USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1036 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 65 THR OG1 : rot 139:sc= -2.17! USER MOD Set 1.2: A 68 ASN : amide:sc= -0.582 K(o=-5.1,f=-6.4) USER MOD Set 1.3: A 118 SER OG : rot 83:sc= 0.866 USER MOD Set 1.4: A 122 LYS NZ :NH3+ 152:sc= -3.24! (180deg=-4.93!) USER MOD Set 2.1: A 45 HIS : no HD1:sc= -0.803 K(o=-0.8,f=-1.5) USER MOD Set 2.2: A 48 LYS NZ :NH3+ -141:sc= 0 (180deg=0) USER MOD Set 3.1: A 29 LYS NZ :NH3+ 162:sc= 0.36 (180deg=0) USER MOD Set 3.2: A 30 ASN : amide:sc= -1.32 K(o=-0.96,f=-7!) USER MOD Set 4.1: A 13 THR OG1 : rot 180:sc= -0.0899 USER MOD Set 4.2: A 50 MET CE :methyl -168:sc= -1.53 (180deg=-1.98) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0109 (180deg=-0.355) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.0877 (180deg=-0.387) USER MOD Single : A 2 MET CE :methyl 160:sc= -0.0472 (180deg=-0.545) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.164) USER MOD Single : A 16 TYR OH : rot 55:sc= 0.00623 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 19 ASN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 21 ASN : amide:sc= -0.418 K(o=-0.42,f=-4.4!) USER MOD Single : A 23 THR OG1 : rot 120:sc= 1.15 USER MOD Single : A 34 MET CE :methyl -128:sc= -0.0824 (180deg=-2.55!) USER MOD Single : A 38 ASN : amide:sc= -0.208 X(o=-0.21,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -147:sc= -2.51! (180deg=-6.06!) USER MOD Single : A 57 SER OG : rot -56:sc= -0.165 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -135:sc= -10.2! (180deg=-11.4!) USER MOD Single : A 61 LYS NZ :NH3+ 142:sc= -0.651 (180deg=-2.96!) USER MOD Single : A 63 CYS SG : rot -108:sc= -2.43! USER MOD Single : A 64 HIS : no HD1:sc= -1.65 X(o=-1.6,f=-1.9) USER MOD Single : A 72 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.341) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0.0015) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 156:sc= 0.111 (180deg=0.00393) USER MOD Single : A 81 THR OG1 : rot -46:sc= 0.439 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 160:sc= -2.76! (180deg=-4.16!) USER MOD Single : A 94 MET CE :methyl -158:sc= -0.0888 (180deg=-1.1) USER MOD Single : A 96 THR OG1 : rot 84:sc= 1.09 USER MOD Single : A 98 MET CE :methyl 143:sc= -0.568 (180deg=-3.1!) USER MOD Single : A 101 LYS NZ :NH3+ -174:sc= 0.163 (180deg=0.0977) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot -170:sc= -1.58! USER MOD Single : A 113 ASN : amide:sc= -1.13 K(o=-1.1,f=-2.9!) USER MOD Single : A 120 THR OG1 : rot 91:sc= 0.532 USER MOD Single : A 123 SER OG : rot 93:sc= 0.0445 USER MOD Single : A 126 SER OG : rot 180:sc= 0.0498 USER MOD Single : A 127 SER OG : rot 180:sc= -0.183 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 12.401 -26.334 -2.749 1.00 0.00 N ATOM 2 CA MET A 1 12.394 -27.800 -2.477 1.00 0.00 C ATOM 3 C MET A 1 11.101 -28.198 -1.760 1.00 0.00 C ATOM 4 O MET A 1 10.732 -29.355 -1.723 1.00 0.00 O ATOM 5 CB MET A 1 13.601 -28.042 -1.571 1.00 0.00 C ATOM 6 CG MET A 1 14.891 -27.874 -2.377 1.00 0.00 C ATOM 7 SD MET A 1 16.287 -28.517 -1.420 1.00 0.00 S ATOM 8 CE MET A 1 16.367 -27.177 -0.205 1.00 0.00 C ATOM 0 H1 MET A 1 13.163 -26.109 -3.420 1.00 0.00 H new ATOM 0 H2 MET A 1 11.487 -26.052 -3.157 1.00 0.00 H new ATOM 0 H3 MET A 1 12.558 -25.817 -1.860 1.00 0.00 H new ATOM 0 HA MET A 1 12.446 -28.389 -3.393 1.00 0.00 H new ATOM 0 HB2 MET A 1 13.588 -27.341 -0.736 1.00 0.00 H new ATOM 0 HB3 MET A 1 13.554 -29.045 -1.146 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.811 -28.404 -3.326 1.00 0.00 H new ATOM 0 HG3 MET A 1 15.051 -26.822 -2.612 1.00 0.00 H new ATOM 0 HE1 MET A 1 17.325 -27.213 0.314 1.00 0.00 H new ATOM 0 HE2 MET A 1 16.266 -26.218 -0.714 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.559 -27.292 0.517 1.00 0.00 H new ATOM 20 N MET A 2 10.411 -27.250 -1.188 1.00 0.00 N ATOM 21 CA MET A 2 9.146 -27.580 -0.471 1.00 0.00 C ATOM 22 C MET A 2 8.232 -26.350 -0.410 1.00 0.00 C ATOM 23 O MET A 2 8.292 -25.477 -1.252 1.00 0.00 O ATOM 24 CB MET A 2 9.588 -27.994 0.932 1.00 0.00 C ATOM 25 CG MET A 2 10.363 -26.844 1.570 1.00 0.00 C ATOM 26 SD MET A 2 11.894 -27.473 2.301 1.00 0.00 S ATOM 27 CE MET A 2 11.527 -27.026 4.015 1.00 0.00 C ATOM 0 H MET A 2 10.667 -26.263 -1.186 1.00 0.00 H new ATOM 0 HA MET A 2 8.580 -28.367 -0.970 1.00 0.00 H new ATOM 0 HB2 MET A 2 8.720 -28.246 1.541 1.00 0.00 H new ATOM 0 HB3 MET A 2 10.212 -28.886 0.882 1.00 0.00 H new ATOM 0 HG2 MET A 2 10.591 -26.086 0.820 1.00 0.00 H new ATOM 0 HG3 MET A 2 9.754 -26.363 2.335 1.00 0.00 H new ATOM 0 HE1 MET A 2 12.149 -27.618 4.687 1.00 0.00 H new ATOM 0 HE2 MET A 2 11.734 -25.967 4.167 1.00 0.00 H new ATOM 0 HE3 MET A 2 10.476 -27.224 4.226 1.00 0.00 H new ATOM 37 N GLU A 3 7.383 -26.278 0.582 1.00 0.00 N ATOM 38 CA GLU A 3 6.463 -25.106 0.698 1.00 0.00 C ATOM 39 C GLU A 3 7.195 -23.906 1.275 1.00 0.00 C ATOM 40 O GLU A 3 6.619 -22.859 1.497 1.00 0.00 O ATOM 41 CB GLU A 3 5.381 -25.531 1.679 1.00 0.00 C ATOM 42 CG GLU A 3 6.033 -25.997 2.982 1.00 0.00 C ATOM 43 CD GLU A 3 4.989 -26.001 4.101 1.00 0.00 C ATOM 44 OE1 GLU A 3 4.783 -24.955 4.695 1.00 0.00 O ATOM 45 OE2 GLU A 3 4.415 -27.049 4.345 1.00 0.00 O ATOM 0 H GLU A 3 7.286 -26.979 1.317 1.00 0.00 H new ATOM 0 HA GLU A 3 6.066 -24.824 -0.277 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.705 -24.699 1.875 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.782 -26.335 1.251 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.450 -26.996 2.856 1.00 0.00 H new ATOM 0 HG3 GLU A 3 6.860 -25.337 3.244 1.00 0.00 H new ATOM 52 N GLU A 4 8.450 -24.047 1.545 1.00 0.00 N ATOM 53 CA GLU A 4 9.186 -22.910 2.135 1.00 0.00 C ATOM 54 C GLU A 4 9.302 -21.767 1.126 1.00 0.00 C ATOM 55 O GLU A 4 9.750 -20.684 1.444 1.00 0.00 O ATOM 56 CB GLU A 4 10.561 -23.465 2.503 1.00 0.00 C ATOM 57 CG GLU A 4 11.352 -22.407 3.273 1.00 0.00 C ATOM 58 CD GLU A 4 12.843 -22.738 3.202 1.00 0.00 C ATOM 59 OE1 GLU A 4 13.186 -23.689 2.519 1.00 0.00 O ATOM 60 OE2 GLU A 4 13.617 -22.034 3.831 1.00 0.00 O ATOM 0 H GLU A 4 8.997 -24.893 1.385 1.00 0.00 H new ATOM 0 HA GLU A 4 8.677 -22.499 3.007 1.00 0.00 H new ATOM 0 HB2 GLU A 4 10.451 -24.364 3.109 1.00 0.00 H new ATOM 0 HB3 GLU A 4 11.101 -23.753 1.601 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.167 -21.419 2.851 1.00 0.00 H new ATOM 0 HG3 GLU A 4 11.024 -22.376 4.312 1.00 0.00 H new ATOM 67 N TYR A 5 8.890 -22.001 -0.085 1.00 0.00 N ATOM 68 CA TYR A 5 8.962 -20.931 -1.119 1.00 0.00 C ATOM 69 C TYR A 5 7.992 -19.811 -0.772 1.00 0.00 C ATOM 70 O TYR A 5 8.306 -18.639 -0.855 1.00 0.00 O ATOM 71 CB TYR A 5 8.565 -21.613 -2.429 1.00 0.00 C ATOM 72 CG TYR A 5 9.759 -21.655 -3.351 1.00 0.00 C ATOM 73 CD1 TYR A 5 10.957 -22.233 -2.918 1.00 0.00 C ATOM 74 CD2 TYR A 5 9.668 -21.114 -4.639 1.00 0.00 C ATOM 75 CE1 TYR A 5 12.066 -22.271 -3.771 1.00 0.00 C ATOM 76 CE2 TYR A 5 10.777 -21.150 -5.492 1.00 0.00 C ATOM 77 CZ TYR A 5 11.975 -21.730 -5.059 1.00 0.00 C ATOM 78 OH TYR A 5 13.067 -21.767 -5.901 1.00 0.00 O ATOM 0 H TYR A 5 8.505 -22.889 -0.407 1.00 0.00 H new ATOM 0 HA TYR A 5 9.953 -20.482 -1.188 1.00 0.00 H new ATOM 0 HB2 TYR A 5 8.207 -22.624 -2.232 1.00 0.00 H new ATOM 0 HB3 TYR A 5 7.746 -21.071 -2.901 1.00 0.00 H new ATOM 0 HD1 TYR A 5 11.026 -22.650 -1.924 1.00 0.00 H new ATOM 0 HD2 TYR A 5 8.743 -20.669 -4.974 1.00 0.00 H new ATOM 0 HE1 TYR A 5 12.991 -22.717 -3.436 1.00 0.00 H new ATOM 0 HE2 TYR A 5 10.708 -20.730 -6.485 1.00 0.00 H new ATOM 0 HH TYR A 5 12.834 -21.350 -6.757 1.00 0.00 H new ATOM 88 N LEU A 6 6.823 -20.176 -0.361 1.00 0.00 N ATOM 89 CA LEU A 6 5.812 -19.153 0.024 1.00 0.00 C ATOM 90 C LEU A 6 6.130 -18.644 1.428 1.00 0.00 C ATOM 91 O LEU A 6 5.814 -17.525 1.782 1.00 0.00 O ATOM 92 CB LEU A 6 4.465 -19.875 0.000 1.00 0.00 C ATOM 93 CG LEU A 6 4.409 -20.897 1.135 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.668 -20.295 2.330 1.00 0.00 C ATOM 95 CD2 LEU A 6 3.671 -22.148 0.656 1.00 0.00 C ATOM 0 H LEU A 6 6.515 -21.144 -0.272 1.00 0.00 H new ATOM 0 HA LEU A 6 5.806 -18.294 -0.647 1.00 0.00 H new ATOM 0 HB2 LEU A 6 3.653 -19.155 0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 6 4.326 -20.374 -0.959 1.00 0.00 H new ATOM 0 HG LEU A 6 5.423 -21.163 1.434 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.629 -21.025 3.139 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.193 -19.403 2.671 1.00 0.00 H new ATOM 0 HD13 LEU A 6 2.654 -20.028 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 6 3.630 -22.878 1.464 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.658 -21.880 0.357 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.199 -22.578 -0.195 1.00 0.00 H new ATOM 107 N GLY A 7 6.764 -19.459 2.229 1.00 0.00 N ATOM 108 CA GLY A 7 7.116 -19.019 3.607 1.00 0.00 C ATOM 109 C GLY A 7 7.931 -17.730 3.522 1.00 0.00 C ATOM 110 O GLY A 7 7.772 -16.829 4.320 1.00 0.00 O ATOM 0 H GLY A 7 7.052 -20.407 1.988 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.212 -18.855 4.193 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.689 -19.794 4.115 1.00 0.00 H new ATOM 114 N VAL A 8 8.801 -17.633 2.552 1.00 0.00 N ATOM 115 CA VAL A 8 9.622 -16.397 2.411 1.00 0.00 C ATOM 116 C VAL A 8 8.809 -15.315 1.714 1.00 0.00 C ATOM 117 O VAL A 8 8.958 -14.138 1.971 1.00 0.00 O ATOM 118 CB VAL A 8 10.826 -16.807 1.564 1.00 0.00 C ATOM 119 CG1 VAL A 8 11.611 -15.561 1.154 1.00 0.00 C ATOM 120 CG2 VAL A 8 11.729 -17.732 2.382 1.00 0.00 C ATOM 0 H VAL A 8 8.978 -18.355 1.853 1.00 0.00 H new ATOM 0 HA VAL A 8 9.934 -15.991 3.374 1.00 0.00 H new ATOM 0 HB VAL A 8 10.482 -17.328 0.671 1.00 0.00 H new ATOM 0 HG11 VAL A 8 12.470 -15.854 0.550 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.967 -14.900 0.573 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.957 -15.039 2.046 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.589 -18.026 1.780 1.00 0.00 H new ATOM 0 HG22 VAL A 8 12.072 -17.209 3.275 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.170 -18.621 2.675 1.00 0.00 H new ATOM 130 N PHE A 9 7.941 -15.719 0.845 1.00 0.00 N ATOM 131 CA PHE A 9 7.087 -14.729 0.127 1.00 0.00 C ATOM 132 C PHE A 9 6.137 -14.063 1.121 1.00 0.00 C ATOM 133 O PHE A 9 5.804 -12.902 0.999 1.00 0.00 O ATOM 134 CB PHE A 9 6.300 -15.543 -0.901 1.00 0.00 C ATOM 135 CG PHE A 9 6.742 -15.162 -2.294 1.00 0.00 C ATOM 136 CD1 PHE A 9 6.420 -13.900 -2.810 1.00 0.00 C ATOM 137 CD2 PHE A 9 7.473 -16.069 -3.070 1.00 0.00 C ATOM 138 CE1 PHE A 9 6.829 -13.546 -4.101 1.00 0.00 C ATOM 139 CE2 PHE A 9 7.881 -15.715 -4.362 1.00 0.00 C ATOM 140 CZ PHE A 9 7.559 -14.454 -4.877 1.00 0.00 C ATOM 0 H PHE A 9 7.779 -16.694 0.594 1.00 0.00 H new ATOM 0 HA PHE A 9 7.671 -13.942 -0.349 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.460 -16.608 -0.736 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.232 -15.360 -0.784 1.00 0.00 H new ATOM 0 HD1 PHE A 9 5.856 -13.200 -2.211 1.00 0.00 H new ATOM 0 HD2 PHE A 9 7.722 -17.042 -2.672 1.00 0.00 H new ATOM 0 HE1 PHE A 9 6.581 -12.573 -4.498 1.00 0.00 H new ATOM 0 HE2 PHE A 9 8.444 -16.415 -4.961 1.00 0.00 H new ATOM 0 HZ PHE A 9 7.874 -14.181 -5.873 1.00 0.00 H new ATOM 150 N VAL A 10 5.706 -14.795 2.115 1.00 0.00 N ATOM 151 CA VAL A 10 4.783 -14.208 3.128 1.00 0.00 C ATOM 152 C VAL A 10 5.590 -13.470 4.196 1.00 0.00 C ATOM 153 O VAL A 10 5.163 -12.465 4.726 1.00 0.00 O ATOM 154 CB VAL A 10 4.045 -15.400 3.737 1.00 0.00 C ATOM 155 CG1 VAL A 10 3.073 -14.903 4.809 1.00 0.00 C ATOM 156 CG2 VAL A 10 3.264 -16.129 2.641 1.00 0.00 C ATOM 0 H VAL A 10 5.954 -15.773 2.268 1.00 0.00 H new ATOM 0 HA VAL A 10 4.090 -13.488 2.693 1.00 0.00 H new ATOM 0 HB VAL A 10 4.765 -16.083 4.187 1.00 0.00 H new ATOM 0 HG11 VAL A 10 2.546 -15.752 5.244 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.627 -14.381 5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.352 -14.221 4.358 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.737 -16.979 3.074 1.00 0.00 H new ATOM 0 HG22 VAL A 10 2.543 -15.446 2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.955 -16.482 1.875 1.00 0.00 H new ATOM 166 N ASP A 11 6.761 -13.954 4.512 1.00 0.00 N ATOM 167 CA ASP A 11 7.590 -13.261 5.536 1.00 0.00 C ATOM 168 C ASP A 11 8.015 -11.901 4.999 1.00 0.00 C ATOM 169 O ASP A 11 8.357 -10.998 5.736 1.00 0.00 O ATOM 170 CB ASP A 11 8.803 -14.165 5.759 1.00 0.00 C ATOM 171 CG ASP A 11 8.377 -15.410 6.538 1.00 0.00 C ATOM 172 OD1 ASP A 11 7.448 -15.304 7.323 1.00 0.00 O ATOM 173 OD2 ASP A 11 8.985 -16.448 6.337 1.00 0.00 O ATOM 0 H ASP A 11 7.176 -14.794 4.108 1.00 0.00 H new ATOM 0 HA ASP A 11 7.053 -13.090 6.469 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.236 -14.453 4.801 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.575 -13.626 6.308 1.00 0.00 H new ATOM 178 N GLU A 12 7.977 -11.757 3.713 1.00 0.00 N ATOM 179 CA GLU A 12 8.359 -10.462 3.086 1.00 0.00 C ATOM 180 C GLU A 12 7.124 -9.570 2.945 1.00 0.00 C ATOM 181 O GLU A 12 7.147 -8.403 3.282 1.00 0.00 O ATOM 182 CB GLU A 12 8.914 -10.833 1.711 1.00 0.00 C ATOM 183 CG GLU A 12 10.412 -11.122 1.825 1.00 0.00 C ATOM 184 CD GLU A 12 11.183 -10.219 0.860 1.00 0.00 C ATOM 185 OE1 GLU A 12 11.142 -10.483 -0.330 1.00 0.00 O ATOM 186 OE2 GLU A 12 11.801 -9.277 1.329 1.00 0.00 O ATOM 0 H GLU A 12 7.695 -12.486 3.058 1.00 0.00 H new ATOM 0 HA GLU A 12 9.088 -9.911 3.680 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.393 -11.707 1.321 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.743 -10.019 1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.749 -10.951 2.847 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.609 -12.169 1.596 1.00 0.00 H new ATOM 193 N THR A 13 6.043 -10.111 2.450 1.00 0.00 N ATOM 194 CA THR A 13 4.809 -9.289 2.292 1.00 0.00 C ATOM 195 C THR A 13 4.424 -8.662 3.636 1.00 0.00 C ATOM 196 O THR A 13 3.843 -7.596 3.692 1.00 0.00 O ATOM 197 CB THR A 13 3.728 -10.262 1.803 1.00 0.00 C ATOM 198 OG1 THR A 13 2.687 -9.528 1.174 1.00 0.00 O ATOM 199 CG2 THR A 13 3.153 -11.049 2.984 1.00 0.00 C ATOM 0 H THR A 13 5.961 -11.082 2.149 1.00 0.00 H new ATOM 0 HA THR A 13 4.945 -8.467 1.589 1.00 0.00 H new ATOM 0 HB THR A 13 4.171 -10.961 1.093 1.00 0.00 H new ATOM 0 HG1 THR A 13 1.995 -10.146 0.859 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.387 -11.736 2.625 1.00 0.00 H new ATOM 0 HG22 THR A 13 3.950 -11.614 3.467 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.712 -10.357 3.702 1.00 0.00 H new ATOM 207 N LYS A 14 4.754 -9.312 4.719 1.00 0.00 N ATOM 208 CA LYS A 14 4.417 -8.748 6.056 1.00 0.00 C ATOM 209 C LYS A 14 5.484 -7.736 6.467 1.00 0.00 C ATOM 210 O LYS A 14 5.186 -6.624 6.850 1.00 0.00 O ATOM 211 CB LYS A 14 4.412 -9.946 7.004 1.00 0.00 C ATOM 212 CG LYS A 14 3.067 -10.667 6.903 1.00 0.00 C ATOM 213 CD LYS A 14 3.290 -12.178 7.002 1.00 0.00 C ATOM 214 CE LYS A 14 2.868 -12.664 8.390 1.00 0.00 C ATOM 215 NZ LYS A 14 3.974 -12.242 9.294 1.00 0.00 N ATOM 0 H LYS A 14 5.242 -10.208 4.735 1.00 0.00 H new ATOM 0 HA LYS A 14 3.459 -8.228 6.064 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.223 -10.628 6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.584 -9.614 8.028 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.403 -10.334 7.700 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.580 -10.421 5.959 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.714 -12.693 6.233 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.339 -12.414 6.825 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.919 -12.221 8.693 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.735 -13.746 8.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.837 -12.668 10.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.884 -12.557 8.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 3.975 -11.206 9.381 1.00 0.00 H new ATOM 229 N GLU A 15 6.730 -8.104 6.376 1.00 0.00 N ATOM 230 CA GLU A 15 7.807 -7.146 6.745 1.00 0.00 C ATOM 231 C GLU A 15 7.768 -5.953 5.795 1.00 0.00 C ATOM 232 O GLU A 15 8.368 -4.923 6.037 1.00 0.00 O ATOM 233 CB GLU A 15 9.110 -7.929 6.587 1.00 0.00 C ATOM 234 CG GLU A 15 9.218 -8.967 7.705 1.00 0.00 C ATOM 235 CD GLU A 15 10.680 -9.387 7.870 1.00 0.00 C ATOM 236 OE1 GLU A 15 11.247 -9.880 6.909 1.00 0.00 O ATOM 237 OE2 GLU A 15 11.207 -9.207 8.955 1.00 0.00 O ATOM 0 H GLU A 15 7.048 -9.021 6.064 1.00 0.00 H new ATOM 0 HA GLU A 15 7.700 -6.757 7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.136 -8.421 5.615 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.962 -7.250 6.623 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.840 -8.552 8.639 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.603 -9.836 7.470 1.00 0.00 H new ATOM 244 N TYR A 16 7.055 -6.094 4.719 1.00 0.00 N ATOM 245 CA TYR A 16 6.946 -4.986 3.733 1.00 0.00 C ATOM 246 C TYR A 16 5.736 -4.104 4.061 1.00 0.00 C ATOM 247 O TYR A 16 5.818 -2.895 4.022 1.00 0.00 O ATOM 248 CB TYR A 16 6.770 -5.674 2.378 1.00 0.00 C ATOM 249 CG TYR A 16 8.123 -5.866 1.731 1.00 0.00 C ATOM 250 CD1 TYR A 16 9.222 -6.260 2.503 1.00 0.00 C ATOM 251 CD2 TYR A 16 8.275 -5.649 0.356 1.00 0.00 C ATOM 252 CE1 TYR A 16 10.475 -6.436 1.900 1.00 0.00 C ATOM 253 CE2 TYR A 16 9.527 -5.825 -0.247 1.00 0.00 C ATOM 254 CZ TYR A 16 10.627 -6.219 0.524 1.00 0.00 C ATOM 255 OH TYR A 16 11.861 -6.392 -0.070 1.00 0.00 O ATOM 0 H TYR A 16 6.537 -6.938 4.476 1.00 0.00 H new ATOM 0 HA TYR A 16 7.820 -4.335 3.742 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.277 -6.638 2.509 1.00 0.00 H new ATOM 0 HB3 TYR A 16 6.129 -5.073 1.733 1.00 0.00 H new ATOM 0 HD1 TYR A 16 9.105 -6.428 3.563 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.427 -5.346 -0.240 1.00 0.00 H new ATOM 0 HE1 TYR A 16 11.323 -6.739 2.496 1.00 0.00 H new ATOM 0 HE2 TYR A 16 9.644 -5.657 -1.307 1.00 0.00 H new ATOM 0 HH TYR A 16 12.198 -7.290 0.132 1.00 0.00 H new ATOM 265 N LEU A 17 4.614 -4.692 4.392 1.00 0.00 N ATOM 266 CA LEU A 17 3.422 -3.858 4.726 1.00 0.00 C ATOM 267 C LEU A 17 3.754 -2.971 5.925 1.00 0.00 C ATOM 268 O LEU A 17 3.325 -1.838 6.014 1.00 0.00 O ATOM 269 CB LEU A 17 2.293 -4.849 5.044 1.00 0.00 C ATOM 270 CG LEU A 17 2.415 -5.354 6.484 1.00 0.00 C ATOM 271 CD1 LEU A 17 1.806 -4.329 7.440 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.667 -6.683 6.620 1.00 0.00 C ATOM 0 H LEU A 17 4.473 -5.701 4.445 1.00 0.00 H new ATOM 0 HA LEU A 17 3.125 -3.197 3.912 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.326 -4.366 4.902 1.00 0.00 H new ATOM 0 HB3 LEU A 17 2.334 -5.690 4.352 1.00 0.00 H new ATOM 0 HG LEU A 17 3.467 -5.498 6.730 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.894 -4.690 8.465 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.335 -3.381 7.343 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.754 -4.184 7.195 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.752 -7.045 7.645 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.616 -6.536 6.373 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.100 -7.416 5.939 1.00 0.00 H new ATOM 284 N GLN A 18 4.550 -3.470 6.828 1.00 0.00 N ATOM 285 CA GLN A 18 4.953 -2.653 7.998 1.00 0.00 C ATOM 286 C GLN A 18 5.961 -1.632 7.516 1.00 0.00 C ATOM 287 O GLN A 18 5.866 -0.452 7.790 1.00 0.00 O ATOM 288 CB GLN A 18 5.549 -3.660 8.979 1.00 0.00 C ATOM 289 CG GLN A 18 7.011 -3.332 9.315 1.00 0.00 C ATOM 290 CD GLN A 18 7.569 -4.395 10.262 1.00 0.00 C ATOM 291 OE1 GLN A 18 6.877 -4.866 11.143 1.00 0.00 O ATOM 292 NE2 GLN A 18 8.802 -4.797 10.117 1.00 0.00 N ATOM 0 H GLN A 18 4.939 -4.413 6.803 1.00 0.00 H new ATOM 0 HA GLN A 18 4.145 -2.101 8.477 1.00 0.00 H new ATOM 0 HB2 GLN A 18 4.959 -3.668 9.895 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.490 -4.661 8.553 1.00 0.00 H new ATOM 0 HG2 GLN A 18 7.605 -3.295 8.402 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.077 -2.347 9.778 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.384 -4.402 9.378 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.184 -5.506 10.743 1.00 0.00 H new ATOM 301 N ASN A 19 6.888 -2.083 6.743 1.00 0.00 N ATOM 302 CA ASN A 19 7.876 -1.149 6.163 1.00 0.00 C ATOM 303 C ASN A 19 7.101 -0.191 5.275 1.00 0.00 C ATOM 304 O ASN A 19 7.507 0.925 5.014 1.00 0.00 O ATOM 305 CB ASN A 19 8.830 -2.024 5.348 1.00 0.00 C ATOM 306 CG ASN A 19 10.076 -2.332 6.181 1.00 0.00 C ATOM 307 OD1 ASN A 19 9.972 -2.751 7.317 1.00 0.00 O ATOM 308 ND2 ASN A 19 11.258 -2.142 5.663 1.00 0.00 N ATOM 0 H ASN A 19 7.008 -3.062 6.484 1.00 0.00 H new ATOM 0 HA ASN A 19 8.437 -0.570 6.896 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.334 -2.951 5.060 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.112 -1.513 4.427 1.00 0.00 H new ATOM 0 HD21 ASN A 19 12.094 -2.345 6.211 1.00 0.00 H new ATOM 0 HD22 ASN A 19 11.346 -1.790 4.710 1.00 0.00 H new ATOM 315 N LEU A 20 5.956 -0.633 4.845 1.00 0.00 N ATOM 316 CA LEU A 20 5.084 0.219 4.003 1.00 0.00 C ATOM 317 C LEU A 20 4.133 0.996 4.903 1.00 0.00 C ATOM 318 O LEU A 20 3.471 1.921 4.477 1.00 0.00 O ATOM 319 CB LEU A 20 4.319 -0.753 3.101 1.00 0.00 C ATOM 320 CG LEU A 20 3.081 -0.063 2.525 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.511 0.984 1.496 1.00 0.00 C ATOM 322 CD2 LEU A 20 2.188 -1.107 1.848 1.00 0.00 C ATOM 0 H LEU A 20 5.584 -1.561 5.045 1.00 0.00 H new ATOM 0 HA LEU A 20 5.640 0.946 3.411 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.964 -1.097 2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.023 -1.635 3.670 1.00 0.00 H new ATOM 0 HG LEU A 20 2.529 0.425 3.328 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.628 1.475 1.086 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.149 1.726 1.977 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.063 0.498 0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.305 -0.618 1.436 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.741 -1.593 1.044 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.881 -1.854 2.581 1.00 0.00 H new ATOM 334 N ASN A 21 4.100 0.657 6.162 1.00 0.00 N ATOM 335 CA ASN A 21 3.246 1.400 7.100 1.00 0.00 C ATOM 336 C ASN A 21 4.114 2.467 7.690 1.00 0.00 C ATOM 337 O ASN A 21 3.693 3.561 7.984 1.00 0.00 O ATOM 338 CB ASN A 21 2.819 0.398 8.164 1.00 0.00 C ATOM 339 CG ASN A 21 1.362 -0.008 7.933 1.00 0.00 C ATOM 340 OD1 ASN A 21 0.697 0.533 7.073 1.00 0.00 O ATOM 341 ND2 ASN A 21 0.834 -0.946 8.673 1.00 0.00 N ATOM 0 H ASN A 21 4.634 -0.108 6.573 1.00 0.00 H new ATOM 0 HA ASN A 21 2.364 1.851 6.644 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.462 -0.481 8.128 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.932 0.835 9.156 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.137 -1.224 8.528 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.392 -1.401 9.395 1.00 0.00 H new ATOM 348 N ASP A 22 5.355 2.144 7.831 1.00 0.00 N ATOM 349 CA ASP A 22 6.297 3.130 8.370 1.00 0.00 C ATOM 350 C ASP A 22 6.451 4.220 7.332 1.00 0.00 C ATOM 351 O ASP A 22 6.627 5.385 7.624 1.00 0.00 O ATOM 352 CB ASP A 22 7.610 2.382 8.604 1.00 0.00 C ATOM 353 CG ASP A 22 7.386 1.270 9.630 1.00 0.00 C ATOM 354 OD1 ASP A 22 6.242 0.891 9.822 1.00 0.00 O ATOM 355 OD2 ASP A 22 8.362 0.818 10.206 1.00 0.00 O ATOM 0 H ASP A 22 5.756 1.236 7.595 1.00 0.00 H new ATOM 0 HA ASP A 22 5.968 3.587 9.303 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.972 1.959 7.667 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.376 3.071 8.960 1.00 0.00 H new ATOM 360 N THR A 23 6.337 3.820 6.111 1.00 0.00 N ATOM 361 CA THR A 23 6.417 4.771 4.980 1.00 0.00 C ATOM 362 C THR A 23 5.121 5.567 4.918 1.00 0.00 C ATOM 363 O THR A 23 5.114 6.766 4.716 1.00 0.00 O ATOM 364 CB THR A 23 6.510 3.865 3.769 1.00 0.00 C ATOM 365 OG1 THR A 23 7.712 3.111 3.830 1.00 0.00 O ATOM 366 CG2 THR A 23 6.482 4.699 2.489 1.00 0.00 C ATOM 0 H THR A 23 6.188 2.848 5.839 1.00 0.00 H new ATOM 0 HA THR A 23 7.246 5.475 5.054 1.00 0.00 H new ATOM 0 HB THR A 23 5.659 3.184 3.764 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.498 2.155 3.849 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.549 4.040 1.624 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.551 5.264 2.443 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.326 5.389 2.486 1.00 0.00 H new ATOM 374 N LEU A 24 4.019 4.895 5.107 1.00 0.00 N ATOM 375 CA LEU A 24 2.712 5.591 5.077 1.00 0.00 C ATOM 376 C LEU A 24 2.526 6.318 6.398 1.00 0.00 C ATOM 377 O LEU A 24 1.852 7.324 6.477 1.00 0.00 O ATOM 378 CB LEU A 24 1.670 4.483 4.916 1.00 0.00 C ATOM 379 CG LEU A 24 1.725 3.932 3.489 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.932 2.626 3.416 1.00 0.00 C ATOM 381 CD2 LEU A 24 1.116 4.952 2.525 1.00 0.00 C ATOM 0 H LEU A 24 3.972 3.891 5.281 1.00 0.00 H new ATOM 0 HA LEU A 24 2.631 6.324 4.274 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.860 3.684 5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.674 4.872 5.129 1.00 0.00 H new ATOM 0 HG LEU A 24 2.762 3.744 3.212 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.971 2.233 2.400 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.365 1.899 4.103 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.105 2.814 3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.155 4.560 1.509 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.079 5.140 2.802 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.680 5.883 2.577 1.00 0.00 H new ATOM 393 N LEU A 25 3.134 5.817 7.441 1.00 0.00 N ATOM 394 CA LEU A 25 3.001 6.491 8.766 1.00 0.00 C ATOM 395 C LEU A 25 3.903 7.701 8.820 1.00 0.00 C ATOM 396 O LEU A 25 3.695 8.625 9.581 1.00 0.00 O ATOM 397 CB LEU A 25 3.413 5.449 9.790 1.00 0.00 C ATOM 398 CG LEU A 25 2.282 4.447 9.898 1.00 0.00 C ATOM 399 CD1 LEU A 25 2.780 3.178 10.589 1.00 0.00 C ATOM 400 CD2 LEU A 25 1.141 5.074 10.699 1.00 0.00 C ATOM 0 H LEU A 25 3.713 4.977 7.434 1.00 0.00 H new ATOM 0 HA LEU A 25 1.988 6.847 8.954 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.335 4.955 9.485 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.606 5.916 10.756 1.00 0.00 H new ATOM 0 HG LEU A 25 1.924 4.182 8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.963 2.460 10.664 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.593 2.743 10.008 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.139 3.425 11.588 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.321 4.361 10.783 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.497 5.337 11.695 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.790 5.972 10.191 1.00 0.00 H new ATOM 412 N GLU A 26 4.859 7.729 7.963 1.00 0.00 N ATOM 413 CA GLU A 26 5.742 8.905 7.883 1.00 0.00 C ATOM 414 C GLU A 26 5.130 9.795 6.835 1.00 0.00 C ATOM 415 O GLU A 26 5.301 10.999 6.817 1.00 0.00 O ATOM 416 CB GLU A 26 7.117 8.379 7.467 1.00 0.00 C ATOM 417 CG GLU A 26 7.800 7.739 8.676 1.00 0.00 C ATOM 418 CD GLU A 26 9.231 7.348 8.307 1.00 0.00 C ATOM 419 OE1 GLU A 26 9.810 8.018 7.467 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.725 6.385 8.870 1.00 0.00 O ATOM 0 H GLU A 26 5.073 6.980 7.304 1.00 0.00 H new ATOM 0 HA GLU A 26 5.851 9.465 8.812 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.012 7.648 6.665 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.728 9.193 7.078 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.807 8.436 9.514 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.243 6.859 8.998 1.00 0.00 H new ATOM 427 N LEU A 27 4.385 9.181 5.967 1.00 0.00 N ATOM 428 CA LEU A 27 3.706 9.931 4.914 1.00 0.00 C ATOM 429 C LEU A 27 2.580 10.754 5.535 1.00 0.00 C ATOM 430 O LEU A 27 2.247 11.821 5.063 1.00 0.00 O ATOM 431 CB LEU A 27 3.165 8.875 3.951 1.00 0.00 C ATOM 432 CG LEU A 27 2.276 9.546 2.907 1.00 0.00 C ATOM 433 CD1 LEU A 27 3.125 10.472 2.035 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.620 8.478 2.029 1.00 0.00 C ATOM 0 H LEU A 27 4.223 8.174 5.952 1.00 0.00 H new ATOM 0 HA LEU A 27 4.362 10.628 4.393 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.990 8.356 3.463 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.597 8.124 4.500 1.00 0.00 H new ATOM 0 HG LEU A 27 1.502 10.127 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.491 10.952 1.289 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.591 11.234 2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.899 9.891 1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.986 8.959 1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.392 7.895 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.014 7.818 2.650 1.00 0.00 H new ATOM 446 N GLU A 28 2.006 10.285 6.615 1.00 0.00 N ATOM 447 CA GLU A 28 0.933 11.080 7.270 1.00 0.00 C ATOM 448 C GLU A 28 1.573 12.331 7.859 1.00 0.00 C ATOM 449 O GLU A 28 1.045 13.421 7.763 1.00 0.00 O ATOM 450 CB GLU A 28 0.372 10.202 8.387 1.00 0.00 C ATOM 451 CG GLU A 28 0.244 8.760 7.903 1.00 0.00 C ATOM 452 CD GLU A 28 -0.981 8.110 8.547 1.00 0.00 C ATOM 453 OE1 GLU A 28 -1.805 8.837 9.077 1.00 0.00 O ATOM 454 OE2 GLU A 28 -1.072 6.893 8.501 1.00 0.00 O ATOM 0 H GLU A 28 2.233 9.397 7.064 1.00 0.00 H new ATOM 0 HA GLU A 28 0.143 11.374 6.579 1.00 0.00 H new ATOM 0 HB2 GLU A 28 1.026 10.245 9.258 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.602 10.577 8.701 1.00 0.00 H new ATOM 0 HG2 GLU A 28 0.152 8.737 6.817 1.00 0.00 H new ATOM 0 HG3 GLU A 28 1.143 8.199 8.159 1.00 0.00 H new ATOM 461 N LYS A 29 2.731 12.178 8.446 1.00 0.00 N ATOM 462 CA LYS A 29 3.434 13.360 9.015 1.00 0.00 C ATOM 463 C LYS A 29 3.994 14.188 7.861 1.00 0.00 C ATOM 464 O LYS A 29 4.242 15.372 7.969 1.00 0.00 O ATOM 465 CB LYS A 29 4.530 12.768 9.908 1.00 0.00 C ATOM 466 CG LYS A 29 5.901 12.821 9.225 1.00 0.00 C ATOM 467 CD LYS A 29 6.742 11.650 9.716 1.00 0.00 C ATOM 468 CE LYS A 29 7.691 11.207 8.604 1.00 0.00 C ATOM 469 NZ LYS A 29 8.888 12.082 8.747 1.00 0.00 N ATOM 0 H LYS A 29 3.217 11.288 8.555 1.00 0.00 H new ATOM 0 HA LYS A 29 2.797 14.027 9.596 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.570 13.317 10.849 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.283 11.735 10.152 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.785 12.774 8.142 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.399 13.764 9.451 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.310 11.941 10.600 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.097 10.822 10.010 1.00 0.00 H new ATOM 0 HE2 LYS A 29 7.957 10.155 8.708 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.231 11.324 7.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.691 11.657 8.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.683 13.019 8.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.127 12.182 9.754 1.00 0.00 H new ATOM 483 N ASN A 30 4.152 13.540 6.752 1.00 0.00 N ATOM 484 CA ASN A 30 4.655 14.214 5.522 1.00 0.00 C ATOM 485 C ASN A 30 3.907 13.628 4.347 1.00 0.00 C ATOM 486 O ASN A 30 4.406 12.798 3.613 1.00 0.00 O ATOM 487 CB ASN A 30 6.153 13.913 5.442 1.00 0.00 C ATOM 488 CG ASN A 30 6.910 14.807 6.425 1.00 0.00 C ATOM 489 OD1 ASN A 30 7.396 14.342 7.437 1.00 0.00 O ATOM 490 ND2 ASN A 30 7.034 16.081 6.168 1.00 0.00 N ATOM 0 H ASN A 30 3.950 12.547 6.637 1.00 0.00 H new ATOM 0 HA ASN A 30 4.503 15.293 5.527 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.336 12.864 5.674 1.00 0.00 H new ATOM 0 HB3 ASN A 30 6.515 14.083 4.428 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.539 16.685 6.817 1.00 0.00 H new ATOM 0 HD22 ASN A 30 6.626 16.472 5.319 1.00 0.00 H new ATOM 497 N PRO A 31 2.695 14.066 4.260 1.00 0.00 N ATOM 498 CA PRO A 31 1.773 13.580 3.229 1.00 0.00 C ATOM 499 C PRO A 31 1.923 14.371 1.927 1.00 0.00 C ATOM 500 O PRO A 31 1.079 14.312 1.056 1.00 0.00 O ATOM 501 CB PRO A 31 0.422 13.820 3.875 1.00 0.00 C ATOM 502 CG PRO A 31 0.607 14.942 4.847 1.00 0.00 C ATOM 503 CD PRO A 31 2.072 15.062 5.135 1.00 0.00 C ATOM 0 HA PRO A 31 1.942 12.542 2.942 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -0.326 14.076 3.125 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.070 12.922 4.382 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.222 15.874 4.433 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.052 14.748 5.765 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.439 16.066 4.920 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.289 14.861 6.184 1.00 0.00 H new ATOM 511 N GLU A 32 2.993 15.096 1.782 1.00 0.00 N ATOM 512 CA GLU A 32 3.204 15.875 0.531 1.00 0.00 C ATOM 513 C GLU A 32 4.592 15.563 -0.011 1.00 0.00 C ATOM 514 O GLU A 32 4.981 16.015 -1.070 1.00 0.00 O ATOM 515 CB GLU A 32 3.089 17.360 0.913 1.00 0.00 C ATOM 516 CG GLU A 32 2.524 17.503 2.330 1.00 0.00 C ATOM 517 CD GLU A 32 2.569 18.971 2.759 1.00 0.00 C ATOM 518 OE1 GLU A 32 2.902 19.801 1.931 1.00 0.00 O ATOM 519 OE2 GLU A 32 2.269 19.239 3.911 1.00 0.00 O ATOM 0 H GLU A 32 3.734 15.184 2.477 1.00 0.00 H new ATOM 0 HA GLU A 32 2.474 15.625 -0.239 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.069 17.834 0.855 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.443 17.876 0.203 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.498 17.137 2.361 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.101 16.893 3.025 1.00 0.00 H new ATOM 526 N ASP A 33 5.339 14.783 0.716 1.00 0.00 N ATOM 527 CA ASP A 33 6.700 14.420 0.261 1.00 0.00 C ATOM 528 C ASP A 33 6.608 13.297 -0.773 1.00 0.00 C ATOM 529 O ASP A 33 6.049 12.250 -0.513 1.00 0.00 O ATOM 530 CB ASP A 33 7.426 13.937 1.518 1.00 0.00 C ATOM 531 CG ASP A 33 7.663 15.118 2.461 1.00 0.00 C ATOM 532 OD1 ASP A 33 6.777 15.949 2.573 1.00 0.00 O ATOM 533 OD2 ASP A 33 8.727 15.171 3.055 1.00 0.00 O ATOM 0 H ASP A 33 5.060 14.381 1.611 1.00 0.00 H new ATOM 0 HA ASP A 33 7.223 15.253 -0.208 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.835 13.171 2.020 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.377 13.479 1.247 1.00 0.00 H new ATOM 538 N MET A 34 7.138 13.503 -1.945 1.00 0.00 N ATOM 539 CA MET A 34 7.063 12.442 -2.987 1.00 0.00 C ATOM 540 C MET A 34 7.918 11.236 -2.596 1.00 0.00 C ATOM 541 O MET A 34 7.921 10.227 -3.270 1.00 0.00 O ATOM 542 CB MET A 34 7.598 13.095 -4.261 1.00 0.00 C ATOM 543 CG MET A 34 6.426 13.515 -5.150 1.00 0.00 C ATOM 544 SD MET A 34 6.874 13.287 -6.889 1.00 0.00 S ATOM 545 CE MET A 34 5.310 13.852 -7.602 1.00 0.00 C ATOM 0 H MET A 34 7.619 14.357 -2.226 1.00 0.00 H new ATOM 0 HA MET A 34 6.047 12.070 -3.116 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.207 13.963 -4.009 1.00 0.00 H new ATOM 0 HB3 MET A 34 8.243 12.398 -4.796 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.543 12.922 -4.910 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.170 14.558 -4.963 1.00 0.00 H new ATOM 0 HE1 MET A 34 4.937 13.103 -8.301 1.00 0.00 H new ATOM 0 HE2 MET A 34 4.580 14.001 -6.806 1.00 0.00 H new ATOM 0 HE3 MET A 34 5.469 14.793 -8.129 1.00 0.00 H new ATOM 555 N GLU A 35 8.631 11.316 -1.506 1.00 0.00 N ATOM 556 CA GLU A 35 9.459 10.155 -1.088 1.00 0.00 C ATOM 557 C GLU A 35 8.556 9.113 -0.444 1.00 0.00 C ATOM 558 O GLU A 35 8.458 7.993 -0.906 1.00 0.00 O ATOM 559 CB GLU A 35 10.467 10.709 -0.081 1.00 0.00 C ATOM 560 CG GLU A 35 11.832 10.852 -0.754 1.00 0.00 C ATOM 561 CD GLU A 35 12.930 10.397 0.209 1.00 0.00 C ATOM 562 OE1 GLU A 35 12.648 9.552 1.042 1.00 0.00 O ATOM 563 OE2 GLU A 35 14.036 10.901 0.096 1.00 0.00 O ATOM 0 H GLU A 35 8.675 12.130 -0.892 1.00 0.00 H new ATOM 0 HA GLU A 35 9.971 9.676 -1.923 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.130 11.676 0.292 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.541 10.044 0.779 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.864 10.255 -1.665 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.998 11.889 -1.046 1.00 0.00 H new ATOM 570 N LEU A 36 7.866 9.473 0.603 1.00 0.00 N ATOM 571 CA LEU A 36 6.951 8.490 1.234 1.00 0.00 C ATOM 572 C LEU A 36 5.855 8.149 0.234 1.00 0.00 C ATOM 573 O LEU A 36 5.270 7.085 0.267 1.00 0.00 O ATOM 574 CB LEU A 36 6.363 9.185 2.466 1.00 0.00 C ATOM 575 CG LEU A 36 7.475 9.820 3.308 1.00 0.00 C ATOM 576 CD1 LEU A 36 6.993 9.976 4.748 1.00 0.00 C ATOM 577 CD2 LEU A 36 8.726 8.935 3.290 1.00 0.00 C ATOM 0 H LEU A 36 7.897 10.393 1.042 1.00 0.00 H new ATOM 0 HA LEU A 36 7.455 7.567 1.521 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.653 9.951 2.154 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.810 8.464 3.068 1.00 0.00 H new ATOM 0 HG LEU A 36 7.722 10.796 2.889 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.782 10.428 5.349 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.110 10.615 4.769 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.742 8.997 5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.508 9.398 3.892 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.484 7.955 3.701 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.077 8.822 2.264 1.00 0.00 H new ATOM 589 N ILE A 37 5.590 9.049 -0.673 1.00 0.00 N ATOM 590 CA ILE A 37 4.553 8.786 -1.697 1.00 0.00 C ATOM 591 C ILE A 37 5.122 7.824 -2.740 1.00 0.00 C ATOM 592 O ILE A 37 4.417 7.004 -3.294 1.00 0.00 O ATOM 593 CB ILE A 37 4.264 10.154 -2.309 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.550 11.029 -1.279 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.375 9.997 -3.541 1.00 0.00 C ATOM 596 CD1 ILE A 37 3.149 12.355 -1.929 1.00 0.00 C ATOM 0 H ILE A 37 6.051 9.956 -0.745 1.00 0.00 H new ATOM 0 HA ILE A 37 3.648 8.330 -1.295 1.00 0.00 H new ATOM 0 HB ILE A 37 5.204 10.621 -2.602 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.667 10.516 -0.899 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.203 11.212 -0.426 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.174 10.978 -3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.882 9.374 -4.278 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.435 9.527 -3.254 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.640 12.980 -1.196 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.041 12.869 -2.287 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.480 12.161 -2.768 1.00 0.00 H new ATOM 608 N ASN A 38 6.403 7.909 -2.998 1.00 0.00 N ATOM 609 CA ASN A 38 7.019 6.986 -3.990 1.00 0.00 C ATOM 610 C ASN A 38 7.525 5.734 -3.287 1.00 0.00 C ATOM 611 O ASN A 38 7.609 4.667 -3.865 1.00 0.00 O ATOM 612 CB ASN A 38 8.173 7.770 -4.613 1.00 0.00 C ATOM 613 CG ASN A 38 8.963 6.857 -5.552 1.00 0.00 C ATOM 614 OD1 ASN A 38 10.178 6.851 -5.536 1.00 0.00 O ATOM 615 ND2 ASN A 38 8.318 6.079 -6.379 1.00 0.00 N ATOM 0 H ASN A 38 7.043 8.575 -2.565 1.00 0.00 H new ATOM 0 HA ASN A 38 6.309 6.658 -4.749 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.788 8.629 -5.163 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.826 8.158 -3.832 1.00 0.00 H new ATOM 0 HD21 ASN A 38 8.834 5.467 -7.011 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.298 6.083 -6.393 1.00 0.00 H new ATOM 622 N GLU A 39 7.844 5.855 -2.038 1.00 0.00 N ATOM 623 CA GLU A 39 8.330 4.672 -1.276 1.00 0.00 C ATOM 624 C GLU A 39 7.155 3.741 -1.019 1.00 0.00 C ATOM 625 O GLU A 39 7.293 2.537 -0.915 1.00 0.00 O ATOM 626 CB GLU A 39 8.882 5.230 0.037 1.00 0.00 C ATOM 627 CG GLU A 39 10.288 5.786 -0.193 1.00 0.00 C ATOM 628 CD GLU A 39 11.310 4.654 -0.071 1.00 0.00 C ATOM 629 OE1 GLU A 39 11.184 3.689 -0.806 1.00 0.00 O ATOM 630 OE2 GLU A 39 12.198 4.772 0.756 1.00 0.00 O ATOM 0 H GLU A 39 7.791 6.723 -1.505 1.00 0.00 H new ATOM 0 HA GLU A 39 9.094 4.106 -1.809 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.227 6.015 0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.909 4.446 0.794 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.353 6.244 -1.180 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.506 6.567 0.536 1.00 0.00 H new ATOM 637 N ALA A 40 5.995 4.310 -0.943 1.00 0.00 N ATOM 638 CA ALA A 40 4.769 3.502 -0.716 1.00 0.00 C ATOM 639 C ALA A 40 4.187 3.083 -2.067 1.00 0.00 C ATOM 640 O ALA A 40 3.848 1.935 -2.276 1.00 0.00 O ATOM 641 CB ALA A 40 3.815 4.431 0.036 1.00 0.00 C ATOM 0 H ALA A 40 5.838 5.314 -1.029 1.00 0.00 H new ATOM 0 HA ALA A 40 4.955 2.589 -0.150 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.882 3.906 0.242 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.273 4.739 0.976 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.609 5.311 -0.573 1.00 0.00 H new ATOM 647 N PHE A 41 4.086 3.997 -3.001 1.00 0.00 N ATOM 648 CA PHE A 41 3.551 3.619 -4.337 1.00 0.00 C ATOM 649 C PHE A 41 4.255 2.343 -4.810 1.00 0.00 C ATOM 650 O PHE A 41 3.628 1.384 -5.210 1.00 0.00 O ATOM 651 CB PHE A 41 3.888 4.806 -5.250 1.00 0.00 C ATOM 652 CG PHE A 41 3.951 4.345 -6.690 1.00 0.00 C ATOM 653 CD1 PHE A 41 5.142 3.812 -7.199 1.00 0.00 C ATOM 654 CD2 PHE A 41 2.824 4.449 -7.512 1.00 0.00 C ATOM 655 CE1 PHE A 41 5.204 3.382 -8.530 1.00 0.00 C ATOM 656 CE2 PHE A 41 2.886 4.019 -8.844 1.00 0.00 C ATOM 657 CZ PHE A 41 4.077 3.485 -9.352 1.00 0.00 C ATOM 0 H PHE A 41 4.349 4.977 -2.894 1.00 0.00 H new ATOM 0 HA PHE A 41 2.480 3.418 -4.331 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.134 5.586 -5.141 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.843 5.243 -4.956 1.00 0.00 H new ATOM 0 HD1 PHE A 41 6.013 3.733 -6.565 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.906 4.861 -7.120 1.00 0.00 H new ATOM 0 HE1 PHE A 41 6.122 2.971 -8.922 1.00 0.00 H new ATOM 0 HE2 PHE A 41 2.016 4.099 -9.479 1.00 0.00 H new ATOM 0 HZ PHE A 41 4.125 3.153 -10.378 1.00 0.00 H new ATOM 667 N ARG A 42 5.560 2.330 -4.752 1.00 0.00 N ATOM 668 CA ARG A 42 6.317 1.122 -5.183 1.00 0.00 C ATOM 669 C ARG A 42 5.946 -0.064 -4.295 1.00 0.00 C ATOM 670 O ARG A 42 5.359 -1.027 -4.744 1.00 0.00 O ATOM 671 CB ARG A 42 7.787 1.487 -4.989 1.00 0.00 C ATOM 672 CG ARG A 42 8.195 2.549 -6.009 1.00 0.00 C ATOM 673 CD ARG A 42 9.720 2.637 -6.058 1.00 0.00 C ATOM 674 NE ARG A 42 10.076 2.388 -7.483 1.00 0.00 N ATOM 675 CZ ARG A 42 10.269 1.167 -7.905 1.00 0.00 C ATOM 676 NH1 ARG A 42 9.272 0.326 -7.947 1.00 0.00 N ATOM 677 NH2 ARG A 42 11.459 0.788 -8.283 1.00 0.00 N ATOM 0 H ARG A 42 6.134 3.106 -4.424 1.00 0.00 H new ATOM 0 HA ARG A 42 6.099 0.840 -6.213 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.948 1.860 -3.978 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.410 0.600 -5.105 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.801 2.296 -6.993 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.771 3.515 -5.735 1.00 0.00 H new ATOM 0 HD2 ARG A 42 10.069 3.616 -5.729 1.00 0.00 H new ATOM 0 HD3 ARG A 42 10.179 1.898 -5.402 1.00 0.00 H new ATOM 0 HE ARG A 42 10.169 3.171 -8.130 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.342 0.622 -7.650 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.423 -0.627 -8.277 1.00 0.00 H new ATOM 0 HH21 ARG A 42 12.238 1.445 -8.249 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.610 -0.165 -8.613 1.00 0.00 H new ATOM 691 N ALA A 43 6.285 0.005 -3.034 1.00 0.00 N ATOM 692 CA ALA A 43 5.952 -1.116 -2.107 1.00 0.00 C ATOM 693 C ALA A 43 4.553 -1.650 -2.410 1.00 0.00 C ATOM 694 O ALA A 43 4.361 -2.835 -2.591 1.00 0.00 O ATOM 695 CB ALA A 43 6.003 -0.504 -0.708 1.00 0.00 C ATOM 0 H ALA A 43 6.778 0.789 -2.607 1.00 0.00 H new ATOM 0 HA ALA A 43 6.641 -1.955 -2.207 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.768 -1.269 0.032 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.002 -0.110 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.275 0.304 -0.638 1.00 0.00 H new ATOM 701 N LEU A 44 3.577 -0.787 -2.488 1.00 0.00 N ATOM 702 CA LEU A 44 2.198 -1.257 -2.798 1.00 0.00 C ATOM 703 C LEU A 44 2.172 -1.837 -4.208 1.00 0.00 C ATOM 704 O LEU A 44 1.521 -2.828 -4.474 1.00 0.00 O ATOM 705 CB LEU A 44 1.317 -0.013 -2.704 1.00 0.00 C ATOM 706 CG LEU A 44 1.115 0.355 -1.235 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.841 1.854 -1.118 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.074 -0.426 -0.672 1.00 0.00 C ATOM 0 H LEU A 44 3.675 0.219 -2.351 1.00 0.00 H new ATOM 0 HA LEU A 44 1.853 -2.036 -2.118 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.781 0.816 -3.238 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.354 -0.199 -3.180 1.00 0.00 H new ATOM 0 HG LEU A 44 2.014 0.105 -0.671 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.697 2.117 -0.070 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.688 2.411 -1.519 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.058 2.105 -1.682 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.218 -0.164 0.376 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.973 -0.176 -1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.121 -1.495 -0.755 1.00 0.00 H new ATOM 720 N HIS A 45 2.898 -1.237 -5.110 1.00 0.00 N ATOM 721 CA HIS A 45 2.940 -1.765 -6.499 1.00 0.00 C ATOM 722 C HIS A 45 3.681 -3.099 -6.487 1.00 0.00 C ATOM 723 O HIS A 45 3.369 -4.009 -7.229 1.00 0.00 O ATOM 724 CB HIS A 45 3.717 -0.717 -7.294 1.00 0.00 C ATOM 725 CG HIS A 45 3.489 -0.931 -8.767 1.00 0.00 C ATOM 726 ND1 HIS A 45 2.482 -1.752 -9.249 1.00 0.00 N ATOM 727 CD2 HIS A 45 4.130 -0.435 -9.875 1.00 0.00 C ATOM 728 CE1 HIS A 45 2.546 -1.727 -10.593 1.00 0.00 C ATOM 729 NE2 HIS A 45 3.532 -0.940 -11.027 1.00 0.00 N ATOM 0 H HIS A 45 3.463 -0.404 -4.944 1.00 0.00 H new ATOM 0 HA HIS A 45 1.953 -1.936 -6.930 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.395 0.284 -7.007 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.781 -0.787 -7.066 1.00 0.00 H new ATOM 0 HD2 HIS A 45 4.970 0.243 -9.856 1.00 0.00 H new ATOM 0 HE1 HIS A 45 1.880 -2.277 -11.241 1.00 0.00 H new ATOM 0 HE2 HIS A 45 3.792 -0.749 -11.995 1.00 0.00 H new ATOM 737 N THR A 46 4.647 -3.221 -5.619 1.00 0.00 N ATOM 738 CA THR A 46 5.403 -4.495 -5.515 1.00 0.00 C ATOM 739 C THR A 46 4.577 -5.479 -4.680 1.00 0.00 C ATOM 740 O THR A 46 4.543 -6.664 -4.942 1.00 0.00 O ATOM 741 CB THR A 46 6.721 -4.107 -4.820 1.00 0.00 C ATOM 742 OG1 THR A 46 7.757 -4.035 -5.789 1.00 0.00 O ATOM 743 CG2 THR A 46 7.102 -5.138 -3.751 1.00 0.00 C ATOM 0 H THR A 46 4.945 -2.488 -4.975 1.00 0.00 H new ATOM 0 HA THR A 46 5.601 -4.978 -6.472 1.00 0.00 H new ATOM 0 HB THR A 46 6.586 -3.139 -4.337 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.598 -3.787 -5.351 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.036 -4.840 -3.275 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.314 -5.192 -3.000 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.227 -6.116 -4.217 1.00 0.00 H new ATOM 751 N LEU A 47 3.897 -4.980 -3.682 1.00 0.00 N ATOM 752 CA LEU A 47 3.054 -5.867 -2.835 1.00 0.00 C ATOM 753 C LEU A 47 1.777 -6.228 -3.594 1.00 0.00 C ATOM 754 O LEU A 47 1.268 -7.327 -3.495 1.00 0.00 O ATOM 755 CB LEU A 47 2.729 -5.037 -1.594 1.00 0.00 C ATOM 756 CG LEU A 47 3.685 -5.414 -0.463 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.551 -4.403 0.677 1.00 0.00 C ATOM 758 CD2 LEU A 47 3.336 -6.812 0.051 1.00 0.00 C ATOM 0 H LEU A 47 3.890 -3.995 -3.418 1.00 0.00 H new ATOM 0 HA LEU A 47 3.552 -6.801 -2.573 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.818 -3.975 -1.821 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.698 -5.212 -1.286 1.00 0.00 H new ATOM 0 HG LEU A 47 4.710 -5.407 -0.834 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.233 -4.672 1.484 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.798 -3.407 0.310 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.527 -4.409 1.050 1.00 0.00 H new ATOM 0 HD21 LEU A 47 4.017 -7.083 0.858 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.311 -6.818 0.423 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.431 -7.533 -0.761 1.00 0.00 H new ATOM 770 N LYS A 48 1.266 -5.308 -4.369 1.00 0.00 N ATOM 771 CA LYS A 48 0.038 -5.586 -5.155 1.00 0.00 C ATOM 772 C LYS A 48 0.327 -6.698 -6.163 1.00 0.00 C ATOM 773 O LYS A 48 -0.515 -7.521 -6.460 1.00 0.00 O ATOM 774 CB LYS A 48 -0.260 -4.270 -5.868 1.00 0.00 C ATOM 775 CG LYS A 48 -1.450 -4.452 -6.804 1.00 0.00 C ATOM 776 CD LYS A 48 -1.115 -3.831 -8.157 1.00 0.00 C ATOM 777 CE LYS A 48 -0.431 -4.877 -9.039 1.00 0.00 C ATOM 778 NZ LYS A 48 -0.025 -4.146 -10.276 1.00 0.00 N ATOM 0 H LYS A 48 1.652 -4.372 -4.489 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.802 -5.916 -4.544 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.475 -3.490 -5.138 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.614 -3.945 -6.433 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.678 -5.511 -6.922 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.337 -3.980 -6.382 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.024 -3.470 -8.639 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -0.462 -2.969 -8.022 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.434 -5.310 -8.537 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.109 -5.698 -9.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.177 -4.755 -11.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.596 -3.282 -10.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.981 -3.891 -10.214 1.00 0.00 H new ATOM 792 N GLY A 49 1.523 -6.735 -6.683 1.00 0.00 N ATOM 793 CA GLY A 49 1.877 -7.801 -7.660 1.00 0.00 C ATOM 794 C GLY A 49 2.007 -9.128 -6.915 1.00 0.00 C ATOM 795 O GLY A 49 1.559 -10.159 -7.377 1.00 0.00 O ATOM 0 H GLY A 49 2.270 -6.073 -6.473 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.111 -7.875 -8.432 1.00 0.00 H new ATOM 0 HA3 GLY A 49 2.813 -7.557 -8.162 1.00 0.00 H new ATOM 799 N MET A 50 2.607 -9.110 -5.755 1.00 0.00 N ATOM 800 CA MET A 50 2.753 -10.371 -4.973 1.00 0.00 C ATOM 801 C MET A 50 1.369 -10.866 -4.543 1.00 0.00 C ATOM 802 O MET A 50 1.144 -12.048 -4.385 1.00 0.00 O ATOM 803 CB MET A 50 3.596 -9.991 -3.752 1.00 0.00 C ATOM 804 CG MET A 50 5.028 -9.682 -4.195 1.00 0.00 C ATOM 805 SD MET A 50 6.170 -10.021 -2.830 1.00 0.00 S ATOM 806 CE MET A 50 5.424 -8.900 -1.620 1.00 0.00 C ATOM 0 H MET A 50 3.002 -8.278 -5.316 1.00 0.00 H new ATOM 0 HA MET A 50 3.221 -11.171 -5.547 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.163 -9.123 -3.254 1.00 0.00 H new ATOM 0 HB3 MET A 50 3.596 -10.807 -3.029 1.00 0.00 H new ATOM 0 HG2 MET A 50 5.291 -10.288 -5.062 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.108 -8.639 -4.500 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.094 -8.787 -0.768 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.256 -7.927 -2.081 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.473 -9.311 -1.282 1.00 0.00 H new ATOM 816 N ALA A 51 0.440 -9.968 -4.367 1.00 0.00 N ATOM 817 CA ALA A 51 -0.934 -10.382 -3.962 1.00 0.00 C ATOM 818 C ALA A 51 -1.767 -10.697 -5.204 1.00 0.00 C ATOM 819 O ALA A 51 -2.871 -11.195 -5.116 1.00 0.00 O ATOM 820 CB ALA A 51 -1.511 -9.176 -3.222 1.00 0.00 C ATOM 0 H ALA A 51 0.572 -8.964 -4.486 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.933 -11.276 -3.339 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.524 -9.403 -2.891 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.889 -8.948 -2.356 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.532 -8.315 -3.890 1.00 0.00 H new ATOM 826 N GLY A 52 -1.239 -10.414 -6.362 1.00 0.00 N ATOM 827 CA GLY A 52 -1.991 -10.701 -7.611 1.00 0.00 C ATOM 828 C GLY A 52 -1.909 -12.197 -7.902 1.00 0.00 C ATOM 829 O GLY A 52 -2.684 -12.737 -8.668 1.00 0.00 O ATOM 0 H GLY A 52 -0.318 -9.996 -6.496 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -3.031 -10.394 -7.504 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.574 -10.132 -8.442 1.00 0.00 H new ATOM 833 N THR A 53 -0.975 -12.871 -7.291 1.00 0.00 N ATOM 834 CA THR A 53 -0.840 -14.335 -7.523 1.00 0.00 C ATOM 835 C THR A 53 -0.862 -15.074 -6.187 1.00 0.00 C ATOM 836 O THR A 53 -1.397 -16.158 -6.064 1.00 0.00 O ATOM 837 CB THR A 53 0.500 -14.490 -8.267 1.00 0.00 C ATOM 838 OG1 THR A 53 0.242 -14.821 -9.624 1.00 0.00 O ATOM 839 CG2 THR A 53 1.365 -15.589 -7.637 1.00 0.00 C ATOM 0 H THR A 53 -0.299 -12.470 -6.641 1.00 0.00 H new ATOM 0 HA THR A 53 -1.656 -14.761 -8.107 1.00 0.00 H new ATOM 0 HB THR A 53 1.042 -13.547 -8.198 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.091 -14.919 -10.104 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.303 -15.673 -8.185 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.574 -15.337 -6.597 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.834 -16.540 -7.680 1.00 0.00 H new ATOM 847 N MET A 54 -0.302 -14.478 -5.193 1.00 0.00 N ATOM 848 CA MET A 54 -0.293 -15.109 -3.846 1.00 0.00 C ATOM 849 C MET A 54 -1.305 -14.404 -2.955 1.00 0.00 C ATOM 850 O MET A 54 -1.732 -14.914 -1.939 1.00 0.00 O ATOM 851 CB MET A 54 1.117 -14.903 -3.316 1.00 0.00 C ATOM 852 CG MET A 54 2.104 -15.728 -4.146 1.00 0.00 C ATOM 853 SD MET A 54 2.571 -17.213 -3.226 1.00 0.00 S ATOM 854 CE MET A 54 3.150 -16.375 -1.730 1.00 0.00 C ATOM 0 H MET A 54 0.158 -13.569 -5.247 1.00 0.00 H new ATOM 0 HA MET A 54 -0.558 -16.166 -3.876 1.00 0.00 H new ATOM 0 HB2 MET A 54 1.382 -13.847 -3.361 1.00 0.00 H new ATOM 0 HB3 MET A 54 1.170 -15.200 -2.269 1.00 0.00 H new ATOM 0 HG2 MET A 54 1.652 -16.004 -5.099 1.00 0.00 H new ATOM 0 HG3 MET A 54 2.990 -15.135 -4.373 1.00 0.00 H new ATOM 0 HE1 MET A 54 3.972 -16.940 -1.291 1.00 0.00 H new ATOM 0 HE2 MET A 54 3.494 -15.373 -1.985 1.00 0.00 H new ATOM 0 HE3 MET A 54 2.333 -16.307 -1.012 1.00 0.00 H new ATOM 864 N GLY A 55 -1.707 -13.240 -3.357 1.00 0.00 N ATOM 865 CA GLY A 55 -2.720 -12.484 -2.575 1.00 0.00 C ATOM 866 C GLY A 55 -4.087 -12.812 -3.153 1.00 0.00 C ATOM 867 O GLY A 55 -5.106 -12.363 -2.666 1.00 0.00 O ATOM 0 H GLY A 55 -1.376 -12.772 -4.201 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -2.674 -12.760 -1.521 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.527 -11.413 -2.633 1.00 0.00 H new ATOM 871 N PHE A 56 -4.109 -13.615 -4.190 1.00 0.00 N ATOM 872 CA PHE A 56 -5.406 -14.012 -4.812 1.00 0.00 C ATOM 873 C PHE A 56 -6.013 -12.865 -5.606 1.00 0.00 C ATOM 874 O PHE A 56 -7.094 -12.979 -6.149 1.00 0.00 O ATOM 875 CB PHE A 56 -6.297 -14.386 -3.634 1.00 0.00 C ATOM 876 CG PHE A 56 -6.966 -15.712 -3.903 1.00 0.00 C ATOM 877 CD1 PHE A 56 -7.703 -15.899 -5.079 1.00 0.00 C ATOM 878 CD2 PHE A 56 -6.848 -16.754 -2.978 1.00 0.00 C ATOM 879 CE1 PHE A 56 -8.324 -17.130 -5.327 1.00 0.00 C ATOM 880 CE2 PHE A 56 -7.467 -17.984 -3.226 1.00 0.00 C ATOM 881 CZ PHE A 56 -8.205 -18.172 -4.401 1.00 0.00 C ATOM 0 H PHE A 56 -3.280 -14.012 -4.632 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.285 -14.832 -5.520 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.704 -14.446 -2.721 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -7.050 -13.614 -3.475 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -7.793 -15.095 -5.794 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -6.279 -16.609 -2.072 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -8.894 -17.275 -6.233 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -7.376 -18.788 -2.511 1.00 0.00 H new ATOM 0 HZ PHE A 56 -8.682 -19.122 -4.593 1.00 0.00 H new ATOM 891 N SER A 57 -5.340 -11.755 -5.658 1.00 0.00 N ATOM 892 CA SER A 57 -5.865 -10.575 -6.390 1.00 0.00 C ATOM 893 C SER A 57 -7.011 -9.949 -5.603 1.00 0.00 C ATOM 894 O SER A 57 -7.469 -8.866 -5.904 1.00 0.00 O ATOM 895 CB SER A 57 -6.344 -11.101 -7.730 1.00 0.00 C ATOM 896 OG SER A 57 -5.447 -12.104 -8.190 1.00 0.00 O ATOM 0 H SER A 57 -4.432 -11.613 -5.216 1.00 0.00 H new ATOM 0 HA SER A 57 -5.109 -9.801 -6.523 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.349 -11.512 -7.634 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.400 -10.288 -8.454 1.00 0.00 H new ATOM 0 HG SER A 57 -4.539 -11.737 -8.232 1.00 0.00 H new ATOM 902 N SER A 58 -7.446 -10.604 -4.568 1.00 0.00 N ATOM 903 CA SER A 58 -8.515 -10.031 -3.731 1.00 0.00 C ATOM 904 C SER A 58 -7.845 -9.043 -2.803 1.00 0.00 C ATOM 905 O SER A 58 -8.406 -8.041 -2.406 1.00 0.00 O ATOM 906 CB SER A 58 -9.098 -11.205 -2.950 1.00 0.00 C ATOM 907 OG SER A 58 -9.699 -12.122 -3.857 1.00 0.00 O ATOM 0 H SER A 58 -7.101 -11.516 -4.269 1.00 0.00 H new ATOM 0 HA SER A 58 -9.303 -9.525 -4.290 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.314 -11.702 -2.379 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.837 -10.848 -2.233 1.00 0.00 H new ATOM 0 HG SER A 58 -10.073 -12.878 -3.358 1.00 0.00 H new ATOM 913 N MET A 59 -6.611 -9.320 -2.484 1.00 0.00 N ATOM 914 CA MET A 59 -5.846 -8.398 -1.610 1.00 0.00 C ATOM 915 C MET A 59 -4.822 -7.645 -2.457 1.00 0.00 C ATOM 916 O MET A 59 -4.185 -6.717 -2.002 1.00 0.00 O ATOM 917 CB MET A 59 -5.160 -9.296 -0.578 1.00 0.00 C ATOM 918 CG MET A 59 -4.328 -8.440 0.381 1.00 0.00 C ATOM 919 SD MET A 59 -3.051 -9.462 1.157 1.00 0.00 S ATOM 920 CE MET A 59 -2.134 -9.866 -0.350 1.00 0.00 C ATOM 0 H MET A 59 -6.102 -10.148 -2.793 1.00 0.00 H new ATOM 0 HA MET A 59 -6.474 -7.653 -1.121 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.907 -9.862 -0.021 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.520 -10.021 -1.081 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.867 -7.614 -0.160 1.00 0.00 H new ATOM 0 HG3 MET A 59 -4.971 -8.002 1.144 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.894 -10.929 -0.356 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.743 -9.626 -1.222 1.00 0.00 H new ATOM 0 HE3 MET A 59 -1.212 -9.286 -0.381 1.00 0.00 H new ATOM 930 N ALA A 60 -4.670 -8.024 -3.701 1.00 0.00 N ATOM 931 CA ALA A 60 -3.700 -7.311 -4.573 1.00 0.00 C ATOM 932 C ALA A 60 -4.389 -6.118 -5.230 1.00 0.00 C ATOM 933 O ALA A 60 -3.793 -5.079 -5.426 1.00 0.00 O ATOM 934 CB ALA A 60 -3.266 -8.338 -5.618 1.00 0.00 C ATOM 0 H ALA A 60 -5.174 -8.792 -4.144 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.843 -6.924 -4.022 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.547 -7.882 -6.299 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.804 -9.191 -5.120 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.137 -8.675 -6.181 1.00 0.00 H new ATOM 940 N LYS A 61 -5.651 -6.240 -5.536 1.00 0.00 N ATOM 941 CA LYS A 61 -6.364 -5.083 -6.138 1.00 0.00 C ATOM 942 C LYS A 61 -6.451 -4.012 -5.073 1.00 0.00 C ATOM 943 O LYS A 61 -6.369 -2.827 -5.330 1.00 0.00 O ATOM 944 CB LYS A 61 -7.752 -5.605 -6.489 1.00 0.00 C ATOM 945 CG LYS A 61 -7.802 -5.920 -7.976 1.00 0.00 C ATOM 946 CD LYS A 61 -7.388 -7.373 -8.204 1.00 0.00 C ATOM 947 CE LYS A 61 -8.626 -8.274 -8.155 1.00 0.00 C ATOM 948 NZ LYS A 61 -9.563 -7.696 -9.159 1.00 0.00 N ATOM 0 H LYS A 61 -6.212 -7.080 -5.397 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.874 -4.669 -7.019 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.976 -6.499 -5.907 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.509 -4.862 -6.236 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.808 -5.753 -8.360 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -7.137 -5.251 -8.523 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -6.891 -7.473 -9.169 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -6.671 -7.681 -7.443 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.373 -9.306 -8.399 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.070 -8.281 -7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.058 -8.465 -9.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.258 -7.091 -8.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -9.028 -7.128 -9.847 1.00 0.00 H new ATOM 962 N LEU A 62 -6.579 -4.457 -3.865 1.00 0.00 N ATOM 963 CA LEU A 62 -6.636 -3.531 -2.717 1.00 0.00 C ATOM 964 C LEU A 62 -5.294 -2.814 -2.609 1.00 0.00 C ATOM 965 O LEU A 62 -5.224 -1.635 -2.334 1.00 0.00 O ATOM 966 CB LEU A 62 -6.858 -4.443 -1.514 1.00 0.00 C ATOM 967 CG LEU A 62 -6.680 -3.643 -0.224 1.00 0.00 C ATOM 968 CD1 LEU A 62 -7.449 -2.324 -0.327 1.00 0.00 C ATOM 969 CD2 LEU A 62 -7.220 -4.455 0.955 1.00 0.00 C ATOM 0 H LEU A 62 -6.648 -5.445 -3.620 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.414 -2.771 -2.799 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.859 -4.874 -1.551 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.152 -5.273 -1.539 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.621 -3.434 -0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.321 -1.755 0.594 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.067 -1.745 -1.168 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.508 -2.531 -0.481 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.094 -3.886 1.876 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.278 -4.663 0.799 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.673 -5.395 1.031 1.00 0.00 H new ATOM 981 N CYS A 63 -4.224 -3.530 -2.845 1.00 0.00 N ATOM 982 CA CYS A 63 -2.877 -2.905 -2.778 1.00 0.00 C ATOM 983 C CYS A 63 -2.718 -1.933 -3.944 1.00 0.00 C ATOM 984 O CYS A 63 -2.058 -0.918 -3.838 1.00 0.00 O ATOM 985 CB CYS A 63 -1.890 -4.066 -2.902 1.00 0.00 C ATOM 986 SG CYS A 63 -0.352 -3.639 -2.047 1.00 0.00 S ATOM 0 H CYS A 63 -4.230 -4.522 -3.081 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.715 -2.344 -1.858 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.319 -4.971 -2.472 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.689 -4.277 -3.952 1.00 0.00 H new ATOM 0 HG CYS A 63 0.585 -3.421 -2.922 1.00 0.00 H new ATOM 992 N HIS A 64 -3.341 -2.227 -5.051 1.00 0.00 N ATOM 993 CA HIS A 64 -3.252 -1.309 -6.216 1.00 0.00 C ATOM 994 C HIS A 64 -4.023 -0.036 -5.884 1.00 0.00 C ATOM 995 O HIS A 64 -3.638 1.059 -6.244 1.00 0.00 O ATOM 996 CB HIS A 64 -3.918 -2.056 -7.374 1.00 0.00 C ATOM 997 CG HIS A 64 -3.465 -1.464 -8.680 1.00 0.00 C ATOM 998 ND1 HIS A 64 -3.764 -2.052 -9.900 1.00 0.00 N ATOM 999 CD2 HIS A 64 -2.740 -0.337 -8.974 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -3.225 -1.281 -10.864 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -2.589 -0.223 -10.353 1.00 0.00 N ATOM 0 H HIS A 64 -3.907 -3.063 -5.198 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.228 -1.032 -6.467 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.661 -3.114 -7.334 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -5.003 -1.988 -7.289 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -2.346 0.357 -8.246 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -3.298 -1.492 -11.921 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -2.098 0.511 -10.864 1.00 0.00 H new ATOM 1009 N THR A 65 -5.108 -0.185 -5.178 1.00 0.00 N ATOM 1010 CA THR A 65 -5.922 0.995 -4.788 1.00 0.00 C ATOM 1011 C THR A 65 -5.079 1.940 -3.920 1.00 0.00 C ATOM 1012 O THR A 65 -4.924 3.102 -4.227 1.00 0.00 O ATOM 1013 CB THR A 65 -7.099 0.393 -4.009 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.195 0.211 -4.893 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.518 1.316 -2.863 1.00 0.00 C ATOM 0 H THR A 65 -5.467 -1.082 -4.852 1.00 0.00 H new ATOM 0 HA THR A 65 -6.266 1.591 -5.633 1.00 0.00 H new ATOM 0 HB THR A 65 -6.791 -0.564 -3.588 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.630 -0.646 -4.703 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.354 0.870 -2.324 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.679 1.454 -2.181 1.00 0.00 H new ATOM 0 HG23 THR A 65 -7.820 2.282 -3.266 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.515 1.446 -2.853 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.671 2.319 -1.995 1.00 0.00 C ATOM 1025 C LEU A 66 -2.635 3.007 -2.874 1.00 0.00 C ATOM 1026 O LEU A 66 -2.465 4.206 -2.840 1.00 0.00 O ATOM 1027 CB LEU A 66 -2.982 1.361 -1.027 1.00 0.00 C ATOM 1028 CG LEU A 66 -3.928 1.029 0.122 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -4.849 -0.121 -0.281 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -3.109 0.619 1.345 1.00 0.00 C ATOM 0 H LEU A 66 -4.602 0.479 -2.540 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.239 3.088 -1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.691 0.449 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.068 1.813 -0.641 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.532 1.905 0.359 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.523 -0.354 0.544 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.432 0.169 -1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.250 -1.000 -0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.781 0.381 2.170 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.507 -0.257 1.103 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.454 1.440 1.636 1.00 0.00 H new ATOM 1042 N GLU A 67 -1.953 2.233 -3.674 1.00 0.00 N ATOM 1043 CA GLU A 67 -0.919 2.792 -4.582 1.00 0.00 C ATOM 1044 C GLU A 67 -1.553 3.775 -5.556 1.00 0.00 C ATOM 1045 O GLU A 67 -0.916 4.699 -6.023 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.376 1.570 -5.322 1.00 0.00 C ATOM 1047 CG GLU A 67 0.361 2.011 -6.590 1.00 0.00 C ATOM 1048 CD GLU A 67 0.699 0.785 -7.438 1.00 0.00 C ATOM 1049 OE1 GLU A 67 0.306 -0.305 -7.054 1.00 0.00 O ATOM 1050 OE2 GLU A 67 1.346 0.956 -8.458 1.00 0.00 O ATOM 0 H GLU A 67 -2.073 1.222 -3.735 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.138 3.339 -4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.300 1.013 -4.674 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.194 0.899 -5.582 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.259 2.702 -7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.273 2.546 -6.325 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.805 3.596 -5.863 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.460 4.537 -6.796 1.00 0.00 C ATOM 1059 C ASN A 68 -3.451 5.917 -6.166 1.00 0.00 C ATOM 1060 O ASN A 68 -3.173 6.908 -6.809 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.884 4.030 -6.941 1.00 0.00 C ATOM 1062 CG ASN A 68 -5.135 3.597 -8.385 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -6.208 3.799 -8.915 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.181 3.002 -9.048 1.00 0.00 N ATOM 0 H ASN A 68 -3.396 2.844 -5.509 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.963 4.599 -7.764 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -5.051 3.191 -6.266 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.589 4.812 -6.658 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.337 2.707 -10.012 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.279 2.832 -8.602 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.720 5.978 -4.894 1.00 0.00 N ATOM 1072 CA ILE A 69 -3.694 7.286 -4.201 1.00 0.00 C ATOM 1073 C ILE A 69 -2.284 7.803 -4.261 1.00 0.00 C ATOM 1074 O ILE A 69 -2.018 8.975 -4.420 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.114 6.980 -2.772 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -5.624 6.790 -2.741 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -3.727 8.143 -1.858 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -5.991 5.462 -3.397 1.00 0.00 C ATOM 0 H ILE A 69 -3.956 5.178 -4.307 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.349 8.039 -4.640 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.614 6.076 -2.425 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.981 6.808 -1.711 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.114 7.612 -3.263 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.030 7.919 -0.835 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.647 8.289 -1.893 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.227 9.051 -2.194 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.073 5.331 -3.372 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.649 5.461 -4.432 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.514 4.645 -2.856 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.386 6.901 -4.183 1.00 0.00 N ATOM 1091 CA LEU A 70 0.046 7.273 -4.275 1.00 0.00 C ATOM 1092 C LEU A 70 0.358 7.632 -5.713 1.00 0.00 C ATOM 1093 O LEU A 70 1.313 8.323 -6.007 1.00 0.00 O ATOM 1094 CB LEU A 70 0.835 6.043 -3.833 1.00 0.00 C ATOM 1095 CG LEU A 70 0.300 5.533 -2.495 1.00 0.00 C ATOM 1096 CD1 LEU A 70 1.326 4.598 -1.868 1.00 0.00 C ATOM 1097 CD2 LEU A 70 0.040 6.711 -1.550 1.00 0.00 C ATOM 0 H LEU A 70 -1.569 5.905 -4.058 1.00 0.00 H new ATOM 0 HA LEU A 70 0.300 8.129 -3.650 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.757 5.260 -4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.892 6.293 -3.740 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.635 4.998 -2.662 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.949 4.232 -0.913 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.505 3.755 -2.535 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.259 5.138 -1.706 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -0.341 6.338 -0.599 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.970 7.253 -1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -0.694 7.381 -1.997 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.466 7.190 -6.612 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.243 7.535 -8.036 1.00 0.00 C ATOM 1111 C ASP A 71 -0.842 8.909 -8.295 1.00 0.00 C ATOM 1112 O ASP A 71 -0.221 9.761 -8.898 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.955 6.451 -8.847 1.00 0.00 C ATOM 1114 CG ASP A 71 0.055 5.381 -9.264 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.782 5.619 -10.214 1.00 0.00 O ATOM 1116 OD2 ASP A 71 0.085 4.341 -8.625 1.00 0.00 O ATOM 0 H ASP A 71 -1.282 6.607 -6.424 1.00 0.00 H new ATOM 0 HA ASP A 71 0.812 7.575 -8.308 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.752 6.003 -8.254 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.422 6.889 -9.729 1.00 0.00 H new ATOM 1121 N LYS A 72 -2.024 9.155 -7.801 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.607 10.511 -7.990 1.00 0.00 C ATOM 1123 C LYS A 72 -1.851 11.441 -7.059 1.00 0.00 C ATOM 1124 O LYS A 72 -1.643 12.605 -7.341 1.00 0.00 O ATOM 1125 CB LYS A 72 -4.106 10.448 -7.637 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.515 9.045 -7.198 1.00 0.00 C ATOM 1127 CD LYS A 72 -6.010 8.994 -7.024 1.00 0.00 C ATOM 1128 CE LYS A 72 -6.338 8.379 -5.670 1.00 0.00 C ATOM 1129 NZ LYS A 72 -7.822 8.259 -5.647 1.00 0.00 N ATOM 0 H LYS A 72 -2.601 8.491 -7.285 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.520 10.870 -9.015 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.324 11.159 -6.840 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.698 10.748 -8.502 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.199 8.312 -7.941 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.019 8.785 -6.263 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.430 9.998 -7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.461 8.405 -7.823 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.862 7.405 -5.554 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.981 9.008 -4.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.147 8.155 -4.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.246 9.113 -6.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.111 7.425 -6.197 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.384 10.900 -5.973 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.567 11.703 -5.027 1.00 0.00 C ATOM 1145 C ALA A 73 0.689 12.144 -5.770 1.00 0.00 C ATOM 1146 O ALA A 73 1.230 13.207 -5.548 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.199 10.736 -3.904 1.00 0.00 C ATOM 0 H ALA A 73 -1.534 9.929 -5.698 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.080 12.584 -4.640 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.407 11.255 -3.161 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.108 10.362 -3.433 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.367 9.900 -4.315 1.00 0.00 H new ATOM 1153 N ARG A 74 1.135 11.314 -6.675 1.00 0.00 N ATOM 1154 CA ARG A 74 2.340 11.645 -7.480 1.00 0.00 C ATOM 1155 C ARG A 74 1.906 12.420 -8.718 1.00 0.00 C ATOM 1156 O ARG A 74 2.680 13.127 -9.332 1.00 0.00 O ATOM 1157 CB ARG A 74 2.929 10.295 -7.891 1.00 0.00 C ATOM 1158 CG ARG A 74 4.021 9.882 -6.905 1.00 0.00 C ATOM 1159 CD ARG A 74 4.436 8.437 -7.188 1.00 0.00 C ATOM 1160 NE ARG A 74 4.986 8.462 -8.570 1.00 0.00 N ATOM 1161 CZ ARG A 74 6.243 8.750 -8.766 1.00 0.00 C ATOM 1162 NH1 ARG A 74 6.623 9.996 -8.840 1.00 0.00 N ATOM 1163 NH2 ARG A 74 7.119 7.791 -8.882 1.00 0.00 N ATOM 0 H ARG A 74 0.709 10.412 -6.891 1.00 0.00 H new ATOM 0 HA ARG A 74 3.061 12.251 -6.932 1.00 0.00 H new ATOM 0 HB2 ARG A 74 2.145 9.539 -7.916 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.342 10.360 -8.898 1.00 0.00 H new ATOM 0 HG2 ARG A 74 4.881 10.545 -6.999 1.00 0.00 H new ATOM 0 HG3 ARG A 74 3.657 9.974 -5.882 1.00 0.00 H new ATOM 0 HD2 ARG A 74 5.182 8.092 -6.472 1.00 0.00 H new ATOM 0 HD3 ARG A 74 3.585 7.759 -7.113 1.00 0.00 H new ATOM 0 HE ARG A 74 4.380 8.254 -9.364 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.937 10.745 -8.745 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.606 10.221 -8.993 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.821 6.818 -8.819 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.102 8.014 -9.035 1.00 0.00 H new ATOM 1177 N ASN A 75 0.663 12.284 -9.089 1.00 0.00 N ATOM 1178 CA ASN A 75 0.163 13.007 -10.293 1.00 0.00 C ATOM 1179 C ASN A 75 -0.502 14.320 -9.874 1.00 0.00 C ATOM 1180 O ASN A 75 -1.042 15.042 -10.689 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.851 12.060 -10.934 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.461 11.807 -12.391 1.00 0.00 C ATOM 1183 OD1 ASN A 75 -0.705 12.632 -13.249 1.00 0.00 O ATOM 1184 ND2 ASN A 75 0.139 10.693 -12.708 1.00 0.00 N ATOM 0 H ASN A 75 -0.028 11.705 -8.612 1.00 0.00 H new ATOM 0 HA ASN A 75 0.963 13.266 -10.987 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.882 11.118 -10.386 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.851 12.492 -10.883 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.404 10.514 -13.677 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.344 10.001 -11.987 1.00 0.00 H new ATOM 1191 N SER A 76 -0.463 14.632 -8.607 1.00 0.00 N ATOM 1192 CA SER A 76 -1.084 15.896 -8.123 1.00 0.00 C ATOM 1193 C SER A 76 -2.606 15.812 -8.220 1.00 0.00 C ATOM 1194 O SER A 76 -3.270 16.780 -8.532 1.00 0.00 O ATOM 1195 CB SER A 76 -0.545 16.991 -9.046 1.00 0.00 C ATOM 1196 OG SER A 76 -0.638 18.247 -8.387 1.00 0.00 O ATOM 0 H SER A 76 -0.025 14.062 -7.883 1.00 0.00 H new ATOM 0 HA SER A 76 -0.845 16.094 -7.078 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.491 16.782 -9.311 1.00 0.00 H new ATOM 0 HB3 SER A 76 -1.114 17.012 -9.976 1.00 0.00 H new ATOM 0 HG SER A 76 -0.292 18.951 -8.974 1.00 0.00 H new ATOM 1202 N GLU A 77 -3.171 14.668 -7.938 1.00 0.00 N ATOM 1203 CA GLU A 77 -4.655 14.550 -8.003 1.00 0.00 C ATOM 1204 C GLU A 77 -5.206 14.362 -6.602 1.00 0.00 C ATOM 1205 O GLU A 77 -6.346 14.667 -6.314 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.989 13.317 -8.860 1.00 0.00 C ATOM 1207 CG GLU A 77 -3.810 12.923 -9.751 1.00 0.00 C ATOM 1208 CD GLU A 77 -3.645 13.958 -10.864 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -3.851 15.129 -10.591 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -3.316 13.563 -11.970 1.00 0.00 O ATOM 0 H GLU A 77 -2.674 13.819 -7.668 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.096 15.447 -8.438 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.253 12.481 -8.212 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -5.861 13.527 -9.479 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -2.897 12.862 -9.159 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.979 11.935 -10.180 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.397 13.851 -5.731 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.857 13.623 -4.337 1.00 0.00 C ATOM 1219 C ILE A 78 -3.701 13.807 -3.358 1.00 0.00 C ATOM 1220 O ILE A 78 -2.547 13.813 -3.734 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.326 12.171 -4.322 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.116 11.266 -4.537 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.345 11.947 -5.440 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.395 11.066 -3.211 1.00 0.00 C ATOM 0 H ILE A 78 -3.432 13.579 -5.921 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.640 14.321 -4.041 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.796 11.941 -3.366 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.434 10.304 -4.940 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.440 11.710 -5.268 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.678 10.909 -5.426 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.201 12.605 -5.289 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.883 12.167 -6.403 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -2.530 10.420 -3.361 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.065 12.031 -2.827 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.073 10.603 -2.494 1.00 0.00 H new ATOM 1236 N LYS A 79 -4.006 13.935 -2.101 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.939 14.096 -1.084 1.00 0.00 C ATOM 1238 C LYS A 79 -3.341 13.380 0.207 1.00 0.00 C ATOM 1239 O LYS A 79 -4.495 13.372 0.586 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.843 15.602 -0.848 1.00 0.00 C ATOM 1241 CG LYS A 79 -2.093 16.245 -2.008 1.00 0.00 C ATOM 1242 CD LYS A 79 -0.675 15.685 -2.047 1.00 0.00 C ATOM 1243 CE LYS A 79 -0.378 15.144 -3.445 1.00 0.00 C ATOM 1244 NZ LYS A 79 0.917 15.771 -3.833 1.00 0.00 N ATOM 0 H LYS A 79 -4.957 13.935 -1.732 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.988 13.673 -1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.841 16.033 -0.761 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -2.326 15.803 0.090 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -2.605 16.041 -2.948 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -2.068 17.328 -1.887 1.00 0.00 H new ATOM 0 HD2 LYS A 79 0.042 16.464 -1.787 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -0.566 14.891 -1.308 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -0.304 14.057 -3.440 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -1.170 15.407 -4.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.388 15.181 -4.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 0.740 16.717 -4.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 1.528 15.853 -2.995 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.404 12.793 0.896 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.749 12.104 2.165 1.00 0.00 C ATOM 1260 C ILE A 80 -3.374 13.124 3.105 1.00 0.00 C ATOM 1261 O ILE A 80 -2.706 13.873 3.790 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.430 11.577 2.700 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -1.078 10.278 1.972 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.539 11.303 4.204 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.687 10.583 0.523 1.00 0.00 C ATOM 0 H ILE A 80 -1.418 12.761 0.635 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.463 11.290 2.045 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.652 12.322 2.532 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.256 9.776 2.482 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.929 9.597 1.993 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.586 10.925 4.575 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.791 12.227 4.725 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.318 10.562 4.383 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.438 9.654 0.010 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.522 11.065 0.015 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.177 11.247 0.511 1.00 0.00 H new ATOM 1277 N THR A 81 -4.659 13.168 3.092 1.00 0.00 N ATOM 1278 CA THR A 81 -5.407 14.146 3.928 1.00 0.00 C ATOM 1279 C THR A 81 -6.004 13.464 5.155 1.00 0.00 C ATOM 1280 O THR A 81 -7.027 13.877 5.664 1.00 0.00 O ATOM 1281 CB THR A 81 -6.523 14.625 3.004 1.00 0.00 C ATOM 1282 OG1 THR A 81 -7.203 15.723 3.597 1.00 0.00 O ATOM 1283 CG2 THR A 81 -7.500 13.478 2.764 1.00 0.00 C ATOM 0 H THR A 81 -5.247 12.556 2.526 1.00 0.00 H new ATOM 0 HA THR A 81 -4.774 14.953 4.298 1.00 0.00 H new ATOM 0 HB THR A 81 -6.097 14.947 2.054 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.393 15.521 4.537 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.300 13.814 2.104 1.00 0.00 H new ATOM 0 HG22 THR A 81 -6.974 12.643 2.301 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.925 13.157 3.715 1.00 0.00 H new ATOM 1291 N SER A 82 -5.393 12.405 5.619 1.00 0.00 N ATOM 1292 CA SER A 82 -5.944 11.674 6.801 1.00 0.00 C ATOM 1293 C SER A 82 -7.194 10.891 6.387 1.00 0.00 C ATOM 1294 O SER A 82 -7.750 10.134 7.158 1.00 0.00 O ATOM 1295 CB SER A 82 -6.297 12.751 7.823 1.00 0.00 C ATOM 1296 OG SER A 82 -5.831 12.356 9.106 1.00 0.00 O ATOM 0 H SER A 82 -4.535 12.014 5.230 1.00 0.00 H new ATOM 0 HA SER A 82 -5.232 10.957 7.211 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.846 13.701 7.537 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.376 12.905 7.847 1.00 0.00 H new ATOM 0 HG SER A 82 -6.056 13.048 9.763 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.628 11.059 5.168 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.822 10.322 4.683 1.00 0.00 C ATOM 1304 C ASP A 83 -8.383 9.365 3.581 1.00 0.00 C ATOM 1305 O ASP A 83 -8.671 8.185 3.617 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.758 11.397 4.129 1.00 0.00 C ATOM 1307 CG ASP A 83 -11.212 10.958 4.315 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -11.753 11.206 5.380 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -11.759 10.381 3.390 1.00 0.00 O ATOM 0 H ASP A 83 -7.200 11.682 4.483 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.314 9.737 5.460 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.585 12.343 4.642 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.551 11.564 3.072 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.659 9.858 2.612 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.177 8.957 1.531 1.00 0.00 C ATOM 1316 C LEU A 84 -6.182 7.970 2.131 1.00 0.00 C ATOM 1317 O LEU A 84 -6.013 6.867 1.649 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.494 9.871 0.514 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.506 10.884 -0.022 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.882 11.662 -1.183 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.753 10.144 -0.516 1.00 0.00 C ATOM 0 H LEU A 84 -7.384 10.836 2.524 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.977 8.383 1.062 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.656 10.390 0.980 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.086 9.280 -0.306 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.784 11.577 0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.603 12.385 -1.566 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.993 12.187 -0.833 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.605 10.970 -1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.476 10.864 -0.899 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.475 9.452 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.197 9.588 0.310 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.538 8.355 3.195 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.567 7.439 3.847 1.00 0.00 C ATOM 1335 C LEU A 85 -5.310 6.577 4.875 1.00 0.00 C ATOM 1336 O LEU A 85 -4.973 5.433 5.106 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.526 8.372 4.493 1.00 0.00 C ATOM 1338 CG LEU A 85 -3.654 8.381 6.019 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -2.908 7.180 6.605 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -3.049 9.674 6.572 1.00 0.00 C ATOM 0 H LEU A 85 -5.643 9.266 3.641 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.081 6.744 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.523 8.050 4.212 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.655 9.384 4.110 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.707 8.322 6.294 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -3.001 7.189 7.691 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.337 6.258 6.212 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.855 7.237 6.330 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.139 9.682 7.658 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.996 9.731 6.295 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.580 10.531 6.157 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.332 7.122 5.482 1.00 0.00 N ATOM 1353 CA ASP A 86 -7.112 6.335 6.480 1.00 0.00 C ATOM 1354 C ASP A 86 -7.722 5.116 5.794 1.00 0.00 C ATOM 1355 O ASP A 86 -7.723 4.025 6.328 1.00 0.00 O ATOM 1356 CB ASP A 86 -8.207 7.280 6.977 1.00 0.00 C ATOM 1357 CG ASP A 86 -9.191 6.506 7.855 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -9.832 5.606 7.340 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -9.287 6.828 9.029 1.00 0.00 O ATOM 0 H ASP A 86 -6.659 8.076 5.330 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.497 5.975 7.304 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -7.765 8.099 7.544 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.731 7.724 6.130 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.218 5.286 4.599 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.798 4.125 3.873 1.00 0.00 C ATOM 1366 C LYS A 87 -7.653 3.251 3.377 1.00 0.00 C ATOM 1367 O LYS A 87 -7.715 2.038 3.418 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.581 4.719 2.702 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.603 5.736 3.223 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.312 5.170 4.456 1.00 0.00 C ATOM 1371 CE LYS A 87 -12.284 6.215 5.007 1.00 0.00 C ATOM 1372 NZ LYS A 87 -13.107 6.628 3.837 1.00 0.00 N ATOM 0 H LYS A 87 -8.246 6.174 4.098 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.448 3.510 4.496 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.898 5.202 2.003 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.090 3.926 2.154 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -10.103 6.671 3.476 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.332 5.965 2.445 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.850 4.259 4.194 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.581 4.900 5.218 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.905 5.798 5.799 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.751 7.064 5.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.990 7.065 4.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.576 7.314 3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.331 5.793 3.258 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.586 3.863 2.940 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.419 3.066 2.483 1.00 0.00 C ATOM 1388 C ILE A 88 -4.937 2.226 3.670 1.00 0.00 C ATOM 1389 O ILE A 88 -4.826 1.018 3.595 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.378 4.114 2.048 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.394 4.253 0.533 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -2.962 3.727 2.493 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.248 5.732 0.171 1.00 0.00 C ATOM 0 H ILE A 88 -6.475 4.875 2.881 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.629 2.380 1.662 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.644 5.058 2.523 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.582 3.675 0.093 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.324 3.855 0.128 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.257 4.491 2.167 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.932 3.645 3.579 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.690 2.769 2.049 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.258 5.844 -0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.076 6.295 0.602 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.306 6.112 0.566 1.00 0.00 H new ATOM 1405 N PHE A 89 -4.680 2.868 4.775 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.232 2.124 5.984 1.00 0.00 C ATOM 1407 C PHE A 89 -5.329 1.160 6.408 1.00 0.00 C ATOM 1408 O PHE A 89 -5.090 0.166 7.065 1.00 0.00 O ATOM 1409 CB PHE A 89 -3.996 3.198 7.045 1.00 0.00 C ATOM 1410 CG PHE A 89 -3.984 2.566 8.419 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -5.190 2.309 9.082 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -2.767 2.237 9.028 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -5.179 1.725 10.354 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -2.756 1.652 10.301 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.962 1.396 10.964 1.00 0.00 C ATOM 0 H PHE A 89 -4.761 3.878 4.893 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.331 1.534 5.817 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.049 3.704 6.859 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.778 3.955 6.990 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.129 2.561 8.612 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.837 2.434 8.516 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -6.110 1.528 10.865 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.817 1.399 10.771 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.954 0.945 11.945 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.525 1.438 5.999 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.652 0.535 6.328 1.00 0.00 C ATOM 1427 C ALA A 90 -7.590 -0.645 5.370 1.00 0.00 C ATOM 1428 O ALA A 90 -7.966 -1.752 5.695 1.00 0.00 O ATOM 1429 CB ALA A 90 -8.919 1.361 6.104 1.00 0.00 C ATOM 0 H ALA A 90 -6.774 2.258 5.446 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.624 0.153 7.348 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.795 0.752 6.330 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.905 2.233 6.758 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -8.962 1.687 5.065 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.070 -0.411 4.195 1.00 0.00 N ATOM 1436 CA GLY A 91 -6.927 -1.512 3.212 1.00 0.00 C ATOM 1437 C GLY A 91 -5.796 -2.406 3.703 1.00 0.00 C ATOM 1438 O GLY A 91 -5.900 -3.616 3.714 1.00 0.00 O ATOM 0 H GLY A 91 -6.738 0.500 3.877 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.856 -2.077 3.128 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.703 -1.117 2.221 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.726 -1.806 4.151 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.595 -2.604 4.690 1.00 0.00 C ATOM 1444 C VAL A 92 -4.088 -3.343 5.934 1.00 0.00 C ATOM 1445 O VAL A 92 -3.564 -4.370 6.319 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.522 -1.576 5.055 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.536 -2.192 6.052 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -1.770 -1.153 3.792 1.00 0.00 C ATOM 0 H VAL A 92 -4.589 -0.795 4.166 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.206 -3.342 3.989 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.996 -0.705 5.507 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.773 -1.458 6.310 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.070 -2.493 6.953 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.062 -3.065 5.603 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.006 -0.421 4.052 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.298 -2.025 3.340 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.470 -0.711 3.083 1.00 0.00 H new ATOM 1458 N ASP A 93 -5.118 -2.822 6.545 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.694 -3.472 7.750 1.00 0.00 C ATOM 1460 C ASP A 93 -6.403 -4.755 7.328 1.00 0.00 C ATOM 1461 O ASP A 93 -6.251 -5.794 7.939 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.691 -2.452 8.306 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.362 -2.162 9.771 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -5.193 -2.210 10.117 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -7.286 -1.899 10.523 1.00 0.00 O ATOM 0 H ASP A 93 -5.588 -1.964 6.255 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.945 -3.742 8.495 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.648 -1.532 7.724 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.707 -2.837 8.220 1.00 0.00 H new ATOM 1470 N MET A 94 -7.154 -4.696 6.261 1.00 0.00 N ATOM 1471 CA MET A 94 -7.841 -5.920 5.776 1.00 0.00 C ATOM 1472 C MET A 94 -6.799 -6.807 5.108 1.00 0.00 C ATOM 1473 O MET A 94 -6.809 -8.014 5.230 1.00 0.00 O ATOM 1474 CB MET A 94 -8.875 -5.438 4.759 1.00 0.00 C ATOM 1475 CG MET A 94 -9.714 -4.315 5.371 1.00 0.00 C ATOM 1476 SD MET A 94 -11.294 -4.204 4.497 1.00 0.00 S ATOM 1477 CE MET A 94 -10.616 -4.055 2.825 1.00 0.00 C ATOM 0 H MET A 94 -7.319 -3.855 5.708 1.00 0.00 H new ATOM 0 HA MET A 94 -8.322 -6.490 6.571 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.375 -5.082 3.858 1.00 0.00 H new ATOM 0 HB3 MET A 94 -9.519 -6.265 4.461 1.00 0.00 H new ATOM 0 HG2 MET A 94 -9.884 -4.508 6.430 1.00 0.00 H new ATOM 0 HG3 MET A 94 -9.180 -3.367 5.302 1.00 0.00 H new ATOM 0 HE1 MET A 94 -11.356 -3.593 2.172 1.00 0.00 H new ATOM 0 HE2 MET A 94 -9.718 -3.437 2.850 1.00 0.00 H new ATOM 0 HE3 MET A 94 -10.365 -5.045 2.445 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.875 -6.194 4.421 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.793 -6.964 3.758 1.00 0.00 C ATOM 1489 C ILE A 95 -4.087 -7.818 4.813 1.00 0.00 C ATOM 1490 O ILE A 95 -3.859 -8.997 4.629 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.860 -5.884 3.193 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -4.238 -5.587 1.743 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -2.403 -6.346 3.249 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -3.933 -4.122 1.434 1.00 0.00 C ATOM 0 H ILE A 95 -5.826 -5.183 4.291 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.139 -7.640 2.976 1.00 0.00 H new ATOM 0 HB ILE A 95 -3.968 -4.983 3.797 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.680 -6.237 1.069 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -5.296 -5.793 1.581 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -1.758 -5.566 2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -2.124 -6.546 4.284 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.287 -7.255 2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.201 -3.905 0.400 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.510 -3.482 2.101 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.870 -3.933 1.580 1.00 0.00 H new ATOM 1506 N THR A 96 -3.759 -7.224 5.929 1.00 0.00 N ATOM 1507 CA THR A 96 -3.090 -7.989 7.010 1.00 0.00 C ATOM 1508 C THR A 96 -4.077 -9.009 7.571 1.00 0.00 C ATOM 1509 O THR A 96 -3.722 -10.126 7.888 1.00 0.00 O ATOM 1510 CB THR A 96 -2.722 -6.944 8.065 1.00 0.00 C ATOM 1511 OG1 THR A 96 -1.746 -6.056 7.528 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.163 -7.647 9.303 1.00 0.00 C ATOM 0 H THR A 96 -3.928 -6.239 6.135 1.00 0.00 H new ATOM 0 HA THR A 96 -2.209 -8.534 6.672 1.00 0.00 H new ATOM 0 HB THR A 96 -3.608 -6.376 8.346 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.193 -5.350 7.016 1.00 0.00 H new ATOM 0 HG21 THR A 96 -1.900 -6.904 10.056 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.916 -8.324 9.708 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.274 -8.215 9.029 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.323 -8.634 7.679 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.341 -9.585 8.200 1.00 0.00 C ATOM 1522 C ARG A 97 -6.585 -10.685 7.166 1.00 0.00 C ATOM 1523 O ARG A 97 -6.736 -11.843 7.499 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.605 -8.750 8.406 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.534 -8.047 9.763 1.00 0.00 C ATOM 1526 CD ARG A 97 -8.229 -6.687 9.669 1.00 0.00 C ATOM 1527 NE ARG A 97 -9.163 -6.654 10.827 1.00 0.00 N ATOM 1528 CZ ARG A 97 -9.142 -5.644 11.654 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -8.876 -4.445 11.212 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -9.382 -5.834 12.922 1.00 0.00 N ATOM 0 H ARG A 97 -5.678 -7.711 7.429 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.028 -10.069 9.125 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.702 -8.014 7.608 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.487 -9.388 8.360 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.012 -8.660 10.528 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.494 -7.916 10.063 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -7.508 -5.871 9.719 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -8.765 -6.582 8.726 1.00 0.00 H new ATOM 0 HE ARG A 97 -9.820 -7.420 10.975 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -8.685 -4.298 10.221 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -8.859 -3.655 11.858 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -9.586 -6.772 13.267 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -9.366 -5.045 13.568 1.00 0.00 H new ATOM 1544 N MET A 98 -6.601 -10.331 5.910 1.00 0.00 N ATOM 1545 CA MET A 98 -6.808 -11.357 4.856 1.00 0.00 C ATOM 1546 C MET A 98 -5.545 -12.201 4.757 1.00 0.00 C ATOM 1547 O MET A 98 -5.564 -13.339 4.329 1.00 0.00 O ATOM 1548 CB MET A 98 -7.037 -10.569 3.564 1.00 0.00 C ATOM 1549 CG MET A 98 -8.248 -9.651 3.735 1.00 0.00 C ATOM 1550 SD MET A 98 -8.016 -8.154 2.742 1.00 0.00 S ATOM 1551 CE MET A 98 -8.992 -8.678 1.312 1.00 0.00 C ATOM 0 H MET A 98 -6.480 -9.377 5.571 1.00 0.00 H new ATOM 0 HA MET A 98 -7.646 -12.023 5.060 1.00 0.00 H new ATOM 0 HB2 MET A 98 -6.152 -9.980 3.323 1.00 0.00 H new ATOM 0 HB3 MET A 98 -7.201 -11.254 2.732 1.00 0.00 H new ATOM 0 HG2 MET A 98 -9.156 -10.168 3.426 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.373 -9.388 4.785 1.00 0.00 H new ATOM 0 HE1 MET A 98 -9.533 -7.822 0.907 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.329 -9.083 0.547 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.703 -9.445 1.618 1.00 0.00 H new ATOM 1561 N VAL A 99 -4.443 -11.648 5.172 1.00 0.00 N ATOM 1562 CA VAL A 99 -3.173 -12.403 5.129 1.00 0.00 C ATOM 1563 C VAL A 99 -3.071 -13.280 6.378 1.00 0.00 C ATOM 1564 O VAL A 99 -2.613 -14.403 6.322 1.00 0.00 O ATOM 1565 CB VAL A 99 -2.077 -11.337 5.110 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.755 -11.948 5.583 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.910 -10.809 3.683 1.00 0.00 C ATOM 0 H VAL A 99 -4.371 -10.700 5.541 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.094 -13.062 4.264 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.355 -10.519 5.775 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.024 -11.186 5.568 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.872 -12.328 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.474 -12.766 4.920 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.129 -10.049 3.665 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.632 -11.630 3.022 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.850 -10.372 3.344 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.522 -12.787 7.503 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.473 -13.620 8.733 1.00 0.00 C ATOM 1579 C ASP A 100 -4.353 -14.836 8.495 1.00 0.00 C ATOM 1580 O ASP A 100 -4.047 -15.939 8.903 1.00 0.00 O ATOM 1581 CB ASP A 100 -4.041 -12.743 9.850 1.00 0.00 C ATOM 1582 CG ASP A 100 -2.896 -12.050 10.589 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -1.882 -11.790 9.961 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -3.052 -11.788 11.771 1.00 0.00 O ATOM 0 H ASP A 100 -3.917 -11.854 7.619 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.470 -13.960 8.992 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.721 -12.000 9.433 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.621 -13.351 10.545 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.430 -14.636 7.792 1.00 0.00 N ATOM 1590 CA LYS A 101 -6.326 -15.767 7.468 1.00 0.00 C ATOM 1591 C LYS A 101 -5.669 -16.593 6.359 1.00 0.00 C ATOM 1592 O LYS A 101 -5.987 -17.742 6.150 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.636 -15.110 7.005 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.692 -15.075 5.479 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.186 -16.421 4.971 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.645 -16.300 4.523 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.448 -16.696 5.714 1.00 0.00 N ATOM 0 H LYS A 101 -5.726 -13.731 7.428 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.515 -16.442 8.302 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.489 -15.665 7.396 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.705 -14.098 7.403 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -8.357 -14.279 5.145 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -6.705 -14.858 5.071 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -7.567 -16.756 4.139 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -8.098 -17.172 5.756 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.879 -15.282 4.210 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.852 -16.950 3.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.455 -16.737 5.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.138 -17.631 6.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.313 -15.997 6.472 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.735 -16.005 5.662 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.024 -16.745 4.586 1.00 0.00 C ATOM 1613 C ILE A 102 -3.050 -17.702 5.260 1.00 0.00 C ATOM 1614 O ILE A 102 -3.063 -18.895 5.030 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.313 -15.650 3.783 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.004 -15.487 2.433 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -1.838 -15.985 3.551 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -3.862 -14.041 1.962 1.00 0.00 C ATOM 0 H ILE A 102 -4.434 -15.039 5.794 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.661 -17.340 3.931 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.366 -14.725 4.357 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -3.562 -16.164 1.702 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.058 -15.752 2.517 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.369 -15.185 2.978 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.333 -16.088 4.511 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -1.760 -16.921 2.998 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.355 -13.922 0.997 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.324 -13.374 2.690 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -2.805 -13.793 1.862 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.237 -17.179 6.131 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.294 -18.046 6.872 1.00 0.00 C ATOM 1632 C VAL A 103 -2.121 -19.048 7.671 1.00 0.00 C ATOM 1633 O VAL A 103 -1.674 -20.126 8.009 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.542 -17.094 7.799 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.223 -17.898 8.851 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.442 -16.258 6.979 1.00 0.00 C ATOM 0 H VAL A 103 -2.187 -16.186 6.360 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.603 -18.602 6.238 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.254 -16.435 8.297 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.759 -17.216 9.511 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.479 -18.493 9.436 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.935 -18.559 8.357 1.00 0.00 H new ATOM 0 HG21 VAL A 103 0.980 -15.578 7.639 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.153 -16.917 6.481 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.104 -15.682 6.232 1.00 0.00 H new ATOM 1646 N SER A 104 -3.344 -18.685 7.962 1.00 0.00 N ATOM 1647 CA SER A 104 -4.242 -19.591 8.726 1.00 0.00 C ATOM 1648 C SER A 104 -4.970 -20.535 7.777 1.00 0.00 C ATOM 1649 O SER A 104 -4.890 -21.742 7.887 1.00 0.00 O ATOM 1650 CB SER A 104 -5.238 -18.663 9.419 1.00 0.00 C ATOM 1651 OG SER A 104 -5.816 -19.338 10.529 1.00 0.00 O ATOM 0 H SER A 104 -3.759 -17.791 7.699 1.00 0.00 H new ATOM 0 HA SER A 104 -3.695 -20.212 9.436 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.735 -17.755 9.752 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.016 -18.358 8.719 1.00 0.00 H new ATOM 0 HG SER A 104 -6.454 -18.744 10.977 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.683 -19.980 6.855 1.00 0.00 N ATOM 1658 CA GLU A 105 -6.444 -20.813 5.877 1.00 0.00 C ATOM 1659 C GLU A 105 -5.765 -20.776 4.504 1.00 0.00 C ATOM 1660 O GLU A 105 -5.673 -21.773 3.817 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.834 -20.173 5.790 1.00 0.00 C ATOM 1662 CG GLU A 105 -8.272 -19.674 7.169 1.00 0.00 C ATOM 1663 CD GLU A 105 -9.778 -19.882 7.333 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -10.491 -19.695 6.361 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -10.192 -20.226 8.427 1.00 0.00 O ATOM 0 H GLU A 105 -5.779 -18.973 6.727 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.492 -21.857 6.188 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.817 -19.343 5.083 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.554 -20.899 5.412 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.733 -20.211 7.950 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.026 -18.618 7.280 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.298 -19.627 4.101 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.631 -19.514 2.771 1.00 0.00 C ATOM 1674 C GLY A 106 -5.536 -18.742 1.806 1.00 0.00 C ATOM 1675 O GLY A 106 -5.489 -18.933 0.607 1.00 0.00 O ATOM 0 H GLY A 106 -5.349 -18.760 4.635 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.674 -19.003 2.875 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.421 -20.507 2.373 1.00 0.00 H new ATOM 1679 N SER A 107 -6.362 -17.871 2.320 1.00 0.00 N ATOM 1680 CA SER A 107 -7.273 -17.085 1.429 1.00 0.00 C ATOM 1681 C SER A 107 -7.218 -15.594 1.754 1.00 0.00 C ATOM 1682 O SER A 107 -7.506 -15.164 2.850 1.00 0.00 O ATOM 1683 CB SER A 107 -8.674 -17.622 1.694 1.00 0.00 C ATOM 1684 OG SER A 107 -8.650 -18.480 2.828 1.00 0.00 O ATOM 0 H SER A 107 -6.448 -17.668 3.316 1.00 0.00 H new ATOM 0 HA SER A 107 -6.980 -17.190 0.384 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.365 -16.796 1.865 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.037 -18.166 0.822 1.00 0.00 H new ATOM 0 HG SER A 107 -9.509 -18.946 2.904 1.00 0.00 H new ATOM 1690 N ASP A 108 -6.871 -14.802 0.792 1.00 0.00 N ATOM 1691 CA ASP A 108 -6.818 -13.333 1.028 1.00 0.00 C ATOM 1692 C ASP A 108 -8.224 -12.752 0.903 1.00 0.00 C ATOM 1693 O ASP A 108 -8.423 -11.554 0.962 1.00 0.00 O ATOM 1694 CB ASP A 108 -5.912 -12.783 -0.073 1.00 0.00 C ATOM 1695 CG ASP A 108 -4.866 -11.851 0.540 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -5.208 -11.135 1.466 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -3.740 -11.874 0.074 1.00 0.00 O ATOM 0 H ASP A 108 -6.620 -15.102 -0.150 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.443 -13.079 2.019 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.421 -13.603 -0.597 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.506 -12.244 -0.811 1.00 0.00 H new ATOM 1702 N ASP A 109 -9.206 -13.596 0.726 1.00 0.00 N ATOM 1703 CA ASP A 109 -10.603 -13.087 0.594 1.00 0.00 C ATOM 1704 C ASP A 109 -11.364 -13.277 1.908 1.00 0.00 C ATOM 1705 O ASP A 109 -11.791 -14.365 2.236 1.00 0.00 O ATOM 1706 CB ASP A 109 -11.232 -13.928 -0.517 1.00 0.00 C ATOM 1707 CG ASP A 109 -12.600 -13.349 -0.881 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -13.003 -12.388 -0.244 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -13.222 -13.874 -1.789 1.00 0.00 O ATOM 0 H ASP A 109 -9.103 -14.609 0.667 1.00 0.00 H new ATOM 0 HA ASP A 109 -10.632 -12.022 0.363 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -10.584 -13.936 -1.393 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -11.338 -14.962 -0.189 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.538 -12.225 2.663 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.273 -12.353 3.954 1.00 0.00 C ATOM 1716 C ILE A 110 -13.692 -11.794 3.812 1.00 0.00 C ATOM 1717 O ILE A 110 -14.308 -11.385 4.776 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.467 -11.530 4.960 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -11.536 -10.050 4.581 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -10.010 -11.995 4.948 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -10.956 -9.202 5.715 1.00 0.00 C ATOM 0 H ILE A 110 -11.204 -11.287 2.443 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.371 -13.392 4.270 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.883 -11.667 5.958 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.980 -9.874 3.660 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -12.569 -9.761 4.389 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.435 -11.409 5.665 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.962 -13.049 5.220 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.593 -11.859 3.950 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -11.006 -8.148 5.443 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -11.531 -9.370 6.626 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.917 -9.484 5.885 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.215 -11.780 2.615 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.595 -11.254 2.411 1.00 0.00 C ATOM 1735 C GLY A 111 -15.562 -9.726 2.338 1.00 0.00 C ATOM 1736 O GLY A 111 -16.568 -9.087 2.103 1.00 0.00 O ATOM 0 H GLY A 111 -13.747 -12.110 1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.017 -11.662 1.493 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.241 -11.574 3.229 1.00 0.00 H new ATOM 1740 N GLU A 112 -14.416 -9.135 2.537 1.00 0.00 N ATOM 1741 CA GLU A 112 -14.329 -7.646 2.479 1.00 0.00 C ATOM 1742 C GLU A 112 -14.710 -7.147 1.083 1.00 0.00 C ATOM 1743 O GLU A 112 -15.344 -7.845 0.316 1.00 0.00 O ATOM 1744 CB GLU A 112 -12.868 -7.319 2.791 1.00 0.00 C ATOM 1745 CG GLU A 112 -12.709 -7.084 4.294 1.00 0.00 C ATOM 1746 CD GLU A 112 -13.687 -5.999 4.750 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -13.882 -5.053 4.004 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -14.225 -6.134 5.838 1.00 0.00 O ATOM 0 H GLU A 112 -13.539 -9.615 2.737 1.00 0.00 H new ATOM 0 HA GLU A 112 -15.010 -7.165 3.182 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.224 -8.138 2.470 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -12.556 -6.433 2.238 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.897 -8.009 4.839 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.686 -6.783 4.519 1.00 0.00 H new ATOM 1755 N ASN A 113 -14.336 -5.941 0.745 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.690 -5.404 -0.599 1.00 0.00 C ATOM 1757 C ASN A 113 -13.464 -4.800 -1.283 1.00 0.00 C ATOM 1758 O ASN A 113 -12.650 -4.146 -0.663 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.736 -4.324 -0.328 1.00 0.00 C ATOM 1760 CG ASN A 113 -17.128 -4.873 -0.646 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -17.267 -5.805 -1.413 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -18.172 -4.331 -0.083 1.00 0.00 N ATOM 0 H ASN A 113 -13.802 -5.307 1.340 1.00 0.00 H new ATOM 0 HA ASN A 113 -15.063 -6.184 -1.263 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.687 -4.008 0.714 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.532 -3.444 -0.938 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -19.105 -4.690 -0.287 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -18.056 -3.549 0.561 1.00 0.00 H new ATOM 1769 N ILE A 114 -13.337 -5.005 -2.565 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.178 -4.433 -3.304 1.00 0.00 C ATOM 1771 C ILE A 114 -12.687 -3.374 -4.284 1.00 0.00 C ATOM 1772 O ILE A 114 -12.583 -2.189 -4.040 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.546 -5.622 -4.044 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.461 -6.255 -3.171 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -10.913 -5.149 -5.356 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.992 -6.460 -1.753 1.00 0.00 C ATOM 0 H ILE A 114 -13.988 -5.546 -3.134 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.450 -3.948 -2.653 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.325 -6.354 -4.258 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -10.152 -7.210 -3.595 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -9.579 -5.615 -3.150 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.468 -5.999 -5.873 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -11.679 -4.700 -5.989 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.141 -4.410 -5.142 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.215 -6.911 -1.135 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -11.279 -5.498 -1.329 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.861 -7.118 -1.781 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.250 -3.791 -5.385 1.00 0.00 N ATOM 1789 CA ASP A 115 -13.775 -2.799 -6.360 1.00 0.00 C ATOM 1790 C ASP A 115 -14.668 -1.808 -5.627 1.00 0.00 C ATOM 1791 O ASP A 115 -14.879 -0.692 -6.056 1.00 0.00 O ATOM 1792 CB ASP A 115 -14.581 -3.612 -7.374 1.00 0.00 C ATOM 1793 CG ASP A 115 -14.614 -2.872 -8.712 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -13.668 -2.158 -8.995 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -15.587 -3.033 -9.432 1.00 0.00 O ATOM 0 H ASP A 115 -13.368 -4.769 -5.649 1.00 0.00 H new ATOM 0 HA ASP A 115 -12.986 -2.231 -6.852 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -14.134 -4.598 -7.503 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -15.596 -3.767 -7.007 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.181 -2.222 -4.510 1.00 0.00 N ATOM 1801 CA VAL A 116 -16.057 -1.330 -3.705 1.00 0.00 C ATOM 1802 C VAL A 116 -15.219 -0.546 -2.708 1.00 0.00 C ATOM 1803 O VAL A 116 -15.406 0.637 -2.508 1.00 0.00 O ATOM 1804 CB VAL A 116 -17.028 -2.268 -2.986 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.695 -1.530 -1.822 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -18.102 -2.738 -3.970 1.00 0.00 C ATOM 0 H VAL A 116 -15.031 -3.150 -4.114 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.586 -0.600 -4.317 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.480 -3.128 -2.601 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.386 -2.202 -1.313 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -16.932 -1.193 -1.120 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.242 -0.668 -2.204 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.795 -3.407 -3.460 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.646 -1.875 -4.354 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.630 -3.267 -4.798 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.285 -1.198 -2.100 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.406 -0.497 -1.124 1.00 0.00 C ATOM 1818 C PHE A 117 -12.384 0.335 -1.894 1.00 0.00 C ATOM 1819 O PHE A 117 -11.793 1.263 -1.376 1.00 0.00 O ATOM 1820 CB PHE A 117 -12.722 -1.607 -0.329 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.015 -1.013 0.866 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -12.756 -0.566 1.966 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -10.619 -0.911 0.873 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -12.100 -0.018 3.074 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -9.964 -0.363 1.981 1.00 0.00 C ATOM 1826 CZ PHE A 117 -10.703 0.084 3.081 1.00 0.00 C ATOM 0 H PHE A 117 -14.085 -2.190 -2.232 1.00 0.00 H new ATOM 0 HA PHE A 117 -13.951 0.177 -0.463 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.459 -2.340 -0.001 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -12.008 -2.134 -0.962 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -13.833 -0.644 1.960 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.048 -1.255 0.023 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.671 0.326 3.924 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -8.887 -0.285 1.987 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.197 0.508 3.936 1.00 0.00 H new ATOM 1836 N SER A 118 -12.201 0.022 -3.147 1.00 0.00 N ATOM 1837 CA SER A 118 -11.259 0.782 -3.984 1.00 0.00 C ATOM 1838 C SER A 118 -12.031 1.896 -4.651 1.00 0.00 C ATOM 1839 O SER A 118 -11.541 2.986 -4.837 1.00 0.00 O ATOM 1840 CB SER A 118 -10.742 -0.221 -5.011 1.00 0.00 C ATOM 1841 OG SER A 118 -9.956 -1.204 -4.351 1.00 0.00 O ATOM 0 H SER A 118 -12.677 -0.743 -3.625 1.00 0.00 H new ATOM 0 HA SER A 118 -10.433 1.226 -3.429 1.00 0.00 H new ATOM 0 HB2 SER A 118 -11.577 -0.693 -5.528 1.00 0.00 H new ATOM 0 HB3 SER A 118 -10.147 0.290 -5.768 1.00 0.00 H new ATOM 0 HG SER A 118 -10.543 -1.889 -3.968 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.258 1.615 -4.977 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.127 2.639 -5.615 1.00 0.00 C ATOM 1849 C ASP A 119 -14.564 3.624 -4.550 1.00 0.00 C ATOM 1850 O ASP A 119 -14.749 4.798 -4.796 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.324 1.869 -6.177 1.00 0.00 C ATOM 1852 CG ASP A 119 -16.402 2.856 -6.632 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -16.274 3.378 -7.727 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.337 3.070 -5.879 1.00 0.00 O ATOM 0 H ASP A 119 -13.702 0.709 -4.827 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.625 3.198 -6.405 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.008 1.248 -7.015 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.727 1.199 -5.418 1.00 0.00 H new ATOM 1859 N THR A 120 -14.686 3.142 -3.357 1.00 0.00 N ATOM 1860 CA THR A 120 -15.064 4.023 -2.227 1.00 0.00 C ATOM 1861 C THR A 120 -13.934 5.018 -2.033 1.00 0.00 C ATOM 1862 O THR A 120 -14.126 6.211 -1.918 1.00 0.00 O ATOM 1863 CB THR A 120 -15.208 3.076 -1.028 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.551 2.623 -0.943 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.831 3.797 0.265 1.00 0.00 C ATOM 0 H THR A 120 -14.539 2.163 -3.110 1.00 0.00 H new ATOM 0 HA THR A 120 -15.984 4.588 -2.376 1.00 0.00 H new ATOM 0 HB THR A 120 -14.540 2.226 -1.166 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.650 1.795 -1.458 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.938 3.113 1.107 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.798 4.138 0.203 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.488 4.655 0.408 1.00 0.00 H new ATOM 1873 N ILE A 121 -12.750 4.505 -2.035 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.549 5.360 -1.894 1.00 0.00 C ATOM 1875 C ILE A 121 -11.389 6.190 -3.174 1.00 0.00 C ATOM 1876 O ILE A 121 -11.094 7.369 -3.133 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.406 4.349 -1.695 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -9.830 4.518 -0.290 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.293 4.546 -2.731 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -8.673 3.538 -0.089 1.00 0.00 C ATOM 0 H ILE A 121 -12.556 3.508 -2.130 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.586 6.073 -1.071 1.00 0.00 H new ATOM 0 HB ILE A 121 -10.810 3.345 -1.823 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -9.482 5.541 -0.149 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -10.605 4.340 0.456 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.503 3.815 -2.560 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.701 4.412 -3.733 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.883 5.552 -2.638 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.263 3.660 0.914 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.035 2.517 -0.211 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -7.895 3.738 -0.826 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.605 5.577 -4.307 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.497 6.309 -5.588 1.00 0.00 C ATOM 1894 C LYS A 122 -12.580 7.374 -5.639 1.00 0.00 C ATOM 1895 O LYS A 122 -12.391 8.452 -6.165 1.00 0.00 O ATOM 1896 CB LYS A 122 -11.735 5.243 -6.649 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.423 4.997 -7.383 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.001 3.539 -7.230 1.00 0.00 C ATOM 1899 CE LYS A 122 -8.754 3.470 -6.342 1.00 0.00 C ATOM 1900 NZ LYS A 122 -7.882 2.436 -6.969 1.00 0.00 N ATOM 0 H LYS A 122 -11.853 4.592 -4.394 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.539 6.811 -5.726 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.091 4.321 -6.188 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.506 5.568 -7.348 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.537 5.242 -8.439 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.647 5.652 -6.986 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.810 2.957 -6.788 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -9.792 3.103 -8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.249 4.435 -6.297 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.014 3.198 -5.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.886 2.644 -6.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.130 1.499 -6.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.021 2.443 -8.000 1.00 0.00 H new ATOM 1914 N SER A 123 -13.711 7.078 -5.071 1.00 0.00 N ATOM 1915 CA SER A 123 -14.813 8.070 -5.053 1.00 0.00 C ATOM 1916 C SER A 123 -14.581 9.049 -3.914 1.00 0.00 C ATOM 1917 O SER A 123 -15.131 10.132 -3.877 1.00 0.00 O ATOM 1918 CB SER A 123 -16.076 7.259 -4.808 1.00 0.00 C ATOM 1919 OG SER A 123 -16.564 6.759 -6.046 1.00 0.00 O ATOM 0 H SER A 123 -13.920 6.189 -4.617 1.00 0.00 H new ATOM 0 HA SER A 123 -14.880 8.644 -5.977 1.00 0.00 H new ATOM 0 HB2 SER A 123 -15.865 6.434 -4.128 1.00 0.00 H new ATOM 0 HB3 SER A 123 -16.833 7.880 -4.330 1.00 0.00 H new ATOM 0 HG SER A 123 -16.199 5.863 -6.204 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.752 8.670 -2.993 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.448 9.571 -1.847 1.00 0.00 C ATOM 1927 C PHE A 124 -12.439 10.626 -2.290 1.00 0.00 C ATOM 1928 O PHE A 124 -12.032 11.481 -1.527 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.839 8.665 -0.782 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.710 8.679 0.454 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -13.955 9.883 1.125 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -14.271 7.487 0.926 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -14.763 9.894 2.269 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -15.079 7.499 2.069 1.00 0.00 C ATOM 1935 CZ PHE A 124 -15.324 8.701 2.741 1.00 0.00 C ATOM 0 H PHE A 124 -13.267 7.773 -2.980 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.329 10.093 -1.475 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -12.748 7.648 -1.164 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.833 9.003 -0.534 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -13.521 10.803 0.761 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -14.081 6.558 0.409 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -14.953 10.822 2.787 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.514 6.579 2.432 1.00 0.00 H new ATOM 0 HZ PHE A 124 -15.946 8.709 3.624 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.037 10.563 -3.524 1.00 0.00 N ATOM 1946 CA ALA A 125 -11.049 11.550 -4.048 1.00 0.00 C ATOM 1947 C ALA A 125 -11.732 12.516 -5.020 1.00 0.00 C ATOM 1948 O ALA A 125 -12.606 12.138 -5.774 1.00 0.00 O ATOM 1949 CB ALA A 125 -9.998 10.709 -4.773 1.00 0.00 C ATOM 0 H ALA A 125 -12.350 9.867 -4.200 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.609 12.157 -3.256 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.232 11.363 -5.189 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -9.539 10.015 -4.069 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.473 10.148 -5.578 1.00 0.00 H new ATOM 1955 N SER A 126 -11.338 13.760 -5.007 1.00 0.00 N ATOM 1956 CA SER A 126 -11.963 14.752 -5.928 1.00 0.00 C ATOM 1957 C SER A 126 -10.880 15.597 -6.604 1.00 0.00 C ATOM 1958 O SER A 126 -9.819 15.111 -6.938 1.00 0.00 O ATOM 1959 CB SER A 126 -12.842 15.624 -5.032 1.00 0.00 C ATOM 1960 OG SER A 126 -13.849 16.244 -5.821 1.00 0.00 O ATOM 0 H SER A 126 -10.610 14.133 -4.398 1.00 0.00 H new ATOM 0 HA SER A 126 -12.538 14.276 -6.722 1.00 0.00 H new ATOM 0 HB2 SER A 126 -13.299 15.017 -4.250 1.00 0.00 H new ATOM 0 HB3 SER A 126 -12.236 16.381 -4.535 1.00 0.00 H new ATOM 0 HG SER A 126 -14.415 16.803 -5.249 1.00 0.00 H new ATOM 1966 N SER A 127 -11.141 16.860 -6.808 1.00 0.00 N ATOM 1967 CA SER A 127 -10.125 17.734 -7.462 1.00 0.00 C ATOM 1968 C SER A 127 -10.033 19.078 -6.734 1.00 0.00 C ATOM 1969 O SER A 127 -8.961 19.612 -6.532 1.00 0.00 O ATOM 1970 CB SER A 127 -10.631 17.930 -8.889 1.00 0.00 C ATOM 1971 OG SER A 127 -11.278 19.193 -8.988 1.00 0.00 O ATOM 0 H SER A 127 -12.012 17.324 -6.551 1.00 0.00 H new ATOM 0 HA SER A 127 -9.128 17.294 -7.440 1.00 0.00 H new ATOM 0 HB2 SER A 127 -9.800 17.878 -9.592 1.00 0.00 H new ATOM 0 HB3 SER A 127 -11.324 17.132 -9.155 1.00 0.00 H new ATOM 0 HG SER A 127 -11.603 19.323 -9.903 1.00 0.00 H new ATOM 1977 N GLY A 128 -11.148 19.629 -6.340 1.00 0.00 N ATOM 1978 CA GLY A 128 -11.120 20.939 -5.627 1.00 0.00 C ATOM 1979 C GLY A 128 -11.765 20.787 -4.247 1.00 0.00 C ATOM 1980 O GLY A 128 -12.414 19.800 -3.959 1.00 0.00 O ATOM 0 H GLY A 128 -12.076 19.230 -6.480 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.092 21.286 -5.523 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.653 21.692 -6.208 1.00 0.00 H new ATOM 1984 N LYS A 129 -11.594 21.758 -3.391 1.00 0.00 N ATOM 1985 CA LYS A 129 -12.198 21.671 -2.029 1.00 0.00 C ATOM 1986 C LYS A 129 -13.516 22.450 -1.986 1.00 0.00 C ATOM 1987 O LYS A 129 -13.622 23.541 -2.512 1.00 0.00 O ATOM 1988 CB LYS A 129 -11.168 22.309 -1.096 1.00 0.00 C ATOM 1989 CG LYS A 129 -11.094 21.512 0.207 1.00 0.00 C ATOM 1990 CD LYS A 129 -10.989 22.473 1.394 1.00 0.00 C ATOM 1991 CE LYS A 129 -10.032 21.894 2.439 1.00 0.00 C ATOM 1992 NZ LYS A 129 -10.341 22.630 3.697 1.00 0.00 N ATOM 0 H LYS A 129 -11.062 22.608 -3.576 1.00 0.00 H new ATOM 0 HA LYS A 129 -12.425 20.644 -1.743 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -10.190 22.330 -1.577 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -11.443 23.343 -0.887 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -11.979 20.885 0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -10.232 20.846 0.189 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -10.631 23.446 1.057 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -11.973 22.631 1.835 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -10.184 20.822 2.562 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -8.992 22.037 2.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -9.724 22.287 4.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -10.180 23.647 3.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -11.335 22.470 3.958 1.00 0.00 H new ATOM 2006 N GLU A 130 -14.522 21.900 -1.364 1.00 0.00 N ATOM 2007 CA GLU A 130 -15.833 22.608 -1.287 1.00 0.00 C ATOM 2008 C GLU A 130 -16.374 22.874 -2.696 1.00 0.00 C ATOM 2009 O GLU A 130 -15.628 22.979 -3.648 1.00 0.00 O ATOM 2010 CB GLU A 130 -15.531 23.925 -0.570 1.00 0.00 C ATOM 2011 CG GLU A 130 -16.723 24.314 0.306 1.00 0.00 C ATOM 2012 CD GLU A 130 -17.263 25.674 -0.143 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -16.458 26.549 -0.419 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -18.474 25.818 -0.202 1.00 0.00 O ATOM 0 H GLU A 130 -14.494 20.990 -0.905 1.00 0.00 H new ATOM 0 HA GLU A 130 -16.588 22.023 -0.762 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -14.635 23.821 0.042 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -15.330 24.710 -1.299 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -17.505 23.558 0.232 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -16.420 24.358 1.352 1.00 0.00 H new ATOM 2021 N LYS A 131 -17.668 22.980 -2.834 1.00 0.00 N ATOM 2022 CA LYS A 131 -18.257 23.238 -4.180 1.00 0.00 C ATOM 2023 C LYS A 131 -17.628 22.306 -5.221 1.00 0.00 C ATOM 2024 O LYS A 131 -16.576 22.583 -5.762 1.00 0.00 O ATOM 2025 CB LYS A 131 -17.917 24.696 -4.491 1.00 0.00 C ATOM 2026 CG LYS A 131 -19.209 25.506 -4.602 1.00 0.00 C ATOM 2027 CD LYS A 131 -19.303 26.479 -3.426 1.00 0.00 C ATOM 2028 CE LYS A 131 -19.277 27.917 -3.951 1.00 0.00 C ATOM 2029 NZ LYS A 131 -20.551 28.522 -3.473 1.00 0.00 N ATOM 0 H LYS A 131 -18.343 22.899 -2.073 1.00 0.00 H new ATOM 0 HA LYS A 131 -19.332 23.058 -4.200 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -17.283 25.108 -3.706 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -17.354 24.759 -5.422 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -19.227 26.054 -5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -20.070 24.838 -4.605 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -20.221 26.302 -2.866 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -18.473 26.316 -2.738 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -18.413 28.461 -3.569 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -19.213 27.939 -5.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -20.608 29.510 -3.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -21.355 27.987 -3.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -20.581 28.493 -2.434 1.00 0.00 H new ATOM 2043 N LEU A 132 -18.266 21.203 -5.506 1.00 0.00 N ATOM 2044 CA LEU A 132 -17.708 20.253 -6.511 1.00 0.00 C ATOM 2045 C LEU A 132 -18.841 19.469 -7.179 1.00 0.00 C ATOM 2046 O LEU A 132 -19.963 19.466 -6.713 1.00 0.00 O ATOM 2047 CB LEU A 132 -16.805 19.314 -5.710 1.00 0.00 C ATOM 2048 CG LEU A 132 -17.527 18.872 -4.435 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -17.373 17.361 -4.257 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -16.917 19.592 -3.230 1.00 0.00 C ATOM 0 H LEU A 132 -19.151 20.918 -5.086 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.162 20.763 -7.305 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -16.543 18.444 -6.312 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -15.873 19.818 -5.456 1.00 0.00 H new ATOM 0 HG LEU A 132 -18.585 19.121 -4.512 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -17.888 17.047 -3.349 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -17.806 16.847 -5.115 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -16.315 17.110 -4.180 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -17.430 19.278 -2.321 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -15.859 19.342 -3.154 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -17.027 20.669 -3.356 1.00 0.00 H new ATOM 2062 N GLU A 133 -18.559 18.806 -8.267 1.00 0.00 N ATOM 2063 CA GLU A 133 -19.624 18.025 -8.962 1.00 0.00 C ATOM 2064 C GLU A 133 -19.110 16.627 -9.317 1.00 0.00 C ATOM 2065 O GLU A 133 -18.423 16.507 -10.317 1.00 0.00 O ATOM 2066 CB GLU A 133 -19.938 18.818 -10.232 1.00 0.00 C ATOM 2067 CG GLU A 133 -21.161 19.707 -9.994 1.00 0.00 C ATOM 2068 CD GLU A 133 -22.249 19.369 -11.016 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -23.045 18.488 -10.735 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -22.268 19.996 -12.061 1.00 0.00 O ATOM 0 H GLU A 133 -17.639 18.771 -8.705 1.00 0.00 H new ATOM 0 HA GLU A 133 -20.507 17.890 -8.338 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -19.080 19.430 -10.512 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -20.127 18.136 -11.061 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -21.539 19.559 -8.983 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -20.882 20.757 -10.079 1.00 0.00 H new TER 2077 GLU A 133