOM 1069 CE LYS A 68 -8.458 6.615 -5.823 1.00 0.00 C ATOM 1070 NZ LYS A 68 -8.245 7.734 -6.760 1.00 0.00 N ATOM 0 H LYS A 68 -7.858 3.147 -1.995 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.481 2.309 -4.287 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -6.300 4.797 -2.525 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.424 4.652 -4.035 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -8.030 4.061 -4.807 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.273 5.265 -3.556 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.572 6.754 -4.780 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -6.578 5.584 -6.085 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -9.034 5.840 -6.329 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -9.063 6.968 -4.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -8.938 7.676 -7.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.363 8.636 -6.256 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.284 7.680 -7.153 1.00 0.00 H new ATOM 1084 N ALA A 69 -4.595 2.264 -1.592 1.00 0.00 N ATOM 1085 CA ALA A 69 -3.326 1.766 -1.080 1.00 0.00 C ATOM 1086 C ALA A 69 -3.135 0.283 -1.405 1.00 0.00 C ATOM 1087 O ALA A 69 -2.034 -0.146 -1.733 1.00 0.00 O ATOM 1088 CB ALA A 69 -3.293 1.970 0.434 1.00 0.00 C ATOM 0 H ALA A 69 -5.259 2.514 -0.859 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.516 2.318 -1.557 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.347 1.601 0.830 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.392 3.032 0.660 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -4.117 1.423 0.893 1.00 0.00 H new ATOM 1094 N LEU A 70 -4.192 -0.522 -1.328 1.00 0.00 N ATOM 1095 CA LEU A 70 -4.096 -1.980 -1.411 1.00 0.00 C ATOM 1096 C LEU A 70 -3.482 -2.440 -2.738 1.00 0.00 C ATOM 1097 O LEU A 70 -2.556 -3.257 -2.737 1.00 0.00 O ATOM 1098 CB LEU A 70 -5.481 -2.594 -1.163 1.00 0.00 C ATOM 1099 CG LEU A 70 -6.028 -2.328 0.251 1.00 0.00 C ATOM 1100 CD1 LEU A 70 -7.485 -2.767 0.362 1.00 0.00 C ATOM 1101 CD2 LEU A 70 -5.173 -3.006 1.325 1.00 0.00 C ATOM 0 H LEU A 70 -5.145 -0.181 -1.206 1.00 0.00 H new ATOM 0 HA LEU A 70 -3.417 -2.335 -0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.183 -2.196 -1.896 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.427 -3.670 -1.326 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.979 -1.253 0.423 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.849 -2.569 1.370 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -8.088 -2.212 -0.357 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.561 -3.834 0.152 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.591 -2.795 2.309 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.165 -4.083 1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.154 -2.623 1.274 1.00 0.00 H new ATOM 1113 N ARG A 71 -3.925 -1.879 -3.872 1.00 0.00 N ATOM 1114 CA ARG A 71 -3.315 -2.152 -5.177 1.00 0.00 C ATOM 1115 C ARG A 71 -1.890 -1.626 -5.293 1.00 0.00 C ATOM 1116 O ARG A 71 -1.128 -2.189 -6.077 1.00 0.00 O ATOM 1117 CB ARG A 71 -4.184 -1.623 -6.334 1.00 0.00 C ATOM 1118 CG ARG A 71 -4.450 -0.101 -6.352 1.00 0.00 C ATOM 1119 CD ARG A 71 -5.620 0.188 -7.303 1.00 0.00 C ATOM 1120 NE ARG A 71 -6.148 1.554 -7.194 1.00 0.00 N ATOM 1121 CZ ARG A 71 -7.406 1.914 -7.485 1.00 0.00 C ATOM 1122 NH1 ARG A 71 -8.288 1.028 -7.936 1.00 0.00 N ATOM 1123 NH2 ARG A 71 -7.775 3.178 -7.316 1.00 0.00 N ATOM 0 H ARG A 71 -4.710 -1.229 -3.909 1.00 0.00 H new ATOM 0 HA ARG A 71 -3.260 -3.238 -5.255 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.705 -1.897 -7.274 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.144 -2.138 -6.303 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.684 0.253 -5.348 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.558 0.434 -6.678 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -5.294 0.015 -8.329 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -6.424 -0.520 -7.101 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.510 2.283 -6.873 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -8.012 0.055 -8.066 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -9.241 1.321 -8.152 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -7.104 3.863 -6.968 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -8.729 3.464 -7.534 1.00 0.00 H new ATOM 1137 N LEU A 72 -1.539 -0.550 -4.589 1.00 0.00 N ATOM 1138 CA LEU A 72 -0.190 0.006 -4.591 1.00 0.00 C ATOM 1139 C LEU A 72 0.769 -0.927 -3.842 1.00 0.00 C ATOM 1140 O LEU A 72 1.911 -1.075 -4.278 1.00 0.00 O ATOM 1141 CB LEU A 72 -0.232 1.427 -3.990 1.00 0.00 C ATOM 1142 CG LEU A 72 1.136 2.082 -3.737 1.00 0.00 C ATOM 1143 CD1 LEU A 72 1.958 2.292 -5.013 1.00 0.00 C ATOM 1144 CD2 LEU A 72 0.926 3.409 -3.003 1.00 0.00 C ATOM 0 H LEU A 72 -2.191 -0.036 -3.996 1.00 0.00 H new ATOM 0 HA LEU A 72 0.188 0.086 -5.610 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -0.804 2.069 -4.660 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.776 1.387 -3.046 1.00 0.00 H new ATOM 0 HG LEU A 72 1.718 1.396 -3.122 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.910 2.758 -4.760 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.141 1.329 -5.491 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.409 2.938 -5.698 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.892 3.880 -2.820 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.310 4.069 -3.614 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.426 3.224 -2.052 1.00 0.00 H new ATOM 1156 N ILE A 73 0.320 -1.562 -2.749 1.00 0.00 N ATOM 1157 CA ILE A 73 1.162 -2.381 -1.879 1.00 0.00 C ATOM 1158 C ILE A 73 1.669 -3.559 -2.698 1.00 0.00 C ATOM 1159 O ILE A 73 2.825 -3.594 -3.101 1.00 0.00 O ATOM 1160 CB ILE A 73 0.435 -2.769 -0.567 1.00 0.00 C ATOM 1161 CG1 ILE A 73 0.237 -1.531 0.332 1.00 0.00 C ATOM 1162 CG2 ILE A 73 1.257 -3.808 0.226 1.00 0.00 C ATOM 1163 CD1 ILE A 73 -0.858 -1.696 1.393 1.00 0.00 C ATOM 0 H ILE A 73 -0.652 -1.517 -2.445 1.00 0.00 H new ATOM 0 HA ILE A 73 2.027 -1.817 -1.531 1.00 0.00 H new ATOM 0 HB ILE A 73 -0.532 -3.190 -0.843 1.00 0.00 H new ATOM 0 HG12 ILE A 73 1.179 -1.303 0.830 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -0.007 -0.674 -0.296 1.00 0.00 H new ATOM 0 HG21 ILE A 73 0.728 -4.067 1.144 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.392 -4.704 -0.380 1.00 0.00 H new ATOM 0 HG23 ILE A 73 2.232 -3.388 0.475 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.934 -0.782 1.983 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -1.812 -1.893 0.904 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -0.607 -2.531 2.048 1.00 0.00 H new ATOM 1175 N LYS A 74 0.796 -4.521 -2.983 1.00 0.00 N ATOM 1176 CA LYS A 74 1.149 -5.762 -3.668 1.00 0.00 C ATOM 1177 C LYS A 74 1.788 -5.585 -5.039 1.00 0.00 C ATOM 1178 O LYS A 74 2.399 -6.528 -5.541 1.00 0.00 O ATOM 1179 CB LYS A 74 -0.086 -6.654 -3.783 1.00 0.00 C ATOM 1180 CG LYS A 74 -1.308 -5.959 -4.413 1.00 0.00 C ATOM 1181 CD LYS A 74 -1.621 -6.619 -5.757 1.00 0.00 C ATOM 1182 CE LYS A 74 -2.752 -5.934 -6.515 1.00 0.00 C ATOM 1183 NZ LYS A 74 -4.080 -6.272 -5.948 1.00 0.00 N ATOM 0 H LYS A 74 -0.193 -4.460 -2.741 1.00 0.00 H new ATOM 0 HA LYS A 74 1.917 -6.227 -3.051 1.00 0.00 H new ATOM 0 HB2 LYS A 74 0.167 -7.531 -4.379 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.357 -7.011 -2.789 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.168 -6.034 -3.748 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -1.106 -4.897 -4.553 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -0.723 -6.613 -6.375 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -1.886 -7.663 -5.589 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.608 -4.854 -6.484 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -2.718 -6.230 -7.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.823 -5.787 -6.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.228 -7.300 -6.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.121 -5.966 -4.955 1.00 0.00 H new ATOM 1197 N TYR A 75 1.632 -4.422 -5.667 1.00 0.00 N ATOM 1198 CA TYR A 75 2.380 -4.126 -6.870 1.00 0.00 C ATOM 1199 C TYR A 75 3.850 -3.919 -6.499 1.00 0.00 C ATOM 1200 O TYR A 75 4.709 -4.639 -7.000 1.00 0.00 O ATOM 1201 CB TYR A 75 1.757 -2.923 -7.583 1.00 0.00 C ATOM 1202 CG TYR A 75 2.379 -2.539 -8.921 1.00 0.00 C ATOM 1203 CD1 TYR A 75 2.980 -3.505 -9.760 1.00 0.00 C ATOM 1204 CD2 TYR A 75 2.342 -1.193 -9.341 1.00 0.00 C ATOM 1205 CE1 TYR A 75 3.525 -3.137 -11.003 1.00 0.00 C ATOM 1206 CE2 TYR A 75 2.863 -0.828 -10.592 1.00 0.00 C ATOM 1207 CZ TYR A 75 3.441 -1.798 -11.439 1.00 0.00 C ATOM 1208 OH TYR A 75 3.870 -1.442 -12.678 1.00 0.00 O ATOM 0 H TYR A 75 1.000 -3.682 -5.362 1.00 0.00 H new ATOM 0 HA TYR A 75 2.337 -4.956 -7.575 1.00 0.00 H new ATOM 0 HB2 TYR A 75 0.699 -3.130 -7.744 1.00 0.00 H new ATOM 0 HB3 TYR A 75 1.816 -2.062 -6.918 1.00 0.00 H new ATOM 0 HD1 TYR A 75 3.021 -4.537 -9.443 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.911 -0.440 -8.697 1.00 0.00 H new ATOM 0 HE1 TYR A 75 4.007 -3.878 -11.623 1.00 0.00 H new ATOM 0 HE2 TYR A 75 2.821 0.204 -10.909 1.00 0.00 H new ATOM 0 HH TYR A 75 3.758 -2.197 -13.292 1.00 0.00 H new ATOM 1218 N ALA A 76 4.134 -2.951 -5.621 1.00 0.00 N ATOM 1219 CA ALA A 76 5.486 -2.574 -5.235 1.00 0.00 C ATOM 1220 C ALA A 76 6.223 -3.676 -4.466 1.00 0.00 C ATOM 1221 O ALA A 76 7.413 -3.866 -4.707 1.00 0.00 O ATOM 1222 CB ALA A 76 5.422 -1.294 -4.396 1.00 0.00 C ATOM 0 H ALA A 76 3.413 -2.401 -5.154 1.00 0.00 H new ATOM 0 HA ALA A 76 6.057 -2.408 -6.149 1.00 0.00 H new ATOM 0 HB1 ALA A 76 6.430 -1.002 -4.101 1.00 0.00 H new ATOM 0 HB2 ALA A 76 4.970 -0.495 -4.984 1.00 0.00 H new ATOM 0 HB3 ALA A 76 4.820 -1.473 -3.505 1.00 0.00 H new ATOM 1228 N VAL A 77 5.530 -4.399 -3.573 1.00 0.00 N ATOM 1229 CA VAL A 77 6.086 -5.471 -2.736 1.00 0.00 C ATOM 1230 C VAL A 77 6.930 -6.432 -3.579 1.00 0.00 C ATOM 1231 O VAL A 77 8.045 -6.784 -3.196 1.00 0.00 O ATOM 1232 CB VAL A 77 4.955 -6.208 -1.978 1.00 0.00 C ATOM 1233 CG1 VAL A 77 5.504 -7.432 -1.243 1.00 0.00 C ATOM 1234 CG2 VAL A 77 4.301 -5.367 -0.872 1.00 0.00 C ATOM 0 H VAL A 77 4.535 -4.248 -3.409 1.00 0.00 H new ATOM 0 HA VAL A 77 6.746 -5.029 -1.990 1.00 0.00 H new ATOM 0 HB VAL A 77 4.230 -6.452 -2.755 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.692 -7.935 -0.717 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.951 -8.118 -1.962 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.261 -7.116 -0.525 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.519 -5.950 -0.386 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.054 -5.085 -0.136 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.866 -4.468 -1.308 1.00 0.00 H new ATOM 1244 N GLY A 78 6.412 -6.836 -4.739 1.00 0.00 N ATOM 1245 CA GLY A 78 7.052 -7.811 -5.605 1.00 0.00 C ATOM 1246 C GLY A 78 8.186 -7.243 -6.458 1.00 0.00 C ATOM 1247 O GLY A 78 8.471 -7.829 -7.506 1.00 0.00 O ATOM 0 H GLY A 78 5.525 -6.488 -5.103 1.00 0.00 H new ATOM 0 HA2 GLY A 78 7.445 -8.622 -4.992 1.00 0.00 H new ATOM 0 HA3 GLY A 78 6.299 -8.245 -6.263 1.00 0.00 H new ATOM 1251 N LYS A 79 8.772 -6.087 -6.108 1.00 0.00 N ATOM 1252 CA LYS A 79 9.766 -5.400 -6.945 1.00 0.00 C ATOM 1253 C LYS A 79 10.883 -4.785 -6.111 1.00 0.00 C ATOM 1254 O LYS A 79 12.054 -4.918 -6.462 1.00 0.00 O ATOM 1255 CB LYS A 79 9.098 -4.299 -7.793 1.00 0.00 C ATOM 1256 CG LYS A 79 7.887 -4.808 -8.567 1.00 0.00 C ATOM 1257 CD LYS A 79 7.436 -3.862 -9.688 1.00 0.00 C ATOM 1258 CE LYS A 79 6.851 -4.653 -10.862 1.00 0.00 C ATOM 1259 NZ LYS A 79 7.837 -5.562 -11.494 1.00 0.00 N ATOM 0 H LYS A 79 8.569 -5.602 -5.234 1.00 0.00 H new ATOM 0 HA LYS A 79 10.202 -6.153 -7.601 1.00 0.00 H new ATOM 0 HB2 LYS A 79 8.791 -3.481 -7.142 1.00 0.00 H new ATOM 0 HB3 LYS A 79 9.827 -3.892 -8.493 1.00 0.00 H new ATOM 0 HG2 LYS A 79 8.123 -5.781 -8.997 1.00 0.00 H new ATOM 0 HG3 LYS A 79 7.059 -4.958 -7.874 1.00 0.00 H new ATOM 0 HD2 LYS A 79 6.690 -3.166 -9.305 1.00 0.00 H new ATOM 0 HD3 LYS A 79 8.282 -3.266 -10.030 1.00 0.00 H new ATOM 0 HE2 LYS A 79 5.999 -5.236 -10.512 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.474 -3.956 -11.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.600 -5.686 -12.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 8.790 -5.153 -11.411 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 7.814 -6.485 -11.016 1.00 0.00 H new ATOM 1273 N SER A 80 10.503 -4.119 -5.027 1.00 0.00 N ATOM 1274 CA SER A 80 11.260 -3.183 -4.218 1.00 0.00 C ATOM 1275 C SER A 80 12.660 -3.605 -3.737 1.00 0.00 C ATOM 1276 O SER A 80 13.469 -2.719 -3.450 1.00 0.00 O ATOM 1277 CB SER A 80 10.326 -2.817 -3.056 1.00 0.00 C ATOM 1278 OG SER A 80 9.635 -3.948 -2.553 1.00 0.00 O ATOM 0 H SER A 80 9.559 -4.237 -4.659 1.00 0.00 H new ATOM 0 HA SER A 80 11.534 -2.339 -4.852 1.00 0.00 H new ATOM 0 HB2 SER A 80 10.907 -2.361 -2.254 1.00 0.00 H new ATOM 0 HB3 SER A 80 9.605 -2.071 -3.391 1.00 0.00 H new ATOM 0 HG SER A 80 8.686 -3.882 -2.787 1.00 0.00 H new ATOM 1284 N GLY A 81 12.993 -4.896 -3.640 1.00 0.00 N ATOM 1285 CA GLY A 81 14.301 -5.382 -3.190 1.00 0.00 C ATOM 1286 C GLY A 81 14.139 -6.273 -1.962 1.00 0.00 C ATOM 1287 O GLY A 81 13.368 -7.231 -2.024 1.00 0.00 O ATOM 0 H GLY A 81 12.347 -5.648 -3.877 1.00 0.00 H new ATOM 0 HA2 GLY A 81 14.785 -5.940 -3.992 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.949 -4.538 -2.953 1.00 0.00 H new ATOM 1291 N SER A 82 14.797 -5.984 -0.832 1.00 0.00 N ATOM 1292 CA SER A 82 14.692 -6.809 0.373 1.00 0.00 C ATOM 1293 C SER A 82 14.196 -6.060 1.613 1.00 0.00 C ATOM 1294 O SER A 82 13.522 -6.683 2.422 1.00 0.00 O ATOM 1295 CB SER A 82 16.026 -7.530 0.630 1.00 0.00 C ATOM 1296 OG SER A 82 15.793 -8.844 1.102 1.00 0.00 O ATOM 0 H SER A 82 15.412 -5.177 -0.730 1.00 0.00 H new ATOM 0 HA SER A 82 13.914 -7.547 0.178 1.00 0.00 H new ATOM 0 HB2 SER A 82 16.611 -7.565 -0.289 1.00 0.00 H new ATOM 0 HB3 SER A 82 16.613 -6.973 1.360 1.00 0.00 H new ATOM 0 HG SER A 82 16.650 -9.292 1.260 1.00 0.00 H new ATOM 1302 N GLU A 83 14.460 -4.763 1.771 1.00 0.00 N ATOM 1303 CA GLU A 83 14.009 -3.974 2.921 1.00 0.00 C ATOM 1304 C GLU A 83 12.476 -3.864 2.953 1.00 0.00 C ATOM 1305 O GLU A 83 11.833 -4.301 3.908 1.00 0.00 O ATOM 1306 CB GLU A 83 14.665 -2.583 2.863 1.00 0.00 C ATOM 1307 CG GLU A 83 16.170 -2.591 3.192 1.00 0.00 C ATOM 1308 CD GLU A 83 16.959 -1.642 2.282 1.00 0.00 C ATOM 1309 OE1 GLU A 83 16.625 -0.447 2.182 1.00 0.00 O ATOM 1310 OE2 GLU A 83 17.864 -2.119 1.557 1.00 0.00 O ATOM 0 H GLU A 83 15.000 -4.222 1.096 1.00 0.00 H new ATOM 0 HA GLU A 83 14.311 -4.475 3.840 1.00 0.00 H new ATOM 0 HB2 GLU A 83 14.523 -2.166 1.866 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.153 -1.921 3.562 1.00 0.00 H new ATOM 0 HG2 GLU A 83 16.316 -2.301 4.233 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.560 -3.603 3.086 1.00 0.00 H new ATOM 1317 N PHE A 84 11.876 -3.258 1.925 1.00 0.00 N ATOM 1318 CA PHE A 84 10.457 -2.902 1.903 1.00 0.00 C ATOM 1319 C PHE A 84 9.567 -4.121 2.095 1.00 0.00 C ATOM 1320 O PHE A 84 8.566 -4.044 2.816 1.00 0.00 O ATOM 1321 CB PHE A 84 10.112 -2.198 0.587 1.00 0.00 C ATOM 1322 CG PHE A 84 8.639 -1.864 0.436 1.00 0.00 C ATOM 1323 CD1 PHE A 84 8.100 -0.706 1.031 1.00 0.00 C ATOM 1324 CD2 PHE A 84 7.789 -2.739 -0.266 1.00 0.00 C ATOM 1325 CE1 PHE A 84 6.727 -0.431 0.919 1.00 0.00 C ATOM 1326 CE2 PHE A 84 6.421 -2.462 -0.381 1.00 0.00 C ATOM 1327 CZ PHE A 84 5.883 -1.312 0.220 1.00 0.00 C ATOM 0 H PHE A 84 12.371 -2.997 1.072 1.00 0.00 H new ATOM 0 HA PHE A 84 10.272 -2.223 2.736 1.00 0.00 H new ATOM 0 HB2 PHE A 84 10.692 -1.278 0.515 1.00 0.00 H new ATOM 0 HB3 PHE A 84 10.418 -2.833 -0.244 1.00 0.00 H new ATOM 0 HD1 PHE A 84 8.743 -0.029 1.574 1.00 0.00 H new ATOM 0 HD2 PHE A 84 8.195 -3.631 -0.720 1.00 0.00 H new ATOM 0 HE1 PHE A 84 6.318 0.460 1.371 1.00 0.00 H new ATOM 0 HE2 PHE A 84 5.779 -3.133 -0.932 1.00 0.00 H new ATOM 0 HZ PHE A 84 4.826 -1.105 0.146 1.00 0.00 H new ATOM 1337 N ARG A 85 9.941 -5.262 1.504 1.00 0.00 N ATOM 1338 CA ARG A 85 9.136 -6.467 1.626 1.00 0.00 C ATOM 1339 C ARG A 85 9.040 -6.946 3.078 1.00 0.00 C ATOM 1340 O ARG A 85 8.204 -7.797 3.360 1.00 0.00 O ATOM 1341 CB ARG A 85 9.639 -7.598 0.710 1.00 0.00 C ATOM 1342 CG ARG A 85 11.075 -8.043 1.025 1.00 0.00 C ATOM 1343 CD ARG A 85 11.360 -9.437 0.473 1.00 0.00 C ATOM 1344 NE ARG A 85 12.739 -9.873 0.752 1.00 0.00 N ATOM 1345 CZ ARG A 85 13.272 -11.013 0.293 1.00 0.00 C ATOM 1346 NH1 ARG A 85 12.555 -11.886 -0.394 1.00 0.00 N ATOM 1347 NH2 ARG A 85 14.546 -11.302 0.508 1.00 0.00 N ATOM 0 H ARG A 85 10.787 -5.369 0.944 1.00 0.00 H new ATOM 0 HA ARG A 85 8.132 -6.199 1.296 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.972 -8.455 0.803 1.00 0.00 H new ATOM 0 HB3 ARG A 85 9.588 -7.266 -0.327 1.00 0.00 H new ATOM 0 HG2 ARG A 85 11.780 -7.330 0.598 1.00 0.00 H new ATOM 0 HG3 ARG A 85 11.231 -8.038 2.104 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.660 -10.149 0.910 1.00 0.00 H new ATOM 0 HD3 ARG A 85 11.190 -9.442 -0.604 1.00 0.00 H new ATOM 0 HE ARG A 85 13.324 -9.270 1.330 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.571 -11.699 -0.586 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.986 -12.746 -0.732 1.00 0.00 H new ATOM 0 HH21 ARG A 85 15.135 -10.653 1.029 1.00 0.00 H new ATOM 0 HH22 ARG A 85 14.938 -12.174 0.152 1.00 0.00 H new ATOM 1361 N ARG A 86 9.863 -6.457 4.010 1.00 0.00 N ATOM 1362 CA ARG A 86 9.774 -6.829 5.420 1.00 0.00 C ATOM 1363 C ARG A 86 9.026 -5.752 6.191 1.00 0.00 C ATOM 1364 O ARG A 86 8.187 -6.084 7.021 1.00 0.00 O ATOM 1365 CB ARG A 86 11.175 -7.098 5.987 1.00 0.00 C ATOM 1366 CG ARG A 86 12.002 -8.087 5.146 1.00 0.00 C ATOM 1367 CD ARG A 86 11.313 -9.371 4.671 1.00 0.00 C ATOM 1368 NE ARG A 86 10.901 -10.256 5.760 1.00 0.00 N ATOM 1369 CZ ARG A 86 10.616 -11.552 5.637 1.00 0.00 C ATOM 1370 NH1 ARG A 86 10.766 -12.155 4.464 1.00 0.00 N ATOM 1371 NH2 ARG A 86 10.164 -12.230 6.681 1.00 0.00 N ATOM 0 H ARG A 86 10.609 -5.792 3.806 1.00 0.00 H new ATOM 0 HA ARG A 86 9.208 -7.754 5.525 1.00 0.00 H new ATOM 0 HB2 ARG A 86 11.716 -6.154 6.059 1.00 0.00 H new ATOM 0 HB3 ARG A 86 11.079 -7.488 7.000 1.00 0.00 H new ATOM 0 HG2 ARG A 86 12.365 -7.556 4.266 1.00 0.00 H new ATOM 0 HG3 ARG A 86 12.877 -8.373 5.729 1.00 0.00 H new ATOM 0 HD2 ARG A 86 10.437 -9.105 4.080 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.990 -9.913 4.011 1.00 0.00 H new ATOM 0 HE ARG A 86 10.825 -9.847 6.691 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.099 -11.626 3.658 1.00 0.00 H new ATOM 0 HH12 ARG A 86 10.548 -13.147 4.369 1.00 0.00 H new ATOM 0 HH21 ARG A 86 10.035 -11.760 7.577 1.00 0.00 H new ATOM 0 HH22 ARG A 86 9.945 -13.222 6.589 1.00 0.00 H new ATOM 1385 N GLU A 87 9.226 -4.474 5.874 1.00 0.00 N ATOM 1386 CA GLU A 87 8.526 -3.365 6.525 1.00 0.00 C ATOM 1387 C GLU A 87 7.012 -3.433 6.335 1.00 0.00 C ATOM 1388 O GLU A 87 6.270 -3.113 7.267 1.00 0.00 O ATOM 1389 CB GLU A 87 9.123 -2.034 6.041 1.00 0.00 C ATOM 1390 CG GLU A 87 10.577 -1.844 6.514 1.00 0.00 C ATOM 1391 CD GLU A 87 10.703 -1.937 8.042 1.00 0.00 C ATOM 1392 OE1 GLU A 87 10.845 -3.061 8.577 1.00 0.00 O ATOM 1393 OE2 GLU A 87 10.595 -0.890 8.716 1.00 0.00 O ATOM 0 H GLU A 87 9.883 -4.175 5.153 1.00 0.00 H new ATOM 0 HA GLU A 87 8.678 -3.443 7.602 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.089 -1.997 4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.512 -1.209 6.408 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.210 -2.601 6.051 1.00 0.00 H new ATOM 0 HG3 GLU A 87 10.943 -0.874 6.179 1.00 0.00 H new ATOM 1400 N MET A 88 6.546 -3.931 5.191 1.00 0.00 N ATOM 1401 CA MET A 88 5.132 -4.218 4.979 1.00 0.00 C ATOM 1402 C MET A 88 4.644 -5.363 5.877 1.00 0.00 C ATOM 1403 O MET A 88 3.508 -5.314 6.343 1.00 0.00 O ATOM 1404 CB MET A 88 4.922 -4.548 3.502 1.00 0.00 C ATOM 1405 CG MET A 88 5.011 -3.290 2.638 1.00 0.00 C ATOM 1406 SD MET A 88 3.513 -2.268 2.658 1.00 0.00 S ATOM 1407 CE MET A 88 4.124 -0.841 3.576 1.00 0.00 C ATOM 0 H MET A 88 7.138 -4.146 4.388 1.00 0.00 H new ATOM 0 HA MET A 88 4.543 -3.342 5.250 1.00 0.00 H new ATOM 0 HB2 MET A 88 5.672 -5.269 3.177 1.00 0.00 H new ATOM 0 HB3 MET A 88 3.948 -5.018 3.366 1.00 0.00 H new ATOM 0 HG2 MET A 88 5.853 -2.688 2.979 1.00 0.00 H new ATOM 0 HG3 MET A 88 5.224 -3.583 1.610 1.00 0.00 H new ATOM 0 HE1 MET A 88 3.360 -0.063 3.590 1.00 0.00 H new ATOM 0 HE2 MET A 88 4.357 -1.139 4.598 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.024 -0.457 3.095 1.00 0.00 H new ATOM 1417 N GLN A 89 5.462 -6.387 6.155 1.00 0.00 N ATOM 1418 CA GLN A 89 5.102 -7.444 7.099 1.00 0.00 C ATOM 1419 C GLN A 89 4.959 -6.883 8.511 1.00 0.00 C ATOM 1420 O GLN A 89 4.005 -7.232 9.208 1.00 0.00 O ATOM 1421 CB GLN A 89 6.118 -8.594 7.116 1.00 0.00 C ATOM 1422 CG GLN A 89 6.212 -9.337 5.791 1.00 0.00 C ATOM 1423 CD GLN A 89 7.048 -10.606 5.911 1.00 0.00 C ATOM 1424 OE1 GLN A 89 7.340 -11.093 7.004 1.00 0.00 O ATOM 1425 NE2 GLN A 89 7.437 -11.162 4.782 1.00 0.00 N ATOM 0 H GLN A 89 6.384 -6.502 5.734 1.00 0.00 H new ATOM 0 HA GLN A 89 4.147 -7.844 6.758 1.00 0.00 H new ATOM 0 HB2 GLN A 89 7.100 -8.197 7.372 1.00 0.00 H new ATOM 0 HB3 GLN A 89 5.844 -9.299 7.901 1.00 0.00 H new ATOM 0 HG2 GLN A 89 5.210 -9.593 5.446 1.00 0.00 H new ATOM 0 HG3 GLN A 89 6.651 -8.683 5.038 1.00 0.00 H new ATOM 0 HE21 GLN A 89 7.181 -10.738 3.890 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.994 -12.016 4.800 1.00 0.00 H new ATOM 1434 N ARG A 90 5.886 -6.023 8.953 1.00 0.00 N ATOM 1435 CA ARG A 90 5.902 -5.521 10.334 1.00 0.00 C ATOM 1436 C ARG A 90 4.605 -4.813 10.715 1.00 0.00 C ATOM 1437 O ARG A 90 4.220 -4.839 11.883 1.00 0.00 O ATOM 1438 CB ARG A 90 7.086 -4.571 10.573 1.00 0.00 C ATOM 1439 CG ARG A 90 8.444 -5.212 10.254 1.00 0.00 C ATOM 1440 CD ARG A 90 9.581 -4.610 11.079 1.00 0.00 C ATOM 1441 NE ARG A 90 9.532 -5.066 12.476 1.00 0.00 N ATOM 1442 CZ ARG A 90 10.334 -4.644 13.454 1.00 0.00 C ATOM 1443 NH1 ARG A 90 11.285 -3.745 13.236 1.00 0.00 N ATOM 1444 NH2 ARG A 90 10.165 -5.132 14.672 1.00 0.00 N ATOM 0 H ARG A 90 6.639 -5.658 8.370 1.00 0.00 H new ATOM 0 HA ARG A 90 6.009 -6.400 10.969 1.00 0.00 H new ATOM 0 HB2 ARG A 90 6.958 -3.679 9.960 1.00 0.00 H new ATOM 0 HB3 ARG A 90 7.079 -4.246 11.613 1.00 0.00 H new ATOM 0 HG2 ARG A 90 8.390 -6.284 10.443 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.662 -5.086 9.194 1.00 0.00 H new ATOM 0 HD2 ARG A 90 10.538 -4.887 10.638 1.00 0.00 H new ATOM 0 HD3 ARG A 90 9.519 -3.522 11.048 1.00 0.00 H new ATOM 0 HE ARG A 90 8.827 -5.762 12.717 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.417 -3.359 12.301 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.884 -3.440 14.003 1.00 0.00 H new ATOM 0 HH21 ARG A 90 9.432 -5.818 14.849 1.00 0.00 H new ATOM 0 HH22 ARG A 90 10.768 -4.822 15.434 1.00 0.00 H new ATOM 1458 N ASN A 91 3.918 -4.213 9.742 1.00 0.00 N ATOM 1459 CA ASN A 91 2.694 -3.451 9.958 1.00 0.00 C ATOM 1460 C ASN A 91 1.526 -4.019 9.146 1.00 0.00 C ATOM 1461 O ASN A 91 0.545 -3.328 8.878 1.00 0.00 O ATOM 1462 CB ASN A 91 2.978 -1.958 9.751 1.00 0.00 C ATOM 1463 CG ASN A 91 3.922 -1.411 10.825 1.00 0.00 C ATOM 1464 OD1 ASN A 91 3.675 -1.546 12.022 1.00 0.00 O ATOM 1465 ND2 ASN A 91 5.042 -0.814 10.455 1.00 0.00 N ATOM 0 H ASN A 91 4.205 -4.246 8.764 1.00 0.00 H new ATOM 0 HA ASN A 91 2.361 -3.552 10.991 1.00 0.00 H new ATOM 0 HB2 ASN A 91 3.418 -1.804 8.766 1.00 0.00 H new ATOM 0 HB3 ASN A 91 2.041 -1.402 9.772 1.00 0.00 H new ATOM 0 HD21 ASN A 91 5.693 -0.470 11.160 1.00 0.00 H new ATOM 0 HD22 ASN A 91 5.255 -0.698 9.464 1.00 0.00 H new ATOM 1472 N SER A 92 1.600 -5.297 8.747 1.00 0.00 N ATOM 1473 CA SER A 92 0.610 -5.907 7.862 1.00 0.00 C ATOM 1474 C SER A 92 -0.795 -5.966 8.463 1.00 0.00 C ATOM 1475 O SER A 92 -1.768 -6.126 7.720 1.00 0.00 O ATOM 1476 CB SER A 92 1.073 -7.306 7.455 1.00 0.00 C ATOM 1477 OG SER A 92 1.003 -8.247 8.516 1.00 0.00 O ATOM 0 H SER A 92 2.347 -5.931 9.030 1.00 0.00 H new ATOM 0 HA SER A 92 0.536 -5.265 6.985 1.00 0.00 H new ATOM 0 HB2 SER A 92 0.461 -7.658 6.625 1.00 0.00 H new ATOM 0 HB3 SER A 92 2.100 -7.251 7.093 1.00 0.00 H new ATOM 0 HG SER A 92 1.174 -9.147 8.167 1.00 0.00 H new ATOM 1483 N VAL A 93 -0.912 -5.850 9.791 1.00 0.00 N ATOM 1484 CA VAL A 93 -2.186 -5.888 10.487 1.00 0.00 C ATOM 1485 C VAL A 93 -3.102 -4.802 9.948 1.00 0.00 C ATOM 1486 O VAL A 93 -4.303 -5.028 9.870 1.00 0.00 O ATOM 1487 CB VAL A 93 -1.995 -5.805 12.014 1.00 0.00 C ATOM 1488 CG1 VAL A 93 -1.429 -4.475 12.508 1.00 0.00 C ATOM 1489 CG2 VAL A 93 -3.275 -6.161 12.775 1.00 0.00 C ATOM 0 H VAL A 93 -0.112 -5.726 10.411 1.00 0.00 H new ATOM 0 HA VAL A 93 -2.667 -6.848 10.298 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.237 -6.557 12.233 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -1.327 -4.503 13.593 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -0.452 -4.305 12.056 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -2.104 -3.666 12.228 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.093 -6.089 13.847 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.069 -5.469 12.495 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.575 -7.179 12.526 1.00 0.00 H new ATOM 1499 N ALA A 94 -2.556 -3.666 9.501 1.00 0.00 N ATOM 1500 CA ALA A 94 -3.387 -2.578 9.025 1.00 0.00 C ATOM 1501 C ALA A 94 -4.231 -3.000 7.815 1.00 0.00 C ATOM 1502 O ALA A 94 -5.312 -2.470 7.581 1.00 0.00 O ATOM 1503 CB ALA A 94 -2.498 -1.389 8.640 1.00 0.00 C ATOM 0 H ALA A 94 -1.553 -3.486 9.463 1.00 0.00 H new ATOM 0 HA ALA A 94 -4.068 -2.295 9.828 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -3.121 -0.570 8.282 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -1.932 -1.060 9.512 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -1.808 -1.691 7.852 1.00 0.00 H new ATOM 1509 N VAL A 95 -3.733 -3.957 7.031 1.00 0.00 N ATOM 1510 CA VAL A 95 -4.413 -4.531 5.884 1.00 0.00 C ATOM 1511 C VAL A 95 -5.244 -5.731 6.354 1.00 0.00 C ATOM 1512 O VAL A 95 -6.428 -5.834 6.030 1.00 0.00 O ATOM 1513 CB VAL A 95 -3.347 -4.898 4.836 1.00 0.00 C ATOM 1514 CG1 VAL A 95 -3.952 -5.635 3.640 1.00 0.00 C ATOM 1515 CG2 VAL A 95 -2.597 -3.652 4.331 1.00 0.00 C ATOM 0 H VAL A 95 -2.811 -4.364 7.189 1.00 0.00 H new ATOM 0 HA VAL A 95 -5.106 -3.830 5.418 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.643 -5.561 5.339 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.165 -5.875 2.925 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.425 -6.556 3.981 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.697 -5.000 3.160 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -1.852 -3.950 3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.305 -2.961 3.874 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -2.101 -3.161 5.169 1.00 0.00 H new ATOM 1525 N ARG A 96 -4.647 -6.647 7.126 1.00 0.00 N ATOM 1526 CA ARG A 96 -5.310 -7.862 7.614 1.00 0.00 C ATOM 1527 C ARG A 96 -6.570 -7.535 8.413 1.00 0.00 C ATOM 1528 O ARG A 96 -7.546 -8.288 8.367 1.00 0.00 O ATOM 1529 CB ARG A 96 -4.339 -8.682 8.471 1.00 0.00 C ATOM 1530 CG ARG A 96 -3.251 -9.347 7.636 1.00 0.00 C ATOM 1531 CD ARG A 96 -2.188 -10.064 8.471 1.00 0.00 C ATOM 1532 NE ARG A 96 -2.742 -11.229 9.178 1.00 0.00 N ATOM 1533 CZ ARG A 96 -2.095 -12.018 10.044 1.00 0.00 C ATOM 1534 NH1 ARG A 96 -0.852 -11.752 10.432 1.00 0.00 N ATOM 1535 NH2 ARG A 96 -2.720 -13.074 10.536 1.00 0.00 N ATOM 0 H ARG A 96 -3.678 -6.564 7.433 1.00 0.00 H new ATOM 0 HA ARG A 96 -5.611 -8.449 6.746 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -3.877 -8.033 9.215 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -4.894 -9.446 9.015 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -3.713 -10.065 6.958 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -2.766 -8.591 7.018 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -1.373 -10.386 7.823 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -1.764 -9.368 9.195 1.00 0.00 H new ATOM 0 HE ARG A 96 -3.718 -11.459 8.989 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -0.369 -10.930 10.069 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -0.381 -12.369 11.093 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -3.679 -13.276 10.254 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -2.243 -13.687 11.197 1.00 0.00 H new ATOM 1549 N ASN A 97 -6.585 -6.401 9.113 1.00 0.00 N ATOM 1550 CA ASN A 97 -7.699 -5.976 9.946 1.00 0.00 C ATOM 1551 C ASN A 97 -8.880 -5.444 9.129 1.00 0.00 C ATOM 1552 O ASN A 97 -9.932 -5.161 9.699 1.00 0.00 O ATOM 1553 CB ASN A 97 -7.253 -4.937 10.991 1.00 0.00 C ATOM 1554 CG ASN A 97 -8.253 -4.835 12.140 1.00 0.00 C ATOM 1555 OD1 ASN A 97 -8.905 -5.814 12.512 1.00 0.00 O ATOM 1556 ND2 ASN A 97 -8.439 -3.656 12.706 1.00 0.00 N ATOM 0 H ASN A 97 -5.806 -5.743 9.114 1.00 0.00 H new ATOM 0 HA ASN A 97 -8.046 -6.868 10.468 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -6.273 -5.211 11.383 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -7.145 -3.963 10.514 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -9.124 -3.552 13.454 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -7.897 -2.850 12.395 1.00 0.00 H new ATOM 1563 N LEU A 98 -8.760 -5.330 7.801 1.00 0.00 N ATOM 1564 CA LEU A 98 -9.763 -4.793 6.884 1.00 0.00 C ATOM 1565 C LEU A 98 -10.389 -5.874 6.013 1.00 0.00 C ATOM 1566 O LEU A 98 -11.352 -5.589 5.301 1.00 0.00 O ATOM 1567 CB LEU A 98 -9.109 -3.664 6.096 1.00 0.00 C ATOM 1568 CG LEU A 98 -9.243 -2.325 6.816 1.00 0.00 C ATOM 1569 CD1 LEU A 98 -10.644 -1.727 6.815 1.00 0.00 C ATOM 1570 CD2 LEU A 98 -8.657 -2.224 8.228 1.00 0.00 C ATOM 0 H LEU A 98 -7.914 -5.627 7.315 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.610 -4.388 7.439 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -8.054 -3.891 5.942 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -9.568 -3.595 5.110 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.599 -1.725 6.173 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.635 -0.778 7.351 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.968 -1.561 5.788 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -11.333 -2.414 7.306 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.822 -1.220 8.620 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.144 -2.952 8.877 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.587 -2.428 8.193 1.00 0.00 H new ATOM 1582 N PHE A 99 -9.944 -7.120 6.150 1.00 0.00 N ATOM 1583 CA PHE A 99 -10.523 -8.292 5.485 1.00 0.00 C ATOM 1584 C PHE A 99 -12.047 -8.395 5.648 1.00 0.00 C ATOM 1585 O PHE A 99 -12.691 -9.071 4.845 1.00 0.00 O ATOM 1586 CB PHE A 99 -9.876 -9.575 6.031 1.00 0.00 C ATOM 1587 CG PHE A 99 -8.577 -10.001 5.373 1.00 0.00 C ATOM 1588 CD1 PHE A 99 -7.546 -9.076 5.131 1.00 0.00 C ATOM 1589 CD2 PHE A 99 -8.385 -11.352 5.022 1.00 0.00 C ATOM 1590 CE1 PHE A 99 -6.338 -9.494 4.555 1.00 0.00 C ATOM 1591 CE2 PHE A 99 -7.189 -11.766 4.411 1.00 0.00 C ATOM 1592 CZ PHE A 99 -6.165 -10.836 4.179 1.00 0.00 C ATOM 0 H PHE A 99 -9.148 -7.353 6.743 1.00 0.00 H new ATOM 0 HA PHE A 99 -10.318 -8.173 4.421 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -9.692 -9.439 7.097 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -10.594 -10.390 5.932 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -7.686 -8.037 5.390 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.162 -12.074 5.224 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.540 -8.783 4.400 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -7.059 -12.798 4.121 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.244 -11.152 3.711 1.00 0.00 H new ATOM 1602 N HIS A 100 -12.650 -7.746 6.653 1.00 0.00 N ATOM 1603 CA HIS A 100 -14.086 -7.798 6.880 1.00 0.00 C ATOM 1604 C HIS A 100 -14.733 -6.436 7.121 1.00 0.00 C ATOM 1605 O HIS A 100 -15.690 -6.334 7.899 1.00 0.00 O ATOM 1606 CB HIS A 100 -14.425 -8.830 7.974 1.00 0.00 C ATOM 1607 CG HIS A 100 -13.761 -10.171 7.796 1.00 0.00 C ATOM 1608 ND1 HIS A 100 -14.255 -11.231 7.074 1.00 0.00 N ATOM 1609 CD2 HIS A 100 -12.520 -10.525 8.253 1.00 0.00 C ATOM 1610 CE1 HIS A 100 -13.317 -12.187 7.066 1.00 0.00 C ATOM 1611 NE2 HIS A 100 -12.243 -11.810 7.782 1.00 0.00 N ATOM 0 H HIS A 100 -12.147 -7.171 7.329 1.00 0.00 H new ATOM 0 HA HIS A 100 -14.536 -8.137 5.947 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -14.137 -8.422 8.943 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -15.505 -8.974 7.998 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -11.871 -9.919 8.868 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -13.411 -13.133 6.554 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -11.396 -12.354 7.948 1.00 0.00 H new ATOM 1619 N TYR A 101 -14.219 -5.385 6.477 1.00 0.00 N ATOM 1620 CA TYR A 101 -14.808 -4.063 6.605 1.00 0.00 C ATOM 1621 C TYR A 101 -16.208 -4.042 6.000 1.00 0.00 C ATOM 1622 O TYR A 101 -16.529 -4.805 5.086 1.00 0.00 O ATOM 1623 CB TYR A 101 -13.922 -3.039 5.898 1.00 0.00 C ATOM 1624 CG TYR A 101 -14.362 -1.589 6.024 1.00 0.00 C ATOM 1625 CD1 TYR A 101 -14.676 -1.038 7.281 1.00 0.00 C ATOM 1626 CD2 TYR A 101 -14.513 -0.806 4.867 1.00 0.00 C ATOM 1627 CE1 TYR A 101 -15.164 0.275 7.383 1.00 0.00 C ATOM 1628 CE2 TYR A 101 -15.001 0.510 4.962 1.00 0.00 C ATOM 1629 CZ TYR A 101 -15.326 1.063 6.222 1.00 0.00 C ATOM 1630 OH TYR A 101 -15.696 2.367 6.298 1.00 0.00 O ATOM 0 H TYR A 101 -13.402 -5.429 5.868 1.00 0.00 H new ATOM 0 HA TYR A 101 -14.883 -3.811 7.663 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -12.910 -3.128 6.292 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -13.876 -3.295 4.839 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -14.540 -1.630 8.174 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -14.254 -1.216 3.902 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -15.416 0.683 8.351 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -15.128 1.101 4.067 1.00 0.00 H new ATOM 0 HH TYR A 101 -15.754 2.744 5.395 1.00 0.00 H new ATOM 1640 N LYS A 102 -17.023 -3.113 6.490 1.00 0.00 N ATOM 1641 CA LYS A 102 -18.367 -2.843 6.003 1.00 0.00 C ATOM 1642 C LYS A 102 -18.663 -1.359 6.143 1.00 0.00 C ATOM 1643 O LYS A 102 -19.090 -0.706 5.188 1.00 0.00 O ATOM 1644 CB LYS A 102 -19.379 -3.730 6.746 1.00 0.00 C ATOM 1645 CG LYS A 102 -19.392 -3.535 8.271 1.00 0.00 C ATOM 1646 CD LYS A 102 -20.018 -4.695 9.046 1.00 0.00 C ATOM 1647 CE LYS A 102 -19.241 -4.923 10.351 1.00 0.00 C ATOM 1648 NZ LYS A 102 -19.440 -3.857 11.349 1.00 0.00 N ATOM 0 H LYS A 102 -16.754 -2.507 7.265 1.00 0.00 H new ATOM 0 HA LYS A 102 -18.449 -3.092 4.945 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -20.377 -3.527 6.357 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -19.158 -4.775 6.527 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -18.368 -3.393 8.617 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -19.937 -2.621 8.504 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -21.063 -4.476 9.267 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -20.003 -5.601 8.439 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -19.545 -5.876 10.784 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -18.178 -5.002 10.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -18.888 -4.074 12.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -19.124 -2.948 10.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.449 -3.796 11.595 1.00 0.00 H new ATOM 1662 N GLY A 103 -18.375 -0.809 7.319 1.00 0.00 N ATOM 1663 CA GLY A 103 -18.638 0.570 7.662 1.00 0.00 C ATOM 1664 C GLY A 103 -20.143 0.812 7.646 1.00 0.00 C ATOM 1665 O GLY A 103 -20.849 0.233 8.473 1.00 0.00 O ATOM 0 H GLY A 103 -17.939 -1.334 8.077 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -18.232 0.796 8.648 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -18.143 1.234 6.953 1.00 0.00 H new ATOM 1669 N HIS A 104 -20.630 1.664 6.743 1.00 0.00 N ATOM 1670 CA HIS A 104 -22.048 1.942 6.504 1.00 0.00 C ATOM 1671 C HIS A 104 -22.247 2.114 4.997 1.00 0.00 C ATOM 1672 O HIS A 104 -21.315 2.585 4.330 1.00 0.00 O ATOM 1673 CB HIS A 104 -22.519 3.243 7.184 1.00 0.00 C ATOM 1674 CG HIS A 104 -22.233 3.422 8.650 1.00 0.00 C ATOM 1675 ND1 HIS A 104 -23.129 3.748 9.647 1.00 0.00 N ATOM 1676 CD2 HIS A 104 -20.985 3.549 9.173 1.00 0.00 C ATOM 1677 CE1 HIS A 104 -22.427 4.066 10.747 1.00 0.00 C ATOM 1678 NE2 HIS A 104 -21.109 3.948 10.505 1.00 0.00 N ATOM 0 H HIS A 104 -20.019 2.204 6.130 1.00 0.00 H new ATOM 0 HA HIS A 104 -22.624 1.113 6.916 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -22.066 4.080 6.652 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -23.597 3.321 7.043 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -20.058 3.372 8.649 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -22.858 4.372 11.689 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -20.350 4.117 11.165 1.00 0.00 H new ATOM 1686 N PRO A 105 -23.429 1.802 4.445 1.00 0.00 N ATOM 1687 CA PRO A 105 -23.686 1.933 3.027 1.00 0.00 C ATOM 1688 C PRO A 105 -23.821 3.385 2.592 1.00 0.00 C ATOM 1689 O PRO A 105 -24.006 4.313 3.386 1.00 0.00 O ATOM 1690 CB PRO A 105 -24.992 1.204 2.743 1.00 0.00 C ATOM 1691 CG PRO A 105 -25.723 1.369 4.077 1.00 0.00 C ATOM 1692 CD PRO A 105 -24.590 1.256 5.111 1.00 0.00 C ATOM 0 HA PRO A 105 -22.847 1.513 2.473 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -25.541 1.652 1.915 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -24.831 0.156 2.489 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -26.233 2.330 4.141 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -26.479 0.597 4.221 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -24.825 1.813 6.018 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -24.426 0.220 5.407 1.00 0.00 H new ATOM 1700 N ASP A 106 -23.788 3.536 1.279 1.00 0.00 N ATOM 1701 CA ASP A 106 -23.595 4.763 0.545 1.00 0.00 C ATOM 1702 C ASP A 106 -24.824 5.031 -0.326 1.00 0.00 C ATOM 1703 O ASP A 106 -25.474 4.072 -0.747 1.00 0.00 O ATOM 1704 CB ASP A 106 -22.392 4.537 -0.366 1.00 0.00 C ATOM 1705 CG ASP A 106 -21.045 4.644 0.348 1.00 0.00 C ATOM 1706 OD1 ASP A 106 -20.554 5.776 0.549 1.00 0.00 O ATOM 1707 OD2 ASP A 106 -20.463 3.584 0.691 1.00 0.00 O ATOM 0 H ASP A 106 -23.905 2.738 0.655 1.00 0.00 H new ATOM 0 HA ASP A 106 -23.443 5.606 1.219 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -22.474 3.550 -0.821 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -22.421 5.265 -1.177 1.00 0.00 H new ATOM 1712 N PRO A 107 -25.144 6.294 -0.660 1.00 0.00 N ATOM 1713 CA PRO A 107 -26.423 6.647 -1.270 1.00 0.00 C ATOM 1714 C PRO A 107 -26.644 6.017 -2.643 1.00 0.00 C ATOM 1715 O PRO A 107 -27.764 5.613 -2.957 1.00 0.00 O ATOM 1716 CB PRO A 107 -26.457 8.178 -1.344 1.00 0.00 C ATOM 1717 CG PRO A 107 -25.012 8.611 -1.097 1.00 0.00 C ATOM 1718 CD PRO A 107 -24.446 7.491 -0.235 1.00 0.00 C ATOM 0 HA PRO A 107 -27.237 6.252 -0.662 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -26.812 8.520 -2.316 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -27.129 8.596 -0.594 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -24.460 8.717 -2.031 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -24.963 9.573 -0.587 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -23.370 7.391 -0.377 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -24.611 7.688 0.824 1.00 0.00 H new ATOM 1726 N LEU A 108 -25.584 5.929 -3.442 1.00 0.00 N ATOM 1727 CA LEU A 108 -25.586 5.366 -4.789 1.00 0.00 C ATOM 1728 C LEU A 108 -24.787 4.068 -4.815 1.00 0.00 C ATOM 1729 O LEU A 108 -25.255 3.051 -5.317 1.00 0.00 O ATOM 1730 CB LEU A 108 -25.032 6.366 -5.823 1.00 0.00 C ATOM 1731 CG LEU A 108 -23.811 7.205 -5.392 1.00 0.00 C ATOM 1732 CD1 LEU A 108 -22.814 7.366 -6.546 1.00 0.00 C ATOM 1733 CD2 LEU A 108 -24.242 8.589 -4.927 1.00 0.00 C ATOM 0 H LEU A 108 -24.663 6.262 -3.157 1.00 0.00 H new ATOM 0 HA LEU A 108 -26.619 5.152 -5.063 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -24.763 5.812 -6.722 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -25.835 7.050 -6.098 1.00 0.00 H new ATOM 0 HG LEU A 108 -23.331 6.673 -4.570 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -21.964 7.962 -6.212 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -22.466 6.384 -6.865 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -23.303 7.867 -7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -23.364 9.162 -4.628 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -24.752 9.104 -5.741 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -24.919 8.493 -4.078 1.00 0.00 H new ATOM 1745 N LYS A 109 -23.567 4.102 -4.272 1.00 0.00 N ATOM 1746 CA LYS A 109 -22.634 2.980 -4.313 1.00 0.00 C ATOM 1747 C LYS A 109 -23.135 1.813 -3.453 1.00 0.00 C ATOM 1748 O LYS A 109 -22.638 0.699 -3.617 1.00 0.00 O ATOM 1749 CB LYS A 109 -21.227 3.439 -3.880 1.00 0.00 C ATOM 1750 CG LYS A 109 -20.738 4.754 -4.520 1.00 0.00 C ATOM 1751 CD LYS A 109 -20.354 4.687 -6.004 1.00 0.00 C ATOM 1752 CE LYS A 109 -18.889 4.279 -6.180 1.00 0.00 C ATOM 1753 NZ LYS A 109 -18.379 4.537 -7.541 1.00 0.00 N ATOM 0 H LYS A 109 -23.198 4.920 -3.787 1.00 0.00 H new ATOM 0 HA LYS A 109 -22.571 2.619 -5.340 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -21.218 3.556 -2.796 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -20.515 2.650 -4.121 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -21.521 5.503 -4.403 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -19.873 5.107 -3.958 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -20.997 3.972 -6.517 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -20.522 5.658 -6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -18.277 4.822 -5.460 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -18.783 3.218 -5.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -17.384 4.241 -7.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -18.942 3.999 -8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -18.452 5.553 -7.752 1.00 0.00 H new ATOM 1767 N GLY A 110 -24.107 2.047 -2.564 1.00 0.00 N ATOM 1768 CA GLY A 110 -24.640 1.083 -1.622 1.00 0.00 C ATOM 1769 C GLY A 110 -23.512 0.531 -0.779 1.00 0.00 C ATOM 1770 O GLY A 110 -22.946 1.245 0.035 1.00 0.00 O ATOM 0 H GLY A 110 -24.558 2.959 -2.486 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -25.388 1.555 -0.985 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -25.140 0.274 -2.155 1.00 0.00 H new ATOM 1774 N ASP A 111 -23.104 -0.702 -1.007 1.00 0.00 N ATOM 1775 CA ASP A 111 -22.047 -1.375 -0.253 1.00 0.00 C ATOM 1776 C ASP A 111 -20.839 -1.755 -1.125 1.00 0.00 C ATOM 1777 O ASP A 111 -20.028 -2.602 -0.740 1.00 0.00 O ATOM 1778 CB ASP A 111 -22.646 -2.549 0.531 1.00 0.00 C ATOM 1779 CG ASP A 111 -22.753 -3.838 -0.277 1.00 0.00 C ATOM 1780 OD1 ASP A 111 -22.986 -3.806 -1.512 1.00 0.00 O ATOM 1781 OD2 ASP A 111 -22.607 -4.913 0.342 1.00 0.00 O ATOM 0 H ASP A 111 -23.505 -1.286 -1.741 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.632 -0.675 0.471 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.034 -2.734 1.414 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -23.638 -2.269 0.884 1.00 0.00 H new ATOM 1786 N ALA A 112 -20.709 -1.146 -2.306 1.00 0.00 N ATOM 1787 CA ALA A 112 -19.614 -1.400 -3.226 1.00 0.00 C ATOM 1788 C ALA A 112 -18.277 -0.860 -2.717 1.00 0.00 C ATOM 1789 O ALA A 112 -17.265 -1.543 -2.878 1.00 0.00 O ATOM 1790 CB ALA A 112 -19.931 -0.782 -4.586 1.00 0.00 C ATOM 0 H ALA A 112 -21.375 -0.454 -2.649 1.00 0.00 H new ATOM 0 HA ALA A 112 -19.513 -2.482 -3.314 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -19.108 -0.974 -5.274 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -20.845 -1.224 -4.982 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -20.067 0.294 -4.474 1.00 0.00 H new ATOM 1796 N LEU A 113 -18.241 0.360 -2.163 1.00 0.00 N ATOM 1797 CA LEU A 113 -17.000 1.049 -1.801 1.00 0.00 C ATOM 1798 C LEU A 113 -16.264 0.247 -0.746 1.00 0.00 C ATOM 1799 O LEU A 113 -15.091 -0.069 -0.926 1.00 0.00 O ATOM 1800 CB LEU A 113 -17.267 2.488 -1.298 1.00 0.00 C ATOM 1801 CG LEU A 113 -16.653 3.608 -2.147 1.00 0.00 C ATOM 1802 CD1 LEU A 113 -17.056 3.527 -3.621 1.00 0.00 C ATOM 1803 CD2 LEU A 113 -17.145 4.943 -1.583 1.00 0.00 C ATOM 0 H LEU A 113 -19.081 0.899 -1.953 1.00 0.00 H new ATOM 0 HA LEU A 113 -16.382 1.129 -2.696 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -18.345 2.643 -1.248 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -16.885 2.576 -0.281 1.00 0.00 H new ATOM 0 HG LEU A 113 -15.568 3.510 -2.102 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -16.591 4.345 -4.171 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -16.724 2.576 -4.037 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -18.140 3.602 -3.706 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -16.725 5.762 -2.167 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -18.233 4.981 -1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -16.828 5.038 -0.544 1.00 0.00 H new ATOM 1815 N ASN A 114 -16.954 -0.091 0.349 1.00 0.00 N ATOM 1816 CA ASN A 114 -16.369 -0.888 1.421 1.00 0.00 C ATOM 1817 C ASN A 114 -15.954 -2.268 0.922 1.00 0.00 C ATOM 1818 O ASN A 114 -14.872 -2.727 1.277 1.00 0.00 O ATOM 1819 CB ASN A 114 -17.316 -1.010 2.626 1.00 0.00 C ATOM 1820 CG ASN A 114 -18.473 -1.979 2.410 1.00 0.00 C ATOM 1821 OD1 ASN A 114 -18.318 -3.188 2.509 1.00 0.00 O ATOM 1822 ND2 ASN A 114 -19.655 -1.486 2.100 1.00 0.00 N ATOM 0 H ASN A 114 -17.924 0.179 0.512 1.00 0.00 H new ATOM 0 HA ASN A 114 -15.475 -0.362 1.755 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -16.742 -1.333 3.495 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -17.720 -0.025 2.859 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -20.444 -2.113 1.942 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -19.781 -0.477 2.018 1.00 0.00 H new ATOM 1829 N LYS A 115 -16.753 -2.906 0.062 1.00 0.00 N ATOM 1830 CA LYS A 115 -16.423 -4.229 -0.444 1.00 0.00 C ATOM 1831 C LYS A 115 -15.153 -4.164 -1.282 1.00 0.00 C ATOM 1832 O LYS A 115 -14.268 -4.992 -1.112 1.00 0.00 O ATOM 1833 CB LYS A 115 -17.615 -4.803 -1.208 1.00 0.00 C ATOM 1834 CG LYS A 115 -17.390 -6.235 -1.710 1.00 0.00 C ATOM 1835 CD LYS A 115 -16.657 -6.351 -3.059 1.00 0.00 C ATOM 1836 CE LYS A 115 -17.621 -6.318 -4.237 1.00 0.00 C ATOM 1837 NZ LYS A 115 -18.029 -7.691 -4.608 1.00 0.00 N ATOM 0 H LYS A 115 -17.629 -2.524 -0.294 1.00 0.00 H new ATOM 0 HA LYS A 115 -16.219 -4.908 0.384 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.492 -4.787 -0.561 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -17.835 -4.159 -2.059 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -16.821 -6.781 -0.958 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -18.358 -6.728 -1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -15.941 -5.535 -3.154 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -16.087 -7.280 -3.083 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -18.500 -5.728 -3.979 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -17.148 -5.830 -5.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -18.686 -7.652 -5.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -17.189 -8.243 -4.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -18.499 -8.144 -3.799 1.00 0.00 H new ATOM 1851 N ALA A 116 -15.011 -3.157 -2.139 1.00 0.00 N ATOM 1852 CA ALA A 116 -13.756 -2.936 -2.838 1.00 0.00 C ATOM 1853 C ALA A 116 -12.557 -2.799 -1.886 1.00 0.00 C ATOM 1854 O ALA A 116 -11.449 -3.140 -2.295 1.00 0.00 O ATOM 1855 CB ALA A 116 -13.871 -1.715 -3.747 1.00 0.00 C ATOM 0 H ALA A 116 -15.746 -2.487 -2.363 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.565 -3.821 -3.445 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -12.926 -1.558 -4.266 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.663 -1.878 -4.477 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -14.106 -0.836 -3.147 1.00 0.00 H new ATOM 1861 N VAL A 117 -12.726 -2.346 -0.638 1.00 0.00 N ATOM 1862 CA VAL A 117 -11.654 -2.434 0.349 1.00 0.00 C ATOM 1863 C VAL A 117 -11.488 -3.879 0.856 1.00 0.00 C ATOM 1864 O VAL A 117 -10.363 -4.270 1.161 1.00 0.00 O ATOM 1865 CB VAL A 117 -11.853 -1.484 1.553 1.00 0.00 C ATOM 1866 CG1 VAL A 117 -10.495 -1.249 2.240 1.00 0.00 C ATOM 1867 CG2 VAL A 117 -12.430 -0.108 1.226 1.00 0.00 C ATOM 0 H VAL A 117 -13.587 -1.920 -0.294 1.00 0.00 H new ATOM 0 HA VAL A 117 -10.748 -2.118 -0.169 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.583 -1.991 2.184 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.628 -0.580 3.090 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -10.093 -2.201 2.587 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -9.801 -0.800 1.530 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.527 0.473 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.765 0.411 0.536 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -13.411 -0.225 0.765 1.00 0.00 H new ATOM 1877 N ARG A 118 -12.571 -4.644 1.070 1.00 0.00 N ATOM 1878 CA ARG A 118 -12.514 -5.892 1.826 1.00 0.00 C ATOM 1879 C ARG A 118 -11.700 -6.910 1.052 1.00 0.00 C ATOM 1880 O ARG A 118 -10.754 -7.461 1.602 1.00 0.00 O ATOM 1881 CB ARG A 118 -13.920 -6.354 2.288 1.00 0.00 C ATOM 1882 CG ARG A 118 -14.768 -7.179 1.309 1.00 0.00 C ATOM 1883 CD ARG A 118 -16.127 -7.570 1.895 1.00 0.00 C ATOM 1884 NE ARG A 118 -16.067 -8.784 2.720 1.00 0.00 N ATOM 1885 CZ ARG A 118 -17.111 -9.289 3.392 1.00 0.00 C ATOM 1886 NH1 ARG A 118 -18.271 -8.635 3.432 1.00 0.00 N ATOM 1887 NH2 ARG A 118 -16.987 -10.440 4.039 1.00 0.00 N ATOM 0 H ARG A 118 -13.502 -4.411 0.724 1.00 0.00 H new ATOM 0 HA ARG A 118 -11.986 -5.744 2.768 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -13.796 -6.941 3.198 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -14.491 -5.466 2.557 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -14.922 -6.606 0.395 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -14.222 -8.081 1.032 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -16.507 -6.746 2.498 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -16.837 -7.724 1.082 1.00 0.00 H new ATOM 0 HE ARG A 118 -15.175 -9.274 2.786 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -18.370 -7.742 2.949 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -19.060 -9.027 3.946 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -16.098 -10.940 4.025 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -17.781 -10.825 4.551 1.00 0.00 H new ATOM 1901 N GLU A 119 -12.026 -7.100 -0.225 1.00 0.00 N ATOM 1902 CA GLU A 119 -11.457 -8.172 -1.036 1.00 0.00 C ATOM 1903 C GLU A 119 -10.015 -7.845 -1.372 1.00 0.00 C ATOM 1904 O GLU A 119 -9.125 -8.646 -1.130 1.00 0.00 O ATOM 1905 CB GLU A 119 -12.257 -8.365 -2.326 1.00 0.00 C ATOM 1906 CG GLU A 119 -13.771 -8.388 -2.105 1.00 0.00 C ATOM 1907 CD GLU A 119 -14.314 -9.623 -1.378 1.00 0.00 C ATOM 1908 OE1 GLU A 119 -13.560 -10.340 -0.676 1.00 0.00 O ATOM 1909 OE2 GLU A 119 -15.548 -9.815 -1.436 1.00 0.00 O ATOM 0 H GLU A 119 -12.693 -6.514 -0.726 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.500 -9.099 -0.464 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -12.011 -7.562 -3.021 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -11.952 -9.299 -2.798 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.051 -7.501 -1.536 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.263 -8.313 -3.075 1.00 0.00 H new ATOM 1916 N THR A 120 -9.776 -6.630 -1.867 1.00 0.00 N ATOM 1917 CA THR A 120 -8.470 -6.177 -2.320 1.00 0.00 C ATOM 1918 C THR A 120 -7.395 -6.368 -1.238 1.00 0.00 C ATOM 1919 O THR A 120 -6.228 -6.586 -1.559 1.00 0.00 O ATOM 1920 CB THR A 120 -8.618 -4.724 -2.776 1.00 0.00 C ATOM 1921 OG1 THR A 120 -9.748 -4.580 -3.629 1.00 0.00 O ATOM 1922 CG2 THR A 120 -7.411 -4.198 -3.540 1.00 0.00 C ATOM 0 H THR A 120 -10.504 -5.922 -1.964 1.00 0.00 H new ATOM 0 HA THR A 120 -8.124 -6.779 -3.160 1.00 0.00 H new ATOM 0 HB THR A 120 -8.727 -4.148 -1.857 1.00 0.00 H new ATOM 0 HG1 THR A 120 -10.331 -3.872 -3.283 1.00 0.00 H new ATOM 0 HG21 THR A 120 -7.588 -3.163 -3.831 1.00 0.00 H new ATOM 0 HG22 THR A 120 -6.527 -4.250 -2.904 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.253 -4.804 -4.432 1.00 0.00 H new ATOM 1930 N ALA A 121 -7.775 -6.295 0.042 1.00 0.00 N ATOM 1931 CA ALA A 121 -6.853 -6.475 1.144 1.00 0.00 C ATOM 1932 C ALA A 121 -6.318 -7.911 1.220 1.00 0.00 C ATOM 1933 O ALA A 121 -5.185 -8.088 1.662 1.00 0.00 O ATOM 1934 CB ALA A 121 -7.546 -6.044 2.441 1.00 0.00 C ATOM 0 H ALA A 121 -8.735 -6.109 0.333 1.00 0.00 H new ATOM 0 HA ALA A 121 -5.977 -5.847 0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -6.862 -6.175 3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -7.835 -4.995 2.368 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -8.435 -6.655 2.599 1.00 0.00 H new ATOM 1940 N HIS A 122 -7.080 -8.916 0.780 1.00 0.00 N ATOM 1941 CA HIS A 122 -6.619 -10.296 0.683 1.00 0.00 C ATOM 1942 C HIS A 122 -5.467 -10.376 -0.317 1.00 0.00 C ATOM 1943 O HIS A 122 -4.376 -10.830 0.029 1.00 0.00 O ATOM 1944 CB HIS A 122 -7.750 -11.232 0.239 1.00 0.00 C ATOM 1945 CG HIS A 122 -8.876 -11.417 1.218 1.00 0.00 C ATOM 1946 ND1 HIS A 122 -9.143 -12.557 1.933 1.00 0.00 N ATOM 1947 CD2 HIS A 122 -9.891 -10.538 1.456 1.00 0.00 C ATOM 1948 CE1 HIS A 122 -10.294 -12.365 2.591 1.00 0.00 C ATOM 1949 NE2 HIS A 122 -10.804 -11.149 2.319 1.00 0.00 N ATOM 0 H HIS A 122 -8.046 -8.788 0.478 1.00 0.00 H new ATOM 0 HA HIS A 122 -6.282 -10.615 1.669 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.165 -10.851 -0.694 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -7.321 -12.210 0.021 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.975 -9.542 1.048 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -10.751 -13.088 3.250 1.00 0.00 H new ATOM 0 HE2 HIS A 122 -11.677 -10.755 2.670 1.00 0.00 H new ATOM 1957 N GLU A 123 -5.687 -9.867 -1.536 1.00 0.00 N ATOM 1958 CA GLU A 123 -4.671 -9.818 -2.585 1.00 0.00 C ATOM 1959 C GLU A 123 -3.410 -9.112 -2.093 1.00 0.00 C ATOM 1960 O GLU A 123 -2.301 -9.505 -2.450 1.00 0.00 O ATOM 1961 CB GLU A 123 -5.193 -9.086 -3.831 1.00 0.00 C ATOM 1962 CG GLU A 123 -6.224 -9.872 -4.654 1.00 0.00 C ATOM 1963 CD GLU A 123 -7.642 -9.717 -4.123 1.00 0.00 C ATOM 1964 OE1 GLU A 123 -8.300 -8.723 -4.522 1.00 0.00 O ATOM 1965 OE2 GLU A 123 -8.048 -10.585 -3.316 1.00 0.00 O ATOM 0 H GLU A 123 -6.585 -9.475 -1.820 1.00 0.00 H new ATOM 0 HA GLU A 123 -4.433 -10.849 -2.846 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.640 -8.142 -3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -4.347 -8.841 -4.473 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.190 -9.534 -5.690 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -5.954 -10.928 -4.654 1.00 0.00 H new ATOM 1972 N THR A 124 -3.563 -8.084 -1.258 1.00 0.00 N ATOM 1973 CA THR A 124 -2.429 -7.430 -0.647 1.00 0.00 C ATOM 1974 C THR A 124 -1.601 -8.407 0.201 1.00 0.00 C ATOM 1975 O THR A 124 -0.382 -8.448 0.029 1.00 0.00 O ATOM 1976 CB THR A 124 -2.886 -6.170 0.088 1.00 0.00 C ATOM 1977 OG1 THR A 124 -3.514 -5.275 -0.810 1.00 0.00 O ATOM 1978 CG2 THR A 124 -1.699 -5.439 0.697 1.00 0.00 C ATOM 0 H THR A 124 -4.468 -7.693 -0.995 1.00 0.00 H new ATOM 0 HA THR A 124 -1.738 -7.095 -1.420 1.00 0.00 H new ATOM 0 HB THR A 124 -3.579 -6.485 0.868 1.00 0.00 H new ATOM 0 HG1 THR A 124 -2.833 -4.745 -1.274 1.00 0.00 H new ATOM 0 HG21 THR A 124 -2.048 -4.546 1.215 1.00 0.00 H new ATOM 0 HG22 THR A 124 -1.193 -6.094 1.406 1.00 0.00 H new ATOM 0 HG23 THR A 124 -1.004 -5.152 -0.092 1.00 0.00 H new ATOM 1986 N ILE A 125 -2.202 -9.172 1.117 1.00 0.00 N ATOM 1987 CA ILE A 125 -1.447 -10.076 1.995 1.00 0.00 C ATOM 1988 C ILE A 125 -0.774 -11.185 1.190 1.00 0.00 C ATOM 1989 O ILE A 125 0.359 -11.552 1.519 1.00 0.00 O ATOM 1990 CB ILE A 125 -2.348 -10.641 3.111 1.00 0.00 C ATOM 1991 CG1 ILE A 125 -2.995 -9.515 3.933 1.00 0.00 C ATOM 1992 CG2 ILE A 125 -1.615 -11.569 4.091 1.00 0.00 C ATOM 1993 CD1 ILE A 125 -2.062 -8.421 4.451 1.00 0.00 C ATOM 0 H ILE A 125 -3.210 -9.185 1.271 1.00 0.00 H new ATOM 0 HA ILE A 125 -0.656 -9.502 2.477 1.00 0.00 H new ATOM 0 HB ILE A 125 -3.102 -11.224 2.582 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -3.764 -9.045 3.320 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -3.500 -9.965 4.788 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -2.315 -11.926 4.847 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.203 -12.419 3.548 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.807 -11.021 4.575 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -2.639 -7.688 5.014 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -1.306 -8.864 5.100 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.574 -7.930 3.609 1.00 0.00 H new ATOM 2005 N SER A 126 -1.408 -11.648 0.109 1.00 0.00 N ATOM 2006 CA SER A 126 -0.812 -12.626 -0.795 1.00 0.00 C ATOM 2007 C SER A 126 0.553 -12.151 -1.327 1.00 0.00 C ATOM 2008 O SER A 126 1.414 -12.986 -1.611 1.00 0.00 O ATOM 2009 CB SER A 126 -1.787 -12.930 -1.943 1.00 0.00 C ATOM 2010 OG SER A 126 -1.445 -14.153 -2.569 1.00 0.00 O ATOM 0 H SER A 126 -2.347 -11.354 -0.161 1.00 0.00 H new ATOM 0 HA SER A 126 -0.628 -13.545 -0.238 1.00 0.00 H new ATOM 0 HB2 SER A 126 -2.806 -12.983 -1.559 1.00 0.00 H new ATOM 0 HB3 SER A 126 -1.763 -12.121 -2.673 1.00 0.00 H new ATOM 0 HG SER A 126 -2.075 -14.335 -3.297 1.00 0.00 H new ATOM 2016 N ALA A 127 0.776 -10.831 -1.421 1.00 0.00 N ATOM 2017 CA ALA A 127 2.080 -10.274 -1.738 1.00 0.00 C ATOM 2018 C ALA A 127 2.908 -10.024 -0.483 1.00 0.00 C ATOM 2019 O ALA A 127 4.087 -10.377 -0.495 1.00 0.00 O ATOM 2020 CB ALA A 127 1.929 -8.986 -2.535 1.00 0.00 C ATOM 0 H ALA A 127 0.051 -10.128 -1.278 1.00 0.00 H new ATOM 0 HA ALA A 127 2.611 -11.008 -2.344 1.00 0.00 H new ATOM 0 HB1 ALA A 127 2.915 -8.582 -2.764 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.397 -9.193 -3.464 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.366 -8.259 -1.949 1.00 0.00 H new ATOM 2026 N ILE A 128 2.342 -9.420 0.579 1.00 0.00 N ATOM 2027 CA ILE A 128 3.112 -9.048 1.774 1.00 0.00 C ATOM 2028 C ILE A 128 3.933 -10.251 2.286 1.00 0.00 C ATOM 2029 O ILE A 128 5.076 -10.072 2.716 1.00 0.00 O ATOM 2030 CB ILE A 128 2.230 -8.408 2.884 1.00 0.00 C ATOM 2031 CG1 ILE A 128 1.646 -7.044 2.446 1.00 0.00 C ATOM 2032 CG2 ILE A 128 3.043 -8.204 4.174 1.00 0.00 C ATOM 2033 CD1 ILE A 128 0.869 -6.298 3.548 1.00 0.00 C ATOM 0 H ILE A 128 1.352 -9.180 0.631 1.00 0.00 H new ATOM 0 HA ILE A 128 3.815 -8.268 1.482 1.00 0.00 H new ATOM 0 HB ILE A 128 1.407 -9.099 3.065 1.00 0.00 H new ATOM 0 HG12 ILE A 128 2.461 -6.408 2.100 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.983 -7.203 1.596 1.00 0.00 H new ATOM 0 HG21 ILE A 128 2.407 -7.755 4.937 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.411 -9.167 4.528 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.887 -7.545 3.972 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.495 -5.353 3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.030 -6.910 3.879 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.531 -6.103 4.391 1.00 0.00 H new ATOM 2045 N PHE A 129 3.369 -11.460 2.227 1.00 0.00 N ATOM 2046 CA PHE A 129 3.978 -12.685 2.737 1.00 0.00 C ATOM 2047 C PHE A 129 4.341 -13.655 1.606 1.00 0.00 C ATOM 2048 O PHE A 129 4.412 -14.867 1.836 1.00 0.00 O ATOM 2049 CB PHE A 129 3.049 -13.289 3.799 1.00 0.00 C ATOM 2050 CG PHE A 129 2.926 -12.394 5.014 1.00 0.00 C ATOM 2051 CD1 PHE A 129 3.912 -12.416 6.015 1.00 0.00 C ATOM 2052 CD2 PHE A 129 1.861 -11.482 5.106 1.00 0.00 C ATOM 2053 CE1 PHE A 129 3.815 -11.558 7.121 1.00 0.00 C ATOM 2054 CE2 PHE A 129 1.760 -10.624 6.215 1.00 0.00 C ATOM 2055 CZ PHE A 129 2.737 -10.666 7.226 1.00 0.00 C ATOM 0 H PHE A 129 2.451 -11.615 1.811 1.00 0.00 H new ATOM 0 HA PHE A 129 4.931 -12.458 3.216 1.00 0.00 H new ATOM 0 HB2 PHE A 129 2.062 -13.453 3.367 1.00 0.00 H new ATOM 0 HB3 PHE A 129 3.430 -14.264 4.103 1.00 0.00 H new ATOM 0 HD1 PHE A 129 4.747 -13.096 5.933 1.00 0.00 H new ATOM 0 HD2 PHE A 129 1.118 -11.440 4.323 1.00 0.00 H new ATOM 0 HE1 PHE A 129 4.571 -11.584 7.892 1.00 0.00 H new ATOM 0 HE2 PHE A 129 0.933 -9.933 6.291 1.00 0.00 H new ATOM 0 HZ PHE A 129 2.658 -10.012 8.082 1.00 0.00 H new ATOM 2065 N SER A 130 4.545 -13.135 0.392 1.00 0.00 N ATOM 2066 CA SER A 130 5.047 -13.910 -0.726 1.00 0.00 C ATOM 2067 C SER A 130 6.489 -14.371 -0.455 1.00 0.00 C ATOM 2068 O SER A 130 7.187 -13.832 0.410 1.00 0.00 O ATOM 2069 CB SER A 130 4.932 -13.080 -2.012 1.00 0.00 C ATOM 2070 OG SER A 130 5.154 -13.870 -3.171 1.00 0.00 O ATOM 0 H SER A 130 4.363 -12.157 0.165 1.00 0.00 H new ATOM 0 HA SER A 130 4.447 -14.811 -0.853 1.00 0.00 H new ATOM 0 HB2 SER A 130 3.942 -12.627 -2.065 1.00 0.00 H new ATOM 0 HB3 SER A 130 5.655 -12.264 -1.984 1.00 0.00 H new ATOM 0 HG SER A 130 5.071 -13.309 -3.970 1.00 0.00 H new ATOM 2076 N GLU A 131 6.934 -15.367 -1.217 1.00 0.00 N ATOM 2077 CA GLU A 131 8.263 -15.955 -1.157 1.00 0.00 C ATOM 2078 C GLU A 131 9.265 -15.147 -1.990 1.00 0.00 C ATOM 2079 O GLU A 131 8.881 -14.292 -2.793 1.00 0.00 O ATOM 2080 CB GLU A 131 8.126 -17.396 -1.662 1.00 0.00 C ATOM 2081 CG GLU A 131 9.401 -18.238 -1.550 1.00 0.00 C ATOM 2082 CD GLU A 131 9.094 -19.726 -1.627 1.00 0.00 C ATOM 2083 OE1 GLU A 131 8.785 -20.333 -0.576 1.00 0.00 O ATOM 2084 OE2 GLU A 131 9.190 -20.294 -2.739 1.00 0.00 O ATOM 0 H GLU A 131 6.346 -15.805 -1.927 1.00 0.00 H new ATOM 0 HA GLU A 131 8.652 -15.945 -0.139 1.00 0.00 H new ATOM 0 HB2 GLU A 131 7.331 -17.889 -1.102 1.00 0.00 H new ATOM 0 HB3 GLU A 131 7.813 -17.372 -2.706 1.00 0.00 H new ATOM 0 HG2 GLU A 131 10.090 -17.966 -2.350 1.00 0.00 H new ATOM 0 HG3 GLU A 131 9.903 -18.017 -0.608 1.00 0.00 H new ATOM 2091 N GLU A 132 10.553 -15.458 -1.834 1.00 0.00 N ATOM 2092 CA GLU A 132 11.675 -14.962 -2.626 1.00 0.00 C ATOM 2093 C GLU A 132 11.456 -15.179 -4.126 1.00 0.00 C ATOM 2094 O GLU A 132 11.682 -14.263 -4.919 1.00 0.00 O ATOM 2095 CB GLU A 132 12.936 -15.718 -2.163 1.00 0.00 C ATOM 2096 CG GLU A 132 14.263 -15.197 -2.747 1.00 0.00 C ATOM 2097 CD GLU A 132 14.602 -13.796 -2.242 1.00 0.00 C ATOM 2098 OE1 GLU A 132 14.585 -13.609 -1.002 1.00 0.00 O ATOM 2099 OE2 GLU A 132 14.807 -12.876 -3.065 1.00 0.00 O ATOM 0 H GLU A 132 10.857 -16.103 -1.105 1.00 0.00 H new ATOM 0 HA GLU A 132 11.778 -13.887 -2.475 1.00 0.00 H new ATOM 0 HB2 GLU A 132 12.991 -15.668 -1.076 1.00 0.00 H new ATOM 0 HB3 GLU A 132 12.828 -16.770 -2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 132 15.069 -15.882 -2.483 1.00 0.00 H new ATOM 0 HG3 GLU A 132 14.200 -15.184 -3.835 1.00 0.00 H new ATOM 2106 N ASN A 133 11.089 -16.411 -4.509 1.00 0.00 N ATOM 2107 CA ASN A 133 11.057 -16.980 -5.866 1.00 0.00 C ATOM 2108 C ASN A 133 12.391 -16.916 -6.639 1.00 0.00 C ATOM 2109 O ASN A 133 12.591 -17.678 -7.579 1.00 0.00 O ATOM 2110 CB ASN A 133 9.866 -16.397 -6.643 1.00 0.00 C ATOM 2111 CG ASN A 133 9.675 -16.982 -8.038 1.00 0.00 C ATOM 2112 OD1 ASN A 133 9.638 -16.239 -9.015 1.00 0.00 O ATOM 2113 ND2 ASN A 133 9.457 -18.282 -8.172 1.00 0.00 N ATOM 0 H ASN A 133 10.780 -17.094 -3.818 1.00 0.00 H new ATOM 0 HA ASN A 133 10.909 -18.054 -5.754 1.00 0.00 H new ATOM 0 HB2 ASN A 133 8.956 -16.562 -6.066 1.00 0.00 H new ATOM 0 HB3 ASN A 133 9.998 -15.318 -6.730 1.00 0.00 H new ATOM 0 HD21 ASN A 133 9.256 -18.673 -9.092 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.490 -18.892 -7.355 1.00 0.00 H new ATOM 2120 N GLY A 134 13.340 -16.092 -6.201 1.00 0.00 N ATOM 2121 CA GLY A 134 14.674 -15.944 -6.746 1.00 0.00 C ATOM 2122 C GLY A 134 15.546 -17.182 -6.565 1.00 0.00 C ATOM 2123 O GLY A 134 15.161 -18.173 -5.945 1.00 0.00 O ATOM 0 H GLY A 134 13.181 -15.474 -5.405 1.00 0.00 H new ATOM 0 HA2 GLY A 134 14.600 -15.714 -7.809 1.00 0.00 H new ATOM 0 HA3 GLY A 134 15.161 -15.094 -6.269 1.00 0.00 H new ATOM 2127 N SER A 135 16.736 -17.110 -7.156 1.00 0.00 N ATOM 2128 CA SER A 135 17.697 -18.182 -7.405 1.00 0.00 C ATOM 2129 C SER A 135 17.202 -19.241 -8.398 1.00 0.00 C ATOM 2130 O SER A 135 18.030 -19.953 -8.964 1.00 0.00 O ATOM 2131 CB SER A 135 18.199 -18.798 -6.097 1.00 0.00 C ATOM 2132 OG SER A 135 18.728 -17.793 -5.246 1.00 0.00 O ATOM 0 H SER A 135 17.084 -16.217 -7.505 1.00 0.00 H new ATOM 0 HA SER A 135 18.549 -17.713 -7.898 1.00 0.00 H new ATOM 0 HB2 SER A 135 17.382 -19.315 -5.594 1.00 0.00 H new ATOM 0 HB3 SER A 135 18.965 -19.543 -6.310 1.00 0.00 H new ATOM 0 HG SER A 135 19.043 -18.202 -4.413 1.00 0.00 H new ATOM 2138 N GLY A 136 15.910 -19.290 -8.717 1.00 0.00 N ATOM 2139 CA GLY A 136 15.410 -20.028 -9.863 1.00 0.00 C ATOM 2140 C GLY A 136 13.949 -19.680 -10.102 1.00 0.00 C ATOM 2141 O GLY A 136 13.097 -20.538 -9.899 1.00 0.00 O ATOM 0 H GLY A 136 15.182 -18.815 -8.183 1.00 0.00 H new ATOM 0 HA2 GLY A 136 16.000 -19.788 -10.747 1.00 0.00 H new ATOM 0 HA3 GLY A 136 15.515 -21.099 -9.691 1.00 0.00 H new ATOM 2145 N PRO A 137 13.624 -18.439 -10.500 1.00 0.00 N ATOM 2146 CA PRO A 137 12.241 -18.022 -10.686 1.00 0.00 C ATOM 2147 C PRO A 137 11.615 -18.594 -11.962 1.00 0.00 C ATOM 2148 O PRO A 137 10.400 -18.487 -12.136 1.00 0.00 O ATOM 2149 CB PRO A 137 12.296 -16.496 -10.712 1.00 0.00 C ATOM 2150 CG PRO A 137 13.666 -16.202 -11.302 1.00 0.00 C ATOM 2151 CD PRO A 137 14.533 -17.338 -10.766 1.00 0.00 C ATOM 0 HA PRO A 137 11.602 -18.398 -9.887 1.00 0.00 H new ATOM 0 HB2 PRO A 137 11.497 -16.076 -11.323 1.00 0.00 H new ATOM 0 HB3 PRO A 137 12.190 -16.073 -9.713 1.00 0.00 H new ATOM 0 HG2 PRO A 137 13.641 -16.195 -12.392 1.00 0.00 H new ATOM 0 HG3 PRO A 137 14.039 -15.228 -10.986 1.00 0.00 H new ATOM 0 HD2 PRO A 137 15.293 -17.626 -11.492 1.00 0.00 H new ATOM 0 HD3 PRO A 137 15.057 -17.036 -9.859 1.00 0.00 H new ATOM 2159 N SER A 138 12.412 -19.177 -12.861 1.00 0.00 N ATOM 2160 CA SER A 138 11.911 -19.936 -13.991 1.00 0.00 C ATOM 2161 C SER A 138 11.122 -21.124 -13.434 1.00 0.00 C ATOM 2162 O SER A 138 11.634 -21.861 -12.590 1.00 0.00 O ATOM 2163 CB SER A 138 13.110 -20.368 -14.848 1.00 0.00 C ATOM 2164 OG SER A 138 12.713 -21.118 -15.985 1.00 0.00 O ATOM 0 H SER A 138 13.430 -19.130 -12.818 1.00 0.00 H new ATOM 0 HA SER A 138 11.245 -19.354 -14.628 1.00 0.00 H new ATOM 0 HB2 SER A 138 13.660 -19.485 -15.172 1.00 0.00 H new ATOM 0 HB3 SER A 138 13.792 -20.964 -14.242 1.00 0.00 H new ATOM 0 HG SER A 138 13.505 -21.371 -16.503 1.00 0.00 H new ATOM 2170 N SER A 139 9.904 -21.337 -13.928 1.00 0.00 N ATOM 2171 CA SER A 139 9.047 -22.455 -13.544 1.00 0.00 C ATOM 2172 C SER A 139 8.693 -23.282 -14.782 1.00 0.00 C ATOM 2173 O SER A 139 9.179 -23.019 -15.891 1.00 0.00 O ATOM 2174 CB SER A 139 7.810 -21.908 -12.818 1.00 0.00 C ATOM 2175 OG SER A 139 8.184 -21.181 -11.662 1.00 0.00 O ATOM 0 H SER A 139 9.477 -20.723 -14.622 1.00 0.00 H new ATOM 0 HA SER A 139 9.564 -23.123 -12.856 1.00 0.00 H new ATOM 0 HB2 SER A 139 7.244 -21.264 -13.491 1.00 0.00 H new ATOM 0 HB3 SER A 139 7.154 -22.732 -12.538 1.00 0.00 H new ATOM 0 HG SER A 139 7.381 -20.840 -11.216 1.00 0.00 H new ATOM 2181 N GLY A 140 7.837 -24.286 -14.617 1.00 0.00 N ATOM 2182 CA GLY A 140 7.410 -25.225 -15.639 1.00 0.00 C ATOM 2183 C GLY A 140 7.518 -26.626 -15.084 1.00 0.00 C ATOM 2184 O GLY A 140 7.357 -26.778 -13.849 1.00 0.00 O ATOM 0 H GLY A 140 7.401 -24.473 -13.714 1.00 0.00 H new ATOM 0 HA2 GLY A 140 6.383 -25.016 -15.940 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.030 -25.122 -16.530 1.00 0.00 H new TER 2188 GLY A 140